A0A096NHJ9_PAPAN Loading...

Exportin-6

Mediates the nuclear export of actin and profilin-actin complexes in somatic cells.

AlphaFold DB (A0A2K5M6N0), UniProt , Accession A0A096NHJ9, Species PAPAN (Papio anubis, Olive baboon), Gene XPO6, Length 1,125 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
1M37.5Very low76.7Confident246 Ų24679.9 Ų79.9100%1.21244%0.443SS*.  0113.30-74.8174.1173.500106.9
2A53.5Low77.8Confident65 Ų6577.8 Ų77.854%0.53743%0.427SS..  trans-66148.9170.500000108.9A6A2-A6 HydrophobicContact CB-CB 4.32Å
3S75.2Confident78.6Confident71 Ų7177.7 Ų77.750%0.49744%0.435SS..  trans-64.7150.6171.960.60000110E5 A6 S7S3-E5 PolarHBondContact O-N 3.16Å; S3-E5 VanDerWaalsContact O-N 3.1Å; S3-A6 PolarHBondContact O-N 3.45Å; S3-A6 PolarHBondContact OG-N 3.14Å; S3-S7 PolarHBondContact O-N 3.09Å; S3-S7 VanDerWaalsContact O-N 3.09Å
4E79Confident79.5Confident90 Ų9075.1 Ų75.142%0.42142%0.42SS..Hα-helixtrans-52.1-34.4177.2-63.3175.1156.900111.8L8 F47 Y50E4-L8 WeakPolarHBondContact O-CB 3.21Å; E4-L8 PolarHBondContact O-N 2.84Å; E4-F47 HydrophobicContact CB-CD1 4.43Å; E4-F47 HydrophobicContact CG-CD1 4.02Å; E4-F47 HydrophobicContact CG-CE1 3.92Å; E4-Y50 HydrophobicContact CB-CD1 3.68Å; E4-Y50 HydrophobicContact CB-CD2 4.43Å; E4-Y50 HydrophobicContact CB-CE1 3.78Å; E4-Y50 HydrophobicContact CB-CG 4.02Å; E4-Y50 WeakPolarHBondContact OE2-CD2 3.45Å
5E81.8Confident80.1Confident95 Ų9570.6 Ų70.644%0.44439%0.394SS..Hα-helixtrans-68.7-38.7175.9-165.1-178.917500113.7S3 L8 R9S3-E5 PolarHBondContact O-N 3.16Å; S3-E5 VanDerWaalsContact O-N 3.1Å; E5-L8 PolarHBondContact O-N 3.1Å; E5-R9 WeakPolarHBondContact O-CG 3.46Å; E5-R9 PolarHBondContact O-N 2.96Å; E5-R9 VanDerWaalsContact O-N 3.15Å; E5-R9 IonicContact OE1-CZ 3.63Å; E5-R9 IonicContact OE1-NE 3.93Å; E5-R9 IonicContact OE1-NH2 2.69Å; E5-R9 PolarHBondContact OE1-NH2 3.48Å
6A82.2Confident80.7Confident47 Ų4770.9 Ų70.939%0.38840%0.398SS..Hα-helixtrans-68.9-39.6176.400000111.4A2 S3 L8 R9 A10A2-A6 HydrophobicContact CB-CB 4.32Å; S3-A6 PolarHBondContact O-N 3.45Å; S3-A6 PolarHBondContact OG-N 3.14Å; A6-L8 VanDerWaalsContact C-N 3.35Å; A6-R9 PolarHBondContact O-N 3.17Å; A6-A10 PolarHBondContact O-N 2.79Å; A6-A10 VanDerWaalsContact O-N 3.13Å
7S84Confident81.3Confident32 Ų3270.4 Ų70.422%0.22439%0.392CS..Hα-helixtrans-64.3-38.2174-670000112.3S3 A10 L11S3-S7 PolarHBondContact O-N 3.09Å; S3-S7 VanDerWaalsContact O-N 3.09Å; S7-A10 PolarHBondContact O-N 3.14Å; S7-L11 WeakPolarHBondContact O-CB 3.48Å; S7-L11 PolarHBondContact O-N 3.24Å
8L88Confident81.8Confident12 Ų1268.3 Ų68.36%0.06338%0.379CS..Hα-helixtrans-62.5-49.4176176.556.6000111.8E4 E5 A6 A10 L11 E12 Y50 F51 V60E4-L8 WeakPolarHBondContact O-CB 3.21Å; E4-L8 PolarHBondContact O-N 2.84Å; E5-L8 PolarHBondContact O-N 3.1Å; A6-L8 VanDerWaalsContact C-N 3.35Å; L8-A10 VanDerWaalsContact C-N 3.29Å; L8-A10 PolarHBondContact O-N 3.04Å; L8-L11 PolarHBondContact O-N 2.93Å; L8-L11 VanDerWaalsContact O-N 3.17Å; L8-E12 HydrophobicContact CD1-CG 4.16Å; L8-E12 WeakPolarHBondContact O-CG 3.22Å; L8-E12 PolarHBondContact O-N 3.1Å; L8-Y50 HydrophobicContact CD2-CE1 4.22Å; L8-F51 HydrophobicContact CB-CD1 3.69Å; L8-F51 HydrophobicContact CB-CE1 3.64Å; L8-F51 HydrophobicContact CD1-CB 4.06Å; L8-F51 HydrophobicContact CD1-CD1 3.59Å; L8-F51 HydrophobicContact CD1-CE1 4.27Å; L8-F51 HydrophobicContact CD1-CG 3.92Å; L8-F51 HydrophobicContact CD2-CD1 4.49Å; L8-F51 HydrophobicContact CG-CD1 4.1Å; L8-V60 HydrophobicContact CD1-CG1 4.03Å
9R87.1Confident82.2Confident156 Ų15669.8 Ų69.859%0.58938%0.381SS*.Hα-helixtrans-62-37.5179.4-68.4-178.3-165.5169.24.6112.3E5 A6 S13E5-R9 WeakPolarHBondContact O-CG 3.46Å; E5-R9 PolarHBondContact O-N 2.96Å; E5-R9 VanDerWaalsContact O-N 3.15Å; E5-R9 IonicContact OE1-CZ 3.63Å; E5-R9 IonicContact OE1-NE 3.93Å; E5-R9 IonicContact OE1-NH2 2.69Å; E5-R9 PolarHBondContact OE1-NH2 3.48Å; A6-R9 PolarHBondContact O-N 3.17Å; R9-S13 PolarHBondContact O-N 3.11Å; R9-S13 VanDerWaalsContact O-N 3.09Å
10A86.3Confident82.6Confident52 Ų5271.6 Ų71.643%0.4339%0.386SS..Hα-helixtrans-64.4-43.7175.300000111.7A6 S7 L8 S13 L14A6-A10 PolarHBondContact O-N 2.79Å; A6-A10 VanDerWaalsContact O-N 3.13Å; S7-A10 PolarHBondContact O-N 3.14Å; L8-A10 VanDerWaalsContact C-N 3.29Å; L8-A10 PolarHBondContact O-N 3.04Å; A10-S13 PolarHBondContact O-N 3.03Å; A10-L14 WeakPolarHBondContact O-CG 3.48Å; A10-L14 PolarHBondContact O-N 3.23Å
11L88.8Confident82.8Confident13 Ų1376 Ų767%0.06841%0.409CS..Hα-helixtrans-67.3-39.9178.3-175.660.3000112.3S7 L8 S13 L14 M15 L35 F51 V60 Y63S7-L11 WeakPolarHBondContact O-CB 3.48Å; S7-L11 PolarHBondContact O-N 3.24Å; L8-L11 PolarHBondContact O-N 2.93Å; L8-L11 VanDerWaalsContact O-N 3.17Å; L11-S13 VanDerWaalsContact C-N 3.32Å; L11-S13 PolarHBondContact O-N 3.2Å; L11-L14 PolarHBondContact O-N 3.45Å; L11-M15 HydrophobicContact CD1-CE 4.29Å; L11-M15 HydrophobicContact CD1-CG 4.27Å; L11-M15 HydrophobicContact CG-CG 4.44Å; L11-M15 WeakPolarHBondContact O-CB 3.14Å; L11-M15 WeakPolarHBondContact O-CG 3.5Å; L11-M15 PolarHBondContact O-N 3.32Å; L11-L35 HydrophobicContact CD1-CD2 3.48Å; L11-L35 VanDerWaalsContact CD1-CD2 3.48Å; L11-F51 HydrophobicContact CD2-CD2 3.57Å; L11-F51 HydrophobicContact CD2-CE2 3.47Å; L11-F51 VanDerWaalsContact CD2-CE2 3.47Å; L11-F51 HydrophobicContact CD2-CZ 4.35Å; L11-V60 HydrophobicContact CD2-CG1 3.8Å; L11-V60 HydrophobicContact CG-CG1 4.23Å; L11-V60 HydrophobicContact CG-CG2 4.26Å; L11-Y63 HydrophobicContact CD1-CD1 4.09Å; L11-Y63 HydrophobicContact CD1-CE1 4.01Å; L11-Y63 HydrophobicContact CD2-CD1 3.94Å; L11-Y63 HydrophobicContact CD2-CE1 4.11Å
12E90Very high85.3Confident55 Ų5569.3 Ų69.326%0.25739%0.386SS..Hα-helixtrans-59.1-43.1173.1-76.9176.2165.400111.7L8 T16 T55 N57 V60L8-E12 HydrophobicContact CD1-CG 4.16Å; L8-E12 WeakPolarHBondContact O-CG 3.22Å; L8-E12 PolarHBondContact O-N 3.1Å; E12-T16 WeakPolarHBondContact O-CB 3.44Å; E12-T16 PolarHBondContact O-N 3.37Å; E12-T16 PolarHBondContact O-OG1 2.88Å; E12-T55 PolarHBondContact OE1-OG1 3.1Å; E12-N57 HydrophobicContact CG-CB 4.19Å; E12-V60 HydrophobicContact CB-CG2 4.37Å; E12-V60 HydrophobicContact CG-CG2 3.74Å
13S89.1Confident87Confident76 Ų7667.2 Ų67.253%0.53137%0.366SS..Hα-helixtrans-62.7-46.2176-170.90000111.8R9 A10 L11 T16 E17R9-S13 PolarHBondContact O-N 3.11Å; R9-S13 VanDerWaalsContact O-N 3.09Å; A10-S13 PolarHBondContact O-N 3.03Å; L11-S13 VanDerWaalsContact C-N 3.32Å; L11-S13 PolarHBondContact O-N 3.2Å; S13-T16 PolarHBondContact O-N 3.5Å; S13-E17 WeakPolarHBondContact O-CB 3.42Å; S13-E17 PolarHBondContact O-N 3.21Å
14L90.2Very high87.8Confident41 Ų4167.8 Ų67.822%0.21537%0.367CS..Hα-helixtrans-66.9-42.4-179-73.3167.4000112.4A10 L11 T16 E17 F18 I31A10-L14 WeakPolarHBondContact O-CG 3.48Å; A10-L14 PolarHBondContact O-N 3.23Å; L11-L14 PolarHBondContact O-N 3.45Å; L14-T16 VanDerWaalsContact C-N 3.34Å; L14-E17 PolarHBondContact O-N 3.1Å; L14-F18 WeakPolarHBondContact O-CB 3.46Å; L14-F18 PolarHBondContact O-N 3.12Å; L14-I31 HydrophobicContact CB-CG2 4.43Å; L14-I31 HydrophobicContact CD2-CG1 4.24Å
15M89.7Confident88.3Confident8 Ų869.4 Ų69.44%0.03938%0.379CS..Hα-helixtrans-62.6-42.6175.6-76.4-69.6118.100111.6L11 F18 F19 L35 V60 Y63L11-M15 HydrophobicContact CD1-CE 4.29Å; L11-M15 HydrophobicContact CD1-CG 4.27Å; L11-M15 HydrophobicContact CG-CG 4.44Å; L11-M15 WeakPolarHBondContact O-CB 3.14Å; L11-M15 WeakPolarHBondContact O-CG 3.5Å; L11-M15 PolarHBondContact O-N 3.32Å; M15-F18 PolarHBondContact O-N 3.43Å; M15-F19 WeakPolarHBondContact O-CD2 3.23Å; M15-F19 PolarHBondContact O-N 3.19Å; M15-F19 HydrophobicContact SD-CE2 4.45Å; M15-L35 HydrophobicContact CE-CD1 3.14Å; M15-L35 HydrophobicContact CE-CD2 3.39Å; M15-L35 HydrophobicContact CE-CG 3.87Å; M15-V60 HydrophobicContact CB-CG2 4.15Å; M15-V60 HydrophobicContact CG-CG2 3.82Å; M15-Y63 HydrophobicContact CE-CD2 4.26Å; M15-Y63 HydrophobicContact CE-CG 4.22Å
16T88.9Confident88.8Confident75 Ų7572 Ų7246%0.4639%0.391SS..Hα-helixtrans-67.6-38.7178.8-51.90000111.2E12 S13 L14 H20E12-T16 WeakPolarHBondContact O-CB 3.44Å; E12-T16 PolarHBondContact O-N 3.37Å; E12-T16 PolarHBondContact O-OG1 2.88Å; S13-T16 PolarHBondContact O-N 3.5Å; L14-T16 VanDerWaalsContact C-N 3.34Å; T16-H20 PolarHBondContact O-N 3.3Å
17E90.8Very high89.3Confident63 Ų6373.3 Ų73.329%0.29439%0.386SS..Hα-helixtrans-63.4-44.1173.3-172.6-174.9167.100111.5S13 L14 F19 H20 T23 R27 I31S13-E17 WeakPolarHBondContact O-CB 3.42Å; S13-E17 PolarHBondContact O-N 3.21Å; L14-E17 PolarHBondContact O-N 3.1Å; E17-F19 VanDerWaalsContact C-N 3.34Å; E17-F19 PolarHBondContact O-N 2.97Å; E17-H20 WeakPolarHBondContact O-CB 3.31Å; E17-H20 PolarHBondContact O-N 2.97Å; E17-T23 HydrophobicContact CG-CG2 4.47Å; E17-T23 WeakPolarHBondContact O-CB 3.1Å; E17-T23 PolarHBondContact O-OG1 3.23Å; E17-R27 IonicContact OE1-CZ 3.51Å; E17-R27 IonicContact OE1-NE 3.63Å; E17-R27 PolarHBondContact OE1-NE 3Å; E17-R27 IonicContact OE1-NH2 3.32Å; E17-R27 PolarHBondContact OE1-NH2 3.43Å; E17-R27 IonicContact OE2-NH2 2.63Å; E17-R27 PolarHBondContact OE2-NH2 3.49Å; E17-I31 HydrophobicContact CB-CD1 4.28Å; E17-I31 HydrophobicContact CG-CD1 4Å
18F90.1Very high89.6Confident33 Ų3374.6 Ų74.615%0.14539%0.387CS..Hα-helixtrans-59.2-42.3-178.7-176.2-93.2000113.1L14 M15 K28 I31 E32L14-F18 WeakPolarHBondContact O-CB 3.46Å; L14-F18 PolarHBondContact O-N 3.12Å; M15-F18 PolarHBondContact O-N 3.43Å; F18-K28 HydrophobicContact CD2-CB 4.03Å; F18-K28 HydrophobicContact CD2-CG 4Å; F18-K28 HydrophobicContact CE2-CB 3.66Å; F18-K28 HydrophobicContact CE2-CD 4.45Å; F18-K28 HydrophobicContact CE2-CG 3.96Å; F18-K28 HydrophobicContact CZ-CB 4.49Å; F18-K28 VanDerWaalsContact O-CE 3.22Å; F18-K28 WeakPolarHBondContact O-CE 3.45Å; F18-I31 HydrophobicContact CB-CD1 4.39Å; F18-I31 HydrophobicContact CB-CG2 4.19Å; F18-I31 HydrophobicContact CD2-CB 4.15Å; F18-I31 HydrophobicContact CD2-CG2 4Å; F18-I31 HydrophobicContact CG-CG2 4.49Å; F18-E32 HydrophobicContact CE2-CG 3.69Å; F18-E32 HydrophobicContact CZ-CG 4.15Å; F18-E32 WeakPolarHBondContact CZ-OE1 3.41Å
19F89.6Confident89.8Confident97 Ų9782.4 Ų82.443%0.42542%0.416SS..THydrogen-bonded Turntrans-90.14.3-179.2-69.1-72.3000114.3M15 E17 Y59M15-F19 WeakPolarHBondContact O-CD2 3.23Å; M15-F19 PolarHBondContact O-N 3.19Å; M15-F19 HydrophobicContact SD-CE2 4.45Å; E17-F19 VanDerWaalsContact C-N 3.34Å; E17-F19 PolarHBondContact O-N 2.97Å; F19-Y59 HydrophobicContact CB-CE1 4.32Å; F19-Y59 HydrophobicContact CB-CE2 4.06Å; F19-Y59 HydrophobicContact CD1-CE1 4.17Å; F19-Y59 AromaticContact CD2-CD1 3.41Å; F19-Y59 HydrophobicContact CD2-CD1 3.41Å; F19-Y59 VanDerWaalsContact CD2-CD1 3.41Å; F19-Y59 AromaticContact CD2-CD2 3.87Å; F19-Y59 HydrophobicContact CD2-CD2 3.87Å; F19-Y59 AromaticContact CD2-CE1 3.57Å; F19-Y59 HydrophobicContact CD2-CE1 3.57Å; F19-Y59 HydrophobicContact CD2-CE2 4.01Å; F19-Y59 AromaticContact CD2-CG 3.57Å; F19-Y59 HydrophobicContact CD2-CG 3.57Å; F19-Y59 AromaticContact CD2-CZ 3.86Å; F19-Y59 HydrophobicContact CE1-CE1 4.41Å; F19-Y59 AromaticContact CE2-CD1 3.39Å; F19-Y59 HydrophobicContact CE2-CD1 3.39Å; F19-Y59 AromaticContact CE2-CE1 3.86Å; F19-Y59 HydrophobicContact CE2-CE1 3.86Å; F19-Y59 AromaticContact CE2-CG 3.77Å; F19-Y59 HydrophobicContact CE2-CG 3.77Å; F19-Y59 HydrophobicContact CG-CD1 4.1Å; F19-Y59 AromaticContact CG-CE1 3.76Å; F19-Y59 HydrophobicContact CG-CE1 3.76Å; F19-Y59 HydrophobicContact CG-CE2 4.24Å; F19-Y59 HydrophobicContact CG-CG 4.49Å; F19-Y59 AromaticContact CG-CZ 3.83Å; F19-Y59 HydrophobicContact CZ-CD1 4.04Å; F19-Y59 HydrophobicContact CZ-CE1 4.27Å
20H90.9Very high90Very high105 Ų10579.7 Ų79.749%0.48641%0.41SS..SBendtrans-77.4139177.4-166.5-84.7000111.7T16 E17 C22 T23T16-H20 PolarHBondContact O-N 3.3Å; E17-H20 WeakPolarHBondContact O-CB 3.31Å; E17-H20 PolarHBondContact O-N 2.97Å; H20-C22 PolarHBondContact ND1-N 3.46Å; H20-C22 PolarHBondContact O-N 3.09Å; H20-C22 VanDerWaalsContact O-N 3.13Å; H20-T23 PolarHBondContact O-N 2.84Å; H20-T23 VanDerWaalsContact O-N 3.13Å; H20-T23 PolarHBondContact O-OG1 3.48Å
21D86.6Confident90.1Very high163 Ų16377.2 Ų77.287%0.87239%0.389SS*.THydrogen-bonded Turntrans-60.7-27.8-174-66.1-30.4000113.6
22C88.9Confident90.1Very high106 Ų10681 Ų8172%0.71641%0.407SS*.THydrogen-bonded Turntrans-85.90.2-178.8-55.60000115.1H20H20-C22 PolarHBondContact ND1-N 3.46Å; H20-C22 PolarHBondContact O-N 3.09Å; H20-C22 VanDerWaalsContact O-N 3.13Å
23T90.6Very high90.1Very high21 Ų2184.3 Ų84.313%0.12942%0.422CS..  trans-84.2124.8-174.7-550000111E17 H20 R27 K28E17-T23 HydrophobicContact CG-CG2 4.47Å; E17-T23 WeakPolarHBondContact O-CB 3.1Å; E17-T23 PolarHBondContact O-OG1 3.23Å; H20-T23 PolarHBondContact O-N 2.84Å; H20-T23 VanDerWaalsContact O-N 3.13Å; H20-T23 PolarHBondContact O-OG1 3.48Å; T23-R27 HydrophobicContact CG2-CB 3.96Å; T23-R27 HydrophobicContact CG2-CG 3.81Å; T23-K28 HydrophobicContact CG2-CG 3.87Å; T23-K28 WeakPolarHBondContact O-CE 3.4Å
24T90.6Very high90Very high84 Ų8485 Ų8552%0.51542%0.42SS..  trans-69.3155.3-177.964.70000112.2E26 R27 K28T24-E26 VanDerWaalsContact C-N 3.25Å; T24-E26 PolarHBondContact O-N 2.88Å; T24-R27 PolarHBondContact O-N 2.92Å; T24-R27 WeakPolarHBondContact OG1-CB 3.48Å; T24-R27 PolarHBondContact OG1-N 3.2Å; T24-K28 WeakPolarHBondContact O-CG 3.49Å; T24-K28 PolarHBondContact O-N 3.18Å
25N91.1Very high89.9Confident124 Ų12483.9 Ų83.966%0.66341%0.414SS*.Hα-helixtrans-60.7-34.3177.3-71-19.7000112.8K28 R29N25-K28 PolarHBondContact O-N 3.23Å; N25-R29 WeakPolarHBondContact O-CG 3.37Å; N25-R29 PolarHBondContact O-N 3.21Å; N25-R29 VanDerWaalsContact O-N 3.11Å
26E92.1Very high89.8Confident150 Ų15088 Ų8870%0.70144%0.436SS*.Hα-helixtrans-62.5-48.7174.6-68.3173.5179.500110.8T24 K28 R29 E30T24-E26 VanDerWaalsContact C-N 3.25Å; T24-E26 PolarHBondContact O-N 2.88Å; E26-K28 VanDerWaalsContact C-N 3.34Å; E26-K28 PolarHBondContact O-N 3.45Å; E26-R29 WeakPolarHBondContact O-CB 3.22Å; E26-R29 PolarHBondContact O-N 3.01Å; E26-E30 PolarHBondContact O-N 3.41Å; E26-E30 VanDerWaalsContact O-N 3.08Å
