A0A077Z0N4_TRITR Loading...

Vacuolar protein sorting-associated protein 52 homolog

AlphaFold DB , UniProt , Accession A0A077Z0N4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 537 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
1M73.4Confident82.5Confident29 Ų2957.1 Ų57.114%0.14333%0.334CS..  0-11.60-58.5-46-97.900114.6F10 L14 L17 L45 K48 A49 K52M1-F10 HydrophobicContact CE-CE2 3.86Å; M1-F10 HydrophobicContact CE-CZ 4.09Å; M1-F10 HydrophobicContact SD-CD2 4.36Å; M1-F10 HydrophobicContact SD-CE2 3.73Å; M1-F10 HydrophobicContact SD-CZ 4.49Å; M1-L14 HydrophobicContact CE-CD1 4.44Å; M1-L17 HydrophobicContact CE-CD2 3.98Å; M1-L45 HydrophobicContact CG-CD2 4.02Å; M1-K48 HydrophobicContact CB-CD 4.43Å; M1-A49 HydrophobicContact CE-CB 3.13Å; M1-K52 PolarHBondContact O-NZ 3.49Å
2D76.2Confident83.4Confident135 Ų13563.3 Ų63.372%0.72236%0.357SS*.  trans-84.1-27.5179.7-59-37.8000112.6K48 K52D2-K48 IonicContact OD1-NZ 2.76Å; D2-K48 PolarHBondContact OD1-NZ 3.49Å; D2-K52 PolarHBondContact O-NZ 2.95Å
3E78.3Confident84.2Confident63 Ų6362.7 Ų62.729%0.29435%0.35SS..SBendtrans-50.1146.5170.7-73.8170.3-153.100114.7E7 S9 F10 Q13 K52E3-E7 VanDerWaalsContact CB-OE2 3.28Å; E3-E7 WeakPolarHBondContact CB-OE2 3.28Å; E3-S9 VanDerWaalsContact CD-OG 3.27Å; E3-S9 VanDerWaalsContact OE2-C 3.27Å; E3-S9 WeakPolarHBondContact OE2-CB 3.5Å; E3-S9 PolarHBondContact OE2-OG 3.38Å; E3-F10 HydrophobicContact CB-CB 4.39Å; E3-F10 PolarHBondContact OE2-N 3.36Å; E3-Q13 VanDerWaalsContact CD-NE2 3.31Å; E3-Q13 PolarHBondContact OE1-NE2 3.4Å; E3-Q13 PolarHBondContact OE2-NE2 2.76Å; E3-K52 WeakPolarHBondContact O-CE 3.47Å; E3-K52 PolarHBondContact O-NZ 3.31Å
4A80.5Confident84.9Confident42 Ų4258.2 Ų58.235%0.34733%0.325SS..  trans-63.2143.1-177.800000111.5T6 E7A4-T6 PolarHBondContact O-N 3.32Å; A4-E7 HydrophobicContact CB-CG 4.19Å; A4-E7 PolarHBondContact N-OE2 2.8Å; A4-E7 WeakPolarHBondContact O-CB 3.25Å; A4-E7 PolarHBondContact O-N 2.58Å
5A77.1Confident85.6Confident12 Ų1260.2 Ų60.210%0.09933%0.33CS..THydrogen-bonded Turntrans-64.3-3.5178.300000113.9F10 K52 F56 Y84A5-F10 HydrophobicContact CB-CD1 4.38Å; A5-F10 HydrophobicContact CB-CE1 4.37Å; A5-K52 HydrophobicContact CB-CG 4.35Å; A5-F56 HydrophobicContact CB-CB 4.11Å; A5-F56 HydrophobicContact CB-CD2 3.87Å; A5-F56 HydrophobicContact CB-CG 4.09Å; A5-Y84 PolarHBondContact O-OH 3.21Å
6T82.3Confident86.2Confident89 Ų8962.9 Ų62.955%0.54634%0.34SS..THydrogen-bonded Turntrans-91.8-14.3174.746.60000113.5A4 F56A4-T6 PolarHBondContact O-N 3.32Å; T6-F56 HydrophobicContact CG2-CE2 3.75Å
7E83.3Confident86.7Confident88 Ų8859.9 Ų59.941%0.41132%0.324SS..SBendtrans-82.6143.3-175.3-67.9170.6179.800111.2E3 A4 S9 F10E3-E7 VanDerWaalsContact CB-OE2 3.28Å; E3-E7 WeakPolarHBondContact CB-OE2 3.28Å; A4-E7 HydrophobicContact CB-CG 4.19Å; A4-E7 PolarHBondContact N-OE2 2.8Å; A4-E7 WeakPolarHBondContact O-CB 3.25Å; A4-E7 PolarHBondContact O-N 2.58Å; E7-S9 VanDerWaalsContact C-N 3.27Å; E7-S9 PolarHBondContact O-N 2.95Å; E7-F10 PolarHBondContact O-N 3.04Å
8S84.5Confident87.2Confident89 Ų8958.1 Ų58.162%0.62231%0.312SS*.Hα-helixtrans-64-34.3178.953.70000112.3F10 L11 E12S8-F10 VanDerWaalsContact C-N 3.29Å; S8-F10 PolarHBondContact O-N 3.35Å; S8-L11 WeakPolarHBondContact O-CB 3.26Å; S8-L11 PolarHBondContact O-N 3.46Å; S8-L11 VanDerWaalsContact O-N 3.12Å; S8-E12 PolarHBondContact O-N 3.48Å; S8-E12 VanDerWaalsContact O-N 3.1Å
9S88.7Confident87.6Confident35 Ų3561.9 Ų61.925%0.24533%0.328CS..Hα-helixtrans-61.9-34176.552.10000112.6E3 E7 L11 E12 Q13E3-S9 VanDerWaalsContact CD-OG 3.27Å; E3-S9 VanDerWaalsContact OE2-C 3.27Å; E3-S9 WeakPolarHBondContact OE2-CB 3.5Å; E3-S9 PolarHBondContact OE2-OG 3.38Å; E7-S9 VanDerWaalsContact C-N 3.27Å; E7-S9 PolarHBondContact O-N 2.95Å; S9-L11 PolarHBondContact O-N 3.32Å; S9-E12 PolarHBondContact O-N 3.28Å; S9-Q13 VanDerWaalsContact O-CG 3.32Å; S9-Q13 WeakPolarHBondContact O-CG 3.4Å; S9-Q13 PolarHBondContact O-N 3.14Å
10F92.1Very high87.9Confident0 Ų063.4 Ų63.40%033%0.331CS..Hα-helixtrans-66.3-38.4174.2-179.2-97.7000111.8M1 E3 A5 E7 S8 Q13 L14 K52 T53 Y84M1-F10 HydrophobicContact CE-CE2 3.86Å; M1-F10 HydrophobicContact CE-CZ 4.09Å; M1-F10 HydrophobicContact SD-CD2 4.36Å; M1-F10 HydrophobicContact SD-CE2 3.73Å; M1-F10 HydrophobicContact SD-CZ 4.49Å; E3-F10 HydrophobicContact CB-CB 4.39Å; E3-F10 PolarHBondContact OE2-N 3.36Å; A5-F10 HydrophobicContact CB-CD1 4.38Å; A5-F10 HydrophobicContact CB-CE1 4.37Å; E7-F10 PolarHBondContact O-N 3.04Å; S8-F10 VanDerWaalsContact C-N 3.29Å; S8-F10 PolarHBondContact O-N 3.35Å; F10-Q13 PolarHBondContact O-N 3.44Å; F10-L14 WeakPolarHBondContact O-CB 3.35Å; F10-L14 PolarHBondContact O-N 3.17Å; F10-K52 HydrophobicContact CE2-CD 3.78Å; F10-K52 HydrophobicContact CZ-CD 3.9Å; F10-K52 HydrophobicContact CZ-CG 4.31Å; F10-T53 HydrophobicContact CE1-CG2 3.84Å; F10-T53 HydrophobicContact CZ-CG2 4.17Å; F10-Y84 HydrophobicContact CD1-CE1 4.33Å; F10-Y84 AromaticContact CD1-CZ 3.89Å; F10-Y84 WeakPolarHBondContact CD1-OH 3.35Å; F10-Y84 HydrophobicContact CE1-CE1 4.43Å; F10-Y84 HydrophobicContact CE1-CE2 4.5Å
11L91.3Very high88.2Confident46 Ų4660.8 Ų60.824%0.24132%0.318CS..Hα-helixtrans-63.6-42.9174.9174.764.5000111.2S8 S9 L14 H15 F83 Y84S8-L11 WeakPolarHBondContact O-CB 3.26Å; S8-L11 PolarHBondContact O-N 3.46Å; S8-L11 VanDerWaalsContact O-N 3.12Å; S9-L11 PolarHBondContact O-N 3.32Å; L11-L14 WeakPolarHBondContact O-CB 3.35Å; L11-L14 PolarHBondContact O-N 3.44Å; L11-H15 PolarHBondContact O-CD2 2.95Å; L11-H15 VanDerWaalsContact O-CD2 3.27Å; L11-H15 PolarHBondContact O-N 3.29Å; L11-F83 HydrophobicContact CD1-CB 3.91Å; L11-F83 HydrophobicContact CD1-CD1 3.73Å; L11-F83 HydrophobicContact CD1-CG 4.21Å; L11-Y84 HydrophobicContact CB-CE1 4.18Å; L11-Y84 HydrophobicContact CD1-CD1 4.06Å; L11-Y84 HydrophobicContact CD1-CE1 3.6Å; L11-Y84 HydrophobicContact CG-CE1 4.48Å
12E92.7Very high89Confident131 Ų13162 Ų6261%0.61233%0.326SS*.Hα-helixtrans-61.4-46175.2-68.3170.9-169.100111.7S8 S9 L14 H15 E16S8-E12 PolarHBondContact O-N 3.48Å; S8-E12 VanDerWaalsContact O-N 3.1Å; S9-E12 PolarHBondContact O-N 3.28Å; E12-L14 PolarHBondContact O-N 2.97Å; E12-H15 PolarHBondContact O-N 3.41Å; E12-E16 PolarHBondContact O-N 3.26Å
13Q93.5Very high89.7Confident56 Ų5661.8 Ų61.826%0.26232%0.316SS..Hα-helixtrans-59.4-36.2174.5-73.4175.415.400112E3 S9 F10 E16 L17E3-Q13 VanDerWaalsContact CD-NE2 3.31Å; E3-Q13 PolarHBondContact OE1-NE2 3.4Å; E3-Q13 PolarHBondContact OE2-NE2 2.76Å; S9-Q13 VanDerWaalsContact O-CG 3.32Å; S9-Q13 WeakPolarHBondContact O-CG 3.4Å; S9-Q13 PolarHBondContact O-N 3.14Å; F10-Q13 PolarHBondContact O-N 3.44Å; Q13-E16 PolarHBondContact O-N 2.85Å; Q13-L17 VanDerWaalsContact O-CB 3.28Å; Q13-L17 WeakPolarHBondContact O-CB 3.37Å; Q13-L17 PolarHBondContact O-N 2.97Å
14L94.8Very high90.2Very high0 Ų059.9 Ų59.90%031%0.309CS..Hα-helixtrans-69.2-40.8177.8-164.767.6000111.8M1 F10 L11 E12 L17 Q18 A49 T53 F83 Y84 F87M1-L14 HydrophobicContact CE-CD1 4.44Å; F10-L14 WeakPolarHBondContact O-CB 3.35Å; F10-L14 PolarHBondContact O-N 3.17Å; L11-L14 WeakPolarHBondContact O-CB 3.35Å; L11-L14 PolarHBondContact O-N 3.44Å; E12-L14 PolarHBondContact O-N 2.97Å; L14-L17 PolarHBondContact O-N 2.95Å; L14-Q18 WeakPolarHBondContact O-CB 3.37Å; L14-Q18 PolarHBondContact O-N 2.91Å; L14-A49 HydrophobicContact CD1-CB 3.87Å; L14-T53 HydrophobicContact CD1-CG2 4.47Å; L14-T53 HydrophobicContact CD2-CG2 3.88Å; L14-F83 HydrophobicContact CB-CE1 4.22Å; L14-F83 HydrophobicContact CD2-CD1 4.01Å; L14-F83 HydrophobicContact CD2-CE1 4.12Å; L14-F83 HydrophobicContact CG-CD1 4.34Å; L14-F83 HydrophobicContact CG-CE1 3.97Å; L14-Y84 HydrophobicContact CD2-CD1 3.49Å; L14-Y84 VanDerWaalsContact CD2-CD1 3.49Å; L14-Y84 HydrophobicContact CD2-CE1 3.9Å; L14-Y84 HydrophobicContact CD2-CG 4.3Å; L14-F87 HydrophobicContact CD1-CD1 3.72Å; L14-F87 HydrophobicContact CD1-CD2 3.75Å; L14-F87 HydrophobicContact CD1-CE1 3.76Å; L14-F87 HydrophobicContact CD1-CE2 3.78Å; L14-F87 HydrophobicContact CD1-CG 3.72Å; L14-F87 HydrophobicContact CD1-CZ 3.79Å; L14-F87 HydrophobicContact CD2-CB 3.95Å; L14-F87 HydrophobicContact CD2-CD1 4.37Å; L14-F87 HydrophobicContact CD2-CD2 4.5Å; L14-F87 HydrophobicContact CD2-CG 4.01Å; L14-F87 HydrophobicContact CG-CB 4.2Å; L14-F87 HydrophobicContact CG-CD1 4.3Å; L14-F87 HydrophobicContact CG-CD2 3.85Å; L14-F87 HydrophobicContact CG-CE2 4.32Å; L14-F87 HydrophobicContact CG-CG 3.84Å
15H94.9Very high90.5Very high88 Ų8864.1 Ų64.141%0.40732%0.316SS..Hα-helixtrans-61.4-45.9172.9-83.4-72.9000111.4L11 E12 L17 Q18 H19 F83L11-H15 PolarHBondContact O-CD2 2.95Å; L11-H15 VanDerWaalsContact O-CD2 3.27Å; L11-H15 PolarHBondContact O-N 3.29Å; E12-H15 PolarHBondContact O-N 3.41Å; H15-L17 PolarHBondContact O-N 3.17Å; H15-Q18 PolarHBondContact O-N 2.88Å; H15-H19 PolarHBondContact O-N 2.98Å; H15-F83 HydrophobicContact CB-CE1 4.25Å; H15-F83 HydrophobicContact CB-CZ 4.42Å; H15-F83 AromaticContact CD2-CD1 3.83Å; H15-F83 AromaticContact CD2-CE1 3.87Å; H15-F83 AromaticContact CE1-CD1 3.52Å; H15-F83 AromaticContact CE1-CD2 3.22Å; H15-F83 WeakPolarHBondContact CE1-CD2 3.48Å; H15-F83 AromaticContact CE1-CE1 3.61Å; H15-F83 AromaticContact CE1-CE2 3.31Å; H15-F83 WeakPolarHBondContact CE1-CE2 3.48Å; H15-F83 AromaticContact CE1-CG 3.33Å; H15-F83 WeakPolarHBondContact CE1-CG 3.4Å; H15-F83 AromaticContact CE1-CZ 3.5Å; H15-F83 AromaticContact CG-CE1 3.59Å; H15-F83 AromaticContact CG-CZ 3.78Å; H15-F83 AromaticContact ND1-CD1 3.84Å; H15-F83 AromaticContact ND1-CD2 3.8Å; H15-F83 AromaticContact ND1-CE1 3.42Å; H15-F83 WeakPolarHBondContact ND1-CE1 3.44Å; H15-F83 AromaticContact ND1-CE2 3.37Å; H15-F83 WeakPolarHBondContact ND1-CE2 3.46Å; H15-F83 AromaticContact ND1-CZ 3.16Å; H15-F83 WeakPolarHBondContact ND1-CZ 3.42Å; H15-F83 AromaticContact NE2-CD1 3.51Å; H15-F83 AromaticContact NE2-CD2 3.91Å; H15-F83 AromaticContact NE2-CE1 3.89Å; H15-F83 AromaticContact NE2-CG 3.52Å
16E95.1Very high90.9Very high103 Ų10370 Ų7048%0.48134%0.341SS..Hα-helixtrans-62.9-43.3178.1-168.8-174.1171.900111.4E12 Q13 Q18 H19 K20E12-E16 PolarHBondContact O-N 3.26Å; Q13-E16 PolarHBondContact O-N 2.85Å; E16-Q18 PolarHBondContact O-N 3.43Å; E16-H19 PolarHBondContact O-N 3.08Å; E16-K20 HydrophobicContact CG-CD 4.34Å; E16-K20 WeakPolarHBondContact O-CG 3.03Å; E16-K20 PolarHBondContact O-N 3.43Å; E16-K20 WeakPolarHBondContact OE1-CE 3.32Å; E16-K20 IonicContact OE1-NZ 3.31Å; E16-K20 PolarHBondContact OE1-NZ 3.35Å
17L95.3Very high91.1Very high13 Ų1367.7 Ų67.77%0.06832%0.324CS..Hα-helixtrans-60.3-45.1175.4178.660.5000111.3M1 Q13 L14 H15 H19 K20 I21 L42 L45 A49 F87M1-L17 HydrophobicContact CE-CD2 3.98Å; Q13-L17 VanDerWaalsContact O-CB 3.28Å; Q13-L17 WeakPolarHBondContact O-CB 3.37Å; Q13-L17 PolarHBondContact O-N 2.97Å; L14-L17 PolarHBondContact O-N 2.95Å; H15-L17 PolarHBondContact O-N 3.17Å; L17-H19 PolarHBondContact O-N 3.2Å; L17-K20 PolarHBondContact O-N 3.25Å; L17-I21 HydrophobicContact CD1-CD1 4Å; L17-I21 HydrophobicContact CD1-CG1 4.18Å; L17-I21 HydrophobicContact CG-CD1 3.84Å; L17-I21 HydrophobicContact CG-CG1 4.45Å; L17-I21 VanDerWaalsContact O-CG1 3.28Å; L17-I21 WeakPolarHBondContact O-CG1 3.3Å; L17-I21 PolarHBondContact O-N 2.8Å; L17-L42 HydrophobicContact CD1-CD2 3.91Å; L17-L45 HydrophobicContact CD1-CB 3.92Å; L17-L45 HydrophobicContact CD1-CD1 4.38Å; L17-L45 HydrophobicContact CD2-CB 4.24Å; L17-A49 HydrophobicContact CD2-CB 3.79Å; L17-F87 HydrophobicContact CD2-CE2 4.27Å; L17-F87 HydrophobicContact CD2-CZ 3.96Å; L17-F87 HydrophobicContact CG-CE2 4.32Å; L17-F87 HydrophobicContact CG-CZ 4.43Å
18Q95.4Very high90.8Very high26 Ų2665.8 Ų65.812%0.12132%0.324CS..Hα-helixtrans-60-46.3177.1-175.457.518.400111.7L14 H15 E16 K20 I21 V22 F83 F87 N91L14-Q18 WeakPolarHBondContact O-CB 3.37Å; L14-Q18 PolarHBondContact O-N 2.91Å; H15-Q18 PolarHBondContact O-N 2.88Å; E16-Q18 PolarHBondContact O-N 3.43Å; Q18-K20 VanDerWaalsContact C-N 3.34Å; Q18-K20 PolarHBondContact O-N 2.54Å; Q18-I21 PolarHBondContact O-N 3.41Å; Q18-V22 VanDerWaalsContact O-CG2 3.31Å; Q18-V22 WeakPolarHBondContact O-CG2 3.47Å; Q18-V22 PolarHBondContact O-N 3.08Å; Q18-F83 HydrophobicContact CB-CZ 4.06Å; Q18-F83 HydrophobicContact CG-CZ 4.25Å; Q18-F87 HydrophobicContact CB-CD2 3.96Å; Q18-F87 HydrophobicContact CB-CE2 4.2Å; Q18-F87 HydrophobicContact CG-CD2 4.39Å; Q18-F87 VanDerWaalsContact OE1-CD2 3.23Å; Q18-N91 PolarHBondContact OE1-ND2 3.12Å
19H94.9Very high90.4Very high131 Ų13170.6 Ų70.661%0.60633%0.334SS*.Hα-helixtrans-59.7-44.6177.2179.9-98000111.5H15 E16 L17 V22 Y23H15-H19 PolarHBondContact O-N 2.98Å; E16-H19 PolarHBondContact O-N 3.08Å; L17-H19 PolarHBondContact O-N 3.2Å; H19-V22 PolarHBondContact O-N 2.73Å; H19-Y23 VanDerWaalsContact O-CB 3.31Å; H19-Y23 WeakPolarHBondContact O-CB 3.43Å; H19-Y23 PolarHBondContact O-N 3.38Å
20K93.9Very high89.9Confident92 Ų9277.8 Ų77.840%0.436%0.356SS..Hα-helixtrans-63.1-43.8176.7-72.4173.8-178.6170.80112.5E16 L17 Q18 V22 Y23 V24 L42E16-K20 HydrophobicContact CG-CD 4.34Å; E16-K20 WeakPolarHBondContact O-CG 3.03Å; E16-K20 PolarHBondContact O-N 3.43Å; E16-K20 WeakPolarHBondContact OE1-CE 3.32Å; E16-K20 IonicContact OE1-NZ 3.31Å; E16-K20 PolarHBondContact OE1-NZ 3.35Å; L17-K20 PolarHBondContact O-N 3.25Å; Q18-K20 VanDerWaalsContact C-N 3.34Å; Q18-K20 PolarHBondContact O-N 2.54Å; K20-V22 PolarHBondContact O-N 2.62Å; K20-Y23 PolarHBondContact O-N 2.97Å; K20-V24 WeakPolarHBondContact O-CG2 3.29Å; K20-V24 PolarHBondContact O-N 3.38Å; K20-L42 HydrophobicContact CB-CD2 4.07Å
21I93.1Very high89Confident9 Ų984.1 Ų84.15%0.04639%0.389CS..Hα-helixtrans-59.7-47.6176.4-70.4166.3000110.4L17 Q18 R25 K46 F87L17-I21 HydrophobicContact CD1-CD1 4Å; L17-I21 HydrophobicContact CD1-CG1 4.18Å; L17-I21 HydrophobicContact CG-CD1 3.84Å; L17-I21 HydrophobicContact CG-CG1 4.45Å; L17-I21 VanDerWaalsContact O-CG1 3.28Å; L17-I21 WeakPolarHBondContact O-CG1 3.3Å; L17-I21 PolarHBondContact O-N 2.8Å; Q18-I21 PolarHBondContact O-N 3.41Å; I21-R25 WeakPolarHBondContact O-CB 3.32Å; I21-R25 WeakPolarHBondContact O-CG 3.4Å; I21-R25 PolarHBondContact O-N 3.33Å; I21-K46 HydrophobicContact CD1-CB 3.88Å; I21-K46 HydrophobicContact CD1-CD 4.37Å; I21-K46 HydrophobicContact CD1-CG 3.98Å; I21-F87 HydrophobicContact CD1-CE2 4.22Å; I21-F87 HydrophobicContact CD1-CZ 4.32Å
22V91.7Very high88.5Confident53 Ų5384 Ų8432%0.32139%0.394SS..Hα-helixtrans-64.5-44.7179.4173.40000110.7Q18 H19 K20 R25 H26Q18-V22 VanDerWaalsContact O-CG2 3.31Å; Q18-V22 WeakPolarHBondContact O-CG2 3.47Å; Q18-V22 PolarHBondContact O-N 3.08Å; H19-V22 PolarHBondContact O-N 2.73Å; K20-V22 PolarHBondContact O-N 2.62Å; V22-R25 PolarHBondContact O-N 3.48Å; V22-H26 VanDerWaalsContact CG1-CE1 3.42Å; V22-H26 WeakPolarHBondContact CG1-CE1 3.46Å; V22-H26 WeakPolarHBondContact CG1-ND1 3.01Å; V22-H26 PolarHBondContact O-N 2.98Å; V22-H26 PolarHBondContact O-ND1 3.18Å
23Y90.4Very high88Confident131 Ų13182.3 Ų82.351%0.51439%0.393SS..Hα-helixtrans-59.5-49.6178.7-179.5-95.8000112.1H19 K20 R25 H26 Q27H19-Y23 VanDerWaalsContact O-CB 3.31Å; H19-Y23 WeakPolarHBondContact O-CB 3.43Å; H19-Y23 PolarHBondContact O-N 3.38Å; K20-Y23 PolarHBondContact O-N 2.97Å; Y23-R25 VanDerWaalsContact C-N 3.34Å; Y23-R25 PolarHBondContact O-N 3.38Å; Y23-H26 PolarHBondContact O-N 3.38Å; Y23-H26 VanDerWaalsContact O-N 3.14Å; Y23-Q27 HydrophobicContact CD1-CG 4.14Å; Y23-Q27 HydrophobicContact CE1-CG 3.72Å; Y23-Q27 HydrophobicContact CE2-CG 4.15Å; Y23-Q27 WeakPolarHBondContact O-CG 3.46Å; Y23-Q27 PolarHBondContact O-N 2.83Å
24V89.4Confident87.4Confident23 Ų2382.6 Ų82.614%0.13941%0.405CS..Hα-helixtrans-62.8-40.6178.6172.60000111.1K20 H26 Q27 A28 C35 L42K20-V24 WeakPolarHBondContact O-CG2 3.29Å; K20-V24 PolarHBondContact O-N 3.38Å; V24-H26 VanDerWaalsContact C-N 3.3Å; V24-H26 PolarHBondContact O-N 3.25Å; V24-Q27 PolarHBondContact O-N 2.85Å; V24-A28 WeakPolarHBondContact O-CB 3.05Å; V24-A28 PolarHBondContact O-N 3.02Å; V24-C35 HydrophobicContact CG1-CB 4.18Å; V24-L42 HydrophobicContact CB-CD1 3.94Å; V24-L42 HydrophobicContact CG1-CD1 4.34Å; V24-L42 HydrophobicContact CG2-CD1 3.55Å
25R86.2Confident86.9Confident131 Ų13183.4 Ų83.449%0.49441%0.41SS..Hα-helixtrans-59.5-37.8173.9-77.6178.4177.9171.42.9113.1I21 V22 Y23I21-R25 WeakPolarHBondContact O-CB 3.32Å; I21-R25 WeakPolarHBondContact O-CG 3.4Å; I21-R25 PolarHBondContact O-N 3.33Å; V22-R25 PolarHBondContact O-N 3.48Å; Y23-R25 VanDerWaalsContact C-N 3.34Å; Y23-R25 PolarHBondContact O-N 3.38Å
26H86.2Confident86.3Confident136 Ų13684.9 Ų84.963%0.6342%0.418SS*.Hα-helixtrans-73.6-34.8176.8-75.584000112.7V22 Y23 V24V22-H26 VanDerWaalsContact CG1-CE1 3.42Å; V22-H26 WeakPolarHBondContact CG1-CE1 3.46Å; V22-H26 WeakPolarHBondContact CG1-ND1 3.01Å; V22-H26 PolarHBondContact O-N 2.98Å; V22-H26 PolarHBondContact O-ND1 3.18Å; Y23-H26 PolarHBondContact O-N 3.38Å; Y23-H26 VanDerWaalsContact O-N 3.14Å; V24-H26 VanDerWaalsContact C-N 3.3Å; V24-H26 PolarHBondContact O-N 3.25Å
27Q84.9Confident85.8Confident41 Ų4186.6 Ų86.619%0.19243%0.426CS..Hα-helixtrans-81.1-21.1178.8-64-59.3-26.400113.4Y23 V24 F29 R30Y23-Q27 HydrophobicContact CD1-CG 4.14Å; Y23-Q27 HydrophobicContact CE1-CG 3.72Å; Y23-Q27 HydrophobicContact CE2-CG 4.15Å; Y23-Q27 WeakPolarHBondContact O-CG 3.46Å; Y23-Q27 PolarHBondContact O-N 2.83Å; V24-Q27 PolarHBondContact O-N 2.85Å; Q27-F29 PolarHBondContact O-N 3.17Å; Q27-F29 VanDerWaalsContact O-N 3.1Å; Q27-R30 WeakPolarHBondContact O-CB 3.39Å; Q27-R30 PolarHBondContact O-N 3.29Å
28A77.6Confident85.6Confident48 Ų4889.1 Ų89.140%0.39744%0.441SS..G310 helixtrans-56.1-27.6178.800000113V24 R30 D31V24-A28 WeakPolarHBondContact O-CB 3.05Å; V24-A28 PolarHBondContact O-N 3.02Å; A28-R30 PolarHBondContact O-N 3.15Å; A28-D31 PolarHBondContact O-N 2.87Å
29F76.5Confident85.2Confident189 Ų18992.6 Ų92.683%0.82946%0.458SS*.G310 helixtrans-62.7-19.4173.9-177.3-97.8000113.9Q27 D31Q27-F29 PolarHBondContact O-N 3.17Å; Q27-F29 VanDerWaalsContact O-N 3.1Å; F29-D31 VanDerWaalsContact C-N 3.32Å
30R78.1Confident84.8Confident187 Ų18791.6 Ų91.671%0.70646%0.457SS*.G310 helixtrans-90.78.6-179.7-60.8-174176.7-178.1-4.6113.5Q27 A28 A32Q27-R30 WeakPolarHBondContact O-CB 3.39Å; Q27-R30 PolarHBondContact O-N 3.29Å; A28-R30 PolarHBondContact O-N 3.15Å; R30-A32 PolarHBondContact O-N 3.43Å
31D74Confident84.7Confident133 Ų13391.4 Ų91.471%0.71146%0.463SS*.THydrogen-bonded Turntrans50.729.7-178.8-64.7-37000114.1A28 F29 V33A28-D31 PolarHBondContact O-N 2.87Å; F29-D31 VanDerWaalsContact C-N 3.32Å; D31-V33 PolarHBondContact O-N 3.43Å
32A79.4Confident84.7Confident42 Ų4291.7 Ų91.735%0.34747%0.465SS..  trans-70.2121-179.800000110.4R30 A34 C35R30-A32 PolarHBondContact O-N 3.43Å; A32-A34 PolarHBondContact O-N 3.17Å; A32-A34 VanDerWaalsContact O-N 3.17Å; A32-C35 VanDerWaalsContact O-CB 3.29Å; A32-C35 WeakPolarHBondContact O-CB 3.44Å; A32-C35 PolarHBondContact O-N 2.91Å
33V82.1Confident84.7Confident96 Ų9691.5 Ų91.558%0.58246%0.462SS*.Hα-helixtrans-51.4-40.8179.1178.80000112.3D31 C35 Q36 E37D31-V33 PolarHBondContact O-N 3.43Å; V33-C35 PolarHBondContact O-N 3.38Å; V33-C35 VanDerWaalsContact O-N 3.15Å; V33-Q36 WeakPolarHBondContact O-CB 3.45Å; V33-Q36 PolarHBondContact O-N 3.35Å; V33-E37 PolarHBondContact O-N 2.94Å
34A82.5Confident84.9Confident62 Ų6290.6 Ų90.651%0.51247%0.466SS..Hα-helixtrans-58.6-28.1177.200000113.7A32 V38A32-A34 PolarHBondContact O-N 3.17Å; A32-A34 VanDerWaalsContact O-N 3.17Å; A34-V38 WeakPolarHBondContact O-CG2 3.32Å; A34-V38 PolarHBondContact O-N 3.29Å
35C83.5Confident85.1Confident17 Ų1792.6 Ų92.612%0.11548%0.475CS..Hα-helixtrans-69-40.8175.1-67.60000111.3V24 A32 V33 V38 E39V24-C35 HydrophobicContact CG1-CB 4.18Å; A32-C35 VanDerWaalsContact O-CB 3.29Å; A32-C35 WeakPolarHBondContact O-CB 3.44Å; A32-C35 PolarHBondContact O-N 2.91Å; V33-C35 PolarHBondContact O-N 3.38Å; V33-C35 VanDerWaalsContact O-N 3.15Å; C35-V38 PolarHBondContact O-N 3.36Å; C35-E39 VanDerWaalsContact O-CB 3.3Å; C35-E39 WeakPolarHBondContact O-CB 3.39Å; C35-E39 PolarHBondContact O-N 2.86Å
36Q82.2Confident85.5Confident120 Ų12087.9 Ų87.956%0.56146%0.459SS*.Hα-helixtrans-66.4-38.5178.8-62.8178.5-4.600111.5V33V33-Q36 WeakPolarHBondContact O-CB 3.45Å; V33-Q36 PolarHBondContact O-N 3.35Å
37E85.4Confident86Confident138 Ų13886.1 Ų86.165%0.64545%0.453SS*.Hα-helixtrans-64.2-41.6178.1-68.1179.1172.600112.3V33V33-E37 PolarHBondContact O-N 2.94Å
38V89.3Confident86.5Confident66 Ų6688.9 Ų88.940%0.447%0.465SS..Hα-helixtrans-84.1-22.3-176.2177.90000112.3A34 C35 N40 V41 L42A34-V38 WeakPolarHBondContact O-CG2 3.32Å; A34-V38 PolarHBondContact O-N 3.29Å; C35-V38 PolarHBondContact O-N 3.36Å; V38-N40 VanDerWaalsContact C-N 3.35Å; V38-N40 PolarHBondContact O-N 2.7Å; V38-V41 PolarHBondContact O-N 2.89Å; V38-V41 VanDerWaalsContact O-N 3.17Å; V38-L42 HydrophobicContact CG1-CD1 3.72Å; V38-L42 HydrophobicContact CG1-CG 3.75Å; V38-L42 PolarHBondContact O-N 3.26Å
39E87.2Confident87.3Confident99 Ų9986.6 Ų86.646%0.46345%0.446SS..Hα-helixtrans-55.6-45.2-177.1179.3169.9-163.900112.9C35 V41 L42 N43C35-E39 VanDerWaalsContact O-CB 3.3Å; C35-E39 WeakPolarHBondContact O-CB 3.39Å; C35-E39 PolarHBondContact O-N 2.86Å; E39-V41 PolarHBondContact O-N 2.81Å; E39-L42 PolarHBondContact O-N 3.14Å; E39-N43 WeakPolarHBondContact CG-ND2 3.17Å; E39-N43 VanDerWaalsContact O-CB 3.32Å; E39-N43 WeakPolarHBondContact O-CB 3.41Å; E39-N43 PolarHBondContact O-N 3.49Å; E39-N43 PolarHBondContact O-ND2 3.23Å
40N87.6Confident88.3Confident111 Ų11178 Ų7859%0.59441%0.408SS*.Hα-helixtrans-63-42.1179.2-74-32.1000112.2V38 N43 N44V38-N40 VanDerWaalsContact C-N 3.35Å; V38-N40 PolarHBondContact O-N 2.7Å; N40-N43 PolarHBondContact O-N 2.95Å; N40-N44 PolarHBondContact O-N 3.1Å; N40-N44 PolarHBondContact O-ND2 3.4Å
41V91.2Very high89.2Confident87 Ų8775.5 Ų75.553%0.52741%0.405SS..Hα-helixtrans-65.9-45.8178.3-179.70000110.6V38 E39 N43 N44 L45V38-V41 PolarHBondContact O-N 2.89Å; V38-V41 VanDerWaalsContact O-N 3.17Å; E39-V41 PolarHBondContact O-N 2.81Å; V41-N43 VanDerWaalsContact C-N 3.35Å; V41-N43 PolarHBondContact O-N 3.13Å; V41-N44 PolarHBondContact O-N 3.33Å; V41-L45 HydrophobicContact CG1-CD1 4.16Å; V41-L45 WeakPolarHBondContact O-CG 3.47Å; V41-L45 PolarHBondContact O-N 3.24Å
42L92.7Very high90.3Very high15 Ų1571.6 Ų71.68%0.07938%0.382CS..Hα-helixtrans-64.4-38.5177.4-72.6178000112.1L17 K20 V24 V38 E39 L45 K46L17-L42 HydrophobicContact CD1-CD2 3.91Å; K20-L42 HydrophobicContact CB-CD2 4.07Å; V24-L42 HydrophobicContact CB-CD1 3.94Å; V24-L42 HydrophobicContact CG1-CD1 4.34Å; V24-L42 HydrophobicContact CG2-CD1 3.55Å; V38-L42 HydrophobicContact CG1-CD1 3.72Å; V38-L42 HydrophobicContact CG1-CG 3.75Å; V38-L42 PolarHBondContact O-N 3.26Å; E39-L42 PolarHBondContact O-N 3.14Å; L42-L45 PolarHBondContact O-N 2.88Å; L42-K46 WeakPolarHBondContact O-CB 3.33Å; L42-K46 PolarHBondContact O-N 3.16Å
43N92.2Very high91.1Very high50 Ų5069.6 Ų69.627%0.26737%0.365SS..Hα-helixtrans-64.4-42.5176.1-82.1-36.4000112E39 N40 V41 K46 L47E39-N43 WeakPolarHBondContact CG-ND2 3.17Å; E39-N43 VanDerWaalsContact O-CB 3.32Å; E39-N43 WeakPolarHBondContact O-CB 3.41Å; E39-N43 PolarHBondContact O-N 3.49Å; E39-N43 PolarHBondContact O-ND2 3.23Å; N40-N43 PolarHBondContact O-N 2.95Å; V41-N43 VanDerWaalsContact C-N 3.35Å; V41-N43 PolarHBondContact O-N 3.13Å; N43-K46 WeakPolarHBondContact O-CB 3.35Å; N43-K46 PolarHBondContact O-N 3.15Å; N43-K46 PolarHBondContact OD1-NZ 3.04Å; N43-L47 WeakPolarHBondContact O-CG 3.43Å; N43-L47 PolarHBondContact O-N 2.96Å
44N94.1Very high91.9Very high112 Ų11268.7 Ų68.760%0.59935%0.351SS*.Hα-helixtrans-64.6-43.7175.4-72.1-22.5000112.1N40 V41 L47 K48N40-N44 PolarHBondContact O-N 3.1Å; N40-N44 PolarHBondContact O-ND2 3.4Å; V41-N44 PolarHBondContact O-N 3.33Å; N44-L47 PolarHBondContact O-N 3.4Å; N44-K48 PolarHBondContact O-N 2.95Å; N44-K48 VanDerWaalsContact O-N 3.08Å
45L94.6Very high92.6Very high64 Ų6471.8 Ų71.834%0.33536%0.355SS..Hα-helixtrans-62.9-42.1175.1-73.5173.7000111.8M1 L17 V41 L42 K48 A49M1-L45 HydrophobicContact CG-CD2 4.02Å; L17-L45 HydrophobicContact CD1-CB 3.92Å; L17-L45 HydrophobicContact CD1-CD1 4.38Å; L17-L45 HydrophobicContact CD2-CB 4.24Å; V41-L45 HydrophobicContact CG1-CD1 4.16Å; V41-L45 WeakPolarHBondContact O-CG 3.47Å; V41-L45 PolarHBondContact O-N 3.24Å; L42-L45 PolarHBondContact O-N 2.88Å; L45-K48 PolarHBondContact O-N 3.33Å; L45-A49 VanDerWaalsContact O-CB 3.26Å; L45-A49 WeakPolarHBondContact O-CB 3.38Å; L45-A49 PolarHBondContact O-N 2.95Å
46K95.5Very high93.2Very high33 Ų3372.1 Ų72.114%0.14336%0.355CS..Hα-helixtrans-58.4-48174.9179.9-165.474.9-167.30111.3I21 L42 N43 A49 V50 F87 N91I21-K46 HydrophobicContact CD1-CB 3.88Å; I21-K46 HydrophobicContact CD1-CD 4.37Å; I21-K46 HydrophobicContact CD1-CG 3.98Å; L42-K46 WeakPolarHBondContact O-CB 3.33Å; L42-K46 PolarHBondContact O-N 3.16Å; N43-K46 WeakPolarHBondContact O-CB 3.35Å; N43-K46 PolarHBondContact O-N 3.15Å; N43-K46 PolarHBondContact OD1-NZ 3.04Å; K46-A49 WeakPolarHBondContact O-CB 3.35Å; K46-A49 PolarHBondContact O-N 2.96Å; K46-V50 VanDerWaalsContact O-CG2 3.32Å; K46-V50 WeakPolarHBondContact O-CG2 3.36Å; K46-V50 PolarHBondContact O-N 3.27Å; K46-F87 HydrophobicContact CG-CZ 4.49Å; K46-N91 HydrophobicContact CD-CB 4.01Å; K46-N91 HydrophobicContact CG-CB 3.97Å
47L95.5Very high93.9Very high99 Ų9966.4 Ų66.452%0.51833%0.328SS..Hα-helixtrans-61.7-47.6178.7-70.7173.3000111.7N43 N44 A49 V50 E51N43-L47 WeakPolarHBondContact O-CG 3.43Å; N43-L47 PolarHBondContact O-N 2.96Å; N44-L47 PolarHBondContact O-N 3.4Å; L47-A49 VanDerWaalsContact C-N 3.28Å; L47-A49 PolarHBondContact O-N 3.43Å; L47-V50 PolarHBondContact O-N 3.49Å; L47-E51 WeakPolarHBondContact O-CB 3.28Å; L47-E51 PolarHBondContact O-N 2.88Å
48K95.2Very high94.6Very high98 Ų9860.4 Ų60.443%0.42630%0.3SS..Hα-helixtrans-61.3-37.1176.1-171.5174176-177.50111.9M1 D2 N44 L45 K52M1-K48 HydrophobicContact CB-CD 4.43Å; D2-K48 IonicContact OD1-NZ 2.76Å; D2-K48 PolarHBondContact OD1-NZ 3.49Å; N44-K48 PolarHBondContact O-N 2.95Å; N44-K48 VanDerWaalsContact O-N 3.08Å; L45-K48 PolarHBondContact O-N 3.33Å; K48-K52 WeakPolarHBondContact O-CB 3.36Å; K48-K52 PolarHBondContact O-N 3.12Å; K48-K52 VanDerWaalsContact O-N 3.14Å
49A95.5Very high94.9Very high0 Ų065.5 Ų65.50%031%0.312CS..Hα-helixtrans-63.7-50.617500000112.3M1 L14 L17 L45 K46 L47 K52 T53 F87M1-A49 HydrophobicContact CE-CB 3.13Å; L14-A49 HydrophobicContact CD1-CB 3.87Å; L17-A49 HydrophobicContact CD2-CB 3.79Å; L45-A49 VanDerWaalsContact O-CB 3.26Å; L45-A49 WeakPolarHBondContact O-CB 3.38Å; L45-A49 PolarHBondContact O-N 2.95Å; K46-A49 WeakPolarHBondContact O-CB 3.35Å; K46-A49 PolarHBondContact O-N 2.96Å; L47-A49 VanDerWaalsContact C-N 3.28Å; L47-A49 PolarHBondContact O-N 3.43Å; A49-K52 PolarHBondContact O-N 3.5Å; A49-T53 WeakPolarHBondContact O-CB 3.5Å; A49-T53 WeakPolarHBondContact O-CG2 3.48Å; A49-T53 PolarHBondContact O-N 2.92Å; A49-T53 PolarHBondContact O-OG1 3.2Å; A49-F87 HydrophobicContact CB-CE1 3.48Å; A49-F87 VanDerWaalsContact CB-CE1 3.48Å; A49-F87 HydrophobicContact CB-CZ 3.66Å
50V97.4Very high95.3Very high8 Ų862.6 Ų62.65%0.04830%0.298CS..Hα-helixtrans-60.4-46.6179.8169.10000110K46 L47 K52 T53 R54 F87 N91 D92 V95K46-V50 VanDerWaalsContact O-CG2 3.32Å; K46-V50 WeakPolarHBondContact O-CG2 3.36Å; K46-V50 PolarHBondContact O-N 3.27Å; L47-V50 PolarHBondContact O-N 3.49Å; V50-K52 PolarHBondContact O-N 2.95Å; V50-T53 PolarHBondContact O-OG1 2.62Å; V50-R54 WeakPolarHBondContact O-CB 3.39Å; V50-R54 PolarHBondContact O-N 3.1Å; V50-F87 HydrophobicContact CG2-CD1 4.41Å; V50-F87 HydrophobicContact CG2-CE1 3.83Å; V50-N91 HydrophobicContact CG2-CB 4.29Å; V50-D92 HydrophobicContact CG1-CB 4.04Å; V50-D92 HydrophobicContact CG2-CB 4.37Å; V50-V95 HydrophobicContact CG1-CB 4.12Å; V50-V95 HydrophobicContact CG1-CG1 4.02Å; V50-V95 HydrophobicContact CG1-CG2 3.95Å
51E96.8Very high95.7Very high135 Ų13557.3 Ų57.363%0.63127%0.27SS*.Hα-helixtrans-59.8-48.6178.7-174.7176.3-166.400112.1L47 R54 E55L47-E51 WeakPolarHBondContact O-CB 3.28Å; L47-E51 PolarHBondContact O-N 2.88Å; E51-R54 PolarHBondContact O-N 3Å; E51-E55 PolarHBondContact O-N 3.19Å
52K96Very high95.9Very high51 Ų5158 Ų5822%0.22226%0.264CS..Hα-helixtrans-65.9-44-178-168.4171.3-163.4170.20112.7M1 D2 E3 A5 F10 K48 A49 V50 F56M1-K52 PolarHBondContact O-NZ 3.49Å; D2-K52 PolarHBondContact O-NZ 2.95Å; E3-K52 WeakPolarHBondContact O-CE 3.47Å; E3-K52 PolarHBondContact O-NZ 3.31Å; A5-K52 HydrophobicContact CB-CG 4.35Å; F10-K52 HydrophobicContact CE2-CD 3.78Å; F10-K52 HydrophobicContact CZ-CD 3.9Å; F10-K52 HydrophobicContact CZ-CG 4.31Å; K48-K52 WeakPolarHBondContact O-CB 3.36Å; K48-K52 PolarHBondContact O-N 3.12Å; K48-K52 VanDerWaalsContact O-N 3.14Å; A49-K52 PolarHBondContact O-N 3.5Å; V50-K52 PolarHBondContact O-N 2.95Å; K52-F56 WeakPolarHBondContact O-CB 3.36Å; K52-F56 PolarHBondContact O-N 3.43Å; K52-F56 VanDerWaalsContact O-N 3.17Å
53T97.2Very high96Very high0 Ų060 Ų600%027%0.272CS..Hα-helixtrans-68.9-38.4177.450.10000111.6F10 L14 A49 V50 F56 L57 Y84 I88F10-T53 HydrophobicContact CE1-CG2 3.84Å; F10-T53 HydrophobicContact CZ-CG2 4.17Å; L14-T53 HydrophobicContact CD1-CG2 4.47Å; L14-T53 HydrophobicContact CD2-CG2 3.88Å; A49-T53 WeakPolarHBondContact O-CB 3.5Å; A49-T53 WeakPolarHBondContact O-CG2 3.48Å; A49-T53 PolarHBondContact O-N 2.92Å; A49-T53 PolarHBondContact O-OG1 3.2Å; V50-T53 PolarHBondContact O-OG1 2.62Å; T53-F56 PolarHBondContact O-N 2.86Å; T53-L57 WeakPolarHBondContact O-CG 3.15Å; T53-L57 PolarHBondContact O-N 3.44Å; T53-Y84 HydrophobicContact CG2-CD1 4.29Å; T53-Y84 HydrophobicContact CG2-CD2 3.97Å; T53-Y84 HydrophobicContact CG2-CE2 4.49Å; T53-Y84 HydrophobicContact CG2-CG 3.87Å; T53-I88 WeakPolarHBondContact OG1-CD1 3.43Å; T53-I88 WeakPolarHBondContact OG1-CG1 3.44Å
54R97.7Very high96.1Very high78 Ų7857.8 Ų57.829%0.29426%0.261SS..Hα-helixtrans-58.2-53.1173175.7-169.4173.1-91.60.7111.8V50 E51 F56 L57 L58 I88 V95 E98 I99V50-R54 WeakPolarHBondContact O-CB 3.39Å; V50-R54 PolarHBondContact O-N 3.1Å; E51-R54 PolarHBondContact O-N 3Å; R54-F56 VanDerWaalsContact C-N 3.28Å; R54-F56 PolarHBondContact O-N 2.96Å; R54-L57 PolarHBondContact O-N 3.4Å; R54-L58 HydrophobicContact CG-CD1 3.86Å; R54-L58 HydrophobicContact CG-CG 4.41Å; R54-L58 WeakPolarHBondContact O-CB 3.44Å; R54-L58 WeakPolarHBondContact O-CG 3.47Å; R54-L58 PolarHBondContact O-N 2.9Å; R54-I88 HydrophobicContact CB-CD1 4.48Å; R54-V95 HydrophobicContact CB-CG1 3.72Å; R54-V95 HydrophobicContact CG-CG1 3.59Å; R54-E98 IonicContact CZ-OE1 3.39Å; R54-E98 IonicContact CZ-OE2 2.8Å; R54-E98 VanDerWaalsContact CZ-OE2 3.31Å; R54-E98 IonicContact NE-OE1 3.14Å; R54-E98 IonicContact NE-OE2 3.71Å; R54-E98 PolarHBondContact NE-OE2 2.86Å; R54-E98 IonicContact NH2-OE1 3.37Å; R54-E98 PolarHBondContact NH2-OE1 3.19Å; R54-E98 IonicContact NH2-OE2 3.92Å; R54-E98 PolarHBondContact NH2-OE2 2.88Å; R54-E98 VanDerWaalsContact NH2-OE2 3.08Å; R54-I99 HydrophobicContact CB-CD1 4.44Å; R54-I99 HydrophobicContact CG-CD1 4.41Å
55E97.4Very high96Very high126 Ų12657.8 Ų57.859%0.58925%0.253SS*.Hα-helixtrans-57.3-44.9179.8-170.9-167.615900111E51 R59E51-E55 PolarHBondContact O-N 3.19Å; E55-R59 VanDerWaalsContact O-CB 3.25Å; E55-R59 WeakPolarHBondContact O-CB 3.1Å; E55-R59 PolarHBondContact O-N 2.59Å
56F96.9Very high95.7Very high24 Ų2461.1 Ų61.111%0.10526%0.264CS..Hα-helixtrans-59.7-50.1177.8178.5-92.9000112.6A5 T6 K52 T53 R54 R59 K60 Y81 Y84A5-F56 HydrophobicContact CB-CB 4.11Å; A5-F56 HydrophobicContact CB-CD2 3.87Å; A5-F56 HydrophobicContact CB-CG 4.09Å; T6-F56 HydrophobicContact CG2-CE2 3.75Å; K52-F56 WeakPolarHBondContact O-CB 3.36Å; K52-F56 PolarHBondContact O-N 3.43Å; K52-F56 VanDerWaalsContact O-N 3.17Å; T53-F56 PolarHBondContact O-N 2.86Å; R54-F56 VanDerWaalsContact C-N 3.28Å; R54-F56 PolarHBondContact O-N 2.96Å; F56-R59 PolarHBondContact O-N 3.06Å; F56-K60 HydrophobicContact CD1-CG 4.5Å; F56-K60 HydrophobicContact CE1-CG 4.05Å; F56-K60 HydrophobicContact CZ-CG 4.12Å; F56-K60 WeakPolarHBondContact O-CG 3.38Å; F56-K60 PolarHBondContact O-N 3.3Å; F56-Y81 AromaticContact CE1-CD1 3.87Å; F56-Y81 HydrophobicContact CE1-CD1 3.87Å; F56-Y81 AromaticContact CE1-CD2 3.57Å; F56-Y81 HydrophobicContact CE1-CD2 3.57Å; F56-Y81 HydrophobicContact CE1-CE1 4.17Å; F56-Y81 AromaticContact CE1-CE2 3.91Å; F56-Y81 HydrophobicContact CE1-CE2 3.91Å; F56-Y81 AromaticContact CE1-CG 3.55Å; F56-Y81 HydrophobicContact CE1-CG 3.55Å; F56-Y81 HydrophobicContact CZ-CD1 4.09Å; F56-Y81 AromaticContact CZ-CD2 3.75Å; F56-Y81 HydrophobicContact CZ-CD2 3.75Å; F56-Y81 AromaticContact CZ-CE1 3.89Å; F56-Y81 HydrophobicContact CZ-CE1 3.89Å; F56-Y81 AromaticContact CZ-CE2 3.56Å; F56-Y81 HydrophobicContact CZ-CE2 3.56Å; F56-Y81 HydrophobicContact CZ-CG 4.01Å; F56-Y81 AromaticContact CZ-CZ 3.62Å; F56-Y84 AromaticContact CD1-CD2 3.85Å; F56-Y84 HydrophobicContact CD1-CD2 3.85Å; F56-Y84 AromaticContact CD1-CE2 3.91Å; F56-Y84 HydrophobicContact CD1-CE2 3.91Å; F56-Y84 HydrophobicContact CE1-CD2 4.24Å; F56-Y84 HydrophobicContact CE1-CE2 4.09Å; F56-Y84 HydrophobicContact CG-CE2 4.47Å
57L97.9Very high94.9Very high0 Ų065.3 Ų65.30%030%0.295CS..Hα-helixtrans-65.7-44.8-178.6-70.9-178.3000111.8T53 R54 R59 K60 I61 L78 F85 I88 I99 F219T53-L57 WeakPolarHBondContact O-CG 3.15Å; T53-L57 PolarHBondContact O-N 3.44Å; R54-L57 PolarHBondContact O-N 3.4Å; L57-R59 VanDerWaalsContact C-N 3.33Å; L57-R59 PolarHBondContact O-N 3.38Å; L57-K60 WeakPolarHBondContact O-CB 3.22Å; L57-K60 PolarHBondContact O-N 3.25Å; L57-K60 VanDerWaalsContact O-N 3.16Å; L57-I61 WeakPolarHBondContact O-CG1 3.46Å; L57-I61 PolarHBondContact O-N 2.97Å; L57-L78 HydrophobicContact CD2-CD2 3.91Å; L57-F85 HydrophobicContact CD1-CB 4.22Å; L57-I88 HydrophobicContact CD1-CD1 3.98Å; L57-I99 HydrophobicContact CB-CD1 4.33Å; L57-I99 HydrophobicContact CB-CG2 4.35Å; L57-I99 HydrophobicContact CD1-CD1 4.02Å; L57-I99 HydrophobicContact CD1-CG2 4.48Å; L57-F219 HydrophobicContact CD1-CZ 4.35Å; L57-F219 HydrophobicContact CD2-CE2 4.46Å; L57-F219 HydrophobicContact CD2-CZ 3.88Å
58L98.1Very high93.9Very high12 Ų1269.4 Ų69.46%0.06332%0.316CS..Hα-helixtrans-60.5-43.5175.8-70.8176.3000111.3R54 K60 I61 Y62 I99 E102R54-L58 HydrophobicContact CG-CD1 3.86Å; R54-L58 HydrophobicContact CG-CG 4.41Å; R54-L58 WeakPolarHBondContact O-CB 3.44Å; R54-L58 WeakPolarHBondContact O-CG 3.47Å; R54-L58 PolarHBondContact O-N 2.9Å; L58-K60 VanDerWaalsContact C-N 3.29Å; L58-K60 PolarHBondContact O-N 3.5Å; L58-I61 HydrophobicContact CD2-CD1 4.47Å; L58-I61 PolarHBondContact O-N 3.44Å; L58-I61 VanDerWaalsContact O-N 3.17Å; L58-Y62 HydrophobicContact CB-CE2 4.08Å; L58-Y62 WeakPolarHBondContact O-CD2 3.39Å; L58-Y62 PolarHBondContact O-N 3.07Å; L58-I99 HydrophobicContact CD2-CG1 4.18Å; L58-I99 HydrophobicContact CG-CG1 4.33Å; L58-E102 HydrophobicContact CD2-CB 3.98Å; L58-E102 HydrophobicContact CD2-CG 4.02Å
59R96.2Very high92.9Very high173 Ų17366.8 Ų66.865%0.65331%0.313SS*.Hα-helixtrans-59.3-39.4175.6-175.8178.7174.9-170-1.7112.2E55 F56 L57 Q63E55-R59 VanDerWaalsContact O-CB 3.25Å; E55-R59 WeakPolarHBondContact O-CB 3.1Å; E55-R59 PolarHBondContact O-N 2.59Å; F56-R59 PolarHBondContact O-N 3.06Å; L57-R59 VanDerWaalsContact C-N 3.33Å; L57-R59 PolarHBondContact O-N 3.38Å; R59-Q63 WeakPolarHBondContact O-CG 3.39Å; R59-Q63 PolarHBondContact O-N 3.33Å
60K95.1Very high92.4Very high38 Ų3870.5 Ų70.517%0.16533%0.333CS..Hα-helixtrans-68.1-41.5174.5-75.7-77.3-175.1172.10112F56 L57 L58 Y62 Q63 S77 L78F56-K60 HydrophobicContact CD1-CG 4.5Å; F56-K60 HydrophobicContact CE1-CG 4.05Å; F56-K60 HydrophobicContact CZ-CG 4.12Å; F56-K60 WeakPolarHBondContact O-CG 3.38Å; F56-K60 PolarHBondContact O-N 3.3Å; L57-K60 WeakPolarHBondContact O-CB 3.22Å; L57-K60 PolarHBondContact O-N 3.25Å; L57-K60 VanDerWaalsContact O-N 3.16Å; L58-K60 VanDerWaalsContact C-N 3.29Å; L58-K60 PolarHBondContact O-N 3.5Å; K60-Y62 VanDerWaalsContact C-N 3.32Å; K60-Y62 PolarHBondContact O-N 3.43Å; K60-Q63 WeakPolarHBondContact O-CB 3.34Å; K60-Q63 PolarHBondContact O-N 2.75Å; K60-Q63 VanDerWaalsContact O-N 3.1Å; K60-S77 PolarHBondContact NZ-OG 3.31Å; K60-L78 HydrophobicContact CB-CD2 3.53Å; K60-L78 HydrophobicContact CB-CG 4.1Å; K60-L78 HydrophobicContact CG-CD2 4.24Å
61I96.7Very high92.1Very high1 Ų170.9 Ų70.91%0.00533%0.334CS..Hα-helixtrans-59.2-44.5174.8-69166.8000110.6L57 L58 Q63 L64 I99 E102 Y103 T106L57-I61 WeakPolarHBondContact O-CG1 3.46Å; L57-I61 PolarHBondContact O-N 2.97Å; L58-I61 HydrophobicContact CD2-CD1 4.47Å; L58-I61 PolarHBondContact O-N 3.44Å; L58-I61 VanDerWaalsContact O-N 3.17Å; I61-Q63 PolarHBondContact O-N 3.03Å; I61-L64 HydrophobicContact CG2-CD1 4.46Å; I61-L64 WeakPolarHBondContact O-CB 3.27Å; I61-L64 WeakPolarHBondContact O-CG 3.4Å; I61-L64 PolarHBondContact O-N 2.78Å; I61-I99 HydrophobicContact CD1-CG2 3.67Å; I61-E102 HydrophobicContact CG2-CG 4.32Å; I61-Y103 HydrophobicContact CG1-CD2 4.2Å; I61-T106 HydrophobicContact CG2-CG2 4.34Å
62Y95.5Very high91.8Very high102 Ų10266.7 Ų66.740%0.431%0.314SS..Hα-helixtrans-64.4-24.4177.6-66.5-49.8000113.8L58 K60 L64 R65 E102L58-Y62 HydrophobicContact CB-CE2 4.08Å; L58-Y62 WeakPolarHBondContact O-CD2 3.39Å; L58-Y62 PolarHBondContact O-N 3.07Å; K60-Y62 VanDerWaalsContact C-N 3.32Å; K60-Y62 PolarHBondContact O-N 3.43Å; Y62-L64 PolarHBondContact O-N 3.02Å; Y62-R65 VanDerWaalsContact CD1-CZ 3.45Å; Y62-R65 WeakPolarHBondContact O-CB 3.33Å; Y62-R65 PolarHBondContact O-N 3.5Å; Y62-E102 HydrophobicContact CE1-CG 3.94Å; Y62-E102 VanDerWaalsContact CE1-OE1 3.22Å; Y62-E102 WeakPolarHBondContact CE1-OE1 3.38Å
63Q94.5Very high91.7Very high55 Ų5568.8 Ų68.826%0.25733%0.331SS..Hα-helixtrans-68.1-24.1174.4-68.8165.724.100112.6R59 K60 I61 R65 K66 T74R59-Q63 WeakPolarHBondContact O-CG 3.39Å; R59-Q63 PolarHBondContact O-N 3.33Å; K60-Q63 WeakPolarHBondContact O-CB 3.34Å; K60-Q63 PolarHBondContact O-N 2.75Å; K60-Q63 VanDerWaalsContact O-N 3.1Å; I61-Q63 PolarHBondContact O-N 3.03Å; Q63-R65 PolarHBondContact O-N 3.25Å; Q63-R65 VanDerWaalsContact O-N 3.15Å; Q63-K66 WeakPolarHBondContact O-CB 3.21Å; Q63-K66 WeakPolarHBondContact O-CG 3.44Å; Q63-K66 PolarHBondContact O-N 3.01Å; Q63-K66 VanDerWaalsContact O-N 3.13Å; Q63-T74 HydrophobicContact CB-CG2 4.25Å
64L94.6Very high91.5Very high5 Ų569.7 Ų69.73%0.02634%0.336CS..THydrogen-bonded Turntrans-61.2-21.1174.4-61.5163.7000112.3I61 Y62 K66 T74 Q75 L78 Y103 T106 M107I61-L64 HydrophobicContact CG2-CD1 4.46Å; I61-L64 WeakPolarHBondContact O-CB 3.27Å; I61-L64 WeakPolarHBondContact O-CG 3.4Å; I61-L64 PolarHBondContact O-N 2.78Å; Y62-L64 PolarHBondContact O-N 3.02Å; L64-K66 VanDerWaalsContact C-N 3.31Å; L64-K66 PolarHBondContact O-N 2.99Å; L64-T74 HydrophobicContact CD2-CG2 3.64Å; L64-T74 HydrophobicContact CG-CG2 3.98Å; L64-Q75 HydrophobicContact CD2-CG 4.23Å; L64-L78 HydrophobicContact CD1-CD1 4.44Å; L64-Y103 HydrophobicContact CD1-CD2 4.06Å; L64-Y103 HydrophobicContact CD1-CE2 3.87Å; L64-T106 HydrophobicContact CB-CG2 4.05Å; L64-M107 HydrophobicContact CB-SD 4.21Å; L64-M107 HydrophobicContact CD1-CG 4.29Å; L64-M107 HydrophobicContact CD1-SD 3.85Å; L64-M107 HydrophobicContact CD2-SD 4.26Å; L64-M107 HydrophobicContact CG-SD 4.34Å
65R92.7Very high91.3Very high112 Ų11266.3 Ų66.342%0.42332%0.324SS..THydrogen-bonded Turntrans-78-12.8179.4-60.1177.1178.8-179.9-3.1113.7Y62 Q63 P67 E102 T106Y62-R65 VanDerWaalsContact CD1-CZ 3.45Å; Y62-R65 WeakPolarHBondContact O-CB 3.33Å; Y62-R65 PolarHBondContact O-N 3.5Å; Q63-R65 PolarHBondContact O-N 3.25Å; Q63-R65 VanDerWaalsContact O-N 3.15Å; R65-P67 WeakPolarHBondContact O-CD 3.28Å; R65-E102 IonicContact CZ-OE1 2.78Å; R65-E102 IonicContact NH2-OE1 3.74Å; R65-E102 PolarHBondContact NH2-OE1 2.94Å; R65-T106 HydrophobicContact CG-CG2 3.61Å; R65-T106 PolarHBondContact NE-OG1 3.02Å; R65-T106 PolarHBondContact NH2-OG1 3.32Å
66K88.5Confident91.2Very high133 Ų13365.1 Ų65.158%0.57832%0.321SS*.SBendtrans-63122.4-174.8-74.5-174.2176.7-174.20110Q63 L64 A69Q63-K66 WeakPolarHBondContact O-CB 3.21Å; Q63-K66 WeakPolarHBondContact O-CG 3.44Å; Q63-K66 PolarHBondContact O-N 3.01Å; Q63-K66 VanDerWaalsContact O-N 3.13Å; L64-K66 VanDerWaalsContact C-N 3.31Å; L64-K66 PolarHBondContact O-N 2.99Å; K66-A69 HydrophobicContact CB-CB 3.81Å; K66-A69 WeakPolarHBondContact O-CB 3.45Å; K66-A69 PolarHBondContact O-N 3.04Å
67P78.4Confident91Very high121 Ų12165.2 Ų65.279%0.78633%0.325SS*.THydrogen-bonded Turntrans-56.5143.5175.9-23.933.6000111.2R65 A69R65-P67 WeakPolarHBondContact O-CD 3.28Å; P67-A69 PolarHBondContact O-N 3.26Å
68L73.6Confident90.9Very high185 Ų18565.2 Ų65.297%0.96933%0.325SS*.THydrogen-bonded Turntrans63.2-5.8-180-51.5171.3000115.6N70L68-N70 PolarHBondContact O-N 3.21Å
69A74.8Confident90.7Very high43 Ų4367 Ų6736%0.35533%0.334SS..  trans-67.9132.5171.600000108.8K66 P67 Y71K66-A69 HydrophobicContact CB-CB 3.81Å; K66-A69 WeakPolarHBondContact O-CB 3.45Å; K66-A69 PolarHBondContact O-N 3.04Å; P67-A69 PolarHBondContact O-N 3.26Å; A69-Y71 PolarHBondContact O-N 3.37Å
70N85.2Confident90.6Very high78 Ų7866.5 Ų66.542%0.41734%0.337SS..  trans-67.9104166.2-174.6-9.8000107.7L68 E72 V73L68-N70 PolarHBondContact O-N 3.21Å; N70-E72 PolarHBondContact ND2-OE2 3.43Å; N70-E72 PolarHBondContact O-N 3.28Å; N70-E72 VanDerWaalsContact O-N 3.16Å; N70-E72 WeakPolarHBondContact OD1-CB 3.46Å; N70-E72 WeakPolarHBondContact OD1-CG 3.43Å; N70-E72 PolarHBondContact OD1-N 3.39Å; N70-E72 PolarHBondContact OD1-OE2 3.32Å; N70-V73 HydrophobicContact CB-CG2 3.99Å; N70-V73 PolarHBondContact O-N 3.05Å; N70-V73 VanDerWaalsContact O-N 3.13Å
71Y90.5Very high90.6Very high17 Ų1766.6 Ų66.67%0.06734%0.337CS..Hα-helixtrans-60-25.9-179.374.3-99.2000111.4A69 V73 T74 Q75 M107 L111 H208A69-Y71 PolarHBondContact O-N 3.37Å; Y71-V73 VanDerWaalsContact C-N 3.34Å; Y71-V73 PolarHBondContact O-N 2.81Å; Y71-T74 CarbonylContact O-C 3.38Å; Y71-T74 WeakPolarHBondContact O-CA 3.42Å; Y71-T74 WeakPolarHBondContact O-CB 3.21Å; Y71-T74 PolarHBondContact O-N 3.22Å; Y71-Q75 HydrophobicContact CD2-CG 4.36Å; Y71-Q75 VanDerWaalsContact CE2-OE1 3.3Å; Y71-Q75 PolarHBondContact O-N 2.77Å; Y71-M107 HydrophobicContact CD2-CE 3.62Å; Y71-M107 HydrophobicContact CE2-CE 3.81Å; Y71-M107 HydrophobicContact CG-CE 4.16Å; Y71-L111 HydrophobicContact CE1-CD2 4.36Å; Y71-H208 AromaticContact CE1-CE1 3.89Å; Y71-H208 AromaticContact CE1-ND1 3.81Å; Y71-H208 AromaticContact CZ-ND1 3.67Å; Y71-H208 PolarHBondContact OH-CE1 3.36Å; Y71-H208 PolarHBondContact OH-ND1 3.16Å
72E91.1Very high90.6Very high46 Ų4670.7 Ų70.722%0.21535%0.352CS..Hα-helixtrans-64.1-38178.5-53.8159.3-169.100111.5N70 T74 Q75 N76 R211N70-E72 PolarHBondContact ND2-OE2 3.43Å; N70-E72 PolarHBondContact O-N 3.28Å; N70-E72 VanDerWaalsContact O-N 3.16Å; N70-E72 WeakPolarHBondContact OD1-CB 3.46Å; N70-E72 WeakPolarHBondContact OD1-CG 3.43Å; N70-E72 PolarHBondContact OD1-N 3.39Å; N70-E72 PolarHBondContact OD1-OE2 3.32Å; E72-T74 PolarHBondContact O-N 2.96Å; E72-Q75 PolarHBondContact O-N 2.96Å; E72-N76 WeakPolarHBondContact O-CB 3.44Å; E72-N76 PolarHBondContact O-N 2.93Å; E72-N76 PolarHBondContact O-ND2 2.96Å; E72-R211 IonicContact OE1-CZ 3.92Å; E72-R211 VanDerWaalsContact OE1-CZ 3.26Å; E72-R211 IonicContact OE1-NH1 3.64Å; E72-R211 PolarHBondContact OE1-NH1 3.5Å; E72-R211 IonicContact OE1-NH2 2.75Å; E72-R211 PolarHBondContact OE1-NH2 3.04Å; E72-R211 IonicContact OE2-NH1 2.78Å; E72-R211 PolarHBondContact OE2-NH1 3.36Å; E72-R211 VanDerWaalsContact OE2-NH1 3.11Å
73V92.5Very high90.7Very high96 Ų9667 Ų6758%0.58234%0.338SS*.Hα-helixtrans-61.9-36.6174.7176.10000110.2N70 Y71 S77N70-V73 HydrophobicContact CB-CG2 3.99Å; N70-V73 PolarHBondContact O-N 3.05Å; N70-V73 VanDerWaalsContact O-N 3.13Å; Y71-V73 VanDerWaalsContact C-N 3.34Å; Y71-V73 PolarHBondContact O-N 2.81Å; V73-S77 WeakPolarHBondContact O-CB 3.35Å; V73-S77 PolarHBondContact O-N 2.85Å
74T93.1Very high90.8Very high18 Ų1864.5 Ų64.511%0.1133%0.326CS..Hα-helixtrans-74.6-39.2178.3-54.20000111.5Q63 L64 Y71 E72 S77 L78Q63-T74 HydrophobicContact CB-CG2 4.25Å; L64-T74 HydrophobicContact CD2-CG2 3.64Å; L64-T74 HydrophobicContact CG-CG2 3.98Å; Y71-T74 CarbonylContact O-C 3.38Å; Y71-T74 WeakPolarHBondContact O-CA 3.42Å; Y71-T74 WeakPolarHBondContact O-CB 3.21Å; Y71-T74 PolarHBondContact O-N 3.22Å; E72-T74 PolarHBondContact O-N 2.96Å; T74-S77 CarbonylContact O-C 3.58Å; T74-S77 WeakPolarHBondContact O-CB 3.28Å; T74-S77 PolarHBondContact O-N 3.14Å; T74-L78 PolarHBondContact O-N 2.93Å
75Q94.9Very high91Very high8 Ų864.5 Ų64.54%0.03733%0.326CS..Hα-helixtrans-61.8-47.1172.1-78.8178.6-28.600112L64 Y71 E72 S77 L78 L79 Y103 E212 F215L64-Q75 HydrophobicContact CD2-CG 4.23Å; Y71-Q75 HydrophobicContact CD2-CG 4.36Å; Y71-Q75 VanDerWaalsContact CE2-OE1 3.3Å; Y71-Q75 PolarHBondContact O-N 2.77Å; E72-Q75 PolarHBondContact O-N 2.96Å; Q75-S77 PolarHBondContact O-N 3.05Å; Q75-L78 WeakPolarHBondContact O-CA 3.46Å; Q75-L78 WeakPolarHBondContact O-CB 3.31Å; Q75-L78 PolarHBondContact O-N 3.29Å; Q75-L79 PolarHBondContact O-N 3.03Å; Q75-Y103 PolarHBondContact NE2-OH 3.49Å; Q75-E212 PolarHBondContact NE2-OE2 3.14Å; Q75-F215 HydrophobicContact CB-CD2 3.73Å; Q75-F215 HydrophobicContact CB-CE2 3.73Å; Q75-F215 HydrophobicContact CB-CG 4.4Å; Q75-F215 HydrophobicContact CB-CZ 4.42Å; Q75-F215 HydrophobicContact CG-CD1 4.43Å; Q75-F215 HydrophobicContact CG-CD2 3.98Å; Q75-F215 HydrophobicContact CG-CE1 4.42Å; Q75-F215 HydrophobicContact CG-CE2 3.94Å; Q75-F215 HydrophobicContact CG-CG 4.23Å; Q75-F215 HydrophobicContact CG-CZ 4.17Å; Q75-F215 WeakPolarHBondContact O-CE2 3.34Å
76N94Very high91.2Very high100 Ų10062.8 Ų62.854%0.53532%0.323SS..Hα-helixtrans-60.4-35.1174-74.2-33.2000111.9E72E72-N76 WeakPolarHBondContact O-CB 3.44Å; E72-N76 PolarHBondContact O-N 2.93Å; E72-N76 PolarHBondContact O-ND2 2.96Å
77S93.1Very high91.6Very high27 Ų2756.4 Ų56.419%0.18930%0.295CS..Hα-helixtrans-66.6-36.8170.6177.90000112.6K60 V73 T74 Q75 Y81K60-S77 PolarHBondContact NZ-OG 3.31Å; V73-S77 WeakPolarHBondContact O-CB 3.35Å; V73-S77 PolarHBondContact O-N 2.85Å; T74-S77 CarbonylContact O-C 3.58Å; T74-S77 WeakPolarHBondContact O-CB 3.28Å; T74-S77 PolarHBondContact O-N 3.14Å; Q75-S77 PolarHBondContact O-N 3.05Å; S77-Y81 WeakPolarHBondContact O-CD2 3.46Å; S77-Y81 WeakPolarHBondContact O-CE2 3.34Å
78L95.4Very high92.6Very high0 Ų050.7 Ų50.70%026%0.258CS..Hα-helixtrans-66.8-39.9177.9-84.2165000111.6L57 K60 L64 T74 Q75 K80 Y81 R82 F215 F219L57-L78 HydrophobicContact CD2-CD2 3.91Å; K60-L78 HydrophobicContact CB-CD2 3.53Å; K60-L78 HydrophobicContact CB-CG 4.1Å; K60-L78 HydrophobicContact CG-CD2 4.24Å; L64-L78 HydrophobicContact CD1-CD1 4.44Å; T74-L78 PolarHBondContact O-N 2.93Å; Q75-L78 WeakPolarHBondContact O-CA 3.46Å; Q75-L78 WeakPolarHBondContact O-CB 3.31Å; Q75-L78 PolarHBondContact O-N 3.29Å; L78-K80 PolarHBondContact O-N 3.32Å; L78-Y81 CarbonylContact O-C 3.58Å; L78-Y81 WeakPolarHBondContact O-CA 3.31Å; L78-Y81 PolarHBondContact O-N 2.9Å; L78-R82 PolarHBondContact O-N 3.45Å; L78-F215 HydrophobicContact CB-CE2 4.14Å; L78-F215 HydrophobicContact CB-CZ 4.15Å; L78-F215 HydrophobicContact CD1-CZ 4.14Å; L78-F219 HydrophobicContact CB-CD2 4.33Å; L78-F219 HydrophobicContact CB-CE2 4.08Å; L78-F219 HydrophobicContact CD2-CE2 4.36Å; L78-F219 HydrophobicContact CD2-CZ 4.14Å; L78-F219 VanDerWaalsContact O-CE2 3.31Å; L78-F219 WeakPolarHBondContact O-CE2 3.13Å