27R91.9Very high89.6Confident73 Ų7388.8 Ų88.828%0.27544%0.437SS..Hα-helixtrans-64.6-37.4178.3-176.656.4178.3160.58.2112.4E17 T23 T24 R29 E30 I31E17-R27 IonicContact OE1-CZ 3.51Å; E17-R27 IonicContact OE1-NE 3.63Å; E17-R27 PolarHBondContact OE1-NE 3Å; E17-R27 IonicContact OE1-NH2 3.32Å; E17-R27 PolarHBondContact OE1-NH2 3.43Å; E17-R27 IonicContact OE2-NH2 2.63Å; E17-R27 PolarHBondContact OE2-NH2 3.49Å; T23-R27 HydrophobicContact CG2-CB 3.96Å; T23-R27 HydrophobicContact CG2-CG 3.81Å; T24-R27 PolarHBondContact O-N 2.92Å; T24-R27 WeakPolarHBondContact OG1-CB 3.48Å; T24-R27 PolarHBondContact OG1-N 3.2Å; R27-R29 VanDerWaalsContact C-N 3.34Å; R27-R29 PolarHBondContact O-N 2.85Å; R27-E30 VanDerWaalsContact CD-OE2 3.3Å; R27-E30 WeakPolarHBondContact CD-OE2 3.47Å; R27-E30 IonicContact CZ-OE2 3.34Å; R27-E30 IonicContact NE-OE2 2.89Å; R27-E30 IonicContact NH1-OE2 3.34Å; R27-E30 PolarHBondContact NH1-OE2 3.27Å; R27-E30 PolarHBondContact O-N 3.18Å; R27-I31 HydrophobicContact CG-CD1 4.09Å; R27-I31 WeakPolarHBondContact O-CG1 3.43Å; R27-I31 PolarHBondContact O-N 3.22Å
28K91.5Very high89.4Confident59 Ų5987.7 Ų87.726%0.25743%0.431SS..Hα-helixtrans-59.6-42.9173.7-72.8-177.6-175.1-175.80111.8F18 T23 T24 N25 E26 I31 E32F18-K28 HydrophobicContact CD2-CB 4.03Å; F18-K28 HydrophobicContact CD2-CG 4Å; F18-K28 HydrophobicContact CE2-CB 3.66Å; F18-K28 HydrophobicContact CE2-CD 4.45Å; F18-K28 HydrophobicContact CE2-CG 3.96Å; F18-K28 HydrophobicContact CZ-CB 4.49Å; F18-K28 VanDerWaalsContact O-CE 3.22Å; F18-K28 WeakPolarHBondContact O-CE 3.45Å; T23-K28 HydrophobicContact CG2-CG 3.87Å; T23-K28 WeakPolarHBondContact O-CE 3.4Å; T24-K28 WeakPolarHBondContact O-CG 3.49Å; T24-K28 PolarHBondContact O-N 3.18Å; N25-K28 PolarHBondContact O-N 3.23Å; E26-K28 VanDerWaalsContact C-N 3.34Å; E26-K28 PolarHBondContact O-N 3.45Å; K28-I31 PolarHBondContact O-N 3.42Å; K28-E32 WeakPolarHBondContact O-CG 3.49Å; K28-E32 PolarHBondContact O-N 3.41Å
29R91.1Very high89.2Confident176 Ų17687 Ų8766%0.66443%0.432SS*.Hα-helixtrans-63.1-42.6175.3-72.8178-179.1176.70.4112.5N25 E26 R27 I31 E32 E33N25-R29 WeakPolarHBondContact O-CG 3.37Å; N25-R29 PolarHBondContact O-N 3.21Å; N25-R29 VanDerWaalsContact O-N 3.11Å; E26-R29 WeakPolarHBondContact O-CB 3.22Å; E26-R29 PolarHBondContact O-N 3.01Å; R27-R29 VanDerWaalsContact C-N 3.34Å; R27-R29 PolarHBondContact O-N 2.85Å; R29-I31 VanDerWaalsContact C-N 3.33Å; R29-I31 PolarHBondContact O-N 3.05Å; R29-E32 PolarHBondContact O-N 3.44Å; R29-E33 WeakPolarHBondContact O-CG 3.38Å; R29-E33 PolarHBondContact O-N 3.29Å
30E90.4Very high88.7Confident99 Ų9988.8 Ų88.846%0.46344%0.442SS..Hα-helixtrans-59.9-43.9175.1-68176.6179.700111.8E26 R27 E33 L34E26-E30 PolarHBondContact O-N 3.41Å; E26-E30 VanDerWaalsContact O-N 3.08Å; R27-E30 VanDerWaalsContact CD-OE2 3.3Å; R27-E30 WeakPolarHBondContact CD-OE2 3.47Å; R27-E30 IonicContact CZ-OE2 3.34Å; R27-E30 IonicContact NE-OE2 2.89Å; R27-E30 IonicContact NH1-OE2 3.34Å; R27-E30 PolarHBondContact NH1-OE2 3.27Å; R27-E30 PolarHBondContact O-N 3.18Å; E30-E33 PolarHBondContact O-N 3.01Å; E30-L34 WeakPolarHBondContact O-CG 3.25Å; E30-L34 PolarHBondContact O-N 2.95Å
31I89.8Confident88.3Confident0 Ų089.2 Ų89.20%044%0.444CS..Hα-helixtrans-64.7-43.6177.6-65.4167.4000110.2L14 E17 F18 R27 K28 R29 E33 L34 L35L14-I31 HydrophobicContact CB-CG2 4.43Å; L14-I31 HydrophobicContact CD2-CG1 4.24Å; E17-I31 HydrophobicContact CB-CD1 4.28Å; E17-I31 HydrophobicContact CG-CD1 4Å; F18-I31 HydrophobicContact CB-CD1 4.39Å; F18-I31 HydrophobicContact CB-CG2 4.19Å; F18-I31 HydrophobicContact CD2-CB 4.15Å; F18-I31 HydrophobicContact CD2-CG2 4Å; F18-I31 HydrophobicContact CG-CG2 4.49Å; R27-I31 HydrophobicContact CG-CD1 4.09Å; R27-I31 WeakPolarHBondContact O-CG1 3.43Å; R27-I31 PolarHBondContact O-N 3.22Å; K28-I31 PolarHBondContact O-N 3.42Å; R29-I31 VanDerWaalsContact C-N 3.33Å; R29-I31 PolarHBondContact O-N 3.05Å; I31-E33 PolarHBondContact O-N 3.48Å; I31-L34 PolarHBondContact O-N 2.92Å; I31-L35 HydrophobicContact CG2-CD1 3.75Å; I31-L35 HydrophobicContact CG2-CG 4.23Å; I31-L35 WeakPolarHBondContact O-CD1 3.45Å; I31-L35 WeakPolarHBondContact O-CG 3.21Å; I31-L35 PolarHBondContact O-N 3.13Å
32E88.9Confident87.8Confident92 Ų9289.2 Ų89.243%0.4344%0.442SS..Hα-helixtrans-57.6-44.2174.5-79.8171.1-179.100112.6F18 K28 R29 L35 N36F18-E32 HydrophobicContact CE2-CG 3.69Å; F18-E32 HydrophobicContact CZ-CG 4.15Å; F18-E32 WeakPolarHBondContact CZ-OE1 3.41Å; K28-E32 WeakPolarHBondContact O-CG 3.49Å; K28-E32 PolarHBondContact O-N 3.41Å; R29-E32 PolarHBondContact O-N 3.44Å; E32-L35 PolarHBondContact O-N 3.13Å; E32-N36 WeakPolarHBondContact O-CB 3.39Å; E32-N36 VanDerWaalsContact O-CG 3.23Å; E32-N36 PolarHBondContact O-N 3.37Å; E32-N36 PolarHBondContact O-ND2 3.3Å; E32-N36 VanDerWaalsContact O-ND2 3.17Å
33E88.6Confident87.4Confident126 Ų12684.9 Ų84.959%0.58942%0.416SS*.Hα-helixtrans-60.8-44.7175.4-75.4-179.7-17500111.8R29 E30 I31 L35 N36 N37R29-E33 WeakPolarHBondContact O-CG 3.38Å; R29-E33 PolarHBondContact O-N 3.29Å; E30-E33 PolarHBondContact O-N 3.01Å; I31-E33 PolarHBondContact O-N 3.48Å; E33-L35 VanDerWaalsContact C-N 3.33Å; E33-L35 PolarHBondContact O-N 3.48Å; E33-N36 PolarHBondContact O-N 3.1Å; E33-N37 VanDerWaalsContact O-CB 3.32Å; E33-N37 WeakPolarHBondContact O-CB 3.2Å; E33-N37 PolarHBondContact O-N 3.46Å; E33-N37 PolarHBondContact O-ND2 3.16Å
34L88.1Confident87.2Confident91 Ų9184 Ų8448%0.47641%0.411SS..Hα-helixtrans-61.4-41.6176.9-71.6172.9000112.3E30 I31 N37 F38E30-L34 WeakPolarHBondContact O-CG 3.25Å; E30-L34 PolarHBondContact O-N 2.95Å; I31-L34 PolarHBondContact O-N 2.92Å; L34-N37 PolarHBondContact O-N 2.84Å; L34-F38 PolarHBondContact O-N 3.07Å
35L88.6Confident87.1Confident16 Ų1680.6 Ų80.68%0.08439%0.388CS..Hα-helixtrans-67.7-47.2177.8-66.8166.4000111.3L11 M15 I31 E32 E33 N37 F38 A39 Y63L11-L35 HydrophobicContact CD1-CD2 3.48Å; L11-L35 VanDerWaalsContact CD1-CD2 3.48Å; M15-L35 HydrophobicContact CE-CD1 3.14Å; M15-L35 HydrophobicContact CE-CD2 3.39Å; M15-L35 HydrophobicContact CE-CG 3.87Å; I31-L35 HydrophobicContact CG2-CD1 3.75Å; I31-L35 HydrophobicContact CG2-CG 4.23Å; I31-L35 WeakPolarHBondContact O-CD1 3.45Å; I31-L35 WeakPolarHBondContact O-CG 3.21Å; I31-L35 PolarHBondContact O-N 3.13Å; E32-L35 PolarHBondContact O-N 3.13Å; E33-L35 VanDerWaalsContact C-N 3.33Å; E33-L35 PolarHBondContact O-N 3.48Å; L35-N37 VanDerWaalsContact C-N 3.27Å; L35-N37 PolarHBondContact O-N 2.95Å; L35-F38 WeakPolarHBondContact O-CB 3.46Å; L35-F38 PolarHBondContact O-N 3.38Å; L35-F38 VanDerWaalsContact O-N 3.08Å; L35-A39 PolarHBondContact O-N 2.79Å; L35-Y63 WeakPolarHBondContact CA-OH 3.36Å; L35-Y63 HydrophobicContact CB-CE2 3.78Å; L35-Y63 HydrophobicContact CD2-CD2 4.47Å; L35-Y63 HydrophobicContact CD2-CE1 4.1Å; L35-Y63 HydrophobicContact CD2-CE2 3.96Å; L35-Y63 HydrophobicContact CG-CE2 4.3Å; L35-Y63 PolarHBondContact O-OH 2.95Å
36N86.4Confident87.1Confident96 Ų9679.3 Ų79.351%0.51337%0.374SS..Hα-helixtrans-58.1-42.6175.8-73.9-31000111.4E32 E33 F38 A39 Q40E32-N36 WeakPolarHBondContact O-CB 3.39Å; E32-N36 VanDerWaalsContact O-CG 3.23Å; E32-N36 PolarHBondContact O-N 3.37Å; E32-N36 PolarHBondContact O-ND2 3.3Å; E32-N36 VanDerWaalsContact O-ND2 3.17Å; E33-N36 PolarHBondContact O-N 3.1Å; N36-F38 PolarHBondContact O-N 3.42Å; N36-A39 PolarHBondContact O-N 3.22Å; N36-Q40 WeakPolarHBondContact O-CG 3.35Å; N36-Q40 PolarHBondContact O-N 2.87Å; N36-Q40 VanDerWaalsContact O-N 3.15Å
37N85.2Confident86.9Confident91 Ų9175 Ų7549%0.48735%0.353SS..Hα-helixtrans-61.8-41.3175.1-73.6-30.7000112.1E33 L34 L35 Q41E33-N37 VanDerWaalsContact O-CB 3.32Å; E33-N37 WeakPolarHBondContact O-CB 3.2Å; E33-N37 PolarHBondContact O-N 3.46Å; E33-N37 PolarHBondContact O-ND2 3.16Å; L34-N37 PolarHBondContact O-N 2.84Å; L35-N37 VanDerWaalsContact C-N 3.27Å; L35-N37 PolarHBondContact O-N 2.95Å; N37-Q41 WeakPolarHBondContact O-CG 3.36Å
38F86.8Confident86.9Confident39 Ų3971.6 Ų71.617%0.17134%0.34CS..Hα-helixtrans-63.6-46.6174.4172.6-91.9000111.8L34 L35 N36 Q40 Q41 A44 F47 F51 Y63L34-F38 PolarHBondContact O-N 3.07Å; L35-F38 WeakPolarHBondContact O-CB 3.46Å; L35-F38 PolarHBondContact O-N 3.38Å; L35-F38 VanDerWaalsContact O-N 3.08Å; N36-F38 PolarHBondContact O-N 3.42Å; F38-Q40 PolarHBondContact O-N 3.5Å; F38-Q41 WeakPolarHBondContact O-CB 3.42Å; F38-Q41 PolarHBondContact O-N 3.23Å; F38-A44 HydrophobicContact CE1-CB 4.18Å; F38-A44 HydrophobicContact CZ-CB 4.29Å; F38-A44 VanDerWaalsContact O-CB 3.29Å; F38-A44 WeakPolarHBondContact O-CB 3.42Å; F38-F47 HydrophobicContact CE2-CB 4.47Å; F38-F47 HydrophobicContact CZ-CB 3.9Å; F38-F51 HydrophobicContact CE1-CE2 4.41Å; F38-F51 AromaticContact CZ-CE2 3.91Å; F38-F51 HydrophobicContact CZ-CE2 3.91Å; F38-F51 HydrophobicContact CZ-CZ 4.44Å; F38-Y63 HydrophobicContact CD1-CE1 4Å; F38-Y63 WeakPolarHBondContact CD1-OH 3.37Å; F38-Y63 HydrophobicContact CE1-CE1 4.2Å
39A84.4Confident86.8Confident19 Ų1970.3 Ų70.316%0.15734%0.336CS..Hα-helixtrans-61.3-28.1-17800000113.1L35 N36 V67L35-A39 PolarHBondContact O-N 2.79Å; N36-A39 PolarHBondContact O-N 3.22Å; A39-V67 HydrophobicContact CB-CG1 4.45Å; A39-V67 HydrophobicContact CB-CG2 3.88Å
40Q79.6Confident86.8Confident135 Ų13565.1 Ų65.163%0.63132%0.317SS*.THydrogen-bonded Turntrans-81.6-9.9176.9-69.7175.75.300114N36 F38N36-Q40 WeakPolarHBondContact O-CG 3.35Å; N36-Q40 PolarHBondContact O-N 2.87Å; N36-Q40 VanDerWaalsContact O-N 3.15Å; F38-Q40 PolarHBondContact O-N 3.5Å
41Q82.4Confident86.8Confident113 Ų11360.5 Ų60.553%0.52830%0.295SS..SBendtrans-70138.6-179.3-69175.19.500112.1N37 F38 G43 A44N37-Q41 WeakPolarHBondContact O-CG 3.36Å; F38-Q41 WeakPolarHBondContact O-CB 3.42Å; F38-Q41 PolarHBondContact O-N 3.23Å; Q41-G43 PolarHBondContact O-N 3.35Å; Q41-A44 HydrophobicContact CB-CB 4.3Å; Q41-A44 VanDerWaalsContact O-CB 3.27Å; Q41-A44 WeakPolarHBondContact O-CB 3.47Å; Q41-A44 PolarHBondContact O-N 3.25Å
42I76.4Confident86.8Confident164 Ų16461.1 Ų61.184%0.84130%0.298SS*.THydrogen-bonded Turntrans-62.2120.8175.4-58.7172.8000109.1
43G80.8Confident86.6Confident15 Ų1559.9 Ų59.916%0.15530%0.3CS..THydrogen-bonded Turntrans855.2-17900000115.3Q41 W45 R46Q41-G43 PolarHBondContact O-N 3.35Å; G43-W45 PolarHBondContact O-N 2.93Å; G43-W45 VanDerWaalsContact O-N 3.12Å; G43-R46 WeakPolarHBondContact O-CB 3.49Å; G43-R46 PolarHBondContact O-N 3.34Å
44A86.3Confident86.6Confident3 Ų356.5 Ų56.53%0.02529%0.291CS..Hα-helixtrans-53.1-33174.600000113F38 Q41 R46 F47 C48F38-A44 HydrophobicContact CE1-CB 4.18Å; F38-A44 HydrophobicContact CZ-CB 4.29Å; F38-A44 VanDerWaalsContact O-CB 3.29Å; F38-A44 WeakPolarHBondContact O-CB 3.42Å; Q41-A44 HydrophobicContact CB-CB 4.3Å; Q41-A44 VanDerWaalsContact O-CB 3.27Å; Q41-A44 WeakPolarHBondContact O-CB 3.47Å; Q41-A44 PolarHBondContact O-N 3.25Å; A44-R46 PolarHBondContact O-N 2.94Å; A44-F47 WeakPolarHBondContact O-CB 3.38Å; A44-F47 PolarHBondContact O-N 2.83Å; A44-F47 VanDerWaalsContact O-N 3.13Å; A44-C48 PolarHBondContact O-N 3.27Å
45W89.2Confident86.6Confident11 Ų1152.6 Ų52.64%0.04227%0.271CS..Hα-helixtrans-59.1-28.7177.272.8-100.2000113.6G43 C48 L49 F68 L71 D83 E86 I87G43-W45 PolarHBondContact O-N 2.93Å; G43-W45 VanDerWaalsContact O-N 3.12Å; W45-C48 PolarHBondContact O-N 3.03Å; W45-L49 HydrophobicContact CZ3-CD2 4.38Å; W45-L49 PolarHBondContact O-N 3.42Å; W45-F68 HydrophobicContact CB-CD1 4.45Å; W45-F68 HydrophobicContact CB-CE1 3.87Å; W45-F68 HydrophobicContact CB-CZ 4.24Å; W45-F68 HydrophobicContact CE3-CE1 4.15Å; W45-F68 HydrophobicContact CE3-CZ 4.36Å; W45-F68 WeakPolarHBondContact O-CZ 3.47Å; W45-L71 HydrophobicContact CB-CD2 3.78Å; W45-L71 HydrophobicContact CG-CD2 4.03Å; W45-D83 HydrophobicContact CZ2-CB 3.75Å; W45-D83 PolarHBondContact NE1-OD2 3.16Å; W45-E86 HydrophobicContact CH2-CB 4.15Å; W45-E86 HydrophobicContact CH2-CG 4.01Å; W45-E86 WeakPolarHBondContact CH2-OE2 3.29Å; W45-E86 HydrophobicContact CZ3-CG 4.46Å; W45-I87 HydrophobicContact CD2-CD1 3.83Å; W45-I87 HydrophobicContact CD2-CG1 3.98Å; W45-I87 HydrophobicContact CE3-CD1 3.99Å; W45-I87 HydrophobicContact CE3-CG1 3.61Å; W45-I87 HydrophobicContact CG-CD1 4.2Å; W45-I87 HydrophobicContact CH2-CG1 4Å; W45-I87 HydrophobicContact CZ2-CD1 4.42Å; W45-I87 HydrophobicContact CZ2-CG1 4.33Å; W45-I87 HydrophobicContact CZ3-CD1 4.37Å; W45-I87 HydrophobicContact CZ3-CG1 3.63Å
46R89.9Confident86.5Confident97 Ų9763.1 Ų63.137%0.36631%0.309SS..Hα-helixtrans-67.3-43.3176.5-68.9-176.3165.293.85111.1G43 A44 L49 Y50 D83 E86G43-R46 WeakPolarHBondContact O-CB 3.49Å; G43-R46 PolarHBondContact O-N 3.34Å; A44-R46 PolarHBondContact O-N 2.94Å; R46-L49 WeakPolarHBondContact O-CB 3.2Å; R46-L49 PolarHBondContact O-N 3.05Å; R46-Y50 PolarHBondContact O-N 3.27Å; R46-Y50 VanDerWaalsContact O-N 3.12Å; R46-D83 IonicContact CZ-OD1 2.76Å; R46-D83 IonicContact CZ-OD2 2.74Å; R46-D83 IonicContact NH1-OD1 3.79Å; R46-D83 IonicContact NH1-OD2 3.63Å; R46-D83 PolarHBondContact NH1-OD2 3.48Å; R46-D83 VanDerWaalsContact NH2-CG 3.3Å; R46-D83 IonicContact NH2-OD1 3.96Å; R46-D83 PolarHBondContact NH2-OD1 2.78Å; R46-D83 IonicContact NH2-OD2 3.89Å; R46-D83 PolarHBondContact NH2-OD2 3.46Å; R46-E86 IonicContact NH2-OE2 2.81Å
47F88.6Confident86.7Confident61 Ų6160.1 Ų60.127%0.26829%0.293SS..Hα-helixtrans-62.9-44.4172.3-69.1-82000111.1E4 F38 A44 L49 Y50 F51E4-F47 HydrophobicContact CB-CD1 4.43Å; E4-F47 HydrophobicContact CG-CD1 4.02Å; E4-F47 HydrophobicContact CG-CE1 3.92Å; F38-F47 HydrophobicContact CE2-CB 4.47Å; F38-F47 HydrophobicContact CZ-CB 3.9Å; A44-F47 WeakPolarHBondContact O-CB 3.38Å; A44-F47 PolarHBondContact O-N 2.83Å; A44-F47 VanDerWaalsContact O-N 3.13Å; F47-L49 VanDerWaalsContact C-N 3.29Å; F47-L49 PolarHBondContact O-N 2.95Å; F47-Y50 WeakPolarHBondContact O-CB 3.34Å; F47-Y50 PolarHBondContact O-N 2.74Å; F47-Y50 VanDerWaalsContact O-N 3.17Å; F47-F51 HydrophobicContact CB-CE1 4.28Å; F47-F51 HydrophobicContact CB-CE2 3.91Å; F47-F51 HydrophobicContact CB-CZ 3.72Å; F47-F51 HydrophobicContact CD1-CZ 4.4Å; F47-F51 HydrophobicContact CG-CZ 4.49Å; F47-F51 VanDerWaalsContact O-CD1 3.23Å; F47-F51 WeakPolarHBondContact O-CD1 3.37Å; F47-F51 WeakPolarHBondContact O-CD2 3.26Å; F47-F51 WeakPolarHBondContact O-CG 3.25Å; F47-F51 PolarHBondContact O-N 2.94Å
48C91.7Very high87Confident0 Ų058.8 Ų58.80%029%0.286CS..Hα-helixtrans-59.8-37.5175.2-68.90000112.9A44 W45 F51 L52 F68A44-C48 PolarHBondContact O-N 3.27Å; W45-C48 PolarHBondContact O-N 3.03Å; C48-F51 PolarHBondContact O-N 3.45Å; C48-L52 VanDerWaalsContact O-CG 3.31Å; C48-L52 WeakPolarHBondContact O-CG 3.44Å; C48-L52 PolarHBondContact O-N 2.95Å; C48-F68 HydrophobicContact CB-CD2 4.37Å; C48-F68 HydrophobicContact CB-CE2 3.79Å; C48-F68 HydrophobicContact CB-CZ 4.37Å
49L90.2Very high87.2Confident32 Ų3262 Ų6217%0.16830%0.298CS..Hα-helixtrans-62.7-45.8174.8-17364.3000111.2W45 R46 F47 L52 S53 F68 C90 L91W45-L49 HydrophobicContact CZ3-CD2 4.38Å; W45-L49 PolarHBondContact O-N 3.42Å; R46-L49 WeakPolarHBondContact O-CB 3.2Å; R46-L49 PolarHBondContact O-N 3.05Å; F47-L49 VanDerWaalsContact C-N 3.29Å; F47-L49 PolarHBondContact O-N 2.95Å; L49-L52 PolarHBondContact O-N 3.43Å; L49-S53 PolarHBondContact O-N 3.27Å; L49-S53 PolarHBondContact O-OG 3Å; L49-F68 HydrophobicContact CB-CZ 4.17Å; L49-C90 HydrophobicContact CD1-CB 4.12Å; L49-C90 HydrophobicContact CD2-CB 3.94Å; L49-L91 HydrophobicContact CD1-CD2 3.96Å
50Y89.4Confident87.5Confident68 Ų6861.1 Ų61.127%0.26729%0.29SS..Hα-helixtrans-62.2-41.8174.5176.7-95.7000112E4 L8 R46 F47 L52 S53 S54E4-Y50 HydrophobicContact CB-CD1 3.68Å; E4-Y50 HydrophobicContact CB-CD2 4.43Å; E4-Y50 HydrophobicContact CB-CE1 3.78Å; E4-Y50 HydrophobicContact CB-CG 4.02Å; E4-Y50 WeakPolarHBondContact OE2-CD2 3.45Å; L8-Y50 HydrophobicContact CD2-CE1 4.22Å; R46-Y50 PolarHBondContact O-N 3.27Å; R46-Y50 VanDerWaalsContact O-N 3.12Å; F47-Y50 WeakPolarHBondContact O-CB 3.34Å; F47-Y50 PolarHBondContact O-N 2.74Å; F47-Y50 VanDerWaalsContact O-N 3.17Å; Y50-L52 VanDerWaalsContact C-N 3.35Å; Y50-L52 PolarHBondContact O-N 3.23Å; Y50-S53 PolarHBondContact O-N 3.31Å; Y50-S53 PolarHBondContact O-OG 3.35Å; Y50-S54 WeakPolarHBondContact CE2-OG 3.31Å; Y50-S54 WeakPolarHBondContact O-CB 3.48Å; Y50-S54 PolarHBondContact O-N 2.94Å; Y50-S54 VanDerWaalsContact O-N 3.1Å; Y50-S54 PolarHBondContact O-OG 3.09Å
51F91.5Very high88.1Confident1 Ų155.3 Ų55.30%0.00426%0.263CS..Hα-helixtrans-60.8-44.6178.5-59-22.1000111.3L8 L11 F38 F47 C48 S53 S54 T55 V60L8-F51 HydrophobicContact CB-CD1 3.69Å; L8-F51 HydrophobicContact CB-CE1 3.64Å; L8-F51 HydrophobicContact CD1-CB 4.06Å; L8-F51 HydrophobicContact CD1-CD1 3.59Å; L8-F51 HydrophobicContact CD1-CE1 4.27Å; L8-F51 HydrophobicContact CD1-CG 3.92Å; L8-F51 HydrophobicContact CD2-CD1 4.49Å; L8-F51 HydrophobicContact CG-CD1 4.1Å; L11-F51 HydrophobicContact CD2-CD2 3.57Å; L11-F51 HydrophobicContact CD2-CE2 3.47Å; L11-F51 VanDerWaalsContact CD2-CE2 3.47Å; L11-F51 HydrophobicContact CD2-CZ 4.35Å; F38-F51 HydrophobicContact CE1-CE2 4.41Å; F38-F51 AromaticContact CZ-CE2 3.91Å; F38-F51 HydrophobicContact CZ-CE2 3.91Å; F38-F51 HydrophobicContact CZ-CZ 4.44Å; F47-F51 HydrophobicContact CB-CE1 4.28Å; F47-F51 HydrophobicContact CB-CE2 3.91Å; F47-F51 HydrophobicContact CB-CZ 3.72Å; F47-F51 HydrophobicContact CD1-CZ 4.4Å; F47-F51 HydrophobicContact CG-CZ 4.49Å; F47-F51 VanDerWaalsContact O-CD1 3.23Å; F47-F51 WeakPolarHBondContact O-CD1 3.37Å; F47-F51 WeakPolarHBondContact O-CD2 3.26Å; F47-F51 WeakPolarHBondContact O-CG 3.25Å; F47-F51 PolarHBondContact O-N 2.94Å; C48-F51 PolarHBondContact O-N 3.45Å; F51-S53 VanDerWaalsContact C-N 3.27Å; F51-S53 PolarHBondContact O-N 3.1Å; F51-S54 PolarHBondContact O-N 3.43Å; F51-S54 VanDerWaalsContact O-N 3.14Å; F51-T55 WeakPolarHBondContact O-CB 3.42Å; F51-T55 WeakPolarHBondContact O-CG2 3.41Å; F51-T55 PolarHBondContact O-N 3.27Å; F51-V60 HydrophobicContact CB-CG1 4.14Å
52L88.9Confident88.6Confident13 Ų1353 Ų537%0.06825%0.253CS..Hα-helixtrans-61.3-31.8179.1-73.1171.5000113.6C48 L49 Y50 M61 L65 F68 L91 L94C48-L52 VanDerWaalsContact O-CG 3.31Å; C48-L52 WeakPolarHBondContact O-CG 3.44Å; C48-L52 PolarHBondContact O-N 2.95Å; L49-L52 PolarHBondContact O-N 3.43Å; Y50-L52 VanDerWaalsContact C-N 3.35Å; Y50-L52 PolarHBondContact O-N 3.23Å; L52-M61 HydrophobicContact CD2-CB 4.08Å; L52-M61 HydrophobicContact CD2-CG 4.29Å; L52-L65 HydrophobicContact CD1-CD2 3.85Å; L52-L65 HydrophobicContact CD1-CG 4.49Å; L52-L65 HydrophobicContact CD2-CD2 4.13Å; L52-L65 HydrophobicContact CD2-CG 4Å; L52-F68 HydrophobicContact CD1-CD2 4.16Å; L52-F68 HydrophobicContact CD1-CE2 3.82Å; L52-L91 HydrophobicContact CD1-CD2 4.48Å; L52-L94 HydrophobicContact CB-CD2 3.97Å; L52-L94 HydrophobicContact CD1-CD2 4.32Å
53S86.1Confident89.4Confident67 Ų6746.6 Ų46.647%0.46922%0.219SC..Hα-helixtrans-84.1-21.2176.455.10000114.2L49 Y50 F51L49-S53 PolarHBondContact O-N 3.27Å; L49-S53 PolarHBondContact O-OG 3Å; Y50-S53 PolarHBondContact O-N 3.31Å; Y50-S53 PolarHBondContact O-OG 3.35Å; F51-S53 VanDerWaalsContact C-N 3.27Å; F51-S53 PolarHBondContact O-N 3.1Å
54S87.5Confident90Very high55 Ų5545.9 Ų45.939%0.38521%0.211SC..Hα-helixtrans-114.8-22.4-163.7-58.10000114.6Y50 F51Y50-S54 WeakPolarHBondContact CE2-OG 3.31Å; Y50-S54 WeakPolarHBondContact O-CB 3.48Å; Y50-S54 PolarHBondContact O-N 2.94Å; Y50-S54 VanDerWaalsContact O-N 3.1Å; Y50-S54 PolarHBondContact O-OG 3.09Å; F51-S54 PolarHBondContact O-N 3.43Å; F51-S54 VanDerWaalsContact O-N 3.14Å
55T89.4Confident90.4Very high9 Ų945.8 Ų45.86%0.05521%0.21CC..  trans-91.3162.5-180-166.10000112.9E12 F51 N57 V60 M61E12-T55 PolarHBondContact OE1-OG1 3.1Å; F51-T55 WeakPolarHBondContact O-CB 3.42Å; F51-T55 WeakPolarHBondContact O-CG2 3.41Å; F51-T55 PolarHBondContact O-N 3.27Å; T55-N57 WeakPolarHBondContact OG1-CB 3.22Å; T55-N57 PolarHBondContact OG1-N 2.66Å; T55-V60 HydrophobicContact CG2-CB 4.22Å; T55-V60 HydrophobicContact CG2-CG1 4.11Å; T55-M61 HydrophobicContact CG2-CE 3.84Å; T55-M61 HydrophobicContact CG2-CG 3.63Å; T55-M61 WeakPolarHBondContact O-CE 3.41Å
56R85.8Confident90.6Very high236 Ų23647.5 Ų47.589%0.89122%0.222SC*.  trans-117.54.5163.4-64.8-174.5179.8-176.3-0112.4
57N90.1Very high90.6Very high34 Ų3443.2 Ų43.218%0.18221%0.207CC..  trans-84.8113.4-179.1-173.6-38.9000110.2E12 T55 Y59 V60 M61E12-N57 HydrophobicContact CG-CB 4.19Å; T55-N57 WeakPolarHBondContact OG1-CB 3.22Å; T55-N57 PolarHBondContact OG1-N 2.66Å; N57-Y59 VanDerWaalsContact C-N 3.26Å; N57-Y59 PolarHBondContact O-N 3.16Å; N57-Y59 WeakPolarHBondContact OD1-CB 3.45Å; N57-Y59 PolarHBondContact OD1-N 2.76Å; N57-V60 HydrophobicContact CB-CB 4.24Å; N57-V60 HydrophobicContact CB-CG2 3.99Å; N57-V60 PolarHBondContact O-N 2.69Å; N57-V60 VanDerWaalsContact O-N 3.14Å; N57-V60 PolarHBondContact OD1-N 2.94Å; N57-M61 PolarHBondContact O-N 3.29Å; N57-M61 VanDerWaalsContact O-N 3.09Å
58D91.1Very high90.9Very high63 Ų6340.3 Ų40.334%0.33719%0.194SC..Hα-helixtrans-60.2-33.5-176.7-66.5-18.6000113M61 M62 P103 F105D58-M61 PolarHBondContact O-N 2.83Å; D58-M62 PolarHBondContact O-N 3.01Å; D58-P103 WeakPolarHBondContact OD1-CG 3.4Å; D58-F105 HydrophobicContact CB-CE2 4.2Å; D58-F105 HydrophobicContact CB-CZ 4.08Å
59Y90.9Very high90.8Very high107 Ų10741.5 Ų41.542%0.4220%0.2SC..Hα-helixtrans-65.4-42.6177-58.4-54.8000111.6F19 N57 M61 M62 Y63F19-Y59 HydrophobicContact CB-CE1 4.32Å; F19-Y59 HydrophobicContact CB-CE2 4.06Å; F19-Y59 HydrophobicContact CD1-CE1 4.17Å; F19-Y59 AromaticContact CD2-CD1 3.41Å; F19-Y59 HydrophobicContact CD2-CD1 3.41Å; F19-Y59 VanDerWaalsContact CD2-CD1 3.41Å; F19-Y59 AromaticContact CD2-CD2 3.87Å; F19-Y59 HydrophobicContact CD2-CD2 3.87Å; F19-Y59 AromaticContact CD2-CE1 3.57Å; F19-Y59 HydrophobicContact CD2-CE1 3.57Å; F19-Y59 HydrophobicContact CD2-CE2 4.01Å; F19-Y59 AromaticContact CD2-CG 3.57Å; F19-Y59 HydrophobicContact CD2-CG 3.57Å; F19-Y59 AromaticContact CD2-CZ 3.86Å; F19-Y59 HydrophobicContact CE1-CE1 4.41Å; F19-Y59 AromaticContact CE2-CD1 3.39Å; F19-Y59 HydrophobicContact CE2-CD1 3.39Å; F19-Y59 AromaticContact CE2-CE1 3.86Å; F19-Y59 HydrophobicContact CE2-CE1 3.86Å; F19-Y59 AromaticContact CE2-CG 3.77Å; F19-Y59 HydrophobicContact CE2-CG 3.77Å; F19-Y59 HydrophobicContact CG-CD1 4.1Å; F19-Y59 AromaticContact CG-CE1 3.76Å; F19-Y59 HydrophobicContact CG-CE1 3.76Å; F19-Y59 HydrophobicContact CG-CE2 4.24Å; F19-Y59 HydrophobicContact CG-CG 4.49Å; F19-Y59 AromaticContact CG-CZ 3.83Å; F19-Y59 HydrophobicContact CZ-CD1 4.04Å; F19-Y59 HydrophobicContact CZ-CE1 4.27Å; N57-Y59 VanDerWaalsContact C-N 3.26Å; N57-Y59 PolarHBondContact O-N 3.16Å; N57-Y59 WeakPolarHBondContact OD1-CB 3.45Å; N57-Y59 PolarHBondContact OD1-N 2.76Å; Y59-M61 VanDerWaalsContact C-N 3.35Å; Y59-M62 PolarHBondContact O-N 3.13Å; Y59-Y63 VanDerWaalsContact O-CB 3.31Å; Y59-Y63 WeakPolarHBondContact O-CB 3.4Å; Y59-Y63 PolarHBondContact O-N 3.5Å
60V91.4Very high90.8Very high0 Ų042.9 Ų42.90%021%0.207CC..Hα-helixtrans-66.9-38.4177.6177.80000111L8 L11 E12 M15 F51 T55 N57 S64L8-V60 HydrophobicContact CD1-CG1 4.03Å; L11-V60 HydrophobicContact CD2-CG1 3.8Å; L11-V60 HydrophobicContact CG-CG1 4.23Å; L11-V60 HydrophobicContact CG-CG2 4.26Å; E12-V60 HydrophobicContact CB-CG2 4.37Å; E12-V60 HydrophobicContact CG-CG2 3.74Å; M15-V60 HydrophobicContact CB-CG2 4.15Å; M15-V60 HydrophobicContact CG-CG2 3.82Å; F51-V60 HydrophobicContact CB-CG1 4.14Å; T55-V60 HydrophobicContact CG2-CB 4.22Å; T55-V60 HydrophobicContact CG2-CG1 4.11Å; N57-V60 HydrophobicContact CB-CB 4.24Å; N57-V60 HydrophobicContact CB-CG2 3.99Å; N57-V60 PolarHBondContact O-N 2.69Å; N57-V60 VanDerWaalsContact O-N 3.14Å; N57-V60 PolarHBondContact OD1-N 2.94Å; V60-S64 VanDerWaalsContact O-CB 3.3Å; V60-S64 WeakPolarHBondContact O-CB 3.2Å; V60-S64 PolarHBondContact O-N 3.47Å; V60-S64 PolarHBondContact O-OG 3.34Å
61M92.3Very high90.7Very high12 Ų1240.5 Ų40.56%0.05920%0.199CC..Hα-helixtrans-64.2-48.3174.7-66.4-172.1-17700111.7L52 T55 N57 D58 Y59 Y63 S64 L65 L102 I106L52-M61 HydrophobicContact CD2-CB 4.08Å; L52-M61 HydrophobicContact CD2-CG 4.29Å; T55-M61 HydrophobicContact CG2-CE 3.84Å; T55-M61 HydrophobicContact CG2-CG 3.63Å; T55-M61 WeakPolarHBondContact O-CE 3.41Å; N57-M61 PolarHBondContact O-N 3.29Å; N57-M61 VanDerWaalsContact O-N 3.09Å; D58-M61 PolarHBondContact O-N 2.83Å; Y59-M61 VanDerWaalsContact C-N 3.35Å; M61-Y63 PolarHBondContact O-N 3.12Å; M61-S64 PolarHBondContact O-N 2.93Å; M61-L65 WeakPolarHBondContact O-CG 3.34Å; M61-L65 PolarHBondContact O-N 3.49Å; M61-L102 HydrophobicContact CE-CD2 4.4Å; M61-L102 HydrophobicContact SD-CD2 3.91Å; M61-I106 HydrophobicContact CB-CD1 3.76Å; M61-I106 HydrophobicContact CB-CG1 4.31Å; M61-I106 HydrophobicContact CB-CG2 4.11Å; M61-I106 HydrophobicContact SD-CG1 4.42Å; M61-I106 HydrophobicContact SD-CG2 4.1Å
62M93.2Very high90.7Very high65 Ų6540.4 Ų40.432%0.3220%0.199SC..Hα-helixtrans-60.7-45.3177.2-84-56.5-78.500112.2D58 Y59 L65 T66 F105 I106 K109D58-M62 PolarHBondContact O-N 3.01Å; Y59-M62 PolarHBondContact O-N 3.13Å; M62-L65 PolarHBondContact O-N 2.85Å; M62-T66 WeakPolarHBondContact O-CB 3.39Å; M62-T66 PolarHBondContact O-N 3.44Å; M62-T66 PolarHBondContact O-OG1 3.41Å; M62-F105 HydrophobicContact CG-CD2 4.32Å; M62-F105 HydrophobicContact CG-CE2 4.34Å; M62-F105 HydrophobicContact SD-CD2 4.19Å; M62-I106 HydrophobicContact CB-CD1 4.31Å; M62-I106 HydrophobicContact CG-CD1 3.4Å; M62-I106 VanDerWaalsContact CG-CD1 3.4Å; M62-I106 HydrophobicContact SD-CD1 3.61Å; M62-K109 HydrophobicContact CE-CG 4.35Å; M62-K109 HydrophobicContact SD-CB 4.15Å; M62-K109 HydrophobicContact SD-CG 4.13Å
63Y92.9Very high90.5Very high30 Ų3040.7 Ų40.712%0.11820%0.2CC..Hα-helixtrans-58.7-48.7176.1174.4-104.2000111.2L11 M15 L35 F38 Y59 M61 L65 T66 V67L11-Y63 HydrophobicContact CD1-CD1 4.09Å; L11-Y63 HydrophobicContact CD1-CE1 4.01Å; L11-Y63 HydrophobicContact CD2-CD1 3.94Å; L11-Y63 HydrophobicContact CD2-CE1 4.11Å; M15-Y63 HydrophobicContact CE-CD2 4.26Å; M15-Y63 HydrophobicContact CE-CG 4.22Å; L35-Y63 WeakPolarHBondContact CA-OH 3.36Å; L35-Y63 HydrophobicContact CB-CE2 3.78Å; L35-Y63 HydrophobicContact CD2-CD2 4.47Å; L35-Y63 HydrophobicContact CD2-CE1 4.1Å; L35-Y63 HydrophobicContact CD2-CE2 3.96Å; L35-Y63 HydrophobicContact CG-CE2 4.3Å; L35-Y63 PolarHBondContact O-OH 2.95Å; F38-Y63 HydrophobicContact CD1-CE1 4Å; F38-Y63 WeakPolarHBondContact CD1-OH 3.37Å; F38-Y63 HydrophobicContact CE1-CE1 4.2Å; Y59-Y63 VanDerWaalsContact O-CB 3.31Å; Y59-Y63 WeakPolarHBondContact O-CB 3.4Å; Y59-Y63 PolarHBondContact O-N 3.5Å; M61-Y63 PolarHBondContact O-N 3.12Å; Y63-L65 VanDerWaalsContact C-N 3.33Å; Y63-L65 PolarHBondContact O-N 2.88Å; Y63-T66 WeakPolarHBondContact O-CA 3.49Å; Y63-T66 WeakPolarHBondContact O-CB 3.23Å; Y63-T66 PolarHBondContact O-N 3.45Å; Y63-V67 HydrophobicContact CD1-CG2 4.39Å; Y63-V67 HydrophobicContact CE1-CG2 3.95Å; Y63-V67 HydrophobicContact CE2-CG2 4.15Å; Y63-V67 WeakPolarHBondContact O-CG2 3.29Å; Y63-V67 PolarHBondContact O-N 3.29Å
64S93.5Very high90.4Very high0 Ų041.5 Ų41.50%020%0.195CC..Hα-helixtrans-59.2-41.8178.5-61.30000112.4V60 M61 T66 V67 F68V60-S64 VanDerWaalsContact O-CB 3.3Å; V60-S64 WeakPolarHBondContact O-CB 3.2Å; V60-S64 PolarHBondContact O-N 3.47Å; V60-S64 PolarHBondContact O-OG 3.34Å; M61-S64 PolarHBondContact O-N 2.93Å; S64-T66 VanDerWaalsContact C-N 3.32Å; S64-T66 PolarHBondContact O-N 2.95Å; S64-V67 PolarHBondContact O-N 3.42Å; S64-F68 VanDerWaalsContact O-CD2 3.25Å; S64-F68 WeakPolarHBondContact O-CD2 3.44Å; S64-F68 PolarHBondContact O-N 2.93Å; S64-F68 VanDerWaalsContact O-N 3.16Å
65L94.2Very high90.2Very high0 Ų040.6 Ų40.60%019%0.185CC..Hα-helixtrans-67.4-32.4174.8-67.8175.3000112.8L52 M61 M62 Y63 F68 E69 I106 K109 L110 V113L52-L65 HydrophobicContact CD1-CD2 3.85Å; L52-L65 HydrophobicContact CD1-CG 4.49Å; L52-L65 HydrophobicContact CD2-CD2 4.13Å; L52-L65 HydrophobicContact CD2-CG 4Å; M61-L65 WeakPolarHBondContact O-CG 3.34Å; M61-L65 PolarHBondContact O-N 3.49Å; M62-L65 PolarHBondContact O-N 2.85Å; Y63-L65 VanDerWaalsContact C-N 3.33Å; Y63-L65 PolarHBondContact O-N 2.88Å; L65-F68 PolarHBondContact O-N 2.88Å; L65-E69 WeakPolarHBondContact O-CB 3.29Å; L65-E69 PolarHBondContact O-N 3.22Å; L65-I106 HydrophobicContact CD1-CG2 3.84Å; L65-I106 WeakPolarHBondContact CD1-O 3.4Å; L65-K109 HydrophobicContact CB-CG 3.75Å; L65-K109 HydrophobicContact CD1-CB 3.8Å; L65-K109 HydrophobicContact CD1-CG 3.73Å; L65-K109 HydrophobicContact CG-CG 4.37Å; L65-L110 HydrophobicContact CD1-CB 4.15Å; L65-L110 HydrophobicContact CD2-CB 3.96Å; L65-L110 HydrophobicContact CD2-CD1 3.74Å; L65-L110 HydrophobicContact CD2-CG 4.4Å; L65-V113 HydrophobicContact CB-CG2 4.4Å; L65-V113 HydrophobicContact CD2-CG2 4.47Å; L65-V113 WeakPolarHBondContact O-CG2 3.41Å
66T92.9Very high90.1Very high48 Ų4840.6 Ų40.629%0.29418%0.184SC..Hα-helixtrans-70.5-35.5176.1-55.50000111.2M62 Y63 S64 E69 N70M62-T66 WeakPolarHBondContact O-CB 3.39Å; M62-T66 PolarHBondContact O-N 3.44Å; M62-T66 PolarHBondContact O-OG1 3.41Å; Y63-T66 WeakPolarHBondContact O-CA 3.49Å; Y63-T66 WeakPolarHBondContact O-CB 3.23Å; Y63-T66 PolarHBondContact O-N 3.45Å; S64-T66 VanDerWaalsContact C-N 3.32Å; S64-T66 PolarHBondContact O-N 2.95Å; T66-E69 PolarHBondContact O-N 3.04Å; T66-N70 WeakPolarHBondContact O-CB 3.46Å; T66-N70 PolarHBondContact O-N 3.46Å; T66-N70 PolarHBondContact O-ND2 3.35Å