79L95.3Very high93.7Very high48 Ų4845 Ų4525%0.25123%0.228SC..Hα-helixtrans-56.9-33.7178.6-71.5173.4000113.1Q75 Y81 R82 F215 D218 F219Q75-L79 PolarHBondContact O-N 3.03Å; L79-Y81 PolarHBondContact O-N 3.28Å; L79-Y81 VanDerWaalsContact O-N 3.12Å; L79-R82 VanDerWaalsContact O-CB 3.26Å; L79-R82 WeakPolarHBondContact O-CB 3.38Å; L79-R82 PolarHBondContact O-N 2.86Å; L79-F215 HydrophobicContact CD1-CD2 4.25Å; L79-F215 HydrophobicContact CD2-CD2 3.93Å; L79-F215 HydrophobicContact CD2-CE2 4Å; L79-F215 HydrophobicContact CG-CD2 3.94Å; L79-F215 HydrophobicContact CG-CE2 3.92Å; L79-D218 HydrophobicContact CD2-CB 4.05Å; L79-F219 HydrophobicContact CD2-CB 4.01Å; L79-F219 HydrophobicContact CD2-CD2 4.47Å
80K93.9Very high94.7Very high164 Ų16445.6 Ų45.671%0.71323%0.23SC*.THydrogen-bonded Turntrans-60.5-21.4173.6-63.9-178.3179.1-175.70113.6L78L78-K80 PolarHBondContact O-N 3.32Å
81Y95Very high95.3Very high39 Ų3943 Ų4315%0.15322%0.216CC..THydrogen-bonded Turntrans-112.622178.9-54.6-78.5000111.8F56 S77 L78 L79 F83 Y84F56-Y81 AromaticContact CE1-CD1 3.87Å; F56-Y81 HydrophobicContact CE1-CD1 3.87Å; F56-Y81 AromaticContact CE1-CD2 3.57Å; F56-Y81 HydrophobicContact CE1-CD2 3.57Å; F56-Y81 HydrophobicContact CE1-CE1 4.17Å; F56-Y81 AromaticContact CE1-CE2 3.91Å; F56-Y81 HydrophobicContact CE1-CE2 3.91Å; F56-Y81 AromaticContact CE1-CG 3.55Å; F56-Y81 HydrophobicContact CE1-CG 3.55Å; F56-Y81 HydrophobicContact CZ-CD1 4.09Å; F56-Y81 AromaticContact CZ-CD2 3.75Å; F56-Y81 HydrophobicContact CZ-CD2 3.75Å; F56-Y81 AromaticContact CZ-CE1 3.89Å; F56-Y81 HydrophobicContact CZ-CE1 3.89Å; F56-Y81 AromaticContact CZ-CE2 3.56Å; F56-Y81 HydrophobicContact CZ-CE2 3.56Å; F56-Y81 HydrophobicContact CZ-CG 4.01Å; F56-Y81 AromaticContact CZ-CZ 3.62Å; S77-Y81 WeakPolarHBondContact O-CD2 3.46Å; S77-Y81 WeakPolarHBondContact O-CE2 3.34Å; L78-Y81 CarbonylContact O-C 3.58Å; L78-Y81 WeakPolarHBondContact O-CA 3.31Å; L78-Y81 PolarHBondContact O-N 2.9Å; L79-Y81 PolarHBondContact O-N 3.28Å; L79-Y81 VanDerWaalsContact O-N 3.12Å; Y81-F83 PolarHBondContact O-N 3.48Å; Y81-Y84 HydrophobicContact CD1-CD2 4.11Å; Y81-Y84 HydrophobicContact CD1-CE1 4.31Å; Y81-Y84 AromaticContact CD1-CE2 3.48Å; Y81-Y84 HydrophobicContact CD1-CE2 3.48Å; Y81-Y84 VanDerWaalsContact CD1-CE2 3.48Å; Y81-Y84 AromaticContact CD1-CZ 3.59Å; Y81-Y84 HydrophobicContact CE1-CE2 4.24Å; Y81-Y84 HydrophobicContact CG-CD2 4.36Å; Y81-Y84 HydrophobicContact CG-CE2 4.15Å; Y81-Y84 VanDerWaalsContact O-CB 3.28Å; Y81-Y84 WeakPolarHBondContact O-CB 3.33Å; Y81-Y84 PolarHBondContact O-N 3.38Å
82R96Very high95.6Very high88 Ų8844.2 Ų44.233%0.33222%0.224SC..Hα-helixtrans-49.3-42.3176.7169.3179.1158.5133.92.8112.3L78 L79 Y84 F85 E86 D218 F219L78-R82 PolarHBondContact O-N 3.45Å; L79-R82 VanDerWaalsContact O-CB 3.26Å; L79-R82 WeakPolarHBondContact O-CB 3.38Å; L79-R82 PolarHBondContact O-N 2.86Å; R82-Y84 PolarHBondContact O-N 3.45Å; R82-Y84 VanDerWaalsContact O-N 3.14Å; R82-F85 PolarHBondContact O-N 3Å; R82-E86 PolarHBondContact O-N 2.88Å; R82-D218 VanDerWaalsContact CD-OD1 3.28Å; R82-D218 WeakPolarHBondContact CD-OD1 3.37Å; R82-D218 IonicContact CZ-OD1 2.84Å; R82-D218 IonicContact NE-OD1 3.32Å; R82-D218 PolarHBondContact NH1-O 3.27Å; R82-D218 IonicContact NH1-OD1 3.54Å; R82-D218 PolarHBondContact NH1-OD1 3.36Å; R82-F219 HydrophobicContact CB-CD2 4.4Å
83F96.7Very high95.8Very high25 Ų2551.8 Ų51.811%0.1125%0.25CS..Hα-helixtrans-61.2-24.6-179.9-173.6-105.9000113.2L11 L14 H15 Q18 Y81 F85 E86 F87L11-F83 HydrophobicContact CD1-CB 3.91Å; L11-F83 HydrophobicContact CD1-CD1 3.73Å; L11-F83 HydrophobicContact CD1-CG 4.21Å; L14-F83 HydrophobicContact CB-CE1 4.22Å; L14-F83 HydrophobicContact CD2-CD1 4.01Å; L14-F83 HydrophobicContact CD2-CE1 4.12Å; L14-F83 HydrophobicContact CG-CD1 4.34Å; L14-F83 HydrophobicContact CG-CE1 3.97Å; H15-F83 HydrophobicContact CB-CE1 4.25Å; H15-F83 HydrophobicContact CB-CZ 4.42Å; H15-F83 AromaticContact CD2-CD1 3.83Å; H15-F83 AromaticContact CD2-CE1 3.87Å; H15-F83 AromaticContact CE1-CD1 3.52Å; H15-F83 AromaticContact CE1-CD2 3.22Å; H15-F83 WeakPolarHBondContact CE1-CD2 3.48Å; H15-F83 AromaticContact CE1-CE1 3.61Å; H15-F83 AromaticContact CE1-CE2 3.31Å; H15-F83 WeakPolarHBondContact CE1-CE2 3.48Å; H15-F83 AromaticContact CE1-CG 3.33Å; H15-F83 WeakPolarHBondContact CE1-CG 3.4Å; H15-F83 AromaticContact CE1-CZ 3.5Å; H15-F83 AromaticContact CG-CE1 3.59Å; H15-F83 AromaticContact CG-CZ 3.78Å; H15-F83 AromaticContact ND1-CD1 3.84Å; H15-F83 AromaticContact ND1-CD2 3.8Å; H15-F83 AromaticContact ND1-CE1 3.42Å; H15-F83 WeakPolarHBondContact ND1-CE1 3.44Å; H15-F83 AromaticContact ND1-CE2 3.37Å; H15-F83 WeakPolarHBondContact ND1-CE2 3.46Å; H15-F83 AromaticContact ND1-CZ 3.16Å; H15-F83 WeakPolarHBondContact ND1-CZ 3.42Å; H15-F83 AromaticContact NE2-CD1 3.51Å; H15-F83 AromaticContact NE2-CD2 3.91Å; H15-F83 AromaticContact NE2-CE1 3.89Å; H15-F83 AromaticContact NE2-CG 3.52Å; Q18-F83 HydrophobicContact CB-CZ 4.06Å; Q18-F83 HydrophobicContact CG-CZ 4.25Å; Y81-F83 PolarHBondContact O-N 3.48Å; F83-F85 VanDerWaalsContact C-N 3.33Å; F83-F85 PolarHBondContact O-N 3.05Å; F83-E86 HydrophobicContact CD2-CB 4.22Å; F83-E86 HydrophobicContact CD2-CG 4.45Å; F83-E86 PolarHBondContact O-N 2.97Å; F83-F87 HydrophobicContact CE1-CB 4.42Å; F83-F87 WeakPolarHBondContact O-CB 3.37Å; F83-F87 PolarHBondContact O-N 3.13Å
84Y97.8Very high96.1Very high1 Ų154.8 Ų54.80%0.00426%0.257CS..Hα-helixtrans-65.5-41.1175.7-66.95.6000110.5A5 F10 L11 L14 T53 F56 Y81 R82 I88A5-Y84 PolarHBondContact O-OH 3.21Å; F10-Y84 HydrophobicContact CD1-CE1 4.33Å; F10-Y84 AromaticContact CD1-CZ 3.89Å; F10-Y84 WeakPolarHBondContact CD1-OH 3.35Å; F10-Y84 HydrophobicContact CE1-CE1 4.43Å; F10-Y84 HydrophobicContact CE1-CE2 4.5Å; L11-Y84 HydrophobicContact CB-CE1 4.18Å; L11-Y84 HydrophobicContact CD1-CD1 4.06Å; L11-Y84 HydrophobicContact CD1-CE1 3.6Å; L11-Y84 HydrophobicContact CG-CE1 4.48Å; L14-Y84 HydrophobicContact CD2-CD1 3.49Å; L14-Y84 VanDerWaalsContact CD2-CD1 3.49Å; L14-Y84 HydrophobicContact CD2-CE1 3.9Å; L14-Y84 HydrophobicContact CD2-CG 4.3Å; T53-Y84 HydrophobicContact CG2-CD1 4.29Å; T53-Y84 HydrophobicContact CG2-CD2 3.97Å; T53-Y84 HydrophobicContact CG2-CE2 4.49Å; T53-Y84 HydrophobicContact CG2-CG 3.87Å; F56-Y84 AromaticContact CD1-CD2 3.85Å; F56-Y84 HydrophobicContact CD1-CD2 3.85Å; F56-Y84 AromaticContact CD1-CE2 3.91Å; F56-Y84 HydrophobicContact CD1-CE2 3.91Å; F56-Y84 HydrophobicContact CE1-CD2 4.24Å; F56-Y84 HydrophobicContact CE1-CE2 4.09Å; F56-Y84 HydrophobicContact CG-CE2 4.47Å; Y81-Y84 HydrophobicContact CD1-CD2 4.11Å; Y81-Y84 HydrophobicContact CD1-CE1 4.31Å; Y81-Y84 AromaticContact CD1-CE2 3.48Å; Y81-Y84 HydrophobicContact CD1-CE2 3.48Å; Y81-Y84 VanDerWaalsContact CD1-CE2 3.48Å; Y81-Y84 AromaticContact CD1-CZ 3.59Å; Y81-Y84 HydrophobicContact CE1-CE2 4.24Å; Y81-Y84 HydrophobicContact CG-CD2 4.36Å; Y81-Y84 HydrophobicContact CG-CE2 4.15Å; Y81-Y84 VanDerWaalsContact O-CB 3.28Å; Y81-Y84 WeakPolarHBondContact O-CB 3.33Å; Y81-Y84 PolarHBondContact O-N 3.38Å; R82-Y84 PolarHBondContact O-N 3.45Å; R82-Y84 VanDerWaalsContact O-N 3.14Å; Y84-I88 WeakPolarHBondContact O-CG1 3.24Å; Y84-I88 PolarHBondContact O-N 3.29Å
85F98Very high96.3Very high6 Ų654.8 Ų54.83%0.02626%0.257CS..Hα-helixtrans-67.7-40.8174.8-174.7-99.7000111.5L57 R82 F83 F87 I88 L89 A96 I99 F219 F220L57-F85 HydrophobicContact CD1-CB 4.22Å; R82-F85 PolarHBondContact O-N 3Å; F83-F85 VanDerWaalsContact C-N 3.33Å; F83-F85 PolarHBondContact O-N 3.05Å; F85-F87 PolarHBondContact O-N 3.34Å; F85-I88 PolarHBondContact O-N 3.23Å; F85-L89 HydrophobicContact CE1-CB 4.42Å; F85-L89 HydrophobicContact CE1-CD2 4.25Å; F85-L89 VanDerWaalsContact O-CB 3.31Å; F85-L89 WeakPolarHBondContact O-CB 3.31Å; F85-L89 PolarHBondContact O-N 3.44Å; F85-A96 HydrophobicContact CE2-CB 4.11Å; F85-A96 HydrophobicContact CZ-CB 4.2Å; F85-I99 HydrophobicContact CD2-CG2 4.17Å; F85-I99 HydrophobicContact CE2-CB 4.42Å; F85-I99 HydrophobicContact CE2-CG2 4.34Å; F85-F219 HydrophobicContact CB-CE1 4.17Å; F85-F219 HydrophobicContact CB-CZ 4.04Å; F85-F219 WeakPolarHBondContact CD1-O 3.22Å; F85-F219 HydrophobicContact CD2-CE1 4.47Å; F85-F219 HydrophobicContact CG-CE1 4.32Å; F85-F220 HydrophobicContact CD1-CD1 4.31Å; F85-F220 HydrophobicContact CD2-CD1 4.24Å; F85-F220 HydrophobicContact CD2-CE1 4.26Å; F85-F220 HydrophobicContact CE1-CB 4.26Å; F85-F220 AromaticContact CE1-CD1 3.81Å; F85-F220 HydrophobicContact CE1-CD1 3.81Å; F85-F220 HydrophobicContact CE1-CG 4.49Å; F85-F220 AromaticContact CE2-CD1 3.72Å; F85-F220 HydrophobicContact CE2-CD1 3.72Å; F85-F220 AromaticContact CE2-CE1 3.89Å; F85-F220 HydrophobicContact CE2-CE1 3.89Å; F85-F220 AromaticContact CZ-CD1 3.51Å; F85-F220 HydrophobicContact CZ-CD1 3.51Å; F85-F220 HydrophobicContact CZ-CE1 4.16Å
86E97.5Very high96.5Very high75 Ų7554.5 Ų54.535%0.3526%0.257SS..Hα-helixtrans-59.7-43.9175.8-172.2178.3157.100112.5R82 F83 L89 S90 L221R82-E86 PolarHBondContact O-N 2.88Å; F83-E86 HydrophobicContact CD2-CB 4.22Å; F83-E86 HydrophobicContact CD2-CG 4.45Å; F83-E86 PolarHBondContact O-N 2.97Å; E86-L89 PolarHBondContact O-N 3.39Å; E86-S90 WeakPolarHBondContact O-CB 3.16Å; E86-S90 PolarHBondContact O-N 2.85Å; E86-S90 PolarHBondContact O-OG 3.16Å; E86-L221 HydrophobicContact CB-CD1 3.95Å; E86-L221 HydrophobicContact CG-CD1 3.92Å
87F97.8Very high96.7Very high0 Ų055.1 Ų55.10%026%0.255CS..Hα-helixtrans-61-48.6175.1178-92.5000111.2L14 L17 Q18 I21 K46 A49 V50 F83 F85 S90 N91L14-F87 HydrophobicContact CD1-CD1 3.72Å; L14-F87 HydrophobicContact CD1-CD2 3.75Å; L14-F87 HydrophobicContact CD1-CE1 3.76Å; L14-F87 HydrophobicContact CD1-CE2 3.78Å; L14-F87 HydrophobicContact CD1-CG 3.72Å; L14-F87 HydrophobicContact CD1-CZ 3.79Å; L14-F87 HydrophobicContact CD2-CB 3.95Å; L14-F87 HydrophobicContact CD2-CD1 4.37Å; L14-F87 HydrophobicContact CD2-CD2 4.5Å; L14-F87 HydrophobicContact CD2-CG 4.01Å; L14-F87 HydrophobicContact CG-CB 4.2Å; L14-F87 HydrophobicContact CG-CD1 4.3Å; L14-F87 HydrophobicContact CG-CD2 3.85Å; L14-F87 HydrophobicContact CG-CE2 4.32Å; L14-F87 HydrophobicContact CG-CG 3.84Å; L17-F87 HydrophobicContact CD2-CE2 4.27Å; L17-F87 HydrophobicContact CD2-CZ 3.96Å; L17-F87 HydrophobicContact CG-CE2 4.32Å; L17-F87 HydrophobicContact CG-CZ 4.43Å; Q18-F87 HydrophobicContact CB-CD2 3.96Å; Q18-F87 HydrophobicContact CB-CE2 4.2Å; Q18-F87 HydrophobicContact CG-CD2 4.39Å; Q18-F87 VanDerWaalsContact OE1-CD2 3.23Å; I21-F87 HydrophobicContact CD1-CE2 4.22Å; I21-F87 HydrophobicContact CD1-CZ 4.32Å; K46-F87 HydrophobicContact CG-CZ 4.49Å; A49-F87 HydrophobicContact CB-CE1 3.48Å; A49-F87 VanDerWaalsContact CB-CE1 3.48Å; A49-F87 HydrophobicContact CB-CZ 3.66Å; V50-F87 HydrophobicContact CG2-CD1 4.41Å; V50-F87 HydrophobicContact CG2-CE1 3.83Å; F83-F87 HydrophobicContact CE1-CB 4.42Å; F83-F87 WeakPolarHBondContact O-CB 3.37Å; F83-F87 PolarHBondContact O-N 3.13Å; F85-F87 PolarHBondContact O-N 3.34Å; F87-S90 PolarHBondContact O-N 2.89Å; F87-N91 WeakPolarHBondContact CE2-ND2 3.44Å; F87-N91 WeakPolarHBondContact O-CB 3.48Å; F87-N91 PolarHBondContact O-N 3.19Å; F87-N91 PolarHBondContact O-ND2 2.93Å
88I98.2Very high96.9Very high0 Ų057.3 Ų57.30%026%0.262CS..Hα-helixtrans-61.6-48.1177.8-67.2169.5000109.9T53 R54 L57 Y84 F85 S90 N91 D92 V95 A96 I99T53-I88 WeakPolarHBondContact OG1-CD1 3.43Å; T53-I88 WeakPolarHBondContact OG1-CG1 3.44Å; R54-I88 HydrophobicContact CB-CD1 4.48Å; L57-I88 HydrophobicContact CD1-CD1 3.98Å; Y84-I88 WeakPolarHBondContact O-CG1 3.24Å; Y84-I88 PolarHBondContact O-N 3.29Å; F85-I88 PolarHBondContact O-N 3.23Å; I88-S90 PolarHBondContact O-N 3.2Å; I88-N91 PolarHBondContact O-N 3.04Å; I88-D92 CarbonylContact O-C 3.07Å; I88-D92 PolarHBondContact O-N 3.37Å; I88-D92 VanDerWaalsContact O-O 3.11Å; I88-V95 HydrophobicContact CD1-CG1 4.48Å; I88-V95 HydrophobicContact CG2-CB 3.87Å; I88-V95 HydrophobicContact CG2-CG1 3.63Å; I88-A96 HydrophobicContact CG2-CB 3.96Å; I88-I99 HydrophobicContact CD1-CD1 3.48Å; I88-I99 VanDerWaalsContact CD1-CD1 3.48Å; I88-I99 HydrophobicContact CG2-CD1 4.36Å
89L97.2Very high97.1Very high65 Ų6557.3 Ų57.334%0.3426%0.262SS..Hα-helixtrans-57.2-37.2-179.5-176.764.3000112.7F85 E86 N91 A96 L221F85-L89 HydrophobicContact CE1-CB 4.42Å; F85-L89 HydrophobicContact CE1-CD2 4.25Å; F85-L89 VanDerWaalsContact O-CB 3.31Å; F85-L89 WeakPolarHBondContact O-CB 3.31Å; F85-L89 PolarHBondContact O-N 3.44Å; E86-L89 PolarHBondContact O-N 3.39Å; L89-N91 VanDerWaalsContact C-N 3.35Å; L89-A96 HydrophobicContact CB-CB 4.27Å; L89-A96 HydrophobicContact CD1-CB 3.86Å; L89-L221 HydrophobicContact CD2-CD1 3.99Å
90S96.1Very high97.2Very high56 Ų5659.1 Ų59.139%0.39227%0.265SS..Hα-helixtrans-75.4-20.2179.8-59.90000114.1E86 F87 I88E86-S90 WeakPolarHBondContact O-CB 3.16Å; E86-S90 PolarHBondContact O-N 2.85Å; E86-S90 PolarHBondContact O-OG 3.16Å; F87-S90 PolarHBondContact O-N 2.89Å; I88-S90 PolarHBondContact O-N 3.2Å
91N96.3Very high97.4Very high24 Ų2453.6 Ų53.613%0.12824%0.244CC..Hα-helixtrans-119.7-31.9-169.8-72.1-67.4000114.5Q18 K46 V50 F87 I88 L89Q18-N91 PolarHBondContact OE1-ND2 3.12Å; K46-N91 HydrophobicContact CD-CB 4.01Å; K46-N91 HydrophobicContact CG-CB 3.97Å; V50-N91 HydrophobicContact CG2-CB 4.29Å; F87-N91 WeakPolarHBondContact CE2-ND2 3.44Å; F87-N91 WeakPolarHBondContact O-CB 3.48Å; F87-N91 PolarHBondContact O-N 3.19Å; F87-N91 PolarHBondContact O-ND2 2.93Å; I88-N91 PolarHBondContact O-N 3.04Å; L89-N91 VanDerWaalsContact C-N 3.35Å
92D96.9Very high97.6Very high43 Ų4353.8 Ų53.823%0.2325%0.246CC..  trans-147.898.3-179.8-167.8-32.4000111.1V50 I88 H94 V95 A96V50-D92 HydrophobicContact CG1-CB 4.04Å; V50-D92 HydrophobicContact CG2-CB 4.37Å; I88-D92 CarbonylContact O-C 3.07Å; I88-D92 PolarHBondContact O-N 3.37Å; I88-D92 VanDerWaalsContact O-O 3.11Å; D92-H94 VanDerWaalsContact C-N 3.29Å; D92-H94 PolarHBondContact O-N 2.83Å; D92-H94 WeakPolarHBondContact OD1-CB 3.35Å; D92-H94 PolarHBondContact OD1-N 3.34Å; D92-V95 HydrophobicContact CB-CB 4.18Å; D92-V95 HydrophobicContact CB-CG2 4.25Å; D92-V95 VanDerWaalsContact CG-CG2 3.49Å; D92-V95 PolarHBondContact O-N 3.09Å; D92-V95 PolarHBondContact OD1-N 3.41Å; D92-V95 WeakPolarHBondContact OD2-CG2 3.18Å; D92-A96 PolarHBondContact O-N 3.45Å
93R96.7Very high97.7Very high204 Ų20449.6 Ų49.677%0.7723%0.23SC*.Hα-helixtrans-69.6-24.8-179.7-65.5-177.2179.3-179.30.1113.2K97R93-K97 WeakPolarHBondContact O-CB 3.33Å; R93-K97 PolarHBondContact O-N 2.95Å
94H98Very high97.8Very high159 Ų15948.8 Ų48.874%0.73623%0.227SC*.Hα-helixtrans-72.2-45178.9-68.8-74.5000110.2D92 K97 E98D92-H94 VanDerWaalsContact C-N 3.29Å; D92-H94 PolarHBondContact O-N 2.83Å; D92-H94 WeakPolarHBondContact OD1-CB 3.35Å; D92-H94 PolarHBondContact OD1-N 3.34Å; H94-K97 PolarHBondContact O-N 3.01Å; H94-E98 PolarHBondContact O-N 3.31Å
95V98.1Very high97.8Very high18 Ų1852.7 Ų52.711%0.10925%0.248CC..Hα-helixtrans-66-40.2175176.50000111.4V50 R54 I88 D92 K97 E98 I99V50-V95 HydrophobicContact CG1-CB 4.12Å; V50-V95 HydrophobicContact CG1-CG1 4.02Å; V50-V95 HydrophobicContact CG1-CG2 3.95Å; R54-V95 HydrophobicContact CB-CG1 3.72Å; R54-V95 HydrophobicContact CG-CG1 3.59Å; I88-V95 HydrophobicContact CD1-CG1 4.48Å; I88-V95 HydrophobicContact CG2-CB 3.87Å; I88-V95 HydrophobicContact CG2-CG1 3.63Å; D92-V95 HydrophobicContact CB-CB 4.18Å; D92-V95 HydrophobicContact CB-CG2 4.25Å; D92-V95 VanDerWaalsContact CG-CG2 3.49Å; D92-V95 PolarHBondContact O-N 3.09Å; D92-V95 PolarHBondContact OD1-N 3.41Å; D92-V95 WeakPolarHBondContact OD2-CG2 3.18Å; V95-K97 VanDerWaalsContact C-N 3.32Å; V95-K97 PolarHBondContact O-N 2.95Å; V95-E98 WeakPolarHBondContact O-CB 3.38Å; V95-E98 PolarHBondContact O-N 3.06Å; V95-I99 HydrophobicContact CG1-CD1 4.05Å; V95-I99 WeakPolarHBondContact O-CG1 3.29Å; V95-I99 PolarHBondContact O-N 2.96Å
96A98.2Very high97.8Very high3 Ų352.5 Ų52.53%0.02525%0.247CC..Hα-helixtrans-59.3-44.4174.600000111.9F85 I88 L89 D92 I99 R100F85-A96 HydrophobicContact CE2-CB 4.11Å; F85-A96 HydrophobicContact CZ-CB 4.2Å; I88-A96 HydrophobicContact CG2-CB 3.96Å; L89-A96 HydrophobicContact CB-CB 4.27Å; L89-A96 HydrophobicContact CD1-CB 3.86Å; D92-A96 PolarHBondContact O-N 3.45Å; A96-I99 PolarHBondContact O-N 3.42Å; A96-R100 WeakPolarHBondContact O-CB 3.48Å; A96-R100 PolarHBondContact O-N 2.85Å
97K98.1Very high97.8Very high112 Ų11248.9 Ų48.949%0.48723%0.231SC..Hα-helixtrans-61.7-43.5176-178.3-178.5175.9-172.50111.6R93 H94 V95 I99 R100 D101R93-K97 WeakPolarHBondContact O-CB 3.33Å; R93-K97 PolarHBondContact O-N 2.95Å; H94-K97 PolarHBondContact O-N 3.01Å; V95-K97 VanDerWaalsContact C-N 3.32Å; V95-K97 PolarHBondContact O-N 2.95Å; K97-I99 PolarHBondContact O-N 3.34Å; K97-R100 WeakPolarHBondContact O-CB 3.4Å; K97-R100 PolarHBondContact O-N 3.29Å; K97-D101 VanDerWaalsContact CE-OD2 3.24Å; K97-D101 WeakPolarHBondContact CE-OD2 3.22Å; K97-D101 WeakPolarHBondContact CG-OD2 3.07Å; K97-D101 WeakPolarHBondContact O-CB 3.28Å; K97-D101 PolarHBondContact O-N 3.34Å
98E98.6Very high97.8Very high74 Ų7449.3 Ų49.335%0.34623%0.234SC..Hα-helixtrans-57.5-50.5177.3-176.6-170.7-176.700111.9R54 H94 V95 R100 D101 E102R54-E98 IonicContact CZ-OE1 3.39Å; R54-E98 IonicContact CZ-OE2 2.8Å; R54-E98 VanDerWaalsContact CZ-OE2 3.31Å; R54-E98 IonicContact NE-OE1 3.14Å; R54-E98 IonicContact NE-OE2 3.71Å; R54-E98 PolarHBondContact NE-OE2 2.86Å; R54-E98 IonicContact NH2-OE1 3.37Å; R54-E98 PolarHBondContact NH2-OE1 3.19Å; R54-E98 IonicContact NH2-OE2 3.92Å; R54-E98 PolarHBondContact NH2-OE2 2.88Å; R54-E98 VanDerWaalsContact NH2-OE2 3.08Å; H94-E98 PolarHBondContact O-N 3.31Å; V95-E98 WeakPolarHBondContact O-CB 3.38Å; V95-E98 PolarHBondContact O-N 3.06Å; E98-R100 VanDerWaalsContact C-N 3.29Å; E98-R100 PolarHBondContact O-N 3.03Å; E98-D101 PolarHBondContact O-N 3.1Å; E98-E102 WeakPolarHBondContact O-CB 3.4Å; E98-E102 PolarHBondContact O-N 3.07Å
99I98.6Very high97.8Very high0 Ų055.3 Ų55.30%026%0.26CS..Hα-helixtrans-59.5-43.9179.5-66.6168.1000110.5R54 L57 L58 I61 F85 I88 V95 A96 K97 Y103 F220R54-I99 HydrophobicContact CB-CD1 4.44Å; R54-I99 HydrophobicContact CG-CD1 4.41Å; L57-I99 HydrophobicContact CB-CD1 4.33Å; L57-I99 HydrophobicContact CB-CG2 4.35Å; L57-I99 HydrophobicContact CD1-CD1 4.02Å; L57-I99 HydrophobicContact CD1-CG2 4.48Å; L58-I99 HydrophobicContact CD2-CG1 4.18Å; L58-I99 HydrophobicContact CG-CG1 4.33Å; I61-I99 HydrophobicContact CD1-CG2 3.67Å; F85-I99 HydrophobicContact CD2-CG2 4.17Å; F85-I99 HydrophobicContact CE2-CB 4.42Å; F85-I99 HydrophobicContact CE2-CG2 4.34Å; I88-I99 HydrophobicContact CD1-CD1 3.48Å; I88-I99 VanDerWaalsContact CD1-CD1 3.48Å; I88-I99 HydrophobicContact CG2-CD1 4.36Å; V95-I99 HydrophobicContact CG1-CD1 4.05Å; V95-I99 WeakPolarHBondContact O-CG1 3.29Å; V95-I99 PolarHBondContact O-N 2.96Å; A96-I99 PolarHBondContact O-N 3.42Å; K97-I99 PolarHBondContact O-N 3.34Å; I99-Y103 WeakPolarHBondContact O-CB 3.3Å; I99-Y103 PolarHBondContact O-N 2.84Å; I99-F220 HydrophobicContact CG2-CE1 4.43Å
100R98.3Very high97.7Very high85 Ų8553.9 Ų53.932%0.32125%0.254SS..Hα-helixtrans-60.9-51.3177.2-174-163.666.8176.63.5111.6A96 K97 E98 E102 Y103 V104 F220 M230A96-R100 WeakPolarHBondContact O-CB 3.48Å; A96-R100 PolarHBondContact O-N 2.85Å; K97-R100 WeakPolarHBondContact O-CB 3.4Å; K97-R100 PolarHBondContact O-N 3.29Å; E98-R100 VanDerWaalsContact C-N 3.29Å; E98-R100 PolarHBondContact O-N 3.03Å; R100-E102 VanDerWaalsContact C-N 3.32Å; R100-E102 PolarHBondContact O-N 2.91Å; R100-Y103 PolarHBondContact O-N 3.27Å; R100-V104 VanDerWaalsContact O-CG2 3.3Å; R100-V104 WeakPolarHBondContact O-CG2 3.36Å; R100-V104 PolarHBondContact O-N 3.01Å; R100-F220 HydrophobicContact CB-CD1 4.15Å; R100-F220 HydrophobicContact CB-CE1 3.96Å; R100-F220 HydrophobicContact CG-CD1 4.08Å; R100-F220 HydrophobicContact CG-CE1 4.19Å; R100-M230 HydrophobicContact CG-CE 3.36Å; R100-M230 HydrophobicContact CG-SD 4.01Å
101D98.5Very high97.7Very high49 Ų4951.2 Ų51.226%0.26224%0.235SC..Hα-helixtrans-65.5-37-177-65.1-4.1000110.6K97 E98 V104 N105K97-D101 VanDerWaalsContact CE-OD2 3.24Å; K97-D101 WeakPolarHBondContact CE-OD2 3.22Å; K97-D101 WeakPolarHBondContact CG-OD2 3.07Å; K97-D101 WeakPolarHBondContact O-CB 3.28Å; K97-D101 PolarHBondContact O-N 3.34Å; E98-D101 PolarHBondContact O-N 3.1Å; D101-V104 PolarHBondContact O-N 3.19Å; D101-N105 WeakPolarHBondContact O-CB 3.35Å; D101-N105 PolarHBondContact O-N 3.46Å; D101-N105 PolarHBondContact O-ND2 3.05Å; D101-N105 VanDerWaalsContact O-ND2 3.09Å
102E98.4Very high97.8Very high42 Ų4252.3 Ų52.320%0.19624%0.239CC..Hα-helixtrans-68.6-38.5175.8-167.657-144.300112.8L58 I61 Y62 R65 E98 R100 T106L58-E102 HydrophobicContact CD2-CB 3.98Å; L58-E102 HydrophobicContact CD2-CG 4.02Å; I61-E102 HydrophobicContact CG2-CG 4.32Å; Y62-E102 HydrophobicContact CE1-CG 3.94Å; Y62-E102 VanDerWaalsContact CE1-OE1 3.22Å; Y62-E102 WeakPolarHBondContact CE1-OE1 3.38Å; R65-E102 IonicContact CZ-OE1 2.78Å; R65-E102 IonicContact NH2-OE1 3.74Å; R65-E102 PolarHBondContact NH2-OE1 2.94Å; E98-E102 WeakPolarHBondContact O-CB 3.4Å; E98-E102 PolarHBondContact O-N 3.07Å; R100-E102 VanDerWaalsContact C-N 3.32Å; R100-E102 PolarHBondContact O-N 2.91Å; E102-T106 VanDerWaalsContact O-CB 3.27Å; E102-T106 WeakPolarHBondContact O-CB 3.31Å; E102-T106 PolarHBondContact O-N 3.44Å; E102-T106 PolarHBondContact O-OG1 3.01Å
103Y98.6Very high97.8Very high0 Ų053.6 Ų53.60%025%0.251CS..Hα-helixtrans-61.6-51.1172.2177-86.8000110.9I61 L64 Q75 I99 R100 N105 T106 M107 E212 F215 L216 F220 M230I61-Y103 HydrophobicContact CG1-CD2 4.2Å; L64-Y103 HydrophobicContact CD1-CD2 4.06Å; L64-Y103 HydrophobicContact CD1-CE2 3.87Å; Q75-Y103 PolarHBondContact NE2-OH 3.49Å; I99-Y103 WeakPolarHBondContact O-CB 3.3Å; I99-Y103 PolarHBondContact O-N 2.84Å; R100-Y103 PolarHBondContact O-N 3.27Å; Y103-N105 VanDerWaalsContact C-N 3.35Å; Y103-N105 PolarHBondContact O-N 2.81Å; Y103-T106 PolarHBondContact O-N 3.43Å; Y103-T106 VanDerWaalsContact O-N 3.09Å; Y103-M107 HydrophobicContact CD1-CG 4.29Å; Y103-M107 HydrophobicContact CD2-CG 4.25Å; Y103-M107 HydrophobicContact CE1-CB 4.16Å; Y103-M107 HydrophobicContact CE1-CG 3.7Å; Y103-M107 HydrophobicContact CE2-CG 3.69Å; Y103-M107 PolarHBondContact O-N 3.44Å; Y103-M107 WeakPolarHBondContact OH-CG 3.43Å; Y103-E212 WeakPolarHBondContact CE1-OE1 3.37Å; Y103-E212 VanDerWaalsContact OH-CD 3.29Å; Y103-E212 PolarHBondContact OH-OE1 3.32Å; Y103-E212 PolarHBondContact OH-OE2 3.09Å; Y103-F215 HydrophobicContact CD2-CE1 4.25Å; Y103-F215 HydrophobicContact CE1-CD1 4.38Å; Y103-F215 HydrophobicContact CE1-CE1 4.13Å; Y103-F215 HydrophobicContact CE2-CD1 4.14Å; Y103-F215 AromaticContact CE2-CE1 3.34Å; Y103-F215 HydrophobicContact CE2-CE1 3.34Å; Y103-F215 AromaticContact CE2-CZ 3.99Å; Y103-F215 HydrophobicContact CE2-CZ 3.99Å; Y103-F215 AromaticContact CZ-CD1 3.62Å; Y103-F215 AromaticContact CZ-CE1 3.27Å; Y103-F215 WeakPolarHBondContact OH-CD1 3.37Å; Y103-F215 WeakPolarHBondContact OH-CE1 3.13Å; Y103-L216 HydrophobicContact CD1-CD2 4.12Å; Y103-L216 HydrophobicContact CE1-CD2 3.51Å; Y103-F220 AromaticContact CD1-CE2 3.51Å; Y103-F220 HydrophobicContact CD1-CE2 3.51Å; Y103-F220 AromaticContact CD1-CZ 3.81Å; Y103-F220 HydrophobicContact CD1-CZ 3.81Å; Y103-F220 HydrophobicContact CD2-CE2 4.1Å; Y103-F220 HydrophobicContact CD2-CZ 4.06Å; Y103-F220 AromaticContact CE1-CE2 3.89Å; Y103-F220 HydrophobicContact CE1-CE2 3.89Å; Y103-F220 HydrophobicContact CE2-CE2 4.42Å; Y103-F220 AromaticContact CG-CE2 3.65Å; Y103-F220 HydrophobicContact CG-CE2 3.65Å; Y103-F220 AromaticContact CG-CZ 3.52Å; Y103-F220 HydrophobicContact CG-CZ 3.52Å; Y103-M230 HydrophobicContact CD1-CE 4.26Å
104V98.5Very high97.7Very high8 Ų848.4 Ų48.45%0.04823%0.232CC..Hα-helixtrans-56.4-49.7179.7167.10000110.8R100 D101 T106 S108 M230 Q233 V234R100-V104 VanDerWaalsContact O-CG2 3.3Å; R100-V104 WeakPolarHBondContact O-CG2 3.36Å; R100-V104 PolarHBondContact O-N 3.01Å; D101-V104 PolarHBondContact O-N 3.19Å; V104-T106 VanDerWaalsContact C-N 3.27Å; V104-T106 PolarHBondContact O-N 2.86Å; V104-S108 WeakPolarHBondContact O-CB 3.46Å; V104-S108 PolarHBondContact O-N 3.18Å; V104-M230 HydrophobicContact CG2-CE 3.61Å; V104-M230 HydrophobicContact CG2-CG 4.1Å; V104-Q233 HydrophobicContact CG1-CB 3.56Å; V104-V234 HydrophobicContact CB-CG2 4.28Å; V104-V234 HydrophobicContact CG1-CG2 4.25Å; V104-V234 HydrophobicContact CG2-CG2 3.95Å
105N98.3Very high97.7Very high83 Ų8340.8 Ų40.844%0.44420%0.197SC..Hα-helixtrans-60-37.3177.8-77.3-33.8000112.8D101 Y103 K109D101-N105 WeakPolarHBondContact O-CB 3.35Å; D101-N105 PolarHBondContact O-N 3.46Å; D101-N105 PolarHBondContact O-ND2 3.05Å; D101-N105 VanDerWaalsContact O-ND2 3.09Å; Y103-N105 VanDerWaalsContact C-N 3.35Å; Y103-N105 PolarHBondContact O-N 2.81Å; N105-K109 WeakPolarHBondContact O-CD 3.16Å; N105-K109 WeakPolarHBondContact O-CG 3.5Å
106T97.6Very high97.7Very high2 Ų245.7 Ų45.71%0.01222%0.217CC..Hα-helixtrans-72-54.8179.9-64.20000111I61 L64 R65 E102 Y103 V104 S108 K109 V110I61-T106 HydrophobicContact CG2-CG2 4.34Å; L64-T106 HydrophobicContact CB-CG2 4.05Å; R65-T106 HydrophobicContact CG-CG2 3.61Å; R65-T106 PolarHBondContact NE-OG1 3.02Å; R65-T106 PolarHBondContact NH2-OG1 3.32Å; E102-T106 VanDerWaalsContact O-CB 3.27Å; E102-T106 WeakPolarHBondContact O-CB 3.31Å; E102-T106 PolarHBondContact O-N 3.44Å; E102-T106 PolarHBondContact O-OG1 3.01Å; Y103-T106 PolarHBondContact O-N 3.43Å; Y103-T106 VanDerWaalsContact O-N 3.09Å; V104-T106 VanDerWaalsContact C-N 3.27Å; V104-T106 PolarHBondContact O-N 2.86Å; T106-S108 VanDerWaalsContact C-N 3.35Å; T106-S108 PolarHBondContact O-N 2.77Å; T106-K109 PolarHBondContact O-N 2.84Å; T106-V110 HydrophobicContact CG2-CG2 4.36Å; T106-V110 WeakPolarHBondContact O-CG2 3.41Å; T106-V110 PolarHBondContact O-N 3.3Å
107M97.5Very high97.6Very high0 Ų048.4 Ų48.40%023%0.233CC..Hα-helixtrans-67-36-176.2-74.7-52.3-64.400112.7L64 Y71 Y103 K109 V110 L111 V234L64-M107 HydrophobicContact CB-SD 4.21Å; L64-M107 HydrophobicContact CD1-CG 4.29Å; L64-M107 HydrophobicContact CD1-SD 3.85Å; L64-M107 HydrophobicContact CD2-SD 4.26Å; L64-M107 HydrophobicContact CG-SD 4.34Å; Y71-M107 HydrophobicContact CD2-CE 3.62Å; Y71-M107 HydrophobicContact CE2-CE 3.81Å; Y71-M107 HydrophobicContact CG-CE 4.16Å; Y103-M107 HydrophobicContact CD1-CG 4.29Å; Y103-M107 HydrophobicContact CD2-CG 4.25Å; Y103-M107 HydrophobicContact CE1-CB 4.16Å; Y103-M107 HydrophobicContact CE1-CG 3.7Å; Y103-M107 HydrophobicContact CE2-CG 3.69Å; Y103-M107 PolarHBondContact O-N 3.44Å; Y103-M107 WeakPolarHBondContact OH-CG 3.43Å; M107-K109 VanDerWaalsContact C-N 3.29Å; M107-K109 PolarHBondContact O-N 2.96Å; M107-V110 PolarHBondContact O-N 2.75Å; M107-L111 HydrophobicContact CB-CD1 4.46Å; M107-L111 HydrophobicContact CE-CD1 3.99Å; M107-L111 HydrophobicContact CE-CD2 4.45Å; M107-L111 HydrophobicContact CE-CG 4.04Å; M107-L111 WeakPolarHBondContact O-CB 3.42Å; M107-L111 WeakPolarHBondContact O-CG 3.44Å; M107-L111 PolarHBondContact O-N 2.88Å; M107-V234 HydrophobicContact CB-CG1 3.82Å
108S98Very high97.6Very high9 Ų943.9 Ų43.96%0.06321%0.213CC..Hα-helixtrans-56.9-43.4173.6-171.30000112V104 T106 F112 V234V104-S108 WeakPolarHBondContact O-CB 3.46Å; V104-S108 PolarHBondContact O-N 3.18Å; T106-S108 VanDerWaalsContact C-N 3.35Å; T106-S108 PolarHBondContact O-N 2.77Å; S108-F112 WeakPolarHBondContact O-CB 3.43Å; S108-F112 PolarHBondContact O-N 3.14Å; S108-V234 VanDerWaalsContact CA-O 3.22Å; S108-V234 WeakPolarHBondContact CA-O 3.33Å; S108-V234 VanDerWaalsContact CB-O 3.29Å; S108-V234 WeakPolarHBondContact CB-O 3.33Å; S108-V234 PolarHBondContact OG-O 3.36Å; S108-V234 VanDerWaalsContact OG-O 3.1Å
109K97.4Very high97.6Very high126 Ų12640.5 Ų40.555%0.54820%0.198SC..Hα-helixtrans-70.8-42.2177.7-69.9172.5-174171.80112.6N105 T106 M107 S113N105-K109 WeakPolarHBondContact O-CD 3.16Å; N105-K109 WeakPolarHBondContact O-CG 3.5Å; T106-K109 PolarHBondContact O-N 2.84Å; M107-K109 VanDerWaalsContact C-N 3.29Å; M107-K109 PolarHBondContact O-N 2.96Å; K109-S113 VanDerWaalsContact O-CB 3.28Å; K109-S113 WeakPolarHBondContact O-CB 3.2Å; K109-S113 PolarHBondContact O-N 3.2Å
110V95.7Very high97.5Very high35 Ų3543.4 Ų43.421%0.21222%0.218CC..Hα-helixtrans-61.3-53.4-179.91690000110.3T106 M107 S113 Y114T106-V110 HydrophobicContact CG2-CG2 4.36Å; T106-V110 WeakPolarHBondContact O-CG2 3.41Å; T106-V110 PolarHBondContact O-N 3.3Å; M107-V110 PolarHBondContact O-N 2.75Å; V110-S113 PolarHBondContact O-N 2.64Å; V110-Y114 WeakPolarHBondContact O-CB 3.31Å; V110-Y114 PolarHBondContact O-N 2.94Å
111L96Very high97.5Very high0 Ų046.2 Ų46.20%023%0.229CC..Hα-helixtrans-65.4-43.3-178.7-68.4164.2000111.4Y71 M107 S113 Y114 F115 E212 V234 F235Y71-L111 HydrophobicContact CE1-CD2 4.36Å; M107-L111 HydrophobicContact CB-CD1 4.46Å; M107-L111 HydrophobicContact CE-CD1 3.99Å; M107-L111 HydrophobicContact CE-CD2 4.45Å; M107-L111 HydrophobicContact CE-CG 4.04Å; M107-L111 WeakPolarHBondContact O-CB 3.42Å; M107-L111 WeakPolarHBondContact O-CG 3.44Å; M107-L111 PolarHBondContact O-N 2.88Å; L111-S113 PolarHBondContact O-N 3.18Å; L111-Y114 PolarHBondContact O-N 2.85Å; L111-F115 WeakPolarHBondContact O-CD2 3.27Å; L111-F115 PolarHBondContact O-N 2.98Å; L111-E212 HydrophobicContact CD1-CG 4.49Å; L111-V234 HydrophobicContact CD1-CG1 3.74Å; L111-F235 HydrophobicContact CD1-CD2 3.72Å; L111-F235 HydrophobicContact CD1-CE2 3.83Å; L111-F235 HydrophobicContact CD2-CE2 4.24Å; L111-F235 HydrophobicContact CG-CE2 4.44Å
112F97.6Very high97.5Very high47 Ų4743.9 Ų43.921%0.20622%0.216CC..Hα-helixtrans-58.5-47176-179.8-88.2000111.8S108 K116 R237 T238 L241S108-F112 WeakPolarHBondContact O-CB 3.43Å; S108-F112 PolarHBondContact O-N 3.14Å; F112-K116 HydrophobicContact CE1-CD 3.93Å; F112-K116 HydrophobicContact CZ-CD 4.47Å; F112-K116 WeakPolarHBondContact O-CB 3.3Å; F112-K116 PolarHBondContact O-N 3.09Å; F112-R237 HydrophobicContact CD2-CB 4.06Å; F112-T238 WeakPolarHBondContact CA-OG1 3.05Å; F112-T238 PolarHBondContact N-OG1 2.78Å; F112-L241 HydrophobicContact CD2-CB 4.24Å; F112-L241 HydrophobicContact CD2-CD2 3.96Å; F112-L241 HydrophobicContact CE2-CB 3.81Å; F112-L241 HydrophobicContact CE2-CD1 4.33Å; F112-L241 HydrophobicContact CE2-CD2 3.83Å; F112-L241 HydrophobicContact CE2-CG 4.21Å; F112-L241 HydrophobicContact CG-CD2 4.45Å; F112-L241 HydrophobicContact CZ-CD1 4.35Å; F112-L241 HydrophobicContact CZ-CD2 4.18Å
113S96.3Very high97.4Very high69 Ų6943.7 Ų43.748%0.48322%0.216SC..Hα-helixtrans-65.1-39.7179.7-173.20000112.3K109 V110 L111 T117K109-S113 VanDerWaalsContact O-CB 3.28Å; K109-S113 WeakPolarHBondContact O-CB 3.2Å; K109-S113 PolarHBondContact O-N 3.2Å; V110-S113 PolarHBondContact O-N 2.64Å; L111-S113 PolarHBondContact O-N 3.18Å; S113-T117 WeakPolarHBondContact O-CB 3.12Å; S113-T117 PolarHBondContact O-N 3.37Å; S113-T117 VanDerWaalsContact O-N 3.14Å; S113-T117 PolarHBondContact O-OG1 3.47Å
114Y95.3Very high97.2Very high95 Ų9551.1 Ų51.137%0.37325%0.248SC..Hα-helixtrans-59.7-57.9175.6172.6-98.2000110.9V110 L111 K116 T117 F118 H208V110-Y114 WeakPolarHBondContact O-CB 3.31Å; V110-Y114 PolarHBondContact O-N 2.94Å; L111-Y114 PolarHBondContact O-N 2.85Å; Y114-K116 PolarHBondContact O-N 3.47Å; Y114-T117 PolarHBondContact O-N 3.43Å; Y114-F118 WeakPolarHBondContact O-CB 3.33Å; Y114-F118 PolarHBondContact O-N 3.29Å; Y114-H208 AromaticContact CE1-CD2 3.92Å; Y114-H208 AromaticContact CE1-CE1 3.89Å; Y114-H208 AromaticContact CE1-NE2 3.36Å; Y114-H208 WeakPolarHBondContact CE1-NE2 3.47Å; Y114-H208 AromaticContact CZ-NE2 3.57Å; Y114-H208 PolarHBondContact OH-NE2 3.44Å
115F97.4Very high97.1Very high0 Ų051.1 Ų51.10%025%0.248CC..Hα-helixtrans-65.7-37-177.7-83-78.2000112.5L111 T117 F118 I119 A204 L205 H208 F235 T238L111-F115 WeakPolarHBondContact O-CD2 3.27Å; L111-F115 PolarHBondContact O-N 2.98Å; F115-T117 VanDerWaalsContact C-N 3.29Å; F115-T117 PolarHBondContact O-N 3.2Å; F115-F118 HydrophobicContact CD1-CD1 4.41Å; F115-F118 PolarHBondContact O-N 3.25Å; F115-I119 HydrophobicContact CB-CD1 4.36Å; F115-I119 WeakPolarHBondContact O-CB 3.46Å; F115-I119 WeakPolarHBondContact O-CD1 3.28Å; F115-I119 WeakPolarHBondContact O-CG1 3.26Å; F115-I119 PolarHBondContact O-N 3.21Å; F115-A204 HydrophobicContact CE1-CB 4.03Å; F115-A204 HydrophobicContact CZ-CB 4.34Å; F115-L205 HydrophobicContact CD1-CD1 4.1Å; F115-L205 HydrophobicContact CD2-CD1 4.29Å; F115-L205 HydrophobicContact CE1-CB 4.03Å; F115-L205 HydrophobicContact CE1-CD1 3.79Å; F115-L205 HydrophobicContact CE2-CD1 3.99Å; F115-L205 HydrophobicContact CG-CD1 4.36Å; F115-L205 HydrophobicContact CZ-CB 4.18Å; F115-L205 HydrophobicContact CZ-CD1 3.75Å; F115-H208 HydrophobicContact CE2-CB 4.01Å; F115-H208 HydrophobicContact CZ-CB 4.01Å; F115-H208 AromaticContact CZ-CD2 3.66Å; F115-H208 AromaticContact CZ-CG 3.95Å; F115-F235 HydrophobicContact CE2-CZ 4.19Å; F115-T238 HydrophobicContact CB-CG2 3.82Å; F115-T238 HydrophobicContact CD2-CG2 3.38Å; F115-T238 HydrophobicContact CE2-CG2 4.18Å; F115-T238 HydrophobicContact CG-CG2 3.73Å
116K98.1Very high96.9Very high121 Ų12151.6 Ų51.653%0.52624%0.243SC..Hα-helixtrans-56.5-45.6173.8-173.7175.2179.3179.50111.8F112 Y114 S120 L241F112-K116 HydrophobicContact CE1-CD 3.93Å; F112-K116 HydrophobicContact CZ-CD 4.47Å; F112-K116 WeakPolarHBondContact O-CB 3.3Å; F112-K116 PolarHBondContact O-N 3.09Å; Y114-K116 PolarHBondContact O-N 3.47Å; K116-S120 WeakPolarHBondContact O-CB 3.49Å; K116-S120 PolarHBondContact O-N 3Å; K116-L241 HydrophobicContact CB-CD2 3.68Å; K116-L241 HydrophobicContact CG-CD2 4.39Å
117T97Very high96.6Very high60 Ų6054.7 Ų54.737%0.36826%0.257SS..Hα-helixtrans-71.7-43.9179.5-55.40000111.2S113 Y114 F115 S120 R121S113-T117 WeakPolarHBondContact O-CB 3.12Å; S113-T117 PolarHBondContact O-N 3.37Å; S113-T117 VanDerWaalsContact O-N 3.14Å; S113-T117 PolarHBondContact O-OG1 3.47Å; Y114-T117 PolarHBondContact O-N 3.43Å; F115-T117 VanDerWaalsContact C-N 3.29Å; F115-T117 PolarHBondContact O-N 3.2Å; T117-S120 PolarHBondContact O-N 3.2Å; T117-R121 WeakPolarHBondContact O-CG 3.2Å; T117-R121 PolarHBondContact O-N 2.99Å
118F97.6Very high95.8Very high16 Ų1662.1 Ų62.17%0.0729%0.292CS..Hα-helixtrans-60.1-53.8-178.8-177.7-125.4000111.5Y114 F115 S120 R121 L122 V179 P182 V201 A204Y114-F118 WeakPolarHBondContact O-CB 3.33Å; Y114-F118 PolarHBondContact O-N 3.29Å; F115-F118 HydrophobicContact CD1-CD1 4.41Å; F115-F118 PolarHBondContact O-N 3.25Å; F118-S120 PolarHBondContact O-N 3.39Å; F118-R121 PolarHBondContact O-N 2.98Å; F118-L122 HydrophobicContact CD1-CD1 4.22Å; F118-L122 HydrophobicContact CD2-CD1 4.34Å; F118-L122 HydrophobicContact CD2-CG 4.34Å; F118-L122 HydrophobicContact CE1-CD1 3.7Å; F118-L122 HydrophobicContact CE2-CD1 3.82Å; F118-L122 HydrophobicContact CE2-CD2 4.31Å; F118-L122 HydrophobicContact CE2-CG 4.06Å; F118-L122 HydrophobicContact CZ-CD1 3.48Å; F118-L122 VanDerWaalsContact CZ-CD1 3.48Å; F118-L122 HydrophobicContact CZ-CG 4.24Å; F118-L122 WeakPolarHBondContact O-CG 3.09Å; F118-L122 PolarHBondContact O-N 3.11Å; F118-V179 HydrophobicContact CZ-CB 4.4Å; F118-P182 HydrophobicContact CD2-CG 3.91Å; F118-P182 HydrophobicContact CE2-CG 3.92Å; F118-V201 HydrophobicContact CD1-CG2 4.46Å; F118-V201 HydrophobicContact CE1-CG2 4.28Å; F118-A204 HydrophobicContact CE1-CB 3.88Å
119I98Very high94.9Very high3 Ų364.7 Ų64.72%0.01531%0.305CS..Hα-helixtrans-62.2-44.7179.3-60164.7000110.4F115 R121 L122 M123 V201 V242 T245F115-I119 HydrophobicContact CB-CD1 4.36Å; F115-I119 WeakPolarHBondContact O-CB 3.46Å; F115-I119 WeakPolarHBondContact O-CD1 3.28Å; F115-I119 WeakPolarHBondContact O-CG1 3.26Å; F115-I119 PolarHBondContact O-N 3.21Å; I119-R121 VanDerWaalsContact C-N 3.27Å; I119-R121 PolarHBondContact O-N 3.09Å; I119-L122 PolarHBondContact O-N 2.66Å; I119-M123 HydrophobicContact CG2-CG 3.97Å; I119-M123 WeakPolarHBondContact O-CB 3.39Å; I119-M123 VanDerWaalsContact O-CG 3.24Å; I119-M123 WeakPolarHBondContact O-CG 3.3Å; I119-M123 PolarHBondContact O-N 3.25Å; I119-V201 HydrophobicContact CD1-CG1 3.92Å; I119-V201 HydrophobicContact CG1-CB 4.49Å; I119-V201 HydrophobicContact CG1-CG1 3.71Å; I119-V201 HydrophobicContact CG1-CG2 3.87Å; I119-V242 HydrophobicContact CD1-CB 4.34Å; I119-V242 HydrophobicContact CD1-CG2 3.68Å; I119-T245 HydrophobicContact CG2-CG2 3.59Å
120S97.8Very high94Very high62 Ų6261.9 Ų61.943%0.43431%0.305SS..Hα-helixtrans-58.3-39178.3-179.90000112.7K116 T117 F118 K124K116-S120 WeakPolarHBondContact O-CB 3.49Å; K116-S120 PolarHBondContact O-N 3Å; T117-S120 PolarHBondContact O-N 3.2Å; F118-S120 PolarHBondContact O-N 3.39Å; S120-K124 WeakPolarHBondContact O-CG 3.25Å
121R98Very high93.6Very high144 Ų14461 Ų6154%0.54330%0.302SS..Hα-helixtrans-70.9-44.2176-70.6176.5179.9179.5-0.2111.8T117 F118 I119 M123 K124 P182T117-R121 WeakPolarHBondContact O-CG 3.2Å; T117-R121 PolarHBondContact O-N 2.99Å; F118-R121 PolarHBondContact O-N 2.98Å; I119-R121 VanDerWaalsContact C-N 3.27Å; I119-R121 PolarHBondContact O-N 3.09Å; R121-M123 PolarHBondContact O-N 3.1Å; R121-K124 WeakPolarHBondContact O-CB 3.47Å; R121-K124 PolarHBondContact O-N 3.31Å; R121-P182 HydrophobicContact CB-CB 3.74Å; R121-P182 HydrophobicContact CB-CG 4.14Å
122L98Very high93.2Very high0 Ų062.1 Ų62.10%031%0.314CS..Hα-helixtrans-63.7-40.3178.7-69.1-173.7000112.6F118 I119 K124 L125 I180 P182 I197 V201F118-L122 HydrophobicContact CD1-CD1 4.22Å; F118-L122 HydrophobicContact CD2-CD1 4.34Å; F118-L122 HydrophobicContact CD2-CG 4.34Å; F118-L122 HydrophobicContact CE1-CD1 3.7Å; F118-L122 HydrophobicContact CE2-CD1 3.82Å; F118-L122 HydrophobicContact CE2-CD2 4.31Å; F118-L122 HydrophobicContact CE2-CG 4.06Å; F118-L122 HydrophobicContact CZ-CD1 3.48Å; F118-L122 VanDerWaalsContact CZ-CD1 3.48Å; F118-L122 HydrophobicContact CZ-CG 4.24Å; F118-L122 WeakPolarHBondContact O-CG 3.09Å; F118-L122 PolarHBondContact O-N 3.11Å; I119-L122 PolarHBondContact O-N 2.66Å; L122-K124 PolarHBondContact O-N 3.19Å; L122-L125 HydrophobicContact CD2-CD1 4.13Å; L122-L125 WeakPolarHBondContact O-CA 3.36Å; L122-L125 WeakPolarHBondContact O-CB 3.38Å; L122-L125 PolarHBondContact O-N 3.41Å; L122-I180 HydrophobicContact CD2-CB 3.72Å; L122-I180 HydrophobicContact CD2-CG2 3.54Å; L122-P182 HydrophobicContact CD2-CB 4.36Å; L122-P182 HydrophobicContact CD2-CG 3.86Å; L122-P182 HydrophobicContact CG-CG 4.4Å; L122-I197 HydrophobicContact CB-CG2 3.82Å; L122-I197 HydrophobicContact CD1-CG2 4.44Å; L122-I197 VanDerWaalsContact O-CD1 3.32Å; L122-I197 WeakPolarHBondContact O-CD1 3.48Å; L122-V201 HydrophobicContact CD1-CG2 3.67Å
123M96.1Very high92.7Very high38 Ų3867.1 Ų67.119%0.18734%0.335CS..Hα-helixtrans-63-24.6178.2-68.1-61.2-73.100113I119 R121 L125 R126 I197 S249I119-M123 HydrophobicContact CG2-CG 3.97Å; I119-M123 WeakPolarHBondContact O-CB 3.39Å; I119-M123 VanDerWaalsContact O-CG 3.24Å; I119-M123 WeakPolarHBondContact O-CG 3.3Å; I119-M123 PolarHBondContact O-N 3.25Å; R121-M123 PolarHBondContact O-N 3.1Å; M123-L125 VanDerWaalsContact C-N 3.32Å; M123-R126 WeakPolarHBondContact O-CB 3.18Å; M123-I197 HydrophobicContact SD-CG2 3.98Å; M123-S249 WeakPolarHBondContact CE-OG 3.49Å
124K95.8Very high92.2Very high156 Ų15668.2 Ų68.268%0.67834%0.336SS*.Hα-helixtrans-76.1-18.8172.6-67.6176.3-177.9-172.70113.6S120 R121 L122 R126S120-K124 WeakPolarHBondContact O-CG 3.25Å; R121-K124 WeakPolarHBondContact O-CB 3.47Å; R121-K124 PolarHBondContact O-N 3.31Å; L122-K124 PolarHBondContact O-N 3.19Å; K124-R126 VanDerWaalsContact C-N 3.27Å
125L96.2Very high91.9Very high8 Ų864.8 Ų64.84%0.04232%0.324CS..THydrogen-bonded Turntrans-87.85176.3-60.7171.3000112.3L122 M123 I180 P182 A185 D186 K191 F192L122-L125 HydrophobicContact CD2-CD1 4.13Å; L122-L125 WeakPolarHBondContact O-CA 3.36Å; L122-L125 WeakPolarHBondContact O-CB 3.38Å; L122-L125 PolarHBondContact O-N 3.41Å; M123-L125 VanDerWaalsContact C-N 3.32Å; L125-I180 HydrophobicContact CD1-CG2 4.31Å; L125-P182 HydrophobicContact CD1-CB 4.32Å; L125-A185 HydrophobicContact CD1-CB 3.66Å; L125-A185 HydrophobicContact CD2-CB 4.33Å; L125-D186 HydrophobicContact CD2-CB 4.15Å; L125-K191 CarbonylContact O-C 3.6Å; L125-K191 WeakPolarHBondContact O-CA 3.43Å; L125-F192 HydrophobicContact CB-CD2 4.09Å; L125-F192 PolarHBondContact O-N 2.92Å
126R93.4Very high91.7Very high93 Ų9365.8 Ų65.835%0.35133%0.329SS..BIsolated β-bridgetrans-67.9149.5175-165.7175.562.6-166.4-1.8110.8M123 K124 F192 I197M123-R126 WeakPolarHBondContact O-CB 3.18Å; K124-R126 VanDerWaalsContact C-N 3.27Å; R126-F192 WeakPolarHBondContact CA-O 3.48Å; R126-I197 HydrophobicContact CB-CD1 3.85Å; R126-I197 HydrophobicContact CG-CD1 4.26Å
127H90.9Very high91.4Very high66 Ų6660 Ų6031%0.30630%0.304SS..  trans-51.7139.7163.9-70.6-72.4000111F192 H193H127-F192 PolarHBondContact CD2-O 3.03Å; H127-F192 PolarHBondContact N-O 3.3Å; H127-F192 VanDerWaalsContact N-O 3.13Å; H127-H193 AromaticContact CD2-CD2 3.76Å; H127-H193 AromaticContact CD2-CG 3.94Å; H127-H193 AromaticContact CD2-NE2 3.83Å; H127-H193 AromaticContact NE2-CE1 3.79Å; H127-H193 AromaticContact NE2-ND1 3.97Å; H127-H193 AromaticContact NE2-NE2 3.96Å
128E81.6Confident91Very high156 Ų15657.4 Ų57.473%0.72929%0.289SS*.SBendtrans-81-32.5-177.2-69.6168.3-157.900111.4A130 K191E128-A130 VanDerWaalsContact C-N 3.26Å; E128-A130 PolarHBondContact O-N 3.12Å; E128-K191 IonicContact OE1-NZ 3.11Å; E128-K191 PolarHBondContact OE1-NZ 2.77Å
129D78.5Confident90.5Very high63 Ų6357.5 Ų57.534%0.33729%0.293SS..  trans-8265.4179.5-59.2-35.9000111.3
130A79.3Confident89.7Confident67 Ų6759.9 Ų59.955%0.55431%0.305SS*.  trans-73.1140.7175.300000111.1E128 G132E128-A130 VanDerWaalsContact C-N 3.26Å; E128-A130 PolarHBondContact O-N 3.12Å; A130-G132 PolarHBondContact O-N 3.13Å
131A86.5Confident88.2Confident17 Ų1761.6 Ų61.614%0.1431%0.31CS..  trans-54.9138.417200000111.1D135 V161 F254 D255A131-D135 WeakPolarHBondContact CA-OD2 3.44Å; A131-D135 HydrophobicContact CB-CB 4.36Å; A131-V161 HydrophobicContact CB-CB 4.33Å; A131-V161 HydrophobicContact CB-CG1 3.63Å; A131-V161 HydrophobicContact CB-CG2 3.75Å; A131-F254 HydrophobicContact CB-CB 3.92Å; A131-F254 WeakPolarHBondContact O-CB 3.17Å; A131-D255 HydrophobicContact CB-CB 4.49Å
132G87.8Confident85.9Confident24 Ų2458.8 Ų58.825%0.24731%0.312CS..  trans-121.1-173177.900000112.9A130 D134 D135A130-G132 PolarHBondContact O-N 3.13Å; G132-D134 PolarHBondContact O-N 3.19Å; G132-D135 PolarHBondContact N-OD2 3.22Å; G132-D135 PolarHBondContact O-N 3.5Å
133K86.4Confident83.4Confident152 Ų15261.8 Ų61.866%0.66134%0.343SS*.THydrogen-bonded Turntrans-61.9-25.5178.8-172.6178.4175.7-175.10113.3D135 L136 F254K133-D135 PolarHBondContact O-N 3.23Å; K133-L136 WeakPolarHBondContact O-CG 3.24Å; K133-F254 HydrophobicContact CB-CE1 3.89Å; K133-F254 HydrophobicContact CB-CZ 3.81Å; K133-F254 HydrophobicContact CG-CE1 4.26Å; K133-F254 HydrophobicContact CG-CZ 4.42Å
134D87.3Confident80.7Confident92 Ų9268.8 Ų68.849%0.49237%0.372SS..THydrogen-bonded Turntrans-80.6-2.8177.8-56-37.9000112.7G132 A139G132-D134 PolarHBondContact O-N 3.19Å; D134-A139 VanDerWaalsContact O-CB 3.3Å; D134-A139 WeakPolarHBondContact O-CB 3.38Å
135D89.1Confident77.9Confident22 Ų2265.8 Ų65.812%0.11838%0.376CS..  trans-104.437.3179.5-56.4-63.5000111.7A131 G132 K133 R158 V161 F162A131-D135 WeakPolarHBondContact CA-OD2 3.44Å; A131-D135 HydrophobicContact CB-CB 4.36Å; G132-D135 PolarHBondContact N-OD2 3.22Å; G132-D135 PolarHBondContact O-N 3.5Å; K133-D135 PolarHBondContact O-N 3.23Å; D135-R158 IonicContact OD1-CZ 2.59Å; D135-R158 IonicContact OD1-NE 3.64Å; D135-R158 IonicContact OD1-NH1 2.85Å; D135-R158 PolarHBondContact OD1-NH1 3.01Å; D135-V161 HydrophobicContact CB-CG1 4.15Å; D135-V161 HydrophobicContact CB-CG2 4.06Å; D135-F162 WeakPolarHBondContact O-CE1 3.46Å; D135-F162 WeakPolarHBondContact O-CZ 3.47Å
136L93Very high75.1Confident22 Ų2269.9 Ų69.912%0.11541%0.411CS..SBendtrans-83.1157.5167.5-59.9171.4000110.5K133 G138 A139 A298 N299 R324K133-L136 WeakPolarHBondContact O-CG 3.24Å; L136-G138 PolarHBondContact O-N 3.29Å; L136-A139 HydrophobicContact CB-CB 3.91Å; L136-A139 WeakPolarHBondContact O-CB 3.41Å; L136-A139 PolarHBondContact O-N 3.44Å; L136-A139 VanDerWaalsContact O-N 3.1Å; L136-A298 HydrophobicContact CD1-CB 4.27Å; L136-A298 HydrophobicContact CD2-CB 3.94Å; L136-N299 WeakPolarHBondContact CA-OD1 3.18Å; L136-R324 PolarHBondContact O-NH1 2.94Å
137L91.5Very high72.1Confident0 Ų068.1 Ų68.10%042%0.423CS..THydrogen-bonded Turntrans-52.1-54.4-178.8-73.5176.8000111.4F162 N299 F303 I321 R324 F328 L351L137-F162 HydrophobicContact CD2-CD1 3.62Å; L137-F162 HydrophobicContact CD2-CE1 3.59Å; L137-F162 HydrophobicContact CD2-CG 4.2Å; L137-F162 HydrophobicContact CD2-CZ 4.15Å; L137-F162 HydrophobicContact CG-CD1 4.42Å; L137-F162 HydrophobicContact CG-CE1 4.03Å; L137-N299 HydrophobicContact CD1-CB 4.02Å; L137-N299 HydrophobicContact CG-CB 4.23Å; L137-N299 WeakPolarHBondContact CG-OD1 3.17Å; L137-N299 PolarHBondContact N-OD1 3.21Å; L137-F303 HydrophobicContact CB-CE2 3.79Å; L137-F303 HydrophobicContact CB-CZ 3.94Å; L137-F303 HydrophobicContact CD1-CE2 3.56Å; L137-F303 HydrophobicContact CD1-CZ 4.06Å; L137-F303 HydrophobicContact CG-CE2 4.32Å; L137-I321 WeakPolarHBondContact O-CG1 3.45Å; L137-R324 VanDerWaalsContact CD2-C 3.47Å; L137-R324 HydrophobicContact CD2-CB 3.77Å; L137-R324 WeakPolarHBondContact CD2-O 3.5Å; L137-F328 HydrophobicContact CD1-CD1 3.92Å; L137-F328 HydrophobicContact CD1-CE1 4.49Å; L137-F328 HydrophobicContact CD2-CB 4.01Å; L137-F328 HydrophobicContact CD2-CD1 4.45Å; L137-F328 HydrophobicContact CD2-CG 4.4Å; L137-L351 HydrophobicContact CD1-CD2 3.81Å
138G89.1Confident69.9Low5 Ų572.4 Ų72.45%0.05245%0.447CS..THydrogen-bonded Turntrans-89.13.117800000115.2L136 L140 S302 I321L136-G138 PolarHBondContact O-N 3.29Å; G138-L140 PolarHBondContact O-N 2.87Å; G138-L140 VanDerWaalsContact O-N 3.1Å; G138-S302 WeakPolarHBondContact CA-OG 3.44Å; G138-S302 PolarHBondContact N-OG 3.29Å; G138-I321 VanDerWaalsContact CA-CD1 3.49Å
139A87.2Confident68Low18 Ų1873.7 Ų73.715%0.14945%0.45CS..  trans-64.3118.2170.400000108.4D134 L136 D141 R324D134-A139 VanDerWaalsContact O-CB 3.3Å; D134-A139 WeakPolarHBondContact O-CB 3.38Å; L136-A139 HydrophobicContact CB-CB 3.91Å; L136-A139 WeakPolarHBondContact O-CB 3.41Å; L136-A139 PolarHBondContact O-N 3.44Å; L136-A139 VanDerWaalsContact O-N 3.1Å; A139-D141 PolarHBondContact O-N 3.2Å; A139-R324 PolarHBondContact O-NH1 3.2Å
140L79.7Confident65.9Low53 Ų5381.8 Ų81.828%0.27748%0.478SS..  trans-57.9144.2166.3-63.8-172.3000108.3G138 S142 L306 Q310 F320G138-L140 PolarHBondContact O-N 2.87Å; G138-L140 VanDerWaalsContact O-N 3.1Å; L140-S142 VanDerWaalsContact C-N 3.29Å; L140-S142 PolarHBondContact O-N 2.89Å; L140-L306 HydrophobicContact CD2-CD1 3.85Å; L140-L306 HydrophobicContact CG-CD1 4.29Å; L140-Q310 HydrophobicContact CD1-CB 3.68Å; L140-Q310 VanDerWaalsContact CD1-CD 3.41Å; L140-Q310 HydrophobicContact CD1-CG 4Å; L140-Q310 HydrophobicContact CD2-CB 4.33Å; L140-F320 HydrophobicContact CD2-CE1 4.3Å; L140-F320 HydrophobicContact CD2-CZ 3.84Å
141D66.4Low63.7Low98 Ų9882 Ų8252%0.52449%0.487SS..  trans-54.8110.7160-73.3-24.6000105.2A139 G143 R324A139-D141 PolarHBondContact O-N 3.2Å; D141-G143 PolarHBondContact O-N 3.32Å; D141-R324 IonicContact OD1-CZ 3.59Å; D141-R324 IonicContact OD1-NH2 2.75Å; D141-R324 PolarHBondContact OD1-NH2 2.96Å; D141-R324 IonicContact OD2-NH2 3.49Å
142S49.9Very low61.1Low85 Ų8590.3 Ų90.359%0.59452%0.52SS*.  trans-58.488.6160-730000103.4L140 K144L140-S142 VanDerWaalsContact C-N 3.29Å; L140-S142 PolarHBondContact O-N 2.89Å; S142-K144 PolarHBondContact O-N 2.96Å
143G44.9Very low58.5Low63 Ų6395.3 Ų95.365%0.64955%0.548SS*.  trans-52.3103.7160.100000101.9D141 A145D141-G143 PolarHBondContact O-N 3.32Å; G143-A145 PolarHBondContact O-N 2.85Å