67V91.7Very high89.9Confident7 Ų734.8 Ų34.84%0.04217%0.171CC..Hα-helixtrans-60.9-45.2170.2175.30000110.6A39 Y63 S64 N70 L71A39-V67 HydrophobicContact CB-CG1 4.45Å; A39-V67 HydrophobicContact CB-CG2 3.88Å; Y63-V67 HydrophobicContact CD1-CG2 4.39Å; Y63-V67 HydrophobicContact CE1-CG2 3.95Å; Y63-V67 HydrophobicContact CE2-CG2 4.15Å; Y63-V67 WeakPolarHBondContact O-CG2 3.29Å; Y63-V67 PolarHBondContact O-N 3.29Å; S64-V67 PolarHBondContact O-N 3.42Å; V67-N70 PolarHBondContact O-N 2.95Å; V67-L71 VanDerWaalsContact O-CB 3.31Å; V67-L71 WeakPolarHBondContact O-CB 3.38Å; V67-L71 PolarHBondContact O-N 2.96Å
68F93.1Very high89.3Confident0 Ų035.5 Ų35.50%019%0.186CC..Hα-helixtrans-62.1-48174.6-80.9-70.4000112.7W45 C48 L49 L52 S64 L65 N70 L71 I72 I87 L91 V113W45-F68 HydrophobicContact CB-CD1 4.45Å; W45-F68 HydrophobicContact CB-CE1 3.87Å; W45-F68 HydrophobicContact CB-CZ 4.24Å; W45-F68 HydrophobicContact CE3-CE1 4.15Å; W45-F68 HydrophobicContact CE3-CZ 4.36Å; W45-F68 WeakPolarHBondContact O-CZ 3.47Å; C48-F68 HydrophobicContact CB-CD2 4.37Å; C48-F68 HydrophobicContact CB-CE2 3.79Å; C48-F68 HydrophobicContact CB-CZ 4.37Å; L49-F68 HydrophobicContact CB-CZ 4.17Å; L52-F68 HydrophobicContact CD1-CD2 4.16Å; L52-F68 HydrophobicContact CD1-CE2 3.82Å; S64-F68 VanDerWaalsContact O-CD2 3.25Å; S64-F68 WeakPolarHBondContact O-CD2 3.44Å; S64-F68 PolarHBondContact O-N 2.93Å; S64-F68 VanDerWaalsContact O-N 3.16Å; L65-F68 PolarHBondContact O-N 2.88Å; F68-N70 VanDerWaalsContact C-N 3.32Å; F68-N70 PolarHBondContact O-N 3.15Å; F68-L71 WeakPolarHBondContact O-CB 3.39Å; F68-L71 PolarHBondContact O-N 3.13Å; F68-I72 HydrophobicContact CB-CD1 4.4Å; F68-I72 WeakPolarHBondContact O-CB 3.41Å; F68-I72 VanDerWaalsContact O-CD1 3.3Å; F68-I72 WeakPolarHBondContact O-CD1 3.42Å; F68-I72 VanDerWaalsContact O-CG1 3.27Å; F68-I72 WeakPolarHBondContact O-CG1 3.48Å; F68-I72 PolarHBondContact O-N 3.38Å; F68-I87 HydrophobicContact CD1-CG2 4.29Å; F68-I87 HydrophobicContact CE1-CD1 4.48Å; F68-I87 HydrophobicContact CE1-CG1 4.27Å; F68-I87 HydrophobicContact CE1-CG2 4.16Å; F68-L91 HydrophobicContact CD1-CD1 4.08Å; F68-L91 HydrophobicContact CD2-CD2 4.48Å; F68-L91 HydrophobicContact CE1-CD1 4.3Å; F68-L91 HydrophobicContact CE1-CD2 4.48Å; F68-L91 HydrophobicContact CE2-CD2 4.15Å; F68-L91 HydrophobicContact CG-CD1 4.33Å; F68-L91 HydrophobicContact CZ-CD2 4.16Å; F68-V113 HydrophobicContact CB-CG1 3.67Å; F68-V113 HydrophobicContact CB-CG2 4.44Å; F68-V113 HydrophobicContact CG-CG1 4.46Å
69E91.1Very high89.1Confident24 Ų2433.3 Ų33.311%0.11217%0.174CC..Hα-helixtrans-56.5-45.2178-177.4-177.8-132.600111.8L65 T66 I72 N73 K109 K112 V113L65-E69 WeakPolarHBondContact O-CB 3.29Å; L65-E69 PolarHBondContact O-N 3.22Å; T66-E69 PolarHBondContact O-N 3.04Å; E69-I72 PolarHBondContact O-N 3.34Å; E69-N73 WeakPolarHBondContact CG-ND2 3.28Å; E69-N73 WeakPolarHBondContact O-CB 3.48Å; E69-N73 PolarHBondContact O-N 3.24Å; E69-N73 PolarHBondContact O-ND2 3Å; E69-N73 VanDerWaalsContact O-ND2 3.12Å; E69-K109 IonicContact OE1-NZ 3.72Å; E69-K109 PolarHBondContact OE1-NZ 3.44Å; E69-K109 WeakPolarHBondContact OE2-CE 3.37Å; E69-K109 IonicContact OE2-NZ 2.71Å; E69-K109 PolarHBondContact OE2-NZ 2.94Å; E69-K112 WeakPolarHBondContact OE1-CE 3.45Å; E69-K112 IonicContact OE1-NZ 3.11Å; E69-K112 PolarHBondContact OE1-NZ 2.87Å; E69-V113 HydrophobicContact CB-CG2 4.17Å
70N88.6Confident88.9Confident61 Ų6131.8 Ų31.833%0.32618%0.178SC..Hα-helixtrans-66-41.9176.5-78.5-35.6000112.2T66 V67 F68 I72 K74T66-N70 WeakPolarHBondContact O-CB 3.46Å; T66-N70 PolarHBondContact O-N 3.46Å; T66-N70 PolarHBondContact O-ND2 3.35Å; V67-N70 PolarHBondContact O-N 2.95Å; F68-N70 VanDerWaalsContact C-N 3.32Å; F68-N70 PolarHBondContact O-N 3.15Å; N70-I72 VanDerWaalsContact C-N 3.31Å; N70-I72 PolarHBondContact O-N 2.98Å; N70-K74 VanDerWaalsContact O-CB 3.29Å; N70-K74 WeakPolarHBondContact O-CB 3.29Å; N70-K74 PolarHBondContact O-N 3.41Å
71L89.4Confident88.7Confident18 Ų1836.5 Ų36.59%0.09421%0.211CC..Hα-helixtrans-58.4-44175.7-179.973.2000111.2W45 V67 F68 M75 W76 V79 I87W45-L71 HydrophobicContact CB-CD2 3.78Å; W45-L71 HydrophobicContact CG-CD2 4.03Å; V67-L71 VanDerWaalsContact O-CB 3.31Å; V67-L71 WeakPolarHBondContact O-CB 3.38Å; V67-L71 PolarHBondContact O-N 2.96Å; F68-L71 WeakPolarHBondContact O-CB 3.39Å; F68-L71 PolarHBondContact O-N 3.13Å; L71-M75 HydrophobicContact CB-CE 4.3Å; L71-M75 HydrophobicContact CD1-CB 4.08Å; L71-M75 HydrophobicContact CD1-CE 3.77Å; L71-M75 CarbonylContact O-C 3.3Å; L71-M75 VanDerWaalsContact O-C 3.3Å; L71-M75 WeakPolarHBondContact O-CA 2.92Å; L71-M75 PolarHBondContact O-N 3.16Å; L71-W76 PolarHBondContact O-N 3.35Å; L71-V79 HydrophobicContact CD1-CG2 3.72Å; L71-V79 HydrophobicContact CG-CG2 4.14Å; L71-I87 HydrophobicContact CD2-CD1 3.9Å
72I89.6Confident88.5Confident0 Ų043.5 Ų43.50%024%0.243CC..Hα-helixtrans-76.9-41.9-176.5-64.6154.9000112F68 E69 N70 W76 V113 D116 I117 Q120F68-I72 HydrophobicContact CB-CD1 4.4Å; F68-I72 WeakPolarHBondContact O-CB 3.41Å; F68-I72 VanDerWaalsContact O-CD1 3.3Å; F68-I72 WeakPolarHBondContact O-CD1 3.42Å; F68-I72 VanDerWaalsContact O-CG1 3.27Å; F68-I72 WeakPolarHBondContact O-CG1 3.48Å; F68-I72 PolarHBondContact O-N 3.38Å; E69-I72 PolarHBondContact O-N 3.34Å; N70-I72 VanDerWaalsContact C-N 3.31Å; N70-I72 PolarHBondContact O-N 2.98Å; I72-W76 HydrophobicContact CB-CE3 4.34Å; I72-W76 HydrophobicContact CG1-CE3 3.87Å; I72-W76 HydrophobicContact CG1-CZ3 3.88Å; I72-W76 WeakPolarHBondContact O-CB 3.23Å; I72-V113 HydrophobicContact CD1-CG1 3.6Å; I72-D116 HydrophobicContact CG2-CB 3.81Å; I72-D116 WeakPolarHBondContact CG2-O 3.48Å; I72-I117 HydrophobicContact CD1-CD1 4Å; I72-I117 HydrophobicContact CD1-CG1 3.45Å; I72-I117 VanDerWaalsContact CD1-CG1 3.45Å; I72-I117 HydrophobicContact CG1-CG1 3.95Å; I72-I117 HydrophobicContact CG2-CG1 4.18Å; I72-Q120 HydrophobicContact CG2-CG 4.12Å
73N86.4Confident88.4Confident19 Ų1941.5 Ų41.510%0.10223%0.234CC..Hα-helixtrans-81.7-24.2-176.5-69-46.7000113E69 D116 R119E69-N73 WeakPolarHBondContact CG-ND2 3.28Å; E69-N73 WeakPolarHBondContact O-CB 3.48Å; E69-N73 PolarHBondContact O-N 3.24Å; E69-N73 PolarHBondContact O-ND2 3Å; E69-N73 VanDerWaalsContact O-ND2 3.12Å; N73-D116 PolarHBondContact ND2-OD2 3.41Å; N73-R119 PolarHBondContact OD1-NH1 3.1Å
74K83.7Confident88.3Confident83 Ų8341.5 Ų41.536%0.36124%0.235SC..Hα-helixtrans-118-36.7-174.2-53.3-174.2-178.3-1780115.3N70 S1117N70-K74 VanDerWaalsContact O-CB 3.29Å; N70-K74 WeakPolarHBondContact O-CB 3.29Å; N70-K74 PolarHBondContact O-N 3.41Å; K74-S1117 WeakPolarHBondContact CB-OG 3.43Å
75M83.7Confident88.1Confident36 Ų3647.2 Ų47.218%0.17726%0.263CS..SBendtrans-109.70.1-171.9-66.5-171.2-74.300113.8L71 L77 G78 V79 S1117L71-M75 HydrophobicContact CB-CE 4.3Å; L71-M75 HydrophobicContact CD1-CB 4.08Å; L71-M75 HydrophobicContact CD1-CE 3.77Å; L71-M75 CarbonylContact O-C 3.3Å; L71-M75 VanDerWaalsContact O-C 3.3Å; L71-M75 WeakPolarHBondContact O-CA 2.92Å; L71-M75 PolarHBondContact O-N 3.16Å; M75-L77 VanDerWaalsContact C-N 3.28Å; M75-L77 PolarHBondContact O-N 3.47Å; M75-L77 VanDerWaalsContact O-N 3.16Å; M75-G78 PolarHBondContact O-N 2.96Å; M75-V79 PolarHBondContact O-N 2.97Å; M75-S1117 VanDerWaalsContact CG-O 3.29Å; M75-S1117 WeakPolarHBondContact CG-O 3.41Å
76W87.3Confident88Confident9 Ų950.8 Ų50.83%0.03428%0.279CS..G310 helixtrans-58.7-36.6-168.4-168.6-115.4000113.6L71 I72 G78 V79 K84 I87 I117 Q120 D121L71-W76 PolarHBondContact O-N 3.35Å; I72-W76 HydrophobicContact CB-CE3 4.34Å; I72-W76 HydrophobicContact CG1-CE3 3.87Å; I72-W76 HydrophobicContact CG1-CZ3 3.88Å; I72-W76 WeakPolarHBondContact O-CB 3.23Å; W76-G78 PolarHBondContact O-N 3.32Å; W76-V79 HydrophobicContact CE3-CG2 4.37Å; W76-V79 PolarHBondContact O-N 3.4Å; W76-K84 HydrophobicContact CD2-CD 4.33Å; W76-K84 HydrophobicContact CD2-CG 4.33Å; W76-K84 HydrophobicContact CE3-CG 4.37Å; W76-K84 HydrophobicContact CH2-CB 3.84Å; W76-K84 HydrophobicContact CH2-CD 4.44Å; W76-K84 HydrophobicContact CH2-CG 3.73Å; W76-K84 HydrophobicContact CZ2-CB 3.84Å; W76-K84 HydrophobicContact CZ2-CD 3.88Å; W76-K84 HydrophobicContact CZ2-CG 3.65Å; W76-K84 HydrophobicContact CZ3-CG 4.08Å; W76-K84 WeakPolarHBondContact O-CE 3.46Å; W76-K84 PolarHBondContact O-NZ 3.29Å; W76-I87 HydrophobicContact CZ3-CD1 4.23Å; W76-I117 HydrophobicContact CH2-CG2 4.12Å; W76-I117 HydrophobicContact CZ2-CG2 3.82Å; W76-Q120 HydrophobicContact CG-CB 4.39Å; W76-Q120 HydrophobicContact CG-CG 4.35Å; W76-D121 WeakPolarHBondContact CZ2-OD2 3.46Å; W76-D121 PolarHBondContact NE1-OD1 3.23Å
77L80.6Confident88Confident115 Ų11548.5 Ų48.560%0.60227%0.266SS*.G310 helixtrans-58.5-35.2176.2-70.1173.7000112.7M75M75-L77 VanDerWaalsContact C-N 3.28Å; M75-L77 PolarHBondContact O-N 3.47Å; M75-L77 VanDerWaalsContact O-N 3.16Å
78G78.6Confident88Confident49 Ų4950.2 Ų50.251%0.50527%0.271SS..G310 helixtrans-83.8-10.1-179.700000115M75 W76M75-G78 PolarHBondContact O-N 2.96Å; W76-G78 PolarHBondContact O-N 3.32Å
79V85.3Confident87.9Confident16 Ų1652.5 Ų52.510%0.09729%0.287CS..SBendtrans-75.3131.6-178.7-177.50000110.5L71 M75 W76 D83 K84L71-V79 HydrophobicContact CD1-CG2 3.72Å; L71-V79 HydrophobicContact CG-CG2 4.14Å; M75-V79 PolarHBondContact O-N 2.97Å; W76-V79 HydrophobicContact CE3-CG2 4.37Å; W76-V79 PolarHBondContact O-N 3.4Å; V79-D83 HydrophobicContact CG1-CB 3.75Å; V79-K84 HydrophobicContact CB-CG 3.99Å; V79-K84 HydrophobicContact CG1-CG 3.77Å; V79-K84 WeakPolarHBondContact O-CE 3.48Å
80P87.8Confident87.9Confident75 Ų7553 Ų5349%0.48729%0.293SS..  trans-56.3144.7175.6-25.734.6000112.9Q82 D83 K84P80-Q82 PolarHBondContact O-N 2.87Å; P80-D83 HydrophobicContact CB-CB 4.42Å; P80-D83 PolarHBondContact O-N 3.08Å; P80-D83 VanDerWaalsContact O-N 3.12Å; P80-K84 PolarHBondContact O-N 3.46Å
81S87Confident88.1Confident100 Ų10050.2 Ų50.270%0.69928%0.278SS*.Hα-helixtrans-59.6-32.3-176.7-66.40000113.6M85S81-M85 PolarHBondContact O-N 2.88Å; S81-M85 VanDerWaalsContact O-N 3.09Å
82Q88.6Confident88.3Confident158 Ų15850.6 Ų50.674%0.73828%0.282SS*.Hα-helixtrans-67.8-46.4176.3-173.2172-0.700111.6P80 K84 M85 E86P80-Q82 PolarHBondContact O-N 2.87Å; Q82-K84 VanDerWaalsContact C-N 3.34Å; Q82-K84 PolarHBondContact O-N 3.41Å; Q82-M85 WeakPolarHBondContact O-CB 3.47Å; Q82-M85 PolarHBondContact O-N 2.66Å; Q82-E86 PolarHBondContact O-N 3.05Å
83D89.9Confident88.4Confident24 Ų2457.4 Ų57.413%0.12831%0.311CS..Hα-helixtrans-62.3-41.5176.3-73.317.7000110.8W45 R46 V79 P80 M85 E86 I87W45-D83 HydrophobicContact CZ2-CB 3.75Å; W45-D83 PolarHBondContact NE1-OD2 3.16Å; R46-D83 IonicContact CZ-OD1 2.76Å; R46-D83 IonicContact CZ-OD2 2.74Å; R46-D83 IonicContact NH1-OD1 3.79Å; R46-D83 IonicContact NH1-OD2 3.63Å; R46-D83 PolarHBondContact NH1-OD2 3.48Å; R46-D83 VanDerWaalsContact NH2-CG 3.3Å; R46-D83 IonicContact NH2-OD1 3.96Å; R46-D83 PolarHBondContact NH2-OD1 2.78Å; R46-D83 IonicContact NH2-OD2 3.89Å; R46-D83 PolarHBondContact NH2-OD2 3.46Å; V79-D83 HydrophobicContact CG1-CB 3.75Å; P80-D83 HydrophobicContact CB-CB 4.42Å; P80-D83 PolarHBondContact O-N 3.08Å; P80-D83 VanDerWaalsContact O-N 3.12Å; D83-M85 VanDerWaalsContact C-N 3.33Å; D83-M85 PolarHBondContact O-N 3.43Å; D83-E86 PolarHBondContact O-N 3.26Å; D83-I87 VanDerWaalsContact O-CG1 3.27Å; D83-I87 WeakPolarHBondContact O-CG1 3.38Å; D83-I87 PolarHBondContact O-N 3.22Å
84K91.6Very high88.6Confident30 Ų3057.6 Ų57.613%0.1331%0.312CS..Hα-helixtrans-57.8-45.1173.5-69-177.3174.6176.20112.3W76 V79 P80 Q82 E86 R88W76-K84 HydrophobicContact CD2-CD 4.33Å; W76-K84 HydrophobicContact CD2-CG 4.33Å; W76-K84 HydrophobicContact CE3-CG 4.37Å; W76-K84 HydrophobicContact CH2-CB 3.84Å; W76-K84 HydrophobicContact CH2-CD 4.44Å; W76-K84 HydrophobicContact CH2-CG 3.73Å; W76-K84 HydrophobicContact CZ2-CB 3.84Å; W76-K84 HydrophobicContact CZ2-CD 3.88Å; W76-K84 HydrophobicContact CZ2-CG 3.65Å; W76-K84 HydrophobicContact CZ3-CG 4.08Å; W76-K84 WeakPolarHBondContact O-CE 3.46Å; W76-K84 PolarHBondContact O-NZ 3.29Å; V79-K84 HydrophobicContact CB-CG 3.99Å; V79-K84 HydrophobicContact CG1-CG 3.77Å; V79-K84 WeakPolarHBondContact O-CE 3.48Å; P80-K84 PolarHBondContact O-N 3.46Å; Q82-K84 VanDerWaalsContact C-N 3.34Å; Q82-K84 PolarHBondContact O-N 3.41Å; K84-E86 VanDerWaalsContact C-N 3.35Å; K84-R88 WeakPolarHBondContact O-CB 3.44Å; K84-R88 VanDerWaalsContact O-CG 3.3Å; K84-R88 WeakPolarHBondContact O-CG 3.42Å; K84-R88 PolarHBondContact O-N 2.92Å
85M90.3Very high89Confident120 Ų12053.8 Ų53.859%0.59130%0.296SS*.Hα-helixtrans-64.2-41.8178.8-174.5-176.5-70.900111.2S81 Q82 D83 R88 S89S81-M85 PolarHBondContact O-N 2.88Å; S81-M85 VanDerWaalsContact O-N 3.09Å; Q82-M85 WeakPolarHBondContact O-CB 3.47Å; Q82-M85 PolarHBondContact O-N 2.66Å; D83-M85 VanDerWaalsContact C-N 3.33Å; D83-M85 PolarHBondContact O-N 3.43Å; M85-R88 PolarHBondContact O-N 3.01Å; M85-S89 WeakPolarHBondContact O-CB 3.48Å; M85-S89 PolarHBondContact O-N 3.48Å; M85-S89 PolarHBondContact O-OG 3.26Å
86E91.4Very high89.4Confident74 Ų7456 Ų5635%0.34631%0.308SS..Hα-helixtrans-60.4-52.6176.4-169174.6177.800110.8W45 R46 Q82 D83 K84 R88 S89 C90W45-E86 HydrophobicContact CH2-CB 4.15Å; W45-E86 HydrophobicContact CH2-CG 4.01Å; W45-E86 WeakPolarHBondContact CH2-OE2 3.29Å; W45-E86 HydrophobicContact CZ3-CG 4.46Å; R46-E86 IonicContact NH2-OE2 2.81Å; Q82-E86 PolarHBondContact O-N 3.05Å; D83-E86 PolarHBondContact O-N 3.26Å; K84-E86 VanDerWaalsContact C-N 3.35Å; E86-R88 PolarHBondContact O-N 3.44Å; E86-S89 PolarHBondContact O-N 3.25Å; E86-S89 PolarHBondContact O-OG 3.22Å; E86-C90 WeakPolarHBondContact O-CB 3.4Å; E86-C90 PolarHBondContact O-N 3.02Å; E86-C90 PolarHBondContact O-SG 3.31Å; E86-C90 VanDerWaalsContact O-SG 3.34Å
87I92.2Very high89.5Confident1 Ų159 Ų591%0.00533%0.334CS..Hα-helixtrans-56.8-47.3177.6-65.2167.7000111.1W45 F68 L71 W76 D83 S89 C90 L91 I117W45-I87 HydrophobicContact CD2-CD1 3.83Å; W45-I87 HydrophobicContact CD2-CG1 3.98Å; W45-I87 HydrophobicContact CE3-CD1 3.99Å; W45-I87 HydrophobicContact CE3-CG1 3.61Å; W45-I87 HydrophobicContact CG-CD1 4.2Å; W45-I87 HydrophobicContact CH2-CG1 4Å; W45-I87 HydrophobicContact CZ2-CD1 4.42Å; W45-I87 HydrophobicContact CZ2-CG1 4.33Å; W45-I87 HydrophobicContact CZ3-CD1 4.37Å; W45-I87 HydrophobicContact CZ3-CG1 3.63Å; F68-I87 HydrophobicContact CD1-CG2 4.29Å; F68-I87 HydrophobicContact CE1-CD1 4.48Å; F68-I87 HydrophobicContact CE1-CG1 4.27Å; F68-I87 HydrophobicContact CE1-CG2 4.16Å; L71-I87 HydrophobicContact CD2-CD1 3.9Å; W76-I87 HydrophobicContact CZ3-CD1 4.23Å; D83-I87 VanDerWaalsContact O-CG1 3.27Å; D83-I87 WeakPolarHBondContact O-CG1 3.38Å; D83-I87 PolarHBondContact O-N 3.22Å; I87-S89 PolarHBondContact O-N 3.11Å; I87-C90 PolarHBondContact O-N 3.34Å; I87-L91 HydrophobicContact CG2-CD1 3.76Å; I87-L91 HydrophobicContact CG2-CG 4.28Å; I87-L91 PolarHBondContact O-N 3.01Å; I87-I117 HydrophobicContact CG2-CD1 3.94Å
88R92.3Very high89.8Confident43 Ų4357.2 Ų57.216%0.16232%0.323CS..Hα-helixtrans-60.2-31.6177.6-79.9-172.5-65.4119.8-12.8113.3K84 M85 E86 P92 I117 D121 F125 Y126K84-R88 WeakPolarHBondContact O-CB 3.44Å; K84-R88 VanDerWaalsContact O-CG 3.3Å; K84-R88 WeakPolarHBondContact O-CG 3.42Å; K84-R88 PolarHBondContact O-N 2.92Å; M85-R88 PolarHBondContact O-N 3.01Å; E86-R88 PolarHBondContact O-N 3.44Å; R88-P92 WeakPolarHBondContact O-CD 3.35Å; R88-P92 VanDerWaalsContact O-CG 3.28Å; R88-P92 WeakPolarHBondContact O-CG 3.32Å; R88-I117 HydrophobicContact CG-CD1 4.44Å; R88-I117 HydrophobicContact CG-CG2 3.42Å; R88-I117 VanDerWaalsContact CG-CG2 3.42Å; R88-D121 WeakPolarHBondContact CD-OD2 3.3Å; R88-D121 IonicContact CZ-OD2 3.67Å; R88-D121 IonicContact NE-OD2 3.41Å; R88-D121 PolarHBondContact NE-OD2 3.22Å; R88-F125 VanDerWaalsContact CZ-O 3.27Å; R88-F125 PolarHBondContact NH1-O 3.46Å; R88-Y126 HydrophobicContact CG-CD1 4.46Å
89S89.9Confident90.3Very high48 Ų4856.3 Ų56.334%0.33631%0.305SS..Hα-helixtrans-86.2-33-179.680.20000113.3M85 E86 I87 K93M85-S89 WeakPolarHBondContact O-CB 3.48Å; M85-S89 PolarHBondContact O-N 3.48Å; M85-S89 PolarHBondContact O-OG 3.26Å; E86-S89 PolarHBondContact O-N 3.25Å; E86-S89 PolarHBondContact O-OG 3.22Å; I87-S89 PolarHBondContact O-N 3.11Å; S89-K93 VanDerWaalsContact O-CD 3.23Å; S89-K93 WeakPolarHBondContact O-CD 3.2Å; S89-K93 WeakPolarHBondContact O-CE 3.44Å; S89-K93 VanDerWaalsContact O-CG 3.22Å; S89-K93 WeakPolarHBondContact O-CG 3.44Å
90C92.3Very high90.3Very high35 Ų3562.8 Ų62.824%0.23633%0.332CS..Hα-helixtrans-85-43.7-171.4-70.70000113L49 E86 I87 K93 L94L49-C90 HydrophobicContact CD1-CB 4.12Å; L49-C90 HydrophobicContact CD2-CB 3.94Å; E86-C90 WeakPolarHBondContact O-CB 3.4Å; E86-C90 PolarHBondContact O-N 3.02Å; E86-C90 PolarHBondContact O-SG 3.31Å; E86-C90 VanDerWaalsContact O-SG 3.34Å; I87-C90 PolarHBondContact O-N 3.34Å; C90-K93 PolarHBondContact O-N 3.34Å; C90-L94 PolarHBondContact O-N 3.41Å
91L93.5Very high90.3Very high1 Ų164.5 Ų64.51%0.00534%0.341CS..Hα-helixtrans-64.2-43.8-176.1-65.1-179.4000113.4L49 L52 F68 I87 K93 L94 L95 L110 V113 I114 I117L49-L91 HydrophobicContact CD1-CD2 3.96Å; L52-L91 HydrophobicContact CD1-CD2 4.48Å; F68-L91 HydrophobicContact CD1-CD1 4.08Å; F68-L91 HydrophobicContact CD2-CD2 4.48Å; F68-L91 HydrophobicContact CE1-CD1 4.3Å; F68-L91 HydrophobicContact CE1-CD2 4.48Å; F68-L91 HydrophobicContact CE2-CD2 4.15Å; F68-L91 HydrophobicContact CG-CD1 4.33Å; F68-L91 HydrophobicContact CZ-CD2 4.16Å; I87-L91 HydrophobicContact CG2-CD1 3.76Å; I87-L91 HydrophobicContact CG2-CG 4.28Å; I87-L91 PolarHBondContact O-N 3.01Å; L91-K93 VanDerWaalsContact C-N 3.33Å; L91-K93 PolarHBondContact O-N 3.22Å; L91-L94 PolarHBondContact O-N 3.45Å; L91-L95 PolarHBondContact O-N 3.27Å; L91-L110 HydrophobicContact CB-CD1 4.24Å; L91-L110 HydrophobicContact CD2-CD1 4.15Å; L91-V113 HydrophobicContact CD1-CG1 3.77Å; L91-I114 HydrophobicContact CB-CD1 4.4Å; L91-I114 HydrophobicContact CB-CG1 4.05Å; L91-I117 HydrophobicContact CD1-CD1 4.14Å
92P92.1Very high90.4Very high26 Ų2661 Ų6117%0.16931%0.314CS..Hα-helixtrans-63.4-36.8174.1-23.936.1000113R88 L95 L96 I114 Y126R88-P92 WeakPolarHBondContact O-CD 3.35Å; R88-P92 VanDerWaalsContact O-CG 3.28Å; R88-P92 WeakPolarHBondContact O-CG 3.32Å; P92-L95 PolarHBondContact O-N 3.11Å; P92-L96 WeakPolarHBondContact O-CG 3.47Å; P92-L96 PolarHBondContact O-N 3.13Å; P92-I114 HydrophobicContact CB-CD1 4.49Å; P92-I114 HydrophobicContact CG-CD1 4.29Å; P92-I114 HydrophobicContact CG-CG1 4.41Å; P92-I114 HydrophobicContact CG-CG2 4.3Å; P92-Y126 WeakPolarHBondContact CG-OH 3.41Å
93K91.7Very high90.5Very high143 Ų14355.3 Ų55.362%0.62229%0.291SS*.Hα-helixtrans-64.1-43.6175.5-72.1174.8-171.7171.10111.6S89 C90 L91 L96 A97S89-K93 VanDerWaalsContact O-CD 3.23Å; S89-K93 WeakPolarHBondContact O-CD 3.2Å; S89-K93 WeakPolarHBondContact O-CE 3.44Å; S89-K93 VanDerWaalsContact O-CG 3.22Å; S89-K93 WeakPolarHBondContact O-CG 3.44Å; C90-K93 PolarHBondContact O-N 3.34Å; L91-K93 VanDerWaalsContact C-N 3.33Å; L91-K93 PolarHBondContact O-N 3.22Å; K93-L96 PolarHBondContact O-N 2.74Å; K93-A97 WeakPolarHBondContact O-CB 3.44Å; K93-A97 PolarHBondContact O-N 2.97Å
94L91.5Very high90.5Very high23 Ų2361.8 Ų61.812%0.1232%0.315CS..Hα-helixtrans-60-46.6175.2-17396.3000110.9L52 C90 L91 L96 A97 H98 L110L52-L94 HydrophobicContact CB-CD2 3.97Å; L52-L94 HydrophobicContact CD1-CD2 4.32Å; C90-L94 PolarHBondContact O-N 3.41Å; L91-L94 PolarHBondContact O-N 3.45Å; L94-L96 PolarHBondContact O-N 3.35Å; L94-A97 PolarHBondContact O-N 3.28Å; L94-H98 PolarHBondContact O-N 2.89Å; L94-L110 HydrophobicContact CD2-CD2 3.91Å
95L92.3Very high90.5Very high3 Ų363.9 Ų63.92%0.01633%0.325CS..Hα-helixtrans-57.7-51.5176.8-179.665.5000110.6L91 P92 A97 H98 H99 R107 L110 I114 L145 M149L91-L95 PolarHBondContact O-N 3.27Å; P92-L95 PolarHBondContact O-N 3.11Å; L95-A97 VanDerWaalsContact C-N 3.34Å; L95-A97 PolarHBondContact O-N 2.88Å; L95-H98 PolarHBondContact O-N 3.42Å; L95-H99 HydrophobicContact CD1-CB 4.32Å; L95-H99 WeakPolarHBondContact O-CA 3.33Å; L95-H99 WeakPolarHBondContact O-CB 3.34Å; L95-H99 PolarHBondContact O-N 3.43Å; L95-H99 PolarHBondContact O-ND1 3.12Å; L95-R107 HydrophobicContact CD1-CG 4.02Å; L95-L110 HydrophobicContact CB-CD2 3.77Å; L95-L110 HydrophobicContact CB-CG 4.24Å; L95-L110 HydrophobicContact CD1-CD2 3.81Å; L95-L110 HydrophobicContact CD1-CG 4.12Å; L95-L110 HydrophobicContact CG-CD2 4.38Å; L95-I114 HydrophobicContact CB-CD1 4.06Å; L95-I114 HydrophobicContact CD2-CD1 3.69Å; L95-I114 HydrophobicContact CG-CD1 4.49Å; L95-L145 HydrophobicContact CD1-CD1 4.09Å; L95-L145 HydrophobicContact CD2-CD1 4.18Å; L95-L145 HydrophobicContact CD2-CD2 4.27Å; L95-L145 HydrophobicContact CG-CD1 4.33Å; L95-L145 HydrophobicContact CG-CD2 4.18Å; L95-M149 HydrophobicContact CD2-SD 4.05Å
96L91.3Very high90.6Very high83 Ų8358.3 Ų58.344%0.43530%0.297SS..Hα-helixtrans-64.6-36.3-179.1-67.3176.9000112.9P92 K93 L94 H99 L136 L145P92-L96 WeakPolarHBondContact O-CG 3.47Å; P92-L96 PolarHBondContact O-N 3.13Å; K93-L96 PolarHBondContact O-N 2.74Å; L94-L96 PolarHBondContact O-N 3.35Å; L96-H99 PolarHBondContact O-CE1 2.77Å; L96-H99 VanDerWaalsContact O-CE1 3.25Å; L96-H99 PolarHBondContact O-ND1 3.32Å; L96-L136 HydrophobicContact CD2-CD2 3.64Å; L96-L145 HydrophobicContact CD2-CD2 4.2Å
97A89.3Confident90.7Very high71 Ų7156.6 Ų56.659%0.58729%0.287SS*.Hα-helixtrans-68.2-36177.600000113.1K93 L94 L95K93-A97 WeakPolarHBondContact O-CB 3.44Å; K93-A97 PolarHBondContact O-N 2.97Å; L94-A97 PolarHBondContact O-N 3.28Å; L95-A97 VanDerWaalsContact C-N 3.34Å; L95-A97 PolarHBondContact O-N 2.88Å
98H88Confident90.8Very high78 Ų7859.2 Ų59.236%0.36130%0.301SS..Hα-helixtrans-121.72.7-167.4-61.2-68.5000115.6L94 L95 K100 T101 L102L94-H98 PolarHBondContact O-N 2.89Å; L95-H98 PolarHBondContact O-N 3.42Å; H98-K100 PolarHBondContact O-N 2.97Å; H98-T101 PolarHBondContact O-N 2.98Å; H98-T101 PolarHBondContact O-OG1 2.86Å; H98-L102 HydrophobicContact CB-CD1 4.07Å; H98-L102 HydrophobicContact CB-CG 4.06Å; H98-L102 WeakPolarHBondContact O-CG 3.43Å; H98-L102 PolarHBondContact O-N 2.94Å
99H88Confident91Very high30 Ų3058.9 Ų58.914%0.13930%0.301CS..THydrogen-bonded Turntrans-56-25-175.963.8-76.2000115.1L95 L96 R107 L145L95-H99 HydrophobicContact CD1-CB 4.32Å; L95-H99 WeakPolarHBondContact O-CA 3.33Å; L95-H99 WeakPolarHBondContact O-CB 3.34Å; L95-H99 PolarHBondContact O-N 3.43Å; L95-H99 PolarHBondContact O-ND1 3.12Å; L96-H99 PolarHBondContact O-CE1 2.77Å; L96-H99 VanDerWaalsContact O-CE1 3.25Å; L96-H99 PolarHBondContact O-ND1 3.32Å; H99-R107 HydrophobicContact CB-CG 4.49Å; H99-R107 WeakPolarHBondContact O-CD 3.18Å; H99-L145 HydrophobicContact CB-CD1 4.48Å; H99-L145 HydrophobicContact CB-CD2 4.01Å
100K86.5Confident91.2Very high153 Ų15356.7 Ų56.767%0.66529%0.286SS*.THydrogen-bonded Turntrans-83.5-23.8177.3-61.9-171177.9-1770113.7H98 V141H98-K100 PolarHBondContact O-N 2.97Å; K100-V141 VanDerWaalsContact NZ-CG1 3.29Å
101T87.1Confident91.3Very high110 Ų11055 Ų5568%0.67527%0.274SS*.THydrogen-bonded Turntrans-99.8-23.3-175.854.70000112.7H98H98-T101 PolarHBondContact O-N 2.98Å; H98-T101 PolarHBondContact O-OG1 2.86Å
102L89.1Confident91.4Very high26 Ų2656.7 Ų56.714%0.13628%0.281CS..SBendtrans-72.3141.5178.8-70.6170.9000111.6M61 H98 I106 R107 L110M61-L102 HydrophobicContact CE-CD2 4.4Å; M61-L102 HydrophobicContact SD-CD2 3.91Å; H98-L102 HydrophobicContact CB-CD1 4.07Å; H98-L102 HydrophobicContact CB-CG 4.06Å; H98-L102 WeakPolarHBondContact O-CG 3.43Å; H98-L102 PolarHBondContact O-N 2.94Å; L102-I106 HydrophobicContact CD2-CG2 4.04Å; L102-R107 HydrophobicContact CB-CB 4.26Å; L102-L110 HydrophobicContact CD1-CD2 4.33Å
103P90.6Very high91.6Very high39 Ų3955.4 Ų55.425%0.25327%0.273SS..  trans-55.9145.3167.8-22.231.9000111.4D58 F105 I106 R107D58-P103 WeakPolarHBondContact OD1-CG 3.4Å; P103-F105 VanDerWaalsContact C-N 3.26Å; P103-F105 HydrophobicContact CB-CD1 3.98Å; P103-F105 HydrophobicContact CB-CE1 3.46Å; P103-F105 VanDerWaalsContact CB-CE1 3.46Å; P103-F105 HydrophobicContact CB-CE2 4.37Å; P103-F105 HydrophobicContact CB-CZ 3.68Å; P103-F105 HydrophobicContact CG-CE1 4.43Å; P103-F105 HydrophobicContact CG-CZ 4.25Å; P103-F105 PolarHBondContact O-N 3.3Å; P103-F105 VanDerWaalsContact O-N 3.17Å; P103-I106 HydrophobicContact CB-CG1 4.16Å; P103-I106 HydrophobicContact CG-CG1 4.16Å; P103-I106 PolarHBondContact O-N 3.5Å; P103-I106 VanDerWaalsContact O-N 3.09Å; P103-R107 PolarHBondContact O-N 3.29Å
104Y89.2Confident91.8Very high160 Ų16048.7 Ų48.763%0.62724%0.244SC*.Hα-helixtrans-57.5-37.3-171.975.5-88.4000113R107 N108Y104-R107 PolarHBondContact O-N 2.9Å; Y104-N108 VanDerWaalsContact O-CB 3.31Å; Y104-N108 WeakPolarHBondContact O-CB 3.49Å; Y104-N108 PolarHBondContact O-N 3.46Å; Y104-N108 PolarHBondContact O-OD1 3.48Å; Y104-N108 VanDerWaalsContact O-OD1 3.13Å
105F91.2Very high91.9Very high75 Ų7547.6 Ų47.633%0.32924%0.239SC..Hα-helixtrans-70.6-37.5179.958.3-92000112.2D58 M62 P103 K109D58-F105 HydrophobicContact CB-CE2 4.2Å; D58-F105 HydrophobicContact CB-CZ 4.08Å; M62-F105 HydrophobicContact CG-CD2 4.32Å; M62-F105 HydrophobicContact CG-CE2 4.34Å; M62-F105 HydrophobicContact SD-CD2 4.19Å; P103-F105 VanDerWaalsContact C-N 3.26Å; P103-F105 HydrophobicContact CB-CD1 3.98Å; P103-F105 HydrophobicContact CB-CE1 3.46Å; P103-F105 VanDerWaalsContact CB-CE1 3.46Å; P103-F105 HydrophobicContact CB-CE2 4.37Å; P103-F105 HydrophobicContact CB-CZ 3.68Å; P103-F105 HydrophobicContact CG-CE1 4.43Å; P103-F105 HydrophobicContact CG-CZ 4.25Å; P103-F105 PolarHBondContact O-N 3.3Å; P103-F105 VanDerWaalsContact O-N 3.17Å; F105-K109 VanDerWaalsContact O-CB 3.28Å; F105-K109 WeakPolarHBondContact O-CB 3.23Å; F105-K109 PolarHBondContact O-N 3.03Å
106I93.6Very high92Very high2 Ų247.5 Ų47.51%0.0124%0.238CC..Hα-helixtrans-65.1-49.1172.3-58-58.3000110.3M61 M62 L65 L102 P103 N108 K109 L110M61-I106 HydrophobicContact CB-CD1 3.76Å; M61-I106 HydrophobicContact CB-CG1 4.31Å; M61-I106 HydrophobicContact CB-CG2 4.11Å; M61-I106 HydrophobicContact SD-CG1 4.42Å; M61-I106 HydrophobicContact SD-CG2 4.1Å; M62-I106 HydrophobicContact CB-CD1 4.31Å; M62-I106 HydrophobicContact CG-CD1 3.4Å; M62-I106 VanDerWaalsContact CG-CD1 3.4Å; M62-I106 HydrophobicContact SD-CD1 3.61Å; L65-I106 HydrophobicContact CD1-CG2 3.84Å; L65-I106 WeakPolarHBondContact CD1-O 3.4Å; L102-I106 HydrophobicContact CD2-CG2 4.04Å; P103-I106 HydrophobicContact CB-CG1 4.16Å; P103-I106 HydrophobicContact CG-CG1 4.16Å; P103-I106 PolarHBondContact O-N 3.5Å; P103-I106 VanDerWaalsContact O-N 3.09Å; I106-N108 VanDerWaalsContact C-N 3.35Å; I106-N108 PolarHBondContact O-N 3.18Å; I106-K109 PolarHBondContact O-N 3.44Å; I106-L110 WeakPolarHBondContact O-CB 3.02Å; I106-L110 PolarHBondContact O-N 3.01Å
107R93.9Very high92.1Very high39 Ų3943.6 Ų43.615%0.14722%0.217CC..Hα-helixtrans-57.1-47.9179-179.2-164.567.7-165.30.5111.2L95 H99 L102 P103 Y104 L110 C111 L145 I148 Y244L95-R107 HydrophobicContact CD1-CG 4.02Å; H99-R107 HydrophobicContact CB-CG 4.49Å; H99-R107 WeakPolarHBondContact O-CD 3.18Å; L102-R107 HydrophobicContact CB-CB 4.26Å; P103-R107 PolarHBondContact O-N 3.29Å; Y104-R107 PolarHBondContact O-N 2.9Å; R107-L110 PolarHBondContact O-N 3.03Å; R107-C111 PolarHBondContact O-N 2.97Å; R107-C111 PolarHBondContact O-SG 2.95Å; R107-L145 HydrophobicContact CG-CD1 4.22Å; R107-I148 VanDerWaalsContact NH2-CD1 3.31Å; R107-Y244 PolarHBondContact NH2-OH 3.17Å
108N93.9Very high92.3Very high55 Ų5540.2 Ų40.229%0.29419%0.189SC..Hα-helixtrans-66.9-38.1179.8-68.78.3000111.3Y104 I106 C111 K112Y104-N108 VanDerWaalsContact O-CB 3.31Å; Y104-N108 WeakPolarHBondContact O-CB 3.49Å; Y104-N108 PolarHBondContact O-N 3.46Å; Y104-N108 PolarHBondContact O-OD1 3.48Å; Y104-N108 VanDerWaalsContact O-OD1 3.13Å; I106-N108 VanDerWaalsContact C-N 3.35Å; I106-N108 PolarHBondContact O-N 3.18Å; N108-C111 WeakPolarHBondContact O-CB 3.48Å; N108-C111 PolarHBondContact O-N 3.39Å; N108-K112 PolarHBondContact O-N 2.8Å
109K95.1Very high92.5Very high36 Ų3636.5 Ų36.516%0.15717%0.172CC..Hα-helixtrans-63.5-40.5173.5-175.667173.4-171.50112.1M62 L65 E69 F105 I106 K112 V113M62-K109 HydrophobicContact CE-CG 4.35Å; M62-K109 HydrophobicContact SD-CB 4.15Å; M62-K109 HydrophobicContact SD-CG 4.13Å; L65-K109 HydrophobicContact CB-CG 3.75Å; L65-K109 HydrophobicContact CD1-CB 3.8Å; L65-K109 HydrophobicContact CD1-CG 3.73Å; L65-K109 HydrophobicContact CG-CG 4.37Å; E69-K109 IonicContact OE1-NZ 3.72Å; E69-K109 PolarHBondContact OE1-NZ 3.44Å; E69-K109 WeakPolarHBondContact OE2-CE 3.37Å; E69-K109 IonicContact OE2-NZ 2.71Å; E69-K109 PolarHBondContact OE2-NZ 2.94Å; F105-K109 VanDerWaalsContact O-CB 3.28Å; F105-K109 WeakPolarHBondContact O-CB 3.23Å; F105-K109 PolarHBondContact O-N 3.03Å; I106-K109 PolarHBondContact O-N 3.44Å; K109-K112 WeakPolarHBondContact O-CB 3.27Å; K109-K112 PolarHBondContact O-N 3.38Å; K109-V113 WeakPolarHBondContact O-CG2 3.33Å; K109-V113 PolarHBondContact O-N 3.49Å