144K40.7Very low56Low185 Ų18591.6 Ų91.680%0.80454%0.541SS*.  trans-44.3102.4149.4-79.7-179.1177176.10102.2S142 A146S142-K144 PolarHBondContact O-N 2.96Å; K144-A146 PolarHBondContact O-N 3.37Å
145A36.8Very low53.5Low92 Ų9292.8 Ų92.876%0.7656%0.557SS**  trans-41.5123.7169.400000103.8G143 G147G143-A145 PolarHBondContact O-N 2.85Å; A145-G147 PolarHBondContact O-N 3.42Å
146A37.2Very low51.1Low94 Ų9496.6 Ų96.678%0.77758%0.576SS**  trans-64.570.9176.700000107.8K144 L148K144-A146 PolarHBondContact O-N 3.37Å; A146-L148 PolarHBondContact O-N 3.4Å
147G29.6Very low48.4Very low57 Ų57100 Ų10059%0.58860%0.602SS**  trans-64.2117.7159.100000104.5A145 F149A145-G147 PolarHBondContact O-N 3.42Å; G147-F149 PolarHBondContact O-N 3.23Å
148L44.8Very low46.5Very low156 Ų156106.5 Ų106.582%0.81763%0.627SS**THydrogen-bonded Turntrans-56.18.8-170.5-107.368.8000116.1A146A146-L148 PolarHBondContact O-N 3.4Å
149F42.8Very low44.7Very low183 Ų183107.4 Ų107.480%0.80363%0.633SS**THydrogen-bonded Turntrans-135.316.7-165.9-71.2-73.4000117.1G147G147-F149 PolarHBondContact O-N 3.23Å
150Y34.4Very low44Very low232 Ų232109.8 Ų109.891%0.9165%0.647SS**SBendtrans-124.7128166.4-91.7-89.9000113.7
151G32.8Very low44.3Very low72 Ų72108.3 Ų108.374%0.74264%0.64SS**  trans-63.6164.3-163.600000115.7
152K31Very low45.4Very low191 Ų191104.4 Ų104.483%0.8362%0.619SS**SBendtrans13.6117179.3-76.1-178.2177.2178.80114.3S154K152-S154 VanDerWaalsContact C-N 3.34Å; K152-S154 PolarHBondContact O-N 3.1Å
153P34.8Very low47.3Very low129 Ų129101.5 Ų101.584%0.83860%0.598SS**  trans-51.9109.8169.423.5-30.7000106S155P153-S155 PolarHBondContact O-N 2.82Å
154S33.7Very low49.5Very low74 Ų7499.2 Ų99.252%0.51757%0.571SS.*  trans-67.788.7175.460.50000103.1K152 L156K152-S154 VanDerWaalsContact C-N 3.34Å; K152-S154 PolarHBondContact O-N 3.1Å; S154-L156 PolarHBondContact O-N 3.41Å
155S35Very low51.8Low118 Ų11893.9 Ų93.983%0.82556%0.562SS**  trans-6260.4155.2176.30000105.9P153 S157P153-S155 PolarHBondContact O-N 2.82Å; S155-S157 VanDerWaalsContact C-N 3.26Å; S155-S157 PolarHBondContact O-N 3.48Å; S155-S157 VanDerWaalsContact O-N 3.09Å
156L38.7Very low54.3Low101 Ų10195 Ų9553%0.52956%0.555SS.*  trans-68.2106.2157.6-69168.3000101.1S154 R158S154-L156 PolarHBondContact O-N 3.41Å; L156-R158 PolarHBondContact O-N 3.35Å
157S34.6Very low57Low93 Ų9391.2 Ų91.265%0.6552%0.521SS*.  trans-41.983.6160.4159.20000107.9S155 A159S155-S157 VanDerWaalsContact C-N 3.26Å; S155-S157 PolarHBondContact O-N 3.48Å; S155-S157 VanDerWaalsContact O-N 3.09Å; S157-A159 PolarHBondContact O-N 3.35Å
158R51.9Low60.1Low138 Ų13890.2 Ų90.252%0.52150%0.501SS..  trans-56.3114.1168.7-73.6-169-169.6175.27.9103.6D135 L156D135-R158 IonicContact OD1-CZ 2.59Å; D135-R158 IonicContact OD1-NE 3.64Å; D135-R158 IonicContact OD1-NH1 2.85Å; D135-R158 PolarHBondContact OD1-NH1 3.01Å; L156-R158 PolarHBondContact O-N 3.35Å
159A52.4Low62.6Low23 Ų2384.3 Ų84.319%0.1947%0.474CS..  trans-47.2136.6170.400000106.4S157 V161S157-A159 PolarHBondContact O-N 3.35Å; A159-V161 VanDerWaalsContact C-N 3.29Å; A159-V161 WeakPolarHBondContact O-CG2 3.33Å; A159-V161 PolarHBondContact O-N 3.43Å
160P70.9Confident65.1Low69 Ų6975.8 Ų75.845%0.44844%0.437SS..  trans-68.594.7-169.629.6-36.5000108.9F162 S163P160-F162 PolarHBondContact O-N 3.4Å; P160-F162 VanDerWaalsContact O-N 3.09Å; P160-S163 WeakPolarHBondContact CB-OG 3.22Å; P160-S163 WeakPolarHBondContact CG-OG 3.44Å; P160-S163 PolarHBondContact O-N 3.41Å; P160-S163 VanDerWaalsContact O-N 3.07Å
161V85.9Confident68Low21 Ų2165.1 Ų65.113%0.12740%0.395CS..THydrogen-bonded Turntrans-55.2-33.4-171.2178.60000111.5A131 D135 A159A131-V161 HydrophobicContact CB-CB 4.33Å; A131-V161 HydrophobicContact CB-CG1 3.63Å; A131-V161 HydrophobicContact CB-CG2 3.75Å; D135-V161 HydrophobicContact CB-CG1 4.15Å; D135-V161 HydrophobicContact CB-CG2 4.06Å; A159-V161 VanDerWaalsContact C-N 3.29Å; A159-V161 WeakPolarHBondContact O-CG2 3.33Å; A159-V161 PolarHBondContact O-N 3.43Å
162F90.3Very high70.9Confident16 Ų1665.5 Ų65.57%0.0738%0.383CS..THydrogen-bonded Turntrans-98.8-14.7-175.7-54.9-61000113.6D135 L137 P160 I257 R324 E327 F328D135-F162 WeakPolarHBondContact O-CE1 3.46Å; D135-F162 WeakPolarHBondContact O-CZ 3.47Å; L137-F162 HydrophobicContact CD2-CD1 3.62Å; L137-F162 HydrophobicContact CD2-CE1 3.59Å; L137-F162 HydrophobicContact CD2-CG 4.2Å; L137-F162 HydrophobicContact CD2-CZ 4.15Å; L137-F162 HydrophobicContact CG-CD1 4.42Å; L137-F162 HydrophobicContact CG-CE1 4.03Å; P160-F162 PolarHBondContact O-N 3.4Å; P160-F162 VanDerWaalsContact O-N 3.09Å; F162-I257 VanDerWaalsContact C-CD1 3.49Å; F162-I257 WeakPolarHBondContact O-CD1 3.23Å; F162-R324 HydrophobicContact CD2-CB 3.78Å; F162-R324 HydrophobicContact CD2-CG 3.71Å; F162-R324 HydrophobicContact CE2-CB 3.93Å; F162-R324 HydrophobicContact CE2-CG 3.67Å; F162-R324 HydrophobicContact CG-CB 4.26Å; F162-E327 HydrophobicContact CB-CB 4.15Å; F162-E327 CarbonylContact O-C 3.02Å; F162-F328 HydrophobicContact CB-CB 3.99Å; F162-F328 HydrophobicContact CD1-CB 4.11Å; F162-F328 HydrophobicContact CD1-CD2 4.1Å; F162-F328 HydrophobicContact CD1-CG 4.22Å; F162-F328 HydrophobicContact CG-CB 4.43Å; F162-F328 WeakPolarHBondContact O-CA 3.13Å; F162-F328 PolarHBondContact O-N 3.49Å; F162-F328 VanDerWaalsContact O-N 3.15Å
163S90.1Very high74Confident24 Ų2461.5 Ų61.517%0.16838%0.375CS..  trans-98.1140.5-175.789.90000111.3P160P160-S163 WeakPolarHBondContact CB-OG 3.22Å; P160-S163 WeakPolarHBondContact CG-OG 3.44Å; P160-S163 PolarHBondContact O-N 3.41Å; P160-S163 VanDerWaalsContact O-N 3.07Å
164L91.1Very high76.9Confident16 Ų1657.6 Ų57.68%0.08435%0.347CS..  trans-74.6-36.9174.7-170.861.8000112.7N166 R167 D168 I257 L261 A331 T334 I335L164-N166 PolarHBondContact O-N 2.75Å; L164-N166 VanDerWaalsContact O-N 3.16Å; L164-R167 HydrophobicContact CD1-CB 4.28Å; L164-R167 VanDerWaalsContact O-CB 3.23Å; L164-R167 WeakPolarHBondContact O-CB 3.36Å; L164-R167 WeakPolarHBondContact O-CD 3.49Å; L164-R167 WeakPolarHBondContact O-CG 3.43Å; L164-R167 PolarHBondContact O-N 2.85Å; L164-D168 HydrophobicContact CD1-CB 4.33Å; L164-D168 HydrophobicContact CD2-CB 4.05Å; L164-D168 HydrophobicContact CG-CB 4.29Å; L164-I257 HydrophobicContact CD1-CG2 3.77Å; L164-L261 HydrophobicContact CD1-CD1 4.17Å; L164-L261 HydrophobicContact CD1-CD2 4.37Å; L164-A331 HydrophobicContact CB-CB 3.74Å; L164-T334 HydrophobicContact CD2-CG2 3.44Å; L164-T334 VanDerWaalsContact CD2-CG2 3.44Å; L164-I335 HydrophobicContact CD1-CD1 4.04Å; L164-I335 HydrophobicContact CD1-CG1 4.03Å; L164-I335 HydrophobicContact CD2-CG1 4.48Å
165A88.3Confident79.9Confident73 Ų7355.2 Ų55.260%0.60333%0.328SS*.THydrogen-bonded Turntrans47.7-117.4-169.400000111.1
166N90.9Very high82.7Confident115 Ų11555.2 Ų55.262%0.61532%0.315SS*.THydrogen-bonded Turntrans-109.214.9177.266.8-32.5000113.2L164 D168 S169L164-N166 PolarHBondContact O-N 2.75Å; L164-N166 VanDerWaalsContact O-N 3.16Å; N166-D168 VanDerWaalsContact C-OD1 3.31Å; N166-D168 PolarHBondContact O-N 2.92Å; N166-S169 VanDerWaalsContact O-CB 3.23Å; N166-S169 WeakPolarHBondContact O-CB 3.39Å; N166-S169 PolarHBondContact O-N 3.41Å; N166-S169 PolarHBondContact O-OG 3.49Å
167R93.9Very high85.5Confident15 Ų1551.6 Ų51.66%0.05730%0.3CS..THydrogen-bonded Turntrans-67-22.4-173.4-64.3172.465-178.17.1112.8L164 S169 V170 E195 D255 A258 L261L164-R167 HydrophobicContact CD1-CB 4.28Å; L164-R167 VanDerWaalsContact O-CB 3.23Å; L164-R167 WeakPolarHBondContact O-CB 3.36Å; L164-R167 WeakPolarHBondContact O-CD 3.49Å; L164-R167 WeakPolarHBondContact O-CG 3.43Å; L164-R167 PolarHBondContact O-N 2.85Å; R167-S169 PolarHBondContact O-N 2.72Å; R167-V170 VanDerWaalsContact O-CG1 3.25Å; R167-V170 WeakPolarHBondContact O-CG1 3.43Å; R167-V170 PolarHBondContact O-N 3.11Å; R167-E195 IonicContact CZ-OE1 3.26Å; R167-E195 IonicContact CZ-OE2 3.91Å; R167-E195 IonicContact NE-OE1 2.84Å; R167-E195 PolarHBondContact NE-OE1 3.24Å; R167-E195 IonicContact NE-OE2 3.61Å; R167-E195 VanDerWaalsContact NH2-CD 3.29Å; R167-E195 IonicContact NH2-OE1 2.66Å; R167-E195 PolarHBondContact NH2-OE1 3.03Å; R167-E195 VanDerWaalsContact NH2-OE1 3.14Å; R167-E195 IonicContact NH2-OE2 3.2Å; R167-E195 PolarHBondContact NH2-OE2 2.92Å; R167-D255 IonicContact CZ-OD1 3.11Å; R167-D255 IonicContact CZ-OD2 2.89Å; R167-D255 IonicContact NH1-OD1 2.72Å; R167-D255 PolarHBondContact NH1-OD1 2.78Å; R167-D255 VanDerWaalsContact NH1-OD1 3.11Å; R167-D255 IonicContact NH1-OD2 3.98Å; R167-D255 PolarHBondContact NH1-OD2 3.37Å; R167-D255 IonicContact NH2-OD1 3.21Å; R167-D255 PolarHBondContact NH2-OD1 3.48Å; R167-D255 IonicContact NH2-OD2 3.9Å; R167-D255 PolarHBondContact NH2-OD2 3.29Å; R167-A258 VanDerWaalsContact NH2-CB 3.34Å; R167-L261 HydrophobicContact CB-CD1 3.73Å
168D94.2Very high88.4Confident35 Ų3552.8 Ų52.819%0.18731%0.306CS..THydrogen-bonded Turntrans-64.6-16.8171.964.7-54.6000113.6L164 N166 V170 I171 T172 L261 I338L164-D168 HydrophobicContact CD1-CB 4.33Å; L164-D168 HydrophobicContact CD2-CB 4.05Å; L164-D168 HydrophobicContact CG-CB 4.29Å; N166-D168 VanDerWaalsContact C-OD1 3.31Å; N166-D168 PolarHBondContact O-N 2.92Å; D168-V170 PolarHBondContact O-N 2.92Å; D168-V170 VanDerWaalsContact O-N 3.07Å; D168-I171 PolarHBondContact O-N 2.88Å; D168-T172 PolarHBondContact O-N 2.94Å; D168-T172 VanDerWaalsContact O-N 3.09Å; D168-T172 PolarHBondContact O-OG1 3.43Å; D168-L261 HydrophobicContact CB-CD2 4.48Å; D168-I338 HydrophobicContact CB-CD1 4.07Å
169S95.9Very high90.6Very high33 Ų3348.4 Ų48.423%0.23129%0.294CS..Hα-helixtrans-53.5-30.6173.582.10000112.2N166 R167 I171 T172 T173 D174N166-S169 VanDerWaalsContact O-CB 3.23Å; N166-S169 WeakPolarHBondContact O-CB 3.39Å; N166-S169 PolarHBondContact O-N 3.41Å; N166-S169 PolarHBondContact O-OG 3.49Å; R167-S169 PolarHBondContact O-N 2.72Å; S169-I171 PolarHBondContact O-N 3.5Å; S169-I171 VanDerWaalsContact O-N 3.08Å; S169-T172 WeakPolarHBondContact CA-OG1 3.44Å; S169-T172 PolarHBondContact O-N 2.63Å; S169-T173 PolarHBondContact O-N 3.13Å; S169-D174 WeakPolarHBondContact CB-OD2 3.25Å; S169-D174 PolarHBondContact O-N 3.46Å; S169-D174 PolarHBondContact OG-OD2 3.18Å
170V96.7Very high92.8Very high4 Ų448.1 Ų48.12%0.02429%0.289CS..Hα-helixtrans-57.7-25.417879.20000113.1R167 D168 L175 E195 R199 L261 I265R167-V170 VanDerWaalsContact O-CG1 3.25Å; R167-V170 WeakPolarHBondContact O-CG1 3.43Å; R167-V170 PolarHBondContact O-N 3.11Å; D168-V170 PolarHBondContact O-N 2.92Å; D168-V170 VanDerWaalsContact O-N 3.07Å; V170-L175 WeakPolarHBondContact O-CA 3.25Å; V170-L175 PolarHBondContact O-N 3.16Å; V170-E195 HydrophobicContact CB-CG 4.45Å; V170-E195 HydrophobicContact CG1-CB 4.44Å; V170-E195 HydrophobicContact CG1-CG 3.9Å; V170-R199 HydrophobicContact CG2-CB 3.74Å; V170-R199 HydrophobicContact CG2-CG 3.96Å; V170-L261 HydrophobicContact CG1-CB 4.4Å; V170-I265 HydrophobicContact CG1-CD1 3.97Å; V170-I265 HydrophobicContact CG1-CG1 4.42Å; V170-I265 HydrophobicContact CG2-CD1 4Å
171I95.4Very high94Very high7 Ų749.1 Ų49.14%0.03629%0.294CS..Hα-helixtrans-103-42.6177.9-56.5158.2000111D168 S169 L261 Q264 I265 K268 I338D168-I171 PolarHBondContact O-N 2.88Å; S169-I171 PolarHBondContact O-N 3.5Å; S169-I171 VanDerWaalsContact O-N 3.08Å; I171-L261 HydrophobicContact CD1-CB 4.4Å; I171-L261 HydrophobicContact CD1-CD2 3.4Å; I171-L261 VanDerWaalsContact CD1-CD2 3.4Å; I171-L261 HydrophobicContact CG1-CD2 4.43Å; I171-Q264 HydrophobicContact CD1-CB 3.45Å; I171-Q264 VanDerWaalsContact CD1-CB 3.45Å; I171-Q264 HydrophobicContact CD1-CG 4.09Å; I171-Q264 HydrophobicContact CG1-CB 4.22Å; I171-I265 HydrophobicContact CG1-CG1 4.05Å; I171-K268 HydrophobicContact CG2-CG 4.01Å; I171-I338 HydrophobicContact CD1-CD1 4.09Å; I171-I338 HydrophobicContact CG2-CG2 3.68Å
172T93.8Very high94.5Very high81 Ų8149.1 Ų49.150%0.49729%0.294SS..Hα-helixtrans-79.8-34.7-170.859.30000113D168 S169 I338D168-T172 PolarHBondContact O-N 2.94Å; D168-T172 VanDerWaalsContact O-N 3.09Å; D168-T172 PolarHBondContact O-OG1 3.43Å; S169-T172 WeakPolarHBondContact CA-OG1 3.44Å; S169-T172 PolarHBondContact O-N 2.63Å; T172-I338 HydrophobicContact CG2-CD1 4.22Å; T172-I338 HydrophobicContact CG2-CG1 4.45Å
173T95.1Very high94.7Very high106 Ų10654.1 Ų54.165%0.6532%0.317SS*.THydrogen-bonded Turntrans-122.3-43-173.1-51.30000112.1S169S169-T173 PolarHBondContact O-N 3.13Å
174D96.6Very high95Very high47 Ų4755.4 Ų55.425%0.25133%0.33SS..SBendtrans-98.89.4-166-46.7-47.6000114S169 E176 A177 R199S169-D174 WeakPolarHBondContact CB-OD2 3.25Å; S169-D174 PolarHBondContact O-N 3.46Å; S169-D174 PolarHBondContact OG-OD2 3.18Å; D174-E176 VanDerWaalsContact C-N 3.29Å; D174-E176 PolarHBondContact O-N 3.02Å; D174-A177 HydrophobicContact CB-CB 3.97Å; D174-A177 WeakPolarHBondContact O-CB 3.41Å; D174-A177 PolarHBondContact O-N 3.07Å; D174-A177 VanDerWaalsContact O-N 3.12Å; D174-R199 WeakPolarHBondContact O-CD 3.35Å; D174-R199 PolarHBondContact O-NE 3.26Å
175L95.4Very high95.3Very high24 Ų2455 Ų5513%0.12633%0.329CS..THydrogen-bonded Turntrans-57.2-41.3-173-176.569.1000112.5V170 K268 Y269V170-L175 WeakPolarHBondContact O-CA 3.25Å; V170-L175 PolarHBondContact O-N 3.16Å; L175-K268 HydrophobicContact CD1-CB 4.12Å; L175-K268 HydrophobicContact CD2-CB 3.78Å; L175-K268 HydrophobicContact CD2-CG 4.24Å; L175-Y269 HydrophobicContact CD1-CD1 4.31Å; L175-Y269 HydrophobicContact CD1-CE1 3.74Å; L175-Y269 HydrophobicContact CD1-CE2 4.37Å; L175-Y269 HydrophobicContact CG-CE1 3.88Å; L175-Y269 PolarHBondContact O-OH 3Å
176E94.7Very high95.6Very high118 Ų11856.6 Ų56.655%0.55133%0.327SS*.THydrogen-bonded Turntrans-111.815.2177-62.7-174.6-129.400112.1D174 Y203D174-E176 VanDerWaalsContact C-N 3.29Å; D174-E176 PolarHBondContact O-N 3.02Å; E176-Y203 HydrophobicContact CB-CE2 4.16Å; E176-Y203 HydrophobicContact CG-CE2 3.98Å
177A96.4Very high95.9Very high26 Ų2657.6 Ų57.622%0.21533%0.328CS..SBendtrans-65.4155.1176.300000111D174 V179D174-A177 HydrophobicContact CB-CB 3.97Å; D174-A177 WeakPolarHBondContact O-CB 3.41Å; D174-A177 PolarHBondContact O-N 3.07Å; D174-A177 VanDerWaalsContact O-N 3.12Å; A177-V179 PolarHBondContact O-N 2.65Å
178P97.2Very high96Very high118 Ų11860.4 Ų60.477%0.76635%0.35SS*.PPolyproline II helixtrans-49.3140.8177.6-28.535.4000113
179V97.4Very high96Very high46 Ų4667.4 Ų67.428%0.27938%0.379SS..PPolyproline II helixtrans-63.1150.1178.4-60.50000110.8F118 A177 V181 S200 Y203 A204F118-V179 HydrophobicContact CZ-CB 4.4Å; A177-V179 PolarHBondContact O-N 2.65Å; V179-V181 PolarHBondContact O-N 3.43Å; V179-S200 WeakPolarHBondContact CA-OG 3.41Å; V179-S200 WeakPolarHBondContact CB-OG 3.32Å; V179-Y203 HydrophobicContact CG1-CD1 3.84Å; V179-A204 HydrophobicContact CG1-CB 4.1Å
180I97.9Very high95.9Very high16 Ų1668.6 Ų68.68%0.08238%0.384CS..PPolyproline II helixtrans-62.9120.8178.5-61.2167.1000108.6L122 L125 P182 A185 F192 S200L122-I180 HydrophobicContact CD2-CB 3.72Å; L122-I180 HydrophobicContact CD2-CG2 3.54Å; L125-I180 HydrophobicContact CD1-CG2 4.31Å; I180-P182 VanDerWaalsContact O-CD 3.25Å; I180-P182 WeakPolarHBondContact O-CD 3.23Å; I180-A185 HydrophobicContact CG2-CB 4.13Å; I180-F192 HydrophobicContact CD1-CB 4.5Å; I180-F192 HydrophobicContact CD1-CD1 3.79Å; I180-F192 HydrophobicContact CD1-CD2 4.09Å; I180-F192 HydrophobicContact CD1-CE1 3.96Å; I180-F192 HydrophobicContact CD1-CE2 4.24Å; I180-F192 HydrophobicContact CD1-CG 3.86Å; I180-F192 HydrophobicContact CD1-CZ 4.18Å; I180-F192 HydrophobicContact CG1-CD1 4.47Å; I180-F192 HydrophobicContact CG1-CE1 4.14Å; I180-F192 HydrophobicContact CG1-CZ 4.18Å; I180-F192 HydrophobicContact CG2-CD2 4.37Å; I180-F192 HydrophobicContact CG2-CE2 3.71Å; I180-F192 HydrophobicContact CG2-CZ 3.87Å; I180-S200 PolarHBondContact N-OG 3.2Å
181V97.2Very high95.8Very high90 Ų9072 Ų7255%0.54540%0.399SS..  trans-84.3108.7174.5179.80000108.4V179 H183 A184 A185V179-V181 PolarHBondContact O-N 3.43Å; V181-H183 VanDerWaalsContact C-N 3.31Å; V181-H183 PolarHBondContact O-N 2.71Å; V181-A184 HydrophobicContact CB-CB 4.07Å; V181-A184 HydrophobicContact CG1-CB 4Å; V181-A184 PolarHBondContact O-N 2.92Å; V181-A185 PolarHBondContact O-N 3.21Å; V181-A185 VanDerWaalsContact O-N 3.07Å
182P96.2Very high95.8Very high21 Ų2173.9 Ų73.914%0.13641%0.407CS..Hα-helixtrans-62.8-36.5-166.2-22.832.4000113.8F118 R121 L122 L125 I180 D186F118-P182 HydrophobicContact CD2-CG 3.91Å; F118-P182 HydrophobicContact CE2-CG 3.92Å; R121-P182 HydrophobicContact CB-CB 3.74Å; R121-P182 HydrophobicContact CB-CG 4.14Å; L122-P182 HydrophobicContact CD2-CB 4.36Å; L122-P182 HydrophobicContact CD2-CG 3.86Å; L122-P182 HydrophobicContact CG-CG 4.4Å; L125-P182 HydrophobicContact CD1-CB 4.32Å; I180-P182 VanDerWaalsContact O-CD 3.25Å; I180-P182 WeakPolarHBondContact O-CD 3.23Å; P182-D186 VanDerWaalsContact O-CB 3.27Å; P182-D186 WeakPolarHBondContact O-CB 3.39Å; P182-D186 PolarHBondContact O-N 3.03Å
183H95.1Very high95.8Very high121 Ų12172.5 Ų72.556%0.5640%0.395SS*.Hα-helixtrans-71-40-179.6-171.552.2000112.6V181 D186 Q187V181-H183 VanDerWaalsContact C-N 3.31Å; V181-H183 PolarHBondContact O-N 2.71Å; H183-D186 PolarHBondContact O-N 3.07Å; H183-Q187 PolarHBondContact CD2-NE2 3.35Å; H183-Q187 VanDerWaalsContact CD2-NE2 3.34Å; H183-Q187 PolarHBondContact CE1-NE2 3.29Å; H183-Q187 PolarHBondContact NE2-NE2 3.11Å; H183-Q187 WeakPolarHBondContact O-CB 3.44Å; H183-Q187 VanDerWaalsContact O-CG 3.3Å; H183-Q187 WeakPolarHBondContact O-CG 3.26Å; H183-Q187 PolarHBondContact O-N 3.4Å
184A96.7Very high95.9Very high52 Ų5268.1 Ų68.143%0.4337%0.367SS..Hα-helixtrans-65-44.8177.600000110.6V181 D186 Q187 S188V181-A184 HydrophobicContact CB-CB 4.07Å; V181-A184 HydrophobicContact CG1-CB 4Å; V181-A184 PolarHBondContact O-N 2.92Å; A184-D186 PolarHBondContact O-N 3.27Å; A184-Q187 PolarHBondContact O-N 3.1Å; A184-S188 PolarHBondContact O-N 2.77Å; A184-S188 PolarHBondContact O-OG 2.92Å; A184-S188 VanDerWaalsContact O-OG 3.09Å
185A96.6Very high95.9Very high7 Ų766.1 Ų66.16%0.05836%0.356CS..Hα-helixtrans-63.3-39.4176.500000113.3L125 I180 V181 S188 K189 T190 F192L125-A185 HydrophobicContact CD1-CB 3.66Å; L125-A185 HydrophobicContact CD2-CB 4.33Å; I180-A185 HydrophobicContact CG2-CB 4.13Å; V181-A185 PolarHBondContact O-N 3.21Å; V181-A185 VanDerWaalsContact O-N 3.07Å; A185-S188 WeakPolarHBondContact CA-OG 3.45Å; A185-S188 CarbonylContact O-C 3.42Å; A185-S188 PolarHBondContact O-N 3.26Å; A185-S188 PolarHBondContact O-OG 3.36Å; A185-S188 VanDerWaalsContact O-OG 3.13Å; A185-K189 PolarHBondContact O-N 3.37Å; A185-T190 PolarHBondContact O-N 3.04Å; A185-F192 HydrophobicContact CB-CE2 3.77Å; A185-F192 HydrophobicContact CB-CZ 4.26Å
186D95.2Very high96Very high107 Ų10765.6 Ų65.657%0.57236%0.355SS*.Hα-helixtrans-66.2-43.1176.7-168.549.4000111.3L125 P182 H183 A184 S188 K189L125-D186 HydrophobicContact CD2-CB 4.15Å; P182-D186 VanDerWaalsContact O-CB 3.27Å; P182-D186 WeakPolarHBondContact O-CB 3.39Å; P182-D186 PolarHBondContact O-N 3.03Å; H183-D186 PolarHBondContact O-N 3.07Å; A184-D186 PolarHBondContact O-N 3.27Å; D186-S188 PolarHBondContact O-N 3.14Å; D186-K189 PolarHBondContact O-N 2.85Å; D186-K189 VanDerWaalsContact O-N 3.09Å
187Q95.6Very high96.1Very high135 Ų13560 Ų6063%0.63133%0.329SS*.Hα-helixtrans-61.6-41.7174.6-74.6-178.35.600112.5H183 A184 K189H183-Q187 PolarHBondContact CD2-NE2 3.35Å; H183-Q187 VanDerWaalsContact CD2-NE2 3.34Å; H183-Q187 PolarHBondContact CE1-NE2 3.29Å; H183-Q187 PolarHBondContact NE2-NE2 3.11Å; H183-Q187 WeakPolarHBondContact O-CB 3.44Å; H183-Q187 VanDerWaalsContact O-CG 3.3Å; H183-Q187 WeakPolarHBondContact O-CG 3.26Å; H183-Q187 PolarHBondContact O-N 3.4Å; A184-Q187 PolarHBondContact O-N 3.1Å; Q187-K189 PolarHBondContact O-N 2.84Å
188S96Very high96.2Very high74 Ų7458.8 Ų58.852%0.51732%0.319SS..THydrogen-bonded Turntrans-79.7-0.3176.663.70000113.6A184 A185 D186 T190A184-S188 PolarHBondContact O-N 2.77Å; A184-S188 PolarHBondContact O-OG 2.92Å; A184-S188 VanDerWaalsContact O-OG 3.09Å; A185-S188 WeakPolarHBondContact CA-OG 3.45Å; A185-S188 CarbonylContact O-C 3.42Å; A185-S188 PolarHBondContact O-N 3.26Å; A185-S188 PolarHBondContact O-OG 3.36Å; A185-S188 VanDerWaalsContact O-OG 3.13Å; D186-S188 PolarHBondContact O-N 3.14Å; S188-T190 PolarHBondContact O-N 3.21Å; S188-T190 VanDerWaalsContact O-N 3.16Å; S188-T190 PolarHBondContact OG-OG1 3.32Å
189K94.1Very high96.2Very high183 Ų18354 Ų5480%0.79629%0.286SS*.THydrogen-bonded Turntrans52.630.5-174.5-58-178.8178.6179.30113.1A185 D186 Q187A185-K189 PolarHBondContact O-N 3.37Å; D186-K189 PolarHBondContact O-N 2.85Å; D186-K189 VanDerWaalsContact O-N 3.09Å; Q187-K189 PolarHBondContact O-N 2.84Å
190T94.9Very high96.3Very high57 Ų5751.9 Ų51.935%0.3527%0.272SS..  trans-78.7126.7-179.4-550000109.7A185 S188 F192A185-T190 PolarHBondContact O-N 3.04Å; S188-T190 PolarHBondContact O-N 3.21Å; S188-T190 VanDerWaalsContact O-N 3.16Å; S188-T190 PolarHBondContact OG-OG1 3.32Å; T190-F192 HydrophobicContact CG2-CE1 4.06Å; T190-F192 HydrophobicContact CG2-CE2 3.89Å; T190-F192 HydrophobicContact CG2-CZ 3.58Å
191K94.5Very high96.3Very high75 Ų7551.1 Ų51.133%0.32627%0.269SS..  trans-104.2152.1174.5-60.9-66.3-165.2152.60110.2L125 E128L125-K191 CarbonylContact O-C 3.6Å; L125-K191 WeakPolarHBondContact O-CA 3.43Å; E128-K191 IonicContact OE1-NZ 3.11Å; E128-K191 PolarHBondContact OE1-NZ 2.77Å
192F95Very high96.2Very high48 Ų4846.8 Ų46.821%0.21124%0.243CC..BIsolated β-bridgetrans-128.3149.2-176.4-61.2-87.5000112L125 R126 H127 I180 A185 T190 A196 I197L125-F192 HydrophobicContact CB-CD2 4.09Å; L125-F192 PolarHBondContact O-N 2.92Å; R126-F192 WeakPolarHBondContact CA-O 3.48Å; H127-F192 PolarHBondContact CD2-O 3.03Å; H127-F192 PolarHBondContact N-O 3.3Å; H127-F192 VanDerWaalsContact N-O 3.13Å; I180-F192 HydrophobicContact CD1-CB 4.5Å; I180-F192 HydrophobicContact CD1-CD1 3.79Å; I180-F192 HydrophobicContact CD1-CD2 4.09Å; I180-F192 HydrophobicContact CD1-CE1 3.96Å; I180-F192 HydrophobicContact CD1-CE2 4.24Å; I180-F192 HydrophobicContact CD1-CG 3.86Å; I180-F192 HydrophobicContact CD1-CZ 4.18Å; I180-F192 HydrophobicContact CG1-CD1 4.47Å; I180-F192 HydrophobicContact CG1-CE1 4.14Å; I180-F192 HydrophobicContact CG1-CZ 4.18Å; I180-F192 HydrophobicContact CG2-CD2 4.37Å; I180-F192 HydrophobicContact CG2-CE2 3.71Å; I180-F192 HydrophobicContact CG2-CZ 3.87Å; A185-F192 HydrophobicContact CB-CE2 3.77Å; A185-F192 HydrophobicContact CB-CZ 4.26Å; T190-F192 HydrophobicContact CG2-CE1 4.06Å; T190-F192 HydrophobicContact CG2-CE2 3.89Å; T190-F192 HydrophobicContact CG2-CZ 3.58Å; F192-A196 HydrophobicContact CB-CB 4.33Å; F192-A196 HydrophobicContact CD1-CB 4.35Å; F192-I197 HydrophobicContact CB-CD1 4.24Å; F192-I197 HydrophobicContact CB-CG1 3.99Å
193H94.7Very high96.2Very high52 Ų5248.9 Ų48.924%0.24125%0.248CC..  trans-70.7160.6165.9-62.5100.8000110.9H127 E195 A196 I197H127-H193 AromaticContact CD2-CD2 3.76Å; H127-H193 AromaticContact CD2-CG 3.94Å; H127-H193 AromaticContact CD2-NE2 3.83Å; H127-H193 AromaticContact NE2-CE1 3.79Å; H127-H193 AromaticContact NE2-ND1 3.97Å; H127-H193 AromaticContact NE2-NE2 3.96Å; H193-E195 VanDerWaalsContact CB-CD 3.46Å; H193-E195 WeakPolarHBondContact CB-OE1 3.42Å; H193-E195 WeakPolarHBondContact CB-OE2 3.48Å; H193-E195 IonicContact CG-OE1 2.71Å; H193-E195 PolarHBondContact O-N 3.18Å; H193-A196 PolarHBondContact O-N 2.92Å; H193-I197 PolarHBondContact O-N 2.9Å
194F95.8Very high96.2Very high14 Ų1443.3 Ų43.36%0.06122%0.223CC..Hα-helixtrans-59.3-43.8-174.2171.8-98.1000112.5A196 I197 F198 F246 I250 A258 L259F194-A196 VanDerWaalsContact C-N 3.29Å; F194-A196 PolarHBondContact O-N 3.47Å; F194-I197 PolarHBondContact O-N 3.44Å; F194-F198 HydrophobicContact CE1-CB 4.29Å; F194-F198 HydrophobicContact CE1-CD2 4.23Å; F194-F198 HydrophobicContact CE1-CG 4.49Å; F194-F198 HydrophobicContact CZ-CB 4.5Å; F194-F198 HydrophobicContact CZ-CD2 4.09Å; F194-F198 WeakPolarHBondContact O-CB 3.26Å; F194-F198 PolarHBondContact O-N 2.85Å; F194-F246 AromaticContact CE2-CD1 3.94Å; F194-F246 HydrophobicContact CE2-CD1 3.94Å; F194-F246 HydrophobicContact CE2-CE1 4.25Å; F194-F246 AromaticContact CZ-CD1 3.91Å; F194-F246 HydrophobicContact CZ-CD1 3.91Å; F194-F246 HydrophobicContact CZ-CE1 4.41Å; F194-I250 HydrophobicContact CZ-CG1 4.18Å; F194-A258 HydrophobicContact CB-CB 4.07Å; F194-A258 HydrophobicContact CD1-CB 4.08Å; F194-L259 HydrophobicContact CE1-CD2 4.23Å
195E97Very high96.1Very high4 Ų440.8 Ų40.82%0.01920%0.203CC..Hα-helixtrans-62.8-32.2-178.866.7-78.2-175.500113.1R167 V170 H193 F198 R199 A258 L261 I265R167-E195 IonicContact CZ-OE1 3.26Å; R167-E195 IonicContact CZ-OE2 3.91Å; R167-E195 IonicContact NE-OE1 2.84Å; R167-E195 PolarHBondContact NE-OE1 3.24Å; R167-E195 IonicContact NE-OE2 3.61Å; R167-E195 VanDerWaalsContact NH2-CD 3.29Å; R167-E195 IonicContact NH2-OE1 2.66Å; R167-E195 PolarHBondContact NH2-OE1 3.03Å; R167-E195 VanDerWaalsContact NH2-OE1 3.14Å; R167-E195 IonicContact NH2-OE2 3.2Å; R167-E195 PolarHBondContact NH2-OE2 2.92Å; V170-E195 HydrophobicContact CB-CG 4.45Å; V170-E195 HydrophobicContact CG1-CB 4.44Å; V170-E195 HydrophobicContact CG1-CG 3.9Å; H193-E195 VanDerWaalsContact CB-CD 3.46Å; H193-E195 WeakPolarHBondContact CB-OE1 3.42Å; H193-E195 WeakPolarHBondContact CB-OE2 3.48Å; H193-E195 IonicContact CG-OE1 2.71Å; H193-E195 PolarHBondContact O-N 3.18Å; E195-F198 PolarHBondContact O-N 3.16Å; E195-R199 VanDerWaalsContact O-CB 3.22Å; E195-R199 WeakPolarHBondContact O-CB 3.4Å; E195-R199 PolarHBondContact O-N 2.88Å; E195-A258 WeakPolarHBondContact OE2-CA 3.4Å; E195-A258 VanDerWaalsContact OE2-CB 3.28Å; E195-A258 WeakPolarHBondContact OE2-CB 3.22Å; E195-L261 HydrophobicContact CB-CB 3.91Å; E195-L261 HydrophobicContact CG-CB 4.01Å; E195-L261 HydrophobicContact CG-CD1 3.81Å; E195-I265 HydrophobicContact CB-CD1 4.21Å
196A97.3Very high95.9Very high14 Ų1441.4 Ų41.412%0.11621%0.205CC..Hα-helixtrans-71.6-40.5176.200000111.5F192 H193 F194 S200F192-A196 HydrophobicContact CB-CB 4.33Å; F192-A196 HydrophobicContact CD1-CB 4.35Å; H193-A196 PolarHBondContact O-N 2.92Å; F194-A196 VanDerWaalsContact C-N 3.29Å; F194-A196 PolarHBondContact O-N 3.47Å; A196-S200 WeakPolarHBondContact O-CB 3.49Å; A196-S200 PolarHBondContact O-N 2.97Å
197I97.9Very high95.7Very high0 Ų039.7 Ų39.70%020%0.196CC..Hα-helixtrans-64.1-47.1172.1-68.5164.9000109.9L122 M123 R126 F192 H193 F194 R199 S200 V201L122-I197 HydrophobicContact CB-CG2 3.82Å; L122-I197 HydrophobicContact CD1-CG2 4.44Å; L122-I197 VanDerWaalsContact O-CD1 3.32Å; L122-I197 WeakPolarHBondContact O-CD1 3.48Å; M123-I197 HydrophobicContact SD-CG2 3.98Å; R126-I197 HydrophobicContact CB-CD1 3.85Å; R126-I197 HydrophobicContact CG-CD1 4.26Å; F192-I197 HydrophobicContact CB-CD1 4.24Å; F192-I197 HydrophobicContact CB-CG1 3.99Å; H193-I197 PolarHBondContact O-N 2.9Å; F194-I197 PolarHBondContact O-N 3.44Å; I197-R199 PolarHBondContact O-N 3.13Å; I197-S200 PolarHBondContact O-N 3.22Å; I197-V201 HydrophobicContact CG2-CG2 4.45Å; I197-V201 WeakPolarHBondContact O-CG2 3.34Å; I197-V201 PolarHBondContact O-N 3.42Å
198F98.2Very high95.6Very high0 Ų033.9 Ų33.90%017%0.168CC..Hα-helixtrans-55.6-52.8177.9-176.8-90.4000111F194 E195 S200 V201 V202 F246 I265 I266 L284F194-F198 HydrophobicContact CE1-CB 4.29Å; F194-F198 HydrophobicContact CE1-CD2 4.23Å; F194-F198 HydrophobicContact CE1-CG 4.49Å; F194-F198 HydrophobicContact CZ-CB 4.5Å; F194-F198 HydrophobicContact CZ-CD2 4.09Å; F194-F198 WeakPolarHBondContact O-CB 3.26Å; F194-F198 PolarHBondContact O-N 2.85Å; E195-F198 PolarHBondContact O-N 3.16Å; F198-S200 PolarHBondContact O-N 3.39Å; F198-V201 PolarHBondContact O-N 3.06Å; F198-V202 HydrophobicContact CD1-CG2 4.13Å; F198-V202 HydrophobicContact CE1-CG2 3.77Å; F198-V202 HydrophobicContact CE2-CG2 4.25Å; F198-V202 HydrophobicContact CZ-CG2 3.81Å; F198-V202 WeakPolarHBondContact O-CB 3.38Å; F198-V202 VanDerWaalsContact O-CG2 3.31Å; F198-V202 WeakPolarHBondContact O-CG2 3.48Å; F198-V202 PolarHBondContact O-N 3.3Å; F198-F246 HydrophobicContact CB-CE1 4.35Å; F198-F246 HydrophobicContact CB-CZ 4.32Å; F198-F246 AromaticContact CD2-CD1 3.77Å; F198-F246 HydrophobicContact CD2-CD1 3.77Å; F198-F246 AromaticContact CD2-CD2 3.67Å; F198-F246 HydrophobicContact CD2-CD2 3.67Å; F198-F246 AromaticContact CD2-CE1 3.73Å; F198-F246 HydrophobicContact CD2-CE1 3.73Å; F198-F246 AromaticContact CD2-CE2 3.6Å; F198-F246 HydrophobicContact CD2-CE2 3.6Å; F198-F246 AromaticContact CD2-CG 3.76Å; F198-F246 HydrophobicContact CD2-CG 3.76Å; F198-F246 AromaticContact CD2-CZ 3.65Å; F198-F246 HydrophobicContact CD2-CZ 3.65Å; F198-F246 HydrophobicContact CE2-CB 4.36Å; F198-F246 HydrophobicContact CE2-CD1 4.32Å; F198-F246 AromaticContact CE2-CD2 3.53Å; F198-F246 HydrophobicContact CE2-CD2 3.53Å; F198-F246 AromaticContact CE2-CE2 3.79Å; F198-F246 HydrophobicContact CE2-CE2 3.79Å; F198-F246 AromaticContact CE2-CG 3.84Å; F198-F246 HydrophobicContact CE2-CG 3.84Å; F198-F246 HydrophobicContact CE2-CZ 4.31Å; F198-F246 HydrophobicContact CG-CE1 4.48Å; F198-F246 HydrophobicContact CG-CE2 4.45Å; F198-F246 HydrophobicContact CG-CZ 4.27Å; F198-I265 HydrophobicContact CD1-CD1 4.37Å; F198-I265 HydrophobicContact CD1-CG2 4.33Å; F198-I265 HydrophobicContact CE1-CG2 4.31Å; F198-I266 HydrophobicContact CE1-CD1 4.31Å; F198-I266 HydrophobicContact CE1-CG1 3.9Å; F198-I266 HydrophobicContact CZ-CD1 3.88Å; F198-I266 HydrophobicContact CZ-CG1 3.91Å; F198-L284 HydrophobicContact CE2-CD1 4.2Å; F198-L284 HydrophobicContact CZ-CD1 4.07Å
199R97.8Very high95.5Very high19 Ų1930.3 Ų30.37%0.07214%0.144CC..Hα-helixtrans-54.7-49.5175.1-175.4-100.1-63162.61.7111.7V170 D174 E195 I197 V201 V202 Y203 I265 Y269V170-R199 HydrophobicContact CG2-CB 3.74Å; V170-R199 HydrophobicContact CG2-CG 3.96Å; D174-R199 WeakPolarHBondContact O-CD 3.35Å; D174-R199 PolarHBondContact O-NE 3.26Å; E195-R199 VanDerWaalsContact O-CB 3.22Å; E195-R199 WeakPolarHBondContact O-CB 3.4Å; E195-R199 PolarHBondContact O-N 2.88Å; I197-R199 PolarHBondContact O-N 3.13Å; R199-V201 VanDerWaalsContact C-N 3.34Å; R199-V201 PolarHBondContact O-N 3.29Å; R199-V202 PolarHBondContact O-N 2.86Å; R199-Y203 VanDerWaalsContact O-CB 3.25Å; R199-Y203 WeakPolarHBondContact O-CB 3.35Å; R199-Y203 PolarHBondContact O-N 3.37Å; R199-I265 HydrophobicContact CB-CD1 3.83Å; R199-I265 HydrophobicContact CB-CG1 4.49Å; R199-I265 HydrophobicContact CB-CG2 4.38Å; R199-I265 HydrophobicContact CG-CD1 4.43Å; R199-I265 HydrophobicContact CG-CG2 4.39Å; R199-Y269 WeakPolarHBondContact CG-OH 3.32Å
200S98.1Very high95.3Very high0 Ų023.1 Ų23.10%012%0.118CC..Hα-helixtrans-61.5-39.1-178.9-174.50000113.2V179 I180 A196 I197 F198 A204V179-S200 WeakPolarHBondContact CA-OG 3.41Å; V179-S200 WeakPolarHBondContact CB-OG 3.32Å; I180-S200 PolarHBondContact N-OG 3.2Å; A196-S200 WeakPolarHBondContact O-CB 3.49Å; A196-S200 PolarHBondContact O-N 2.97Å; I197-S200 PolarHBondContact O-N 3.22Å; F198-S200 PolarHBondContact O-N 3.39Å; S200-A204 WeakPolarHBondContact O-CB 3.28Å; S200-A204 PolarHBondContact O-N 2.87Å
201V97.8Very high95.2Very high0 Ų024 Ų240%012%0.115CC..Hα-helixtrans-70.6-47.3177.4171.70000110.7F118 I119 L122 I197 F198 R199 A204 L205 V242 F246F118-V201 HydrophobicContact CD1-CG2 4.46Å; F118-V201 HydrophobicContact CE1-CG2 4.28Å; I119-V201 HydrophobicContact CD1-CG1 3.92Å; I119-V201 HydrophobicContact CG1-CB 4.49Å; I119-V201 HydrophobicContact CG1-CG1 3.71Å; I119-V201 HydrophobicContact CG1-CG2 3.87Å; L122-V201 HydrophobicContact CD1-CG2 3.67Å; I197-V201 HydrophobicContact CG2-CG2 4.45Å; I197-V201 WeakPolarHBondContact O-CG2 3.34Å; I197-V201 PolarHBondContact O-N 3.42Å; F198-V201 PolarHBondContact O-N 3.06Å; R199-V201 VanDerWaalsContact C-N 3.34Å; R199-V201 PolarHBondContact O-N 3.29Å; V201-A204 PolarHBondContact O-N 2.95Å; V201-L205 VanDerWaalsContact O-CB 3.32Å; V201-L205 WeakPolarHBondContact O-CB 3.4Å; V201-L205 PolarHBondContact O-N 2.93Å; V201-V242 HydrophobicContact CG1-CG1 4.06Å; V201-F246 HydrophobicContact CB-CE2 4.12Å; V201-F246 HydrophobicContact CB-CZ 3.72Å; V201-F246 HydrophobicContact CG1-CE2 3.81Å; V201-F246 HydrophobicContact CG1-CZ 3.82Å; V201-F246 HydrophobicContact CG2-CZ 4.01Å
202V95.9Very high95.2Very high0 Ų020.5 Ų20.50%010%0.1CC..Hα-helixtrans-65.4-41.3-178173.30000111F198 R199 L205 L206 F246 Y269 W281F198-V202 HydrophobicContact CD1-CG2 4.13Å; F198-V202 HydrophobicContact CE1-CG2 3.77Å; F198-V202 HydrophobicContact CE2-CG2 4.25Å; F198-V202 HydrophobicContact CZ-CG2 3.81Å; F198-V202 WeakPolarHBondContact O-CB 3.38Å; F198-V202 VanDerWaalsContact O-CG2 3.31Å; F198-V202 WeakPolarHBondContact O-CG2 3.48Å; F198-V202 PolarHBondContact O-N 3.3Å; R199-V202 PolarHBondContact O-N 2.86Å; V202-L205 WeakPolarHBondContact O-CB 3.34Å; V202-L205 PolarHBondContact O-N 3.07Å; V202-L206 HydrophobicContact CG1-CD1 4.21Å; V202-L206 WeakPolarHBondContact O-CG 3.2Å; V202-L206 PolarHBondContact O-N 3.32Å; V202-F246 HydrophobicContact CG2-CE2 4.26Å; V202-Y269 HydrophobicContact CB-CE2 4.25Å; V202-Y269 HydrophobicContact CG1-CD2 3.56Å; V202-Y269 HydrophobicContact CG1-CE2 3.73Å; V202-W281 HydrophobicContact CG1-CH2 3.49Å; V202-W281 VanDerWaalsContact CG1-CH2 3.49Å; V202-W281 HydrophobicContact CG1-CZ3 3.55Å
203Y95.6Very high95.1Very high64 Ų6420.6 Ų20.625%0.25110%0.099SC..Hα-helixtrans-63.5-45.7176.6-167.9-119.1000112E176 V179 R199 L205 L206 D207 Y269E176-Y203 HydrophobicContact CB-CE2 4.16Å; E176-Y203 HydrophobicContact CG-CE2 3.98Å; V179-Y203 HydrophobicContact CG1-CD1 3.84Å; R199-Y203 VanDerWaalsContact O-CB 3.25Å; R199-Y203 WeakPolarHBondContact O-CB 3.35Å; R199-Y203 PolarHBondContact O-N 3.37Å; Y203-L205 VanDerWaalsContact C-N 3.29Å; Y203-L205 PolarHBondContact O-N 3.22Å; Y203-L206 PolarHBondContact O-N 3.47Å; Y203-D207 PolarHBondContact O-N 3.4Å; Y203-Y269 WeakPolarHBondContact CB-OH 3.38Å; Y203-Y269 AromaticContact CD2-CE1 3.79Å; Y203-Y269 HydrophobicContact CD2-CE1 3.79Å; Y203-Y269 AromaticContact CD2-CZ 3.84Å; Y203-Y269 WeakPolarHBondContact CD2-OH 3.43Å; Y203-Y269 HydrophobicContact CE2-CE1 4.41Å
204A95.2Very high95.1Very high4 Ų425.1 Ų25.13%0.03312%0.118CC..Hα-helixtrans-57.2-45.717200000110.9F115 F118 V179 S200 V201 L206 D207 H208F115-A204 HydrophobicContact CE1-CB 4.03Å; F115-A204 HydrophobicContact CZ-CB 4.34Å; F118-A204 HydrophobicContact CE1-CB 3.88Å; V179-A204 HydrophobicContact CG1-CB 4.1Å; S200-A204 WeakPolarHBondContact O-CB 3.28Å; S200-A204 PolarHBondContact O-N 2.87Å; V201-A204 PolarHBondContact O-N 2.95Å; A204-L206 VanDerWaalsContact C-N 3.34Å; A204-L206 PolarHBondContact O-N 2.87Å; A204-D207 PolarHBondContact O-N 2.9Å; A204-H208 WeakPolarHBondContact O-CB 3.4Å; A204-H208 PolarHBondContact O-CD2 3.09Å; A204-H208 PolarHBondContact O-N 2.77Å
205L94.3Very high95.1Very high0 Ų024.9 Ų24.90%012%0.117CC..Hα-helixtrans-58.1-45.8179.5-165.872.8000111.8F115 V201 V202 Y203 A209 F235 T238 L239 V242 F277 F280F115-L205 HydrophobicContact CD1-CD1 4.1Å; F115-L205 HydrophobicContact CD2-CD1 4.29Å; F115-L205 HydrophobicContact CE1-CB 4.03Å; F115-L205 HydrophobicContact CE1-CD1 3.79Å; F115-L205 HydrophobicContact CE2-CD1 3.99Å; F115-L205 HydrophobicContact CG-CD1 4.36Å; F115-L205 HydrophobicContact CZ-CB 4.18Å; F115-L205 HydrophobicContact CZ-CD1 3.75Å; V201-L205 VanDerWaalsContact O-CB 3.32Å; V201-L205 WeakPolarHBondContact O-CB 3.4Å; V201-L205 PolarHBondContact O-N 2.93Å; V202-L205 WeakPolarHBondContact O-CB 3.34Å; V202-L205 PolarHBondContact O-N 3.07Å; Y203-L205 VanDerWaalsContact C-N 3.29Å; Y203-L205 PolarHBondContact O-N 3.22Å; L205-A209 WeakPolarHBondContact O-CB 3.38Å; L205-A209 PolarHBondContact O-N 3.19Å; L205-F235 HydrophobicContact CD1-CE1 3.35Å; L205-F235 HydrophobicContact CD1-CZ 3.61Å; L205-F235 HydrophobicContact CG-CE1 3.8Å; L205-F235 HydrophobicContact CG-CZ 4.23Å; L205-T238 HydrophobicContact CD1-CG2 4.04Å; L205-L239 HydrophobicContact CD1-CD2 4.36Å; L205-L239 HydrophobicContact CD2-CD2 3.81Å; L205-L239 HydrophobicContact CG-CD2 4.25Å; L205-V242 HydrophobicContact CD1-CG2 3.96Å; L205-V242 HydrophobicContact CD2-CB 4.49Å; L205-V242 HydrophobicContact CD2-CG1 4.25Å; L205-V242 HydrophobicContact CD2-CG2 4.24Å; L205-F277 HydrophobicContact CD2-CE1 4.23Å; L205-F277 HydrophobicContact CG-CE1 4.19Å; L205-F280 HydrophobicContact CD2-CD2 4.47Å; L205-F280 HydrophobicContact CD2-CE1 3.87Å; L205-F280 HydrophobicContact CD2-CE2 3.76Å; L205-F280 HydrophobicContact CD2-CZ 3.41Å; L205-F280 VanDerWaalsContact CD2-CZ 3.41Å
206L92.5Very high95.1Very high20 Ų2024.7 Ų24.711%0.10512%0.116CC..Hα-helixtrans-59.4-49.1177.3-75.2169.6000112.1V202 Y203 A204 A209 A210 Y269 F277 W281V202-L206 HydrophobicContact CG1-CD1 4.21Å; V202-L206 WeakPolarHBondContact O-CG 3.2Å; V202-L206 PolarHBondContact O-N 3.32Å; Y203-L206 PolarHBondContact O-N 3.47Å; A204-L206 VanDerWaalsContact C-N 3.34Å; A204-L206 PolarHBondContact O-N 2.87Å; L206-A209 PolarHBondContact O-N 2.71Å; L206-A210 VanDerWaalsContact O-CB 3.28Å; L206-A210 WeakPolarHBondContact O-CB 3.28Å; L206-A210 PolarHBondContact O-N 3.41Å; L206-Y269 HydrophobicContact CD1-CD1 3.68Å; L206-Y269 HydrophobicContact CD1-CD2 3.78Å; L206-Y269 HydrophobicContact CD1-CE1 4.18Å; L206-Y269 HydrophobicContact CD1-CE2 4.22Å; L206-Y269 HydrophobicContact CD1-CG 3.5Å; L206-Y269 VanDerWaalsContact CD1-CG 3.5Å; L206-F277 HydrophobicContact CD2-CD2 3.57Å; L206-F277 HydrophobicContact CD2-CE1 4.49Å; L206-F277 HydrophobicContact CD2-CE2 3.32Å; L206-F277 HydrophobicContact CD2-CG 4.26Å; L206-F277 HydrophobicContact CD2-CZ 3.79Å; L206-F277 HydrophobicContact CG-CE2 4.46Å; L206-W281 HydrophobicContact CD1-CH2 4.06Å; L206-W281 HydrophobicContact CD1-CZ2 4.34Å; L206-W281 HydrophobicContact CD2-CH2 3.82Å; L206-W281 HydrophobicContact CD2-CZ2 3.5Å; L206-W281 VanDerWaalsContact CD2-CZ2 3.5Å; L206-W281 HydrophobicContact CG-CH2 4.08Å; L206-W281 HydrophobicContact CG-CZ2 4.25Å
207D91.8Very high95Very high71 Ų7125.6 Ų25.638%0.3812%0.121SC..Hα-helixtrans-64.1-46.5-179.1175.944.5000112Y203 A204 A209 R211Y203-D207 PolarHBondContact O-N 3.4Å; A204-D207 PolarHBondContact O-N 2.9Å; D207-A209 PolarHBondContact O-N 3.28Å; D207-R211 WeakPolarHBondContact O-CB 3.11Å; D207-R211 WeakPolarHBondContact O-CG 3.06Å; D207-R211 PolarHBondContact O-N 3.02Å; D207-R211 PolarHBondContact O-NE 2.88Å; D207-R211 VanDerWaalsContact O-NE 3.07Å; D207-R211 IonicContact OD1-CZ 2.73Å; D207-R211 IonicContact OD1-NE 2.62Å; D207-R211 PolarHBondContact OD1-NE 2.81Å; D207-R211 IonicContact OD1-NH2 2.62Å; D207-R211 IonicContact OD2-CZ 3.08Å; D207-R211 IonicContact OD2-NE 3.9Å; D207-R211 PolarHBondContact OD2-NE 3.45Å; D207-R211 IonicContact OD2-NH1 3.7Å; D207-R211 IonicContact OD2-NH2 3.52Å; D207-R211 PolarHBondContact OD2-NH2 3.09Å
208H93.8Very high94.9Very high12 Ų1228.8 Ų28.86%0.05614%0.138CC..Hα-helixtrans-62.8-41.6176.3-80.8-81.6000112.1Y71 Y114 F115 A204 E212 F235Y71-H208 AromaticContact CE1-CE1 3.89Å; Y71-H208 AromaticContact CE1-ND1 3.81Å; Y71-H208 AromaticContact CZ-ND1 3.67Å; Y71-H208 PolarHBondContact OH-CE1 3.36Å; Y71-H208 PolarHBondContact OH-ND1 3.16Å; Y114-H208 AromaticContact CE1-CD2 3.92Å; Y114-H208 AromaticContact CE1-CE1 3.89Å; Y114-H208 AromaticContact CE1-NE2 3.36Å; Y114-H208 WeakPolarHBondContact CE1-NE2 3.47Å; Y114-H208 AromaticContact CZ-NE2 3.57Å; Y114-H208 PolarHBondContact OH-NE2 3.44Å; F115-H208 HydrophobicContact CE2-CB 4.01Å; F115-H208 HydrophobicContact CZ-CB 4.01Å; F115-H208 AromaticContact CZ-CD2 3.66Å; F115-H208 AromaticContact CZ-CG 3.95Å; A204-H208 WeakPolarHBondContact O-CB 3.4Å; A204-H208 PolarHBondContact O-CD2 3.09Å; A204-H208 PolarHBondContact O-N 2.77Å; H208-E212 WeakPolarHBondContact O-CB 3.47Å; H208-E212 PolarHBondContact O-N 3.04Å; H208-F235 HydrophobicContact CB-CE2 4.38Å; H208-F235 HydrophobicContact CB-CZ 4.3Å
209A93Very high94.9Very high0 Ų028.8 Ų28.80%014%0.139CC..Hα-helixtrans-79.2-33.3-176.900000113.6L205 L206 D207 E212 Y213 F231 F235 F277L205-A209 WeakPolarHBondContact O-CB 3.38Å; L205-A209 PolarHBondContact O-N 3.19Å; L206-A209 PolarHBondContact O-N 2.71Å; D207-A209 PolarHBondContact O-N 3.28Å; A209-E212 PolarHBondContact O-N 2.89Å; A209-Y213 VanDerWaalsContact O-CB 3.28Å; A209-Y213 WeakPolarHBondContact O-CB 3.45Å; A209-Y213 PolarHBondContact O-N 2.96Å; A209-F231 HydrophobicContact CB-CE2 3.59Å; A209-F231 HydrophobicContact CB-CZ 3.55Å; A209-F231 WeakPolarHBondContact O-CE2 3.45Å; A209-F235 HydrophobicContact CB-CD1 3.85Å; A209-F235 HydrophobicContact CB-CD2 4.2Å; A209-F235 HydrophobicContact CB-CE1 3.45Å; A209-F235 VanDerWaalsContact CB-CE1 3.45Å; A209-F235 HydrophobicContact CB-CE2 3.84Å; A209-F235 HydrophobicContact CB-CG 4.24Å; A209-F235 HydrophobicContact CB-CZ 3.46Å; A209-F235 VanDerWaalsContact CB-CZ 3.46Å; A209-F277 HydrophobicContact CB-CE1 4.03Å; A209-F277 HydrophobicContact CB-CE2 4.08Å; A209-F277 HydrophobicContact CB-CZ 3.3Å
210A91Very high94.9Very high32 Ų3228.1 Ų28.126%0.26414%0.136SC..Hα-helixtrans-59.9-49.6172.400000110.3L206 E212 Y213 F214L206-A210 VanDerWaalsContact O-CB 3.28Å; L206-A210 WeakPolarHBondContact O-CB 3.28Å; L206-A210 PolarHBondContact O-N 3.41Å; A210-E212 PolarHBondContact O-N 2.91Å; A210-Y213 PolarHBondContact O-N 2.87Å; A210-F214 WeakPolarHBondContact O-CD2 3.5Å; A210-F214 PolarHBondContact O-N 3.2Å
211R92.3Very high94.8Very high76 Ų7630.9 Ų30.929%0.28715%0.151SC..Hα-helixtrans-61.3-44.6177.9-70.5-177.9-71.4165.87112.2E72 D207 F214 F215E72-R211 IonicContact OE1-CZ 3.92Å; E72-R211 VanDerWaalsContact OE1-CZ 3.26Å; E72-R211 IonicContact OE1-NH1 3.64Å; E72-R211 PolarHBondContact OE1-NH1 3.5Å; E72-R211 IonicContact OE1-NH2 2.75Å; E72-R211 PolarHBondContact OE1-NH2 3.04Å; E72-R211 IonicContact OE2-NH1 2.78Å; E72-R211 PolarHBondContact OE2-NH1 3.36Å; E72-R211 VanDerWaalsContact OE2-NH1 3.11Å; D207-R211 WeakPolarHBondContact O-CB 3.11Å; D207-R211 WeakPolarHBondContact O-CG 3.06Å; D207-R211 PolarHBondContact O-N 3.02Å; D207-R211 PolarHBondContact O-NE 2.88Å; D207-R211 VanDerWaalsContact O-NE 3.07Å; D207-R211 IonicContact OD1-CZ 2.73Å; D207-R211 IonicContact OD1-NE 2.62Å; D207-R211 PolarHBondContact OD1-NE 2.81Å; D207-R211 IonicContact OD1-NH2 2.62Å; D207-R211 IonicContact OD2-CZ 3.08Å; D207-R211 IonicContact OD2-NE 3.9Å; D207-R211 PolarHBondContact OD2-NE 3.45Å; D207-R211 IonicContact OD2-NH1 3.7Å; D207-R211 IonicContact OD2-NH2 3.52Å; D207-R211 PolarHBondContact OD2-NH2 3.09Å; R211-F214 PolarHBondContact O-N 2.74Å; R211-F215 WeakPolarHBondContact O-CB 3.45Å; R211-F215 PolarHBondContact O-N 2.95Å
212E94.4Very high94.7Very high0 Ų032.2 Ų32.20%016%0.159CC..Hα-helixtrans-61.4-46.5176.2-174.160.8-160.800111.6Q75 Y103 L111 H208 A209 A210 F214 F215 L216 V234Q75-E212 PolarHBondContact NE2-OE2 3.14Å; Y103-E212 WeakPolarHBondContact CE1-OE1 3.37Å; Y103-E212 VanDerWaalsContact OH-CD 3.29Å; Y103-E212 PolarHBondContact OH-OE1 3.32Å; Y103-E212 PolarHBondContact OH-OE2 3.09Å; L111-E212 HydrophobicContact CD1-CG 4.49Å; H208-E212 WeakPolarHBondContact O-CB 3.47Å; H208-E212 PolarHBondContact O-N 3.04Å; A209-E212 PolarHBondContact O-N 2.89Å; A210-E212 PolarHBondContact O-N 2.91Å; E212-F214 VanDerWaalsContact C-N 3.35Å; E212-F214 PolarHBondContact O-N 3.09Å; E212-F215 PolarHBondContact O-N 3.39Å; E212-L216 HydrophobicContact CG-CD1 4.14Å; E212-L216 HydrophobicContact CG-CG 4.3Å; E212-L216 WeakPolarHBondContact O-CB 3.32Å; E212-L216 VanDerWaalsContact O-CG 3.22Å; E212-L216 WeakPolarHBondContact O-CG 3.36Å; E212-L216 PolarHBondContact O-N 3.27Å; E212-V234 HydrophobicContact CG-CG1 3.93Å
213Y93.3Very high94.6Very high50 Ų5036.5 Ų36.520%0.19619%0.189CC..Hα-helixtrans-59.6-44.6179.3-176.6-94.2000111.9A209 A210 L216 C217 S227 F231 I276A209-Y213 VanDerWaalsContact O-CB 3.28Å; A209-Y213 WeakPolarHBondContact O-CB 3.45Å; A209-Y213 PolarHBondContact O-N 2.96Å; A210-Y213 PolarHBondContact O-N 2.87Å; Y213-L216 PolarHBondContact O-N 3.41Å; Y213-C217 VanDerWaalsContact CE1-SG 3.51Å; Y213-C217 PolarHBondContact O-N 2.69Å; Y213-C217 PolarHBondContact O-SG 3.38Å; Y213-S227 PolarHBondContact OH-OG 3.49Å; Y213-F231 HydrophobicContact CD2-CB 4Å; Y213-F231 HydrophobicContact CD2-CD2 4.03Å; Y213-F231 HydrophobicContact CD2-CG 4.08Å; Y213-I276 HydrophobicContact CD1-CD1 3.71Å; Y213-I276 HydrophobicContact CD2-CD1 3.84Å; Y213-I276 HydrophobicContact CD2-CG1 4.35Å; Y213-I276 HydrophobicContact CE1-CD1 4.18Å; Y213-I276 HydrophobicContact CE2-CD1 4.3Å; Y213-I276 HydrophobicContact CE2-CG1 4.5Å; Y213-I276 HydrophobicContact CG-CD1 3.52Å; Y213-I276 HydrophobicContact CG-CG1 4.5Å
214F93.1Very high94.4Very high147 Ų14735.7 Ų35.765%0.64520%0.2SC*.Hα-helixtrans-64-44.6176-75.6-61.7000112A210 R211 E212 L216 C217 D218A210-F214 WeakPolarHBondContact O-CD2 3.5Å; A210-F214 PolarHBondContact O-N 3.2Å; R211-F214 PolarHBondContact O-N 2.74Å; E212-F214 VanDerWaalsContact C-N 3.35Å; E212-F214 PolarHBondContact O-N 3.09Å; F214-L216 VanDerWaalsContact C-N 3.31Å; F214-L216 PolarHBondContact O-N 2.97Å; F214-C217 PolarHBondContact O-N 2.74Å; F214-D218 VanDerWaalsContact O-CB 3.25Å; F214-D218 WeakPolarHBondContact O-CB 3.31Å; F214-D218 PolarHBondContact O-N 3.35Å
215F96.2Very high94.2Very high9 Ų941.8 Ų41.84%0.03923%0.232CC..Hα-helixtrans-59-43.7175.8175.9-90.3000111.6Q75 L78 L79 Y103 R211 E212 D218 F219 F220Q75-F215 HydrophobicContact CB-CD2 3.73Å; Q75-F215 HydrophobicContact CB-CE2 3.73Å; Q75-F215 HydrophobicContact CB-CG 4.4Å; Q75-F215 HydrophobicContact CB-CZ 4.42Å; Q75-F215 HydrophobicContact CG-CD1 4.43Å; Q75-F215 HydrophobicContact CG-CD2 3.98Å; Q75-F215 HydrophobicContact CG-CE1 4.42Å; Q75-F215 HydrophobicContact CG-CE2 3.94Å; Q75-F215 HydrophobicContact CG-CG 4.23Å; Q75-F215 HydrophobicContact CG-CZ 4.17Å; Q75-F215 WeakPolarHBondContact O-CE2 3.34Å; L78-F215 HydrophobicContact CB-CE2 4.14Å; L78-F215 HydrophobicContact CB-CZ 4.15Å; L78-F215 HydrophobicContact CD1-CZ 4.14Å; L79-F215 HydrophobicContact CD1-CD2 4.25Å; L79-F215 HydrophobicContact CD2-CD2 3.93Å; L79-F215 HydrophobicContact CD2-CE2 4Å; L79-F215 HydrophobicContact CG-CD2 3.94Å; L79-F215 HydrophobicContact CG-CE2 3.92Å; Y103-F215 HydrophobicContact CD2-CE1 4.25Å; Y103-F215 HydrophobicContact CE1-CD1 4.38Å; Y103-F215 HydrophobicContact CE1-CE1 4.13Å; Y103-F215 HydrophobicContact CE2-CD1 4.14Å; Y103-F215 AromaticContact CE2-CE1 3.34Å; Y103-F215 HydrophobicContact CE2-CE1 3.34Å; Y103-F215 AromaticContact CE2-CZ 3.99Å; Y103-F215 HydrophobicContact CE2-CZ 3.99Å; Y103-F215 AromaticContact CZ-CD1 3.62Å; Y103-F215 AromaticContact CZ-CE1 3.27Å; Y103-F215 WeakPolarHBondContact OH-CD1 3.37Å; Y103-F215 WeakPolarHBondContact OH-CE1 3.13Å; R211-F215 WeakPolarHBondContact O-CB 3.45Å; R211-F215 PolarHBondContact O-N 2.95Å; E212-F215 PolarHBondContact O-N 3.39Å; F215-D218 PolarHBondContact O-N 3.43Å; F215-F219 HydrophobicContact CD1-CB 4.46Å; F215-F219 HydrophobicContact CD2-CB 4.4Å; F215-F219 HydrophobicContact CE1-CB 3.96Å; F215-F219 HydrophobicContact CE1-CD1 4.3Å; F215-F219 HydrophobicContact CE1-CG 4.25Å; F215-F219 HydrophobicContact CE2-CB 3.92Å; F215-F219 HydrophobicContact CE2-CD2 4.48Å; F215-F219 HydrophobicContact CE2-CG 4.2Å; F215-F219 HydrophobicContact CZ-CB 3.68Å; F215-F219 HydrophobicContact CZ-CD1 4.01Å; F215-F219 HydrophobicContact CZ-CD2 4.27Å; F215-F219 AromaticContact CZ-CG 3.71Å; F215-F219 HydrophobicContact CZ-CG 3.71Å; F215-F219 WeakPolarHBondContact O-CB 3.33Å; F215-F219 PolarHBondContact O-N 3.49Å; F215-F220 HydrophobicContact CE1-CE2 4.06Å
216L96.7Very high94.1Very high0 Ų048.3 Ų48.30%026%0.262CS..Hα-helixtrans-60.7-50.1178.1-72.2179.1000111.6Y103 E212 Y213 F214 D218 F220 V222 M230 F231 V234Y103-L216 HydrophobicContact CD1-CD2 4.12Å; Y103-L216 HydrophobicContact CE1-CD2 3.51Å; E212-L216 HydrophobicContact CG-CD1 4.14Å; E212-L216 HydrophobicContact CG-CG 4.3Å; E212-L216 WeakPolarHBondContact O-CB 3.32Å; E212-L216 VanDerWaalsContact O-CG 3.22Å; E212-L216 WeakPolarHBondContact O-CG 3.36Å; E212-L216 PolarHBondContact O-N 3.27Å; Y213-L216 PolarHBondContact O-N 3.41Å; F214-L216 VanDerWaalsContact C-N 3.31Å; F214-L216 PolarHBondContact O-N 2.97Å; L216-D218 VanDerWaalsContact C-N 3.32Å; L216-D218 PolarHBondContact O-N 2.74Å; L216-F220 HydrophobicContact CD2-CD2 3.87Å; L216-F220 HydrophobicContact CD2-CE2 4.07Å; L216-F220 WeakPolarHBondContact O-CB 3.22Å; L216-F220 PolarHBondContact O-N 2.8Å; L216-F220 VanDerWaalsContact O-N 3.1Å; L216-V222 WeakPolarHBondContact O-CG2 3.25Å; L216-M230 HydrophobicContact CD1-CG 4.25Å; L216-M230 HydrophobicContact CD2-CE 3.54Å; L216-M230 HydrophobicContact CD2-CG 4.09Å; L216-M230 HydrophobicContact CD2-SD 3.89Å; L216-F231 HydrophobicContact CD1-CB 4.1Å; L216-F231 HydrophobicContact CD1-CD2 4.47Å; L216-V234 HydrophobicContact CD1-CG2 4.22Å; L216-V234 HydrophobicContact CD2-CG2 4.45Å
217C95.5Very high94.1Very high33 Ų3347.3 Ų47.322%0.22326%0.257CS..Hα-helixtrans-59.6-43.8178.2-64.70000112Y213 F214 L221 V222 S227Y213-C217 VanDerWaalsContact CE1-SG 3.51Å; Y213-C217 PolarHBondContact O-N 2.69Å; Y213-C217 PolarHBondContact O-SG 3.38Å; F214-C217 PolarHBondContact O-N 2.74Å; C217-L221 PolarHBondContact O-N 2.91Å; C217-V222 WeakPolarHBondContact CA-O 3.34Å; C217-V222 PolarHBondContact O-N 3.38Å; C217-S227 VanDerWaalsContact SG-CB 3.56Å
218D96.2Very high94.1Very high67 Ų6746.8 Ų46.836%0.35826%0.257SS..Hα-helixtrans-69.7-66.5-178.3-170.4-20.5000110.5L79 R82 F214 F215 L216 F220 L221L79-D218 HydrophobicContact CD2-CB 4.05Å; R82-D218 VanDerWaalsContact CD-OD1 3.28Å; R82-D218 WeakPolarHBondContact CD-OD1 3.37Å; R82-D218 IonicContact CZ-OD1 2.84Å; R82-D218 IonicContact NE-OD1 3.32Å; R82-D218 PolarHBondContact NH1-O 3.27Å; R82-D218 IonicContact NH1-OD1 3.54Å; R82-D218 PolarHBondContact NH1-OD1 3.36Å; F214-D218 VanDerWaalsContact O-CB 3.25Å; F214-D218 WeakPolarHBondContact O-CB 3.31Å; F214-D218 PolarHBondContact O-N 3.35Å; F215-D218 PolarHBondContact O-N 3.43Å; L216-D218 VanDerWaalsContact C-N 3.32Å; L216-D218 PolarHBondContact O-N 2.74Å; D218-F220 PolarHBondContact O-N 3.19Å; D218-L221 PolarHBondContact O-N 2.84Å
219F98.2Very high94.1Very high1 Ų150.2 Ų50.20%0.00428%0.275CS..Hα-helixtrans-66.5-40.4-170.5-173.4-98.7000113.3L57 L78 L79 R82 F85 F215L57-F219 HydrophobicContact CD1-CZ 4.35Å; L57-F219 HydrophobicContact CD2-CE2 4.46Å; L57-F219 HydrophobicContact CD2-CZ 3.88Å; L78-F219 HydrophobicContact CB-CD2 4.33Å; L78-F219 HydrophobicContact CB-CE2 4.08Å; L78-F219 HydrophobicContact CD2-CE2 4.36Å; L78-F219 HydrophobicContact CD2-CZ 4.14Å; L78-F219 VanDerWaalsContact O-CE2 3.31Å; L78-F219 WeakPolarHBondContact O-CE2 3.13Å; L79-F219 HydrophobicContact CD2-CB 4.01Å; L79-F219 HydrophobicContact CD2-CD2 4.47Å; R82-F219 HydrophobicContact CB-CD2 4.4Å; F85-F219 HydrophobicContact CB-CE1 4.17Å; F85-F219 HydrophobicContact CB-CZ 4.04Å; F85-F219 WeakPolarHBondContact CD1-O 3.22Å; F85-F219 HydrophobicContact CD2-CE1 4.47Å; F85-F219 HydrophobicContact CG-CE1 4.32Å; F215-F219 HydrophobicContact CD1-CB 4.46Å; F215-F219 HydrophobicContact CD2-CB 4.4Å; F215-F219 HydrophobicContact CE1-CB 3.96Å; F215-F219 HydrophobicContact CE1-CD1 4.3Å; F215-F219 HydrophobicContact CE1-CG 4.25Å; F215-F219 HydrophobicContact CE2-CB 3.92Å; F215-F219 HydrophobicContact CE2-CD2 4.48Å; F215-F219 HydrophobicContact CE2-CG 4.2Å; F215-F219 HydrophobicContact CZ-CB 3.68Å; F215-F219 HydrophobicContact CZ-CD1 4.01Å; F215-F219 HydrophobicContact CZ-CD2 4.27Å; F215-F219 AromaticContact CZ-CG 3.71Å; F215-F219 HydrophobicContact CZ-CG 3.71Å; F215-F219 WeakPolarHBondContact O-CB 3.33Å; F215-F219 PolarHBondContact O-N 3.49Å
220F97.9Very high94.3Very high5 Ų550.6 Ų50.62%0.02228%0.277CS..THydrogen-bonded Turntrans-93.83-176.5-68.1-77.8000114.3F85 I99 R100 Y103 F215 L216 D218 V222 M230F85-F220 HydrophobicContact CD1-CD1 4.31Å; F85-F220 HydrophobicContact CD2-CD1 4.24Å; F85-F220 HydrophobicContact CD2-CE1 4.26Å; F85-F220 HydrophobicContact CE1-CB 4.26Å; F85-F220 AromaticContact CE1-CD1 3.81Å; F85-F220 HydrophobicContact CE1-CD1 3.81Å; F85-F220 HydrophobicContact CE1-CG 4.49Å; F85-F220 AromaticContact CE2-CD1 3.72Å; F85-F220 HydrophobicContact CE2-CD1 3.72Å; F85-F220 AromaticContact CE2-CE1 3.89Å; F85-F220 HydrophobicContact CE2-CE1 3.89Å; F85-F220 AromaticContact CZ-CD1 3.51Å; F85-F220 HydrophobicContact CZ-CD1 3.51Å; F85-F220 HydrophobicContact CZ-CE1 4.16Å; I99-F220 HydrophobicContact CG2-CE1 4.43Å; R100-F220 HydrophobicContact CB-CD1 4.15Å; R100-F220 HydrophobicContact CB-CE1 3.96Å; R100-F220 HydrophobicContact CG-CD1 4.08Å; R100-F220 HydrophobicContact CG-CE1 4.19Å; Y103-F220 AromaticContact CD1-CE2 3.51Å; Y103-F220 HydrophobicContact CD1-CE2 3.51Å; Y103-F220 AromaticContact CD1-CZ 3.81Å; Y103-F220 HydrophobicContact CD1-CZ 3.81Å; Y103-F220 HydrophobicContact CD2-CE2 4.1Å; Y103-F220 HydrophobicContact CD2-CZ 4.06Å; Y103-F220 AromaticContact CE1-CE2 3.89Å; Y103-F220 HydrophobicContact CE1-CE2 3.89Å; Y103-F220 HydrophobicContact CE2-CE2 4.42Å; Y103-F220 AromaticContact CG-CE2 3.65Å; Y103-F220 HydrophobicContact CG-CE2 3.65Å; Y103-F220 AromaticContact CG-CZ 3.52Å; Y103-F220 HydrophobicContact CG-CZ 3.52Å; F215-F220 HydrophobicContact CE1-CE2 4.06Å; L216-F220 HydrophobicContact CD2-CD2 3.87Å; L216-F220 HydrophobicContact CD2-CE2 4.07Å; L216-F220 WeakPolarHBondContact O-CB 3.22Å; L216-F220 PolarHBondContact O-N 2.8Å; L216-F220 VanDerWaalsContact O-N 3.1Å; D218-F220 PolarHBondContact O-N 3.19Å; F220-V222 HydrophobicContact CB-CG1 4.31Å; F220-V222 HydrophobicContact CB-CG2 4.36Å; F220-V222 PolarHBondContact O-N 3.33Å; F220-M230 HydrophobicContact CB-CE 4.32Å; F220-M230 HydrophobicContact CB-SD 4.05Å; F220-M230 HydrophobicContact CD1-CE 4.06Å; F220-M230 HydrophobicContact CD2-CE 3.41Å; F220-M230 VanDerWaalsContact CD2-CE 3.41Å; F220-M230 HydrophobicContact CD2-SD 4.09Å; F220-M230 HydrophobicContact CE1-CE 4.24Å; F220-M230 HydrophobicContact CE2-CE 3.59Å; F220-M230 HydrophobicContact CG-CE 3.66Å; F220-M230 HydrophobicContact CG-SD 4.06Å; F220-M230 HydrophobicContact CZ-CE 4.02Å
221L96.8Very high94.5Very high57 Ų5749.1 Ų49.130%0.29827%0.265SS..  trans58.132.2176.3-46.6176.7000113E86 L89 C217 D218E86-L221 HydrophobicContact CB-CD1 3.95Å; E86-L221 HydrophobicContact CG-CD1 3.92Å; L89-L221 HydrophobicContact CD2-CD1 3.99Å; C217-L221 PolarHBondContact O-N 2.91Å; D218-L221 PolarHBondContact O-N 2.84Å
222V94.8Very high94.6Very high28 Ų2848.4 Ų48.417%0.1727%0.266CS..  trans-100.4145.9-178.3-67.10000111.5L216 C217 F220 H226 M230L216-V222 WeakPolarHBondContact O-CG2 3.25Å; C217-V222 WeakPolarHBondContact CA-O 3.34Å; C217-V222 PolarHBondContact O-N 3.38Å; F220-V222 HydrophobicContact CB-CG1 4.31Å; F220-V222 HydrophobicContact CB-CG2 4.36Å; F220-V222 PolarHBondContact O-N 3.33Å; V222-H226 HydrophobicContact CB-CB 4.33Å; V222-H226 HydrophobicContact CG1-CB 4.44Å; V222-M230 HydrophobicContact CG2-SD 4.31Å
223S93.9Very high94.7Very high91 Ų9153.1 Ų53.164%0.63629%0.289SS*.  trans-147.7165.4177.863.80000111.6N225 H226S223-N225 PolarHBondContact O-N 3.41Å; S223-H226 PolarHBondContact O-N 2.83Å
224G90.6Very high94.9Very high47 Ų4750.8 Ų50.849%0.48528%0.279SS..THydrogen-bonded Turntrans60.3-128.3178.700000113.1H226 S227 T228G224-H226 VanDerWaalsContact C-N 3.31Å; G224-H226 PolarHBondContact O-N 3.34Å; G224-S227 PolarHBondContact N-OG 2.93Å; G224-S227 PolarHBondContact O-OG 3.09Å; G224-T228 PolarHBondContact O-N 3.21Å; G224-T228 PolarHBondContact O-OG1 2.61Å; G224-T228 VanDerWaalsContact O-OG1 3.09Å
225N91.5Very high95Very high131 Ų13143.8 Ų43.870%0.70125%0.249SC*.Hα-helixtrans-66.9-33.8-179-65.9-13.5000111.9S223 S227 T228 D229S223-N225 PolarHBondContact O-N 3.41Å; N225-S227 PolarHBondContact O-N 3.23Å; N225-T228 PolarHBondContact O-N 2.98Å; N225-D229 VanDerWaalsContact O-CG 3.24Å; N225-D229 PolarHBondContact O-N 2.72Å
226H93.2Very high94.9Very high137 Ų13744.2 Ų44.263%0.63426%0.256SS*.Hα-helixtrans-67.3-35.2-179-65.7-52000113.3V222 S223 G224 M230V222-H226 HydrophobicContact CB-CB 4.33Å; V222-H226 HydrophobicContact CG1-CB 4.44Å; S223-H226 PolarHBondContact O-N 2.83Å; G224-H226 VanDerWaalsContact C-N 3.31Å; G224-H226 PolarHBondContact O-N 3.34Å; H226-M230 WeakPolarHBondContact O-CB 3.45Å; H226-M230 PolarHBondContact O-N 3.12Å; H226-M230 VanDerWaalsContact O-N 3.1Å
227S92.6Very high95Very high0 Ų050.8 Ų50.80%028%0.28CS..Hα-helixtrans-68.6-37.8173.4540000111.3Y213 C217 G224 N225 F231Y213-S227 PolarHBondContact OH-OG 3.49Å; C217-S227 VanDerWaalsContact SG-CB 3.56Å; G224-S227 PolarHBondContact N-OG 2.93Å; G224-S227 PolarHBondContact O-OG 3.09Å; N225-S227 PolarHBondContact O-N 3.23Å; S227-F231 VanDerWaalsContact O-CB 3.26Å; S227-F231 WeakPolarHBondContact O-CB 3.34Å; S227-F231 PolarHBondContact O-N 2.79Å
228T91.7Very high95.1Very high60 Ų6049.2 Ų49.237%0.36827%0.27SS..Hα-helixtrans-66.1-47.1176.7-50.40000111.6G224 N225 M230 F231 D232G224-T228 PolarHBondContact O-N 3.21Å; G224-T228 PolarHBondContact O-OG1 2.61Å; G224-T228 VanDerWaalsContact O-OG1 3.09Å; N225-T228 PolarHBondContact O-N 2.98Å; T228-M230 VanDerWaalsContact C-N 3.32Å; T228-M230 PolarHBondContact O-N 3.27Å; T228-F231 WeakPolarHBondContact O-CB 3.4Å; T228-F231 PolarHBondContact O-N 3.42Å; T228-D232 PolarHBondContact O-N 3.38Å
229D94.1Very high95.1Very high84 Ų8447 Ų4745%0.44926%0.258SS..Hα-helixtrans-61.8-40.3177.9-68.4-23000111.9N225 Q233N225-D229 VanDerWaalsContact O-CG 3.24Å; N225-D229 PolarHBondContact O-N 2.72Å; D229-Q233 VanDerWaalsContact O-CG 3.3Å; D229-Q233 WeakPolarHBondContact O-CG 3.5Å; D229-Q233 PolarHBondContact O-N 3.42Å; D229-Q233 VanDerWaalsContact O-N 3.14Å; D229-Q233 PolarHBondContact O-NE2 3.38Å
230M96Very high95Very high7 Ų750.9 Ų50.93%0.03429%0.285CS..Hα-helixtrans-69.2-41.3177.5-172171.5-175.600111.3R100 Y103 V104 L216 F220 V222 H226 T228 D232 Q233 V234R100-M230 HydrophobicContact CG-CE 3.36Å; R100-M230 HydrophobicContact CG-SD 4.01Å; Y103-M230 HydrophobicContact CD1-CE 4.26Å; V104-M230 HydrophobicContact CG2-CE 3.61Å; V104-M230 HydrophobicContact CG2-CG 4.1Å; L216-M230 HydrophobicContact CD1-CG 4.25Å; L216-M230 HydrophobicContact CD2-CE 3.54Å; L216-M230 HydrophobicContact CD2-CG 4.09Å; L216-M230 HydrophobicContact CD2-SD 3.89Å; F220-M230 HydrophobicContact CB-CE 4.32Å; F220-M230 HydrophobicContact CB-SD 4.05Å; F220-M230 HydrophobicContact CD1-CE 4.06Å; F220-M230 HydrophobicContact CD2-CE 3.41Å; F220-M230 VanDerWaalsContact CD2-CE 3.41Å; F220-M230 HydrophobicContact CD2-SD 4.09Å; F220-M230 HydrophobicContact CE1-CE 4.24Å; F220-M230 HydrophobicContact CE2-CE 3.59Å; F220-M230 HydrophobicContact CG-CE 3.66Å; F220-M230 HydrophobicContact CG-SD 4.06Å; F220-M230 HydrophobicContact CZ-CE 4.02Å; V222-M230 HydrophobicContact CG2-SD 4.31Å; H226-M230 WeakPolarHBondContact O-CB 3.45Å; H226-M230 PolarHBondContact O-N 3.12Å; H226-M230 VanDerWaalsContact O-N 3.1Å; T228-M230 VanDerWaalsContact C-N 3.32Å; T228-M230 PolarHBondContact O-N 3.27Å; M230-D232 VanDerWaalsContact C-N 3.34Å; M230-D232 PolarHBondContact O-N 3.1Å; M230-Q233 PolarHBondContact O-N 3.42Å; M230-V234 PolarHBondContact O-N 3.1Å; M230-V234 VanDerWaalsContact O-N 3.13Å
231F95Very high95Very high1 Ų152.4 Ų52.40%0.00429%0.293CS..Hα-helixtrans-59.6-44.6173.8174.6-92.3000111.6A209 Y213 L216 S227 T228 Q233 V234 F235 L239 I276A209-F231 HydrophobicContact CB-CE2 3.59Å; A209-F231 HydrophobicContact CB-CZ 3.55Å; A209-F231 WeakPolarHBondContact O-CE2 3.45Å; Y213-F231 HydrophobicContact CD2-CB 4Å; Y213-F231 HydrophobicContact CD2-CD2 4.03Å; Y213-F231 HydrophobicContact CD2-CG 4.08Å; L216-F231 HydrophobicContact CD1-CB 4.1Å; L216-F231 HydrophobicContact CD1-CD2 4.47Å; S227-F231 VanDerWaalsContact O-CB 3.26Å; S227-F231 WeakPolarHBondContact O-CB 3.34Å; S227-F231 PolarHBondContact O-N 2.79Å; T228-F231 WeakPolarHBondContact O-CB 3.4Å; T228-F231 PolarHBondContact O-N 3.42Å; F231-Q233 VanDerWaalsContact C-N 3.3Å; F231-Q233 PolarHBondContact O-N 2.82Å; F231-V234 PolarHBondContact O-N 2.62Å; F231-V234 VanDerWaalsContact O-N 3.12Å; F231-F235 HydrophobicContact CD1-CB 4.42Å; F231-F235 HydrophobicContact CD2-CB 4.37Å; F231-F235 HydrophobicContact CE1-CB 3.98Å; F231-F235 HydrophobicContact CE1-CG 4.5Å; F231-F235 HydrophobicContact CE2-CB 3.94Å; F231-F235 HydrophobicContact CE2-CD1 4.45Å; F231-F235 HydrophobicContact CE2-CD2 4.42Å; F231-F235 HydrophobicContact CE2-CG 4.05Å; F231-F235 HydrophobicContact CZ-CB 3.73Å; F231-F235 AromaticContact CZ-CD1 3.85Å; F231-F235 HydrophobicContact CZ-CD1 3.85Å; F231-F235 AromaticContact CZ-CG 3.83Å; F231-F235 HydrophobicContact CZ-CG 3.83Å; F231-F235 WeakPolarHBondContact O-CB 3.43Å; F231-F235 PolarHBondContact O-N 3.02Å; F231-L239 HydrophobicContact CE1-CD1 4.49Å; F231-I276 HydrophobicContact CD1-CG2 3.82Å; F231-I276 HydrophobicContact CE1-CG2 3.26Å; F231-I276 HydrophobicContact CE2-CG2 4.06Å; F231-I276 HydrophobicContact CG-CG2 4.42Å; F231-I276 HydrophobicContact CZ-CG2 3.39Å
232D94.5Very high95Very high61 Ų6149.7 Ų49.733%0.32628%0.279SS..Hα-helixtrans-62-36.9177.5-81.5-13.1000112.1T228 M230 V234 G236T228-D232 PolarHBondContact O-N 3.38Å; M230-D232 VanDerWaalsContact C-N 3.34Å; M230-D232 PolarHBondContact O-N 3.1Å; D232-V234 VanDerWaalsContact C-N 3.35Å; D232-G236 VanDerWaalsContact O-CA 3.23Å; D232-G236 WeakPolarHBondContact O-CA 3.45Å; D232-G236 PolarHBondContact O-N 2.92Å
233Q97.1Very high95.2Very high100 Ų10049.1 Ų49.147%0.46728%0.276SS..Hα-helixtrans-66.4-35.6174.9-69.1168.546.600112.7V104 D229 M230 F231V104-Q233 HydrophobicContact CG1-CB 3.56Å; D229-Q233 VanDerWaalsContact O-CG 3.3Å; D229-Q233 WeakPolarHBondContact O-CG 3.5Å; D229-Q233 PolarHBondContact O-N 3.42Å; D229-Q233 VanDerWaalsContact O-N 3.14Å; D229-Q233 PolarHBondContact O-NE2 3.38Å; M230-Q233 PolarHBondContact O-N 3.42Å; F231-Q233 VanDerWaalsContact C-N 3.3Å; F231-Q233 PolarHBondContact O-N 2.82Å
234V97.3Very high95.4Very high0 Ų046.5 Ų46.50%026%0.263CS..Hα-helixtrans-74.9-55.2176.3175.20000110.6V104 M107 S108 L111 E212 L216 M230 F231 D232V104-V234 HydrophobicContact CB-CG2 4.28Å; V104-V234 HydrophobicContact CG1-CG2 4.25Å; V104-V234 HydrophobicContact CG2-CG2 3.95Å; M107-V234 HydrophobicContact CB-CG1 3.82Å; S108-V234 VanDerWaalsContact CA-O 3.22Å; S108-V234 WeakPolarHBondContact CA-O 3.33Å; S108-V234 VanDerWaalsContact CB-O 3.29Å; S108-V234 WeakPolarHBondContact CB-O 3.33Å; S108-V234 PolarHBondContact OG-O 3.36Å; S108-V234 VanDerWaalsContact OG-O 3.1Å; L111-V234 HydrophobicContact CD1-CG1 3.74Å; E212-V234 HydrophobicContact CG-CG1 3.93Å; L216-V234 HydrophobicContact CD1-CG2 4.22Å; L216-V234 HydrophobicContact CD2-CG2 4.45Å; M230-V234 PolarHBondContact O-N 3.1Å; M230-V234 VanDerWaalsContact O-N 3.13Å; F231-V234 PolarHBondContact O-N 2.62Å; F231-V234 VanDerWaalsContact O-N 3.12Å; D232-V234 VanDerWaalsContact C-N 3.35Å
235F95.4Very high95.7Very high0 Ų046.2 Ų46.20%025%0.252CS..Hα-helixtrans-99.1-20-162.2-140.3-103.6000113.6L111 F115 L205 H208 A209 F231 R237 T238 L239 F277L111-F235 HydrophobicContact CD1-CD2 3.72Å; L111-F235 HydrophobicContact CD1-CE2 3.83Å; L111-F235 HydrophobicContact CD2-CE2 4.24Å; L111-F235 HydrophobicContact CG-CE2 4.44Å; F115-F235 HydrophobicContact CE2-CZ 4.19Å; L205-F235 HydrophobicContact CD1-CE1 3.35Å; L205-F235 HydrophobicContact CD1-CZ 3.61Å; L205-F235 HydrophobicContact CG-CE1 3.8Å; L205-F235 HydrophobicContact CG-CZ 4.23Å; H208-F235 HydrophobicContact CB-CE2 4.38Å; H208-F235 HydrophobicContact CB-CZ 4.3Å; A209-F235 HydrophobicContact CB-CD1 3.85Å; A209-F235 HydrophobicContact CB-CD2 4.2Å; A209-F235 HydrophobicContact CB-CE1 3.45Å; A209-F235 VanDerWaalsContact CB-CE1 3.45Å; A209-F235 HydrophobicContact CB-CE2 3.84Å; A209-F235 HydrophobicContact CB-CG 4.24Å; A209-F235 HydrophobicContact CB-CZ 3.46Å; A209-F235 VanDerWaalsContact CB-CZ 3.46Å; F231-F235 HydrophobicContact CD1-CB 4.42Å; F231-F235 HydrophobicContact CD2-CB 4.37Å; F231-F235 HydrophobicContact CE1-CB 3.98Å; F231-F235 HydrophobicContact CE1-CG 4.5Å; F231-F235 HydrophobicContact CE2-CB 3.94Å; F231-F235 HydrophobicContact CE2-CD1 4.45Å; F231-F235 HydrophobicContact CE2-CD2 4.42Å; F231-F235 HydrophobicContact CE2-CG 4.05Å; F231-F235 HydrophobicContact CZ-CB 3.73Å; F231-F235 AromaticContact CZ-CD1 3.85Å; F231-F235 HydrophobicContact CZ-CD1 3.85Å; F231-F235 AromaticContact CZ-CG 3.83Å; F231-F235 HydrophobicContact CZ-CG 3.83Å; F231-F235 WeakPolarHBondContact O-CB 3.43Å; F231-F235 PolarHBondContact O-N 3.02Å; F235-R237 VanDerWaalsContact C-N 3.34Å; F235-R237 PolarHBondContact O-N 2.97Å; F235-T238 HydrophobicContact CE1-CG2 4.45Å; F235-T238 HydrophobicContact CZ-CG2 4.42Å; F235-T238 WeakPolarHBondContact O-CA 3.33Å; F235-T238 VanDerWaalsContact O-CB 3.25Å; F235-T238 WeakPolarHBondContact O-CB 3.43Å; F235-T238 PolarHBondContact O-N 3.3Å; F235-L239 HydrophobicContact CD1-CD1 4.24Å; F235-L239 HydrophobicContact CD1-CD2 3.54Å; F235-L239 HydrophobicContact CD1-CG 3.65Å; F235-L239 HydrophobicContact CE1-CD2 3.71Å; F235-L239 HydrophobicContact CE1-CG 4.3Å; F235-L239 PolarHBondContact O-N 3.2Å; F235-F277 HydrophobicContact CE1-CE1 4.42Å
236G95Very high96Very high18 Ų1840 Ų4019%0.18622%0.219CC..Hα-helixtrans-55-43.3-172.500000113.8D232 T238 L239 S240D232-G236 VanDerWaalsContact O-CA 3.23Å; D232-G236 WeakPolarHBondContact O-CA 3.45Å; D232-G236 PolarHBondContact O-N 2.92Å; G236-T238 VanDerWaalsContact C-N 3.29Å; G236-T238 PolarHBondContact O-N 2.69Å; G236-L239 PolarHBondContact O-N 2.75Å; G236-S240 PolarHBondContact O-N 3.33Å; G236-S240 PolarHBondContact O-OG 3.12Å; G236-S240 VanDerWaalsContact O-OG 3.11Å
237R97.6Very high96.2Very high138 Ų13836.5 Ų36.552%0.52120%0.203SC..Hα-helixtrans-62.5-36.2175.8-67.4-17863.5-179.30.4112.9F112 F235 L241F112-R237 HydrophobicContact CD2-CB 4.06Å; F235-R237 VanDerWaalsContact C-N 3.34Å; F235-R237 PolarHBondContact O-N 2.97Å; R237-L241 WeakPolarHBondContact O-CB 3.39Å; R237-L241 PolarHBondContact O-N 3.42Å
238T97.5Very high96.4Very high0 Ų041.4 Ų41.40%023%0.229CC..Hα-helixtrans-69.9-43.5177-56.20000110.4F112 F115 L205 F235 G236 L241 V242F112-T238 WeakPolarHBondContact CA-OG1 3.05Å; F112-T238 PolarHBondContact N-OG1 2.78Å; F115-T238 HydrophobicContact CB-CG2 3.82Å; F115-T238 HydrophobicContact CD2-CG2 3.38Å; F115-T238 HydrophobicContact CE2-CG2 4.18Å; F115-T238 HydrophobicContact CG-CG2 3.73Å; L205-T238 HydrophobicContact CD1-CG2 4.04Å; F235-T238 HydrophobicContact CE1-CG2 4.45Å; F235-T238 HydrophobicContact CZ-CG2 4.42Å; F235-T238 WeakPolarHBondContact O-CA 3.33Å; F235-T238 VanDerWaalsContact O-CB 3.25Å; F235-T238 WeakPolarHBondContact O-CB 3.43Å; F235-T238 PolarHBondContact O-N 3.3Å; G236-T238 VanDerWaalsContact C-N 3.29Å; G236-T238 PolarHBondContact O-N 2.69Å; T238-L241 WeakPolarHBondContact O-CB 3.38Å; T238-L241 PolarHBondContact O-N 3.05Å; T238-V242 VanDerWaalsContact O-CG2 3.26Å; T238-V242 WeakPolarHBondContact O-CG2 3.44Å; T238-V242 PolarHBondContact O-N 2.98Å
239L95.9Very high96.6Very high21 Ų2139.2 Ų39.211%0.1122%0.216CC..Hα-helixtrans-58.7-49.6174-63.2178.9000111.1L205 F231 F235 G236 L241 V242 V243 F277 F280L205-L239 HydrophobicContact CD1-CD2 4.36Å; L205-L239 HydrophobicContact CD2-CD2 3.81Å; L205-L239 HydrophobicContact CG-CD2 4.25Å; F231-L239 HydrophobicContact CE1-CD1 4.49Å; F235-L239 HydrophobicContact CD1-CD1 4.24Å; F235-L239 HydrophobicContact CD1-CD2 3.54Å; F235-L239 HydrophobicContact CD1-CG 3.65Å; F235-L239 HydrophobicContact CE1-CD2 3.71Å; F235-L239 HydrophobicContact CE1-CG 4.3Å; F235-L239 PolarHBondContact O-N 3.2Å; G236-L239 PolarHBondContact O-N 2.75Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 2.87Å; L239-V242 PolarHBondContact O-N 3.37Å; L239-V243 WeakPolarHBondContact O-CG2 3.33Å; L239-V243 PolarHBondContact O-N 3.19Å; L239-F277 HydrophobicContact CD2-CD1 3.99Å; L239-F277 HydrophobicContact CD2-CE1 3.77Å; L239-F280 HydrophobicContact CB-CD2 4.27Å; L239-F280 HydrophobicContact CD2-CD2 3.96Å; L239-F280 HydrophobicContact CD2-CE2 4.4Å; L239-F280 HydrophobicContact CD2-CG 4.29Å
240S96.7Very high96.8Very high83 Ų8335.3 Ų35.358%0.5820%0.195SC*.Hα-helixtrans-60.3-38178.4-58.70000112.8G236 G244G236-S240 PolarHBondContact O-N 3.33Å; G236-S240 PolarHBondContact O-OG 3.12Å; G236-S240 VanDerWaalsContact O-OG 3.11Å; S240-G244 PolarHBondContact O-N 3.37Å
241L98Very high96.8Very high36 Ų3637.9 Ų37.919%0.18821%0.214CC..Hα-helixtrans-62-47.2174.7169.970.3000112F112 K116 R237 T238 L239 T245F112-L241 HydrophobicContact CD2-CB 4.24Å; F112-L241 HydrophobicContact CD2-CD2 3.96Å; F112-L241 HydrophobicContact CE2-CB 3.81Å; F112-L241 HydrophobicContact CE2-CD1 4.33Å; F112-L241 HydrophobicContact CE2-CD2 3.83Å; F112-L241 HydrophobicContact CE2-CG 4.21Å; F112-L241 HydrophobicContact CG-CD2 4.45Å; F112-L241 HydrophobicContact CZ-CD1 4.35Å; F112-L241 HydrophobicContact CZ-CD2 4.18Å; K116-L241 HydrophobicContact CB-CD2 3.68Å; K116-L241 HydrophobicContact CG-CD2 4.39Å; R237-L241 WeakPolarHBondContact O-CB 3.39Å; R237-L241 PolarHBondContact O-N 3.42Å; T238-L241 WeakPolarHBondContact O-CB 3.38Å; T238-L241 PolarHBondContact O-N 3.05Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 2.87Å; L241-T245 WeakPolarHBondContact O-CB 3.47Å; L241-T245 PolarHBondContact O-N 3.22Å; L241-T245 PolarHBondContact O-OG1 3.49Å
242V97.7Very high96.7Very high0 Ų042.9 Ų42.90%024%0.241CC..Hα-helixtrans-63.2-48.3179.8175.40000109.8I119 V201 L205 T238 L239 T245 F246 F280I119-V242 HydrophobicContact CD1-CB 4.34Å; I119-V242 HydrophobicContact CD1-CG2 3.68Å; V201-V242 HydrophobicContact CG1-CG1 4.06Å; L205-V242 HydrophobicContact CD1-CG2 3.96Å; L205-V242 HydrophobicContact CD2-CB 4.49Å; L205-V242 HydrophobicContact CD2-CG1 4.25Å; L205-V242 HydrophobicContact CD2-CG2 4.24Å; T238-V242 VanDerWaalsContact O-CG2 3.26Å; T238-V242 WeakPolarHBondContact O-CG2 3.44Å; T238-V242 PolarHBondContact O-N 2.98Å; L239-V242 PolarHBondContact O-N 3.37Å; V242-T245 PolarHBondContact O-N 3.06Å; V242-F246 HydrophobicContact CG1-CD2 3.71Å; V242-F246 HydrophobicContact CG1-CE2 3.64Å; V242-F246 PolarHBondContact O-N 3.18Å; V242-F280 HydrophobicContact CB-CE2 4.08Å; V242-F280 HydrophobicContact CG1-CE2 3.8Å; V242-F280 HydrophobicContact CG1-CZ 3.84Å
243V97.5Very high96.7Very high16 Ų1640.9 Ų40.910%0.09723%0.231CC..Hα-helixtrans-55.7-56.7177171.30000110.4L239 T245 F246 E247 F280 T283 L284L239-V243 WeakPolarHBondContact O-CG2 3.33Å; L239-V243 PolarHBondContact O-N 3.19Å; V243-T245 VanDerWaalsContact C-N 3.25Å; V243-T245 PolarHBondContact O-N 2.8Å; V243-F246 PolarHBondContact O-N 3.42Å; V243-F246 VanDerWaalsContact O-N 3.09Å; V243-E247 HydrophobicContact CG1-CG 4.03Å; V243-E247 WeakPolarHBondContact O-CG 3.44Å; V243-E247 PolarHBondContact O-N 2.66Å; V243-F280 HydrophobicContact CG2-CD2 3.42Å; V243-F280 VanDerWaalsContact CG2-CD2 3.42Å; V243-F280 HydrophobicContact CG2-CE2 3.59Å; V243-T283 HydrophobicContact CG1-CG2 3.6Å; V243-L284 HydrophobicContact CG2-CD2 4.46Å; V243-L284 HydrophobicContact CG2-CG 4.33Å
244G97.9Very high96.6Very high36 Ų3638.6 Ų38.637%0.37122%0.22SC..Hα-helixtrans-60.8-33.6-177.400000113.5S240 N248S240-G244 PolarHBondContact O-N 3.37Å; G244-N248 WeakPolarHBondContact O-CB 3.34Å; G244-N248 PolarHBondContact O-N 2.8Å; G244-N248 VanDerWaalsContact O-N 3.16Å
245T97.3Very high96.5Very high41 Ų4139.9 Ų39.925%0.25223%0.227SC..Hα-helixtrans-67.9-43.2176.2-54.70000111.8I119 L241 V242 V243 S249I119-T245 HydrophobicContact CG2-CG2 3.59Å; L241-T245 WeakPolarHBondContact O-CB 3.47Å; L241-T245 PolarHBondContact O-N 3.22Å; L241-T245 PolarHBondContact O-OG1 3.49Å; V242-T245 PolarHBondContact O-N 3.06Å; V243-T245 VanDerWaalsContact C-N 3.25Å; V243-T245 PolarHBondContact O-N 2.8Å; T245-S249 PolarHBondContact O-N 2.71Å; T245-S249 PolarHBondContact O-OG 3.43Å
246F98.2Very high96.6Very high0 Ų040 Ų400%023%0.228CC..Hα-helixtrans-73.8-39.1177.7-73.4-42.3000112.5F194 F198 V201 V202 V242 V243 N248 S249 I250 L284F194-F246 AromaticContact CE2-CD1 3.94Å; F194-F246 HydrophobicContact CE2-CD1 3.94Å; F194-F246 HydrophobicContact CE2-CE1 4.25Å; F194-F246 AromaticContact CZ-CD1 3.91Å; F194-F246 HydrophobicContact CZ-CD1 3.91Å; F194-F246 HydrophobicContact CZ-CE1 4.41Å; F198-F246 HydrophobicContact CB-CE1 4.35Å; F198-F246 HydrophobicContact CB-CZ 4.32Å; F198-F246 AromaticContact CD2-CD1 3.77Å; F198-F246 HydrophobicContact CD2-CD1 3.77Å; F198-F246 AromaticContact CD2-CD2 3.67Å; F198-F246 HydrophobicContact CD2-CD2 3.67Å; F198-F246 AromaticContact CD2-CE1 3.73Å; F198-F246 HydrophobicContact CD2-CE1 3.73Å; F198-F246 AromaticContact CD2-CE2 3.6Å; F198-F246 HydrophobicContact CD2-CE2 3.6Å; F198-F246 AromaticContact CD2-CG 3.76Å; F198-F246 HydrophobicContact CD2-CG 3.76Å; F198-F246 AromaticContact CD2-CZ 3.65Å; F198-F246 HydrophobicContact CD2-CZ 3.65Å; F198-F246 HydrophobicContact CE2-CB 4.36Å; F198-F246 HydrophobicContact CE2-CD1 4.32Å; F198-F246 AromaticContact CE2-CD2 3.53Å; F198-F246 HydrophobicContact CE2-CD2 3.53Å; F198-F246 AromaticContact CE2-CE2 3.79Å; F198-F246 HydrophobicContact CE2-CE2 3.79Å; F198-F246 AromaticContact CE2-CG 3.84Å; F198-F246 HydrophobicContact CE2-CG 3.84Å; F198-F246 HydrophobicContact CE2-CZ 4.31Å; F198-F246 HydrophobicContact CG-CE1 4.48Å; F198-F246 HydrophobicContact CG-CE2 4.45Å; F198-F246 HydrophobicContact CG-CZ 4.27Å; V201-F246 HydrophobicContact CB-CE2 4.12Å; V201-F246 HydrophobicContact CB-CZ 3.72Å; V201-F246 HydrophobicContact CG1-CE2 3.81Å; V201-F246 HydrophobicContact CG1-CZ 3.82Å; V201-F246 HydrophobicContact CG2-CZ 4.01Å; V202-F246 HydrophobicContact CG2-CE2 4.26Å; V242-F246 HydrophobicContact CG1-CD2 3.71Å; V242-F246 HydrophobicContact CG1-CE2 3.64Å; V242-F246 PolarHBondContact O-N 3.18Å; V243-F246 PolarHBondContact O-N 3.42Å; V243-F246 VanDerWaalsContact O-N 3.09Å; F246-N248 VanDerWaalsContact C-N 3.3Å; F246-N248 PolarHBondContact O-N 3.37Å; F246-S249 CarbonylContact O-C 3.33Å; F246-S249 WeakPolarHBondContact O-CA 3.47Å; F246-S249 WeakPolarHBondContact O-CB 3.28Å; F246-S249 PolarHBondContact O-N 2.93Å; F246-I250 HydrophobicContact CB-CD1 4.16Å; F246-I250 WeakPolarHBondContact O-CB 3.46Å; F246-I250 WeakPolarHBondContact O-CD1 3.47Å; F246-I250 WeakPolarHBondContact O-CG1 3.43Å; F246-I250 PolarHBondContact O-N 3.35Å; F246-L284 HydrophobicContact CB-CD2 3.9Å
247E98Very high96.6Very high65 Ų6539.2 Ų39.230%0.30422%0.219SC..Hα-helixtrans-58.5-42.2175-72.9-173.6140.700112.2V243 S249 I250 S251 T283 S287V243-E247 HydrophobicContact CG1-CG 4.03Å; V243-E247 WeakPolarHBondContact O-CG 3.44Å; V243-E247 PolarHBondContact O-N 2.66Å; E247-S249 VanDerWaalsContact C-N 3.29Å; E247-S249 PolarHBondContact O-N 2.71Å; E247-I250 PolarHBondContact O-N 2.76Å; E247-S251 WeakPolarHBondContact O-CB 3.42Å; E247-S251 PolarHBondContact O-N 3.2Å; E247-S251 PolarHBondContact O-OG 3.15Å; E247-T283 WeakPolarHBondContact OE1-CG2 3.37Å; E247-S287 PolarHBondContact OE1-OG 3.07Å
248N96.6Very high96.6Very high102 Ų10232.6 Ų32.655%0.54519%0.194SC..Hα-helixtrans-63.2-36.1172.8-178.267.4000112.3G244 F246 S251 N252G244-N248 WeakPolarHBondContact O-CB 3.34Å; G244-N248 PolarHBondContact O-N 2.8Å; G244-N248 VanDerWaalsContact O-N 3.16Å; F246-N248 VanDerWaalsContact C-N 3.3Å; F246-N248 PolarHBondContact O-N 3.37Å; N248-S251 WeakPolarHBondContact CA-OG 3.48Å; N248-S251 PolarHBondContact O-OG 3.14Å; N248-S251 VanDerWaalsContact O-OG 3.09Å; N248-N252 PolarHBondContact O-ND2 3.33Å
249S95.7Very high96.6Very high14 Ų1432.6 Ų32.610%0.09819%0.194CC..Hα-helixtrans-74.4-39.1178.4-56.30000112.3M123 T245 F246 E247 S253M123-S249 WeakPolarHBondContact CE-OG 3.49Å; T245-S249 PolarHBondContact O-N 2.71Å; T245-S249 PolarHBondContact O-OG 3.43Å; F246-S249 CarbonylContact O-C 3.33Å; F246-S249 WeakPolarHBondContact O-CA 3.47Å; F246-S249 WeakPolarHBondContact O-CB 3.28Å; F246-S249 PolarHBondContact O-N 2.93Å; E247-S249 VanDerWaalsContact C-N 3.29Å; E247-S249 PolarHBondContact O-N 2.71Å; S249-S253 PolarHBondContact O-N 3.44Å
250I97.8Very high96.7Very high2 Ų231.7 Ų31.71%0.0119%0.189CC..Hα-helixtrans-66.8-51179.8-69.3160.5000109.6F194 F246 E247 N252 S253 L259 S287 L288 R291F194-I250 HydrophobicContact CZ-CG1 4.18Å; F246-I250 HydrophobicContact CB-CD1 4.16Å; F246-I250 WeakPolarHBondContact O-CB 3.46Å; F246-I250 WeakPolarHBondContact O-CD1 3.47Å; F246-I250 WeakPolarHBondContact O-CG1 3.43Å; F246-I250 PolarHBondContact O-N 3.35Å; E247-I250 PolarHBondContact O-N 2.76Å; I250-N252 PolarHBondContact O-N 3.2Å; I250-N252 VanDerWaalsContact O-N 3.1Å; I250-S253 WeakPolarHBondContact O-CB 3.49Å; I250-S253 PolarHBondContact O-N 3.47Å; I250-L259 HydrophobicContact CB-CD2 4.47Å; I250-L259 HydrophobicContact CG1-CD2 4.14Å; I250-L259 HydrophobicContact CG2-CD2 4.26Å; I250-S287 WeakPolarHBondContact CG2-O 3.3Å; I250-L288 HydrophobicContact CD1-CD2 3.57Å; I250-L288 HydrophobicContact CD1-CG 3.75Å; I250-L288 HydrophobicContact CG1-CD2 3.75Å; I250-L288 HydrophobicContact CG1-CG 4.44Å; I250-L288 HydrophobicContact CG2-CD2 4.33Å; I250-R291 HydrophobicContact CG2-CB 3.65Å; I250-R291 HydrophobicContact CG2-CG 4.09Å; I250-R291 WeakPolarHBondContact O-CG 3.48Å
251S96.5Very high96.8Very high61 Ų6127.7 Ų27.743%0.42716%0.162SC..Hα-helixtrans-56.2-30.2-178.751.10000113.8E247 N248 R291E247-S251 WeakPolarHBondContact O-CB 3.42Å; E247-S251 PolarHBondContact O-N 3.2Å; E247-S251 PolarHBondContact O-OG 3.15Å; N248-S251 WeakPolarHBondContact CA-OG 3.48Å; N248-S251 PolarHBondContact O-OG 3.14Å; N248-S251 VanDerWaalsContact O-OG 3.09Å; S251-R291 VanDerWaalsContact O-CZ 3.23Å; S251-R291 PolarHBondContact O-NE 3.11Å; S251-R291 PolarHBondContact O-NH1 2.96Å
252N93.5Very high96.8Very high107 Ų10726 Ų2657%0.57215%0.153SC*.THydrogen-bonded Turntrans-94.9-4.3179.2-67.2-59.6000114.3N248 I250N248-N252 PolarHBondContact O-ND2 3.33Å; I250-N252 PolarHBondContact O-N 3.2Å; I250-N252 VanDerWaalsContact O-N 3.1Å
253S94.3Very high96.8Very high19 Ų1926 Ų2613%0.13315%0.153CC..  trans-80.9139.5-174.2-174.60000112.5S249 I250 D255 R291S249-S253 PolarHBondContact O-N 3.44Å; I250-S253 WeakPolarHBondContact O-CB 3.49Å; I250-S253 PolarHBondContact O-N 3.47Å; S253-D255 PolarHBondContact OG-N 3.37Å; S253-R291 PolarHBondContact O-NE 2.86Å; S253-R291 PolarHBondContact O-NH2 2.93Å
254F94.7Very high96.8Very high52 Ų5225.3 Ų25.323%0.22815%0.149CC..  trans-109.3-0.4165.1-69.1-99.1000112.8A131 K133 C256 L295A131-F254 HydrophobicContact CB-CB 3.92Å; A131-F254 WeakPolarHBondContact O-CB 3.17Å; K133-F254 HydrophobicContact CB-CE1 3.89Å; K133-F254 HydrophobicContact CB-CZ 3.81Å; K133-F254 HydrophobicContact CG-CE1 4.26Å; K133-F254 HydrophobicContact CG-CZ 4.42Å; F254-C256 PolarHBondContact O-N 2.83Å; F254-C256 VanDerWaalsContact O-N 3.08Å; F254-L295 HydrophobicContact CB-CD2 4.4Å; F254-L295 HydrophobicContact CD1-CD2 3.76Å; F254-L295 HydrophobicContact CE1-CD2 4.33Å; F254-L295 HydrophobicContact CG-CD2 4.25Å
255D95Very high96.8Very high27 Ų2723.6 Ų23.614%0.14413%0.131CC..  trans-82.785.7176.9-174.9-13.7000109.8A131 R167 S253 I257 A258 L259A131-D255 HydrophobicContact CB-CB 4.49Å; R167-D255 IonicContact CZ-OD1 3.11Å; R167-D255 IonicContact CZ-OD2 2.89Å; R167-D255 IonicContact NH1-OD1 2.72Å; R167-D255 PolarHBondContact NH1-OD1 2.78Å; R167-D255 VanDerWaalsContact NH1-OD1 3.11Å; R167-D255 IonicContact NH1-OD2 3.98Å; R167-D255 PolarHBondContact NH1-OD2 3.37Å; R167-D255 IonicContact NH2-OD1 3.21Å; R167-D255 PolarHBondContact NH2-OD1 3.48Å; R167-D255 IonicContact NH2-OD2 3.9Å; R167-D255 PolarHBondContact NH2-OD2 3.29Å; S253-D255 PolarHBondContact OG-N 3.37Å; D255-I257 PolarHBondContact O-N 3.28Å; D255-I257 PolarHBondContact OD1-N 3.39Å; D255-A258 HydrophobicContact CB-CB 4Å; D255-A258 VanDerWaalsContact CG-CB 3.45Å; D255-A258 PolarHBondContact O-N 2.97Å; D255-A258 PolarHBondContact OD1-N 3.26Å; D255-A258 WeakPolarHBondContact OD2-CB 3.3Å; D255-L259 WeakPolarHBondContact O-CG 3.23Å; D255-L259 PolarHBondContact O-N 2.88Å
256C96.4Very high96.7Very high3 Ų321.7 Ų21.72%0.0212%0.119CC..Hα-helixtrans-62.2-31.5-178.5-169.70000112.4F254 L259 L260 L295 F328F254-C256 PolarHBondContact O-N 2.83Å; F254-C256 VanDerWaalsContact O-N 3.08Å; C256-L259 PolarHBondContact O-N 3.08Å; C256-L260 WeakPolarHBondContact O-CG 3.25Å; C256-L260 PolarHBondContact O-N 2.94Å; C256-L295 HydrophobicContact CB-CB 4.38Å; C256-L295 HydrophobicContact CB-CD1 3.98Å; C256-F328 HydrophobicContact CB-CE2 3.91Å; C256-F328 HydrophobicContact CB-CZ 3.9Å
257I96.1Very high96.5Very high0 Ų024.7 Ų24.70%013%0.13CC..Hα-helixtrans-64.6-47.6177.2-69.6174.2000110.1F162 L164 D255 L259 L260 L261 F328 A331 I335F162-I257 VanDerWaalsContact C-CD1 3.49Å; F162-I257 WeakPolarHBondContact O-CD1 3.23Å; L164-I257 HydrophobicContact CD1-CG2 3.77Å; D255-I257 PolarHBondContact O-N 3.28Å; D255-I257 PolarHBondContact OD1-N 3.39Å; I257-L259 VanDerWaalsContact C-N 3.26Å; I257-L259 PolarHBondContact O-N 3.05Å; I257-L260 PolarHBondContact O-N 2.89Å; I257-L261 HydrophobicContact CG2-CD1 3.79Å; I257-L261 HydrophobicContact CG2-CG 4.32Å; I257-L261 WeakPolarHBondContact O-CB 3.39Å; I257-L261 VanDerWaalsContact O-CG 3.29Å; I257-L261 WeakPolarHBondContact O-CG 3.49Å; I257-L261 PolarHBondContact O-N 3.32Å; I257-F328 HydrophobicContact CD1-CD2 4.45Å; I257-F328 HydrophobicContact CG1-CD2 4.4Å; I257-F328 HydrophobicContact CG1-CE2 4.26Å; I257-A331 HydrophobicContact CD1-CB 3.52Å; I257-A331 HydrophobicContact CG1-CB 4.04Å; I257-I335 HydrophobicContact CG2-CD1 4.18Å
258A96.4Very high96.3Very high0 Ų024.6 Ų24.60%013%0.129CC..Hα-helixtrans-56-42.217600000112.5R167 F194 E195 D255 S262R167-A258 VanDerWaalsContact NH2-CB 3.34Å; F194-A258 HydrophobicContact CB-CB 4.07Å; F194-A258 HydrophobicContact CD1-CB 4.08Å; E195-A258 WeakPolarHBondContact OE2-CA 3.4Å; E195-A258 VanDerWaalsContact OE2-CB 3.28Å; E195-A258 WeakPolarHBondContact OE2-CB 3.22Å; D255-A258 HydrophobicContact CB-CB 4Å; D255-A258 VanDerWaalsContact CG-CB 3.45Å; D255-A258 PolarHBondContact O-N 2.97Å; D255-A258 PolarHBondContact OD1-N 3.26Å; D255-A258 WeakPolarHBondContact OD2-CB 3.3Å; A258-S262 WeakPolarHBondContact O-CB 3.37Å; A258-S262 PolarHBondContact O-N 3.22Å; A258-S262 PolarHBondContact O-OG 3.22Å
259L98.1Very high96.1Very high0 Ų019.8 Ų19.80%010%0.103CC..Hα-helixtrans-68.6-44.3-178.5-58.6-175.2000111.3F194 I250 D255 C256 I257 S262 I263 L288 R291 V292 L295F194-L259 HydrophobicContact CE1-CD2 4.23Å; I250-L259 HydrophobicContact CB-CD2 4.47Å; I250-L259 HydrophobicContact CG1-CD2 4.14Å; I250-L259 HydrophobicContact CG2-CD2 4.26Å; D255-L259 WeakPolarHBondContact O-CG 3.23Å; D255-L259 PolarHBondContact O-N 2.88Å; C256-L259 PolarHBondContact O-N 3.08Å; I257-L259 VanDerWaalsContact C-N 3.26Å; I257-L259 PolarHBondContact O-N 3.05Å; L259-S262 WeakPolarHBondContact O-CB 3.33Å; L259-S262 PolarHBondContact O-N 3.07Å; L259-I263 WeakPolarHBondContact O-CG1 3.47Å; L259-I263 PolarHBondContact O-N 2.8Å; L259-L288 HydrophobicContact CB-CD2 4.22Å; L259-L288 HydrophobicContact CD2-CD2 3.94Å; L259-R291 HydrophobicContact CD1-CB 3.94Å; L259-R291 HydrophobicContact CD1-CG 3.44Å; L259-R291 VanDerWaalsContact CD1-CG 3.44Å; L259-V292 HydrophobicContact CB-CG2 3.66Å; L259-V292 HydrophobicContact CD1-CG2 4.21Å; L259-L295 HydrophobicContact CD1-CD1 3.87Å
260L98.3Very high95.9Very high1 Ų121.8 Ų21.81%0.00511%0.111CC..Hα-helixtrans-62.8-43.2175.5-73.7172.4000111.8C256 I257 S262 I263 Q264 W289 V292 L332 I335 I344C256-L260 WeakPolarHBondContact O-CG 3.25Å; C256-L260 PolarHBondContact O-N 2.94Å; I257-L260 PolarHBondContact O-N 2.89Å; L260-S262 VanDerWaalsContact C-N 3.3Å; L260-S262 PolarHBondContact O-N 3.38Å; L260-I263 HydrophobicContact CD2-CD1 4.3Å; L260-I263 WeakPolarHBondContact O-CB 3.36Å; L260-I263 PolarHBondContact O-N 3.43Å; L260-Q264 WeakPolarHBondContact O-CG 3.49Å; L260-Q264 PolarHBondContact O-N 2.83Å; L260-W289 HydrophobicContact CD2-CZ3 4.22Å; L260-V292 HydrophobicContact CD2-CG1 3.88Å; L260-V292 HydrophobicContact CD2-CG2 4.21Å; L260-V292 HydrophobicContact CG-CG1 4.34Å; L260-V292 HydrophobicContact CG-CG2 4.27Å; L260-L332 HydrophobicContact CD1-CD1 3.69Å; L260-L332 HydrophobicContact CD1-CG 3.75Å; L260-I335 HydrophobicContact CB-CD1 4.05Å; L260-I335 HydrophobicContact CB-CG2 4.19Å; L260-I335 HydrophobicContact CD1-CD1 4.47Å; L260-I344 HydrophobicContact CD2-CD1 4.13Å; L260-I344 HydrophobicContact CD2-CG1 4.06Å
261L98.1Very high95.3Very high0 Ų027.2 Ų27.20%014%0.144CC..Hα-helixtrans-61.3-40.5174-69172.1000111.5L164 R167 D168 V170 I171 E195 I257 I263 Q264 I265 I335L164-L261 HydrophobicContact CD1-CD1 4.17Å; L164-L261 HydrophobicContact CD1-CD2 4.37Å; R167-L261 HydrophobicContact CB-CD1 3.73Å; D168-L261 HydrophobicContact CB-CD2 4.48Å; V170-L261 HydrophobicContact CG1-CB 4.4Å; I171-L261 HydrophobicContact CD1-CB 4.4Å; I171-L261 HydrophobicContact CD1-CD2 3.4Å; I171-L261 VanDerWaalsContact CD1-CD2 3.4Å; I171-L261 HydrophobicContact CG1-CD2 4.43Å; E195-L261 HydrophobicContact CB-CB 3.91Å; E195-L261 HydrophobicContact CG-CB 4.01Å; E195-L261 HydrophobicContact CG-CD1 3.81Å; I257-L261 HydrophobicContact CG2-CD1 3.79Å; I257-L261 HydrophobicContact CG2-CG 4.32Å; I257-L261 WeakPolarHBondContact O-CB 3.39Å; I257-L261 VanDerWaalsContact O-CG 3.29Å; I257-L261 WeakPolarHBondContact O-CG 3.49Å; I257-L261 PolarHBondContact O-N 3.32Å; L261-I263 VanDerWaalsContact C-N 3.34Å; L261-I263 PolarHBondContact O-N 3.03Å; L261-Q264 PolarHBondContact O-N 3.24Å; L261-I265 WeakPolarHBondContact O-CD1 3.28Å; L261-I265 VanDerWaalsContact O-CG1 3.3Å; L261-I265 WeakPolarHBondContact O-CG1 3.31Å; L261-I265 PolarHBondContact O-N 3.32Å; L261-I335 HydrophobicContact CD2-CD1 4.08Å; L261-I335 HydrophobicContact CD2-CG1 3.84Å; L261-I335 HydrophobicContact CG-CD1 4.08Å; L261-I335 HydrophobicContact CG-CG1 4.4Å
262S98.3Very high94.6Very high0 Ų029.3 Ų29.30%015%0.15CC..Hα-helixtrans-63.4-37.4175.6-57.40000112.6A258 L259 L260 I265 I266A258-S262 WeakPolarHBondContact O-CB 3.37Å; A258-S262 PolarHBondContact O-N 3.22Å; A258-S262 PolarHBondContact O-OG 3.22Å; L259-S262 WeakPolarHBondContact O-CB 3.33Å; L259-S262 PolarHBondContact O-N 3.07Å; L260-S262 VanDerWaalsContact C-N 3.3Å; L260-S262 PolarHBondContact O-N 3.38Å; S262-I265 PolarHBondContact O-N 3.07Å; S262-I266 WeakPolarHBondContact O-CG1 3.1Å; S262-I266 PolarHBondContact O-N 2.79Å; S262-I266 VanDerWaalsContact O-N 3.11Å
263I98.4Very high93.5Very high1 Ų125.9 Ų25.91%0.00514%0.135CC..Hα-helixtrans-60.9-48.1171.9-70.9162.9000110.3L259 L260 L261 I265 I266 R267 L285 L288 W289 V292L259-I263 WeakPolarHBondContact O-CG1 3.47Å; L259-I263 PolarHBondContact O-N 2.8Å; L260-I263 HydrophobicContact CD2-CD1 4.3Å; L260-I263 WeakPolarHBondContact O-CB 3.36Å; L260-I263 PolarHBondContact O-N 3.43Å; L261-I263 VanDerWaalsContact C-N 3.34Å; L261-I263 PolarHBondContact O-N 3.03Å; I263-I265 VanDerWaalsContact C-N 3.32Å; I263-I265 PolarHBondContact O-N 2.93Å; I263-I266 PolarHBondContact O-N 3.44Å; I263-R267 HydrophobicContact CG2-CG 4.48Å; I263-R267 WeakPolarHBondContact O-CG 3.48Å; I263-R267 PolarHBondContact O-N 2.77Å; I263-L285 HydrophobicContact CB-CD2 4.47Å; I263-L285 HydrophobicContact CG1-CD2 4.43Å; I263-L285 HydrophobicContact CG2-CD2 4Å; I263-L288 HydrophobicContact CD1-CB 3.91Å; I263-L288 HydrophobicContact CG1-CB 3.57Å; I263-L288 HydrophobicContact CG1-CD1 3.86Å; I263-L288 HydrophobicContact CG1-CG 4.21Å; I263-W289 HydrophobicContact CD1-CD2 3.66Å; I263-W289 HydrophobicContact CD1-CE3 3.83Å; I263-W289 HydrophobicContact CD1-CG 4.15Å; I263-W289 HydrophobicContact CD1-CH2 4.28Å; I263-W289 HydrophobicContact CD1-CZ2 4.14Å; I263-W289 HydrophobicContact CD1-CZ3 4.13Å; I263-W289 HydrophobicContact CG2-CH2 4.36Å; I263-W289 HydrophobicContact CG2-CZ2 3.59Å; I263-V292 HydrophobicContact CD1-CG2 4.07Å
264Q97.4Very high92.1Very high1 Ų127.8 Ų27.81%0.00515%0.152CC..Hα-helixtrans-65.1-35.9-179.8-61.2-59.913.900112.4I171 L260 L261 R267 K268 I335 L339I171-Q264 HydrophobicContact CD1-CB 3.45Å; I171-Q264 VanDerWaalsContact CD1-CB 3.45Å; I171-Q264 HydrophobicContact CD1-CG 4.09Å; I171-Q264 HydrophobicContact CG1-CB 4.22Å; L260-Q264 WeakPolarHBondContact O-CG 3.49Å; L260-Q264 PolarHBondContact O-N 2.83Å; L261-Q264 PolarHBondContact O-N 3.24Å; Q264-R267 PolarHBondContact O-N 2.85Å; Q264-K268 WeakPolarHBondContact O-CG 3.22Å; Q264-K268 PolarHBondContact O-N 3.47Å; Q264-I335 HydrophobicContact CG-CG2 3.78Å; Q264-I335 PolarHBondContact NE2-O 3.19Å; Q264-L339 PolarHBondContact NE2-O 3.3Å
265I96.9Very high90.7Very high0 Ų033.1 Ų33.10%018%0.181CC..Hα-helixtrans-57-50.4171.5-70.9157.7000110.5V170 I171 E195 F198 R199 L261 S262 I263 R267 K268 Y269V170-I265 HydrophobicContact CG1-CD1 3.97Å; V170-I265 HydrophobicContact CG1-CG1 4.42Å; V170-I265 HydrophobicContact CG2-CD1 4Å; I171-I265 HydrophobicContact CG1-CG1 4.05Å; E195-I265 HydrophobicContact CB-CD1 4.21Å; F198-I265 HydrophobicContact CD1-CD1 4.37Å; F198-I265 HydrophobicContact CD1-CG2 4.33Å; F198-I265 HydrophobicContact CE1-CG2 4.31Å; R199-I265 HydrophobicContact CB-CD1 3.83Å; R199-I265 HydrophobicContact CB-CG1 4.49Å; R199-I265 HydrophobicContact CB-CG2 4.38Å; R199-I265 HydrophobicContact CG-CD1 4.43Å; R199-I265 HydrophobicContact CG-CG2 4.39Å; L261-I265 WeakPolarHBondContact O-CD1 3.28Å; L261-I265 VanDerWaalsContact O-CG1 3.3Å; L261-I265 WeakPolarHBondContact O-CG1 3.31Å; L261-I265 PolarHBondContact O-N 3.32Å; S262-I265 PolarHBondContact O-N 3.07Å; I263-I265 VanDerWaalsContact C-N 3.32Å; I263-I265 PolarHBondContact O-N 2.93Å; I265-R267 VanDerWaalsContact C-N 3.35Å; I265-R267 PolarHBondContact O-N 3.46Å; I265-K268 PolarHBondContact O-N 2.9Å; I265-Y269 HydrophobicContact CG2-CD2 3.6Å; I265-Y269 HydrophobicContact CG2-CE2 3.32Å; I265-Y269 WeakPolarHBondContact O-CD2 3.45Å; I265-Y269 PolarHBondContact O-N 2.85Å
266I95.8Very high89.5Confident0 Ų034.2 Ų34.20%019%0.187CC..Hα-helixtrans-58.6-48.1177.5-66.2172.1000110.5F198 S262 I263 K268 Y269 Q270 W281 L284 L285 L288F198-I266 HydrophobicContact CE1-CD1 4.31Å; F198-I266 HydrophobicContact CE1-CG1 3.9Å; F198-I266 HydrophobicContact CZ-CD1 3.88Å; F198-I266 HydrophobicContact CZ-CG1 3.91Å; S262-I266 WeakPolarHBondContact O-CG1 3.1Å; S262-I266 PolarHBondContact O-N 2.79Å; S262-I266 VanDerWaalsContact O-N 3.11Å; I263-I266 PolarHBondContact O-N 3.44Å; I266-K268 VanDerWaalsContact C-N 3.32Å; I266-K268 PolarHBondContact O-N 2.95Å; I266-Y269 PolarHBondContact O-N 2.64Å; I266-Y269 VanDerWaalsContact O-N 3.15Å; I266-Q270 HydrophobicContact CG2-CG 4.13Å; I266-Q270 WeakPolarHBondContact O-CG 3.4Å; I266-Q270 PolarHBondContact O-N 3.36Å; I266-W281 HydrophobicContact CB-CE3 4.32Å; I266-W281 HydrophobicContact CG1-CE3 4.12Å; I266-W281 HydrophobicContact CG1-CZ3 4.29Å; I266-W281 HydrophobicContact CG2-CB 4.05Å; I266-W281 HydrophobicContact CG2-CD2 3.98Å; I266-W281 HydrophobicContact CG2-CE3 3.57Å; I266-W281 HydrophobicContact CG2-CG 4.21Å; I266-W281 HydrophobicContact CG2-CZ3 4.32Å; I266-L284 HydrophobicContact CD1-CB 3.74Å; I266-L284 HydrophobicContact CD1-CD1 4.48Å; I266-L285 HydrophobicContact CB-CD2 4.04Å; I266-L285 HydrophobicContact CB-CG 4.4Å; I266-L285 HydrophobicContact CD1-CD2 3.95Å; I266-L285 HydrophobicContact CD1-CG 4.03Å; I266-L285 HydrophobicContact CG2-CD1 3.86Å; I266-L285 HydrophobicContact CG2-CD2 3.92Å; I266-L285 HydrophobicContact CG2-CG 3.79Å; I266-L288 HydrophobicContact CD1-CD1 3.52Å
267R94.3Very high88.7Confident63 Ų6334.2 Ų34.224%0.23819%0.186CC..Hα-helixtrans-60.7-40.8-178.5-70.9177.171.8-160.411.9111.9I263 Q264 I265 Q270 T271 L339 P340 D341I263-R267 HydrophobicContact CG2-CG 4.48Å; I263-R267 WeakPolarHBondContact O-CG 3.48Å; I263-R267 PolarHBondContact O-N 2.77Å; Q264-R267 PolarHBondContact O-N 2.85Å; I265-R267 VanDerWaalsContact C-N 3.35Å; I265-R267 PolarHBondContact O-N 3.46Å; R267-Q270 PolarHBondContact O-N 3.29Å; R267-T271 PolarHBondContact O-N 3.29Å; R267-L339 HydrophobicContact CB-CD1 3.88Å; R267-L339 PolarHBondContact NH1-O 3.12Å; R267-P340 PolarHBondContact NH1-O 3.32Å; R267-P340 PolarHBondContact NH2-O 2.98Å; R267-D341 IonicContact CZ-OD2 2.88Å; R267-D341 IonicContact NH1-OD2 3.81Å
268K93.5Very high88.1Confident63 Ų6337.1 Ų37.127%0.27421%0.206SC..Hα-helixtrans-63-47.7173.4-73.4-71.9-173.3178.10111.2I171 L175 Q264 I265 I266 Q270 T271 L339I171-K268 HydrophobicContact CG2-CG 4.01Å; L175-K268 HydrophobicContact CD1-CB 4.12Å; L175-K268 HydrophobicContact CD2-CB 3.78Å; L175-K268 HydrophobicContact CD2-CG 4.24Å; Q264-K268 WeakPolarHBondContact O-CG 3.22Å; Q264-K268 PolarHBondContact O-N 3.47Å; I265-K268 PolarHBondContact O-N 2.9Å; I266-K268 VanDerWaalsContact C-N 3.32Å; I266-K268 PolarHBondContact O-N 2.95Å; K268-Q270 VanDerWaalsContact C-N 3.32Å; K268-Q270 PolarHBondContact O-N 3.33Å; K268-T271 WeakPolarHBondContact O-CB 3.4Å; K268-T271 PolarHBondContact O-N 3.22Å; K268-T271 VanDerWaalsContact O-N 3.09Å; K268-T271 PolarHBondContact O-OG1 2.94Å; K268-L339 HydrophobicContact CD-CD1 3.94Å; K268-L339 HydrophobicContact CD-CG 4.47Å; K268-L339 HydrophobicContact CG-CD1 3.87Å
269Y92.8Very high87.7Confident1 Ų146.6 Ų46.60%0.00424%0.242CC..Hα-helixtrans-65.6-31.4178.6-71.7-39.3000114L175 R199 V202 Y203 L206 I265 I266 T271 L272 S273L175-Y269 HydrophobicContact CD1-CD1 4.31Å; L175-Y269 HydrophobicContact CD1-CE1 3.74Å; L175-Y269 HydrophobicContact CD1-CE2 4.37Å; L175-Y269 HydrophobicContact CG-CE1 3.88Å; L175-Y269 PolarHBondContact O-OH 3Å; R199-Y269 WeakPolarHBondContact CG-OH 3.32Å; V202-Y269 HydrophobicContact CB-CE2 4.25Å; V202-Y269 HydrophobicContact CG1-CD2 3.56Å; V202-Y269 HydrophobicContact CG1-CE2 3.73Å; Y203-Y269 WeakPolarHBondContact CB-OH 3.38Å; Y203-Y269 AromaticContact CD2-CE1 3.79Å; Y203-Y269 HydrophobicContact CD2-CE1 3.79Å; Y203-Y269 AromaticContact CD2-CZ 3.84Å; Y203-Y269 WeakPolarHBondContact CD2-OH 3.43Å; Y203-Y269 HydrophobicContact CE2-CE1 4.41Å; L206-Y269 HydrophobicContact CD1-CD1 3.68Å; L206-Y269 HydrophobicContact CD1-CD2 3.78Å; L206-Y269 HydrophobicContact CD1-CE1 4.18Å; L206-Y269 HydrophobicContact CD1-CE2 4.22Å; L206-Y269 HydrophobicContact CD1-CG 3.5Å; L206-Y269 VanDerWaalsContact CD1-CG 3.5Å; I265-Y269 HydrophobicContact CG2-CD2 3.6Å; I265-Y269 HydrophobicContact CG2-CE2 3.32Å; I265-Y269 WeakPolarHBondContact O-CD2 3.45Å; I265-Y269 PolarHBondContact O-N 2.85Å; I266-Y269 PolarHBondContact O-N 2.64Å; I266-Y269 VanDerWaalsContact O-N 3.15Å; Y269-T271 PolarHBondContact O-N 2.78Å; Y269-L272 HydrophobicContact CD1-CD1 4.18Å; Y269-L272 PolarHBondContact O-N 2.75Å; Y269-S273 PolarHBondContact O-N 3.08Å
270Q90.7Very high87.4Confident57 Ų5747 Ų4727%0.26624%0.244SC..Hα-helixtrans-59.4-31.5172.7-78.2178.7-40.100112.3I266 R267 K268 L272 A274 W281I266-Q270 HydrophobicContact CG2-CG 4.13Å; I266-Q270 WeakPolarHBondContact O-CG 3.4Å; I266-Q270 PolarHBondContact O-N 3.36Å; R267-Q270 PolarHBondContact O-N 3.29Å; K268-Q270 VanDerWaalsContact C-N 3.32Å; K268-Q270 PolarHBondContact O-N 3.33Å; Q270-L272 VanDerWaalsContact C-N 3.29Å; Q270-L272 PolarHBondContact O-N 3.32Å; Q270-A274 WeakPolarHBondContact O-CB 3.37Å; Q270-W281 HydrophobicContact CG-CB 4.24Å; Q270-W281 HydrophobicContact CG-CD2 4.24Å; Q270-W281 HydrophobicContact CG-CG 3.78Å; Q270-W281 VanDerWaalsContact NE2-CB 3.31Å