110L95.1Very high92.5Very high3 Ų336.5 Ų36.52%0.01617%0.172CC..Hα-helixtrans-65.2-39.9174.3176.958.3000111.8L65 L91 L94 L95 L102 I106 R107 K112 V113 I114L65-L110 HydrophobicContact CD1-CB 4.15Å; L65-L110 HydrophobicContact CD2-CB 3.96Å; L65-L110 HydrophobicContact CD2-CD1 3.74Å; L65-L110 HydrophobicContact CD2-CG 4.4Å; L91-L110 HydrophobicContact CB-CD1 4.24Å; L91-L110 HydrophobicContact CD2-CD1 4.15Å; L94-L110 HydrophobicContact CD2-CD2 3.91Å; L95-L110 HydrophobicContact CB-CD2 3.77Å; L95-L110 HydrophobicContact CB-CG 4.24Å; L95-L110 HydrophobicContact CD1-CD2 3.81Å; L95-L110 HydrophobicContact CD1-CG 4.12Å; L95-L110 HydrophobicContact CG-CD2 4.38Å; L102-L110 HydrophobicContact CD1-CD2 4.33Å; I106-L110 WeakPolarHBondContact O-CB 3.02Å; I106-L110 PolarHBondContact O-N 3.01Å; R107-L110 PolarHBondContact O-N 3.03Å; L110-K112 VanDerWaalsContact C-N 3.32Å; L110-K112 PolarHBondContact O-N 3.1Å; L110-V113 PolarHBondContact O-N 3.39Å; L110-I114 HydrophobicContact CD1-CD1 4.26Å; L110-I114 HydrophobicContact CD1-CG1 4.48Å; L110-I114 HydrophobicContact CG-CD1 4.25Å; L110-I114 WeakPolarHBondContact O-CG1 3.35Å; L110-I114 PolarHBondContact O-N 3.36Å
111C95.3Very high92.8Very high0 Ų029.7 Ų29.70%014%0.143CC..Hα-helixtrans-57.5-47.5171.4-660000110.7R107 N108 V113 I114 V115 L145 I148 M149R107-C111 PolarHBondContact O-N 2.97Å; R107-C111 PolarHBondContact O-SG 2.95Å; N108-C111 WeakPolarHBondContact O-CB 3.48Å; N108-C111 PolarHBondContact O-N 3.39Å; C111-V113 PolarHBondContact O-N 3.12Å; C111-I114 PolarHBondContact O-N 3.3Å; C111-V115 WeakPolarHBondContact O-CG2 3.36Å; C111-V115 PolarHBondContact O-N 3.48Å; C111-L145 VanDerWaalsContact SG-CD1 3.58Å; C111-I148 HydrophobicContact CB-CG2 4.42Å; C111-M149 HydrophobicContact CB-CG 3.95Å
112K94.6Very high93.1Very high35 Ų3525.1 Ų25.115%0.15211%0.114CC..Hα-helixtrans-57.1-48.7176.2-169.6-164.5177.4-170.50112.1E69 N108 K109 L110 I114 V115 D116 T152 E156E69-K112 WeakPolarHBondContact OE1-CE 3.45Å; E69-K112 IonicContact OE1-NZ 3.11Å; E69-K112 PolarHBondContact OE1-NZ 2.87Å; N108-K112 PolarHBondContact O-N 2.8Å; K109-K112 WeakPolarHBondContact O-CB 3.27Å; K109-K112 PolarHBondContact O-N 3.38Å; L110-K112 VanDerWaalsContact C-N 3.32Å; L110-K112 PolarHBondContact O-N 3.1Å; K112-I114 VanDerWaalsContact C-N 3.27Å; K112-I114 PolarHBondContact O-N 3.44Å; K112-V115 CarbonylContact O-C 3.52Å; K112-V115 WeakPolarHBondContact O-CA 3.33Å; K112-V115 WeakPolarHBondContact O-CB 3.43Å; K112-V115 PolarHBondContact O-N 2.76Å; K112-D116 PolarHBondContact O-N 2.89Å; K112-T152 HydrophobicContact CB-CG2 4.01Å; K112-T152 HydrophobicContact CG-CG2 3.96Å; K112-E156 WeakPolarHBondContact CE-OE1 3.37Å; K112-E156 IonicContact NZ-OE1 3.19Å
113V95.4Very high93.1Very high0 Ų025.5 Ų25.50%012%0.118CC..Hα-helixtrans-57.1-40.6177.2169.60000111.6L65 F68 E69 I72 L91 K109 L110 C111 D116 I117L65-V113 HydrophobicContact CB-CG2 4.4Å; L65-V113 HydrophobicContact CD2-CG2 4.47Å; L65-V113 WeakPolarHBondContact O-CG2 3.41Å; F68-V113 HydrophobicContact CB-CG1 3.67Å; F68-V113 HydrophobicContact CB-CG2 4.44Å; F68-V113 HydrophobicContact CG-CG1 4.46Å; E69-V113 HydrophobicContact CB-CG2 4.17Å; I72-V113 HydrophobicContact CD1-CG1 3.6Å; L91-V113 HydrophobicContact CD1-CG1 3.77Å; K109-V113 WeakPolarHBondContact O-CG2 3.33Å; K109-V113 PolarHBondContact O-N 3.49Å; L110-V113 PolarHBondContact O-N 3.39Å; C111-V113 PolarHBondContact O-N 3.12Å; V113-D116 PolarHBondContact O-N 3.47Å; V113-I117 WeakPolarHBondContact O-CG1 3.42Å; V113-I117 PolarHBondContact O-N 2.86Å
114I95.8Very high93.1Very high2 Ų229.7 Ų29.71%0.0114%0.135CC..Hα-helixtrans-67.3-39.3176.2-66.8162.8000111.3L91 P92 L95 L110 C111 K112 D116 I117 G118 F129 M149L91-I114 HydrophobicContact CB-CD1 4.4Å; L91-I114 HydrophobicContact CB-CG1 4.05Å; P92-I114 HydrophobicContact CB-CD1 4.49Å; P92-I114 HydrophobicContact CG-CD1 4.29Å; P92-I114 HydrophobicContact CG-CG1 4.41Å; P92-I114 HydrophobicContact CG-CG2 4.3Å; L95-I114 HydrophobicContact CB-CD1 4.06Å; L95-I114 HydrophobicContact CD2-CD1 3.69Å; L95-I114 HydrophobicContact CG-CD1 4.49Å; L110-I114 HydrophobicContact CD1-CD1 4.26Å; L110-I114 HydrophobicContact CD1-CG1 4.48Å; L110-I114 HydrophobicContact CG-CD1 4.25Å; L110-I114 WeakPolarHBondContact O-CG1 3.35Å; L110-I114 PolarHBondContact O-N 3.36Å; C111-I114 PolarHBondContact O-N 3.3Å; K112-I114 VanDerWaalsContact C-N 3.27Å; K112-I114 PolarHBondContact O-N 3.44Å; I114-D116 VanDerWaalsContact C-N 3.35Å; I114-I117 WeakPolarHBondContact O-CB 3.47Å; I114-I117 PolarHBondContact O-N 2.98Å; I114-G118 PolarHBondContact O-N 2.91Å; I114-G118 VanDerWaalsContact O-N 3.11Å; I114-F129 HydrophobicContact CG2-CE2 4.34Å; I114-M149 HydrophobicContact CB-CE 4.34Å; I114-M149 HydrophobicContact CG2-CE 3.76Å
115V95.1Very high93Very high0 Ų028.8 Ų28.80%014%0.135CC..Hα-helixtrans-63.6-40174.2171.20000111.3C111 K112 I117 G118 R119 F129 T152 T153 E156 L157C111-V115 WeakPolarHBondContact O-CG2 3.36Å; C111-V115 PolarHBondContact O-N 3.48Å; K112-V115 CarbonylContact O-C 3.52Å; K112-V115 WeakPolarHBondContact O-CA 3.33Å; K112-V115 WeakPolarHBondContact O-CB 3.43Å; K112-V115 PolarHBondContact O-N 2.76Å; V115-I117 PolarHBondContact O-N 3.42Å; V115-G118 CarbonylContact O-C 3.53Å; V115-G118 WeakPolarHBondContact O-CA 3.32Å; V115-G118 PolarHBondContact O-N 2.99Å; V115-R119 WeakPolarHBondContact O-CB 3.48Å; V115-R119 PolarHBondContact O-N 3.27Å; V115-F129 HydrophobicContact CB-CZ 4.39Å; V115-F129 HydrophobicContact CG1-CZ 4.48Å; V115-F129 HydrophobicContact CG2-CE2 4.47Å; V115-F129 HydrophobicContact CG2-CZ 4.16Å; V115-T152 HydrophobicContact CB-CG2 4.18Å; V115-T152 HydrophobicContact CG1-CG2 4.26Å; V115-T152 HydrophobicContact CG2-CG2 4.1Å; V115-T153 WeakPolarHBondContact CG2-OG1 3.43Å; V115-E156 HydrophobicContact CG1-CB 4.01Å; V115-E156 HydrophobicContact CG1-CG 4.39Å; V115-L157 HydrophobicContact CG1-CD1 3.68Å
116D93.3Very high93Very high0 Ų026.4 Ų26.40%012%0.124CC..Hα-helixtrans-60.6-33.6175-68.8-15.1000111.3I72 N73 K112 V113 I114 R119 Q120I72-D116 HydrophobicContact CG2-CB 3.81Å; I72-D116 WeakPolarHBondContact CG2-O 3.48Å; N73-D116 PolarHBondContact ND2-OD2 3.41Å; K112-D116 PolarHBondContact O-N 2.89Å; V113-D116 PolarHBondContact O-N 3.47Å; I114-D116 VanDerWaalsContact C-N 3.35Å; D116-R119 WeakPolarHBondContact O-CB 3.45Å; D116-R119 PolarHBondContact O-N 3.18Å; D116-Q120 WeakPolarHBondContact O-CG 3.36Å; D116-Q120 PolarHBondContact O-N 3.45Å
117I93.7Very high92.9Very high1 Ų132 Ų321%0.00515%0.15CC..Hα-helixtrans-68.4-44171.8-54.8166.2000110.6I72 W76 I87 R88 L91 V113 I114 V115 R119 Q120 D121 Y126I72-I117 HydrophobicContact CD1-CD1 4Å; I72-I117 HydrophobicContact CD1-CG1 3.45Å; I72-I117 VanDerWaalsContact CD1-CG1 3.45Å; I72-I117 HydrophobicContact CG1-CG1 3.95Å; I72-I117 HydrophobicContact CG2-CG1 4.18Å; W76-I117 HydrophobicContact CH2-CG2 4.12Å; W76-I117 HydrophobicContact CZ2-CG2 3.82Å; I87-I117 HydrophobicContact CG2-CD1 3.94Å; R88-I117 HydrophobicContact CG-CD1 4.44Å; R88-I117 HydrophobicContact CG-CG2 3.42Å; R88-I117 VanDerWaalsContact CG-CG2 3.42Å; L91-I117 HydrophobicContact CD1-CD1 4.14Å; V113-I117 WeakPolarHBondContact O-CG1 3.42Å; V113-I117 PolarHBondContact O-N 2.86Å; I114-I117 WeakPolarHBondContact O-CB 3.47Å; I114-I117 PolarHBondContact O-N 2.98Å; V115-I117 PolarHBondContact O-N 3.42Å; I117-R119 VanDerWaalsContact C-N 3.28Å; I117-R119 PolarHBondContact O-N 3.02Å; I117-Q120 PolarHBondContact O-N 3.3Å; I117-Q120 VanDerWaalsContact O-N 3.12Å; I117-D121 HydrophobicContact CG2-CB 4.46Å; I117-D121 WeakPolarHBondContact O-CB 3.26Å; I117-D121 PolarHBondContact O-N 2.71Å; I117-Y126 HydrophobicContact CG2-CD1 4.13Å
118G93.1Very high92.8Very high0 Ų035 Ų350%017%0.169CC..Hα-helixtrans-57.1-43.117400000112I114 V115 Q120 D121 W122 R168I114-G118 PolarHBondContact O-N 2.91Å; I114-G118 VanDerWaalsContact O-N 3.11Å; V115-G118 CarbonylContact O-C 3.53Å; V115-G118 WeakPolarHBondContact O-CA 3.32Å; V115-G118 PolarHBondContact O-N 2.99Å; G118-Q120 PolarHBondContact O-N 2.97Å; G118-D121 PolarHBondContact O-N 3.4Å; G118-W122 WeakPolarHBondContact O-CB 3.4Å; G118-W122 PolarHBondContact O-N 3.26Å; G118-R168 PolarHBondContact O-NH2 3.21Å
119R92.1Very high92.8Very high1 Ų132.5 Ų32.50%0.00416%0.155CC..Hα-helixtrans-54.3-37.5175-176.1179.5-176.3-126.6-6.4112.2N73 V115 D116 I117 E156 L157 D163 L164 R168 L172N73-R119 PolarHBondContact OD1-NH1 3.1Å; V115-R119 WeakPolarHBondContact O-CB 3.48Å; V115-R119 PolarHBondContact O-N 3.27Å; D116-R119 WeakPolarHBondContact O-CB 3.45Å; D116-R119 PolarHBondContact O-N 3.18Å; I117-R119 VanDerWaalsContact C-N 3.28Å; I117-R119 PolarHBondContact O-N 3.02Å; R119-E156 PolarHBondContact NE-O 3.36Å; R119-L157 HydrophobicContact CB-CD1 3.77Å; R119-L157 HydrophobicContact CB-CG 4.3Å; R119-L157 HydrophobicContact CG-CD1 4.25Å; R119-D163 IonicContact CZ-OD1 3.45Å; R119-D163 IonicContact CZ-OD2 2.63Å; R119-D163 VanDerWaalsContact NH1-CG 3.31Å; R119-D163 IonicContact NH1-OD1 3.31Å; R119-D163 PolarHBondContact NH1-OD1 3.39Å; R119-D163 IonicContact NH1-OD2 3.26Å; R119-D163 PolarHBondContact NH1-OD2 3.29Å; R119-D163 IonicContact NH2-OD1 3.5Å; R119-D163 PolarHBondContact NH2-OD1 2.89Å; R119-D163 IonicContact NH2-OD2 2.8Å; R119-L164 HydrophobicContact CG-CD1 3.78Å; R119-R168 PolarHBondContact O-NE 2.9Å; R119-R168 PolarHBondContact O-NH2 3.35Å; R119-L172 HydrophobicContact CG-CD1 4.12Å
120Q89.8Confident92.8Very high29 Ų2931.1 Ų31.114%0.13615%0.149CC..Hα-helixtrans-85.8-41176.9-59.4-62.6-1500114.1I72 W76 D116 I117 G118 R168I72-Q120 HydrophobicContact CG2-CG 4.12Å; W76-Q120 HydrophobicContact CG-CB 4.39Å; W76-Q120 HydrophobicContact CG-CG 4.35Å; D116-Q120 WeakPolarHBondContact O-CG 3.36Å; D116-Q120 PolarHBondContact O-N 3.45Å; I117-Q120 PolarHBondContact O-N 3.3Å; I117-Q120 VanDerWaalsContact O-N 3.12Å; G118-Q120 PolarHBondContact O-N 2.97Å; Q120-R168 VanDerWaalsContact C-NH2 3.34Å; Q120-R168 PolarHBondContact O-NH2 2.98Å
121D92.3Very high92.8Very high11 Ų1134.2 Ų34.26%0.05917%0.168CC..Hα-helixtrans-111.8-12.9-163.4-82.89.4000115.3W76 R88 I117 G118 P123 M124 F125 Y126W76-D121 WeakPolarHBondContact CZ2-OD2 3.46Å; W76-D121 PolarHBondContact NE1-OD1 3.23Å; R88-D121 WeakPolarHBondContact CD-OD2 3.3Å; R88-D121 IonicContact CZ-OD2 3.67Å; R88-D121 IonicContact NE-OD2 3.41Å; R88-D121 PolarHBondContact NE-OD2 3.22Å; I117-D121 HydrophobicContact CG2-CB 4.46Å; I117-D121 WeakPolarHBondContact O-CB 3.26Å; I117-D121 PolarHBondContact O-N 2.71Å; G118-D121 PolarHBondContact O-N 3.4Å; D121-P123 CarbonylContact O-C 3.51Å; D121-M124 PolarHBondContact O-N 3.05Å; D121-F125 HydrophobicContact CB-CB 3.86Å; D121-F125 PolarHBondContact O-N 2.93Å; D121-Y126 PolarHBondContact O-N 2.8Å
122W93.5Very high92.7Very high14 Ų1437.1 Ų37.15%0.05318%0.184CC..THydrogen-bonded Turntrans-79.4133-179.3177.662.7000111.6G118 F129 F130 L157 R168 L172 L175 L176G118-W122 WeakPolarHBondContact O-CB 3.4Å; G118-W122 PolarHBondContact O-N 3.26Å; W122-F129 HydrophobicContact CB-CB 4.39Å; W122-F129 HydrophobicContact CB-CD1 3.98Å; W122-F129 HydrophobicContact CB-CG 4.48Å; W122-F129 HydrophobicContact CD2-CD1 4.16Å; W122-F129 HydrophobicContact CG-CB 4.32Å; W122-F129 AromaticContact CG-CD1 3.85Å; W122-F129 HydrophobicContact CG-CD1 3.85Å; W122-F130 HydrophobicContact CH2-CB 4.45Å; W122-F130 HydrophobicContact CH2-CD2 4.15Å; W122-F130 HydrophobicContact CH2-CG 4.31Å; W122-F130 HydrophobicContact CZ2-CB 3.67Å; W122-F130 HydrophobicContact CZ2-CD2 4.19Å; W122-F130 AromaticContact CZ2-CG 3.92Å; W122-F130 HydrophobicContact CZ2-CG 3.92Å; W122-L157 HydrophobicContact CE3-CD2 3.71Å; W122-L157 HydrophobicContact CZ3-CD2 3.85Å; W122-R168 PolarHBondContact O-NH1 3.24Å; W122-R168 PolarHBondContact O-NH2 3.38Å; W122-L172 HydrophobicContact CE3-CD2 4.06Å; W122-L175 HydrophobicContact CE3-CB 4.41Å; W122-L175 HydrophobicContact CE3-CD1 4.24Å; W122-L175 HydrophobicContact CH2-CB 3.51Å; W122-L175 HydrophobicContact CZ2-CB 4.17Å; W122-L175 HydrophobicContact CZ3-CB 3.65Å; W122-L175 HydrophobicContact CZ3-CD1 4.28Å; W122-L176 HydrophobicContact CH2-CD2 4.09Å; W122-L176 HydrophobicContact CZ3-CD2 3.99Å; W122-L176 HydrophobicContact CZ3-CG 4.22Å
123P89.5Confident92.8Very high34 Ų3435.5 Ų35.522%0.22118%0.177CC..THydrogen-bonded Turncis-95.5-162.935.9-31.1000113.3D121 F125 Y126 H127 L175D121-P123 CarbonylContact O-C 3.51Å; P123-F125 PolarHBondContact O-N 2.96Å; P123-Y126 CarbonylContact O-C 3.47Å; P123-H127 WeakPolarHBondContact O-CA 3.42Å; P123-H127 PolarHBondContact O-CD2 3.18Å; P123-H127 PolarHBondContact O-N 3.49Å; P123-H127 VanDerWaalsContact O-N 3.13Å; P123-L175 HydrophobicContact CG-CD1 4.19Å; P123-L175 HydrophobicContact CG-CD2 4.27Å
124M89.1Confident92.8Very high126 Ų12636.5 Ų36.562%0.62118%0.182SC*.THydrogen-bonded Turntrans-65.8-36.2-164.8-68-61.2-74.200115.1D121 H127D121-M124 PolarHBondContact O-N 3.05Å; M124-H127 PolarHBondContact O-CE1 3.38Å; M124-H127 PolarHBondContact O-NE2 2.9Å; M124-H127 VanDerWaalsContact O-NE2 3.16Å
125F88.1Confident92.7Very high141 Ų14141.7 Ų41.762%0.61821%0.207SC*.THydrogen-bonded Turntrans-110-23.3179.9-62.3-67.9000111.7R88 D121 P123R88-F125 VanDerWaalsContact CZ-O 3.27Å; R88-F125 PolarHBondContact NH1-O 3.46Å; D121-F125 HydrophobicContact CB-CB 3.86Å; D121-F125 PolarHBondContact O-N 2.93Å; P123-F125 PolarHBondContact O-N 2.96Å
126Y91.6Very high92.6Very high25 Ų2543 Ų4310%0.09821%0.213CC..  trans-123.464.4177.1-161.5179.9000112.1R88 P92 I117 D121 P123 D128 F129R88-Y126 HydrophobicContact CG-CD1 4.46Å; P92-Y126 WeakPolarHBondContact CG-OH 3.41Å; I117-Y126 HydrophobicContact CG2-CD1 4.13Å; D121-Y126 PolarHBondContact O-N 2.8Å; P123-Y126 CarbonylContact O-C 3.47Å; Y126-D128 PolarHBondContact O-N 3.49Å; Y126-F129 HydrophobicContact CD1-CB 3.79Å; Y126-F129 AromaticContact CD1-CD2 3.98Å; Y126-F129 HydrophobicContact CD1-CD2 3.98Å; Y126-F129 HydrophobicContact CD1-CG 4.16Å; Y126-F129 HydrophobicContact CD2-CB 3.86Å; Y126-F129 HydrophobicContact CE1-CB 4.01Å; Y126-F129 AromaticContact CE1-CD2 3.61Å; Y126-F129 HydrophobicContact CE1-CD2 3.61Å; Y126-F129 HydrophobicContact CE1-CG 4.2Å; Y126-F129 HydrophobicContact CE2-CB 4.07Å; Y126-F129 HydrophobicContact CG-CB 3.71Å; Y126-F129 VanDerWaalsContact O-CB 3.28Å; Y126-F129 WeakPolarHBondContact O-CB 3.49Å; Y126-F129 PolarHBondContact O-N 3.17Å
127H90.9Very high92.7Very high121 Ų12143.2 Ų43.256%0.5621%0.214SC*.THydrogen-bonded Turntrans-53-46.4-173.8-57.589.9000114.3P123 M124 F129P123-H127 WeakPolarHBondContact O-CA 3.42Å; P123-H127 PolarHBondContact O-CD2 3.18Å; P123-H127 PolarHBondContact O-N 3.49Å; P123-H127 VanDerWaalsContact O-N 3.13Å; M124-H127 PolarHBondContact O-CE1 3.38Å; M124-H127 PolarHBondContact O-NE2 2.9Å; M124-H127 VanDerWaalsContact O-NE2 3.16Å; H127-F129 VanDerWaalsContact C-N 3.28Å; H127-F129 PolarHBondContact O-N 3Å
128D91.1Very high92.6Very high102 Ų10249.4 Ų49.455%0.54524%0.243SC..THydrogen-bonded Turntrans-82.90.5-174-55.3-48.7000113.9Y126 F130 T131 N132Y126-D128 PolarHBondContact O-N 3.49Å; D128-F130 PolarHBondContact O-N 2.96Å; D128-T131 PolarHBondContact O-N 3.5Å; D128-N132 VanDerWaalsContact O-CB 3.28Å; D128-N132 WeakPolarHBondContact O-CB 3.43Å; D128-N132 PolarHBondContact O-N 2.64Å; D128-N132 PolarHBondContact O-ND2 2.98Å; D128-N132 PolarHBondContact O-OD1 3Å
129F94.9Very high92.5Very high2 Ų251.8 Ų51.81%0.00926%0.26CS..Hα-helixtrans-50.7-57.8-173.7169.1-109.6000112.9I114 V115 W122 Y126 H127 I133 T153 L157I114-F129 HydrophobicContact CG2-CE2 4.34Å; V115-F129 HydrophobicContact CB-CZ 4.39Å; V115-F129 HydrophobicContact CG1-CZ 4.48Å; V115-F129 HydrophobicContact CG2-CE2 4.47Å; V115-F129 HydrophobicContact CG2-CZ 4.16Å; W122-F129 HydrophobicContact CB-CB 4.39Å; W122-F129 HydrophobicContact CB-CD1 3.98Å; W122-F129 HydrophobicContact CB-CG 4.48Å; W122-F129 HydrophobicContact CD2-CD1 4.16Å; W122-F129 HydrophobicContact CG-CB 4.32Å; W122-F129 AromaticContact CG-CD1 3.85Å; W122-F129 HydrophobicContact CG-CD1 3.85Å; Y126-F129 HydrophobicContact CD1-CB 3.79Å; Y126-F129 AromaticContact CD1-CD2 3.98Å; Y126-F129 HydrophobicContact CD1-CD2 3.98Å; Y126-F129 HydrophobicContact CD1-CG 4.16Å; Y126-F129 HydrophobicContact CD2-CB 3.86Å; Y126-F129 HydrophobicContact CE1-CB 4.01Å; Y126-F129 AromaticContact CE1-CD2 3.61Å; Y126-F129 HydrophobicContact CE1-CD2 3.61Å; Y126-F129 HydrophobicContact CE1-CG 4.2Å; Y126-F129 HydrophobicContact CE2-CB 4.07Å; Y126-F129 HydrophobicContact CG-CB 3.71Å; Y126-F129 VanDerWaalsContact O-CB 3.28Å; Y126-F129 WeakPolarHBondContact O-CB 3.49Å; Y126-F129 PolarHBondContact O-N 3.17Å; H127-F129 VanDerWaalsContact C-N 3.28Å; H127-F129 PolarHBondContact O-N 3Å; F129-I133 HydrophobicContact CE1-CD1 4.11Å; F129-I133 HydrophobicContact CE2-CD1 4.02Å; F129-I133 HydrophobicContact CZ-CD1 3.73Å; F129-I133 PolarHBondContact O-N 3.38Å; F129-T153 HydrophobicContact CE1-CG2 4.01Å; F129-T153 HydrophobicContact CZ-CG2 4.27Å; F129-L157 HydrophobicContact CE1-CD2 4.37Å
130F94.7Very high92.2Very high6 Ų656.6 Ų56.63%0.02629%0.291CS..Hα-helixtrans-73.7-38.9-175.9-160.2-94.5000111.6W122 D128 N132 I133 L134 L150 T153 L176 Q179 V183W122-F130 HydrophobicContact CH2-CB 4.45Å; W122-F130 HydrophobicContact CH2-CD2 4.15Å; W122-F130 HydrophobicContact CH2-CG 4.31Å; W122-F130 HydrophobicContact CZ2-CB 3.67Å; W122-F130 HydrophobicContact CZ2-CD2 4.19Å; W122-F130 AromaticContact CZ2-CG 3.92Å; W122-F130 HydrophobicContact CZ2-CG 3.92Å; D128-F130 PolarHBondContact O-N 2.96Å; F130-N132 VanDerWaalsContact C-N 3.28Å; F130-N132 PolarHBondContact O-N 3.26Å; F130-I133 WeakPolarHBondContact O-CB 3.3Å; F130-I133 PolarHBondContact O-N 3.33Å; F130-I133 VanDerWaalsContact O-N 3.08Å; F130-L134 HydrophobicContact CD1-CD1 4.03Å; F130-L134 HydrophobicContact CD1-CD2 4.42Å; F130-L134 HydrophobicContact CD1-CG 4.07Å; F130-L134 HydrophobicContact CE1-CD1 4.03Å; F130-L134 HydrophobicContact CE1-CD2 3.87Å; F130-L134 HydrophobicContact CE1-CG 4.02Å; F130-L134 WeakPolarHBondContact O-CG 3.11Å; F130-L134 PolarHBondContact O-N 2.74Å; F130-L134 VanDerWaalsContact O-N 3.08Å; F130-L150 HydrophobicContact CE2-CD1 4.41Å; F130-L150 HydrophobicContact CZ-CD1 4.19Å; F130-T153 HydrophobicContact CD2-CG2 4.22Å; F130-T153 HydrophobicContact CE2-CG2 4.08Å; F130-L176 HydrophobicContact CD2-CD2 4.42Å; F130-L176 HydrophobicContact CE2-CD2 3.82Å; F130-L176 HydrophobicContact CZ-CD2 4.49Å; F130-Q179 HydrophobicContact CD1-CB 4.26Å; F130-Q179 HydrophobicContact CD1-CG 3.8Å; F130-Q179 HydrophobicContact CE1-CB 3.49Å; F130-Q179 VanDerWaalsContact CE1-CB 3.49Å; F130-Q179 HydrophobicContact CE1-CG 3.56Å; F130-Q179 HydrophobicContact CZ-CB 3.83Å; F130-Q179 HydrophobicContact CZ-CG 4.16Å; F130-V183 HydrophobicContact CE1-CG2 4.11Å; F130-V183 HydrophobicContact CZ-CG2 3.86Å
131T94.1Very high92Very high68 Ų6859.4 Ų59.442%0.41731%0.31SS..Hα-helixtrans-58.7-40.1175.8-48.80000111.7D128 I133 L134 Q135D128-T131 PolarHBondContact O-N 3.5Å; T131-I133 VanDerWaalsContact C-N 3.35Å; T131-I133 PolarHBondContact O-N 2.74Å; T131-L134 PolarHBondContact O-N 3.47Å; T131-Q135 WeakPolarHBondContact O-CG 3.45Å; T131-Q135 PolarHBondContact O-N 3.09Å
132N94.3Very high92Very high61 Ų6159.8 Ų59.833%0.32631%0.313SS..Hα-helixtrans-62.8-40.2175.6-70.9-20000111.6D128 F130 L134 Q135 L136D128-N132 VanDerWaalsContact O-CB 3.28Å; D128-N132 WeakPolarHBondContact O-CB 3.43Å; D128-N132 PolarHBondContact O-N 2.64Å; D128-N132 PolarHBondContact O-ND2 2.98Å; D128-N132 PolarHBondContact O-OD1 3Å; F130-N132 VanDerWaalsContact C-N 3.28Å; F130-N132 PolarHBondContact O-N 3.26Å; N132-L134 PolarHBondContact O-N 3.08Å; N132-Q135 PolarHBondContact O-N 2.73Å; N132-L136 VanDerWaalsContact O-CG 3.29Å; N132-L136 WeakPolarHBondContact O-CG 3.27Å; N132-L136 PolarHBondContact O-N 3.06Å
133I96.1Very high92Very high1 Ų159.8 Ų59.81%0.00532%0.315CS..Hα-helixtrans-60.6-46.9175-64.6173.1000110.2F129 F130 T131 Q135 L136 I137 M149 L150 T153F129-I133 HydrophobicContact CE1-CD1 4.11Å; F129-I133 HydrophobicContact CE2-CD1 4.02Å; F129-I133 HydrophobicContact CZ-CD1 3.73Å; F129-I133 PolarHBondContact O-N 3.38Å; F130-I133 WeakPolarHBondContact O-CB 3.3Å; F130-I133 PolarHBondContact O-N 3.33Å; F130-I133 VanDerWaalsContact O-N 3.08Å; T131-I133 VanDerWaalsContact C-N 3.35Å; T131-I133 PolarHBondContact O-N 2.74Å; I133-Q135 VanDerWaalsContact C-N 3.32Å; I133-Q135 PolarHBondContact O-N 3.48Å; I133-L136 PolarHBondContact O-N 2.61Å; I133-I137 HydrophobicContact CG2-CD1 4.13Å; I133-I137 WeakPolarHBondContact O-CG1 3.47Å; I133-I137 PolarHBondContact O-N 2.92Å; I133-I137 VanDerWaalsContact O-N 3.1Å; I133-M149 HydrophobicContact CD1-CB 4.22Å; I133-M149 HydrophobicContact CD1-CE 4.31Å; I133-M149 HydrophobicContact CG1-CB 4.08Å; I133-M149 HydrophobicContact CG1-CE 4.03Å; I133-M149 HydrophobicContact CG2-CB 4.26Å; I133-L150 HydrophobicContact CG2-CB 3.94Å; I133-T153 VanDerWaalsContact CD1-OG1 3.3Å; I133-T153 WeakPolarHBondContact CD1-OG1 3.39Å
134L95Very high92.1Very high21 Ų2159.1 Ų59.111%0.1131%0.31CS..Hα-helixtrans-61.2-40.2177.9-59.7-177.3000112.2F130 T131 N132 I137 Q138 T182 V183 L186F130-L134 HydrophobicContact CD1-CD1 4.03Å; F130-L134 HydrophobicContact CD1-CD2 4.42Å; F130-L134 HydrophobicContact CD1-CG 4.07Å; F130-L134 HydrophobicContact CE1-CD1 4.03Å; F130-L134 HydrophobicContact CE1-CD2 3.87Å; F130-L134 HydrophobicContact CE1-CG 4.02Å; F130-L134 WeakPolarHBondContact O-CG 3.11Å; F130-L134 PolarHBondContact O-N 2.74Å; F130-L134 VanDerWaalsContact O-N 3.08Å; T131-L134 PolarHBondContact O-N 3.47Å; N132-L134 PolarHBondContact O-N 3.08Å; L134-I137 PolarHBondContact O-N 2.92Å; L134-Q138 WeakPolarHBondContact O-CG 3.36Å; L134-Q138 PolarHBondContact O-N 2.99Å; L134-T182 HydrophobicContact CD1-CG2 4.28Å; L134-V183 HydrophobicContact CD2-CG2 4.16Å; L134-L186 HydrophobicContact CD2-CD1 3.76Å
135Q93.9Very high92.3Very high112 Ų11253.4 Ų53.452%0.52328%0.282SS..Hα-helixtrans-64.8-40.5175.7-72.5175.62.800112.5T131 N132 I133 I137 Q138 S139T131-Q135 WeakPolarHBondContact O-CG 3.45Å; T131-Q135 PolarHBondContact O-N 3.09Å; N132-Q135 PolarHBondContact O-N 2.73Å; I133-Q135 VanDerWaalsContact C-N 3.32Å; I133-Q135 PolarHBondContact O-N 3.48Å; Q135-I137 VanDerWaalsContact C-N 3.29Å; Q135-I137 PolarHBondContact O-N 2.79Å; Q135-Q138 PolarHBondContact O-N 2.66Å; Q135-S139 PolarHBondContact O-N 3Å
136L94.3Very high92.7Very high28 Ų2846.7 Ų46.715%0.14725%0.252CS..Hα-helixtrans-62-38.8176.5-70.2172.4000111.8L96 N132 I133 S139 T142 T143 M149L96-L136 HydrophobicContact CD2-CD2 3.64Å; N132-L136 VanDerWaalsContact O-CG 3.29Å; N132-L136 WeakPolarHBondContact O-CG 3.27Å; N132-L136 PolarHBondContact O-N 3.06Å; I133-L136 PolarHBondContact O-N 2.61Å; L136-S139 PolarHBondContact O-N 2.87Å; L136-T142 HydrophobicContact CD2-CG2 4.02Å; L136-T142 CarbonylContact O-C 3.14Å; L136-T142 WeakPolarHBondContact O-CB 3.48Å; L136-T142 PolarHBondContact O-OG1 3.2Å; L136-T143 WeakPolarHBondContact O-CA 3.36Å; L136-T143 PolarHBondContact O-N 3.22Å; L136-M149 HydrophobicContact CD1-SD 3.89Å
137I95Very high92.9Very high4 Ų445.5 Ų45.52%0.02125%0.248CC..Hα-helixtrans-62.5-42.5177.1-68.3169.7000111.2I133 L134 Q135 S139 T143 G146 L147 L150 I190I133-I137 HydrophobicContact CG2-CD1 4.13Å; I133-I137 WeakPolarHBondContact O-CG1 3.47Å; I133-I137 PolarHBondContact O-N 2.92Å; I133-I137 VanDerWaalsContact O-N 3.1Å; L134-I137 PolarHBondContact O-N 2.92Å; Q135-I137 VanDerWaalsContact C-N 3.29Å; Q135-I137 PolarHBondContact O-N 2.79Å; I137-S139 VanDerWaalsContact C-N 3.31Å; I137-S139 PolarHBondContact O-N 3.22Å; I137-T143 WeakPolarHBondContact O-CB 3.47Å; I137-T143 WeakPolarHBondContact O-CG2 3.42Å; I137-T143 PolarHBondContact O-OG1 3.5Å; I137-G146 VanDerWaalsContact CG1-C 3.47Å; I137-L147 HydrophobicContact CD1-CD2 4.44Å; I137-L147 HydrophobicContact CG1-CD2 4.39Å; I137-L147 HydrophobicContact CG2-CD2 4.39Å; I137-L150 HydrophobicContact CD1-CB 4.05Å; I137-L150 HydrophobicContact CD1-CD2 3.78Å; I137-L150 HydrophobicContact CD1-CG 4.42Å; I137-I190 HydrophobicContact CG2-CD1 3.48Å; I137-I190 VanDerWaalsContact CG2-CD1 3.48Å
138Q91.8Very high93.1Very high131 Ų13140.1 Ų40.161%0.61222%0.223SC*.Hα-helixtrans-71.9-19.7-176.1-70.8174.7-10.900114.3L134 Q135 L186L134-Q138 WeakPolarHBondContact O-CG 3.36Å; L134-Q138 PolarHBondContact O-N 2.99Å; Q135-Q138 PolarHBondContact O-N 2.66Å; Q138-L186 HydrophobicContact CG-CD2 4.03Å
139S90.9Very high93.3Very high50 Ų5035.7 Ų35.735%0.3520%0.199SC..SBendtrans-92.8120.5-179.8154.70000111.2Q135 L136 I137 V141 T142 T143Q135-S139 PolarHBondContact O-N 3Å; L136-S139 PolarHBondContact O-N 2.87Å; I137-S139 VanDerWaalsContact C-N 3.31Å; I137-S139 PolarHBondContact O-N 3.22Å; S139-V141 PolarHBondContact O-N 2.65Å; S139-T142 WeakPolarHBondContact CB-OG1 3.2Å; S139-T142 CarbonylContact O-C 3.53Å; S139-T142 PolarHBondContact O-N 3.27Å; S139-T142 PolarHBondContact O-OG1 3.15Å; S139-T142 PolarHBondContact OG-OG1 3.44Å; S139-T143 PolarHBondContact O-N 3.06Å; S139-T143 PolarHBondContact O-OG1 3.3Å
140P84.6Confident93.3Very high101 Ų10135.9 Ų35.966%0.65620%0.201SC*.THydrogen-bonded Turntrans-52.7-36.3-172.3-29.234.1000115.1T142P140-T142 VanDerWaalsContact C-N 3.32Å; P140-T142 PolarHBondContact O-N 2.97Å
141V87Confident93.4Very high89 Ų8938 Ų3854%0.53921%0.21SC..THydrogen-bonded Turntrans-73.3-27-177.9-177.30000112.2K100 S139K100-V141 VanDerWaalsContact NZ-CG1 3.29Å; S139-V141 PolarHBondContact O-N 2.65Å
142T91.6Very high93.4Very high19 Ų1935.6 Ų35.612%0.11720%0.195CC..THydrogen-bonded Turntrans-111.2-3.7-174.250.70000112.9L136 S139 P140 L145 G146L136-T142 HydrophobicContact CD2-CG2 4.02Å; L136-T142 CarbonylContact O-C 3.14Å; L136-T142 WeakPolarHBondContact O-CB 3.48Å; L136-T142 PolarHBondContact O-OG1 3.2Å; S139-T142 WeakPolarHBondContact CB-OG1 3.2Å; S139-T142 CarbonylContact O-C 3.53Å; S139-T142 PolarHBondContact O-N 3.27Å; S139-T142 PolarHBondContact O-OG1 3.15Å; S139-T142 PolarHBondContact OG-OG1 3.44Å; P140-T142 VanDerWaalsContact C-N 3.32Å; P140-T142 PolarHBondContact O-N 2.97Å; T142-L145 WeakPolarHBondContact O-CA 3.28Å; T142-L145 WeakPolarHBondContact O-CB 3.45Å; T142-L145 PolarHBondContact O-N 3.23Å; T142-G146 PolarHBondContact O-N 3.32Å
143T93.4Very high93.4Very high14 Ų1432.7 Ų32.79%0.08618%0.179CC..Hα-helixtrans-50.2-48.7-178.9-59.10000112.9L136 I137 S139 L145 G146 L147 I190 I245L136-T143 WeakPolarHBondContact O-CA 3.36Å; L136-T143 PolarHBondContact O-N 3.22Å; I137-T143 WeakPolarHBondContact O-CB 3.47Å; I137-T143 WeakPolarHBondContact O-CG2 3.42Å; I137-T143 PolarHBondContact O-OG1 3.5Å; S139-T143 PolarHBondContact O-N 3.06Å; S139-T143 PolarHBondContact O-OG1 3.3Å; T143-L145 VanDerWaalsContact C-N 3.3Å; T143-L145 PolarHBondContact O-N 3.13Å; T143-G146 PolarHBondContact O-N 3.11Å; T143-L147 HydrophobicContact CG2-CD1 4.07Å; T143-L147 HydrophobicContact CG2-CG 4.38Å; T143-L147 WeakPolarHBondContact O-CG 3.42Å; T143-L147 PolarHBondContact O-N 3.07Å; T143-I190 HydrophobicContact CG2-CD1 4.27Å; T143-I245 HydrophobicContact CG2-CG2 4.16Å
144P91.9Very high93.3Very high19 Ų1933 Ų3312%0.12318%0.181CC..Hα-helixtrans-60.7-39.1178.6-19.530000112.9L147 I148 Y244 I245 L248P144-L147 PolarHBondContact O-N 3.38Å; P144-I148 WeakPolarHBondContact O-CD1 3.44Å; P144-I148 VanDerWaalsContact O-CG1 3.27Å; P144-I148 WeakPolarHBondContact O-CG1 3.36Å; P144-I148 PolarHBondContact O-N 3.29Å; P144-I148 VanDerWaalsContact O-N 3.09Å; P144-Y244 HydrophobicContact CB-CD1 4.23Å; P144-Y244 HydrophobicContact CB-CE1 3.91Å; P144-I245 HydrophobicContact CG-CD1 4.28Å; P144-I245 HydrophobicContact CG-CG1 3.9Å; P144-L248 HydrophobicContact CB-CD1 4.06Å
145L93.4Very high93.1Very high6 Ų635.1 Ų35.13%0.03119%0.191CC..Hα-helixtrans-66.6-43.8178.1-177.765.7000111.3L95 L96 H99 R107 C111 T142 T143 I148 M149L95-L145 HydrophobicContact CD1-CD1 4.09Å; L95-L145 HydrophobicContact CD2-CD1 4.18Å; L95-L145 HydrophobicContact CD2-CD2 4.27Å; L95-L145 HydrophobicContact CG-CD1 4.33Å; L95-L145 HydrophobicContact CG-CD2 4.18Å; L96-L145 HydrophobicContact CD2-CD2 4.2Å; H99-L145 HydrophobicContact CB-CD1 4.48Å; H99-L145 HydrophobicContact CB-CD2 4.01Å; R107-L145 HydrophobicContact CG-CD1 4.22Å; C111-L145 VanDerWaalsContact SG-CD1 3.58Å; T142-L145 WeakPolarHBondContact O-CA 3.28Å; T142-L145 WeakPolarHBondContact O-CB 3.45Å; T142-L145 PolarHBondContact O-N 3.23Å; T143-L145 VanDerWaalsContact C-N 3.3Å; T143-L145 PolarHBondContact O-N 3.13Å; L145-I148 PolarHBondContact O-N 3.11Å; L145-M149 WeakPolarHBondContact O-CG 3.44Å; L145-M149 PolarHBondContact O-N 3.11Å
146G95.6Very high93Very high0 Ų030.8 Ų30.80%017%0.171CC..Hα-helixtrans-61.2-41.8176.100000112.6I137 T142 T143 M149 L150I137-G146 VanDerWaalsContact CG1-C 3.47Å; T142-G146 PolarHBondContact O-N 3.32Å; T143-G146 PolarHBondContact O-N 3.11Å; G146-M149 PolarHBondContact O-N 2.92Å; G146-L150 WeakPolarHBondContact O-CB 3.47Å; G146-L150 PolarHBondContact O-N 3.34Å