271T86.7Confident87.1Confident115 Ų11547 Ų4771%0.70624%0.244SC*.Hα-helixtrans-71.5-23.7174.169.50000113.3R267 K268 Y269R267-T271 PolarHBondContact O-N 3.29Å; K268-T271 WeakPolarHBondContact O-CB 3.4Å; K268-T271 PolarHBondContact O-N 3.22Å; K268-T271 VanDerWaalsContact O-N 3.09Å; K268-T271 PolarHBondContact O-OG1 2.94Å; Y269-T271 PolarHBondContact O-N 2.78Å
272L80.8Confident86.9Confident105 Ų10551.2 Ų51.255%0.5527%0.266SS..Hα-helixtrans-92-34179.5-61.1178.2000112.7Y269 Q270Y269-L272 HydrophobicContact CD1-CD1 4.18Å; Y269-L272 PolarHBondContact O-N 2.75Å; Q270-L272 VanDerWaalsContact C-N 3.29Å; Q270-L272 PolarHBondContact O-N 3.32Å
273S70.9Confident86.8Confident36 Ų3653.9 Ų53.925%0.25228%0.282SS..  trans-151.188.7-177.4-173.40000112.3Y269 W281Y269-S273 PolarHBondContact O-N 3.08Å; S273-W281 PolarHBondContact O-NE1 3.43Å
274A65.5Low86.8Confident59 Ų5953.8 Ų53.849%0.48828%0.282SS..  trans-85.1-46.5-171.300000114.9Q270Q270-A274 WeakPolarHBondContact O-CB 3.37Å
275L64.7Low86.8Confident163 Ų16354.9 Ų54.985%0.85329%0.288SS*.SBendtrans-74.9-46.8-161.7-89.798.1000114.6F277L275-F277 VanDerWaalsContact C-N 3.3Å; L275-F277 PolarHBondContact O-N 3.3Å
276I70.5Confident86.9Confident51 Ų5161 Ų6126%0.26232%0.32SS..THydrogen-bonded Turntrans-70.5-30.3-168.4-62.5170.8000111.8Y213 F231Y213-I276 HydrophobicContact CD1-CD1 3.71Å; Y213-I276 HydrophobicContact CD2-CD1 3.84Å; Y213-I276 HydrophobicContact CD2-CG1 4.35Å; Y213-I276 HydrophobicContact CE1-CD1 4.18Å; Y213-I276 HydrophobicContact CE2-CD1 4.3Å; Y213-I276 HydrophobicContact CE2-CG1 4.5Å; Y213-I276 HydrophobicContact CG-CD1 3.52Å; Y213-I276 HydrophobicContact CG-CG1 4.5Å; F231-I276 HydrophobicContact CD1-CG2 3.82Å; F231-I276 HydrophobicContact CE1-CG2 3.26Å; F231-I276 HydrophobicContact CE2-CG2 4.06Å; F231-I276 HydrophobicContact CG-CG2 4.42Å; F231-I276 HydrophobicContact CZ-CG2 3.39Å
277F78.6Confident87Confident2 Ų262.4 Ų62.41%0.00933%0.33CS..THydrogen-bonded Turntrans-106.712-172.2-68.7-84.5000113.9L205 L206 A209 F235 L239 L275 R279 F280 W281L205-F277 HydrophobicContact CD2-CE1 4.23Å; L205-F277 HydrophobicContact CG-CE1 4.19Å; L206-F277 HydrophobicContact CD2-CD2 3.57Å; L206-F277 HydrophobicContact CD2-CE1 4.49Å; L206-F277 HydrophobicContact CD2-CE2 3.32Å; L206-F277 HydrophobicContact CD2-CG 4.26Å; L206-F277 HydrophobicContact CD2-CZ 3.79Å; L206-F277 HydrophobicContact CG-CE2 4.46Å; A209-F277 HydrophobicContact CB-CE1 4.03Å; A209-F277 HydrophobicContact CB-CE2 4.08Å; A209-F277 HydrophobicContact CB-CZ 3.3Å; F235-F277 HydrophobicContact CE1-CE1 4.42Å; L239-F277 HydrophobicContact CD2-CD1 3.99Å; L239-F277 HydrophobicContact CD2-CE1 3.77Å; L275-F277 VanDerWaalsContact C-N 3.3Å; L275-F277 PolarHBondContact O-N 3.3Å; F277-R279 VanDerWaalsContact C-N 3.33Å; F277-R279 PolarHBondContact O-N 3.32Å; F277-F280 HydrophobicContact CB-CB 4.34Å; F277-F280 HydrophobicContact CB-CD1 4.41Å; F277-F280 HydrophobicContact CD1-CB 4.28Å; F277-F280 HydrophobicContact CD1-CD1 4.03Å; F277-F280 HydrophobicContact CD1-CG 4.27Å; F277-F280 WeakPolarHBondContact O-CA 3.46Å; F277-F280 WeakPolarHBondContact O-CB 3.29Å; F277-F280 PolarHBondContact O-N 3.42Å; F277-W281 VanDerWaalsContact C-CD1 3.48Å; F277-W281 HydrophobicContact CB-CD2 4.09Å; F277-W281 HydrophobicContact CB-CG 4.24Å; F277-W281 HydrophobicContact CB-CZ2 3.76Å; F277-W281 HydrophobicContact CD2-CZ2 4.33Å; F277-W281 HydrophobicContact CG-CZ2 4.05Å; F277-W281 VanDerWaalsContact O-CG 3.31Å; F277-W281 PolarHBondContact O-N 2.89Å
278C83.1Confident87.2Confident62 Ų6259.4 Ų59.442%0.41932%0.318SS..Hα-helixtrans-51.2-48.1-173.3-177.50000113.1N282C278-N282 WeakPolarHBondContact O-CB 3.36Å; C278-N282 PolarHBondContact O-N 3.09Å; C278-N282 PolarHBondContact O-ND2 2.92Å
279R87.9Confident87.4Confident199 Ų19957.1 Ų57.175%0.75131%0.308SS*.Hα-helixtrans-63.2-44.5176.4-68-178.5179.7167.20.8112.3F277 N282 T283F277-R279 VanDerWaalsContact C-N 3.33Å; F277-R279 PolarHBondContact O-N 3.32Å; R279-N282 PolarHBondContact O-N 3.11Å; R279-T283 PolarHBondContact O-N 2.91Å; R279-T283 PolarHBondContact O-OG1 3.46Å; R279-T283 VanDerWaalsContact O-OG1 3.1Å
280F92Very high87.7Confident9 Ų960.8 Ų60.84%0.03933%0.334CS..Hα-helixtrans-59.2-47.7179173.1-99.2000111.9L205 L239 V242 V243 F277 L284L205-F280 HydrophobicContact CD2-CD2 4.47Å; L205-F280 HydrophobicContact CD2-CE1 3.87Å; L205-F280 HydrophobicContact CD2-CE2 3.76Å; L205-F280 HydrophobicContact CD2-CZ 3.41Å; L205-F280 VanDerWaalsContact CD2-CZ 3.41Å; L239-F280 HydrophobicContact CB-CD2 4.27Å; L239-F280 HydrophobicContact CD2-CD2 3.96Å; L239-F280 HydrophobicContact CD2-CE2 4.4Å; L239-F280 HydrophobicContact CD2-CG 4.29Å; V242-F280 HydrophobicContact CB-CE2 4.08Å; V242-F280 HydrophobicContact CG1-CE2 3.8Å; V242-F280 HydrophobicContact CG1-CZ 3.84Å; V243-F280 HydrophobicContact CG2-CD2 3.42Å; V243-F280 VanDerWaalsContact CG2-CD2 3.42Å; V243-F280 HydrophobicContact CG2-CE2 3.59Å; F277-F280 HydrophobicContact CB-CB 4.34Å; F277-F280 HydrophobicContact CB-CD1 4.41Å; F277-F280 HydrophobicContact CD1-CB 4.28Å; F277-F280 HydrophobicContact CD1-CD1 4.03Å; F277-F280 HydrophobicContact CD1-CG 4.27Å; F277-F280 WeakPolarHBondContact O-CA 3.46Å; F277-F280 WeakPolarHBondContact O-CB 3.29Å; F277-F280 PolarHBondContact O-N 3.42Å; F280-L284 HydrophobicContact CD1-CD1 4.32Å; F280-L284 HydrophobicContact CD2-CD1 4.45Å; F280-L284 HydrophobicContact CE1-CD1 3.68Å; F280-L284 HydrophobicContact CE2-CD1 3.82Å; F280-L284 HydrophobicContact CZ-CD1 3.38Å; F280-L284 PolarHBondContact O-N 3.21Å
281W93.1Very high88.1Confident1 Ų159.7 Ų59.70%0.00433%0.327CS..Hα-helixtrans-61.8-47.6177-58.1137.2000112.2V202 L206 I266 Q270 S273 F277 T283 L284 L285V202-W281 HydrophobicContact CG1-CH2 3.49Å; V202-W281 VanDerWaalsContact CG1-CH2 3.49Å; V202-W281 HydrophobicContact CG1-CZ3 3.55Å; L206-W281 HydrophobicContact CD1-CH2 4.06Å; L206-W281 HydrophobicContact CD1-CZ2 4.34Å; L206-W281 HydrophobicContact CD2-CH2 3.82Å; L206-W281 HydrophobicContact CD2-CZ2 3.5Å; L206-W281 VanDerWaalsContact CD2-CZ2 3.5Å; L206-W281 HydrophobicContact CG-CH2 4.08Å; L206-W281 HydrophobicContact CG-CZ2 4.25Å; I266-W281 HydrophobicContact CB-CE3 4.32Å; I266-W281 HydrophobicContact CG1-CE3 4.12Å; I266-W281 HydrophobicContact CG1-CZ3 4.29Å; I266-W281 HydrophobicContact CG2-CB 4.05Å; I266-W281 HydrophobicContact CG2-CD2 3.98Å; I266-W281 HydrophobicContact CG2-CE3 3.57Å; I266-W281 HydrophobicContact CG2-CG 4.21Å; I266-W281 HydrophobicContact CG2-CZ3 4.32Å; Q270-W281 HydrophobicContact CG-CB 4.24Å; Q270-W281 HydrophobicContact CG-CD2 4.24Å; Q270-W281 HydrophobicContact CG-CG 3.78Å; Q270-W281 VanDerWaalsContact NE2-CB 3.31Å; S273-W281 PolarHBondContact O-NE1 3.43Å; F277-W281 VanDerWaalsContact C-CD1 3.48Å; F277-W281 HydrophobicContact CB-CD2 4.09Å; F277-W281 HydrophobicContact CB-CG 4.24Å; F277-W281 HydrophobicContact CB-CZ2 3.76Å; F277-W281 HydrophobicContact CD2-CZ2 4.33Å; F277-W281 HydrophobicContact CG-CZ2 4.05Å; F277-W281 VanDerWaalsContact O-CG 3.31Å; F277-W281 PolarHBondContact O-N 2.89Å; W281-T283 VanDerWaalsContact C-N 3.34Å; W281-T283 PolarHBondContact O-N 3.2Å; W281-L284 PolarHBondContact O-N 3.38Å; W281-L285 VanDerWaalsContact O-CB 3.31Å; W281-L285 WeakPolarHBondContact O-CB 3.5Å; W281-L285 VanDerWaalsContact O-CG 3.28Å; W281-L285 WeakPolarHBondContact O-CG 3.45Å; W281-L285 PolarHBondContact O-N 3.31Å
282N94Very high88.7Confident87 Ų8754.2 Ų54.247%0.46529%0.294SS..Hα-helixtrans-62.5-41.5-176.9-70.3-17.9000111.9C278 R279 L286C278-N282 WeakPolarHBondContact O-CB 3.36Å; C278-N282 PolarHBondContact O-N 3.09Å; C278-N282 PolarHBondContact O-ND2 2.92Å; R279-N282 PolarHBondContact O-N 3.11Å; N282-L286 VanDerWaalsContact O-CB 3.3Å; N282-L286 WeakPolarHBondContact O-CB 3.03Å; N282-L286 PolarHBondContact O-N 3.48Å
283T96.5Very high89.5Confident56 Ų5651.8 Ų51.834%0.34428%0.281SS..Hα-helixtrans-63.5-48176.9-57.50000111.7V243 E247 R279 W281 L286 S287V243-T283 HydrophobicContact CG1-CG2 3.6Å; E247-T283 WeakPolarHBondContact OE1-CG2 3.37Å; R279-T283 PolarHBondContact O-N 2.91Å; R279-T283 PolarHBondContact O-OG1 3.46Å; R279-T283 VanDerWaalsContact O-OG1 3.1Å; W281-T283 VanDerWaalsContact C-N 3.34Å; W281-T283 PolarHBondContact O-N 3.2Å; T283-L286 PolarHBondContact O-N 3.04Å; T283-S287 PolarHBondContact O-N 2.98Å; T283-S287 VanDerWaalsContact O-N 3.12Å; T283-S287 PolarHBondContact O-OG 3.16Å
284L97.3Very high90.8Very high0 Ų054.7 Ų54.70%029%0.291CS..Hα-helixtrans-65.4-42.6178.6-73.6178.4000112.5F198 V243 F246 I266 F280 W281 L286 S287 L288F198-L284 HydrophobicContact CE2-CD1 4.2Å; F198-L284 HydrophobicContact CZ-CD1 4.07Å; V243-L284 HydrophobicContact CG2-CD2 4.46Å; V243-L284 HydrophobicContact CG2-CG 4.33Å; F246-L284 HydrophobicContact CB-CD2 3.9Å; I266-L284 HydrophobicContact CD1-CB 3.74Å; I266-L284 HydrophobicContact CD1-CD1 4.48Å; F280-L284 HydrophobicContact CD1-CD1 4.32Å; F280-L284 HydrophobicContact CD2-CD1 4.45Å; F280-L284 HydrophobicContact CE1-CD1 3.68Å; F280-L284 HydrophobicContact CE2-CD1 3.82Å; F280-L284 HydrophobicContact CZ-CD1 3.38Å; F280-L284 PolarHBondContact O-N 3.21Å; W281-L284 PolarHBondContact O-N 3.38Å; L284-L286 VanDerWaalsContact C-N 3.33Å; L284-L286 PolarHBondContact O-N 2.9Å; L284-S287 PolarHBondContact O-N 3.5Å; L284-L288 WeakPolarHBondContact O-CB 3.48Å; L284-L288 WeakPolarHBondContact O-CD1 3.4Å; L284-L288 WeakPolarHBondContact O-CG 3.43Å; L284-L288 PolarHBondContact O-N 2.96Å
285L97.6Very high92.3Very high23 Ų2351.9 Ų51.912%0.1227%0.268CS..Hα-helixtrans-61.6-41.4176.8-75.2171000111.5I263 I266 W281 L288 W289I263-L285 HydrophobicContact CB-CD2 4.47Å; I263-L285 HydrophobicContact CG1-CD2 4.43Å; I263-L285 HydrophobicContact CG2-CD2 4Å; I266-L285 HydrophobicContact CB-CD2 4.04Å; I266-L285 HydrophobicContact CB-CG 4.4Å; I266-L285 HydrophobicContact CD1-CD2 3.95Å; I266-L285 HydrophobicContact CD1-CG 4.03Å; I266-L285 HydrophobicContact CG2-CD1 3.86Å; I266-L285 HydrophobicContact CG2-CD2 3.92Å; I266-L285 HydrophobicContact CG2-CG 3.79Å; W281-L285 VanDerWaalsContact O-CB 3.31Å; W281-L285 WeakPolarHBondContact O-CB 3.5Å; W281-L285 VanDerWaalsContact O-CG 3.28Å; W281-L285 WeakPolarHBondContact O-CG 3.45Å; W281-L285 PolarHBondContact O-N 3.31Å; L285-L288 PolarHBondContact O-N 2.61Å; L285-W289 WeakPolarHBondContact O-CB 3.08Å; L285-W289 PolarHBondContact O-N 3.21Å
286L98.2Very high93.9Very high128 Ų12844.2 Ų44.267%0.6723%0.228SC*.Hα-helixtrans-59.7-48.5176.5-176.467.6000111.1N282 T283 L284 S290N282-L286 VanDerWaalsContact O-CB 3.3Å; N282-L286 WeakPolarHBondContact O-CB 3.03Å; N282-L286 PolarHBondContact O-N 3.48Å; T283-L286 PolarHBondContact O-N 3.04Å; L284-L286 VanDerWaalsContact C-N 3.33Å; L284-L286 PolarHBondContact O-N 2.9Å; L286-S290 VanDerWaalsContact O-CB 3.22Å; L286-S290 WeakPolarHBondContact O-CB 3.42Å; L286-S290 PolarHBondContact O-N 3.09Å
287S98.4Very high95.2Very high30 Ų3049.8 Ų49.821%0.2125%0.245CC..Hα-helixtrans-66.1-39.9179.7-67.80000112.5E247 I250 T283 L284 R291E247-S287 PolarHBondContact OE1-OG 3.07Å; I250-S287 WeakPolarHBondContact CG2-O 3.3Å; T283-S287 PolarHBondContact O-N 2.98Å; T283-S287 VanDerWaalsContact O-N 3.12Å; T283-S287 PolarHBondContact O-OG 3.16Å; L284-S287 PolarHBondContact O-N 3.5Å; S287-R291 PolarHBondContact O-N 2.98Å
288L98.7Very high96.1Very high0 Ų050.7 Ų50.70%025%0.253CS..Hα-helixtrans-64.7-53.1176.1-75.2164.7000111.9I250 L259 I263 I266 L284 L285 S290 R291 V292I250-L288 HydrophobicContact CD1-CD2 3.57Å; I250-L288 HydrophobicContact CD1-CG 3.75Å; I250-L288 HydrophobicContact CG1-CD2 3.75Å; I250-L288 HydrophobicContact CG1-CG 4.44Å; I250-L288 HydrophobicContact CG2-CD2 4.33Å; L259-L288 HydrophobicContact CB-CD2 4.22Å; L259-L288 HydrophobicContact CD2-CD2 3.94Å; I263-L288 HydrophobicContact CD1-CB 3.91Å; I263-L288 HydrophobicContact CG1-CB 3.57Å; I263-L288 HydrophobicContact CG1-CD1 3.86Å; I263-L288 HydrophobicContact CG1-CG 4.21Å; I266-L288 HydrophobicContact CD1-CD1 3.52Å; L284-L288 WeakPolarHBondContact O-CB 3.48Å; L284-L288 WeakPolarHBondContact O-CD1 3.4Å; L284-L288 WeakPolarHBondContact O-CG 3.43Å; L284-L288 PolarHBondContact O-N 2.96Å; L285-L288 PolarHBondContact O-N 2.61Å; L288-S290 PolarHBondContact O-N 3.35Å; L288-R291 PolarHBondContact O-N 3.42Å; L288-V292 WeakPolarHBondContact O-CG2 3.46Å; L288-V292 PolarHBondContact O-N 3.09Å
289W98.6Very high96.7Very high15 Ų1548 Ų486%0.05724%0.235CC..Hα-helixtrans-62.2-43.5-179.5-79.4119.2000111.9L260 I263 L285 R291 V292 D293 D341 R343 I344 Y347L260-W289 HydrophobicContact CD2-CZ3 4.22Å; I263-W289 HydrophobicContact CD1-CD2 3.66Å; I263-W289 HydrophobicContact CD1-CE3 3.83Å; I263-W289 HydrophobicContact CD1-CG 4.15Å; I263-W289 HydrophobicContact CD1-CH2 4.28Å; I263-W289 HydrophobicContact CD1-CZ2 4.14Å; I263-W289 HydrophobicContact CD1-CZ3 4.13Å; I263-W289 HydrophobicContact CG2-CH2 4.36Å; I263-W289 HydrophobicContact CG2-CZ2 3.59Å; L285-W289 WeakPolarHBondContact O-CB 3.08Å; L285-W289 PolarHBondContact O-N 3.21Å; W289-R291 VanDerWaalsContact C-N 3.28Å; W289-R291 PolarHBondContact O-N 2.81Å; W289-V292 HydrophobicContact CE3-CG1 4.46Å; W289-V292 PolarHBondContact O-N 3.42Å; W289-D293 PolarHBondContact O-N 2.89Å; W289-D341 HydrophobicContact CH2-CB 4.31Å; W289-D341 WeakPolarHBondContact CZ2-OD2 3.3Å; W289-R343 VanDerWaalsContact CG-NH1 3.25Å; W289-R343 HydrophobicContact CH2-CB 4.21Å; W289-R343 HydrophobicContact CZ3-CB 3.95Å; W289-I344 HydrophobicContact CH2-CD1 4.31Å; W289-I344 HydrophobicContact CH2-CG1 4.05Å; W289-I344 HydrophobicContact CZ3-CG1 4.36Å; W289-Y347 HydrophobicContact CZ3-CE2 4.09Å
290S98.5Very high97.1Very high79 Ų7938.9 Ų38.955%0.55220%0.201SC*.Hα-helixtrans-57.7-41.4176.81780000112.2L286 L288 H294L286-S290 VanDerWaalsContact O-CB 3.22Å; L286-S290 WeakPolarHBondContact O-CB 3.42Å; L286-S290 PolarHBondContact O-N 3.09Å; L288-S290 PolarHBondContact O-N 3.35Å; S290-H294 PolarHBondContact O-N 3.1Å
291R98.4Very high97.3Very high33 Ų3341.3 Ų41.313%0.12521%0.214CC..Hα-helixtrans-71.3-40.8177-175.565.9178.8165.33112.3I250 S251 S253 L259 S287 L288 W289 H294 L295I250-R291 HydrophobicContact CG2-CB 3.65Å; I250-R291 HydrophobicContact CG2-CG 4.09Å; I250-R291 WeakPolarHBondContact O-CG 3.48Å; S251-R291 VanDerWaalsContact O-CZ 3.23Å; S251-R291 PolarHBondContact O-NE 3.11Å; S251-R291 PolarHBondContact O-NH1 2.96Å; S253-R291 PolarHBondContact O-NE 2.86Å; S253-R291 PolarHBondContact O-NH2 2.93Å; L259-R291 HydrophobicContact CD1-CB 3.94Å; L259-R291 HydrophobicContact CD1-CG 3.44Å; L259-R291 VanDerWaalsContact CD1-CG 3.44Å; S287-R291 PolarHBondContact O-N 2.98Å; L288-R291 PolarHBondContact O-N 3.42Å; W289-R291 VanDerWaalsContact C-N 3.28Å; W289-R291 PolarHBondContact O-N 2.81Å; R291-H294 PolarHBondContact NH1-CD2 3.08Å; R291-H294 PolarHBondContact NH1-NE2 3.49Å; R291-H294 WeakPolarHBondContact O-CB 3.47Å; R291-H294 PolarHBondContact O-N 3.24Å; R291-L295 HydrophobicContact CG-CD1 4.33Å; R291-L295 HydrophobicContact CG-CG 4.42Å; R291-L295 WeakPolarHBondContact O-CG 3.41Å; R291-L295 PolarHBondContact O-N 2.78Å
292V98.6Very high97.3Very high0 Ų041.9 Ų41.90%022%0.218CC..Hα-helixtrans-59.2-48.1175.4168.30000110.5L259 L260 I263 L288 W289 H294 L295 I296 Y347L259-V292 HydrophobicContact CB-CG2 3.66Å; L259-V292 HydrophobicContact CD1-CG2 4.21Å; L260-V292 HydrophobicContact CD2-CG1 3.88Å; L260-V292 HydrophobicContact CD2-CG2 4.21Å; L260-V292 HydrophobicContact CG-CG1 4.34Å; L260-V292 HydrophobicContact CG-CG2 4.27Å; I263-V292 HydrophobicContact CD1-CG2 4.07Å; L288-V292 WeakPolarHBondContact O-CG2 3.46Å; L288-V292 PolarHBondContact O-N 3.09Å; W289-V292 HydrophobicContact CE3-CG1 4.46Å; W289-V292 PolarHBondContact O-N 3.42Å; V292-H294 VanDerWaalsContact C-N 3.26Å; V292-H294 PolarHBondContact O-N 3.05Å; V292-L295 PolarHBondContact O-N 3.47Å; V292-L295 VanDerWaalsContact O-N 3.08Å; V292-I296 HydrophobicContact CG1-CG1 4.18Å; V292-I296 WeakPolarHBondContact O-CG1 3.38Å; V292-I296 PolarHBondContact O-N 3.01Å; V292-Y347 HydrophobicContact CG1-CD2 4.41Å; V292-Y347 HydrophobicContact CG1-CE2 3.61Å
293D98.5Very high97.1Very high54 Ų5438.1 Ų38.129%0.28920%0.198SC..Hα-helixtrans-53.4-44.8175.5-80.6-44.1000111.8W289 R297 Y347W289-D293 PolarHBondContact O-N 2.89Å; D293-R297 WeakPolarHBondContact O-CB 3.39Å; D293-R297 VanDerWaalsContact O-CG 3.25Å; D293-R297 WeakPolarHBondContact O-CG 3.47Å; D293-R297 PolarHBondContact O-N 3.27Å; D293-Y347 VanDerWaalsContact CG-OH 3.3Å; D293-Y347 WeakPolarHBondContact OD1-CE1 3.48Å; D293-Y347 PolarHBondContact OD1-OH 3Å
294H98.3Very high96.8Very high97 Ų9741.5 Ų41.545%0.44920%0.204SC..Hα-helixtrans-64.2-44.3177.1174.679.7000112.4S290 R291 V292 R297 A298S290-H294 PolarHBondContact O-N 3.1Å; R291-H294 PolarHBondContact NH1-CD2 3.08Å; R291-H294 PolarHBondContact NH1-NE2 3.49Å; R291-H294 WeakPolarHBondContact O-CB 3.47Å; R291-H294 PolarHBondContact O-N 3.24Å; V292-H294 VanDerWaalsContact C-N 3.26Å; V292-H294 PolarHBondContact O-N 3.05Å; H294-R297 PolarHBondContact O-N 2.85Å; H294-A298 WeakPolarHBondContact O-CB 3.47Å; H294-A298 PolarHBondContact O-N 3.19Å
295L97.7Very high96.5Very high1 Ų149.3 Ų49.31%0.00524%0.241CC..Hα-helixtrans-68.2-39.1179.9-68.8179.9000112.2F254 C256 L259 R291 V292 A298 N299F254-L295 HydrophobicContact CB-CD2 4.4Å; F254-L295 HydrophobicContact CD1-CD2 3.76Å; F254-L295 HydrophobicContact CE1-CD2 4.33Å; F254-L295 HydrophobicContact CG-CD2 4.25Å; C256-L295 HydrophobicContact CB-CB 4.38Å; C256-L295 HydrophobicContact CB-CD1 3.98Å; L259-L295 HydrophobicContact CD1-CD1 3.87Å; R291-L295 HydrophobicContact CG-CD1 4.33Å; R291-L295 HydrophobicContact CG-CG 4.42Å; R291-L295 WeakPolarHBondContact O-CG 3.41Å; R291-L295 PolarHBondContact O-N 2.78Å; V292-L295 PolarHBondContact O-N 3.47Å; V292-L295 VanDerWaalsContact O-N 3.08Å; L295-A298 PolarHBondContact O-N 3.1Å; L295-N299 WeakPolarHBondContact O-CB 3.37Å; L295-N299 PolarHBondContact O-N 2.8Å; L295-N299 PolarHBondContact O-ND2 3.37Å
296I98Very high96.2Very high2 Ų249.2 Ų49.21%0.0124%0.24CC..Hα-helixtrans-62.3-47.5174.6-65.1-64.1000109.9V292 A298 N299 L300 F328 L332 Y347V292-I296 HydrophobicContact CG1-CG1 4.18Å; V292-I296 WeakPolarHBondContact O-CG1 3.38Å; V292-I296 PolarHBondContact O-N 3.01Å; I296-A298 PolarHBondContact O-N 2.93Å; I296-N299 PolarHBondContact O-N 3.23Å; I296-L300 HydrophobicContact CG2-CD1 3.92Å; I296-L300 HydrophobicContact CG2-CG 4.36Å; I296-L300 VanDerWaalsContact O-CG 3.31Å; I296-L300 WeakPolarHBondContact O-CG 3.33Å; I296-L300 PolarHBondContact O-N 3.05Å; I296-F328 HydrophobicContact CD1-CE1 3.88Å; I296-F328 HydrophobicContact CD1-CZ 3.92Å; I296-L332 HydrophobicContact CD1-CD2 4.06Å; I296-Y347 HydrophobicContact CB-CD1 4.21Å; I296-Y347 HydrophobicContact CB-CE1 4.47Å; I296-Y347 HydrophobicContact CB-CG 4.39Å; I296-Y347 HydrophobicContact CD1-CD2 4.25Å; I296-Y347 HydrophobicContact CD1-CG 4.25Å; I296-Y347 HydrophobicContact CG1-CD1 4.1Å; I296-Y347 HydrophobicContact CG1-CD2 3.85Å; I296-Y347 HydrophobicContact CG1-CE1 4.37Å; I296-Y347 HydrophobicContact CG1-CE2 4.15Å; I296-Y347 HydrophobicContact CG1-CG 3.84Å; I296-Y347 HydrophobicContact CG2-CD1 3.72Å; I296-Y347 HydrophobicContact CG2-CE1 4.38Å; I296-Y347 HydrophobicContact CG2-CG 3.97Å
297R97.6Very high95.8Very high167 Ų16746.9 Ų46.963%0.6323%0.229SC*.Hα-helixtrans-58.9-46.9175.8-72.1171.6-171.7-107.81.3112.2D293 H294 N299 L300 D301D293-R297 WeakPolarHBondContact O-CB 3.39Å; D293-R297 VanDerWaalsContact O-CG 3.25Å; D293-R297 WeakPolarHBondContact O-CG 3.47Å; D293-R297 PolarHBondContact O-N 3.27Å; H294-R297 PolarHBondContact O-N 2.85Å; R297-N299 VanDerWaalsContact C-N 3.27Å; R297-N299 PolarHBondContact O-N 2.95Å; R297-L300 PolarHBondContact O-N 3.33Å; R297-L300 VanDerWaalsContact O-N 3.11Å; R297-D301 WeakPolarHBondContact O-CB 3.39Å; R297-D301 VanDerWaalsContact O-CG 3.24Å; R297-D301 PolarHBondContact O-N 2.96Å
298A96.7Very high95.3Very high21 Ų2146.7 Ų46.717%0.17423%0.225CC..Hα-helixtrans-59.3-38.1177.600000112.5L136 H294 L295 I296 S302L136-A298 HydrophobicContact CD1-CB 4.27Å; L136-A298 HydrophobicContact CD2-CB 3.94Å; H294-A298 WeakPolarHBondContact O-CB 3.47Å; H294-A298 PolarHBondContact O-N 3.19Å; L295-A298 PolarHBondContact O-N 3.1Å; I296-A298 PolarHBondContact O-N 2.93Å; A298-S302 WeakPolarHBondContact O-CB 3.41Å; A298-S302 PolarHBondContact O-N 3.32Å
299N95.8Very high94.8Very high7 Ų752.6 Ų52.64%0.03725%0.252CS..Hα-helixtrans-67-43.9173.9-81.9-66.1000112.2L136 L137 L295 I296 R297 S302 F303L136-N299 WeakPolarHBondContact CA-OD1 3.18Å; L137-N299 HydrophobicContact CD1-CB 4.02Å; L137-N299 HydrophobicContact CG-CB 4.23Å; L137-N299 WeakPolarHBondContact CG-OD1 3.17Å; L137-N299 PolarHBondContact N-OD1 3.21Å; L295-N299 WeakPolarHBondContact O-CB 3.37Å; L295-N299 PolarHBondContact O-N 2.8Å; L295-N299 PolarHBondContact O-ND2 3.37Å; I296-N299 PolarHBondContact O-N 3.23Å; R297-N299 VanDerWaalsContact C-N 3.27Å; R297-N299 PolarHBondContact O-N 2.95Å; N299-S302 PolarHBondContact O-N 3.15Å; N299-S302 PolarHBondContact O-OG 3.47Å; N299-F303 VanDerWaalsContact O-CD2 3.31Å; N299-F303 WeakPolarHBondContact O-CD2 3.29Å; N299-F303 PolarHBondContact O-N 3.37Å
300L96.4Very high94.2Very high6 Ų657 Ų573%0.03127%0.274CS..Hα-helixtrans-63.2-43.4175.7-63.5168000111.5I296 R297 S302 F303 R304 L350 L351 E354I296-L300 HydrophobicContact CG2-CD1 3.92Å; I296-L300 HydrophobicContact CG2-CG 4.36Å; I296-L300 VanDerWaalsContact O-CG 3.31Å; I296-L300 WeakPolarHBondContact O-CG 3.33Å; I296-L300 PolarHBondContact O-N 3.05Å; R297-L300 PolarHBondContact O-N 3.33Å; R297-L300 VanDerWaalsContact O-N 3.11Å; L300-S302 VanDerWaalsContact C-N 3.29Å; L300-S302 PolarHBondContact O-N 2.99Å; L300-F303 WeakPolarHBondContact O-CB 3.42Å; L300-F303 PolarHBondContact O-N 2.94Å; L300-F303 VanDerWaalsContact O-N 3.1Å; L300-R304 WeakPolarHBondContact O-CG 3.25Å; L300-R304 PolarHBondContact O-N 3.41Å; L300-L350 HydrophobicContact CD1-CB 3.94Å; L300-L350 HydrophobicContact CD1-CD1 4.13Å; L300-L350 HydrophobicContact CD2-CB 4.14Å; L300-L351 HydrophobicContact CD2-CD2 3.85Å; L300-L351 HydrophobicContact CD2-CG 4.22Å; L300-E354 HydrophobicContact CB-CG 4.41Å; L300-E354 HydrophobicContact CD2-CB 4.15Å; L300-E354 HydrophobicContact CD2-CG 3.55Å
301D95.4Very high93.6Very high60 Ų6053.9 Ų53.932%0.32125%0.251SS..Hα-helixtrans-65.5-35.3178.2-65-26.1000111.1R297 F303 R304 E305R297-D301 WeakPolarHBondContact O-CB 3.39Å; R297-D301 VanDerWaalsContact O-CG 3.24Å; R297-D301 PolarHBondContact O-N 2.96Å; D301-F303 PolarHBondContact O-N 3.41Å; D301-R304 PolarHBondContact O-N 3.36Å; D301-R304 IonicContact OD1-CZ 3.96Å; D301-R304 IonicContact OD1-NH1 2.74Å; D301-R304 PolarHBondContact OD1-NH1 2.84Å; D301-E305 WeakPolarHBondContact O-CB 3.42Å; D301-E305 WeakPolarHBondContact O-CG 3.45Å; D301-E305 PolarHBondContact O-N 3.39Å
302S93.6Very high92.9Very high14 Ų1454.4 Ų54.410%0.09826%0.262CS..Hα-helixtrans-61.7-27.4173.478.40000113.8G138 A298 N299 L300G138-S302 WeakPolarHBondContact CA-OG 3.44Å; G138-S302 PolarHBondContact N-OG 3.29Å; A298-S302 WeakPolarHBondContact O-CB 3.41Å; A298-S302 PolarHBondContact O-N 3.32Å; N299-S302 PolarHBondContact O-N 3.15Å; N299-S302 PolarHBondContact O-OG 3.47Å; L300-S302 VanDerWaalsContact C-N 3.29Å; L300-S302 PolarHBondContact O-N 2.99Å
303F89.9Confident92.2Very high7 Ų759.8 Ų59.83%0.03130%0.297CS..Hα-helixtrans-73.7-40.4170.4-79-72000112.2L137 N299 L300 D301 L306 I321 Y325 L355 L358L137-F303 HydrophobicContact CB-CE2 3.79Å; L137-F303 HydrophobicContact CB-CZ 3.94Å; L137-F303 HydrophobicContact CD1-CE2 3.56Å; L137-F303 HydrophobicContact CD1-CZ 4.06Å; L137-F303 HydrophobicContact CG-CE2 4.32Å; N299-F303 VanDerWaalsContact O-CD2 3.31Å; N299-F303 WeakPolarHBondContact O-CD2 3.29Å; N299-F303 PolarHBondContact O-N 3.37Å; L300-F303 WeakPolarHBondContact O-CB 3.42Å; L300-F303 PolarHBondContact O-N 2.94Å; L300-F303 VanDerWaalsContact O-N 3.1Å; D301-F303 PolarHBondContact O-N 3.41Å; F303-L306 WeakPolarHBondContact O-CB 3.25Å; F303-I321 HydrophobicContact CD1-CD1 3.35Å; F303-I321 HydrophobicContact CD1-CG1 4.1Å; F303-I321 HydrophobicContact CE1-CD1 3.19Å; F303-I321 HydrophobicContact CE1-CG1 3.4Å; F303-I321 HydrophobicContact CG-CD1 4.43Å; F303-I321 HydrophobicContact CZ-CD1 4.15Å; F303-I321 HydrophobicContact CZ-CG1 4.01Å; F303-Y325 HydrophobicContact CZ-CD2 4.35Å; F303-L355 HydrophobicContact CE1-CD1 4.33Å; F303-L358 HydrophobicContact CD1-CD2 3.97Å; F303-L358 HydrophobicContact CE1-CD2 4.16Å
304R91.5Very high91.6Very high128 Ų12859.1 Ų59.148%0.48329%0.292SS..Hα-helixtrans-71.2-36.6-175.1-67170.6-178.9158.9-3112.5L300 D301 L306 E354L300-R304 WeakPolarHBondContact O-CG 3.25Å; L300-R304 PolarHBondContact O-N 3.41Å; D301-R304 PolarHBondContact O-N 3.36Å; D301-R304 IonicContact OD1-CZ 3.96Å; D301-R304 IonicContact OD1-NH1 2.74Å; D301-R304 PolarHBondContact OD1-NH1 2.84Å; R304-L306 VanDerWaalsContact C-N 3.31Å; R304-E354 WeakPolarHBondContact CG-OE2 3.49Å; R304-E354 IonicContact CZ-OE1 3.82Å; R304-E354 IonicContact NE-OE1 3.5Å; R304-E354 PolarHBondContact NE-OE1 3.05Å; R304-E354 IonicContact NE-OE2 3.37Å; R304-E354 IonicContact NH2-OE1 3.08Å; R304-E354 PolarHBondContact NH2-OE1 2.89Å
305E90.9Very high90.5Very high163 Ų16355 Ų5576%0.76228%0.276SS*.SBendtrans-84.6-5.1-178.2-65.8178.6176.400113.2D301 D307D301-E305 WeakPolarHBondContact O-CB 3.42Å; D301-E305 WeakPolarHBondContact O-CG 3.45Å; D301-E305 PolarHBondContact O-N 3.39Å; E305-D307 PolarHBondContact O-N 3.32Å
306L90.3Very high89.7Confident21 Ų2156.7 Ų56.711%0.1129%0.29CS..  trans-68124.2-175.9-172.462.6000112L140 F303 R304 L308 L311 I321 L358L140-L306 HydrophobicContact CD2-CD1 3.85Å; L140-L306 HydrophobicContact CG-CD1 4.29Å; F303-L306 WeakPolarHBondContact O-CB 3.25Å; R304-L306 VanDerWaalsContact C-N 3.31Å; L306-L308 PolarHBondContact O-N 2.79Å; L306-L311 HydrophobicContact CD2-CD1 3.48Å; L306-L311 VanDerWaalsContact CD2-CD1 3.48Å; L306-L311 HydrophobicContact CD2-CD2 4.1Å; L306-L311 HydrophobicContact CD2-CG 3.87Å; L306-L311 HydrophobicContact CG-CD1 4.32Å; L306-L311 HydrophobicContact CG-CG 4.34Å; L306-I321 HydrophobicContact CD2-CD1 3.65Å; L306-L358 HydrophobicContact CD2-CD1 4.42Å
307D89.2Confident89Confident80 Ų8066.3 Ų66.343%0.42833%0.326SS..  trans-74.9116167.6178.310.1000109.8E305 Q309 Q310E305-D307 PolarHBondContact O-N 3.32Å; D307-Q309 PolarHBondContact O-N 3.35Å; D307-Q309 PolarHBondContact OD1-N 3.4Å; D307-Q310 HydrophobicContact CB-CG 3.99Å; D307-Q310 WeakPolarHBondContact O-CB 3.36Å; D307-Q310 PolarHBondContact O-N 2.89Å
308L88.8Confident88.5Confident25 Ų2559.9 Ų59.913%0.13131%0.306CS..G310 helixtrans-58.5-30.4179.8-62.5-179.5000112.4L306 Q310 L311 A312 F314 L358 K361 I362 Q365L306-L308 PolarHBondContact O-N 2.79Å; L308-Q310 PolarHBondContact O-N 3.23Å; L308-L311 HydrophobicContact CD2-CD1 4.47Å; L308-L311 WeakPolarHBondContact O-CB 3.36Å; L308-L311 PolarHBondContact O-N 3.36Å; L308-A312 PolarHBondContact O-N 3.1Å; L308-F314 HydrophobicContact CB-CZ 4.25Å; L308-F314 WeakPolarHBondContact O-CZ 3.46Å; L308-L358 HydrophobicContact CD2-CD1 3.54Å; L308-K361 HydrophobicContact CD1-CB 3.97Å; L308-I362 HydrophobicContact CD2-CD1 4.26Å; L308-I362 HydrophobicContact CD2-CG1 3.88Å; L308-Q365 VanDerWaalsContact CD1-NE2 3.3Å
309Q87.5Confident88.1Confident124 Ų12459.4 Ų59.458%0.57930%0.3SS*.G310 helixtrans-63.1-25.1178.1-62.7-57.9-31.500112.5D307 L311 A312D307-Q309 PolarHBondContact O-N 3.35Å; D307-Q309 PolarHBondContact OD1-N 3.4Å; Q309-L311 VanDerWaalsContact C-N 3.26Å; Q309-L311 PolarHBondContact O-N 3.38Å; Q309-A312 WeakPolarHBondContact O-CB 3.41Å; Q309-A312 PolarHBondContact O-N 2.63Å
310Q86.4Confident87.6Confident109 Ų10962.7 Ų62.751%0.50932%0.315SS..G310 helixtrans-77.2-14.7177.5-57.9172.8-26.100112.9L140 D307 L308L140-Q310 HydrophobicContact CD1-CB 3.68Å; L140-Q310 VanDerWaalsContact CD1-CD 3.41Å; L140-Q310 HydrophobicContact CD1-CG 4Å; L140-Q310 HydrophobicContact CD2-CB 4.33Å; D307-Q310 HydrophobicContact CB-CG 3.99Å; D307-Q310 WeakPolarHBondContact O-CB 3.36Å; D307-Q310 PolarHBondContact O-N 2.89Å; L308-Q310 PolarHBondContact O-N 3.23Å
311L85.1Confident87.3Confident13 Ų1362.4 Ų62.47%0.06831%0.313CS..G310 helixtrans-92.2-9.6173.6-66.4-175.5000113.4L306 L308 Q309 F314 L319 F320 I362L306-L311 HydrophobicContact CD2-CD1 3.48Å; L306-L311 VanDerWaalsContact CD2-CD1 3.48Å; L306-L311 HydrophobicContact CD2-CD2 4.1Å; L306-L311 HydrophobicContact CD2-CG 3.87Å; L306-L311 HydrophobicContact CG-CD1 4.32Å; L306-L311 HydrophobicContact CG-CG 4.34Å; L308-L311 HydrophobicContact CD2-CD1 4.47Å; L308-L311 WeakPolarHBondContact O-CB 3.36Å; L308-L311 PolarHBondContact O-N 3.36Å; Q309-L311 VanDerWaalsContact C-N 3.26Å; Q309-L311 PolarHBondContact O-N 3.38Å; L311-F314 HydrophobicContact CB-CE1 3.59Å; L311-F314 HydrophobicContact CB-CZ 4.11Å; L311-L319 HydrophobicContact CB-CD2 4.26Å; L311-L319 HydrophobicContact CD1-CD1 4.27Å; L311-F320 HydrophobicContact CD2-CD1 4.46Å; L311-F320 HydrophobicContact CD2-CE1 3.58Å; L311-F320 HydrophobicContact CD2-CZ 4.02Å; L311-I362 HydrophobicContact CD1-CD1 4.02Å
312A84.5Confident87Confident44 Ų4459.6 Ų59.636%0.36430%0.298SS..PPolyproline II helixtrans-69.8154.517900000111.5L308 Q309 F314L308-A312 PolarHBondContact O-N 3.1Å; Q309-A312 WeakPolarHBondContact O-CB 3.41Å; Q309-A312 PolarHBondContact O-N 2.63Å; A312-F314 HydrophobicContact CB-CE2 4.3Å
313P84.7Confident86.7Confident113 Ų11365.7 Ų65.773%0.73432%0.319SS*.SBendcis-791382.431.6-34.4000113.2
314F84.8Confident86.7Confident39 Ų3967 Ų6717%0.17132%0.323CS..PPolyproline II helixtrans-82.3145.3173.7-54.5-58.7000111.2L308 L311 A312 L319 I362 L366 F375L308-F314 HydrophobicContact CB-CZ 4.25Å; L308-F314 WeakPolarHBondContact O-CZ 3.46Å; L311-F314 HydrophobicContact CB-CE1 3.59Å; L311-F314 HydrophobicContact CB-CZ 4.11Å; A312-F314 HydrophobicContact CB-CE2 4.3Å; F314-L319 HydrophobicContact CD1-CD2 4.27Å; F314-L319 HydrophobicContact CE1-CD2 4.42Å; F314-I362 HydrophobicContact CB-CG2 4.19Å; F314-I362 HydrophobicContact CD1-CD1 4.44Å; F314-I362 HydrophobicContact CD1-CG2 3.44Å; F314-I362 VanDerWaalsContact CD1-CG2 3.44Å; F314-I362 HydrophobicContact CD2-CG2 4Å; F314-I362 HydrophobicContact CE1-CB 4.45Å; F314-I362 HydrophobicContact CE1-CD1 3.83Å; F314-I362 HydrophobicContact CE1-CG1 3.96Å; F314-I362 HydrophobicContact CE1-CG2 3.66Å; F314-I362 HydrophobicContact CE2-CG2 4.21Å; F314-I362 HydrophobicContact CG-CG2 3.6Å; F314-I362 HydrophobicContact CZ-CD1 4.39Å; F314-I362 HydrophobicContact CZ-CG1 4.09Å; F314-I362 HydrophobicContact CZ-CG2 4.03Å; F314-L366 HydrophobicContact CB-CD2 3.76Å; F314-F375 HydrophobicContact CD1-CE2 4.38Å
315G76.6Confident86.7Confident11 Ų1161.3 Ų61.311%0.11330%0.302CS..SBendtrans148.8-120.1175.200000112.5R317 F375G315-R317 VanDerWaalsContact C-N 3.29Å; G315-R317 PolarHBondContact O-N 3.33Å; G315-F375 WeakPolarHBondContact O-CA 3.48Å
316A79.4Confident86.7Confident37 Ų3753.9 Ų53.931%0.30627%0.268SS..SBendtrans-67.3-23.4-172.300000114.8V374 N378 N477A316-V374 HydrophobicContact CB-CG1 4.44Å; A316-N378 WeakPolarHBondContact CA-ND2 3.31Å; A316-N378 VanDerWaalsContact O-CG 3.24Å; A316-N378 PolarHBondContact O-ND2 2.9Å; A316-N477 WeakPolarHBondContact CA-O 3.31Å; A316-N477 WeakPolarHBondContact CB-O 3.4Å
317R84.1Confident86.6Confident203 Ų20355 Ų5577%0.76627%0.273SS*.SBendtrans-90.5124-178.7-70.5-174.7-179.4173.31.5110.3G315G315-R317 VanDerWaalsContact C-N 3.29Å; G315-R317 PolarHBondContact O-N 3.33Å
318P86.3Confident86.8Confident33 Ų3351.3 Ų51.321%0.21425%0.253CS..PPolyproline II helixtrans-61.2148171.5-19.129.5000110.9N378 N379 I382P318-N378 HydrophobicContact CG-CB 4.09Å; P318-N378 WeakPolarHBondContact CG-O 3.24Å; P318-N379 WeakPolarHBondContact CA-OD1 3.43Å; P318-I382 HydrophobicContact CB-CD1 3.16Å; P318-I382 HydrophobicContact CB-CG1 3.91Å; P318-I382 HydrophobicContact CG-CD1 3.59Å; P318-I382 HydrophobicContact CG-CG1 4.07Å
319L89.3Confident87Confident10 Ų1051.4 Ų51.45%0.05225%0.253CS..PPolyproline II helixtrans-76.6134.3178.2-56.1174.3000109.7L311 F314 I321 V322 R323 M359 I362 F375 N379L311-L319 HydrophobicContact CB-CD2 4.26Å; L311-L319 HydrophobicContact CD1-CD1 4.27Å; F314-L319 HydrophobicContact CD1-CD2 4.27Å; F314-L319 HydrophobicContact CE1-CD2 4.42Å; L319-I321 HydrophobicContact CB-CG2 3.81Å; L319-I321 HydrophobicContact CD1-CG2 4.26Å; L319-I321 PolarHBondContact O-N 3.11Å; L319-I321 VanDerWaalsContact O-N 3.16Å; L319-V322 HydrophobicContact CB-CB 4.46Å; L319-V322 HydrophobicContact CB-CG2 3.98Å; L319-V322 HydrophobicContact CD1-CG2 4.27Å; L319-V322 PolarHBondContact O-N 2.93Å; L319-V322 VanDerWaalsContact O-N 3.1Å; L319-R323 PolarHBondContact O-N 2.98Å; L319-M359 HydrophobicContact CD1-SD 4.43Å; L319-I362 HydrophobicContact CD1-CD1 3.54Å; L319-F375 HydrophobicContact CD1-CE2 3.81Å; L319-F375 HydrophobicContact CD1-CZ 3.71Å; L319-F375 HydrophobicContact CD2-CE2 4.24Å; L319-F375 HydrophobicContact CG-CE2 3.89Å; L319-F375 HydrophobicContact CG-CZ 4.29Å; L319-N379 PolarHBondContact N-OD1 3.42Å
320F86Confident87.2Confident77 Ų7746.2 Ų46.234%0.33823%0.231SC..Hα-helixtrans-58-31.7175.673.3-91.3000111.9L140 L311 V322 R323 R324L140-F320 HydrophobicContact CD2-CE1 4.3Å; L140-F320 HydrophobicContact CD2-CZ 3.84Å; L311-F320 HydrophobicContact CD2-CD1 4.46Å; L311-F320 HydrophobicContact CD2-CE1 3.58Å; L311-F320 HydrophobicContact CD2-CZ 4.02Å; F320-V322 VanDerWaalsContact C-N 3.35Å; F320-V322 PolarHBondContact O-N 3.31Å; F320-R323 WeakPolarHBondContact O-CB 3.32Å; F320-R323 PolarHBondContact O-N 3Å; F320-R324 WeakPolarHBondContact O-CG 3.44Å; F320-R324 PolarHBondContact O-N 2.79Å
321I89.2Confident87.5Confident0 Ų041.1 Ų41.10%021%0.208CC..Hα-helixtrans-65.4-36.9179.2-162.9172.3000112.3L137 G138 F303 L306 L319 R323 R324 Y325 L358L137-I321 WeakPolarHBondContact O-CG1 3.45Å; G138-I321 VanDerWaalsContact CA-CD1 3.49Å; F303-I321 HydrophobicContact CD1-CD1 3.35Å; F303-I321 HydrophobicContact CD1-CG1 4.1Å; F303-I321 HydrophobicContact CE1-CD1 3.19Å; F303-I321 HydrophobicContact CE1-CG1 3.4Å; F303-I321 HydrophobicContact CG-CD1 4.43Å; F303-I321 HydrophobicContact CZ-CD1 4.15Å; F303-I321 HydrophobicContact CZ-CG1 4.01Å; L306-I321 HydrophobicContact CD2-CD1 3.65Å; L319-I321 HydrophobicContact CB-CG2 3.81Å; L319-I321 HydrophobicContact CD1-CG2 4.26Å; L319-I321 PolarHBondContact O-N 3.11Å; L319-I321 VanDerWaalsContact O-N 3.16Å; I321-R323 VanDerWaalsContact C-N 3.31Å; I321-R324 PolarHBondContact O-N 2.51Å; I321-Y325 VanDerWaalsContact O-CB 3.3Å; I321-Y325 WeakPolarHBondContact O-CB 3.3Å; I321-Y325 PolarHBondContact O-N 3.48Å; I321-L358 HydrophobicContact CD1-CD2 4.25Å; I321-L358 HydrophobicContact CG2-CD2 4.1Å
322V89.6Confident87.9Confident0 Ų040.5 Ų40.50%020%0.204CC..Hα-helixtrans-66.2-38.9176.3173.70000109.8L319 F320 Y325 A326 L355 M359 N379 E383L319-V322 HydrophobicContact CB-CB 4.46Å; L319-V322 HydrophobicContact CB-CG2 3.98Å; L319-V322 HydrophobicContact CD1-CG2 4.27Å; L319-V322 PolarHBondContact O-N 2.93Å; L319-V322 VanDerWaalsContact O-N 3.1Å; F320-V322 VanDerWaalsContact C-N 3.35Å; F320-V322 PolarHBondContact O-N 3.31Å; V322-Y325 WeakPolarHBondContact O-CB 3.49Å; V322-Y325 PolarHBondContact O-N 2.89Å; V322-A326 VanDerWaalsContact O-CB 3.26Å; V322-A326 WeakPolarHBondContact O-CB 3.32Å; V322-A326 PolarHBondContact O-N 3.16Å; V322-L355 HydrophobicContact CG2-CD1 4.06Å; V322-M359 HydrophobicContact CG2-SD 4Å; V322-N379 HydrophobicContact CG1-CB 4.13Å; V322-N379 WeakPolarHBondContact CG1-O 3.28Å; V322-N379 HydrophobicContact CG2-CB 4.22Å; V322-N379 WeakPolarHBondContact CG2-OD1 3.47Å; V322-E383 HydrophobicContact CG1-CG 3.94Å
323R86.7Confident88.3Confident143 Ų14339.6 Ų39.654%0.5419%0.193SC..Hα-helixtrans-63.6-49.9173.9-176.7179.1171.6171.31112.3L319 F320 I321 Y325 A326 E327 I382L319-R323 PolarHBondContact O-N 2.98Å; F320-R323 WeakPolarHBondContact O-CB 3.32Å; F320-R323 PolarHBondContact O-N 3Å; I321-R323 VanDerWaalsContact C-N 3.31Å; R323-Y325 VanDerWaalsContact C-N 3.28Å; R323-Y325 PolarHBondContact O-N 3.27Å; R323-A326 PolarHBondContact O-N 3.25Å; R323-A326 VanDerWaalsContact O-N 3.14Å; R323-E327 IonicContact CZ-OE1 2.64Å; R323-E327 IonicContact NE-OE1 3.58Å; R323-E327 PolarHBondContact NE-OE1 3.46Å; R323-E327 IonicContact NH2-OE1 2.92Å; R323-E327 PolarHBondContact NH2-OE1 3.41Å; R323-E327 WeakPolarHBondContact O-CG 3.22Å; R323-E327 PolarHBondContact O-N 3.2Å; R323-I382 HydrophobicContact CB-CD1 4.47Å; R323-I382 HydrophobicContact CB-CG2 3.79Å; R323-I382 HydrophobicContact CG-CG2 4.09Å
324R90.5Very high88.7Confident33 Ų3336.1 Ų36.113%0.12517%0.169CC..Hα-helixtrans-57.8-44.7177.4-69.6178.1179.5-177.84.8110.9L136 L137 A139 D141 F162 F320 I321 F328L136-R324 PolarHBondContact O-NH1 2.94Å; L137-R324 VanDerWaalsContact CD2-C 3.47Å; L137-R324 HydrophobicContact CD2-CB 3.77Å; L137-R324 WeakPolarHBondContact CD2-O 3.5Å; A139-R324 PolarHBondContact O-NH1 3.2Å; D141-R324 IonicContact OD1-CZ 3.59Å; D141-R324 IonicContact OD1-NH2 2.75Å; D141-R324 PolarHBondContact OD1-NH2 2.96Å; D141-R324 IonicContact OD2-NH2 3.49Å; F162-R324 HydrophobicContact CD2-CB 3.78Å; F162-R324 HydrophobicContact CD2-CG 3.71Å; F162-R324 HydrophobicContact CE2-CB 3.93Å; F162-R324 HydrophobicContact CE2-CG 3.67Å; F162-R324 HydrophobicContact CG-CB 4.26Å; F320-R324 WeakPolarHBondContact O-CG 3.44Å; F320-R324 PolarHBondContact O-N 2.79Å; I321-R324 PolarHBondContact O-N 2.51Å; R324-F328 VanDerWaalsContact O-CB 3.29Å; R324-F328 WeakPolarHBondContact O-CB 3.32Å; R324-F328 PolarHBondContact O-N 3.19Å
325Y91.6Very high89.1Confident10 Ų1034.2 Ų34.24%0.03916%0.161CC..Hα-helixtrans-56.8-50.9173.5164.4-89.1000111.3F303 I321 V322 R323 E327 F328 F329 L351 E352 L355F303-Y325 HydrophobicContact CZ-CD2 4.35Å; I321-Y325 VanDerWaalsContact O-CB 3.3Å; I321-Y325 WeakPolarHBondContact O-CB 3.3Å; I321-Y325 PolarHBondContact O-N 3.48Å; V322-Y325 WeakPolarHBondContact O-CB 3.49Å; V322-Y325 PolarHBondContact O-N 2.89Å; R323-Y325 VanDerWaalsContact C-N 3.28Å; R323-Y325 PolarHBondContact O-N 3.27Å; Y325-E327 PolarHBondContact O-N 3.5Å; Y325-F328 PolarHBondContact O-N 3.1Å; Y325-F329 HydrophobicContact CD1-CB 4.5Å; Y325-F329 HydrophobicContact CE1-CB 4.16Å; Y325-F329 HydrophobicContact CE1-CD2 4.39Å; Y325-F329 HydrophobicContact CE1-CG 4.31Å; Y325-F329 HydrophobicContact CE2-CB 4.4Å; Y325-F329 AromaticContact CE2-CD2 3.97Å; Y325-F329 HydrophobicContact CE2-CD2 3.97Å; Y325-F329 AromaticContact CZ-CD2 3.63Å; Y325-F329 AromaticContact CZ-CG 3.99Å; Y325-F329 WeakPolarHBondContact O-CB 3.17Å; Y325-F329 PolarHBondContact O-N 3.44Å; Y325-F329 VanDerWaalsContact OH-CD2 3.26Å; Y325-F329 WeakPolarHBondContact OH-CD2 3.41Å; Y325-F329 WeakPolarHBondContact OH-CE2 3.28Å; Y325-L351 HydrophobicContact CD2-CB 4.44Å; Y325-L351 HydrophobicContact CE2-CB 3.82Å; Y325-L351 WeakPolarHBondContact CE2-O 3.46Å; Y325-E352 WeakPolarHBondContact OH-CA 3.44Å; Y325-L355 HydrophobicContact CD1-CD2 3.27Å; Y325-L355 HydrophobicContact CD2-CB 4.21Å; Y325-L355 HydrophobicContact CD2-CD2 4.02Å; Y325-L355 HydrophobicContact CE1-CD2 3.31Å; Y325-L355 HydrophobicContact CE2-CB 3.98Å; Y325-L355 HydrophobicContact CE2-CD2 4.01Å; Y325-L355 HydrophobicContact CG-CD2 3.66Å
326A89.2Confident90Very high6 Ų634.4 Ų34.45%0.0516%0.159CC..Hα-helixtrans-63.5-43.8-173.700000111.7V322 R323 A330 E383 S386V322-A326 VanDerWaalsContact O-CB 3.26Å; V322-A326 WeakPolarHBondContact O-CB 3.32Å; V322-A326 PolarHBondContact O-N 3.16Å; R323-A326 PolarHBondContact O-N 3.25Å; R323-A326 VanDerWaalsContact O-N 3.14Å; A326-A330 WeakPolarHBondContact O-CB 3.4Å; A326-A330 PolarHBondContact O-N 2.99Å; A326-E383 HydrophobicContact CB-CB 4.43Å; A326-E383 HydrophobicContact CB-CG 4.22Å; A326-S386 WeakPolarHBondContact CB-OG 3.26Å
327E90Very high90.6Very high44 Ų4436.7 Ų36.721%0.20617%0.17CC..Hα-helixtrans-60.7-45.9174.2-69173.7-177.700110.7F162 R323 Y325 A331F162-E327 HydrophobicContact CB-CB 4.15Å; F162-E327 CarbonylContact O-C 3.02Å; R323-E327 IonicContact CZ-OE1 2.64Å; R323-E327 IonicContact NE-OE1 3.58Å; R323-E327 PolarHBondContact NE-OE1 3.46Å; R323-E327 IonicContact NH2-OE1 2.92Å; R323-E327 PolarHBondContact NH2-OE1 3.41Å; R323-E327 WeakPolarHBondContact O-CG 3.22Å; R323-E327 PolarHBondContact O-N 3.2Å; Y325-E327 PolarHBondContact O-N 3.5Å; E327-A331 WeakPolarHBondContact O-CB 3.44Å; E327-A331 PolarHBondContact O-N 2.87Å
328F93.4Very high90.9Very high3 Ų328.8 Ų28.81%0.01314%0.142CC..Hα-helixtrans-67.1-45.2-179.7-170.5-121.1000113.1L137 F162 C256 I257 I296 R324 Y325 A331 L332 L351L137-F328 HydrophobicContact CD1-CD1 3.92Å; L137-F328 HydrophobicContact CD1-CE1 4.49Å; L137-F328 HydrophobicContact CD2-CB 4.01Å; L137-F328 HydrophobicContact CD2-CD1 4.45Å; L137-F328 HydrophobicContact CD2-CG 4.4Å; F162-F328 HydrophobicContact CB-CB 3.99Å; F162-F328 HydrophobicContact CD1-CB 4.11Å; F162-F328 HydrophobicContact CD1-CD2 4.1Å; F162-F328 HydrophobicContact CD1-CG 4.22Å; F162-F328 HydrophobicContact CG-CB 4.43Å; F162-F328 WeakPolarHBondContact O-CA 3.13Å; F162-F328 PolarHBondContact O-N 3.49Å; F162-F328 VanDerWaalsContact O-N 3.15Å; C256-F328 HydrophobicContact CB-CE2 3.91Å; C256-F328 HydrophobicContact CB-CZ 3.9Å; I257-F328 HydrophobicContact CD1-CD2 4.45Å; I257-F328 HydrophobicContact CG1-CD2 4.4Å; I257-F328 HydrophobicContact CG1-CE2 4.26Å; I296-F328 HydrophobicContact CD1-CE1 3.88Å; I296-F328 HydrophobicContact CD1-CZ 3.92Å; R324-F328 VanDerWaalsContact O-CB 3.29Å; R324-F328 WeakPolarHBondContact O-CB 3.32Å; R324-F328 PolarHBondContact O-N 3.19Å; Y325-F328 PolarHBondContact O-N 3.1Å; F328-A331 WeakPolarHBondContact O-CB 3.37Å; F328-A331 PolarHBondContact O-N 3.39Å; F328-L332 HydrophobicContact CD1-CD1 4.3Å; F328-L332 HydrophobicContact CD1-CD2 4.44Å; F328-L332 HydrophobicContact CD2-CD1 3.85Å; F328-L332 HydrophobicContact CE1-CD1 3.96Å; F328-L332 HydrophobicContact CE1-CD2 3.9Å; F328-L332 HydrophobicContact CE2-CD1 3.45Å; F328-L332 VanDerWaalsContact CE2-CD1 3.45Å; F328-L332 HydrophobicContact CG-CD1 4.26Å; F328-L332 HydrophobicContact CZ-CD1 3.52Å; F328-L332 HydrophobicContact CZ-CD2 4.1Å; F328-L332 HydrophobicContact CZ-CG 4.47Å; F328-L332 WeakPolarHBondContact O-CD1 3.43Å; F328-L332 PolarHBondContact O-N 2.73Å; F328-L351 HydrophobicContact CD1-CD1 4.03Å; F328-L351 HydrophobicContact CE1-CD1 3.98Å
329F92.9Very high91.2Very high28 Ų2829.1 Ų29.112%0.12314%0.142CC..Hα-helixtrans-61.9-46.4178.5-173-82.8000110.3Y325 A331 L332 M333 L348 L351 E352 E391Y325-F329 HydrophobicContact CD1-CB 4.5Å; Y325-F329 HydrophobicContact CE1-CB 4.16Å; Y325-F329 HydrophobicContact CE1-CD2 4.39Å; Y325-F329 HydrophobicContact CE1-CG 4.31Å; Y325-F329 HydrophobicContact CE2-CB 4.4Å; Y325-F329 AromaticContact CE2-CD2 3.97Å; Y325-F329 HydrophobicContact CE2-CD2 3.97Å; Y325-F329 AromaticContact CZ-CD2 3.63Å; Y325-F329 AromaticContact CZ-CG 3.99Å; Y325-F329 WeakPolarHBondContact O-CB 3.17Å; Y325-F329 PolarHBondContact O-N 3.44Å; Y325-F329 VanDerWaalsContact OH-CD2 3.26Å; Y325-F329 WeakPolarHBondContact OH-CD2 3.41Å; Y325-F329 WeakPolarHBondContact OH-CE2 3.28Å; F329-A331 VanDerWaalsContact C-N 3.31Å; F329-A331 PolarHBondContact O-N 3.42Å; F329-L332 PolarHBondContact O-N 3.14Å; F329-M333 HydrophobicContact CD1-CG 3.88Å; F329-M333 HydrophobicContact CE1-CG 3.59Å; F329-M333 HydrophobicContact CE1-SD 4.38Å; F329-M333 HydrophobicContact CZ-CG 4.27Å; F329-M333 WeakPolarHBondContact O-CB 3.25Å; F329-M333 WeakPolarHBondContact O-CG 3.47Å; F329-M333 PolarHBondContact O-N 2.85Å; F329-L348 HydrophobicContact CD1-CD2 4.25Å; F329-L348 HydrophobicContact CD2-CD2 3.65Å; F329-L348 HydrophobicContact CE1-CD2 4.17Å; F329-L348 HydrophobicContact CE2-CB 3.95Å; F329-L348 HydrophobicContact CE2-CD2 3.58Å; F329-L348 HydrophobicContact CE2-CG 4.41Å; F329-L348 WeakPolarHBondContact CE2-O 3.26Å; F329-L348 HydrophobicContact CG-CD2 4Å; F329-L348 HydrophobicContact CZ-CB 4.29Å; F329-L348 HydrophobicContact CZ-CD2 3.84Å; F329-L351 HydrophobicContact CD2-CB 4.36Å; F329-E352 HydrophobicContact CE2-CB 4.38Å; F329-E391 WeakPolarHBondContact CE1-OE2 3.49Å; F329-E391 WeakPolarHBondContact CZ-OE2 3.39Å
330A90.4Very high91.4Very high15 Ų1532.6 Ų32.612%0.12417%0.165CC..Hα-helixtrans-62-37.8175.200000112.6A326 T334 S386A326-A330 WeakPolarHBondContact O-CB 3.4Å; A326-A330 PolarHBondContact O-N 2.99Å; A330-T334 WeakPolarHBondContact O-CB 3.45Å; A330-T334 PolarHBondContact O-N 3.17Å; A330-T334 PolarHBondContact O-OG1 2.97Å; A330-S386 WeakPolarHBondContact CB-O 3.42Å
331A92.6Very high91.9Very high2 Ų230.1 Ų30.12%0.01716%0.156CC..Hα-helixtrans-62.5-49.8174.400000111.8L164 I257 E327 F328 F329 M333 T334 I335L164-A331 HydrophobicContact CB-CB 3.74Å; I257-A331 HydrophobicContact CD1-CB 3.52Å; I257-A331 HydrophobicContact CG1-CB 4.04Å; E327-A331 WeakPolarHBondContact O-CB 3.44Å; E327-A331 PolarHBondContact O-N 2.87Å; F328-A331 WeakPolarHBondContact O-CB 3.37Å; F328-A331 PolarHBondContact O-N 3.39Å; F329-A331 VanDerWaalsContact C-N 3.31Å; F329-A331 PolarHBondContact O-N 3.42Å; A331-M333 VanDerWaalsContact C-N 3.35Å; A331-M333 PolarHBondContact O-N 3.19Å; A331-T334 PolarHBondContact O-N 2.92Å; A331-I335 VanDerWaalsContact O-CG1 3.25Å; A331-I335 WeakPolarHBondContact O-CG1 3.32Å; A331-I335 PolarHBondContact O-N 3.38Å
332L94.7Very high92.3Very high0 Ų037 Ų370%019%0.188CC..Hα-helixtrans-61.6-43.2178-94.258.9000111.7L260 I296 F328 F329 I335 N336 I344 L348 L351L260-L332 HydrophobicContact CD1-CD1 3.69Å; L260-L332 HydrophobicContact CD1-CG 3.75Å; I296-L332 HydrophobicContact CD1-CD2 4.06Å; F328-L332 HydrophobicContact CD1-CD1 4.3Å; F328-L332 HydrophobicContact CD1-CD2 4.44Å; F328-L332 HydrophobicContact CD2-CD1 3.85Å; F328-L332 HydrophobicContact CE1-CD1 3.96Å; F328-L332 HydrophobicContact CE1-CD2 3.9Å; F328-L332 HydrophobicContact CE2-CD1 3.45Å; F328-L332 VanDerWaalsContact CE2-CD1 3.45Å; F328-L332 HydrophobicContact CG-CD1 4.26Å; F328-L332 HydrophobicContact CZ-CD1 3.52Å; F328-L332 HydrophobicContact CZ-CD2 4.1Å; F328-L332 HydrophobicContact CZ-CG 4.47Å; F328-L332 WeakPolarHBondContact O-CD1 3.43Å; F328-L332 PolarHBondContact O-N 2.73Å; F329-L332 PolarHBondContact O-N 3.14Å; L332-I335 PolarHBondContact O-N 2.92Å; L332-N336 WeakPolarHBondContact O-CB 3.48Å; L332-N336 PolarHBondContact O-N 2.96Å; L332-I344 HydrophobicContact CB-CG2 4.4Å; L332-L348 HydrophobicContact CB-CD2 3.75Å; L332-L348 HydrophobicContact CB-CG 4.39Å; L332-L351 HydrophobicContact CD2-CD1 3.91Å
333M92.2Very high92.7Very high25 Ų2542 Ų4212%0.12321%0.206CC..Hα-helixtrans-58.5-51.9176-80.6-60.9-71.300111.5F329 A331 I335 N336 T337 L348 L389 E391F329-M333 HydrophobicContact CD1-CG 3.88Å; F329-M333 HydrophobicContact CE1-CG 3.59Å; F329-M333 HydrophobicContact CE1-SD 4.38Å; F329-M333 HydrophobicContact CZ-CG 4.27Å; F329-M333 WeakPolarHBondContact O-CB 3.25Å; F329-M333 WeakPolarHBondContact O-CG 3.47Å; F329-M333 PolarHBondContact O-N 2.85Å; A331-M333 VanDerWaalsContact C-N 3.35Å; A331-M333 PolarHBondContact O-N 3.19Å; M333-I335 VanDerWaalsContact C-N 3.31Å; M333-I335 PolarHBondContact O-N 2.96Å; M333-N336 WeakPolarHBondContact O-CB 3.36Å; M333-N336 PolarHBondContact O-N 3.09Å; M333-T337 WeakPolarHBondContact O-CG2 3.43Å; M333-T337 PolarHBondContact O-N 2.98Å; M333-L348 HydrophobicContact CG-CD1 4.13Å; M333-L348 HydrophobicContact CG-CD2 3.68Å; M333-L348 HydrophobicContact SD-CD1 3.27Å; M333-L348 WeakPolarHBondContact SD-CD1 3.48Å; M333-L348 HydrophobicContact SD-CD2 3.9Å; M333-L348 HydrophobicContact SD-CG 4.14Å; M333-L389 HydrophobicContact CB-CD1 3.63Å; M333-E391 HydrophobicContact CE-CG 4.04Å; M333-E391 WeakPolarHBondContact CE-OE2 3.39Å
334T92.2Very high93.2Very high39 Ų3935.2 Ų35.224%0.23918%0.181CC..Hα-helixtrans-60.7-40178.1-57.60000111.7L164 A330 A331 N336 T337L164-T334 HydrophobicContact CD2-CG2 3.44Å; L164-T334 VanDerWaalsContact CD2-CG2 3.44Å; A330-T334 WeakPolarHBondContact O-CB 3.45Å; A330-T334 PolarHBondContact O-N 3.17Å; A330-T334 PolarHBondContact O-OG1 2.97Å; A331-T334 PolarHBondContact O-N 2.92Å; T334-N336 VanDerWaalsContact C-N 3.29Å; T334-N336 PolarHBondContact O-N 3.34Å; T334-T337 PolarHBondContact O-N 2.97Å; T334-T337 PolarHBondContact O-OG1 2.88Å
335I94.5Very high93.4Very high0 Ų038.5 Ų38.50%020%0.198CC..Hα-helixtrans-63.8-38174.9-68167000111.3L164 I257 L260 L261 Q264 A331 L332 M333 T337 I338L164-I335 HydrophobicContact CD1-CD1 4.04Å; L164-I335 HydrophobicContact CD1-CG1 4.03Å; L164-I335 HydrophobicContact CD2-CG1 4.48Å; I257-I335 HydrophobicContact CG2-CD1 4.18Å; L260-I335 HydrophobicContact CB-CD1 4.05Å; L260-I335 HydrophobicContact CB-CG2 4.19Å; L260-I335 HydrophobicContact CD1-CD1 4.47Å; L261-I335 HydrophobicContact CD2-CD1 4.08Å; L261-I335 HydrophobicContact CD2-CG1 3.84Å; L261-I335 HydrophobicContact CG-CD1 4.08Å; L261-I335 HydrophobicContact CG-CG1 4.4Å; Q264-I335 HydrophobicContact CG-CG2 3.78Å; Q264-I335 PolarHBondContact NE2-O 3.19Å; A331-I335 VanDerWaalsContact O-CG1 3.25Å; A331-I335 WeakPolarHBondContact O-CG1 3.32Å; A331-I335 PolarHBondContact O-N 3.38Å; L332-I335 PolarHBondContact O-N 2.92Å; M333-I335 VanDerWaalsContact C-N 3.31Å; M333-I335 PolarHBondContact O-N 2.96Å; I335-T337 VanDerWaalsContact C-N 3.35Å; I335-I338 PolarHBondContact O-N 3.29Å
336N94.5Very high93.7Very high14 Ų1443.5 Ų43.58%0.07522%0.222CC..Hα-helixtrans-72.5-26.6-179.5-15932.7000112.9L332 M333 T334 I338 L339 P340 D341 I344 Q345L332-N336 WeakPolarHBondContact O-CB 3.48Å; L332-N336 PolarHBondContact O-N 2.96Å; M333-N336 WeakPolarHBondContact O-CB 3.36Å; M333-N336 PolarHBondContact O-N 3.09Å; T334-N336 VanDerWaalsContact C-N 3.29Å; T334-N336 PolarHBondContact O-N 3.34Å; N336-I338 VanDerWaalsContact C-N 3.32Å; N336-L339 CarbonylContact O-C 3.55Å; N336-P340 VanDerWaalsContact O-CA 3.25Å; N336-P340 WeakPolarHBondContact O-CA 3.43Å; N336-P340 VanDerWaalsContact O-N 3.15Å; N336-P340 WeakPolarHBondContact OD1-CA 3.28Å; N336-D341 PolarHBondContact OD1-N 3.21Å; N336-D341 PolarHBondContact OD1-O 3.45Å; N336-I344 HydrophobicContact CB-CB 4.31Å; N336-I344 HydrophobicContact CB-CG2 3.74Å; N336-Q345 VanDerWaalsContact ND2-CG 3.32Å; N336-Q345 WeakPolarHBondContact ND2-CG 3.45Å
337T92.3Very high94.1Very high85 Ų8543.9 Ų43.952%0.52122%0.222SC..Hα-helixtrans-70.7-29.2174.560.90000112.4M333 T334 I335 L389M333-T337 WeakPolarHBondContact O-CG2 3.43Å; M333-T337 PolarHBondContact O-N 2.98Å; T334-T337 PolarHBondContact O-N 2.97Å; T334-T337 PolarHBondContact O-OG1 2.88Å; I335-T337 VanDerWaalsContact C-N 3.35Å; T337-L389 HydrophobicContact CG2-CD2 4.46Å
338I90.8Very high94.4Very high37 Ų3742.1 Ų42.119%0.1921%0.214CC..Hα-helixtrans-63.8-48.1177.9-61.8168.5000111.1D168 I171 T172 I335 N336D168-I338 HydrophobicContact CB-CD1 4.07Å; I171-I338 HydrophobicContact CD1-CD1 4.09Å; I171-I338 HydrophobicContact CG2-CG2 3.68Å; T172-I338 HydrophobicContact CG2-CD1 4.22Å; T172-I338 HydrophobicContact CG2-CG1 4.45Å; I335-I338 PolarHBondContact O-N 3.29Å; N336-I338 VanDerWaalsContact C-N 3.32Å
339L91.6Very high94.4Very high40 Ų4049.5 Ų49.521%0.20924%0.243CC..SBendtrans-149.4101.7176.8-79.5-179000108.8Q264 R267 K268 N336Q264-L339 PolarHBondContact NE2-O 3.3Å; R267-L339 HydrophobicContact CB-CD1 3.88Å; R267-L339 PolarHBondContact NH1-O 3.12Å; K268-L339 HydrophobicContact CD-CD1 3.94Å; K268-L339 HydrophobicContact CD-CG 4.47Å; K268-L339 HydrophobicContact CG-CD1 3.87Å; N336-L339 CarbonylContact O-C 3.55Å
340P95.2Very high94.6Very high83 Ų8351.3 Ų51.354%0.53925%0.253SS..  trans-55.6140.1-177.8-2936000113.3R267 N336R267-P340 PolarHBondContact NH1-O 3.32Å; R267-P340 PolarHBondContact NH2-O 2.98Å; N336-P340 VanDerWaalsContact O-CA 3.25Å; N336-P340 WeakPolarHBondContact O-CA 3.43Å; N336-P340 VanDerWaalsContact O-N 3.15Å; N336-P340 WeakPolarHBondContact OD1-CA 3.28Å
341D96.2Very high94.9Very high25 Ų2550.6 Ų50.613%0.13425%0.248CC..  trans-142131.4171.7-162.6-68.7000110.1R267 W289 N336 R343 I344 Q345R267-D341 IonicContact CZ-OD2 2.88Å; R267-D341 IonicContact NH1-OD2 3.81Å; W289-D341 HydrophobicContact CH2-CB 4.31Å; W289-D341 WeakPolarHBondContact CZ2-OD2 3.3Å; N336-D341 PolarHBondContact OD1-N 3.21Å; N336-D341 PolarHBondContact OD1-O 3.45Å; D341-R343 PolarHBondContact O-N 2.92Å; D341-R343 VanDerWaalsContact OD1-CB 3.32Å; D341-R343 WeakPolarHBondContact OD1-CB 3.17Å; D341-R343 WeakPolarHBondContact OD1-CG 3.41Å; D341-R343 PolarHBondContact OD1-N 3.18Å; D341-R343 IonicContact OD1-NE 2.63Å; D341-I344 HydrophobicContact CB-CD1 3.99Å; D341-I344 HydrophobicContact CB-CG1 4.21Å; D341-I344 PolarHBondContact O-N 3.34Å; D341-Q345 PolarHBondContact O-N 3.31Å
342E96.9Very high94.9Very high144 Ų14453.3 Ų53.367%0.67326%0.26SS*.Hα-helixtrans-60.8-30.9-179.6-65.6-178.3173.100112.3Q345 Q346E342-Q345 WeakPolarHBondContact O-CB 3.47Å; E342-Q345 PolarHBondContact O-N 3.33Å; E342-Q346 VanDerWaalsContact O-CG 3.3Å; E342-Q346 WeakPolarHBondContact O-CG 3.4Å; E342-Q346 PolarHBondContact O-N 2.71Å
343R97.7Very high94.8Very high105 Ų10556.2 Ų56.240%0.39628%0.28SS..Hα-helixtrans-66.8-42177.7-63.5-178.4-125.2-164.2-2.8111.5W289 D341 Q345 Q346 Y347W289-R343 VanDerWaalsContact CG-NH1 3.25Å; W289-R343 HydrophobicContact CH2-CB 4.21Å; W289-R343 HydrophobicContact CZ3-CB 3.95Å; D341-R343 PolarHBondContact O-N 2.92Å; D341-R343 VanDerWaalsContact OD1-CB 3.32Å; D341-R343 WeakPolarHBondContact OD1-CB 3.17Å; D341-R343 WeakPolarHBondContact OD1-CG 3.41Å; D341-R343 PolarHBondContact OD1-N 3.18Å; D341-R343 IonicContact OD1-NE 2.63Å; R343-Q345 VanDerWaalsContact C-N 3.3Å; R343-Q345 PolarHBondContact O-N 3Å; R343-Q346 WeakPolarHBondContact O-CB 3.44Å; R343-Q346 PolarHBondContact O-N 2.97Å; R343-Y347 HydrophobicContact CB-CE2 4.25Å; R343-Y347 WeakPolarHBondContact O-CD1 3.18Å; R343-Y347 VanDerWaalsContact O-CD2 3.32Å; R343-Y347 WeakPolarHBondContact O-CD2 3.37Å; R343-Y347 PolarHBondContact O-N 3.18Å
344I97.4Very high94.9Very high1 Ų156.9 Ų56.91%0.00528%0.283CS..Hα-helixtrans-64.9-41177.6-59.5166.4000109.6L260 W289 L332 N336 D341 Q346 Y347 L348L260-I344 HydrophobicContact CD2-CD1 4.13Å; L260-I344 HydrophobicContact CD2-CG1 4.06Å; W289-I344 HydrophobicContact CH2-CD1 4.31Å; W289-I344 HydrophobicContact CH2-CG1 4.05Å; W289-I344 HydrophobicContact CZ3-CG1 4.36Å; L332-I344 HydrophobicContact CB-CG2 4.4Å; N336-I344 HydrophobicContact CB-CB 4.31Å; N336-I344 HydrophobicContact CB-CG2 3.74Å; D341-I344 HydrophobicContact CB-CD1 3.99Å; D341-I344 HydrophobicContact CB-CG1 4.21Å; D341-I344 PolarHBondContact O-N 3.34Å; I344-Q346 VanDerWaalsContact C-N 3.31Å; I344-Q346 PolarHBondContact O-N 2.84Å; I344-Y347 PolarHBondContact O-N 3.45Å; I344-L348 HydrophobicContact CG2-CD1 3.96Å; I344-L348 HydrophobicContact CG2-CG 4.39Å; I344-L348 WeakPolarHBondContact O-CD1 3.48Å; I344-L348 VanDerWaalsContact O-CG 3.28Å; I344-L348 WeakPolarHBondContact O-CG 3.3Å; I344-L348 PolarHBondContact O-N 3.24Å
345Q95.5Very high94.9Very high102 Ų10255.2 Ų55.248%0.47727%0.273SS..Hα-helixtrans-58.6-41.9173.9-64.8175.4-6.300112.1N336 D341 E342 R343 L348 Y349N336-Q345 VanDerWaalsContact ND2-CG 3.32Å; N336-Q345 WeakPolarHBondContact ND2-CG 3.45Å; D341-Q345 PolarHBondContact O-N 3.31Å; E342-Q345 WeakPolarHBondContact O-CB 3.47Å; E342-Q345 PolarHBondContact O-N 3.33Å; R343-Q345 VanDerWaalsContact C-N 3.3Å; R343-Q345 PolarHBondContact O-N 3Å; Q345-L348 PolarHBondContact O-N 3.04Å; Q345-Y349 PolarHBondContact O-N 3.43Å
346Q97.7Very high94.8Very high116 Ų11657 Ų5754%0.54229%0.285SS..Hα-helixtrans-64.5-41.7175.1-70.7169.513.400112.3E342 R343 I344 L348 Y349 L350E342-Q346 VanDerWaalsContact O-CG 3.3Å; E342-Q346 WeakPolarHBondContact O-CG 3.4Å; E342-Q346 PolarHBondContact O-N 2.71Å; R343-Q346 WeakPolarHBondContact O-CB 3.44Å; R343-Q346 PolarHBondContact O-N 2.97Å; I344-Q346 VanDerWaalsContact C-N 3.31Å; I344-Q346 PolarHBondContact O-N 2.84Å; Q346-L348 VanDerWaalsContact C-N 3.34Å; Q346-L348 PolarHBondContact O-N 3.37Å; Q346-Y349 PolarHBondContact O-N 3.49Å; Q346-L350 VanDerWaalsContact O-CG 3.28Å; Q346-L350 WeakPolarHBondContact O-CG 3.27Å; Q346-L350 PolarHBondContact O-N 2.99Å
347Y97.8Very high94.7Very high13 Ų1357.9 Ų57.95%0.05130%0.297CS..Hα-helixtrans-62.1-42.9176.5-56.6-31.6000111.9W289 V292 D293 I296 R343 I344 L350 L351W289-Y347 HydrophobicContact CZ3-CE2 4.09Å; V292-Y347 HydrophobicContact CG1-CD2 4.41Å; V292-Y347 HydrophobicContact CG1-CE2 3.61Å; D293-Y347 VanDerWaalsContact CG-OH 3.3Å; D293-Y347 WeakPolarHBondContact OD1-CE1 3.48Å; D293-Y347 PolarHBondContact OD1-OH 3Å; I296-Y347 HydrophobicContact CB-CD1 4.21Å; I296-Y347 HydrophobicContact CB-CE1 4.47Å; I296-Y347 HydrophobicContact CB-CG 4.39Å; I296-Y347 HydrophobicContact CD1-CD2 4.25Å; I296-Y347 HydrophobicContact CD1-CG 4.25Å; I296-Y347 HydrophobicContact CG1-CD1 4.1Å; I296-Y347 HydrophobicContact CG1-CD2 3.85Å; I296-Y347 HydrophobicContact CG1-CE1 4.37Å; I296-Y347 HydrophobicContact CG1-CE2 4.15Å; I296-Y347 HydrophobicContact CG1-CG 3.84Å; I296-Y347 HydrophobicContact CG2-CD1 3.72Å; I296-Y347 HydrophobicContact CG2-CE1 4.38Å; I296-Y347 HydrophobicContact CG2-CG 3.97Å; R343-Y347 HydrophobicContact CB-CE2 4.25Å; R343-Y347 WeakPolarHBondContact O-CD1 3.18Å; R343-Y347 VanDerWaalsContact O-CD2 3.32Å; R343-Y347 WeakPolarHBondContact O-CD2 3.37Å; R343-Y347 PolarHBondContact O-N 3.18Å; I344-Y347 PolarHBondContact O-N 3.45Å; Y347-L350 PolarHBondContact O-N 3.36Å; Y347-L351 WeakPolarHBondContact O-CB 3.39Å; Y347-L351 VanDerWaalsContact O-CG 3.24Å; Y347-L351 WeakPolarHBondContact O-CG 3.49Å; Y347-L351 PolarHBondContact O-N 3.39Å
348L95.1Very high94.8Very high7 Ų754.2 Ų54.24%0.03727%0.274CS..Hα-helixtrans-59.7-48.3176.8-70.8160000111.1F329 L332 M333 I344 Q345 Q346 L350 L351 E352F329-L348 HydrophobicContact CD1-CD2 4.25Å; F329-L348 HydrophobicContact CD2-CD2 3.65Å; F329-L348 HydrophobicContact CE1-CD2 4.17Å; F329-L348 HydrophobicContact CE2-CB 3.95Å; F329-L348 HydrophobicContact CE2-CD2 3.58Å; F329-L348 HydrophobicContact CE2-CG 4.41Å; F329-L348 WeakPolarHBondContact CE2-O 3.26Å; F329-L348 HydrophobicContact CG-CD2 4Å; F329-L348 HydrophobicContact CZ-CB 4.29Å; F329-L348 HydrophobicContact CZ-CD2 3.84Å; L332-L348 HydrophobicContact CB-CD2 3.75Å; L332-L348 HydrophobicContact CB-CG 4.39Å; M333-L348 HydrophobicContact CG-CD1 4.13Å; M333-L348 HydrophobicContact CG-CD2 3.68Å; M333-L348 HydrophobicContact SD-CD1 3.27Å; M333-L348 WeakPolarHBondContact SD-CD1 3.48Å; M333-L348 HydrophobicContact SD-CD2 3.9Å; M333-L348 HydrophobicContact SD-CG 4.14Å; I344-L348 HydrophobicContact CG2-CD1 3.96Å; I344-L348 HydrophobicContact CG2-CG 4.39Å; I344-L348 WeakPolarHBondContact O-CD1 3.48Å; I344-L348 VanDerWaalsContact O-CG 3.28Å; I344-L348 WeakPolarHBondContact O-CG 3.3Å; I344-L348 PolarHBondContact O-N 3.24Å; Q345-L348 PolarHBondContact O-N 3.04Å; Q346-L348 VanDerWaalsContact C-N 3.34Å; Q346-L348 PolarHBondContact O-N 3.37Å; L348-L350 VanDerWaalsContact C-N 3.34Å; L348-L350 PolarHBondContact O-N 2.91Å; L348-L351 PolarHBondContact O-N 2.99Å; L348-E352 PolarHBondContact O-N 3.48Å
349Y95.3Very high94.8Very high158 Ų15852.6 Ų52.662%0.6227%0.266SS*.Hα-helixtrans-57.8-44.4175.4174.8-98.5000112.8Q345 Q346 E352 S353Q345-Y349 PolarHBondContact O-N 3.43Å; Q346-Y349 PolarHBondContact O-N 3.49Å; Y349-E352 PolarHBondContact O-N 3.47Å; Y349-S353 WeakPolarHBondContact O-CB 3.49Å; Y349-S353 PolarHBondContact O-N 3.35Å
350L97Very high94.9Very high67 Ų6754.5 Ų54.535%0.35128%0.282SS..Hα-helixtrans-64.3-42.9178.4-70.6171.2000112L300 Q346 Y347 L348 S353 E354L300-L350 HydrophobicContact CD1-CB 3.94Å; L300-L350 HydrophobicContact CD1-CD1 4.13Å; L300-L350 HydrophobicContact CD2-CB 4.14Å; Q346-L350 VanDerWaalsContact O-CG 3.28Å; Q346-L350 WeakPolarHBondContact O-CG 3.27Å; Q346-L350 PolarHBondContact O-N 2.99Å; Y347-L350 PolarHBondContact O-N 3.36Å; L348-L350 VanDerWaalsContact C-N 3.34Å; L348-L350 PolarHBondContact O-N 2.91Å; L350-S353 PolarHBondContact O-N 3.26Å; L350-E354 WeakPolarHBondContact O-CG 3.47Å; L350-E354 PolarHBondContact O-N 3.29Å
351L95.3Very high94.8Very high0 Ų056.2 Ų56.20%028%0.281CS..Hα-helixtrans-61.3-46.3177-74.4167.3000110.8L137 L300 Y325 F328 F329 L332 Y347 L348 S353 E354 L355L137-L351 HydrophobicContact CD1-CD2 3.81Å; L300-L351 HydrophobicContact CD2-CD2 3.85Å; L300-L351 HydrophobicContact CD2-CG 4.22Å; Y325-L351 HydrophobicContact CD2-CB 4.44Å; Y325-L351 HydrophobicContact CE2-CB 3.82Å; Y325-L351 WeakPolarHBondContact CE2-O 3.46Å; F328-L351 HydrophobicContact CD1-CD1 4.03Å; F328-L351 HydrophobicContact CE1-CD1 3.98Å; F329-L351 HydrophobicContact CD2-CB 4.36Å; L332-L351 HydrophobicContact CD2-CD1 3.91Å; Y347-L351 WeakPolarHBondContact O-CB 3.39Å; Y347-L351 VanDerWaalsContact O-CG 3.24Å; Y347-L351 WeakPolarHBondContact O-CG 3.49Å; Y347-L351 PolarHBondContact O-N 3.39Å; L348-L351 PolarHBondContact O-N 2.99Å; L351-S353 VanDerWaalsContact C-N 3.33Å; L351-S353 PolarHBondContact O-N 3.18Å; L351-E354 PolarHBondContact O-N 3.38Å; L351-L355 PolarHBondContact O-N 3.06Å
352E92.5Very high94.7Very high58 Ų5855 Ų5527%0.27128%0.275SS..Hα-helixtrans-61.9-42.3177.5-172.9-174.4-179.600111.6Y325 F329 L348 Y349 S356 R398Y325-E352 WeakPolarHBondContact OH-CA 3.44Å; F329-E352 HydrophobicContact CE2-CB 4.38Å; L348-E352 PolarHBondContact O-N 3.48Å; Y349-E352 PolarHBondContact O-N 3.47Å; E352-S356 VanDerWaalsContact O-CB 3.28Å; E352-S356 WeakPolarHBondContact O-CB 3.2Å; E352-S356 PolarHBondContact O-N 3.42Å; E352-S356 PolarHBondContact O-OG 2.8Å; E352-R398 IonicContact OE1-CZ 3.89Å; E352-R398 IonicContact OE1-NH1 3.45Å; E352-R398 PolarHBondContact OE1-NH1 3.4Å; E352-R398 IonicContact OE1-NH2 3.58Å; E352-R398 PolarHBondContact OE1-NH2 2.95Å
353S94.1Very high94.5Very high62 Ų6249.5 Ų49.543%0.43425%0.251SS..Hα-helixtrans-62.5-47178.7-172.60000112Y349 L350 L351 S356 G357Y349-S353 WeakPolarHBondContact O-CB 3.49Å; Y349-S353 PolarHBondContact O-N 3.35Å; L350-S353 PolarHBondContact O-N 3.26Å; L351-S353 VanDerWaalsContact C-N 3.33Å; L351-S353 PolarHBondContact O-N 3.18Å; S353-S356 PolarHBondContact O-N 2.95Å; S353-G357 PolarHBondContact O-N 3.16Å
354E94.2Very high94.3Very high39 Ų3948.1 Ų48.118%0.18226%0.262CS..Hα-helixtrans-64.8-43.5178.7-72.5-59.9158.200111.9L300 R304 L350 L351 G357 L358L300-E354 HydrophobicContact CB-CG 4.41Å; L300-E354 HydrophobicContact CD2-CB 4.15Å; L300-E354 HydrophobicContact CD2-CG 3.55Å; R304-E354 WeakPolarHBondContact CG-OE2 3.49Å; R304-E354 IonicContact CZ-OE1 3.82Å; R304-E354 IonicContact NE-OE1 3.5Å; R304-E354 PolarHBondContact NE-OE1 3.05Å; R304-E354 IonicContact NE-OE2 3.37Å; R304-E354 IonicContact NH2-OE1 3.08Å; R304-E354 PolarHBondContact NH2-OE1 2.89Å; L350-E354 WeakPolarHBondContact O-CG 3.47Å; L350-E354 PolarHBondContact O-N 3.29Å; L351-E354 PolarHBondContact O-N 3.38Å; E354-G357 PolarHBondContact O-N 3.37Å; E354-L358 PolarHBondContact O-N 3.35Å
355L92.3Very high94.1Very high4 Ų452.5 Ų52.52%0.02128%0.283CS..Hα-helixtrans-64.1-45177.7-178.163.4000111.5F303 V322 Y325 L351 G357 L358 M359 E383F303-L355 HydrophobicContact CE1-CD1 4.33Å; V322-L355 HydrophobicContact CG2-CD1 4.06Å; Y325-L355 HydrophobicContact CD1-CD2 3.27Å; Y325-L355 HydrophobicContact CD2-CB 4.21Å; Y325-L355 HydrophobicContact CD2-CD2 4.02Å; Y325-L355 HydrophobicContact CE1-CD2 3.31Å; Y325-L355 HydrophobicContact CE2-CB 3.98Å; Y325-L355 HydrophobicContact CE2-CD2 4.01Å; Y325-L355 HydrophobicContact CG-CD2 3.66Å; L351-L355 PolarHBondContact O-N 3.06Å; L355-G357 PolarHBondContact O-N 3.37Å; L355-L358 HydrophobicContact CD1-CD2 4.27Å; L355-L358 WeakPolarHBondContact O-CB 3.19Å; L355-L358 PolarHBondContact O-N 3.12Å; L355-L358 VanDerWaalsContact O-N 3.13Å; L355-M359 HydrophobicContact CD1-CG 4.12Å; L355-M359 HydrophobicContact CG-CG 4.18Å; L355-M359 WeakPolarHBondContact O-CB 3.13Å; L355-M359 VanDerWaalsContact O-CG 3.28Å; L355-M359 WeakPolarHBondContact O-CG 3.43Å; L355-M359 PolarHBondContact O-N 3.5Å; L355-E383 WeakPolarHBondContact CD2-OE1 3.34Å
356S91.1Very high93.9Very high38 Ų3848.4 Ų48.427%0.26626%0.264SS..Hα-helixtrans-58.5-39.7177.1-61.90000111.4E352 S353 S360E352-S356 VanDerWaalsContact O-CB 3.28Å; E352-S356 WeakPolarHBondContact O-CB 3.2Å; E352-S356 PolarHBondContact O-N 3.42Å; E352-S356 PolarHBondContact O-OG 2.8Å; S353-S356 PolarHBondContact O-N 2.95Å; S356-S360 WeakPolarHBondContact O-CB 3.09Å; S356-S360 PolarHBondContact O-N 3.31Å; S356-S360 PolarHBondContact O-OG 2.82Å
357G93.4Very high93.5Very high31 Ų3147.7 Ų47.732%0.3227%0.272SS..Hα-helixtrans-63.7-45.6173.500000113S353 E354 L355 S360 K361S353-G357 PolarHBondContact O-N 3.16Å; E354-G357 PolarHBondContact O-N 3.37Å; L355-G357 PolarHBondContact O-N 3.37Å; G357-S360 PolarHBondContact O-N 3.26Å; G357-K361 WeakPolarHBondContact O-CG 3.47Å; G357-K361 PolarHBondContact O-N 3.18Å; G357-K361 VanDerWaalsContact O-N 3.1Å
358L93Very high93.2Very high8 Ų849 Ų494%0.04228%0.283CS..Hα-helixtrans-60-50.2176.1-179.273.7000111.5F303 L306 L308 I321 E354 L355 S360 K361 I362F303-L358 HydrophobicContact CD1-CD2 3.97Å; F303-L358 HydrophobicContact CE1-CD2 4.16Å; L306-L358 HydrophobicContact CD2-CD1 4.42Å; L308-L358 HydrophobicContact CD2-CD1 3.54Å; I321-L358 HydrophobicContact CD1-CD2 4.25Å; I321-L358 HydrophobicContact CG2-CD2 4.1Å; E354-L358 PolarHBondContact O-N 3.35Å; L355-L358 HydrophobicContact CD1-CD2 4.27Å; L355-L358 WeakPolarHBondContact O-CB 3.19Å; L355-L358 PolarHBondContact O-N 3.12Å; L355-L358 VanDerWaalsContact O-N 3.13Å; L358-S360 VanDerWaalsContact C-N 3.28Å; L358-S360 PolarHBondContact O-N 2.91Å; L358-K361 WeakPolarHBondContact O-CB 3.33Å; L358-K361 PolarHBondContact O-N 3.07Å; L358-K361 VanDerWaalsContact O-N 3.14Å; L358-I362 HydrophobicContact CD1-CD1 4.42Å; L358-I362 HydrophobicContact CG-CD1 4.1Å; L358-I362 WeakPolarHBondContact O-CG1 3.44Å; L358-I362 PolarHBondContact O-N 3.25Å
359M92.1Very high93Very high4 Ų451.9 Ų51.92%0.0230%0.303CS..Hα-helixtrans-58.4-42.4179.8-68.9-60.4-73.500111.1L319 V322 L355 K361 I362 V363 F375 L376 N379L319-M359 HydrophobicContact CD1-SD 4.43Å; V322-M359 HydrophobicContact CG2-SD 4Å; L355-M359 HydrophobicContact CD1-CG 4.12Å; L355-M359 HydrophobicContact CG-CG 4.18Å; L355-M359 WeakPolarHBondContact O-CB 3.13Å; L355-M359 VanDerWaalsContact O-CG 3.28Å; L355-M359 WeakPolarHBondContact O-CG 3.43Å; L355-M359 PolarHBondContact O-N 3.5Å; M359-K361 PolarHBondContact O-N 3.42Å; M359-I362 PolarHBondContact O-N 3.4Å; M359-V363 WeakPolarHBondContact O-CB 3.4Å; M359-V363 VanDerWaalsContact O-CG2 3.25Å; M359-V363 WeakPolarHBondContact O-CG2 3.37Å; M359-V363 PolarHBondContact O-N 2.98Å; M359-F375 HydrophobicContact CE-CD1 4.04Å; M359-F375 HydrophobicContact CE-CE1 3.26Å; M359-F375 HydrophobicContact CE-CZ 3.63Å; M359-F375 HydrophobicContact SD-CE1 3.8Å; M359-F375 HydrophobicContact SD-CZ 3.72Å; M359-L376 HydrophobicContact CE-CD2 4.14Å; M359-N379 HydrophobicContact CE-CB 3.48Å; M359-N379 VanDerWaalsContact CE-CB 3.48Å; M359-N379 HydrophobicContact SD-CB 4.44Å
360S93.7Very high92.9Very high79 Ų7946.8 Ų46.855%0.55229%0.285SS*.Hα-helixtrans-62.5-41176.9-600000112.7S356 G357 L358 A364S356-S360 WeakPolarHBondContact O-CB 3.09Å; S356-S360 PolarHBondContact O-N 3.31Å; S356-S360 PolarHBondContact O-OG 2.82Å; G357-S360 PolarHBondContact O-N 3.26Å; L358-S360 VanDerWaalsContact C-N 3.28Å; L358-S360 PolarHBondContact O-N 2.91Å; S360-A364 PolarHBondContact O-N 3.26Å; S360-A364 VanDerWaalsContact O-N 3.1Å
361K93.6Very high92.7Very high119 Ų11947.4 Ų47.452%0.51729%0.286SS..Hα-helixtrans-63.7-41.1176.2-70.3171.7-177.1174.30111.9L308 G357 L358 M359 A364L308-K361 HydrophobicContact CD1-CB 3.97Å; G357-K361 WeakPolarHBondContact O-CG 3.47Å; G357-K361 PolarHBondContact O-N 3.18Å; G357-K361 VanDerWaalsContact O-N 3.1Å; L358-K361 WeakPolarHBondContact O-CB 3.33Å; L358-K361 PolarHBondContact O-N 3.07Å; L358-K361 VanDerWaalsContact O-N 3.14Å; M359-K361 PolarHBondContact O-N 3.42Å; K361-A364 PolarHBondContact O-N 3.21Å
362I93.2Very high92.6Very high0 Ų051.7 Ų51.70%030%0.302CS..Hα-helixtrans-68.9-45.1178.8-64.7172.3000110.7L308 L311 F314 L319 L358 M359 A364 Q365 L366 F375L308-I362 HydrophobicContact CD2-CD1 4.26Å; L308-I362 HydrophobicContact CD2-CG1 3.88Å; L311-I362 HydrophobicContact CD1-CD1 4.02Å; F314-I362 HydrophobicContact CB-CG2 4.19Å; F314-I362 HydrophobicContact CD1-CD1 4.44Å; F314-I362 HydrophobicContact CD1-CG2 3.44Å; F314-I362 VanDerWaalsContact CD1-CG2 3.44Å; F314-I362 HydrophobicContact CD2-CG2 4Å; F314-I362 HydrophobicContact CE1-CB 4.45Å; F314-I362 HydrophobicContact CE1-CD1 3.83Å; F314-I362 HydrophobicContact CE1-CG1 3.96Å; F314-I362 HydrophobicContact CE1-CG2 3.66Å; F314-I362 HydrophobicContact CE2-CG2 4.21Å; F314-I362 HydrophobicContact CG-CG2 3.6Å; F314-I362 HydrophobicContact CZ-CD1 4.39Å; F314-I362 HydrophobicContact CZ-CG1 4.09Å; F314-I362 HydrophobicContact CZ-CG2 4.03Å; L319-I362 HydrophobicContact CD1-CD1 3.54Å; L358-I362 HydrophobicContact CD1-CD1 4.42Å; L358-I362 HydrophobicContact CG-CD1 4.1Å; L358-I362 WeakPolarHBondContact O-CG1 3.44Å; L358-I362 PolarHBondContact O-N 3.25Å; M359-I362 PolarHBondContact O-N 3.4Å; I362-A364 PolarHBondContact O-N 3.45Å; I362-Q365 WeakPolarHBondContact O-CB 2.87Å; I362-Q365 PolarHBondContact O-N 2.96Å; I362-L366 PolarHBondContact O-N 3.2Å; I362-F375 HydrophobicContact CB-CE1 4.07Å; I362-F375 HydrophobicContact CB-CZ 3.94Å; I362-F375 HydrophobicContact CD1-CZ 4.01Å; I362-F375 HydrophobicContact CG2-CD1 4.34Å; I362-F375 HydrophobicContact CG2-CD2 4.42Å; I362-F375 HydrophobicContact CG2-CE1 3.71Å; I362-F375 HydrophobicContact CG2-CE2 3.8Å; I362-F375 HydrophobicContact CG2-CZ 3.42Å; I362-F375 VanDerWaalsContact CG2-CZ 3.42Å
363V93.6Very high92.8Very high29 Ų2949.1 Ų49.118%0.17629%0.29CS..Hα-helixtrans-56.6-36.9176.41660000111.8M359 Q365 L366 R372 F375 L376M359-V363 WeakPolarHBondContact O-CB 3.4Å; M359-V363 VanDerWaalsContact O-CG2 3.25Å; M359-V363 WeakPolarHBondContact O-CG2 3.37Å; M359-V363 PolarHBondContact O-N 2.98Å; V363-Q365 VanDerWaalsContact C-N 3.26Å; V363-Q365 PolarHBondContact O-N 3.05Å; V363-L366 PolarHBondContact O-N 3.33Å; V363-R372 HydrophobicContact CG1-CB 4.08Å; V363-R372 HydrophobicContact CG1-CG 3.81Å; V363-R372 PolarHBondContact O-NE 2.86Å; V363-F375 HydrophobicContact CG2-CD1 3.9Å; V363-F375 HydrophobicContact CG2-CE1 4.12Å; V363-L376 HydrophobicContact CG2-CD1 4.07Å; V363-L376 HydrophobicContact CG2-CD2 3.83Å; V363-L376 HydrophobicContact CG2-CG 3.88Å
364A93.2Very high92.7Very high75 Ų7546.5 Ų46.562%0.6227%0.271SS*.Hα-helixtrans-66.3-23.7176.800000114S360 K361 I362S360-A364 PolarHBondContact O-N 3.26Å; S360-A364 VanDerWaalsContact O-N 3.1Å; K361-A364 PolarHBondContact O-N 3.21Å; I362-A364 PolarHBondContact O-N 3.45Å
365Q91.7Very high92.7Very high94 Ų9444.7 Ų44.744%0.43926%0.263SS..Hα-helixtrans-84.3-15176.7-64.1-1761.200113.1L308 I362 V363L308-Q365 VanDerWaalsContact CD1-NE2 3.3Å; I362-Q365 WeakPolarHBondContact O-CB 2.87Å; I362-Q365 PolarHBondContact O-N 2.96Å; V363-Q365 VanDerWaalsContact C-N 3.26Å; V363-Q365 PolarHBondContact O-N 3.05Å
366L92.1Very high92.8Very high15 Ų1545.3 Ų45.38%0.07927%0.266CS..  trans-80135.2-179.7-69.1172.6000111.4F314 I362 V363 E371 R372 F375F314-L366 HydrophobicContact CB-CD2 3.76Å; I362-L366 PolarHBondContact O-N 3.2Å; V363-L366 PolarHBondContact O-N 3.33Å; L366-E371 HydrophobicContact CB-CB 4.39Å; L366-E371 HydrophobicContact CD2-CB 4.34Å; L366-R372 HydrophobicContact CB-CG 3.67Å; L366-R372 HydrophobicContact CD1-CG 4.19Å; L366-R372 PolarHBondContact O-NE 2.87Å; L366-R372 VanDerWaalsContact O-NE 3.1Å; L366-R372 PolarHBondContact O-NH2 3.01Å; L366-F375 HydrophobicContact CD1-CB 3.71Å; L366-F375 HydrophobicContact CD1-CD1 4.24Å; L366-F375 HydrophobicContact CD1-CG 3.99Å
367S89.2Confident92.9Very high102 Ų10243.5 Ų43.571%0.71325%0.253SS*.SBendtrans-75.2-38.9-168.274.60000113.1E371S367-E371 PolarHBondContact N-OE2 3.35Å; S367-E371 PolarHBondContact OG-OE2 2.86Å
368S91.4Very high92.8Very high41 Ų4142 Ų4229%0.28724%0.238SC..SBendtrans-114.6148.1-175.371.20000112.5K370 E371 R372S368-K370 PolarHBondContact O-N 2.87Å; S368-E371 PolarHBondContact N-OE2 2.9Å; S368-E371 VanDerWaalsContact N-OE2 3.15Å; S368-E371 PolarHBondContact O-N 3.3Å; S368-E371 WeakPolarHBondContact OG-CB 3.47Å; S368-E371 VanDerWaalsContact OG-CD 3.24Å; S368-E371 WeakPolarHBondContact OG-CG 3.32Å; S368-E371 PolarHBondContact OG-N 2.87Å; S368-E371 VanDerWaalsContact OG-N 3.1Å; S368-E371 PolarHBondContact OG-OE2 3.13Å; S368-E371 VanDerWaalsContact OG-OE2 3.09Å; S368-R372 WeakPolarHBondContact O-CG 3.1Å; S368-R372 PolarHBondContact O-N 3.1Å; S368-R372 VanDerWaalsContact O-N 3.16Å
369S91.9Very high92.7Very high66 Ų6641.6 Ų41.646%0.46224%0.236SC..Hα-helixtrans-56.4-35.7173.8-154.50000111.9R372 L373S369-R372 WeakPolarHBondContact O-CB 3.45Å; S369-R372 PolarHBondContact O-N 3.4Å; S369-L373 WeakPolarHBondContact O-CG 3.39Å; S369-L373 PolarHBondContact O-N 3.32Å; S369-L373 VanDerWaalsContact O-N 3.11Å
370K92.1Very high92.6Very high52 Ų5242.1 Ų42.123%0.22624%0.238CC..Hα-helixtrans-65-47.3178.3-172.7-178.7-178.2173.80112.4S368 R372 L373 V374 Y406 T409 E473S368-K370 PolarHBondContact O-N 2.87Å; K370-R372 VanDerWaalsContact C-N 3.29Å; K370-R372 PolarHBondContact O-N 3.28Å; K370-L373 PolarHBondContact O-N 2.98Å; K370-V374 WeakPolarHBondContact O-CG2 3.43Å; K370-V374 PolarHBondContact O-N 2.97Å; K370-Y406 HydrophobicContact CG-CD2 4.42Å; K370-Y406 HydrophobicContact CG-CE2 3.75Å; K370-T409 HydrophobicContact CB-CG2 4.44Å; K370-E473 WeakPolarHBondContact CE-OE1 3.28Å; K370-E473 IonicContact NZ-OE1 3.79Å; K370-E473 PolarHBondContact NZ-OE1 3.38Å; K370-E473 IonicContact NZ-OE2 2.65Å; K370-E473 PolarHBondContact NZ-OE2 3.07Å
371E92.2Very high92.2Very high80 Ų8038.5 Ų38.537%0.37421%0.212SC..Hα-helixtrans-60.5-39.8175.8-76.3164.9163.500111.7L366 S367 S368 L373 V374 F375L366-E371 HydrophobicContact CB-CB 4.39Å; L366-E371 HydrophobicContact CD2-CB 4.34Å; S367-E371 PolarHBondContact N-OE2 3.35Å; S367-E371 PolarHBondContact OG-OE2 2.86Å; S368-E371 PolarHBondContact N-OE2 2.9Å; S368-E371 VanDerWaalsContact N-OE2 3.15Å; S368-E371 PolarHBondContact O-N 3.3Å; S368-E371 WeakPolarHBondContact OG-CB 3.47Å; S368-E371 VanDerWaalsContact OG-CD 3.24Å; S368-E371 WeakPolarHBondContact OG-CG 3.32Å; S368-E371 PolarHBondContact OG-N 2.87Å; S368-E371 VanDerWaalsContact OG-N 3.1Å; S368-E371 PolarHBondContact OG-OE2 3.13Å; S368-E371 VanDerWaalsContact OG-OE2 3.09Å; E371-L373 VanDerWaalsContact C-N 3.35Å; E371-L373 PolarHBondContact O-N 2.78Å; E371-V374 PolarHBondContact O-N 3.14Å; E371-F375 WeakPolarHBondContact O-CB 3.41Å; E371-F375 PolarHBondContact O-N 3.43Å
372R94.8Very high91.7Very high90 Ų9034.2 Ų34.234%0.3420%0.195SC..Hα-helixtrans-58.6-46.7175.9-66.3172.7-171.2172.93.9111.6V363 L366 S368 S369 K370 F375 L376V363-R372 HydrophobicContact CG1-CB 4.08Å; V363-R372 HydrophobicContact CG1-CG 3.81Å; V363-R372 PolarHBondContact O-NE 2.86Å; L366-R372 HydrophobicContact CB-CG 3.67Å; L366-R372 HydrophobicContact CD1-CG 4.19Å; L366-R372 PolarHBondContact O-NE 2.87Å; L366-R372 VanDerWaalsContact O-NE 3.1Å; L366-R372 PolarHBondContact O-NH2 3.01Å; S368-R372 WeakPolarHBondContact O-CG 3.1Å; S368-R372 PolarHBondContact O-N 3.1Å; S368-R372 VanDerWaalsContact O-N 3.16Å; S369-R372 WeakPolarHBondContact O-CB 3.45Å; S369-R372 PolarHBondContact O-N 3.4Å; K370-R372 VanDerWaalsContact C-N 3.29Å; K370-R372 PolarHBondContact O-N 3.28Å; R372-F375 PolarHBondContact O-N 2.97Å; R372-L376 WeakPolarHBondContact O-CB 3.19Å; R372-L376 WeakPolarHBondContact O-CD1 3.25Å; R372-L376 VanDerWaalsContact O-CG 3.25Å; R372-L376 WeakPolarHBondContact O-CG 3.48Å; R372-L376 PolarHBondContact O-N 2.94Å
373L94.8Very high90.8Very high4 Ų435.4 Ų35.42%0.02120%0.2CC..Hα-helixtrans-65.6-44.8178.3-70.5167.3000112.2S369 K370 E371 F375 L376 I377 Y402 E405 Y406S369-L373 WeakPolarHBondContact O-CG 3.39Å; S369-L373 PolarHBondContact O-N 3.32Å; S369-L373 VanDerWaalsContact O-N 3.11Å; K370-L373 PolarHBondContact O-N 2.98Å; E371-L373 VanDerWaalsContact C-N 3.35Å; E371-L373 PolarHBondContact O-N 2.78Å; L373-F375 VanDerWaalsContact C-N 3.31Å; L373-F375 PolarHBondContact O-N 3.43Å; L373-L376 PolarHBondContact O-N 2.78Å; L373-I377 WeakPolarHBondContact O-CB 3.43Å; L373-I377 WeakPolarHBondContact O-CD1 3.48Å; L373-I377 WeakPolarHBondContact O-CG1 3.39Å; L373-I377 PolarHBondContact O-N 3.49Å; L373-Y402 HydrophobicContact CD2-CD1 3.98Å; L373-Y402 HydrophobicContact CD2-CG 4.49Å; L373-E405 HydrophobicContact CD1-CB 4.22Å; L373-E405 HydrophobicContact CD1-CG 3.89Å; L373-E405 HydrophobicContact CD2-CB 3.97Å; L373-E405 HydrophobicContact CD2-CG 4.07Å; L373-Y406 HydrophobicContact CB-CD2 3.9Å; L373-Y406 HydrophobicContact CD1-CD2 4.47Å
374V93.8Very high89.7Confident7 Ų737.3 Ų37.34%0.04220%0.204CC..Hα-helixtrans-57.6-46.5176170.80000110.9A316 K370 E371 N378 Y406 N477 F478A316-V374 HydrophobicContact CB-CG1 4.44Å; K370-V374 WeakPolarHBondContact O-CG2 3.43Å; K370-V374 PolarHBondContact O-N 2.97Å; E371-V374 PolarHBondContact O-N 3.14Å; V374-N378 WeakPolarHBondContact CG1-ND2 3.5Å; V374-N378 WeakPolarHBondContact O-CB 3.49Å; V374-N378 PolarHBondContact O-N 3.05Å; V374-N378 VanDerWaalsContact O-N 3.1Å; V374-N378 PolarHBondContact O-ND2 3.44Å; V374-Y406 HydrophobicContact CG2-CD2 4.12Å; V374-Y406 HydrophobicContact CG2-CE2 3.41Å; V374-Y406 VanDerWaalsContact CG2-CE2 3.41Å; V374-N477 HydrophobicContact CG1-CB 4.01Å; V374-N477 WeakPolarHBondContact CG1-O 3.45Å; V374-N477 HydrophobicContact CG2-CB 3.97Å; V374-F478 HydrophobicContact CG2-CE1 4.43Å; V374-F478 HydrophobicContact CG2-CZ 4.39Å
375F94.2Very high88.6Confident0 Ų038.1 Ų38.10%020%0.198CC..Hα-helixtrans-61.4-48.9177.5171.6-100.3000112F314 G315 L319 M359 I362 V363 L366 E371 R372 L373 N378 N379F314-F375 HydrophobicContact CD1-CE2 4.38Å; G315-F375 WeakPolarHBondContact O-CA 3.48Å; L319-F375 HydrophobicContact CD1-CE2 3.81Å; L319-F375 HydrophobicContact CD1-CZ 3.71Å; L319-F375 HydrophobicContact CD2-CE2 4.24Å; L319-F375 HydrophobicContact CG-CE2 3.89Å; L319-F375 HydrophobicContact CG-CZ 4.29Å; M359-F375 HydrophobicContact CE-CD1 4.04Å; M359-F375 HydrophobicContact CE-CE1 3.26Å; M359-F375 HydrophobicContact CE-CZ 3.63Å; M359-F375 HydrophobicContact SD-CE1 3.8Å; M359-F375 HydrophobicContact SD-CZ 3.72Å; I362-F375 HydrophobicContact CB-CE1 4.07Å; I362-F375 HydrophobicContact CB-CZ 3.94Å; I362-F375 HydrophobicContact CD1-CZ 4.01Å; I362-F375 HydrophobicContact CG2-CD1 4.34Å; I362-F375 HydrophobicContact CG2-CD2 4.42Å; I362-F375 HydrophobicContact CG2-CE1 3.71Å; I362-F375 HydrophobicContact CG2-CE2 3.8Å; I362-F375 HydrophobicContact CG2-CZ 3.42Å; I362-F375 VanDerWaalsContact CG2-CZ 3.42Å; V363-F375 HydrophobicContact CG2-CD1 3.9Å; V363-F375 HydrophobicContact CG2-CE1 4.12Å; L366-F375 HydrophobicContact CD1-CB 3.71Å; L366-F375 HydrophobicContact CD1-CD1 4.24Å; L366-F375 HydrophobicContact CD1-CG 3.99Å; E371-F375 WeakPolarHBondContact O-CB 3.41Å; E371-F375 PolarHBondContact O-N 3.43Å; R372-F375 PolarHBondContact O-N 2.97Å; L373-F375 VanDerWaalsContact C-N 3.31Å; L373-F375 PolarHBondContact O-N 3.43Å; F375-N378 PolarHBondContact O-N 2.93Å; F375-N379 VanDerWaalsContact CD2-ND2 3.33Å; F375-N379 WeakPolarHBondContact CD2-ND2 3.38Å; F375-N379 WeakPolarHBondContact CE2-ND2 3.19Å; F375-N379 PolarHBondContact O-N 2.92Å; F375-N379 PolarHBondContact O-ND2 3.48Å
376L93.5Very high87.5Confident17 Ų1735.4 Ų35.49%0.08919%0.189CC..Hα-helixtrans-61.6-48.9-179.7-72.9164.2000111.5M359 V363 R372 L373 N378 N379 Y380 Y402M359-L376 HydrophobicContact CE-CD2 4.14Å; V363-L376 HydrophobicContact CG2-CD1 4.07Å; V363-L376 HydrophobicContact CG2-CD2 3.83Å; V363-L376 HydrophobicContact CG2-CG 3.88Å; R372-L376 WeakPolarHBondContact O-CB 3.19Å; R372-L376 WeakPolarHBondContact O-CD1 3.25Å; R372-L376 VanDerWaalsContact O-CG 3.25Å; R372-L376 WeakPolarHBondContact O-CG 3.48Å; R372-L376 PolarHBondContact O-N 2.94Å; L373-L376 PolarHBondContact O-N 2.78Å; L376-N378 PolarHBondContact O-N 2.75Å; L376-N379 PolarHBondContact O-N 3.41Å; L376-Y380 HydrophobicContact CB-CD2 4.31Å; L376-Y380 HydrophobicContact CD2-CD2 4.32Å; L376-Y380 HydrophobicContact CD2-CE2 3.75Å; L376-Y380 WeakPolarHBondContact O-CB 3.33Å; L376-Y380 VanDerWaalsContact O-CD2 3.24Å; L376-Y380 WeakPolarHBondContact O-CD2 3.25Å; L376-Y380 PolarHBondContact O-N 2.99Å; L376-Y402 HydrophobicContact CB-CD2 4.04Å; L376-Y402 HydrophobicContact CB-CE2 4.24Å; L376-Y402 HydrophobicContact CB-CG 4.27Å; L376-Y402 HydrophobicContact CD1-CD1 4.14Å; L376-Y402 HydrophobicContact CD1-CE1 3.85Å; L376-Y402 HydrophobicContact CD1-CE2 4.47Å; L376-Y402 HydrophobicContact CD2-CE2 4.47Å
377I93.5Very high86Confident0 Ų035.4 Ų35.40%019%0.192CC..Hα-helixtrans-58.3-48.2-179.8-68.6165.4000110.9L373 N379 D381 L399 V403 Y406 F478 I483 V487L373-I377 WeakPolarHBondContact O-CB 3.43Å; L373-I377 WeakPolarHBondContact O-CD1 3.48Å; L373-I377 WeakPolarHBondContact O-CG1 3.39Å; L373-I377 PolarHBondContact O-N 3.49Å; I377-N379 VanDerWaalsContact C-N 3.3Å; I377-N379 PolarHBondContact O-N 2.92Å; I377-D381 WeakPolarHBondContact O-CB 3.49Å; I377-D381 PolarHBondContact O-N 2.92Å; I377-L399 HydrophobicContact CB-CD1 4.26Å; I377-L399 HydrophobicContact CG1-CD1 4.46Å; I377-L399 HydrophobicContact CG2-CD1 3.94Å; I377-L399 WeakPolarHBondContact O-CD1 3.37Å; I377-V403 HydrophobicContact CD1-CG2 4.1Å; I377-V403 HydrophobicContact CG1-CG2 4.06Å; I377-V403 HydrophobicContact CG2-CG2 4.1Å; I377-Y406 HydrophobicContact CD1-CG 4.13Å; I377-F478 HydrophobicContact CB-CD1 4.4Å; I377-F478 HydrophobicContact CB-CE1 3.83Å; I377-F478 HydrophobicContact CD1-CE1 3.86Å; I377-F478 HydrophobicContact CD1-CZ 4.07Å; I377-F478 HydrophobicContact CG1-CE1 4.47Å; I377-F478 HydrophobicContact CG2-CD1 3.82Å; I377-F478 HydrophobicContact CG2-CE1 3.53Å; I377-F478 HydrophobicContact CG2-CZ 4.47Å; I377-I483 HydrophobicContact CG2-CD1 3.92Å; I377-I483 HydrophobicContact CG2-CG1 3.66Å; I377-V487 HydrophobicContact CG2-CG2 4.3Å
378N92Very high84.5Confident0 Ų038.8 Ų38.80%020%0.203CC..Hα-helixtrans-63.1-34.6-178.4-82.9-50000112.9A316 P318 V374 F375 L376 N477 F478 S479A316-N378 WeakPolarHBondContact CA-ND2 3.31Å; A316-N378 VanDerWaalsContact O-CG 3.24Å; A316-N378 PolarHBondContact O-ND2 2.9Å; P318-N378 HydrophobicContact CG-CB 4.09Å; P318-N378 WeakPolarHBondContact CG-O 3.24Å; V374-N378 WeakPolarHBondContact CG1-ND2 3.5Å; V374-N378 WeakPolarHBondContact O-CB 3.49Å; V374-N378 PolarHBondContact O-N 3.05Å; V374-N378 VanDerWaalsContact O-N 3.1Å; V374-N378 PolarHBondContact O-ND2 3.44Å; F375-N378 PolarHBondContact O-N 2.93Å; L376-N378 PolarHBondContact O-N 2.75Å; N378-N477 PolarHBondContact ND2-O 3.48Å; N378-F478 WeakPolarHBondContact OD1-CA 3.28Å; N378-S479 PolarHBondContact OD1-N 2.96Å; N378-S479 PolarHBondContact OD1-OG 3.12Å; N378-S479 VanDerWaalsContact OD1-OG 3.12Å
379N90.5Very high82.8Confident0 Ų039.6 Ų39.60%020%0.203CC..Hα-helixtrans-80.9-44.2179.6-76.2-76.7000112.4P318 L319 V322 M359 F375 L376 I377 D381 I382 E383P318-N379 WeakPolarHBondContact CA-OD1 3.43Å; L319-N379 PolarHBondContact N-OD1 3.42Å; V322-N379 HydrophobicContact CG1-CB 4.13Å; V322-N379 WeakPolarHBondContact CG1-O 3.28Å; V322-N379 HydrophobicContact CG2-CB 4.22Å; V322-N379 WeakPolarHBondContact CG2-OD1 3.47Å; M359-N379 HydrophobicContact CE-CB 3.48Å; M359-N379 VanDerWaalsContact CE-CB 3.48Å; M359-N379 HydrophobicContact SD-CB 4.44Å; F375-N379 VanDerWaalsContact CD2-ND2 3.33Å; F375-N379 WeakPolarHBondContact CD2-ND2 3.38Å; F375-N379 WeakPolarHBondContact CE2-ND2 3.19Å; F375-N379 PolarHBondContact O-N 2.92Å; F375-N379 PolarHBondContact O-ND2 3.48Å; L376-N379 PolarHBondContact O-N 3.41Å; I377-N379 VanDerWaalsContact C-N 3.3Å; I377-N379 PolarHBondContact O-N 2.92Å; N379-D381 VanDerWaalsContact C-N 3.28Å; N379-D381 PolarHBondContact O-N 3.41Å; N379-I382 WeakPolarHBondContact O-CB 3.34Å; N379-I382 PolarHBondContact O-N 2.95Å; N379-I382 VanDerWaalsContact O-N 3.16Å; N379-E383 PolarHBondContact O-N 3.29Å
380Y89.1Confident81Confident15 Ų1541.8 Ų41.86%0.05921%0.214CC..Hα-helixtrans-67.6-26.1176.8-79.4-69.4000113.2L376 I382 E383 R384 Y402L376-Y380 HydrophobicContact CB-CD2 4.31Å; L376-Y380 HydrophobicContact CD2-CD2 4.32Å; L376-Y380 HydrophobicContact CD2-CE2 3.75Å; L376-Y380 WeakPolarHBondContact O-CB 3.33Å; L376-Y380 VanDerWaalsContact O-CD2 3.24Å; L376-Y380 WeakPolarHBondContact O-CD2 3.25Å; L376-Y380 PolarHBondContact O-N 2.99Å; Y380-I382 VanDerWaalsContact C-N 3.31Å; Y380-I382 PolarHBondContact O-N 3.1Å; Y380-E383 WeakPolarHBondContact CD1-OE2 3.24Å; Y380-E383 PolarHBondContact O-N 3.5Å; Y380-R384 PolarHBondContact O-N 2.87Å; Y380-Y402 AromaticContact CD2-CD2 3.98Å; Y380-Y402 HydrophobicContact CD2-CD2 3.98Å; Y380-Y402 AromaticContact CD2-CE2 3.66Å; Y380-Y402 HydrophobicContact CD2-CE2 3.66Å; Y380-Y402 HydrophobicContact CE2-CD2 4.25Å; Y380-Y402 AromaticContact CE2-CE2 3.47Å; Y380-Y402 HydrophobicContact CE2-CE2 3.47Å; Y380-Y402 VanDerWaalsContact CE2-CE2 3.47Å
381D86.9Confident79.2Confident2 Ų243.4 Ų43.41%0.01122%0.222CC..Hα-helixtrans-64.7-35.2172.3-170.760.4000112I377 N379 R384 L385 L399 N480 I483I377-D381 WeakPolarHBondContact O-CB 3.49Å; I377-D381 PolarHBondContact O-N 2.92Å; N379-D381 VanDerWaalsContact C-N 3.28Å; N379-D381 PolarHBondContact O-N 3.41Å; D381-R384 WeakPolarHBondContact O-CB 3.17Å; D381-R384 PolarHBondContact O-N 3.33Å; D381-L385 WeakPolarHBondContact O-CG 3.49Å; D381-L385 PolarHBondContact O-N 3.34Å; D381-L399 HydrophobicContact CB-CD2 4.33Å; D381-N480 PolarHBondContact OD2-ND2 3.45Å; D381-I483 HydrophobicContact CB-CB 4.47Å; D381-I483 HydrophobicContact CB-CD1 4.34Å; D381-I483 HydrophobicContact CB-CG1 4.22Å
382I81.2Confident77.7Confident29 Ų2941.1 Ų41.115%0.14922%0.215CC..Hα-helixtrans-66.8-42.9174.8-70.1-161.7000111.8P318 R323 N379 Y380 R384 L385 S386P318-I382 HydrophobicContact CB-CD1 3.16Å; P318-I382 HydrophobicContact CB-CG1 3.91Å; P318-I382 HydrophobicContact CG-CD1 3.59Å; P318-I382 HydrophobicContact CG-CG1 4.07Å; R323-I382 HydrophobicContact CB-CD1 4.47Å; R323-I382 HydrophobicContact CB-CG2 3.79Å; R323-I382 HydrophobicContact CG-CG2 4.09Å; N379-I382 WeakPolarHBondContact O-CB 3.34Å; N379-I382 PolarHBondContact O-N 2.95Å; N379-I382 VanDerWaalsContact O-N 3.16Å; Y380-I382 VanDerWaalsContact C-N 3.31Å; Y380-I382 PolarHBondContact O-N 3.1Å; I382-R384 PolarHBondContact O-N 2.9Å; I382-L385 PolarHBondContact O-N 2.88Å; I382-L385 VanDerWaalsContact O-N 3.12Å; I382-S386 PolarHBondContact O-N 2.98Å; I382-S386 PolarHBondContact O-OG 2.92Å; I382-S386 VanDerWaalsContact O-OG 3.09Å
383E74.4Confident76.5Confident25 Ų2542.7 Ų42.712%0.11723%0.226CC..Hα-helixtrans-55-44.1177-71.4-179.5-164.700111.1V322 A326 L355 N379 Y380 L385 S386V322-E383 HydrophobicContact CG1-CG 3.94Å; A326-E383 HydrophobicContact CB-CB 4.43Å; A326-E383 HydrophobicContact CB-CG 4.22Å; L355-E383 WeakPolarHBondContact CD2-OE1 3.34Å; N379-E383 PolarHBondContact O-N 3.29Å; Y380-E383 WeakPolarHBondContact CD1-OE2 3.24Å; Y380-E383 PolarHBondContact O-N 3.5Å; E383-L385 PolarHBondContact O-N 3.37Å; E383-S386 PolarHBondContact O-N 3.03Å
384R72.2Confident75.6Confident69 Ų6946.7 Ų46.726%0.2625%0.245SC..Hα-helixtrans-61.3-41.5177.2-177.7-168174.3-173.13.2113Y380 D381 I382 S386Y380-R384 PolarHBondContact O-N 2.87Å; D381-R384 WeakPolarHBondContact O-CB 3.17Å; D381-R384 PolarHBondContact O-N 3.33Å; I382-R384 PolarHBondContact O-N 2.9Å; R384-S386 PolarHBondContact O-N 3.08Å
385L69.4Low74.8Confident93 Ų9347.4 Ų47.449%0.48725%0.25SS..Hα-helixtrans-68.3-19.4-177.8-71.1172.1000113.2D381 I382 E383 R482D381-L385 WeakPolarHBondContact O-CG 3.49Å; D381-L385 PolarHBondContact O-N 3.34Å; I382-L385 PolarHBondContact O-N 2.88Å; I382-L385 VanDerWaalsContact O-N 3.12Å; E383-L385 PolarHBondContact O-N 3.37Å; L385-R482 VanDerWaalsContact CD2-NH1 3.34Å
386S68.7Low74.2Confident36 Ų3650.5 Ų50.525%0.25227%0.265SS..THydrogen-bonded Turntrans-92.8-10.2-175.3-50.20000113.3A326 A330 I382 E383 R384A326-S386 WeakPolarHBondContact CB-OG 3.26Å; A330-S386 WeakPolarHBondContact CB-O 3.42Å; I382-S386 PolarHBondContact O-N 2.98Å; I382-S386 PolarHBondContact O-OG 2.92Å; I382-S386 VanDerWaalsContact O-OG 3.09Å; E383-S386 PolarHBondContact O-N 3.03Å; R384-S386 PolarHBondContact O-N 3.08Å
387G60.5Low74Confident15 Ų1555.3 Ų55.316%0.15529%0.285CS..  trans-136.4125.3-172.900000115.1S392G387-S392 PolarHBondContact O-OG 2.74Å
388D57.3Low73.7Confident174 Ų17458.3 Ų58.393%0.9330%0.296SS*.  trans-92.915.8174.3-76.7-27.5000113.8
389L56.2Low73.7Confident57 Ų5758.4 Ų58.430%0.29830%0.297SS..SBendtrans-107.7168-167.9-67.3172.1000115.1M333 T337 E391 S392M333-L389 HydrophobicContact CB-CD1 3.63Å; T337-L389 HydrophobicContact CG2-CD2 4.46Å; L389-E391 VanDerWaalsContact C-N 3.32Å; L389-E391 PolarHBondContact O-N 3.02Å; L389-S392 WeakPolarHBondContact O-CA 3.48Å; L389-S392 WeakPolarHBondContact O-CB 3.31Å; L389-S392 PolarHBondContact O-N 3.33Å
390V53.3Low73.8Confident113 Ų11360.8 Ų60.869%0.68531%0.308SS*.THydrogen-bonded Turntrans-54.3-36.6-175.1177.60000114.2S392 Q393V390-S392 PolarHBondContact O-N 3.29Å; V390-Q393 WeakPolarHBondContact O-CB 3.42Å; V390-Q393 WeakPolarHBondContact O-CG 3.44Å; V390-Q393 PolarHBondContact O-N 3.05Å
391E54.5Low74Confident85 Ų8562.6 Ų62.640%0.39733%0.326SS..THydrogen-bonded Turntrans-65.1-21.4175-77177.1175.900113.2F329 M333 L389 Q393 E394 S395F329-E391 WeakPolarHBondContact CE1-OE2 3.49Å; F329-E391 WeakPolarHBondContact CZ-OE2 3.39Å; M333-E391 HydrophobicContact CE-CG 4.04Å; M333-E391 WeakPolarHBondContact CE-OE2 3.39Å; L389-E391 VanDerWaalsContact C-N 3.32Å; L389-E391 PolarHBondContact O-N 3.02Å; E391-Q393 PolarHBondContact O-N 3.47Å; E391-Q393 VanDerWaalsContact O-N 3.08Å; E391-E394 PolarHBondContact O-N 3.36Å; E391-S395 PolarHBondContact O-N 2.98Å
392S61.2Low74.4Confident33 Ų3365.3 Ų65.323%0.23134%0.336CS..Hα-helixtrans-55.4-25.5167.6-165.40000111.1G387 L389 V390 H396G387-S392 PolarHBondContact O-OG 2.74Å; L389-S392 WeakPolarHBondContact O-CA 3.48Å; L389-S392 WeakPolarHBondContact O-CB 3.31Å; L389-S392 PolarHBondContact O-N 3.33Å; V390-S392 PolarHBondContact O-N 3.29Å; S392-H396 WeakPolarHBondContact O-CA 3.19Å; S392-H396 WeakPolarHBondContact O-CB 2.95Å; S392-H396 PolarHBondContact O-N 3.49Å
393Q68.9Low75.1Confident122 Ų12263.9 Ų63.957%0.5733%0.329SS*.Hα-helixtrans-66.5-39.1175.5-64.2-171.2-1200113.2V390 E391 H396 K397V390-Q393 WeakPolarHBondContact O-CB 3.42Å; V390-Q393 WeakPolarHBondContact O-CG 3.44Å; V390-Q393 PolarHBondContact O-N 3.05Å; E391-Q393 PolarHBondContact O-N 3.47Å; E391-Q393 VanDerWaalsContact O-N 3.08Å; Q393-H396 PolarHBondContact O-N 2.89Å; Q393-K397 VanDerWaalsContact O-CG 3.31Å; Q393-K397 WeakPolarHBondContact O-CG 3.33Å; Q393-K397 PolarHBondContact O-N 3.39Å
394E76.8Confident76.1Confident88 Ų8865.3 Ų65.341%0.41134%0.338SS..Hα-helixtrans-76.9-45-177.3-166.956.4-147.500111E391 H396 K397 R398E391-E394 PolarHBondContact O-N 3.36Å; E394-H396 PolarHBondContact O-N 2.91Å; E394-K397 PolarHBondContact O-N 3.31Å; E394-K397 VanDerWaalsContact O-N 3.16Å; E394-K397 WeakPolarHBondContact OE2-CD 3.22Å; E394-K397 IonicContact OE2-NZ 3.87Å; E394-K397 PolarHBondContact OE2-NZ 2.88Å; E394-R398 WeakPolarHBondContact O-CG 3.33Å; E394-R398 PolarHBondContact O-N 3.15Å
395S76.5Confident77.3Confident22 Ų2266.3 Ų66.315%0.15435%0.345CS..Hα-helixtrans-59.2-37.1170.3-62.60000111.5E391 R398 L399E391-S395 PolarHBondContact O-N 2.98Å; S395-R398 PolarHBondContact O-N 3.26Å; S395-L399 WeakPolarHBondContact O-CB 3.36Å; S395-L399 PolarHBondContact O-N 3.2Å
396H83Confident78.5Confident65 Ų6561.9 Ų61.930%0.30132%0.322SS..Hα-helixtrans-64.8-41.1175.1-177.661.5000112.9S392 Q393 E394 L399 Q400S392-H396 WeakPolarHBondContact O-CA 3.19Å; S392-H396 WeakPolarHBondContact O-CB 2.95Å; S392-H396 PolarHBondContact O-N 3.49Å; Q393-H396 PolarHBondContact O-N 2.89Å; E394-H396 PolarHBondContact O-N 2.91Å; H396-L399 PolarHBondContact O-N 3.46Å; H396-Q400 WeakPolarHBondContact O-CB 3.14Å; H396-Q400 PolarHBondContact O-N 2.9Å
397K87.5Confident79.8Confident119 Ų11960.2 Ų60.252%0.51731%0.31SS..Hα-helixtrans-62.4-44173.5-72.5171.5-161.5161.50111.5Q393 E394 Q400 A401Q393-K397 VanDerWaalsContact O-CG 3.31Å; Q393-K397 WeakPolarHBondContact O-CG 3.33Å; Q393-K397 PolarHBondContact O-N 3.39Å; E394-K397 PolarHBondContact O-N 3.31Å; E394-K397 VanDerWaalsContact O-N 3.16Å; E394-K397 WeakPolarHBondContact OE2-CD 3.22Å; E394-K397 IonicContact OE2-NZ 3.87Å; E394-K397 PolarHBondContact OE2-NZ 2.88Å; K397-Q400 PolarHBondContact O-N 3.36Å; K397-A401 WeakPolarHBondContact O-CB 3.43Å; K397-A401 PolarHBondContact O-N 2.93Å
398R88.2Confident81.4Confident63 Ų6362.2 Ų62.224%0.23832%0.318CS..Hα-helixtrans-59.6-49.2175.9-66.9-177.8-147.6170.98.4110.9E352 E394 S395 Q400 A401 Y402E352-R398 IonicContact OE1-CZ 3.89Å; E352-R398 IonicContact OE1-NH1 3.45Å; E352-R398 PolarHBondContact OE1-NH1 3.4Å; E352-R398 IonicContact OE1-NH2 3.58Å; E352-R398 PolarHBondContact OE1-NH2 2.95Å; E394-R398 WeakPolarHBondContact O-CG 3.33Å; E394-R398 PolarHBondContact O-N 3.15Å; S395-R398 PolarHBondContact O-N 3.26Å; R398-Q400 VanDerWaalsContact C-N 3.33Å; R398-Q400 PolarHBondContact O-N 2.85Å; R398-A401 WeakPolarHBondContact O-CB 3.43Å; R398-A401 PolarHBondContact O-N 3.47Å; R398-Y402 HydrophobicContact CB-CE2 4.22Å; R398-Y402 WeakPolarHBondContact O-CD2 3.46Å; R398-Y402 PolarHBondContact O-N 3.3Å
399L91Very high83.2Confident1 Ų156 Ų561%0.00529%0.286CS..Hα-helixtrans-55.1-48.9175.4177.160.6000111.1I377 D381 S395 H396 A401 Y402 V403 I483I377-L399 HydrophobicContact CB-CD1 4.26Å; I377-L399 HydrophobicContact CG1-CD1 4.46Å; I377-L399 HydrophobicContact CG2-CD1 3.94Å; I377-L399 WeakPolarHBondContact O-CD1 3.37Å; D381-L399 HydrophobicContact CB-CD2 4.33Å; S395-L399 WeakPolarHBondContact O-CB 3.36Å; S395-L399 PolarHBondContact O-N 3.2Å; H396-L399 PolarHBondContact O-N 3.46Å; L399-A401 VanDerWaalsContact C-N 3.31Å; L399-A401 PolarHBondContact O-N 3.25Å; L399-Y402 PolarHBondContact O-N 3.03Å; L399-V403 HydrophobicContact CD1-CG2 4.21Å; L399-V403 HydrophobicContact CG-CG2 4.44Å; L399-V403 VanDerWaalsContact O-CG2 3.26Å; L399-V403 WeakPolarHBondContact O-CG2 3.14Å; L399-V403 PolarHBondContact O-N 3.24Å; L399-I483 HydrophobicContact CD1-CD1 4.45Å
400Q92.7Very high85.1Confident50 Ų5053.3 Ų53.323%0.23427%0.272CS..Hα-helixtrans-64.4-35.8-179.6-170.459.444.200112.4H396 K397 R398 V403 N404H396-Q400 WeakPolarHBondContact O-CB 3.14Å; H396-Q400 PolarHBondContact O-N 2.9Å; K397-Q400 PolarHBondContact O-N 3.36Å; R398-Q400 VanDerWaalsContact C-N 3.33Å; R398-Q400 PolarHBondContact O-N 2.85Å; Q400-V403 PolarHBondContact O-N 3.46Å; Q400-N404 PolarHBondContact NE2-OD1 3.45Å; Q400-N404 PolarHBondContact O-N 2.9Å; Q400-N404 PolarHBondContact O-ND2 3.44Å
401A94.7Very high87.1Confident54 Ų5448 Ų4845%0.44624%0.239SC..Hα-helixtrans-61.9-46.4174.100000111.6K397 R398 L399 V403 N404 E405K397-A401 WeakPolarHBondContact O-CB 3.43Å; K397-A401 PolarHBondContact O-N 2.93Å; R398-A401 WeakPolarHBondContact O-CB 3.43Å; R398-A401 PolarHBondContact O-N 3.47Å; L399-A401 VanDerWaalsContact C-N 3.31Å; L399-A401 PolarHBondContact O-N 3.25Å; A401-V403 PolarHBondContact O-N 2.97Å; A401-N404 WeakPolarHBondContact O-CB 3.21Å; A401-N404 PolarHBondContact O-N 2.86Å; A401-E405 PolarHBondContact O-N 3.17Å
402Y94.7Very high89Confident58 Ų5847 Ų4723%0.22724%0.242CC..Hα-helixtrans-65.3-38175.9-60.6-49000112.6L373 L376 Y380 R398 L399 N404 E405 Y406L373-Y402 HydrophobicContact CD2-CD1 3.98Å; L373-Y402 HydrophobicContact CD2-CG 4.49Å; L376-Y402 HydrophobicContact CB-CD2 4.04Å; L376-Y402 HydrophobicContact CB-CE2 4.24Å; L376-Y402 HydrophobicContact CB-CG 4.27Å; L376-Y402 HydrophobicContact CD1-CD1 4.14Å; L376-Y402 HydrophobicContact CD1-CE1 3.85Å; L376-Y402 HydrophobicContact CD1-CE2 4.47Å; L376-Y402 HydrophobicContact CD2-CE2 4.47Å; Y380-Y402 AromaticContact CD2-CD2 3.98Å; Y380-Y402 HydrophobicContact CD2-CD2 3.98Å; Y380-Y402 AromaticContact CD2-CE2 3.66Å; Y380-Y402 HydrophobicContact CD2-CE2 3.66Å; Y380-Y402 HydrophobicContact CE2-CD2 4.25Å; Y380-Y402 AromaticContact CE2-CE2 3.47Å; Y380-Y402 HydrophobicContact CE2-CE2 3.47Å; Y380-Y402 VanDerWaalsContact CE2-CE2 3.47Å; R398-Y402 HydrophobicContact CB-CE2 4.22Å; R398-Y402 WeakPolarHBondContact O-CD2 3.46Å; R398-Y402 PolarHBondContact O-N 3.3Å; L399-Y402 PolarHBondContact O-N 3.03Å; Y402-N404 VanDerWaalsContact C-N 3.29Å; Y402-N404 PolarHBondContact O-N 3.46Å; Y402-E405 PolarHBondContact O-N 3.3Å; Y402-Y406 WeakPolarHBondContact O-CB 3.24Å; Y402-Y406 PolarHBondContact O-N 3.18Å
403V95.2Very high90.5Very high0 Ų050.5 Ų50.50%026%0.258CS..Hα-helixtrans-62.5-37.6174.9170.30000111.2I377 L399 Q400 A401 A407 I483 V487 N490I377-V403 HydrophobicContact CD1-CG2 4.1Å; I377-V403 HydrophobicContact CG1-CG2 4.06Å; I377-V403 HydrophobicContact CG2-CG2 4.1Å; L399-V403 HydrophobicContact CD1-CG2 4.21Å; L399-V403 HydrophobicContact CG-CG2 4.44Å; L399-V403 VanDerWaalsContact O-CG2 3.26Å; L399-V403 WeakPolarHBondContact O-CG2 3.14Å; L399-V403 PolarHBondContact O-N 3.24Å; Q400-V403 PolarHBondContact O-N 3.46Å; A401-V403 PolarHBondContact O-N 2.97Å; V403-A407 WeakPolarHBondContact O-CB 3.31Å; V403-A407 PolarHBondContact O-N 3.35Å; V403-I483 HydrophobicContact CG2-CD1 4.48Å; V403-V487 HydrophobicContact CG1-CG2 4.06Å; V403-V487 HydrophobicContact CG2-CG2 4.01Å; V403-N490 HydrophobicContact CG1-CB 3.91Å; V403-N490 PolarHBondContact O-ND2 3.24Å
404N96.3Very high91.7Very high55 Ų5547 Ų4729%0.29424%0.241SC..Hα-helixtrans-67-47174.5-69.2-22.9000111.7Q400 A401 Y402 Y406 A407 D408 N490Q400-N404 PolarHBondContact NE2-OD1 3.45Å; Q400-N404 PolarHBondContact O-N 2.9Å; Q400-N404 PolarHBondContact O-ND2 3.44Å; A401-N404 WeakPolarHBondContact O-CB 3.21Å; A401-N404 PolarHBondContact O-N 2.86Å; Y402-N404 VanDerWaalsContact C-N 3.29Å; Y402-N404 PolarHBondContact O-N 3.46Å; N404-Y406 VanDerWaalsContact C-N 3.31Å; N404-Y406 PolarHBondContact O-N 3.15Å; N404-A407 WeakPolarHBondContact O-CB 3.37Å; N404-A407 PolarHBondContact O-N 3.09Å; N404-D408 PolarHBondContact O-N 3.23Å; N404-N490 PolarHBondContact OD1-ND2 3.1Å; N404-N490 PolarHBondContact OD1-OD1 3.47Å
405E96.1Very high92.6Very high90 Ų9043.4 Ų43.442%0.42122%0.224SC..Hα-helixtrans-63.9-36.7179.3-167.7-176.3157.800112.3L373 A401 Y402 D408 T409L373-E405 HydrophobicContact CD1-CB 4.22Å; L373-E405 HydrophobicContact CD1-CG 3.89Å; L373-E405 HydrophobicContact CD2-CB 3.97Å; L373-E405 HydrophobicContact CD2-CG 4.07Å; A401-E405 PolarHBondContact O-N 3.17Å; Y402-E405 PolarHBondContact O-N 3.3Å; E405-D408 PolarHBondContact O-N 2.73Å; E405-T409 WeakPolarHBondContact O-CB 3.36Å; E405-T409 PolarHBondContact O-N 3.38Å; E405-T409 PolarHBondContact O-OG1 3.11Å
406Y96.3Very high93.4Very high0 Ų043 Ų430%022%0.223CC..Hα-helixtrans-67.3-42.7174.2-175.4-97.5000111.7K370 L373 V374 I377 Y402 N404 T409 L410 E473 V474 N477 F478 V487K370-Y406 HydrophobicContact CG-CD2 4.42Å; K370-Y406 HydrophobicContact CG-CE2 3.75Å; L373-Y406 HydrophobicContact CB-CD2 3.9Å; L373-Y406 HydrophobicContact CD1-CD2 4.47Å; V374-Y406 HydrophobicContact CG2-CD2 4.12Å; V374-Y406 HydrophobicContact CG2-CE2 3.41Å; V374-Y406 VanDerWaalsContact CG2-CE2 3.41Å; I377-Y406 HydrophobicContact CD1-CG 4.13Å; Y402-Y406 WeakPolarHBondContact O-CB 3.24Å; Y402-Y406 PolarHBondContact O-N 3.18Å; N404-Y406 VanDerWaalsContact C-N 3.31Å; N404-Y406 PolarHBondContact O-N 3.15Å; Y406-T409 WeakPolarHBondContact O-CB 3.3Å; Y406-T409 PolarHBondContact O-N 3.48Å; Y406-L410 HydrophobicContact CD1-CD1 4.06Å; Y406-L410 HydrophobicContact CD1-CG 4.16Å; Y406-L410 HydrophobicContact CE1-CD1 3.4Å; Y406-L410 HydrophobicContact CE1-CD2 4.19Å; Y406-L410 HydrophobicContact CE1-CG 3.73Å; Y406-L410 PolarHBondContact O-N 3.42Å; Y406-E473 PolarHBondContact OH-OE1 3.18Å; Y406-E473 VanDerWaalsContact OH-OE1 3.12Å; Y406-V474 HydrophobicContact CE1-CG2 4.32Å; Y406-N477 PolarHBondContact OH-ND2 2.94Å; Y406-F478 HydrophobicContact CD1-CE2 4.19Å; Y406-F478 AromaticContact CD1-CZ 3.77Å; Y406-F478 HydrophobicContact CD1-CZ 3.77Å; Y406-F478 AromaticContact CE1-CE2 3.61Å; Y406-F478 HydrophobicContact CE1-CE2 3.61Å; Y406-F478 AromaticContact CE1-CZ 3.52Å; Y406-F478 HydrophobicContact CE1-CZ 3.52Å; Y406-F478 HydrophobicContact CE2-CZ 4.31Å; Y406-F478 HydrophobicContact CG-CZ 4.25Å; Y406-F478 AromaticContact CZ-CZ 3.83Å; Y406-V487 HydrophobicContact CD1-CG1 3.6Å; Y406-V487 HydrophobicContact CE1-CG1 3.86Å
407A95.3Very high93.8Very high0 Ų044.3 Ų44.30%023%0.23CC..Hα-helixtrans-59.4-46.2174.300000111.4V403 N404 T409 L410 L411 C491 Q494V403-A407 WeakPolarHBondContact O-CB 3.31Å; V403-A407 PolarHBondContact O-N 3.35Å; N404-A407 WeakPolarHBondContact O-CB 3.37Å; N404-A407 PolarHBondContact O-N 3.09Å; A407-T409 VanDerWaalsContact C-N 3.27Å; A407-T409 PolarHBondContact O-N 3.26Å; A407-L410 PolarHBondContact O-N 3.39Å; A407-L410 VanDerWaalsContact O-N 3.17Å; A407-L411 WeakPolarHBondContact O-CB 3.48Å; A407-L411 VanDerWaalsContact O-CG 3.29Å; A407-L411 WeakPolarHBondContact O-CG 3.33Å; A407-L411 PolarHBondContact O-N 2.97Å; A407-C491 HydrophobicContact CB-CB 4.01Å; A407-Q494 VanDerWaalsContact CB-OE1 3.23Å
408D94.9Very high94Very high58 Ų5838.8 Ų38.831%0.3121%0.206SC..Hα-helixtrans-60.7-37175.2-78.2-43.3000112.3N404 E405 S412 Q494 Y498N404-D408 PolarHBondContact O-N 3.23Å; E405-D408 PolarHBondContact O-N 2.73Å; D408-S412 VanDerWaalsContact O-CB 3.23Å; D408-S412 WeakPolarHBondContact O-CB 3.47Å; D408-S412 PolarHBondContact O-N 2.64Å; D408-S412 PolarHBondContact O-OG 3.48Å; D408-Q494 PolarHBondContact OD1-OE1 3.1Å; D408-Y498 PolarHBondContact OD1-OH 3.23Å
409T94.7Very high94.2Very high43 Ų4336.3 Ų36.326%0.26420%0.198SC..Hα-helixtrans-63.1-45.3174.9-60.20000111.4K370 E405 Y406 A407 S412 L413K370-T409 HydrophobicContact CB-CG2 4.44Å; E405-T409 WeakPolarHBondContact O-CB 3.36Å; E405-T409 PolarHBondContact O-N 3.38Å; E405-T409 PolarHBondContact O-OG1 3.11Å; Y406-T409 WeakPolarHBondContact O-CB 3.3Å; Y406-T409 PolarHBondContact O-N 3.48Å; A407-T409 VanDerWaalsContact C-N 3.27Å; A407-T409 PolarHBondContact O-N 3.26Å; T409-S412 PolarHBondContact O-N 3Å; T409-L413 WeakPolarHBondContact O-CB 3.13Å; T409-L413 PolarHBondContact O-N 3.38Å
410L94.9Very high94.2Very high0 Ų043.9 Ų43.90%023%0.23CC..Hα-helixtrans-67.2-41.9177-67.7-167.5000112.6Y406 A407 S412 L413 H414 I470 E473 V474Y406-L410 HydrophobicContact CD1-CD1 4.06Å; Y406-L410 HydrophobicContact CD1-CG 4.16Å; Y406-L410 HydrophobicContact CE1-CD1 3.4Å; Y406-L410 HydrophobicContact CE1-CD2 4.19Å; Y406-L410 HydrophobicContact CE1-CG 3.73Å; Y406-L410 PolarHBondContact O-N 3.42Å; A407-L410 PolarHBondContact O-N 3.39Å; A407-L410 VanDerWaalsContact O-N 3.17Å; L410-S412 VanDerWaalsContact C-N 3.32Å; L410-L413 WeakPolarHBondContact O-CB 3.32Å; L410-L413 PolarHBondContact O-N 3.16Å; L410-H414 PolarHBondContact O-CD2 3.33Å; L410-H414 PolarHBondContact O-N 3.38Å; L410-I470 HydrophobicContact CD1-CG2 4.08Å; L410-E473 WeakPolarHBondContact CD2-OE1 3.48Å; L410-V474 HydrophobicContact CD1-CG2 3.7Å
411L95.2Very high94.1Very high1 Ų142.3 Ų42.31%0.00522%0.223CC..Hα-helixtrans-66.8-36.8177.7-66.8178.8000111.4A407 L413 F415 G416 V419 Q494 L495 Y498A407-L411 WeakPolarHBondContact O-CB 3.48Å; A407-L411 VanDerWaalsContact O-CG 3.29Å; A407-L411 WeakPolarHBondContact O-CG 3.33Å; A407-L411 PolarHBondContact O-N 2.97Å; L411-L413 VanDerWaalsContact C-N 3.28Å; L411-L413 PolarHBondContact O-N 2.92Å; L411-F415 HydrophobicContact CD2-CD2 3.92Å; L411-F415 CarbonylContact O-C 3.57Å; L411-F415 WeakPolarHBondContact O-CA 3.46Å; L411-F415 VanDerWaalsContact O-CB 3.32Å; L411-F415 WeakPolarHBondContact O-CB 3.25Å; L411-F415 PolarHBondContact O-N 3.44Å; L411-G416 PolarHBondContact O-N 2.72Å; L411-V419 HydrophobicContact CB-CG2 4.21Å; L411-Q494 HydrophobicContact CD1-CB 3.52Å; L411-L495 HydrophobicContact CD2-CB 3.82Å; L411-L495 HydrophobicContact CD2-CD1 4.15Å; L411-L495 HydrophobicContact CD2-CG 4.46Å; L411-Y498 HydrophobicContact CD1-CD2 3.86Å; L411-Y498 HydrophobicContact CD1-CE2 3.83Å
412S94.4Very high93.9Very high65 Ų6539.7 Ų39.746%0.45520%0.202SC..Hα-helixtrans-66.5-31.1173.4-62.60000112.5D408 T409 L410 G416D408-S412 VanDerWaalsContact O-CB 3.23Å; D408-S412 WeakPolarHBondContact O-CB 3.47Å; D408-S412 PolarHBondContact O-N 2.64Å; D408-S412 PolarHBondContact O-OG 3.48Å; T409-S412 PolarHBondContact O-N 3Å; L410-S412 VanDerWaalsContact C-N 3.32Å; S412-G416 WeakPolarHBondContact O-CA 3.39Å; S412-G416 PolarHBondContact O-N 3.48Å
413L94Very high93.7Very high107 Ų10741 Ų4156%0.5621%0.21SC*.Hα-helixtrans-75.3-50.6177.6-178.961.6000112.5T409 L410 L411T409-L413 WeakPolarHBondContact O-CB 3.13Å; T409-L413 PolarHBondContact O-N 3.38Å; L410-L413 WeakPolarHBondContact O-CB 3.32Å; L410-L413 PolarHBondContact O-N 3.16Å; L411-L413 VanDerWaalsContact C-N 3.28Å; L411-L413 PolarHBondContact O-N 2.92Å
414H94.3Very high93.3Very high48 Ų4844.3 Ų44.322%0.22223%0.225CC..Hα-helixtrans-94.9-23.1-172.6-68-76.9000114.2L410 I470 E473L410-H414 PolarHBondContact O-CD2 3.33Å; L410-H414 PolarHBondContact O-N 3.38Å; H414-I470 HydrophobicContact CB-CD1 3.93Å; H414-I470 HydrophobicContact CB-CG1 4.19Å; H414-I470 WeakPolarHBondContact CD2-CG1 3.33Å; H414-E473 IonicContact NE2-OE2 3.25Å
415F94.7Very high92.6Very high13 Ų1341.9 Ų41.96%0.05721%0.212CC..SBendtrans-129.928.3-178.4-65.1-76.3000111.6L411 E417 L418 V419 F459 W463 I467 I470 L495L411-F415 HydrophobicContact CD2-CD2 3.92Å; L411-F415 CarbonylContact O-C 3.57Å; L411-F415 WeakPolarHBondContact O-CA 3.46Å; L411-F415 VanDerWaalsContact O-CB 3.32Å; L411-F415 WeakPolarHBondContact O-CB 3.25Å; L411-F415 PolarHBondContact O-N 3.44Å; F415-E417 VanDerWaalsContact C-N 3.27Å; F415-E417 PolarHBondContact O-N 2.89Å; F415-L418 HydrophobicContact CB-CB 4.31Å; F415-L418 HydrophobicContact CB-CD2 4.4Å; F415-L418 WeakPolarHBondContact O-CA 3.45Å; F415-L418 VanDerWaalsContact O-CB 3.32Å; F415-L418 WeakPolarHBondContact O-CB 3.45Å; F415-L418 PolarHBondContact O-N 3.18Å; F415-V419 PolarHBondContact O-N 3.39Å; F415-F459 HydrophobicContact CD1-CD2 4.02Å; F415-F459 AromaticContact CD1-CE2 3.89Å; F415-F459 HydrophobicContact CD1-CE2 3.89Å; F415-F459 AromaticContact CE1-CD2 3.95Å; F415-F459 HydrophobicContact CE1-CD2 3.95Å; F415-F459 AromaticContact CE1-CE2 3.6Å; F415-F459 HydrophobicContact CE1-CE2 3.6Å; F415-W463 HydrophobicContact CE1-CB 4.09Å; F415-I467 HydrophobicContact CE2-CG1 4.44Å; F415-I467 HydrophobicContact CZ-CG1 4.1Å; F415-I470 HydrophobicContact CD2-CD1 4.09Å; F415-I470 HydrophobicContact CE2-CD1 3.69Å; F415-L495 HydrophobicContact CB-CD1 4.44Å; F415-L495 HydrophobicContact CD1-CD1 4.06Å; F415-L495 HydrophobicContact CD2-CD1 3.7Å; F415-L495 HydrophobicContact CD2-CD2 4.35Å; F415-L495 HydrophobicContact CE1-CD1 4.2Å; F415-L495 HydrophobicContact CE2-CD1 3.84Å; F415-L495 HydrophobicContact CE2-CD2 3.68Å; F415-L495 HydrophobicContact CE2-CG 4.41Å; F415-L495 HydrophobicContact CG-CD1 3.81Å; F415-L495 HydrophobicContact CZ-CD1 4.09Å; F415-L495 HydrophobicContact CZ-CD2 3.84Å
416G92.7Very high92Very high13 Ų1339 Ų3913%0.13420%0.199CC..Hα-helixtrans-57.1-34.2-174.700000114.7L411 S412 K420L411-G416 PolarHBondContact O-N 2.72Å; S412-G416 WeakPolarHBondContact O-CA 3.39Å; S412-G416 PolarHBondContact O-N 3.48Å; G416-K420 VanDerWaalsContact O-CB 3.31Å; G416-K420 WeakPolarHBondContact O-CB 2.77Å; G416-K420 WeakPolarHBondContact O-CG 3.43Å; G416-K420 PolarHBondContact O-N 2.99Å
417E91.1Very high91.4Very high92 Ų9241.4 Ų41.443%0.4322%0.215SC..Hα-helixtrans-62.7-43.2174.2-63.2-172.7172.400111.8F415 F421 H454 L455 S458F415-E417 VanDerWaalsContact C-N 3.27Å; F415-E417 PolarHBondContact O-N 2.89Å; E417-F421 WeakPolarHBondContact O-CB 3.19Å; E417-F421 PolarHBondContact O-N 2.92Å; E417-H454 IonicContact OE1-CE1 3.84Å; E417-H454 PolarHBondContact OE1-CE1 3.25Å; E417-H454 IonicContact OE1-ND1 2.81Å; E417-H454 IonicContact OE2-CE1 3.16Å; E417-H454 IonicContact OE2-ND1 3.49Å; E417-H454 PolarHBondContact OE2-ND1 3.06Å; E417-L455 HydrophobicContact CB-CD1 3.48Å; E417-L455 VanDerWaalsContact CB-CD1 3.48Å; E417-S458 PolarHBondContact OE2-OG 3.4Å
418L92.6Very high90.2Very high3 Ų343.2 Ų43.22%0.01622%0.223CC..Hα-helixtrans-63.7-50.8178172.866.8000110.2F415 K420 F421 V422 L455 F459 L495 L502F415-L418 HydrophobicContact CB-CB 4.31Å; F415-L418 HydrophobicContact CB-CD2 4.4Å; F415-L418 WeakPolarHBondContact O-CA 3.45Å; F415-L418 VanDerWaalsContact O-CB 3.32Å; F415-L418 WeakPolarHBondContact O-CB 3.45Å; F415-L418 PolarHBondContact O-N 3.18Å; L418-K420 PolarHBondContact O-N 3.16Å; L418-F421 PolarHBondContact O-N 2.9Å; L418-V422 HydrophobicContact CD1-CG2 4.06Å; L418-V422 WeakPolarHBondContact O-CB 3.36Å; L418-V422 WeakPolarHBondContact O-CG2 3.47Å; L418-V422 PolarHBondContact O-N 3.43Å; L418-L455 HydrophobicContact CB-CD1 4.16Å; L418-L455 HydrophobicContact CD1-CD2 4.39Å; L418-L455 VanDerWaalsContact N-CD1 3.32Å; L418-F459 HydrophobicContact CD2-CE2 4.35Å; L418-L495 HydrophobicContact CD2-CD1 3.97Å; L418-L502 HydrophobicContact CD1-CB 3.89Å; L418-L502 HydrophobicContact CD1-CD1 4.4Å; L418-L502 HydrophobicContact CD1-CD2 3.62Å; L418-L502 HydrophobicContact CD1-CG 4.16Å
419V92.6Very high88.9Confident12 Ų1243.2 Ų43.27%0.07323%0.225CC..Hα-helixtrans-59-49.3-179.5176.20000110.5L411 F415 H423 Y498L411-V419 HydrophobicContact CB-CG2 4.21Å; F415-V419 PolarHBondContact O-N 3.39Å; V419-H423 WeakPolarHBondContact CG1-ND1 3.48Å; V419-H423 PolarHBondContact O-N 3.29Å; V419-H423 VanDerWaalsContact O-N 3.12Å; V419-H423 PolarHBondContact O-ND1 3.47Å; V419-Y498 HydrophobicContact CG1-CE1 4.23Å; V419-Y498 HydrophobicContact CG2-CD2 4.45Å; V419-Y498 HydrophobicContact CG2-CE1 4.4Å; V419-Y498 HydrophobicContact CG2-CE2 4.34Å
420K91.9Very high87.5Confident159 Ų15948.8 Ų48.869%0.69125%0.248SC*.Hα-helixtrans-63.9-43.1179.9-71.9171.6-175.3176.90112.2G416 L418 H424G416-K420 VanDerWaalsContact O-CB 3.31Å; G416-K420 WeakPolarHBondContact O-CB 2.77Å; G416-K420 WeakPolarHBondContact O-CG 3.43Å; G416-K420 PolarHBondContact O-N 2.99Å; L418-K420 PolarHBondContact O-N 3.16Å; K420-H424 VanDerWaalsContact O-CB 3.23Å; K420-H424 WeakPolarHBondContact O-CB 3.36Å; K420-H424 PolarHBondContact O-N 3.29Å
421F90.3Very high86.1Confident17 Ų1754.9 Ų54.98%0.07528%0.277CS..Hα-helixtrans-64.5-46.2-179.7-178-93.7000111.9E417 L418 H424 C425 F448 N451 A452 L455 L502 V505 L506E417-F421 WeakPolarHBondContact O-CB 3.19Å; E417-F421 PolarHBondContact O-N 2.92Å; L418-F421 PolarHBondContact O-N 2.9Å; F421-H424 PolarHBondContact O-N 3.48Å; F421-C425 WeakPolarHBondContact O-CB 3.11Å; F421-C425 PolarHBondContact O-N 3.12Å; F421-C425 PolarHBondContact O-SG 3.5Å; F421-F448 HydrophobicContact CE2-CD1 4.43Å; F421-N451 HydrophobicContact CD2-CB 4.46Å; F421-N451 HydrophobicContact CE2-CB 4.47Å; F421-A452 HydrophobicContact CE2-CB 4.09Å; F421-A452 HydrophobicContact CZ-CB 3.82Å; F421-L455 HydrophobicContact CB-CD2 4.08Å; F421-L455 HydrophobicContact CD1-CD2 3.81Å; F421-L455 HydrophobicContact CE1-CD2 4.46Å; F421-L455 HydrophobicContact CG-CD2 3.95Å; F421-L502 HydrophobicContact CD1-CD1 3.57Å; F421-L502 HydrophobicContact CE1-CD1 3.61Å; F421-V505 HydrophobicContact CE1-CG1 4.1Å; F421-L506 HydrophobicContact CE1-CD2 4.4Å; F421-L506 HydrophobicContact CZ-CD2 4.47Å
422V89.9Confident84.3Confident0 Ų061.5 Ų61.50%031%0.312CS..Hα-helixtrans-61.6-50.6179170.70000111.1L418 H424 C425 E426 Y498 R501 L502L418-V422 HydrophobicContact CD1-CG2 4.06Å; L418-V422 WeakPolarHBondContact O-CB 3.36Å; L418-V422 WeakPolarHBondContact O-CG2 3.47Å; L418-V422 PolarHBondContact O-N 3.43Å; V422-H424 VanDerWaalsContact C-N 3.32Å; V422-H424 PolarHBondContact O-N 3.43Å; V422-C425 PolarHBondContact O-N 3.04Å; V422-E426 HydrophobicContact CG1-CG 4.37Å; V422-E426 WeakPolarHBondContact O-CB 3.26Å; V422-E426 WeakPolarHBondContact O-CG 3.45Å; V422-E426 PolarHBondContact O-N 3.31Å; V422-Y498 HydrophobicContact CB-CD1 4.48Å; V422-Y498 HydrophobicContact CG1-CD1 4.28Å; V422-R501 HydrophobicContact CG1-CB 3.64Å; V422-L502 HydrophobicContact CG2-CB 3.89Å; V422-L502 HydrophobicContact CG2-CD1 4.39Å
423H90.1Very high82.6Confident85 Ų8560.4 Ų60.439%0.39430%0.3SS..Hα-helixtrans-61-40.4177.5-73.2107.4000112.4V419 E426 S427 Y498V419-H423 WeakPolarHBondContact CG1-ND1 3.48Å; V419-H423 PolarHBondContact O-N 3.29Å; V419-H423 VanDerWaalsContact O-N 3.12Å; V419-H423 PolarHBondContact O-ND1 3.47Å; H423-E426 PolarHBondContact O-N 2.95Å; H423-S427 WeakPolarHBondContact O-CB 3.36Å; H423-S427 PolarHBondContact O-N 2.89Å; H423-Y498 AromaticContact CE1-CE1 3.44Å; H423-Y498 VanDerWaalsContact CE1-CE1 3.44Å; H423-Y498 WeakPolarHBondContact CE1-CE1 3.44Å; H423-Y498 AromaticContact CE1-CZ 3.83Å; H423-Y498 PolarHBondContact CE1-OH 2.99Å
424H86.4Confident81Confident70 Ų7060.7 Ų60.732%0.32430%0.299SS..Hα-helixtrans-60.6-48.4176.7-17460.7000110.8K420 F421 V422 S427 F428 F448K420-H424 VanDerWaalsContact O-CB 3.23Å; K420-H424 WeakPolarHBondContact O-CB 3.36Å; K420-H424 PolarHBondContact O-N 3.29Å; F421-H424 PolarHBondContact O-N 3.48Å; V422-H424 VanDerWaalsContact C-N 3.32Å; V422-H424 PolarHBondContact O-N 3.43Å; H424-S427 PolarHBondContact O-OG 2.91Å; H424-F428 AromaticContact CE1-CE2 3.6Å; H424-F428 AromaticContact CE1-CZ 3.89Å; H424-F428 AromaticContact ND1-CE2 3.96Å; H424-F428 AromaticContact NE2-CE2 3.64Å; H424-F428 WeakPolarHBondContact O-CD2 3.31Å; H424-F428 WeakPolarHBondContact O-CE2 3.24Å; H424-F448 AromaticContact CD2-CE1 3.56Å; H424-F448 AromaticContact CD2-CZ 3.77Å; H424-F448 AromaticContact NE2-CE1 3.81Å; H424-F448 AromaticContact NE2-CZ 3.5Å; H424-F448 WeakPolarHBondContact NE2-CZ 3.06Å
425C82.4Confident79.6Confident3 Ų363.3 Ų63.32%0.0232%0.315CS..Hα-helixtrans-65.6-41.9178.5-75.10000113.5F421 V422 S427 F428 V505F421-C425 WeakPolarHBondContact O-CB 3.11Å; F421-C425 PolarHBondContact O-N 3.12Å; F421-C425 PolarHBondContact O-SG 3.5Å; V422-C425 PolarHBondContact O-N 3.04Å; C425-S427 VanDerWaalsContact C-N 3.34Å; C425-S427 PolarHBondContact O-N 3.2Å; C425-F428 PolarHBondContact O-N 3.25Å; C425-V505 HydrophobicContact CB-CB 4.23Å; C425-V505 HydrophobicContact CB-CG1 3.33Å; C425-V505 HydrophobicContact CB-CG2 3.79Å; C425-V505 WeakPolarHBondContact SG-CG1 3.22Å
426E84.1Confident78Confident31 Ų3168.8 Ų68.815%0.14534%0.338CS..Hα-helixtrans-68.4-32.1179.8-75.2174.8160.800112.9V422 H423 F428 V429 E430 R501 V505V422-E426 HydrophobicContact CG1-CG 4.37Å; V422-E426 WeakPolarHBondContact O-CB 3.26Å; V422-E426 WeakPolarHBondContact O-CG 3.45Å; V422-E426 PolarHBondContact O-N 3.31Å; H423-E426 PolarHBondContact O-N 2.95Å; E426-F428 PolarHBondContact O-N 2.92Å; E426-V429 PolarHBondContact O-N 3.38Å; E426-E430 PolarHBondContact O-N 3.49Å; E426-R501 WeakPolarHBondContact OE1-CB 3.3Å; E426-R501 WeakPolarHBondContact OE1-CG 3.33Å; E426-R501 IonicContact OE1-CZ 3.58Å; E426-R501 IonicContact OE1-NE 2.76Å; E426-R501 PolarHBondContact OE1-NE 3.03Å; E426-R501 IonicContact OE1-NH2 3.4Å; E426-R501 IonicContact OE2-CZ 3.03Å; E426-R501 VanDerWaalsContact OE2-CZ 3.25Å; E426-R501 IonicContact OE2-NE 3.93Å; E426-R501 PolarHBondContact OE2-NE 2.9Å; E426-R501 VanDerWaalsContact OE2-NE 3.16Å; E426-R501 IonicContact OE2-NH2 3.83Å; E426-R501 PolarHBondContact OE2-NH2 2.7Å; E426-V505 HydrophobicContact CG-CG2 4.24Å
427S82.6Confident76.3Confident50 Ų5068.6 Ų68.635%0.3533%0.334SS..Hα-helixtrans-56.5-25.7175.274.50000113.5H423 H424 C425 Q431H423-S427 WeakPolarHBondContact O-CB 3.36Å; H423-S427 PolarHBondContact O-N 2.89Å; H424-S427 PolarHBondContact O-OG 2.91Å; C425-S427 VanDerWaalsContact C-N 3.34Å; C425-S427 PolarHBondContact O-N 3.2Å; S427-Q431 WeakPolarHBondContact O-CG 3.39Å
428F71.1Confident75Confident38 Ų3869.5 Ų69.517%0.16734%0.337CS..Hα-helixtrans-88.7-22.7174.3-64.6-76.7000114H424 C425 E426 M433 L437 A440 F448H424-F428 AromaticContact CE1-CE2 3.6Å; H424-F428 AromaticContact CE1-CZ 3.89Å; H424-F428 AromaticContact ND1-CE2 3.96Å; H424-F428 AromaticContact NE2-CE2 3.64Å; H424-F428 WeakPolarHBondContact O-CD2 3.31Å; H424-F428 WeakPolarHBondContact O-CE2 3.24Å; C425-F428 PolarHBondContact O-N 3.25Å; E426-F428 PolarHBondContact O-N 2.92Å; F428-M433 CarbonylContact O-C 3.53Å; F428-L437 HydrophobicContact CB-CB 3.77Å; F428-L437 HydrophobicContact CB-CD1 3.49Å; F428-L437 VanDerWaalsContact CB-CD1 3.49Å; F428-L437 HydrophobicContact CB-CD2 4.18Å; F428-L437 HydrophobicContact CB-CG 3.95Å; F428-L437 HydrophobicContact CD1-CD1 4.44Å; F428-L437 HydrophobicContact CD2-CD1 3.85Å; F428-L437 HydrophobicContact CG-CB 4.46Å; F428-L437 HydrophobicContact CG-CD1 3.7Å; F428-A440 HydrophobicContact CE1-CB 3.99Å; F428-A440 HydrophobicContact CZ-CB 4.35Å; F428-F448 HydrophobicContact CD2-CZ 4.44Å; F428-F448 HydrophobicContact CE2-CE1 4.43Å; F428-F448 AromaticContact CE2-CZ 3.81Å; F428-F448 HydrophobicContact CE2-CZ 3.81Å; F428-F448 HydrophobicContact CZ-CZ 4.35Å
429V67.6Low73.7Confident57 Ų5773.6 Ų73.635%0.34536%0.359SS..Hα-helixtrans-83.7-40.8-179.5176.90000111.1E426 L437E426-V429 PolarHBondContact O-N 3.38Å; V429-L437 HydrophobicContact CG2-CD2 3.85Å
430E65.3Low72.3Confident160 Ų16074.3 Ų74.375%0.74837%0.365SS*.Hα-helixtrans-72.1-29.6-176-70.9-177.3166.100113.8E426 D432E426-E430 PolarHBondContact O-N 3.49Å; E430-D432 PolarHBondContact O-N 2.89Å
431Q63.8Low70.8Confident128 Ų12866.9 Ų66.960%0.59833%0.334SS*.THydrogen-bonded Turntrans-76.112.8-179.2-64.9-172.9-8.400113.8S427 M433S427-Q431 WeakPolarHBondContact O-CG 3.39Å; Q431-M433 HydrophobicContact CB-CB 4.25Å; Q431-M433 HydrophobicContact CB-CE 4.14Å; Q431-M433 HydrophobicContact CB-CG 3.64Å; Q431-M433 HydrophobicContact CB-SD 4.3Å; Q431-M433 WeakPolarHBondContact O-CG 3.38Å; Q431-M433 PolarHBondContact O-N 3.41Å
432D59.1Low69.5Low141 Ų14175.2 Ų75.275%0.75436%0.364SS*.SBendtrans49.217.1-167.4-154.728.7000113.1E430 Q434E430-D432 PolarHBondContact O-N 2.89Å; D432-Q434 PolarHBondContact O-N 2.95Å
433M57.3Low68.2Low41 Ų4181.6 Ų81.620%0.20240%0.403CS..  trans-86.744.6-179.5-60-159.5-47.300109.9F428 Q431 D435 K436 L437F428-M433 CarbonylContact O-C 3.53Å; Q431-M433 HydrophobicContact CB-CB 4.25Å; Q431-M433 HydrophobicContact CB-CE 4.14Å; Q431-M433 HydrophobicContact CB-CG 3.64Å; Q431-M433 HydrophobicContact CB-SD 4.3Å; Q431-M433 WeakPolarHBondContact O-CG 3.38Å; Q431-M433 PolarHBondContact O-N 3.41Å; M433-D435 PolarHBondContact O-N 3.49Å; M433-D435 VanDerWaalsContact O-N 3.1Å; M433-K436 HydrophobicContact CB-CB 3.96Å; M433-K436 HydrophobicContact CB-CG 4.16Å; M433-K436 HydrophobicContact CE-CB 4.26Å; M433-K436 HydrophobicContact CE-CD 3.82Å; M433-K436 HydrophobicContact CE-CG 4.43Å; M433-K436 CarbonylContact O-C 3.49Å; M433-K436 PolarHBondContact O-N 3.33Å; M433-K436 HydrophobicContact SD-CB 4.44Å; M433-K436 HydrophobicContact SD-CD 3.43Å; M433-K436 WeakPolarHBondContact SD-CD 3.49Å; M433-K436 WeakPolarHBondContact SD-CE 3.28Å; M433-K436 HydrophobicContact SD-CG 4.04Å; M433-K436 PolarHBondContact SD-NZ 2.89Å; M433-L437 PolarHBondContact O-N 2.91Å
434Q60.9Low66.9Low113 Ų11379.9 Ų79.953%0.52840%0.4SS..Hα-helixtrans-53.2-33.3174-79.9-169.7-0.900111.3D432 L437 K438D432-Q434 PolarHBondContact O-N 2.95Å; Q434-L437 PolarHBondContact O-N 3.5Å; Q434-K438 VanDerWaalsContact O-CG 3.27Å; Q434-K438 WeakPolarHBondContact O-CG 3.38Å; Q434-K438 PolarHBondContact O-N 2.74Å
435D65Low65.9Low104 Ų10483.2 Ų83.256%0.55641%0.41SS*.Hα-helixtrans-74.2-38.5177-66-28.5000112.6M433 L437 K438 D439M433-D435 PolarHBondContact O-N 3.49Å; M433-D435 VanDerWaalsContact O-N 3.1Å; D435-L437 VanDerWaalsContact C-N 3.35Å; D435-K438 WeakPolarHBondContact O-CB 3.38Å; D435-K438 PolarHBondContact O-N 2.9Å; D435-K438 IonicContact OD1-NZ 2.88Å; D435-K438 PolarHBondContact OD1-NZ 3.41Å; D435-D439 PolarHBondContact O-N 3.48Å
436K60.9Low65.3Low127 Ų12788 Ų8855%0.55244%0.444SS*.Hα-helixtrans-71-29.1170.7-56.7-162.9-165.6154.80112.7M433 D439 A440M433-K436 HydrophobicContact CB-CB 3.96Å; M433-K436 HydrophobicContact CB-CG 4.16Å; M433-K436 HydrophobicContact CE-CB 4.26Å; M433-K436 HydrophobicContact CE-CD 3.82Å; M433-K436 HydrophobicContact CE-CG 4.43Å; M433-K436 CarbonylContact O-C 3.49Å; M433-K436 PolarHBondContact O-N 3.33Å; M433-K436 HydrophobicContact SD-CB 4.44Å; M433-K436 HydrophobicContact SD-CD 3.43Å; M433-K436 WeakPolarHBondContact SD-CD 3.49Å; M433-K436 WeakPolarHBondContact SD-CE 3.28Å; M433-K436 HydrophobicContact SD-CG 4.04Å; M433-K436 PolarHBondContact SD-NZ 2.89Å; K436-D439 PolarHBondContact O-N 2.73Å; K436-A440 WeakPolarHBondContact O-CB 3.48Å; K436-A440 PolarHBondContact O-N 2.94Å
437L57.8Low64.9Low10 Ų1092.1 Ų92.15%0.05246%0.459CS..Hα-helixtrans-63.5-46.9169.5-178.253.7000109.6F428 V429 M433 Q434 D435 D439 A440 L441 T508F428-L437 HydrophobicContact CB-CB 3.77Å; F428-L437 HydrophobicContact CB-CD1 3.49Å; F428-L437 VanDerWaalsContact CB-CD1 3.49Å; F428-L437 HydrophobicContact CB-CD2 4.18Å; F428-L437 HydrophobicContact CB-CG 3.95Å; F428-L437 HydrophobicContact CD1-CD1 4.44Å; F428-L437 HydrophobicContact CD2-CD1 3.85Å; F428-L437 HydrophobicContact CG-CB 4.46Å; F428-L437 HydrophobicContact CG-CD1 3.7Å; V429-L437 HydrophobicContact CG2-CD2 3.85Å; M433-L437 PolarHBondContact O-N 2.91Å; Q434-L437 PolarHBondContact O-N 3.5Å; D435-L437 VanDerWaalsContact C-N 3.35Å; L437-D439 VanDerWaalsContact C-N 3.31Å; L437-D439 PolarHBondContact O-N 3.26Å; L437-A440 PolarHBondContact O-N 3.4Å; L437-L441 HydrophobicContact CD1-CD1 3.58Å; L437-L441 HydrophobicContact CD1-CG 3.71Å; L437-L441 HydrophobicContact CD2-CD1 4.3Å; L437-L441 HydrophobicContact CG-CD1 3.6Å; L437-L441 HydrophobicContact CG-CG 4.16Å; L437-L441 WeakPolarHBondContact O-CA 3.48Å; L437-L441 WeakPolarHBondContact O-CB 3.21Å; L437-L441 WeakPolarHBondContact O-CG 3.4Å; L437-L441 PolarHBondContact O-N 2.88Å; L437-T508 HydrophobicContact CD2-CG2 4.49Å
438K63.3Low64.5Low111 Ų11190 Ų9048%0.48344%0.443SS..Hα-helixtrans-59.1-43.1174.9-75171-161.5154.90110.9Q434 D435 L441 R442Q434-K438 VanDerWaalsContact O-CG 3.27Å; Q434-K438 WeakPolarHBondContact O-CG 3.38Å; Q434-K438 PolarHBondContact O-N 2.74Å; D435-K438 WeakPolarHBondContact O-CB 3.38Å; D435-K438 PolarHBondContact O-N 2.9Å; D435-K438 IonicContact OD1-NZ 2.88Å; D435-K438 PolarHBondContact OD1-NZ 3.41Å; K438-L441 CarbonylContact O-C 3.51Å; K438-R442 WeakPolarHBondContact O-CB 3.3Å; K438-R442 PolarHBondContact O-N 3.42Å
439D65.7Low64.7Low89 Ų8993 Ų9348%0.47646%0.456SS..Hα-helixtrans-70.5-44.9179.3-74.1-24.2000112.5D435 K436 L437 L441 R442 V443D435-D439 PolarHBondContact O-N 3.48Å; K436-D439 PolarHBondContact O-N 2.73Å; L437-D439 VanDerWaalsContact C-N 3.31Å; L437-D439 PolarHBondContact O-N 3.26Å; D439-L441 VanDerWaalsContact C-N 3.33Å; D439-L441 PolarHBondContact O-N 3.08Å; D439-R442 CarbonylContact O-C 3.6Å; D439-R442 WeakPolarHBondContact O-CB 3.29Å; D439-R442 PolarHBondContact O-N 2.84Å; D439-V443 WeakPolarHBondContact O-CB 3.49Å; D439-V443 VanDerWaalsContact O-CG2 3.31Å; D439-V443 WeakPolarHBondContact O-CG2 3.38Å; D439-V443 PolarHBondContact O-N 2.95Å
440A63Low65.3Low26 Ų2692 Ų9222%0.21546%0.458CS..Hα-helixtrans-63.1-38.7173.300000111.5F428 K436 L437 R442 S444F428-A440 HydrophobicContact CE1-CB 3.99Å; F428-A440 HydrophobicContact CZ-CB 4.35Å; K436-A440 WeakPolarHBondContact O-CB 3.48Å; K436-A440 PolarHBondContact O-N 2.94Å; L437-A440 PolarHBondContact O-N 3.4Å; A440-R442 VanDerWaalsContact C-N 3.31Å; A440-S444 VanDerWaalsContact O-CA 3.26Å; A440-S444 WeakPolarHBondContact O-CA 3.47Å; A440-S444 WeakPolarHBondContact O-CB 3.36Å; A440-S444 PolarHBondContact O-N 3.1Å
441L61.1Low66.1Low4 Ų487.3 Ų87.32%0.02144%0.438CS..Hα-helixtrans-71.4-23.2171.2-74.4172.5000112.4L437 K438 D439 R445 F448 A510 L511L437-L441 HydrophobicContact CD1-CD1 3.58Å; L437-L441 HydrophobicContact CD1-CG 3.71Å; L437-L441 HydrophobicContact CD2-CD1 4.3Å; L437-L441 HydrophobicContact CG-CD1 3.6Å; L437-L441 HydrophobicContact CG-CG 4.16Å; L437-L441 WeakPolarHBondContact O-CA 3.48Å; L437-L441 WeakPolarHBondContact O-CB 3.21Å; L437-L441 WeakPolarHBondContact O-CG 3.4Å; L437-L441 PolarHBondContact O-N 2.88Å; K438-L441 CarbonylContact O-C 3.51Å; D439-L441 VanDerWaalsContact C-N 3.33Å; D439-L441 PolarHBondContact O-N 3.08Å; L441-R445 WeakPolarHBondContact O-CA 3.49Å; L441-R445 WeakPolarHBondContact O-CB 3.29Å; L441-R445 WeakPolarHBondContact O-CG 3.4Å; L441-R445 PolarHBondContact O-N 2.85Å; L441-F448 HydrophobicContact CD2-CB 3.61Å; L441-F448 HydrophobicContact CD2-CD1 3.73Å; L441-F448 HydrophobicContact CD2-CD2 3.43Å; L441-F448 VanDerWaalsContact CD2-CD2 3.43Å; L441-F448 HydrophobicContact CD2-CE1 4.19Å; L441-F448 HydrophobicContact CD2-CE2 3.92Å; L441-F448 HydrophobicContact CD2-CG 3.31Å; L441-F448 HydrophobicContact CD2-CZ 4.27Å; L441-F448 HydrophobicContact CG-CD2 4.35Å; L441-F448 HydrophobicContact CG-CE2 4.45Å; L441-A510 HydrophobicContact CB-CB 4.41Å; L441-A510 HydrophobicContact CD1-CB 3.27Å; L441-A510 HydrophobicContact CG-CB 4.43Å; L441-L511 HydrophobicContact CD1-CG 4.34Å; L441-L511 HydrophobicContact CD2-CD2 3.74Å; L441-L511 HydrophobicContact CD2-CG 4.2Å
442R63Low67.1Low192 Ų19281.3 Ų81.373%0.72541%0.41SS*.Hα-helixtrans-81.2-44.5176.5-173.6178.3179.7-173.7-0.5110.5K438 D439 A440K438-R442 WeakPolarHBondContact O-CB 3.3Å; K438-R442 PolarHBondContact O-N 3.42Å; D439-R442 CarbonylContact O-C 3.6Å; D439-R442 WeakPolarHBondContact O-CB 3.29Å; D439-R442 PolarHBondContact O-N 2.84Å; A440-R442 VanDerWaalsContact C-N 3.31Å
443V61.4Low68.3Low133 Ų13375.8 Ų75.881%0.80638%0.382SS*.Hα-helixtrans-72.5-42.8177.4176.40000111D439D439-V443 WeakPolarHBondContact O-CB 3.49Å; D439-V443 VanDerWaalsContact O-CG2 3.31Å; D439-V443 WeakPolarHBondContact O-CG2 3.38Å; D439-V443 PolarHBondContact O-N 2.95Å
444S63.7Low69.8Low49 Ų4979 Ų7934%0.34340%0.396SS..SBendtrans-108.126.4-176.7-131.80000112.5A440 S446 Y447 F448A440-S444 VanDerWaalsContact O-CA 3.26Å; A440-S444 WeakPolarHBondContact O-CA 3.47Å; A440-S444 WeakPolarHBondContact O-CB 3.36Å; A440-S444 PolarHBondContact O-N 3.1Å; S444-S446 PolarHBondContact O-N 3.23Å; S444-Y447 WeakPolarHBondContact O-CA 3.45Å; S444-Y447 VanDerWaalsContact O-CB 3.29Å; S444-Y447 WeakPolarHBondContact O-CB 3.37Å; S444-Y447 PolarHBondContact O-N 3.41Å; S444-Y447 WeakPolarHBondContact OG-CB 3.4Å; S444-F448 WeakPolarHBondContact O-CD2 3.47Å; S444-F448 PolarHBondContact O-N 3.48Å
445R65.9Low71.2Confident140 Ų14074 Ų7453%0.52837%0.372SS..Hα-helixtrans-54.4-42.5-176.9-150.7168.3-154.4173.57.1113.1L441 Y447 K449L441-R445 WeakPolarHBondContact O-CA 3.49Å; L441-R445 WeakPolarHBondContact O-CB 3.29Å; L441-R445 WeakPolarHBondContact O-CG 3.4Å; L441-R445 PolarHBondContact O-N 2.85Å; R445-Y447 VanDerWaalsContact C-N 3.33Å; R445-K449 WeakPolarHBondContact O-CB 3.49Å; R445-K449 PolarHBondContact O-N 3Å
446S69.4Low72.2Confident104 Ų10469 Ų6973%0.72735%0.346SS*.Hα-helixtrans-62.6-41.8177.5-171.60000111.2S444 K449 G450S444-S446 PolarHBondContact O-N 3.23Å; S446-K449 PolarHBondContact O-N 3.22Å; S446-G450 PolarHBondContact O-N 2.87Å
447Y74.8Confident73.6Confident118 Ų11870.1 Ų70.146%0.46335%0.347SS..Hα-helixtrans-62.2-52.3177173.9-96000111.7S444 R445 K449 G450 N451S444-Y447 WeakPolarHBondContact O-CA 3.45Å; S444-Y447 VanDerWaalsContact O-CB 3.29Å; S444-Y447 WeakPolarHBondContact O-CB 3.37Å; S444-Y447 PolarHBondContact O-N 3.41Å; S444-Y447 WeakPolarHBondContact OG-CB 3.4Å; R445-Y447 VanDerWaalsContact C-N 3.33Å; Y447-K449 PolarHBondContact O-N 3.36Å; Y447-G450 PolarHBondContact O-N 3.18Å; Y447-N451 WeakPolarHBondContact CE1-ND2 3.3Å; Y447-N451 WeakPolarHBondContact CE2-ND2 3.35Å; Y447-N451 VanDerWaalsContact O-CB 3.3Å; Y447-N451 WeakPolarHBondContact O-CB 3.33Å; Y447-N451 VanDerWaalsContact O-CG 3.28Å; Y447-N451 PolarHBondContact O-N 3.17Å; Y447-N451 PolarHBondContact OH-ND2 2.98Å
448F75.2Confident75Confident4 Ų472 Ų722%0.01836%0.36CS..Hα-helixtrans-64.5-40.6178.7-77.2-88000112.3F421 H424 F428 L441 S444 A452 L511F421-F448 HydrophobicContact CE2-CD1 4.43Å; H424-F448 AromaticContact CD2-CE1 3.56Å; H424-F448 AromaticContact CD2-CZ 3.77Å; H424-F448 AromaticContact NE2-CE1 3.81Å; H424-F448 AromaticContact NE2-CZ 3.5Å; H424-F448 WeakPolarHBondContact NE2-CZ 3.06Å; F428-F448 HydrophobicContact CD2-CZ 4.44Å; F428-F448 HydrophobicContact CE2-CE1 4.43Å; F428-F448 AromaticContact CE2-CZ 3.81Å; F428-F448 HydrophobicContact CE2-CZ 3.81Å; F428-F448 HydrophobicContact CZ-CZ 4.35Å; L441-F448 HydrophobicContact CD2-CB 3.61Å; L441-F448 HydrophobicContact CD2-CD1 3.73Å; L441-F448 HydrophobicContact CD2-CD2 3.43Å; L441-F448 VanDerWaalsContact CD2-CD2 3.43Å; L441-F448 HydrophobicContact CD2-CE1 4.19Å; L441-F448 HydrophobicContact CD2-CE2 3.92Å; L441-F448 HydrophobicContact CD2-CG 3.31Å; L441-F448 HydrophobicContact CD2-CZ 4.27Å; L441-F448 HydrophobicContact CG-CD2 4.35Å; L441-F448 HydrophobicContact CG-CE2 4.45Å; S444-F448 WeakPolarHBondContact O-CD2 3.47Å; S444-F448 PolarHBondContact O-N 3.48Å; F448-A452 WeakPolarHBondContact O-CB 3.37Å; F448-A452 PolarHBondContact O-N 2.96Å; F448-L511 HydrophobicContact CB-CD2 4.11Å
449K74.2Confident76.4Confident101 Ų10167.4 Ų67.444%0.43934%0.341SS..Hα-helixtrans-64.2-46.1176.6176.2156.1-169.9-174.50112R445 S446 Y447 T453 L514R445-K449 WeakPolarHBondContact O-CB 3.49Å; R445-K449 PolarHBondContact O-N 3Å; S446-K449 PolarHBondContact O-N 3.22Å; Y447-K449 PolarHBondContact O-N 3.36Å; K449-T453 WeakPolarHBondContact O-CB 3.49Å; K449-T453 PolarHBondContact O-N 3.19Å; K449-T453 PolarHBondContact O-OG1 2.93Å; K449-L514 HydrophobicContact CB-CD2 3.6Å; K449-L514 HydrophobicContact CD-CD2 3.48Å; K449-L514 VanDerWaalsContact CD-CD2 3.48Å; K449-L514 HydrophobicContact CG-CD2 3.32Å
450G80.2Confident77.5Confident37 Ų3765.6 Ų65.638%0.38133%0.331SS..Hα-helixtrans-62.4-51.6178.200000111.3S446 Y447 A452 T453 H454S446-G450 PolarHBondContact O-N 2.87Å; Y447-G450 PolarHBondContact O-N 3.18Å; G450-A452 PolarHBondContact O-N 3.34Å; G450-T453 PolarHBondContact O-N 2.9Å; G450-H454 WeakPolarHBondContact O-CB 3.25Å; G450-H454 PolarHBondContact O-N 3.2Å
451N83.6Confident78.8Confident62 Ų6269.2 Ų69.233%0.33236%0.355SS..Hα-helixtrans-64.8-41.3179.6-70.6-3.2000112.4F421 Y447 H454 L455F421-N451 HydrophobicContact CD2-CB 4.46Å; F421-N451 HydrophobicContact CE2-CB 4.47Å; Y447-N451 WeakPolarHBondContact CE1-ND2 3.3Å; Y447-N451 WeakPolarHBondContact CE2-ND2 3.35Å; Y447-N451 VanDerWaalsContact O-CB 3.3Å; Y447-N451 WeakPolarHBondContact O-CB 3.33Å; Y447-N451 VanDerWaalsContact O-CG 3.28Å; Y447-N451 PolarHBondContact O-N 3.17Å; Y447-N451 PolarHBondContact OH-ND2 2.98Å; N451-H454 PolarHBondContact O-N 2.81Å; N451-L455 WeakPolarHBondContact O-CB 3.24Å; N451-L455 PolarHBondContact O-N 3.39Å
452A83.9Confident80.2Confident1 Ų170.1 Ų70.11%0.00837%0.365CS..Hα-helixtrans-63.4-42.9175.500000111.6F421 F448 G450 L455 V456 L506 L514F421-A452 HydrophobicContact CE2-CB 4.09Å; F421-A452 HydrophobicContact CZ-CB 3.82Å; F448-A452 WeakPolarHBondContact O-CB 3.37Å; F448-A452 PolarHBondContact O-N 2.96Å; G450-A452 PolarHBondContact O-N 3.34Å; A452-L455 PolarHBondContact O-N 2.88Å; A452-V456 VanDerWaalsContact O-CG2 3.31Å; A452-V456 WeakPolarHBondContact O-CG2 3.42Å; A452-V456 PolarHBondContact O-N 3.35Å; A452-L506 HydrophobicContact CB-CD2 4.14Å; A452-L514 HydrophobicContact CB-CD1 3.87Å
453T84.6Confident81.6Confident26 Ų2661.7 Ų61.716%0.1633%0.333CS..Hα-helixtrans-66.9-41.6178.7-52.90000111.4K449 G450 R457 A516K449-T453 WeakPolarHBondContact O-CB 3.49Å; K449-T453 PolarHBondContact O-N 3.19Å; K449-T453 PolarHBondContact O-OG1 2.93Å; G450-T453 PolarHBondContact O-N 2.9Å; T453-R457 WeakPolarHBondContact O-CG 3.39Å; T453-R457 PolarHBondContact O-N 3.3Å; T453-A516 HydrophobicContact CG2-CB 4.26Å
454H88Confident83.1Confident108 Ų10860.6 Ų60.650%0.532%0.317SS..Hα-helixtrans-60.5-50.3173.7179.8-88.1000111.3E417 G450 N451 V456 R457 S458E417-H454 IonicContact OE1-CE1 3.84Å; E417-H454 PolarHBondContact OE1-CE1 3.25Å; E417-H454 IonicContact OE1-ND1 2.81Å; E417-H454 IonicContact OE2-CE1 3.16Å; E417-H454 IonicContact OE2-ND1 3.49Å; E417-H454 PolarHBondContact OE2-ND1 3.06Å; G450-H454 WeakPolarHBondContact O-CB 3.25Å; G450-H454 PolarHBondContact O-N 3.2Å; N451-H454 PolarHBondContact O-N 2.81Å; H454-V456 PolarHBondContact O-N 3.4Å; H454-R457 PolarHBondContact O-N 3.2Å; H454-S458 VanDerWaalsContact O-CB 3.23Å; H454-S458 WeakPolarHBondContact O-CB 3.44Å; H454-S458 PolarHBondContact O-N 2.96Å
455L89.7Confident84.5Confident7 Ų762.4 Ų62.44%0.03733%0.33CS..Hα-helixtrans-54.7-50.1178.8178.178.1000111.5E417 L418 F421 N451 A452 R457 S458 F459 L502E417-L455 HydrophobicContact CB-CD1 3.48Å; E417-L455 VanDerWaalsContact CB-CD1 3.48Å; L418-L455 HydrophobicContact CB-CD1 4.16Å; L418-L455 HydrophobicContact CD1-CD2 4.39Å; L418-L455 VanDerWaalsContact N-CD1 3.32Å; F421-L455 HydrophobicContact CB-CD2 4.08Å; F421-L455 HydrophobicContact CD1-CD2 3.81Å; F421-L455 HydrophobicContact CE1-CD2 4.46Å; F421-L455 HydrophobicContact CG-CD2 3.95Å; N451-L455 WeakPolarHBondContact O-CB 3.24Å; N451-L455 PolarHBondContact O-N 3.39Å; A452-L455 PolarHBondContact O-N 2.88Å; L455-R457 PolarHBondContact O-N 3.49Å; L455-S458 PolarHBondContact O-N 3.15Å; L455-F459 VanDerWaalsContact O-CB 3.22Å; L455-F459 WeakPolarHBondContact O-CB 3.09Å; L455-F459 PolarHBondContact O-N 3.45Å; L455-L502 HydrophobicContact CD2-CD1 3.71Å; L455-L502 HydrophobicContact CD2-CD2 4.05Å
456V87.5Confident85.8Confident1 Ų157 Ų571%0.00631%0.314CS..Hα-helixtrans-62.9-43.7-177.9173.40000111.1A452 H454 N460 A516 E519 L520A452-V456 VanDerWaalsContact O-CG2 3.31Å; A452-V456 WeakPolarHBondContact O-CG2 3.42Å; A452-V456 PolarHBondContact O-N 3.35Å; H454-V456 PolarHBondContact O-N 3.4Å; V456-N460 VanDerWaalsContact O-CB 3.3Å; V456-N460 WeakPolarHBondContact O-CB 3.23Å; V456-N460 PolarHBondContact O-N 3.41Å; V456-N460 PolarHBondContact O-ND2 2.95Å; V456-N460 PolarHBondContact O-OD1 3.35Å; V456-A516 HydrophobicContact CB-CB 4.35Å; V456-A516 HydrophobicContact CG2-CB 4.24Å; V456-E519 HydrophobicContact CG1-CB 3.81Å; V456-L520 HydrophobicContact CB-CD2 4.49Å; V456-L520 HydrophobicContact CG1-CD2 4.16Å; V456-L520 HydrophobicContact CG1-CG 4.45Å; V456-L520 HydrophobicContact CG2-CD2 3.61Å; V456-L520 HydrophobicContact CG2-CG 4.26Å
457R88.8Confident87Confident150 Ų15052 Ų5257%0.56628%0.279SS*.Hα-helixtrans-66.5-44.6178.6-70.3176.2179.7178-0.8112.2T453 H454 L455 N460 S461 E519T453-R457 WeakPolarHBondContact O-CG 3.39Å; T453-R457 PolarHBondContact O-N 3.3Å; H454-R457 PolarHBondContact O-N 3.2Å; L455-R457 PolarHBondContact O-N 3.49Å; R457-N460 PolarHBondContact O-N 3.49Å; R457-S461 PolarHBondContact O-N 2.97Å; R457-S461 VanDerWaalsContact O-N 3.11Å; R457-S461 PolarHBondContact O-OG 3.37Å; R457-E519 IonicContact NE-OE2 3.2Å; R457-E519 PolarHBondContact NE-OE2 3.08Å; R457-E519 IonicContact NH2-OE1 3.78Å
458S88.7Confident87.8Confident48 Ų4850 Ų5034%0.33627%0.274SS..Hα-helixtrans-57.5-52.6175.2178.80000110.4E417 H454 L455 N460 S461 G462E417-S458 PolarHBondContact OE2-OG 3.4Å; H454-S458 VanDerWaalsContact O-CB 3.23Å; H454-S458 WeakPolarHBondContact O-CB 3.44Å; H454-S458 PolarHBondContact O-N 2.96Å; L455-S458 PolarHBondContact O-N 3.15Å; S458-N460 PolarHBondContact O-N 3.23Å; S458-S461 PolarHBondContact O-N 2.96Å; S458-S461 PolarHBondContact O-OG 3.25Å; S458-G462 PolarHBondContact O-N 3.48Å
459F91.5Very high88.8Confident15 Ų1551.8 Ų51.87%0.06629%0.289CS..Hα-helixtrans-55.6-53.9176.2-175.3-91.6000111.3F415 L418 L455 S461 G462 W463 Y499 V521 L526F415-F459 HydrophobicContact CD1-CD2 4.02Å; F415-F459 AromaticContact CD1-CE2 3.89Å; F415-F459 HydrophobicContact CD1-CE2 3.89Å; F415-F459 AromaticContact CE1-CD2 3.95Å; F415-F459 HydrophobicContact CE1-CD2 3.95Å; F415-F459 AromaticContact CE1-CE2 3.6Å; F415-F459 HydrophobicContact CE1-CE2 3.6Å; L418-F459 HydrophobicContact CD2-CE2 4.35Å; L455-F459 VanDerWaalsContact O-CB 3.22Å; L455-F459 WeakPolarHBondContact O-CB 3.09Å; L455-F459 PolarHBondContact O-N 3.45Å; F459-S461 PolarHBondContact O-N 2.98Å; F459-S461 VanDerWaalsContact O-N 3.16Å; F459-G462 PolarHBondContact O-N 3.34Å; F459-W463 HydrophobicContact CD1-CB 4.14Å; F459-W463 HydrophobicContact CD1-CG 4.31Å; F459-W463 HydrophobicContact CD2-CB 4.12Å; F459-W463 HydrophobicContact CE1-CB 3.89Å; F459-W463 AromaticContact CE1-CG 3.94Å; F459-W463 HydrophobicContact CE1-CG 3.94Å; F459-W463 HydrophobicContact CE2-CB 3.89Å; F459-W463 HydrophobicContact CG-CB 4.25Å; F459-W463 HydrophobicContact CZ-CB 3.77Å; F459-W463 HydrophobicContact CZ-CG 4.17Å; F459-W463 VanDerWaalsContact O-CB 3.23Å; F459-W463 WeakPolarHBondContact O-CB 3.13Å; F459-W463 PolarHBondContact O-N 3.44Å; F459-Y499 HydrophobicContact CD1-CE2 4.02Å; F459-Y499 HydrophobicContact CE1-CD2 4.07Å; F459-Y499 AromaticContact CE1-CE2 3.48Å; F459-Y499 HydrophobicContact CE1-CE2 3.48Å; F459-Y499 VanDerWaalsContact CE1-CE2 3.48Å; F459-Y499 HydrophobicContact CE2-CD2 4.23Å; F459-Y499 HydrophobicContact CE2-CE2 4.36Å; F459-Y499 AromaticContact CZ-CD2 3.76Å; F459-Y499 HydrophobicContact CZ-CD2 3.76Å; F459-Y499 AromaticContact CZ-CE2 3.68Å; F459-Y499 HydrophobicContact CZ-CE2 3.68Å; F459-V521 HydrophobicContact CE1-CB 4.27Å; F459-V521 HydrophobicContact CE1-CG2 4.39Å; F459-L526 HydrophobicContact CZ-CD1 4.47Å
460N89.8Confident89.7Confident51 Ų5147 Ų4727%0.27327%0.268SS..Hα-helixtrans-56.2-35-178.1-73.6-8.4000113.7V456 R457 S458 E519 V521V456-N460 VanDerWaalsContact O-CB 3.3Å; V456-N460 WeakPolarHBondContact O-CB 3.23Å; V456-N460 PolarHBondContact O-N 3.41Å; V456-N460 PolarHBondContact O-ND2 2.95Å; V456-N460 PolarHBondContact O-OD1 3.35Å; R457-N460 PolarHBondContact O-N 3.49Å; S458-N460 PolarHBondContact O-N 3.23Å; N460-E519 PolarHBondContact ND2-O 3.01Å; N460-V521 WeakPolarHBondContact OD1-CG2 3.32Å
461S89.4Confident90.4Very high102 Ų10246.2 Ų46.271%0.71326%0.256SS*.Hα-helixtrans-77.9-32.1-17871.20000113.9R457 S458 F459R457-S461 PolarHBondContact O-N 2.97Å; R457-S461 VanDerWaalsContact O-N 3.11Å; R457-S461 PolarHBondContact O-OG 3.37Å; S458-S461 PolarHBondContact O-N 2.96Å; S458-S461 PolarHBondContact O-OG 3.25Å; F459-S461 PolarHBondContact O-N 2.98Å; F459-S461 VanDerWaalsContact O-N 3.16Å
462G89.9Confident90.8Very high23 Ų2348.3 Ų48.324%0.23726%0.264CS..Hα-helixtrans-121.8-12.4-166.200000116.3S458 F459 K464 S465 S466S458-G462 PolarHBondContact O-N 3.48Å; F459-G462 PolarHBondContact O-N 3.34Å; G462-K464 VanDerWaalsContact C-N 3.32Å; G462-K464 PolarHBondContact O-N 3.32Å; G462-K464 VanDerWaalsContact O-N 3.15Å; G462-S465 PolarHBondContact O-N 3.31Å; G462-S465 VanDerWaalsContact O-N 3.08Å; G462-S466 PolarHBondContact O-N 2.82Å; G462-S466 PolarHBondContact O-OG 3.44Å
463W92.5Very high91.3Very high15 Ų1550.2 Ų50.26%0.05727%0.272CS..Hα-helixtrans-57.2-38.1-167.569.4-84.4000114.5F415 F459 S466 I467 V521 L526 E529F415-W463 HydrophobicContact CE1-CB 4.09Å; F459-W463 HydrophobicContact CD1-CB 4.14Å; F459-W463 HydrophobicContact CD1-CG 4.31Å; F459-W463 HydrophobicContact CD2-CB 4.12Å; F459-W463 HydrophobicContact CE1-CB 3.89Å; F459-W463 AromaticContact CE1-CG 3.94Å; F459-W463 HydrophobicContact CE1-CG 3.94Å; F459-W463 HydrophobicContact CE2-CB 3.89Å; F459-W463 HydrophobicContact CG-CB 4.25Å; F459-W463 HydrophobicContact CZ-CB 3.77Å; F459-W463 HydrophobicContact CZ-CG 4.17Å; F459-W463 VanDerWaalsContact O-CB 3.23Å; F459-W463 WeakPolarHBondContact O-CB 3.13Å; F459-W463 PolarHBondContact O-N 3.44Å; W463-S466 PolarHBondContact O-N 2.87Å; W463-I467 HydrophobicContact CE3-CD1 3.63Å; W463-I467 HydrophobicContact CZ3-CD1 3.82Å; W463-I467 WeakPolarHBondContact O-CG1 3.21Å; W463-I467 PolarHBondContact O-N 2.78Å; W463-V521 HydrophobicContact CZ2-CG1 4.1Å; W463-L526 HydrophobicContact CE3-CD1 3.69Å; W463-L526 HydrophobicContact CZ3-CD1 3.64Å; W463-E529 HydrophobicContact CH2-CB 3.64Å; W463-E529 HydrophobicContact CH2-CG 3.91Å; W463-E529 HydrophobicContact CZ3-CB 3.56Å; W463-E529 HydrophobicContact CZ3-CG 3.66Å
464K92.8Very high91.7Very high110 Ų11049 Ų4948%0.47827%0.265SS..Hα-helixtrans-65.6-45.9177.5-67.9-171178.1-175.60112.1G462 S466 I467 E468 E529G462-K464 VanDerWaalsContact C-N 3.32Å; G462-K464 PolarHBondContact O-N 3.32Å; G462-K464 VanDerWaalsContact O-N 3.15Å; K464-S466 VanDerWaalsContact C-N 3.29Å; K464-S466 PolarHBondContact O-N 3.06Å; K464-I467 PolarHBondContact O-N 3.33Å; K464-E468 PolarHBondContact O-N 3.47Å; K464-E529 HydrophobicContact CG-CG 4.48Å; K464-E529 IonicContact NZ-OE2 2.61Å
465S93.1Very high91.8Very high87 Ų8747.6 Ų47.661%0.60826%0.259SS*.Hα-helixtrans-63.6-37.6177.3-53.20000111.2G462 E468 A469G462-S465 PolarHBondContact O-N 3.31Å; G462-S465 VanDerWaalsContact O-N 3.08Å; S465-E468 PolarHBondContact O-N 2.86Å; S465-A469 WeakPolarHBondContact O-CB 3.43Å; S465-A469 PolarHBondContact O-N 3.32Å
466S93.9Very high91.9Very high27 Ų2752.2 Ų52.219%0.18929%0.288CS..Hα-helixtrans-64.5-41.2173.5-67.30000112.7G462 W463 K464 A469 I470G462-S466 PolarHBondContact O-N 2.82Å; G462-S466 PolarHBondContact O-OG 3.44Å; W463-S466 PolarHBondContact O-N 2.87Å; K464-S466 VanDerWaalsContact C-N 3.29Å; K464-S466 PolarHBondContact O-N 3.06Å; S466-A469 PolarHBondContact O-N 2.79Å; S466-I470 WeakPolarHBondContact O-CG1 3.23Å; S466-I470 PolarHBondContact O-N 3.19Å
467I93.9Very high92.1Very high0 Ų054 Ų540%030%0.297CS..Hα-helixtrans-63.9-44174.5-71.8176.2000110.9F415 W463 K464 A469 I470 N471 L492 L495 L526 F533F415-I467 HydrophobicContact CE2-CG1 4.44Å; F415-I467 HydrophobicContact CZ-CG1 4.1Å; W463-I467 HydrophobicContact CE3-CD1 3.63Å; W463-I467 HydrophobicContact CZ3-CD1 3.82Å; W463-I467 WeakPolarHBondContact O-CG1 3.21Å; W463-I467 PolarHBondContact O-N 2.78Å; K464-I467 PolarHBondContact O-N 3.33Å; I467-A469 VanDerWaalsContact C-N 3.34Å; I467-A469 PolarHBondContact O-N 3.2Å; I467-I470 WeakPolarHBondContact O-CB 3.32Å; I467-I470 PolarHBondContact O-N 2.82Å; I467-N471 PolarHBondContact O-N 2.93Å; I467-L492 HydrophobicContact CG1-CD2 4.33Å; I467-L492 HydrophobicContact CG2-CD2 4.05Å; I467-L495 HydrophobicContact CD1-CD2 4.01Å; I467-L495 HydrophobicContact CG1-CD2 3.99Å; I467-L526 HydrophobicContact CD1-CD1 4.03Å; I467-F533 HydrophobicContact CG2-CD2 3.99Å; I467-F533 HydrophobicContact CG2-CE2 3.36Å; I467-F533 HydrophobicContact CG2-CZ 3.79Å
468E93.4Very high92.2Very high75 Ų7547.3 Ų47.335%0.3527%0.273SS..Hα-helixtrans-64.1-40.6177.6-171.357.6-134.100111.4K464 S465 I470 N471 Q472K464-E468 PolarHBondContact O-N 3.47Å; S465-E468 PolarHBondContact O-N 2.86Å; E468-I470 PolarHBondContact O-N 3.41Å; E468-N471 WeakPolarHBondContact O-CB 3.48Å; E468-N471 PolarHBondContact O-N 3.44Å; E468-N471 PolarHBondContact OE1-ND2 3.29Å; E468-Q472 WeakPolarHBondContact O-CG 3.44Å; E468-Q472 PolarHBondContact O-N 2.87Å; E468-Q472 PolarHBondContact OE1-NE2 3.11Å
469A94.4Very high91.9Very high41 Ų4147.8 Ų47.834%0.33928%0.276SS..Hα-helixtrans-60.2-44.6174.500000111.8S465 S466 I467 N471 Q472 E473S465-A469 WeakPolarHBondContact O-CB 3.43Å; S465-A469 PolarHBondContact O-N 3.32Å; S466-A469 PolarHBondContact O-N 2.79Å; I467-A469 VanDerWaalsContact C-N 3.34Å; I467-A469 PolarHBondContact O-N 3.2Å; A469-N471 VanDerWaalsContact C-N 3.35Å; A469-N471 PolarHBondContact O-N 3.23Å; A469-Q472 PolarHBondContact O-N 3.43Å; A469-E473 VanDerWaalsContact O-CB 3.31Å; A469-E473 WeakPolarHBondContact O-CB 3.45Å; A469-E473 PolarHBondContact O-N 3.11Å
470I94.8Very high91.5Very high0 Ų049.2 Ų49.20%028%0.284CS..Hα-helixtrans-58.3-47.2173.2-74.5163.4000110.8L410 H414 F415 S466 I467 E468 E473 V474 L488L410-I470 HydrophobicContact CD1-CG2 4.08Å; H414-I470 HydrophobicContact CB-CD1 3.93Å; H414-I470 HydrophobicContact CB-CG1 4.19Å; H414-I470 WeakPolarHBondContact CD2-CG1 3.33Å; F415-I470 HydrophobicContact CD2-CD1 4.09Å; F415-I470 HydrophobicContact CE2-CD1 3.69Å; S466-I470 WeakPolarHBondContact O-CG1 3.23Å; S466-I470 PolarHBondContact O-N 3.19Å; I467-I470 WeakPolarHBondContact O-CB 3.32Å; I467-I470 PolarHBondContact O-N 2.82Å; E468-I470 PolarHBondContact O-N 3.41Å; I470-E473 PolarHBondContact O-N 3.16Å; I470-V474 HydrophobicContact CG2-CG2 4.24Å; I470-V474 WeakPolarHBondContact O-CB 3.32Å; I470-V474 VanDerWaalsContact O-CG2 3.24Å; I470-V474 WeakPolarHBondContact O-CG2 3.23Å; I470-V474 PolarHBondContact O-N 3.03Å; I470-L488 HydrophobicContact CG2-CD1 3.87Å
471N93.5Very high91.4Very high22 Ų2252 Ų5212%0.11829%0.294CS..Hα-helixtrans-58.6-52.8179.2174.855.5000111.6I467 E468 A469 E473 V474 M475 L488 F533I467-N471 PolarHBondContact O-N 2.93Å; E468-N471 WeakPolarHBondContact O-CB 3.48Å; E468-N471 PolarHBondContact O-N 3.44Å; E468-N471 PolarHBondContact OE1-ND2 3.29Å; A469-N471 VanDerWaalsContact C-N 3.35Å; A469-N471 PolarHBondContact O-N 3.23Å; N471-E473 PolarHBondContact O-N 2.87Å; N471-V474 PolarHBondContact O-N 3.24Å; N471-M475 WeakPolarHBondContact O-CB 3.22Å; N471-M475 WeakPolarHBondContact O-CG 3.44Å; N471-M475 PolarHBondContact O-N 2.92Å; N471-L488 HydrophobicContact CB-CD1 4.35Å; N471-L488 HydrophobicContact CB-CD2 4.35Å; N471-L488 WeakPolarHBondContact OD1-CD2 3.45Å; N471-F533 HydrophobicContact CB-CD1 3.94Å; N471-F533 HydrophobicContact CB-CE1 3.63Å; N471-F533 HydrophobicContact CB-CZ 4.44Å; N471-F533 VanDerWaalsContact CG-CE1 3.46Å; N471-F533 WeakPolarHBondContact ND2-CE1 3.23Å
472Q93.1Very high91.3Very high106 Ų10653.1 Ų53.150%0.49528%0.283SS..Hα-helixtrans-57.4-40.9178.9-68.1-58.8-33.900111.9E468 A469 M475 T476E468-Q472 WeakPolarHBondContact O-CG 3.44Å; E468-Q472 PolarHBondContact O-N 2.87Å; E468-Q472 PolarHBondContact OE1-NE2 3.11Å; A469-Q472 PolarHBondContact O-N 3.43Å; Q472-M475 PolarHBondContact O-N 2.89Å; Q472-T476 WeakPolarHBondContact O-CB 3.35Å; Q472-T476 PolarHBondContact O-N 3.41Å; Q472-T476 PolarHBondContact O-OG1 3.45Å
473E93.6Very high91.2Very high40 Ų4052.1 Ų52.119%0.18727%0.272CS..Hα-helixtrans-69.7-44.5-178.8-157.8-163.3103.100112.7K370 Y406 L410 H414 A469 I470 N471 M475 T476 N477K370-E473 WeakPolarHBondContact CE-OE1 3.28Å; K370-E473 IonicContact NZ-OE1 3.79Å; K370-E473 PolarHBondContact NZ-OE1 3.38Å; K370-E473 IonicContact NZ-OE2 2.65Å; K370-E473 PolarHBondContact NZ-OE2 3.07Å; Y406-E473 PolarHBondContact OH-OE1 3.18Å; Y406-E473 VanDerWaalsContact OH-OE1 3.12Å; L410-E473 WeakPolarHBondContact CD2-OE1 3.48Å; H414-E473 IonicContact NE2-OE2 3.25Å; A469-E473 VanDerWaalsContact O-CB 3.31Å; A469-E473 WeakPolarHBondContact O-CB 3.45Å; A469-E473 PolarHBondContact O-N 3.11Å; I470-E473 PolarHBondContact O-N 3.16Å; N471-E473 PolarHBondContact O-N 2.87Å; E473-M475 VanDerWaalsContact C-N 3.33Å; E473-M475 PolarHBondContact O-N 3.35Å; E473-T476 PolarHBondContact O-N 2.78Å; E473-N477 WeakPolarHBondContact O-CB 3.36Å; E473-N477 PolarHBondContact O-N 3.33Å; E473-N477 PolarHBondContact O-ND2 3.03Å
474V93.9Very high91.1Very high0 Ų051.6 Ų51.60%027%0.27CS..Hα-helixtrans-61.1-44.1174.3171.50000110.5Y406 L410 I470 N471 T476 N477 F478 S484 V487 L488Y406-V474 HydrophobicContact CE1-CG2 4.32Å; L410-V474 HydrophobicContact CD1-CG2 3.7Å; I470-V474 HydrophobicContact CG2-CG2 4.24Å; I470-V474 WeakPolarHBondContact O-CB 3.32Å; I470-V474 VanDerWaalsContact O-CG2 3.24Å; I470-V474 WeakPolarHBondContact O-CG2 3.23Å; I470-V474 PolarHBondContact O-N 3.03Å; N471-V474 PolarHBondContact O-N 3.24Å; V474-T476 PolarHBondContact O-N 3.37Å; V474-N477 PolarHBondContact O-N 3.17Å; V474-F478 HydrophobicContact CB-CD2 4.45Å; V474-F478 HydrophobicContact CB-CE2 4.41Å; V474-F478 HydrophobicContact CG1-CD2 3.76Å; V474-F478 HydrophobicContact CG1-CE2 3.94Å; V474-F478 HydrophobicContact CG2-CE2 4.43Å; V474-F478 WeakPolarHBondContact O-CD2 3.49Å; V474-F478 PolarHBondContact O-N 3.36Å; V474-S484 WeakPolarHBondContact CG1-O 3.32Å; V474-V487 HydrophobicContact CG1-CB 4.16Å; V474-V487 HydrophobicContact CG1-CG1 4.18Å; V474-V487 HydrophobicContact CG2-CG1 4.19Å; V474-L488 HydrophobicContact CG1-CB 4.06Å
475M90.4Very high91.1Very high80 Ų8046.7 Ų46.739%0.39425%0.25SS..Hα-helixtrans-65.6-24.2178.9-66.7-64.9-77.700112.9N471 Q472 E473 F481N471-M475 WeakPolarHBondContact O-CB 3.22Å; N471-M475 WeakPolarHBondContact O-CG 3.44Å; N471-M475 PolarHBondContact O-N 2.92Å; Q472-M475 PolarHBondContact O-N 2.89Å; E473-M475 VanDerWaalsContact C-N 3.33Å; E473-M475 PolarHBondContact O-N 3.35Å; M475-F481 HydrophobicContact CE-CD2 3.94Å; M475-F481 HydrophobicContact CE-CE2 4Å
476T91.2Very high91Very high103 Ų10345 Ų4563%0.63223%0.234SC*.Hα-helixtrans-85.4-37.1177.3-56.10000112.7Q472 E473 V474Q472-T476 WeakPolarHBondContact O-CB 3.35Å; Q472-T476 PolarHBondContact O-N 3.41Å; Q472-T476 PolarHBondContact O-OG1 3.45Å; E473-T476 PolarHBondContact O-N 2.78Å; V474-T476 PolarHBondContact O-N 3.37Å
477N92.1Very high91Very high38 Ų3843.7 Ų43.720%0.20323%0.225CC..Hα-helixtrans-85.4-18.9-169.7-74.6-17.4000114.7A316 V374 N378 Y406 E473 V474A316-N477 WeakPolarHBondContact CA-O 3.31Å; A316-N477 WeakPolarHBondContact CB-O 3.4Å; V374-N477 HydrophobicContact CG1-CB 4.01Å; V374-N477 WeakPolarHBondContact CG1-O 3.45Å; V374-N477 HydrophobicContact CG2-CB 3.97Å; N378-N477 PolarHBondContact ND2-O 3.48Å; Y406-N477 PolarHBondContact OH-ND2 2.94Å; E473-N477 WeakPolarHBondContact O-CB 3.36Å; E473-N477 PolarHBondContact O-N 3.33Å; E473-N477 PolarHBondContact O-ND2 3.03Å; V474-N477 PolarHBondContact O-N 3.17Å
478F90.8Very high91Very high11 Ų1144 Ų445%0.04823%0.226CC..SBendtrans-112144.2-175.8-57.7-72.2000113.3V374 I377 N378 Y406 V474 N480 I483 S484 V487V374-F478 HydrophobicContact CG2-CE1 4.43Å; V374-F478 HydrophobicContact CG2-CZ 4.39Å; I377-F478 HydrophobicContact CB-CD1 4.4Å; I377-F478 HydrophobicContact CB-CE1 3.83Å; I377-F478 HydrophobicContact CD1-CE1 3.86Å; I377-F478 HydrophobicContact CD1-CZ 4.07Å; I377-F478 HydrophobicContact CG1-CE1 4.47Å; I377-F478 HydrophobicContact CG2-CD1 3.82Å; I377-F478 HydrophobicContact CG2-CE1 3.53Å; I377-F478 HydrophobicContact CG2-CZ 4.47Å; N378-F478 WeakPolarHBondContact OD1-CA 3.28Å; Y406-F478 HydrophobicContact CD1-CE2 4.19Å; Y406-F478 AromaticContact CD1-CZ 3.77Å; Y406-F478 HydrophobicContact CD1-CZ 3.77Å; Y406-F478 AromaticContact CE1-CE2 3.61Å; Y406-F478 HydrophobicContact CE1-CE2 3.61Å; Y406-F478 AromaticContact CE1-CZ 3.52Å; Y406-F478 HydrophobicContact CE1-CZ 3.52Å; Y406-F478 HydrophobicContact CE2-CZ 4.31Å; Y406-F478 HydrophobicContact CG-CZ 4.25Å; Y406-F478 AromaticContact CZ-CZ 3.83Å; V474-F478 HydrophobicContact CB-CD2 4.45Å; V474-F478 HydrophobicContact CB-CE2 4.41Å; V474-F478 HydrophobicContact CG1-CD2 3.76Å; V474-F478 HydrophobicContact CG1-CE2 3.94Å; V474-F478 HydrophobicContact CG2-CE2 4.43Å; V474-F478 WeakPolarHBondContact O-CD2 3.49Å; V474-F478 PolarHBondContact O-N 3.36Å; F478-N480 PolarHBondContact O-N 2.98Å; F478-I483 HydrophobicContact CB-CG2 3.81Å; F478-S484 WeakPolarHBondContact CB-OG 3.21Å; F478-V487 HydrophobicContact CD2-CB 4.33Å; F478-V487 HydrophobicContact CD2-CG1 4.43Å; F478-V487 HydrophobicContact CD2-CG2 4.26Å; F478-V487 HydrophobicContact CE1-CG2 4.24Å; F478-V487 HydrophobicContact CE2-CB 3.9Å; F478-V487 HydrophobicContact CE2-CG1 3.56Å; F478-V487 HydrophobicContact CE2-CG2 3.89Å; F478-V487 HydrophobicContact CZ-CB 4.31Å; F478-V487 HydrophobicContact CZ-CG1 3.88Å; F478-V487 HydrophobicContact CZ-CG2 3.86Å
479S81.5Confident91Very high57 Ų5742.4 Ų42.440%0.39922%0.219SC..SBendtrans-74.6-23-165.259.40000115.6N378N378-S479 PolarHBondContact OD1-N 2.96Å; N378-S479 PolarHBondContact OD1-OG 3.12Å; N378-S479 VanDerWaalsContact OD1-OG 3.12Å
480N84Confident91Very high46 Ų4641.8 Ų41.825%0.24621%0.21CC..SBendtrans-141.4152.5-179.576.557.5000111.7D381 F478 R482 I483 S484D381-N480 PolarHBondContact OD2-ND2 3.45Å; F478-N480 PolarHBondContact O-N 2.98Å; N480-R482 PolarHBondContact O-N 2.61Å; N480-R482 WeakPolarHBondContact OD1-CA 3.3Å; N480-R482 WeakPolarHBondContact OD1-CB 3.15Å; N480-R482 PolarHBondContact OD1-N 2.84Å; N480-I483 VanDerWaalsContact O-CG2 3.28Å; N480-I483 WeakPolarHBondContact O-CG2 3.2Å; N480-I483 PolarHBondContact O-N 3.25Å; N480-I483 WeakPolarHBondContact OD1-CG2 3.31Å; N480-I483 PolarHBondContact OD1-N 3.46Å; N480-S484 PolarHBondContact O-N 3.36Å; N480-S484 PolarHBondContact O-OG 2.89Å
481F87.2Confident91Very high110 Ų11041.8 Ų41.848%0.48221%0.21SC..Hα-helixtrans-59.6-32.3-176.4-177.2-103.4000113.5M475 S485 P535 F537M475-F481 HydrophobicContact CE-CD2 3.94Å; M475-F481 HydrophobicContact CE-CE2 4Å; F481-S485 WeakPolarHBondContact O-CB 3.44Å; F481-S485 PolarHBondContact O-N 3.42Å; F481-P535 HydrophobicContact CE1-CB 4.32Å; F481-F537 HydrophobicContact CD1-CE1 4.47Å; F481-F537 HydrophobicContact CE1-CE1 4.45Å
482R87Confident91.1Very high125 Ų12540.7 Ų40.747%0.47220%0.204SC..Hα-helixtrans-66.4-48.4-178.4-173.7-175-175.7-174.62.5111L385 N480 N486L385-R482 VanDerWaalsContact CD2-NH1 3.34Å; N480-R482 PolarHBondContact O-N 2.61Å; N480-R482 WeakPolarHBondContact OD1-CA 3.3Å; N480-R482 WeakPolarHBondContact OD1-CB 3.15Å; N480-R482 PolarHBondContact OD1-N 2.84Å; R482-N486 WeakPolarHBondContact O-CB 3.43Å; R482-N486 PolarHBondContact O-N 2.82Å
483I88.1Confident91.2Very high1 Ų139.9 Ų39.91%0.00521%0.206CC..Hα-helixtrans-71.7-39.2178.1-169.260.2000111.2I377 D381 L399 V403 F478 N480 S485 N486 V487I377-I483 HydrophobicContact CG2-CD1 3.92Å; I377-I483 HydrophobicContact CG2-CG1 3.66Å; D381-I483 HydrophobicContact CB-CB 4.47Å; D381-I483 HydrophobicContact CB-CD1 4.34Å; D381-I483 HydrophobicContact CB-CG1 4.22Å; L399-I483 HydrophobicContact CD1-CD1 4.45Å; V403-I483 HydrophobicContact CG2-CD1 4.48Å; F478-I483 HydrophobicContact CB-CG2 3.81Å; N480-I483 VanDerWaalsContact O-CG2 3.28Å; N480-I483 WeakPolarHBondContact O-CG2 3.2Å; N480-I483 PolarHBondContact O-N 3.25Å; N480-I483 WeakPolarHBondContact OD1-CG2 3.31Å; N480-I483 PolarHBondContact OD1-N 3.46Å; I483-S485 VanDerWaalsContact C-N 3.28Å; I483-S485 PolarHBondContact O-N 2.87Å; I483-N486 HydrophobicContact CD1-CB 4.4Å; I483-N486 PolarHBondContact O-N 3.33Å; I483-N486 VanDerWaalsContact O-N 3.15Å; I483-V487 HydrophobicContact CD1-CG2 4.27Å; I483-V487 HydrophobicContact CG1-CG2 4.27Å; I483-V487 WeakPolarHBondContact O-CG2 3.23Å; I483-V487 PolarHBondContact O-N 3.33Å
484S91.6Very high91.2Very high4 Ų439.5 Ų39.53%0.02821%0.205CC..Hα-helixtrans-56.5-47174.1-54.10000110.4V474 F478 N480 V487 L488V474-S484 WeakPolarHBondContact CG1-O 3.32Å; F478-S484 WeakPolarHBondContact CB-OG 3.21Å; N480-S484 PolarHBondContact O-N 3.36Å; N480-S484 PolarHBondContact O-OG 2.89Å; S484-V487 PolarHBondContact O-N 3.36Å; S484-L488 VanDerWaalsContact O-CB 3.31Å; S484-L488 WeakPolarHBondContact O-CB 3.37Å; S484-L488 PolarHBondContact O-N 2.81Å
485S91.1Very high91.3Very high8 Ų839.5 Ų39.56%0.05621%0.205CC..Hα-helixtrans-65-41.5177.5179.50000112.4F481 I483 L488 Q489 P535F481-S485 WeakPolarHBondContact O-CB 3.44Å; F481-S485 PolarHBondContact O-N 3.42Å; I483-S485 VanDerWaalsContact C-N 3.28Å; I483-S485 PolarHBondContact O-N 2.87Å; S485-L488 PolarHBondContact O-N 3.17Å; S485-Q489 WeakPolarHBondContact O-CB 3.47Å; S485-Q489 VanDerWaalsContact O-CG 3.24Å; S485-Q489 WeakPolarHBondContact O-CG 3.49Å; S485-Q489 PolarHBondContact O-N 3.42Å; S485-P535 VanDerWaalsContact OG-CB 3.25Å; S485-P535 WeakPolarHBondContact OG-CB 3.27Å; S485-P535 WeakPolarHBondContact OG-CD 3.44Å; S485-P535 WeakPolarHBondContact OG-CG 3.31Å
486N90.9Very high91.4Very high51 Ų5137.1 Ų37.127%0.27320%0.195SC..Hα-helixtrans-61.6-47.9177.6-175.840.1000111.5R482 I483 L488 Q489 N490R482-N486 WeakPolarHBondContact O-CB 3.43Å; R482-N486 PolarHBondContact O-N 2.82Å; I483-N486 HydrophobicContact CD1-CB 4.4Å; I483-N486 PolarHBondContact O-N 3.33Å; I483-N486 VanDerWaalsContact O-N 3.15Å; N486-L488 PolarHBondContact O-N 2.89Å; N486-Q489 PolarHBondContact O-N 3.17Å; N486-N490 WeakPolarHBondContact O-CB 3.36Å; N486-N490 PolarHBondContact O-N 2.99Å
487V94.2Very high91.5Very high0 Ų035 Ų350%018%0.184CC..Hα-helixtrans-61.5-45.6177.9174.40000110.9I377 V403 Y406 V474 F478 I483 S484 N490 C491I377-V487 HydrophobicContact CG2-CG2 4.3Å; V403-V487 HydrophobicContact CG1-CG2 4.06Å; V403-V487 HydrophobicContact CG2-CG2 4.01Å; Y406-V487 HydrophobicContact CD1-CG1 3.6Å; Y406-V487 HydrophobicContact CE1-CG1 3.86Å; V474-V487 HydrophobicContact CG1-CB 4.16Å; V474-V487 HydrophobicContact CG1-CG1 4.18Å; V474-V487 HydrophobicContact CG2-CG1 4.19Å; F478-V487 HydrophobicContact CD2-CB 4.33Å; F478-V487 HydrophobicContact CD2-CG1 4.43Å; F478-V487 HydrophobicContact CD2-CG2 4.26Å; F478-V487 HydrophobicContact CE1-CG2 4.24Å; F478-V487 HydrophobicContact CE2-CB 3.9Å; F478-V487 HydrophobicContact CE2-CG1 3.56Å; F478-V487 HydrophobicContact CE2-CG2 3.89Å; F478-V487 HydrophobicContact CZ-CB 4.31Å; F478-V487 HydrophobicContact CZ-CG1 3.88Å; F478-V487 HydrophobicContact CZ-CG2 3.86Å; I483-V487 HydrophobicContact CD1-CG2 4.27Å; I483-V487 HydrophobicContact CG1-CG2 4.27Å; I483-V487 WeakPolarHBondContact O-CG2 3.23Å; I483-V487 PolarHBondContact O-N 3.33Å; S484-V487 PolarHBondContact O-N 3.36Å; V487-N490 PolarHBondContact O-N 3.34Å; V487-C491 WeakPolarHBondContact O-CB 3.31Å; V487-C491 PolarHBondContact O-N 3.41Å
488L94.9Very high91.6Very high5 Ų534.1 Ų34.13%0.02618%0.178CC..Hα-helixtrans-60.9-48.4178.1-17657.8000111.3I470 N471 V474 S484 S485 N486 N490 C491 L492 F533I470-L488 HydrophobicContact CG2-CD1 3.87Å; N471-L488 HydrophobicContact CB-CD1 4.35Å; N471-L488 HydrophobicContact CB-CD2 4.35Å; N471-L488 WeakPolarHBondContact OD1-CD2 3.45Å; V474-L488 HydrophobicContact CG1-CB 4.06Å; S484-L488 VanDerWaalsContact O-CB 3.31Å; S484-L488 WeakPolarHBondContact O-CB 3.37Å; S484-L488 PolarHBondContact O-N 2.81Å; S485-L488 PolarHBondContact O-N 3.17Å; N486-L488 PolarHBondContact O-N 2.89Å; L488-N490 VanDerWaalsContact C-N 3.31Å; L488-N490 PolarHBondContact O-N 3.39Å; L488-C491 PolarHBondContact O-N 2.71Å; L488-L492 HydrophobicContact CD1-CD1 4.11Å; L488-L492 HydrophobicContact CD1-CG 4.14Å; L488-L492 HydrophobicContact CG-CD1 4Å; L488-L492 HydrophobicContact CG-CG 4.4Å; L488-L492 VanDerWaalsContact O-CG 3.28Å; L488-L492 WeakPolarHBondContact O-CG 3.18Å; L488-L492 PolarHBondContact O-N 2.62Å; L488-F533 HydrophobicContact CD2-CB 3.82Å; L488-F533 HydrophobicContact CD2-CD1 4.07Å; L488-F533 HydrophobicContact CD2-CG 4.24Å; L488-F533 HydrophobicContact CG-CB 4.45Å
489Q93.1Very high91.7Very high43 Ų4333.6 Ų33.620%0.20118%0.176CC..Hα-helixtrans-63-38.2179-71.4-59-54.500112S485 N486 L492 T493 F533S485-Q489 WeakPolarHBondContact O-CB 3.47Å; S485-Q489 VanDerWaalsContact O-CG 3.24Å; S485-Q489 WeakPolarHBondContact O-CG 3.49Å; S485-Q489 PolarHBondContact O-N 3.42Å; N486-Q489 PolarHBondContact O-N 3.17Å; Q489-L492 PolarHBondContact O-N 3.4Å; Q489-T493 VanDerWaalsContact O-CB 3.29Å; Q489-T493 WeakPolarHBondContact O-CB 3.41Å; Q489-T493 PolarHBondContact O-N 3.03Å; Q489-T493 PolarHBondContact O-OG1 3.24Å; Q489-F533 VanDerWaalsContact NE2-C 3.31Å; Q489-F533 PolarHBondContact NE2-O 2.9Å
490N94.4Very high92.2Very high27 Ų2736.6 Ų36.614%0.14418%0.183CC..Hα-helixtrans-63.5-46.7175-165.856.4000111.5V403 N404 N486 V487 L488 L492 T493 Q494V403-N490 HydrophobicContact CG1-CB 3.91Å; V403-N490 PolarHBondContact O-ND2 3.24Å; N404-N490 PolarHBondContact OD1-ND2 3.1Å; N404-N490 PolarHBondContact OD1-OD1 3.47Å; N486-N490 WeakPolarHBondContact O-CB 3.36Å; N486-N490 PolarHBondContact O-N 2.99Å; V487-N490 PolarHBondContact O-N 3.34Å; L488-N490 VanDerWaalsContact C-N 3.31Å; L488-N490 PolarHBondContact O-N 3.39Å; N490-L492 PolarHBondContact O-N 3.24Å; N490-T493 PolarHBondContact O-N 3.41Å; N490-Q494 WeakPolarHBondContact O-CG 3.43Å; N490-Q494 PolarHBondContact O-N 3.47Å
491C95.6Very high92.5Very high0 Ų037 Ų370%018%0.181CC..Hα-helixtrans-59.9-46.3176.6-174.30000112.2A407 V487 L488 T493 Q494 L495A407-C491 HydrophobicContact CB-CB 4.01Å; V487-C491 WeakPolarHBondContact O-CB 3.31Å; V487-C491 PolarHBondContact O-N 3.41Å; L488-C491 PolarHBondContact O-N 2.71Å; C491-T493 PolarHBondContact O-N 2.96Å; C491-Q494 PolarHBondContact O-N 3.39Å; C491-L495 PolarHBondContact O-N 3.35Å
492L94.9Very high92.7Very high0 Ų032 Ų320%016%0.159CC..Hα-helixtrans-67.8-36.1178.3-64.2177.5000112.4I467 L488 Q489 N490 L495 V496 V530 F533I467-L492 HydrophobicContact CG1-CD2 4.33Å; I467-L492 HydrophobicContact CG2-CD2 4.05Å; L488-L492 HydrophobicContact CD1-CD1 4.11Å; L488-L492 HydrophobicContact CD1-CG 4.14Å; L488-L492 HydrophobicContact CG-CD1 4Å; L488-L492 HydrophobicContact CG-CG 4.4Å; L488-L492 VanDerWaalsContact O-CG 3.28Å; L488-L492 WeakPolarHBondContact O-CG 3.18Å; L488-L492 PolarHBondContact O-N 2.62Å; Q489-L492 PolarHBondContact O-N 3.4Å; N490-L492 PolarHBondContact O-N 3.24Å; L492-L495 HydrophobicContact CD2-CD2 4.47Å; L492-L495 WeakPolarHBondContact O-CB 3.48Å; L492-L495 PolarHBondContact O-N 2.97Å; L492-V496 WeakPolarHBondContact O-CG2 3.38Å; L492-V496 PolarHBondContact O-N 2.95Å; L492-V530 HydrophobicContact CB-CG1 3.9Å; L492-V530 HydrophobicContact CB-CG2 4.24Å; L492-V530 HydrophobicContact CD1-CG1 4.08Å; L492-V530 HydrophobicContact CD2-CG2 4.35Å; L492-F533 HydrophobicContact CD1-CB 3.82Å; L492-F533 HydrophobicContact CD1-CD2 4.19Å; L492-F533 HydrophobicContact CD1-CG 4.24Å
493T93.9Very high92.8Very high88 Ų8828.6 Ų28.654%0.5415%0.149SC..Hα-helixtrans-64.5-43.7174.9-60.10000111Q489 N490 C491 V496 S497Q489-T493 VanDerWaalsContact O-CB 3.29Å; Q489-T493 WeakPolarHBondContact O-CB 3.41Å; Q489-T493 PolarHBondContact O-N 3.03Å; Q489-T493 PolarHBondContact O-OG1 3.24Å; N490-T493 PolarHBondContact O-N 3.41Å; C491-T493 PolarHBondContact O-N 2.96Å; T493-V496 PolarHBondContact O-N 3Å; T493-S497 PolarHBondContact O-N 3.48Å
494Q94.8Very high92.7Very high32 Ų3235.9 Ų35.915%0.1518%0.181CC..Hα-helixtrans-63.9-41.3174-72.6-1763.600111.9A407 D408 L411 N490 C491 V496 S497 Y498A407-Q494 VanDerWaalsContact CB-OE1 3.23Å; D408-Q494 PolarHBondContact OD1-OE1 3.1Å; L411-Q494 HydrophobicContact CD1-CB 3.52Å; N490-Q494 WeakPolarHBondContact O-CG 3.43Å; N490-Q494 PolarHBondContact O-N 3.47Å; C491-Q494 PolarHBondContact O-N 3.39Å; Q494-V496 VanDerWaalsContact C-N 3.35Å; Q494-V496 PolarHBondContact O-N 3.27Å; Q494-S497 WeakPolarHBondContact O-CA 3.46Å; Q494-S497 VanDerWaalsContact O-CB 3.32Å; Q494-S497 WeakPolarHBondContact O-CB 3.34Å; Q494-S497 PolarHBondContact O-N 2.89Å; Q494-S497 VanDerWaalsContact O-N 3.11Å; Q494-Y498 WeakPolarHBondContact O-CD2 3.14Å; Q494-Y498 PolarHBondContact O-N 2.83Å
495L95.2Very high92.3Very high1 Ų136.1 Ų36.11%0.00518%0.182CC..Hα-helixtrans-57-47.4173.9177.460.4000111.7L411 F415 L418 I467 C491 L492 S497 Y498 Y499L411-L495 HydrophobicContact CD2-CB 3.82Å; L411-L495 HydrophobicContact CD2-CD1 4.15Å; L411-L495 HydrophobicContact CD2-CG 4.46Å; F415-L495 HydrophobicContact CB-CD1 4.44Å; F415-L495 HydrophobicContact CD1-CD1 4.06Å; F415-L495 HydrophobicContact CD2-CD1 3.7Å; F415-L495 HydrophobicContact CD2-CD2 4.35Å; F415-L495 HydrophobicContact CE1-CD1 4.2Å; F415-L495 HydrophobicContact CE2-CD1 3.84Å; F415-L495 HydrophobicContact CE2-CD2 3.68Å; F415-L495 HydrophobicContact CE2-CG 4.41Å; F415-L495 HydrophobicContact CG-CD1 3.81Å; F415-L495 HydrophobicContact CZ-CD1 4.09Å; F415-L495 HydrophobicContact CZ-CD2 3.84Å; L418-L495 HydrophobicContact CD2-CD1 3.97Å; I467-L495 HydrophobicContact CD1-CD2 4.01Å; I467-L495 HydrophobicContact CG1-CD2 3.99Å; C491-L495 PolarHBondContact O-N 3.35Å; L492-L495 HydrophobicContact CD2-CD2 4.47Å; L492-L495 WeakPolarHBondContact O-CB 3.48Å; L492-L495 PolarHBondContact O-N 2.97Å; L495-S497 VanDerWaalsContact C-N 3.27Å; L495-S497 PolarHBondContact O-N 3.49Å; L495-Y498 PolarHBondContact O-N 3.43Å; L495-Y499 WeakPolarHBondContact O-CB 3.34Å; L495-Y499 PolarHBondContact O-N 3.16Å
496V93.2Very high92Very high29 Ų2935.9 Ų35.918%0.17618%0.18CC..Hα-helixtrans-61.3-39.1176.7171.20000110.7L492 T493 Q494 Y499 H500 L526 M527 V530L492-V496 WeakPolarHBondContact O-CG2 3.38Å; L492-V496 PolarHBondContact O-N 2.95Å; T493-V496 PolarHBondContact O-N 3Å; Q494-V496 VanDerWaalsContact C-N 3.35Å; Q494-V496 PolarHBondContact O-N 3.27Å; V496-Y499 PolarHBondContact O-N 3.19Å; V496-H500 WeakPolarHBondContact O-CB 3.44Å; V496-H500 PolarHBondContact O-N 3.4Å; V496-L526 HydrophobicContact CG2-CD2 4.34Å; V496-M527 HydrophobicContact CG1-SD 3.92Å; V496-M527 HydrophobicContact CG2-SD 3.88Å; V496-V530 HydrophobicContact CG2-CG2 4.16Å
497S93.8Very high91.7Very high59 Ų5936 Ų3641%0.41319%0.185SC..Hα-helixtrans-62.1-49174.5-177.80000112.2T493 Q494 L495 Y499 H500 R501T493-S497 PolarHBondContact O-N 3.48Å; Q494-S497 WeakPolarHBondContact O-CA 3.46Å; Q494-S497 VanDerWaalsContact O-CB 3.32Å; Q494-S497 WeakPolarHBondContact O-CB 3.34Å; Q494-S497 PolarHBondContact O-N 2.89Å; Q494-S497 VanDerWaalsContact O-N 3.11Å; L495-S497 VanDerWaalsContact C-N 3.27Å; L495-S497 PolarHBondContact O-N 3.49Å; S497-Y499 VanDerWaalsContact C-N 3.28Å; S497-Y499 PolarHBondContact O-N 3Å; S497-H500 PolarHBondContact O-N 2.87Å; S497-R501 WeakPolarHBondContact O-CG 3.02Å; S497-R501 PolarHBondContact O-N 3.45Å
498Y94Very high90.9Very high20 Ų2037.9 Ų37.98%0.07820%0.196CC..Hα-helixtrans-58.8-39.9174.1-80-67.6000112.1D408 L411 V419 V422 H423 Q494 L495 R501 L502D408-Y498 PolarHBondContact OD1-OH 3.23Å; L411-Y498 HydrophobicContact CD1-CD2 3.86Å; L411-Y498 HydrophobicContact CD1-CE2 3.83Å; V419-Y498 HydrophobicContact CG1-CE1 4.23Å; V419-Y498 HydrophobicContact CG2-CD2 4.45Å; V419-Y498 HydrophobicContact CG2-CE1 4.4Å; V419-Y498 HydrophobicContact CG2-CE2 4.34Å; V422-Y498 HydrophobicContact CB-CD1 4.48Å; V422-Y498 HydrophobicContact CG1-CD1 4.28Å; H423-Y498 AromaticContact CE1-CE1 3.44Å; H423-Y498 VanDerWaalsContact CE1-CE1 3.44Å; H423-Y498 WeakPolarHBondContact CE1-CE1 3.44Å; H423-Y498 AromaticContact CE1-CZ 3.83Å; H423-Y498 PolarHBondContact CE1-OH 2.99Å; Q494-Y498 WeakPolarHBondContact O-CD2 3.14Å; Q494-Y498 PolarHBondContact O-N 2.83Å; L495-Y498 PolarHBondContact O-N 3.43Å; Y498-R501 PolarHBondContact O-N 3.49Å; Y498-L502 PolarHBondContact O-N 3.46Å
499Y92.7Very high89.8Confident0 Ų043 Ų430%023%0.229CC..Hα-helixtrans-66.4-39.3177-163.3-107000112.2F459 L495 V496 S497 L502 H503 L520 V521 I523 L526F459-Y499 HydrophobicContact CD1-CE2 4.02Å; F459-Y499 HydrophobicContact CE1-CD2 4.07Å; F459-Y499 AromaticContact CE1-CE2 3.48Å; F459-Y499 HydrophobicContact CE1-CE2 3.48Å; F459-Y499 VanDerWaalsContact CE1-CE2 3.48Å; F459-Y499 HydrophobicContact CE2-CD2 4.23Å; F459-Y499 HydrophobicContact CE2-CE2 4.36Å; F459-Y499 AromaticContact CZ-CD2 3.76Å; F459-Y499 HydrophobicContact CZ-CD2 3.76Å; F459-Y499 AromaticContact CZ-CE2 3.68Å; F459-Y499 HydrophobicContact CZ-CE2 3.68Å; L495-Y499 WeakPolarHBondContact O-CB 3.34Å; L495-Y499 PolarHBondContact O-N 3.16Å; V496-Y499 PolarHBondContact O-N 3.19Å; S497-Y499 VanDerWaalsContact C-N 3.28Å; S497-Y499 PolarHBondContact O-N 3Å; Y499-L502 HydrophobicContact CD2-CD2 4.4Å; Y499-L502 HydrophobicContact CE2-CD2 4.33Å; Y499-L502 WeakPolarHBondContact O-CB 3.1Å; Y499-L502 PolarHBondContact O-N 3.39Å; Y499-H503 AromaticContact CD1-CD2 3.77Å; Y499-H503 AromaticContact CD1-NE2 3.98Å; Y499-H503 AromaticContact CE1-CD2 3.5Å; Y499-H503 AromaticContact CE1-NE2 3.23Å; Y499-H503 WeakPolarHBondContact CE1-NE2 3.4Å; Y499-H503 AromaticContact CZ-NE2 3.66Å; Y499-H503 PolarHBondContact O-CD2 3.35Å; Y499-H503 PolarHBondContact O-N 2.88Å; Y499-L520 HydrophobicContact CE2-CD2 4.41Å; Y499-V521 PolarHBondContact OH-N 3.29Å; Y499-V521 PolarHBondContact OH-O 2.92Å; Y499-I523 HydrophobicContact CD1-CD1 4.42Å; Y499-I523 HydrophobicContact CD1-CG1 4.31Å; Y499-I523 HydrophobicContact CE1-CB 4.45Å; Y499-L526 HydrophobicContact CD1-CD2 3.65Å; Y499-L526 HydrophobicContact CD2-CD2 4.35Å; Y499-L526 HydrophobicContact CE1-CD2 4.26Å; Y499-L526 HydrophobicContact CG-CD2 3.7Å
500H91.5Very high88.7Confident119 Ų11941.9 Ų41.955%0.55123%0.228SC*.Hα-helixtrans-65.6-41174.7-157.978.4000111.8V496 S497 H503 K504V496-H500 WeakPolarHBondContact O-CB 3.44Å; V496-H500 PolarHBondContact O-N 3.4Å; S497-H500 PolarHBondContact O-N 2.87Å; H500-H503 WeakPolarHBondContact O-CB 3.5Å; H500-H503 PolarHBondContact O-N 3.38Å; H500-K504 PolarHBondContact O-N 3.16Å
501R91.7Very high87.7Confident56 Ų5641 Ų4121%0.21122%0.223CC..Hα-helixtrans-61.8-41.5173.3-72.6161.963.4-167.91.4111.6V422 E426 S497 Y498 H503 K504 V505V422-R501 HydrophobicContact CG1-CB 3.64Å; E426-R501 WeakPolarHBondContact OE1-CB 3.3Å; E426-R501 WeakPolarHBondContact OE1-CG 3.33Å; E426-R501 IonicContact OE1-CZ 3.58Å; E426-R501 IonicContact OE1-NE 2.76Å; E426-R501 PolarHBondContact OE1-NE 3.03Å; E426-R501 IonicContact OE1-NH2 3.4Å; E426-R501 IonicContact OE2-CZ 3.03Å; E426-R501 VanDerWaalsContact OE2-CZ 3.25Å; E426-R501 IonicContact OE2-NE 3.93Å; E426-R501 PolarHBondContact OE2-NE 2.9Å; E426-R501 VanDerWaalsContact OE2-NE 3.16Å; E426-R501 IonicContact OE2-NH2 3.83Å; E426-R501 PolarHBondContact OE2-NH2 2.7Å; S497-R501 WeakPolarHBondContact O-CG 3.02Å; S497-R501 PolarHBondContact O-N 3.45Å; Y498-R501 PolarHBondContact O-N 3.49Å; R501-H503 PolarHBondContact O-N 3.17Å; R501-K504 WeakPolarHBondContact O-CB 3.5Å; R501-K504 PolarHBondContact O-N 2.98Å; R501-K504 VanDerWaalsContact O-N 3.16Å; R501-V505 WeakPolarHBondContact O-CG2 3.25Å; R501-V505 PolarHBondContact O-N 2.68Å
502L90.7Very high86.7Confident3 Ų343.2 Ų43.22%0.01624%0.239CC..Hα-helixtrans-57.7-47.4172.2176.568.6000111.6L418 F421 V422 L455 Y498 Y499 K504 V505 L506 L520L418-L502 HydrophobicContact CD1-CB 3.89Å; L418-L502 HydrophobicContact CD1-CD1 4.4Å; L418-L502 HydrophobicContact CD1-CD2 3.62Å; L418-L502 HydrophobicContact CD1-CG 4.16Å; F421-L502 HydrophobicContact CD1-CD1 3.57Å; F421-L502 HydrophobicContact CE1-CD1 3.61Å; V422-L502 HydrophobicContact CG2-CB 3.89Å; V422-L502 HydrophobicContact CG2-CD1 4.39Å; L455-L502 HydrophobicContact CD2-CD1 3.71Å; L455-L502 HydrophobicContact CD2-CD2 4.05Å; Y498-L502 PolarHBondContact O-N 3.46Å; Y499-L502 HydrophobicContact CD2-CD2 4.4Å; Y499-L502 HydrophobicContact CE2-CD2 4.33Å; Y499-L502 WeakPolarHBondContact O-CB 3.1Å; Y499-L502 PolarHBondContact O-N 3.39Å; L502-K504 VanDerWaalsContact C-N 3.29Å; L502-K504 PolarHBondContact O-N 3.04Å; L502-V505 PolarHBondContact O-N 2.86Å; L502-L506 HydrophobicContact CD1-CD1 3.86Å; L502-L506 HydrophobicContact CD1-CG 4.04Å; L502-L506 HydrophobicContact CD2-CD1 4.38Å; L502-L506 HydrophobicContact CG-CD1 3.85Å; L502-L506 HydrophobicContact CG-CG 4.36Å; L502-L506 WeakPolarHBondContact O-CB 3.45Å; L502-L506 WeakPolarHBondContact O-CG 3.49Å; L502-L506 PolarHBondContact O-N 3.31Å; L502-L520 HydrophobicContact CD2-CD2 4.03Å
503H88.4Confident85.8Confident55 Ų5547.3 Ų47.326%0.25527%0.267SS..Hα-helixtrans-58.4-41175.9-92.5-86.2000112.3Y499 H500 R501 S507Y499-H503 AromaticContact CD1-CD2 3.77Å; Y499-H503 AromaticContact CD1-NE2 3.98Å; Y499-H503 AromaticContact CE1-CD2 3.5Å; Y499-H503 AromaticContact CE1-NE2 3.23Å; Y499-H503 WeakPolarHBondContact CE1-NE2 3.4Å; Y499-H503 AromaticContact CZ-NE2 3.66Å; Y499-H503 PolarHBondContact O-CD2 3.35Å; Y499-H503 PolarHBondContact O-N 2.88Å; H500-H503 WeakPolarHBondContact O-CB 3.5Å; H500-H503 PolarHBondContact O-N 3.38Å; R501-H503 PolarHBondContact O-N 3.17Å; H503-S507 WeakPolarHBondContact O-CB 3.33Å; H503-S507 PolarHBondContact O-N 3.06Å; H503-S507 PolarHBondContact O-OG 3.44Å
504K86.1Confident84.9Confident154 Ų15443.7 Ų43.767%0.6724%0.244SC*.Hα-helixtrans-63.6-47177.3-172.8179.9178.4-175.10111.4H500 R501 L502 S507 T508H500-K504 PolarHBondContact O-N 3.16Å; R501-K504 WeakPolarHBondContact O-CB 3.5Å; R501-K504 PolarHBondContact O-N 2.98Å; R501-K504 VanDerWaalsContact O-N 3.16Å; L502-K504 VanDerWaalsContact C-N 3.29Å; L502-K504 PolarHBondContact O-N 3.04Å; K504-S507 PolarHBondContact O-N 3.12Å; K504-S507 VanDerWaalsContact O-N 3.17Å; K504-T508 PolarHBondContact O-N 3.37Å
505V84.4Confident84.2Confident8 Ų845.7 Ų45.75%0.04826%0.261CS..Hα-helixtrans-60.7-46.7176.5164.80000111.6F421 C425 E426 R501 L502 S507 T508 L511F421-V505 HydrophobicContact CE1-CG1 4.1Å; C425-V505 HydrophobicContact CB-CB 4.23Å; C425-V505 HydrophobicContact CB-CG1 3.33Å; C425-V505 HydrophobicContact CB-CG2 3.79Å; C425-V505 WeakPolarHBondContact SG-CG1 3.22Å; E426-V505 HydrophobicContact CG-CG2 4.24Å; R501-V505 WeakPolarHBondContact O-CG2 3.25Å; R501-V505 PolarHBondContact O-N 2.68Å; L502-V505 PolarHBondContact O-N 2.86Å; V505-S507 PolarHBondContact O-N 2.94Å; V505-T508 VanDerWaalsContact O-CB 3.25Å; V505-T508 WeakPolarHBondContact O-CB 3.15Å; V505-T508 PolarHBondContact O-N 3.04Å; V505-T508 VanDerWaalsContact O-N 3.13Å; V505-T508 PolarHBondContact O-OG1 3.04Å; V505-T508 VanDerWaalsContact O-OG1 3.05Å; V505-L511 HydrophobicContact CG1-CD1 3.8Å
506L84.6Confident83.3Confident3 Ų345.8 Ų45.82%0.01626%0.261CS..Hα-helixtrans-70.3-15.7178.6-68176.3000113.1F421 A452 L502 L511 S512 L514 L520F421-L506 HydrophobicContact CE1-CD2 4.4Å; F421-L506 HydrophobicContact CZ-CD2 4.47Å; A452-L506 HydrophobicContact CB-CD2 4.14Å; L502-L506 HydrophobicContact CD1-CD1 3.86Å; L502-L506 HydrophobicContact CD1-CG 4.04Å; L502-L506 HydrophobicContact CD2-CD1 4.38Å; L502-L506 HydrophobicContact CG-CD1 3.85Å; L502-L506 HydrophobicContact CG-CG 4.36Å; L502-L506 WeakPolarHBondContact O-CB 3.45Å; L502-L506 WeakPolarHBondContact O-CG 3.49Å; L502-L506 PolarHBondContact O-N 3.31Å; L506-L511 CarbonylContact O-C 3.59Å; L506-S512 WeakPolarHBondContact O-CA 3.42Å; L506-S512 PolarHBondContact O-N 3.5Å; L506-L514 HydrophobicContact CD2-CD1 4.15Å; L506-L520 HydrophobicContact CD1-CD1 3.78Å; L506-L520 HydrophobicContact CD1-CD2 4.23Å; L506-L520 HydrophobicContact CD1-CG 4.41Å
507S83.1Confident82.6Confident55 Ų5549.3 Ų49.339%0.38527%0.272SS..THydrogen-bonded Turntrans-86.2-8.5173.9-58.90000113.1H503 K504 V505H503-S507 WeakPolarHBondContact O-CB 3.33Å; H503-S507 PolarHBondContact O-N 3.06Å; H503-S507 PolarHBondContact O-OG 3.44Å; K504-S507 PolarHBondContact O-N 3.12Å; K504-S507 VanDerWaalsContact O-N 3.17Å; V505-S507 PolarHBondContact O-N 2.94Å
508T79.1Confident82Confident39 Ų3953.5 Ų53.524%0.23929%0.289CS..SBendtrans-60.3138.3173.4-56.20000110.1L437 K504 V505 A510 L511 S512L437-T508 HydrophobicContact CD2-CG2 4.49Å; K504-T508 PolarHBondContact O-N 3.37Å; V505-T508 VanDerWaalsContact O-CB 3.25Å; V505-T508 WeakPolarHBondContact O-CB 3.15Å; V505-T508 PolarHBondContact O-N 3.04Å; V505-T508 VanDerWaalsContact O-N 3.13Å; V505-T508 PolarHBondContact O-OG1 3.04Å; V505-T508 VanDerWaalsContact O-OG1 3.05Å; T508-A510 PolarHBondContact O-N 2.88Å; T508-L511 PolarHBondContact O-N 2.89Å; T508-S512 PolarHBondContact O-N 3.5Å
509P71.4Confident81.6Confident111 Ų11156.2 Ų56.272%0.72130%0.303SS*.THydrogen-bonded Turntrans-51.9-27.4-173.4-30.134.8000115.7S512P509-S512 PolarHBondContact O-OG 2.69Å; P509-S512 VanDerWaalsContact O-OG 3.11Å
510A69.7Low81.3Confident20 Ų2057.2 Ų57.217%0.16531%0.308CS..THydrogen-bonded Turntrans-78.4-24.6-179.300000114L441 T508L441-A510 HydrophobicContact CB-CB 4.41Å; L441-A510 HydrophobicContact CD1-CB 3.27Å; L441-A510 HydrophobicContact CG-CB 4.43Å; T508-A510 PolarHBondContact O-N 2.88Å
511L74.1Confident81Confident8 Ų852.5 Ų52.54%0.04229%0.288CS..THydrogen-bonded Turntrans-109.1-11.7178.6-65.3172.8000112.6L441 F448 V505 L506 T508 S513 L514L441-L511 HydrophobicContact CD1-CG 4.34Å; L441-L511 HydrophobicContact CD2-CD2 3.74Å; L441-L511 HydrophobicContact CD2-CG 4.2Å; F448-L511 HydrophobicContact CB-CD2 4.11Å; V505-L511 HydrophobicContact CG1-CD1 3.8Å; L506-L511 CarbonylContact O-C 3.59Å; T508-L511 PolarHBondContact O-N 2.89Å; L511-S513 PolarHBondContact O-N 3.28Å; L511-S513 VanDerWaalsContact O-N 3.13Å; L511-L514 HydrophobicContact CB-CD1 4.04Å; L511-L514 HydrophobicContact CD2-CD1 3.66Å; L511-L514 HydrophobicContact CG-CD1 4.44Å; L511-L514 WeakPolarHBondContact O-CB 3.49Å; L511-L514 WeakPolarHBondContact O-CG 3.36Å; L511-L514 PolarHBondContact O-N 2.98Å
512S73.7Confident80.8Confident48 Ų4854.5 Ų54.534%0.33630%0.302SS..THydrogen-bonded Turntrans-62.6-22.4-175.265.50000114.3L506 T508 P509 L514L506-S512 WeakPolarHBondContact O-CA 3.42Å; L506-S512 PolarHBondContact O-N 3.5Å; T508-S512 PolarHBondContact O-N 3.5Å; P509-S512 PolarHBondContact O-OG 2.69Å; P509-S512 VanDerWaalsContact O-OG 3.11Å; S512-L514 VanDerWaalsContact C-N 3.3Å
513S75.2Confident80.6Confident86 Ų8657.1 Ų57.160%0.60132%0.316SS*.THydrogen-bonded Turntrans-83.52.2176.462.40000114.2L511 P515L511-S513 PolarHBondContact O-N 3.28Å; L511-S513 VanDerWaalsContact O-N 3.13Å; S513-P515 WeakPolarHBondContact O-CD 3.46Å
514L76.3Confident80.5Confident11 Ų1159.7 Ų59.76%0.05833%0.328CS..  trans-72.1124179.1-70.5179.5000111.8K449 A452 L506 L511 S512 A516 R517K449-L514 HydrophobicContact CB-CD2 3.6Å; K449-L514 HydrophobicContact CD-CD2 3.48Å; K449-L514 VanDerWaalsContact CD-CD2 3.48Å; K449-L514 HydrophobicContact CG-CD2 3.32Å; A452-L514 HydrophobicContact CB-CD1 3.87Å; L506-L514 HydrophobicContact CD2-CD1 4.15Å; L511-L514 HydrophobicContact CB-CD1 4.04Å; L511-L514 HydrophobicContact CD2-CD1 3.66Å; L511-L514 HydrophobicContact CG-CD1 4.44Å; L511-L514 WeakPolarHBondContact O-CB 3.49Å; L511-L514 WeakPolarHBondContact O-CG 3.36Å; L511-L514 PolarHBondContact O-N 2.98Å; S512-L514 VanDerWaalsContact C-N 3.3Å; L514-A516 PolarHBondContact O-N 3.13Å; L514-R517 WeakPolarHBondContact O-CB 3.21Å; L514-R517 PolarHBondContact O-N 3.26Å; L514-R517 VanDerWaalsContact O-N 3.12Å
515P79.3Confident80.7Confident75 Ų7556.7 Ų56.749%0.48732%0.319SS..G310 helixtrans-57.7-34.5175.9-2433.2000113.1S513 R517 N518S513-P515 WeakPolarHBondContact O-CD 3.46Å; P515-R517 PolarHBondContact O-N 3.05Å; P515-N518 WeakPolarHBondContact O-CB 3.29Å; P515-N518 PolarHBondContact O-N 3.22Å
516A77.1Confident80.9Confident3 Ų356.3 Ų56.33%0.02532%0.317CS..G310 helixtrans-56-23.2178.800000113.6T453 V456 L514 N518 E519 L520T453-A516 HydrophobicContact CG2-CB 4.26Å; V456-A516 HydrophobicContact CB-CB 4.35Å; V456-A516 HydrophobicContact CG2-CB 4.24Å; L514-A516 PolarHBondContact O-N 3.13Å; A516-N518 VanDerWaalsContact C-N 3.26Å; A516-N518 PolarHBondContact O-N 3.02Å; A516-E519 WeakPolarHBondContact O-CB 3.13Å; A516-E519 PolarHBondContact O-N 3.13Å; A516-L520 PolarHBondContact O-N 2.78Å
517R77.9Confident81.1Confident103 Ų10359.1 Ų59.139%0.38933%0.331SS..G310 helixtrans-60.6-36.4174.8-175.9-178.6175.9-1530.9112.3L514 P515 E519 L520L514-R517 WeakPolarHBondContact O-CB 3.21Å; L514-R517 PolarHBondContact O-N 3.26Å; L514-R517 VanDerWaalsContact O-N 3.12Å; P515-R517 PolarHBondContact O-N 3.05Å; R517-E519 PolarHBondContact O-N 3.48Å; R517-L520 HydrophobicContact CG-CD1 4.31Å; R517-L520 PolarHBondContact O-N 3.1Å
518N81.3Confident81.5Confident146 Ų14659.5 Ų59.578%0.78133%0.33SS*.G310 helixtrans-74.4-17178.1-64.1-20.1000112.3P515 A516P515-N518 WeakPolarHBondContact O-CB 3.29Å; P515-N518 PolarHBondContact O-N 3.22Å; A516-N518 VanDerWaalsContact C-N 3.26Å; A516-N518 PolarHBondContact O-N 3.02Å
519E84.5Confident81.9Confident77 Ų7758.8 Ų58.836%0.3632%0.324SS..G310 helixtrans-86.8-9.8177.7-62.7178.1-165.400112V456 R457 N460 A516 R517 V521V456-E519 HydrophobicContact CG1-CB 3.81Å; R457-E519 IonicContact NE-OE2 3.2Å; R457-E519 PolarHBondContact NE-OE2 3.08Å; R457-E519 IonicContact NH2-OE1 3.78Å; N460-E519 PolarHBondContact ND2-O 3.01Å; A516-E519 WeakPolarHBondContact O-CB 3.13Å; A516-E519 PolarHBondContact O-N 3.13Å; R517-E519 PolarHBondContact O-N 3.48Å; E519-V521 PolarHBondContact O-N 2.87Å
520L86.6Confident82.7Confident21 Ų2154.1 Ų54.111%0.1129%0.294CS..SBendtrans-57.9134.1-179.2-74168000112V456 Y499 L502 L506 A516 R517 N522V456-L520 HydrophobicContact CB-CD2 4.49Å; V456-L520 HydrophobicContact CG1-CD2 4.16Å; V456-L520 HydrophobicContact CG1-CG 4.45Å; V456-L520 HydrophobicContact CG2-CD2 3.61Å; V456-L520 HydrophobicContact CG2-CG 4.26Å; Y499-L520 HydrophobicContact CE2-CD2 4.41Å; L502-L520 HydrophobicContact CD2-CD2 4.03Å; L506-L520 HydrophobicContact CD1-CD1 3.78Å; L506-L520 HydrophobicContact CD1-CD2 4.23Å; L506-L520 HydrophobicContact CD1-CG 4.41Å; A516-L520 PolarHBondContact O-N 2.78Å; R517-L520 HydrophobicContact CG-CD1 4.31Å; R517-L520 PolarHBondContact O-N 3.1Å; L520-N522 PolarHBondContact O-N 3.41Å
521V85.9Confident83.6Confident21 Ų2160.8 Ų60.813%0.12732%0.315CS..PPolyproline II helixtrans-53.8127.6169.3166.80000109.2F459 N460 W463 Y499 E519 I523 N525F459-V521 HydrophobicContact CE1-CB 4.27Å; F459-V521 HydrophobicContact CE1-CG2 4.39Å; N460-V521 WeakPolarHBondContact OD1-CG2 3.32Å; W463-V521 HydrophobicContact CZ2-CG1 4.1Å; Y499-V521 PolarHBondContact OH-N 3.29Å; Y499-V521 PolarHBondContact OH-O 2.92Å; E519-V521 PolarHBondContact O-N 2.87Å; V521-I523 PolarHBondContact O-N 3.46Å; V521-N525 HydrophobicContact CG1-CB 4.04Å
522N87.2Confident84.2Confident97 Ų9766.7 Ų66.752%0.51934%0.34SS..PPolyproline II helixtrans-56127.3175-174.2-29.6000109.1L520 H524 N525 L526L520-N522 PolarHBondContact O-N 3.41Å; N522-H524 PolarHBondContact O-N 2.79Å; N522-H524 WeakPolarHBondContact OD1-CB 3.41Å; N522-H524 PolarHBondContact OD1-N 3.49Å; N522-N525 WeakPolarHBondContact O-CA 3.48Å; N522-N525 WeakPolarHBondContact O-CB 3.43Å; N522-N525 PolarHBondContact O-N 3.03Å; N522-L526 PolarHBondContact O-N 3.21Å
523I86.2Confident84.8Confident59 Ų5965.8 Ų65.830%0.30333%0.33SS..Hα-helixtrans-53.4-29.4179.7-164.3162000112.3Y499 V521 N525 L526 M527Y499-I523 HydrophobicContact CD1-CD1 4.42Å; Y499-I523 HydrophobicContact CD1-CG1 4.31Å; Y499-I523 HydrophobicContact CE1-CB 4.45Å; V521-I523 PolarHBondContact O-N 3.46Å; I523-N525 VanDerWaalsContact C-N 3.33Å; I523-N525 PolarHBondContact O-N 2.97Å; I523-L526 PolarHBondContact O-N 3.01Å; I523-M527 HydrophobicContact CG1-CG 4.42Å; I523-M527 WeakPolarHBondContact O-CB 3.26Å; I523-M527 VanDerWaalsContact O-CG 3.24Å; I523-M527 WeakPolarHBondContact O-CG 3.13Å; I523-M527 PolarHBondContact O-N 2.9Å
524H87.2Confident84.9Confident108 Ų10868.7 Ų68.750%0.533%0.332SS..Hα-helixtrans-61.1-40.1173.8-168.872.7000112.4N522 M527 V528N522-H524 PolarHBondContact O-N 2.79Å; N522-H524 WeakPolarHBondContact OD1-CB 3.41Å; N522-H524 PolarHBondContact OD1-N 3.49Å; H524-M527 PolarHBondContact O-N 2.91Å; H524-V528 WeakPolarHBondContact O-CB 2.89Å; H524-V528 VanDerWaalsContact O-CG2 3.25Å; H524-V528 WeakPolarHBondContact O-CG2 3.12Å; H524-V528 PolarHBondContact O-N 3.11Å
525N89.3Confident84.6Confident91 Ų9169.6 Ų69.649%0.48734%0.338SS..Hα-helixtrans-67.7-40.6177.7-66.4-13.2000111.3V521 N522 I523 M527 V528 E529V521-N525 HydrophobicContact CG1-CB 4.04Å; N522-N525 WeakPolarHBondContact O-CA 3.48Å; N522-N525 WeakPolarHBondContact O-CB 3.43Å; N522-N525 PolarHBondContact O-N 3.03Å; I523-N525 VanDerWaalsContact C-N 3.33Å; I523-N525 PolarHBondContact O-N 2.97Å; N525-M527 VanDerWaalsContact C-N 3.35Å; N525-V528 PolarHBondContact O-N 3.18Å; N525-E529 PolarHBondContact O-N 2.76Å; N525-E529 VanDerWaalsContact O-N 3.08Å
526L89.2Confident83.6Confident0 Ų071.9 Ų71.90%035%0.354CS..Hα-helixtrans-60.5-46.7173.1-178.563.5000110.4F459 W463 I467 V496 Y499 N522 I523 V528 E529 V530F459-L526 HydrophobicContact CZ-CD1 4.47Å; W463-L526 HydrophobicContact CE3-CD1 3.69Å; W463-L526 HydrophobicContact CZ3-CD1 3.64Å; I467-L526 HydrophobicContact CD1-CD1 4.03Å; V496-L526 HydrophobicContact CG2-CD2 4.34Å; Y499-L526 HydrophobicContact CD1-CD2 3.65Å; Y499-L526 HydrophobicContact CD2-CD2 4.35Å; Y499-L526 HydrophobicContact CE1-CD2 4.26Å; Y499-L526 HydrophobicContact CG-CD2 3.7Å; N522-L526 PolarHBondContact O-N 3.21Å; I523-L526 PolarHBondContact O-N 3.01Å; L526-V528 PolarHBondContact O-N 2.9Å; L526-E529 PolarHBondContact O-N 2.9Å; L526-V530 VanDerWaalsContact O-CG2 3.3Å; L526-V530 WeakPolarHBondContact O-CG2 3.05Å; L526-V530 PolarHBondContact O-N 3.42Å
527M89.3Confident82.5Confident63 Ų6381.6 Ų81.631%0.3140%0.397SS..Hα-helixtrans-64-38.5178.3-72.6-62.8-63.700113.1V496 I523 H524 N525 E529 V530 R531V496-M527 HydrophobicContact CG1-SD 3.92Å; V496-M527 HydrophobicContact CG2-SD 3.88Å; I523-M527 HydrophobicContact CG1-CG 4.42Å; I523-M527 WeakPolarHBondContact O-CB 3.26Å; I523-M527 VanDerWaalsContact O-CG 3.24Å; I523-M527 WeakPolarHBondContact O-CG 3.13Å; I523-M527 PolarHBondContact O-N 2.9Å; H524-M527 PolarHBondContact O-N 2.91Å; N525-M527 VanDerWaalsContact C-N 3.35Å; M527-E529 VanDerWaalsContact C-N 3.33Å; M527-V530 PolarHBondContact O-N 3.05Å; M527-R531 WeakPolarHBondContact O-CB 3.13Å; M527-R531 WeakPolarHBondContact O-CG 3.06Å; M527-R531 PolarHBondContact O-N 2.8Å
528V90.2Very high82.8Confident62 Ų6280.5 Ų80.538%0.37640%0.397SS..Hα-helixtrans-62.5-42.6175166.40000110.5H524 N525 L526 R531 K532H524-V528 WeakPolarHBondContact O-CB 2.89Å; H524-V528 VanDerWaalsContact O-CG2 3.25Å; H524-V528 WeakPolarHBondContact O-CG2 3.12Å; H524-V528 PolarHBondContact O-N 3.11Å; N525-V528 PolarHBondContact O-N 3.18Å; L526-V528 PolarHBondContact O-N 2.9Å; V528-R531 PolarHBondContact O-N 3.03Å; V528-K532 PolarHBondContact O-N 2.76Å
529E87.6Confident82.8Confident25 Ų2577.1 Ų77.112%0.11738%0.377CS..Hα-helixtrans-66.9-46.3177.1-158.268.5-141.700111.5W463 K464 N525 L526 M527 R531 K532 F533W463-E529 HydrophobicContact CH2-CB 3.64Å; W463-E529 HydrophobicContact CH2-CG 3.91Å; W463-E529 HydrophobicContact CZ3-CB 3.56Å; W463-E529 HydrophobicContact CZ3-CG 3.66Å; K464-E529 HydrophobicContact CG-CG 4.48Å; K464-E529 IonicContact NZ-OE2 2.61Å; N525-E529 PolarHBondContact O-N 2.76Å; N525-E529 VanDerWaalsContact O-N 3.08Å; L526-E529 PolarHBondContact O-N 2.9Å; M527-E529 VanDerWaalsContact C-N 3.33Å; E529-R531 PolarHBondContact O-N 3.5Å; E529-K532 VanDerWaalsContact O-CB 3.3Å; E529-K532 WeakPolarHBondContact O-CB 3.46Å; E529-K532 PolarHBondContact O-N 3.46Å; E529-K532 WeakPolarHBondContact OE1-CD 3.48Å; E529-K532 WeakPolarHBondContact OE1-CE 2.93Å; E529-K532 IonicContact OE1-NZ 3.72Å; E529-K532 PolarHBondContact OE1-NZ 2.74Å; E529-K532 IonicContact OE2-NZ 3.43Å; E529-K532 PolarHBondContact OE2-NZ 3.45Å; E529-F533 VanDerWaalsContact O-CD2 3.3Å; E529-F533 WeakPolarHBondContact O-CD2 3.13Å
530V88.6Confident82.7Confident13 Ų1377.1 Ų77.18%0.07938%0.378CS..Hα-helixtrans-56.2-39.1175166.60000111.5L492 V496 L526 M527 K532 F533L492-V530 HydrophobicContact CB-CG1 3.9Å; L492-V530 HydrophobicContact CB-CG2 4.24Å; L492-V530 HydrophobicContact CD1-CG1 4.08Å; L492-V530 HydrophobicContact CD2-CG2 4.35Å; V496-V530 HydrophobicContact CG2-CG2 4.16Å; L526-V530 VanDerWaalsContact O-CG2 3.3Å; L526-V530 WeakPolarHBondContact O-CG2 3.05Å; L526-V530 PolarHBondContact O-N 3.42Å; M527-V530 PolarHBondContact O-N 3.05Å; V530-K532 VanDerWaalsContact C-N 3.25Å; V530-K532 PolarHBondContact O-N 2.74Å; V530-F533 PolarHBondContact O-N 2.85Å
531R87.9Confident82.5Confident160 Ų16080.4 Ų80.460%0.60439%0.393SS*.Hα-helixtrans-64.3-24.9178.2-79.5173.1-176.9-173.21.6113.7M527 V528 E529 F533 K534M527-R531 WeakPolarHBondContact O-CB 3.13Å; M527-R531 WeakPolarHBondContact O-CG 3.06Å; M527-R531 PolarHBondContact O-N 2.8Å; V528-R531 PolarHBondContact O-N 3.03Å; E529-R531 PolarHBondContact O-N 3.5Å; R531-F533 PolarHBondContact O-N 3.26Å; R531-K534 WeakPolarHBondContact O-CB 3.45Å; R531-K534 PolarHBondContact O-N 3.49Å
532K87.8Confident82.3Confident132 Ų13284.1 Ų84.157%0.57441%0.41SS*.Hα-helixtrans-63.1-27.6175.7-63178.1-176.9172.10112.4V528 E529 V530V528-K532 PolarHBondContact O-N 2.76Å; E529-K532 VanDerWaalsContact O-CB 3.3Å; E529-K532 WeakPolarHBondContact O-CB 3.46Å; E529-K532 PolarHBondContact O-N 3.46Å; E529-K532 WeakPolarHBondContact OE1-CD 3.48Å; E529-K532 WeakPolarHBondContact OE1-CE 2.93Å; E529-K532 IonicContact OE1-NZ 3.72Å; E529-K532 PolarHBondContact OE1-NZ 2.74Å; E529-K532 IonicContact OE2-NZ 3.43Å; E529-K532 PolarHBondContact OE2-NZ 3.45Å; V530-K532 VanDerWaalsContact C-N 3.25Å; V530-K532 PolarHBondContact O-N 2.74Å
533F85.5Confident82Confident29 Ų2983.2 Ų83.213%0.12740%0.403CS..THydrogen-bonded Turntrans-93.54.2-179.7-59.1-79.8000113.2I467 N471 L488 Q489 L492 E529 V530 R531I467-F533 HydrophobicContact CG2-CD2 3.99Å; I467-F533 HydrophobicContact CG2-CE2 3.36Å; I467-F533 HydrophobicContact CG2-CZ 3.79Å; N471-F533 HydrophobicContact CB-CD1 3.94Å; N471-F533 HydrophobicContact CB-CE1 3.63Å; N471-F533 HydrophobicContact CB-CZ 4.44Å; N471-F533 VanDerWaalsContact CG-CE1 3.46Å; N471-F533 WeakPolarHBondContact ND2-CE1 3.23Å; L488-F533 HydrophobicContact CD2-CB 3.82Å; L488-F533 HydrophobicContact CD2-CD1 4.07Å; L488-F533 HydrophobicContact CD2-CG 4.24Å; L488-F533 HydrophobicContact CG-CB 4.45Å; Q489-F533 VanDerWaalsContact NE2-C 3.31Å; Q489-F533 PolarHBondContact NE2-O 2.9Å; L492-F533 HydrophobicContact CD1-CB 3.82Å; L492-F533 HydrophobicContact CD1-CD2 4.19Å; L492-F533 HydrophobicContact CD1-CG 4.24Å; E529-F533 VanDerWaalsContact O-CD2 3.3Å; E529-F533 WeakPolarHBondContact O-CD2 3.13Å; V530-F533 PolarHBondContact O-N 2.85Å; R531-F533 PolarHBondContact O-N 3.26Å
534K77.8Confident81.7Confident147 Ų14784.9 Ų84.964%0.63941%0.41SS*.SBendtrans-67.2131.1176.7-165.9179.4-178.8-175.40108.8R531 C536R531-K534 WeakPolarHBondContact O-CB 3.45Å; R531-K534 PolarHBondContact O-N 3.49Å; K534-C536 PolarHBondContact O-N 2.88Å
535P70.1Confident81.3Confident29 Ų2983.2 Ų83.219%0.18840%0.403CS..  trans-62132.4179.124-34000111.4F481 S485 F537F481-P535 HydrophobicContact CE1-CB 4.32Å; S485-P535 VanDerWaalsContact OG-CB 3.25Å; S485-P535 WeakPolarHBondContact OG-CB 3.27Å; S485-P535 WeakPolarHBondContact OG-CD 3.44Å; S485-P535 WeakPolarHBondContact OG-CG 3.31Å; P535-F537 HydrophobicContact CB-CD2 3.94Å; P535-F537 HydrophobicContact CB-CE1 4.2Å; P535-F537 HydrophobicContact CB-CE2 3.46Å; P535-F537 VanDerWaalsContact CB-CE2 3.46Å; P535-F537 HydrophobicContact CB-CZ 3.6Å; P535-F537 HydrophobicContact CG-CD2 4.14Å; P535-F537 HydrophobicContact CG-CE2 3.39Å; P535-F537 HydrophobicContact CG-CZ 3.8Å
536C58.3Low80.6Confident123 Ų12382.5 Ų82.583%0.83140%0.396SS*.  trans-91.1106.4156.2-72.60000106.6K534K534-C536 PolarHBondContact O-N 2.88Å
537F54.7Low79.8Confident207 Ų20790 Ų9091%0.90843%0.432SS*.  trans-87.70171.1-66.5-70.8000110.5F481 P535F481-F537 HydrophobicContact CD1-CE1 4.47Å; F481-F537 HydrophobicContact CE1-CE1 4.45Å; P535-F537 HydrophobicContact CB-CD2 3.94Å; P535-F537 HydrophobicContact CB-CE1 4.2Å; P535-F537 HydrophobicContact CB-CE2 3.46Å; P535-F537 VanDerWaalsContact CB-CE2 3.46Å; P535-F537 HydrophobicContact CB-CZ 3.6Å; P535-F537 HydrophobicContact CG-CD2 4.14Å; P535-F537 HydrophobicContact CG-CE2 3.39Å; P535-F537 HydrophobicContact CG-CZ 3.8Å

Retrieved 537 of 537 residues in 294.5 ms (Link to these results)

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