147L95.9Very high92.9Very high0 Ų029.5 Ų29.50%016%0.164CC..Hα-helixtrans-65.3-41.3176.6-68.9174000112.4I137 T143 P144 L150 K151 L187 I190 I245 L248 A249 C252I137-L147 HydrophobicContact CD1-CD2 4.44Å; I137-L147 HydrophobicContact CG1-CD2 4.39Å; I137-L147 HydrophobicContact CG2-CD2 4.39Å; T143-L147 HydrophobicContact CG2-CD1 4.07Å; T143-L147 HydrophobicContact CG2-CG 4.38Å; T143-L147 WeakPolarHBondContact O-CG 3.42Å; T143-L147 PolarHBondContact O-N 3.07Å; P144-L147 PolarHBondContact O-N 3.38Å; L147-L150 PolarHBondContact O-N 3.48Å; L147-K151 PolarHBondContact O-N 3.06Å; L147-L187 HydrophobicContact CD2-CD2 3.4Å; L147-I190 HydrophobicContact CD2-CD1 4.15Å; L147-I245 HydrophobicContact CD1-CG2 4.05Å; L147-L248 HydrophobicContact CB-CB 3.95Å; L147-L248 HydrophobicContact CB-CD1 4.37Å; L147-L248 HydrophobicContact CD1-CB 3.93Å; L147-A249 HydrophobicContact CD1-CB 4.34Å; L147-C252 PolarHBondContact O-SG 2.87Å
148I94.9Very high92.4Very high8 Ų829.4 Ų29.44%0.04116%0.164CC..Hα-helixtrans-59.8-48.3173.9-68.4161.9000110.2R107 C111 P144 L145 L150 K151 T152 L248R107-I148 VanDerWaalsContact NH2-CD1 3.31Å; C111-I148 HydrophobicContact CB-CG2 4.42Å; P144-I148 WeakPolarHBondContact O-CD1 3.44Å; P144-I148 VanDerWaalsContact O-CG1 3.27Å; P144-I148 WeakPolarHBondContact O-CG1 3.36Å; P144-I148 PolarHBondContact O-N 3.29Å; P144-I148 VanDerWaalsContact O-N 3.09Å; L145-I148 PolarHBondContact O-N 3.11Å; I148-L150 VanDerWaalsContact C-N 3.33Å; I148-L150 PolarHBondContact O-N 3.4Å; I148-K151 PolarHBondContact O-N 2.92Å; I148-T152 PolarHBondContact O-N 3.36Å; I148-T152 PolarHBondContact O-OG1 3.19Å; I148-T152 VanDerWaalsContact O-OG1 3.08Å; I148-L248 HydrophobicContact CD1-CD1 4.34Å; I148-L248 HydrophobicContact CG1-CD1 4.02Å; I148-L248 HydrophobicContact CG1-CD2 3.86Å
149M95.6Very high91.6Very high10 Ų1026.7 Ų26.75%0.04916%0.159CC..Hα-helixtrans-62-39.9177.8-72.4-169.57300112.3L95 C111 I114 I133 L136 L145 G146 T153L95-M149 HydrophobicContact CD2-SD 4.05Å; C111-M149 HydrophobicContact CB-CG 3.95Å; I114-M149 HydrophobicContact CB-CE 4.34Å; I114-M149 HydrophobicContact CG2-CE 3.76Å; I133-M149 HydrophobicContact CD1-CB 4.22Å; I133-M149 HydrophobicContact CD1-CE 4.31Å; I133-M149 HydrophobicContact CG1-CB 4.08Å; I133-M149 HydrophobicContact CG1-CE 4.03Å; I133-M149 HydrophobicContact CG2-CB 4.26Å; L136-M149 HydrophobicContact CD1-SD 3.89Å; L145-M149 WeakPolarHBondContact O-CG 3.44Å; L145-M149 PolarHBondContact O-N 3.11Å; G146-M149 PolarHBondContact O-N 2.92Å; M149-T153 VanDerWaalsContact O-CB 3.24Å; M149-T153 WeakPolarHBondContact O-CB 3.47Å; M149-T153 PolarHBondContact O-N 3.11Å; M149-T153 PolarHBondContact O-OG1 2.9Å
150L96.5Very high90.9Very high6 Ų625.2 Ų25.23%0.03115%0.148CC..Hα-helixtrans-63.2-46.7176.5176.466.6000111.8F130 I133 I137 G146 L147 I148 T153 S154 V183 L187F130-L150 HydrophobicContact CE2-CD1 4.41Å; F130-L150 HydrophobicContact CZ-CD1 4.19Å; I133-L150 HydrophobicContact CG2-CB 3.94Å; I137-L150 HydrophobicContact CD1-CB 4.05Å; I137-L150 HydrophobicContact CD1-CD2 3.78Å; I137-L150 HydrophobicContact CD1-CG 4.42Å; G146-L150 WeakPolarHBondContact O-CB 3.47Å; G146-L150 PolarHBondContact O-N 3.34Å; L147-L150 PolarHBondContact O-N 3.48Å; I148-L150 VanDerWaalsContact C-N 3.33Å; I148-L150 PolarHBondContact O-N 3.4Å; L150-T153 WeakPolarHBondContact O-CB 3.37Å; L150-T153 PolarHBondContact O-N 2.9Å; L150-S154 PolarHBondContact O-N 2.78Å; L150-V183 HydrophobicContact CD1-CG1 4.03Å; L150-V183 HydrophobicContact CD1-CG2 4.08Å; L150-V183 HydrophobicContact CD2-CG1 3.64Å; L150-V183 HydrophobicContact CG-CG1 4.35Å; L150-L187 HydrophobicContact CD2-CD1 4.32Å; L150-L187 HydrophobicContact CD2-CD2 4.12Å; L150-L187 HydrophobicContact CD2-CG 4.41Å
151K94.9Very high90.3Very high50 Ų5028 Ų2822%0.21715%0.145CC..Hα-helixtrans-58-53176.7-170.5-175.9176.2-166.70110.8L147 I148 T153 S154 E155 E251L147-K151 PolarHBondContact O-N 3.06Å; I148-K151 PolarHBondContact O-N 2.92Å; K151-T153 VanDerWaalsContact C-N 3.26Å; K151-T153 PolarHBondContact O-N 3.02Å; K151-S154 WeakPolarHBondContact O-CA 3.23Å; K151-S154 WeakPolarHBondContact O-CB 3.46Å; K151-S154 PolarHBondContact O-N 3.32Å; K151-E155 WeakPolarHBondContact CE-OE1 3.37Å; K151-E155 WeakPolarHBondContact O-CG 3.48Å; K151-E155 PolarHBondContact O-N 3.25Å; K151-E251 HydrophobicContact CD-CB 4.18Å; K151-E251 IonicContact NZ-OE2 2.57Å; K151-E251 PolarHBondContact NZ-OE2 3.21Å
152T94.6Very high89.3Confident17 Ų1727 Ų2710%0.10414%0.135CC..Hα-helixtrans-61.4-36.4178.7-55.70000111.8K112 V115 I148 E155 E156K112-T152 HydrophobicContact CB-CG2 4.01Å; K112-T152 HydrophobicContact CG-CG2 3.96Å; V115-T152 HydrophobicContact CB-CG2 4.18Å; V115-T152 HydrophobicContact CG1-CG2 4.26Å; V115-T152 HydrophobicContact CG2-CG2 4.1Å; I148-T152 PolarHBondContact O-N 3.36Å; I148-T152 PolarHBondContact O-OG1 3.19Å; I148-T152 VanDerWaalsContact O-OG1 3.08Å; T152-E155 PolarHBondContact O-N 3.29Å; T152-E156 HydrophobicContact CG2-CG 4.28Å; T152-E156 WeakPolarHBondContact O-CB 3.41Å; T152-E156 WeakPolarHBondContact O-CG 3.5Å; T152-E156 PolarHBondContact O-N 2.95Å
153T95.2Very high88.7Confident1 Ų127.2 Ų27.21%0.00614%0.135CC..Hα-helixtrans-62.8-44.6173-59.50000111.1V115 F129 F130 I133 M149 L150 K151 E155 L157 L176V115-T153 WeakPolarHBondContact CG2-OG1 3.43Å; F129-T153 HydrophobicContact CE1-CG2 4.01Å; F129-T153 HydrophobicContact CZ-CG2 4.27Å; F130-T153 HydrophobicContact CD2-CG2 4.22Å; F130-T153 HydrophobicContact CE2-CG2 4.08Å; I133-T153 VanDerWaalsContact CD1-OG1 3.3Å; I133-T153 WeakPolarHBondContact CD1-OG1 3.39Å; M149-T153 VanDerWaalsContact O-CB 3.24Å; M149-T153 WeakPolarHBondContact O-CB 3.47Å; M149-T153 PolarHBondContact O-N 3.11Å; M149-T153 PolarHBondContact O-OG1 2.9Å; L150-T153 WeakPolarHBondContact O-CB 3.37Å; L150-T153 PolarHBondContact O-N 2.9Å; K151-T153 VanDerWaalsContact C-N 3.26Å; K151-T153 PolarHBondContact O-N 3.02Å; T153-E155 VanDerWaalsContact C-N 3.34Å; T153-E155 PolarHBondContact O-N 3.25Å; T153-L157 HydrophobicContact CG2-CD1 4.18Å; T153-L157 HydrophobicContact CG2-CD2 3.8Å; T153-L157 HydrophobicContact CG2-CG 4.44Å; T153-L157 VanDerWaalsContact O-CB 3.3Å; T153-L157 WeakPolarHBondContact O-CB 3.43Å; T153-L157 PolarHBondContact O-N 3.35Å; T153-L176 HydrophobicContact CG2-CD2 4.24Å
154S93.1Very high88.4Confident6 Ų626.6 Ų26.64%0.04213%0.131CC..Hα-helixtrans-62.5-41.2176.2-175.40000112L150 K151 A158 H255 W259L150-S154 PolarHBondContact O-N 2.78Å; K151-S154 WeakPolarHBondContact O-CA 3.23Å; K151-S154 WeakPolarHBondContact O-CB 3.46Å; K151-S154 PolarHBondContact O-N 3.32Å; S154-A158 WeakPolarHBondContact O-CB 3.27Å; S154-A158 PolarHBondContact O-N 2.93Å; S154-H255 PolarHBondContact O-CE1 3.23Å; S154-H255 PolarHBondContact OG-CE1 3.28Å; S154-H255 PolarHBondContact OG-ND1 2.8Å; S154-W259 PolarHBondContact OG-NE1 3.33Å
155E92Very high88.2Confident67 Ų6726.9 Ų26.931%0.31313%0.133SC..Hα-helixtrans-64.7-48.3179.5-70.9167169.500111.7K151 T152 T153 H255K151-E155 WeakPolarHBondContact CE-OE1 3.37Å; K151-E155 WeakPolarHBondContact O-CG 3.48Å; K151-E155 PolarHBondContact O-N 3.25Å; T152-E155 PolarHBondContact O-N 3.29Å; T153-E155 VanDerWaalsContact C-N 3.34Å; T153-E155 PolarHBondContact O-N 3.25Å; E155-H255 VanDerWaalsContact CA-CE1 3.43Å; E155-H255 WeakPolarHBondContact CA-CE1 3.32Å; E155-H255 PolarHBondContact N-CE1 3.38Å
156E90.6Very high87.9Confident21 Ų2127.8 Ų27.810%0.09814%0.139CC..Hα-helixtrans-85.7-27.3-171.3-66.4-66.5165.100114.4K112 V115 R119 T152 P160K112-E156 WeakPolarHBondContact CE-OE1 3.37Å; K112-E156 IonicContact NZ-OE1 3.19Å; V115-E156 HydrophobicContact CG1-CB 4.01Å; V115-E156 HydrophobicContact CG1-CG 4.39Å; R119-E156 PolarHBondContact NE-O 3.36Å; T152-E156 HydrophobicContact CG2-CG 4.28Å; T152-E156 WeakPolarHBondContact O-CB 3.41Å; T152-E156 WeakPolarHBondContact O-CG 3.5Å; T152-E156 PolarHBondContact O-N 2.95Å; E156-P160 WeakPolarHBondContact O-CA 3.45Å
157L91.7Very high87.5Confident0 Ų030 Ų300%016%0.157CC..Hα-helixtrans-99.6-29.5-177.6-7864.4000113.6V115 R119 W122 F129 T153 P160 L172 L176V115-L157 HydrophobicContact CG1-CD1 3.68Å; R119-L157 HydrophobicContact CB-CD1 3.77Å; R119-L157 HydrophobicContact CB-CG 4.3Å; R119-L157 HydrophobicContact CG-CD1 4.25Å; W122-L157 HydrophobicContact CE3-CD2 3.71Å; W122-L157 HydrophobicContact CZ3-CD2 3.85Å; F129-L157 HydrophobicContact CE1-CD2 4.37Å; T153-L157 HydrophobicContact CG2-CD1 4.18Å; T153-L157 HydrophobicContact CG2-CD2 3.8Å; T153-L157 HydrophobicContact CG2-CG 4.44Å; T153-L157 VanDerWaalsContact O-CB 3.3Å; T153-L157 WeakPolarHBondContact O-CB 3.43Å; T153-L157 PolarHBondContact O-N 3.35Å; L157-P160 WeakPolarHBondContact O-CD 3.4Å; L157-L172 HydrophobicContact CB-CB 4.45Å; L157-L172 HydrophobicContact CD2-CD2 3.9Å; L157-L172 HydrophobicContact CG-CD1 4.23Å; L157-L172 HydrophobicContact CG-CD2 4.06Å; L157-L176 HydrophobicContact CB-CD1 3.58Å; L157-L176 HydrophobicContact CB-CG 4.29Å; L157-L176 HydrophobicContact CD2-CD2 4.46Å
158A85.6Confident87.2Confident3 Ų331.3 Ų31.33%0.02516%0.162CC..Hα-helixtrans-83.8-34.1-178.600000113.1S154 P160 R173 L176 W259S154-A158 WeakPolarHBondContact O-CB 3.27Å; S154-A158 PolarHBondContact O-N 2.93Å; A158-P160 WeakPolarHBondContact O-CD 3.37Å; A158-R173 PolarHBondContact O-NH1 3.28Å; A158-L176 HydrophobicContact CB-CD1 3.82Å; A158-W259 HydrophobicContact CB-CD2 3.54Å; A158-W259 HydrophobicContact CB-CE3 4.01Å; A158-W259 HydrophobicContact CB-CG 3.92Å; A158-W259 HydrophobicContact CB-CH2 4.21Å; A158-W259 HydrophobicContact CB-CZ2 3.73Å; A158-W259 HydrophobicContact CB-CZ3 4.32Å
159C74.9Confident86.9Confident74 Ų7432.8 Ų32.850%0.517%0.168SC..SBendtrans-124.959.2176.7-67.60000110.9
160P75.4Confident86.6Confident19 Ų1936.8 Ų36.812%0.12319%0.187CC..  trans-64.1139.5-174.724.9-33.4000112.2E156 L157 A158 L164 K169E156-P160 WeakPolarHBondContact O-CA 3.45Å; L157-P160 WeakPolarHBondContact O-CD 3.4Å; A158-P160 WeakPolarHBondContact O-CD 3.37Å; P160-L164 HydrophobicContact CB-CD1 3.83Å; P160-K169 HydrophobicContact CB-CG 4.14Å; P160-K169 HydrophobicContact CG-CB 3.7Å; P160-K169 HydrophobicContact CG-CD 3.82Å; P160-K169 HydrophobicContact CG-CG 3.41Å; P160-K169 VanDerWaalsContact CG-CG 3.41Å
161R72.9Confident86.4Confident160 Ų16040.3 Ų40.360%0.60420%0.203SC*.  trans-59168.7171.6-64.4176.5-173.1-158.4-2.6112D163 K169R161-D163 VanDerWaalsContact C-OD1 3.24Å; R161-D163 WeakPolarHBondContact CB-OD1 3.44Å; R161-D163 PolarHBondContact O-N 3.09Å; R161-D163 VanDerWaalsContact O-N 3.13Å; R161-K169 WeakPolarHBondContact O-CE 3.37Å; R161-K169 PolarHBondContact O-NZ 3.17Å; R161-K169 VanDerWaalsContact O-NZ 3.09Å
162E66.4Low86.3Confident68 Ų6837.9 Ų37.932%0.31819%0.193SC..SBendtrans-69.70.9-177.3-67.9-171.3-167.200115.8L164 K1037 R1109E162-L164 PolarHBondContact O-N 3.41Å; E162-K1037 WeakPolarHBondContact OE1-CE 3.49Å; E162-K1037 IonicContact OE1-NZ 2.7Å; E162-K1037 PolarHBondContact OE1-NZ 2.85Å; E162-K1037 WeakPolarHBondContact OE2-CE 3.26Å; E162-K1037 IonicContact OE2-NZ 2.86Å; E162-R1109 IonicContact OE1-NH1 2.93Å; E162-R1109 IonicContact OE2-CZ 3.75Å; E162-R1109 IonicContact OE2-NE 3.31Å; E162-R1109 IonicContact OE2-NH1 2.6Å; E162-R1109 PolarHBondContact OE2-NH1 3.22Å
163D78.9Confident86.2Confident22 Ų2241.8 Ų41.812%0.11821%0.206CC..SBendtrans-82.223.5173.162.5-27.3000113.2R119 R161 Y1110 L1113R119-D163 IonicContact CZ-OD1 3.45Å; R119-D163 IonicContact CZ-OD2 2.63Å; R119-D163 VanDerWaalsContact NH1-CG 3.31Å; R119-D163 IonicContact NH1-OD1 3.31Å; R119-D163 PolarHBondContact NH1-OD1 3.39Å; R119-D163 IonicContact NH1-OD2 3.26Å; R119-D163 PolarHBondContact NH1-OD2 3.29Å; R119-D163 IonicContact NH2-OD1 3.5Å; R119-D163 PolarHBondContact NH2-OD1 2.89Å; R119-D163 IonicContact NH2-OD2 2.8Å; R161-D163 VanDerWaalsContact C-OD1 3.24Å; R161-D163 WeakPolarHBondContact CB-OD1 3.44Å; R161-D163 PolarHBondContact O-N 3.09Å; R161-D163 VanDerWaalsContact O-N 3.13Å; D163-Y1110 WeakPolarHBondContact O-CD2 3.41Å; D163-Y1110 WeakPolarHBondContact O-CE2 3.46Å; D163-L1113 HydrophobicContact CB-CD2 3.45Å; D163-L1113 VanDerWaalsContact CB-CD2 3.45Å
164L85.6Confident86Confident1 Ų148.6 Ų48.61%0.00524%0.235CC..SBendtrans-136.3146.8170.4-76.8-178.2000111.3R119 P160 E162 R168 K169 L172 N1106R119-L164 HydrophobicContact CG-CD1 3.78Å; P160-L164 HydrophobicContact CB-CD1 3.83Å; E162-L164 PolarHBondContact O-N 3.41Å; L164-R168 HydrophobicContact CD1-CG 4.26Å; L164-R168 HydrophobicContact CD2-CG 4.15Å; L164-K169 HydrophobicContact CB-CG 4.01Å; L164-K169 WeakPolarHBondContact O-CE 3.41Å; L164-L172 HydrophobicContact CD1-CD1 3.89Å; L164-N1106 PolarHBondContact O-ND2 3.1Å
165S87.6Confident86.1Confident25 Ų2550 Ų5018%0.17524%0.242CC..  trans-60.6145.3168.170.10000111.8A167 R168 K169 D1107S165-A167 VanDerWaalsContact C-N 3.26Å; S165-A167 PolarHBondContact O-N 3.48Å; S165-R168 WeakPolarHBondContact O-CB 3.47Å; S165-R168 PolarHBondContact O-N 3.41Å; S165-R168 WeakPolarHBondContact OG-CB 3.36Å; S165-R168 PolarHBondContact OG-N 2.92Å; S165-K169 WeakPolarHBondContact O-CG 3.39Å; S165-K169 PolarHBondContact O-N 3.46Å; S165-K169 VanDerWaalsContact O-N 3.12Å; S165-D1107 VanDerWaalsContact CA-OD1 3.24Å; S165-D1107 WeakPolarHBondContact CA-OD1 3.35Å
166V87.3Confident86.1Confident26 Ų2647.3 Ų47.316%0.15823%0.23CC..Hα-helixtrans-57.7-40.5-179.3177.20000111.6R168 K169 E170 R1103 N1106 D1107V166-R168 VanDerWaalsContact C-N 3.27Å; V166-R168 PolarHBondContact O-N 2.74Å; V166-K169 WeakPolarHBondContact O-CB 3.39Å; V166-K169 PolarHBondContact O-N 3.45Å; V166-K169 VanDerWaalsContact O-N 3.1Å; V166-E170 HydrophobicContact CG1-CG 4.34Å; V166-E170 WeakPolarHBondContact O-CG 3.37Å; V166-E170 PolarHBondContact O-N 3.47Å; V166-R1103 HydrophobicContact CB-CG 4.01Å; V166-R1103 HydrophobicContact CG1-CG 4.32Å; V166-R1103 HydrophobicContact CG2-CB 4.27Å; V166-R1103 HydrophobicContact CG2-CG 3.93Å; V166-N1106 HydrophobicContact CG2-CB 3.85Å; V166-N1106 WeakPolarHBondContact CG2-ND2 3.44Å; V166-N1106 PolarHBondContact N-ND2 3.34Å; V166-D1107 PolarHBondContact N-OD1 2.79Å
167A87.4Confident86.2Confident45 Ų4549.3 Ų49.337%0.37224%0.24SC..Hα-helixtrans-58-40.7177.900000112S165 E171S165-A167 VanDerWaalsContact C-N 3.26Å; S165-A167 PolarHBondContact O-N 3.48Å; A167-E171 WeakPolarHBondContact O-CB 3.21Å; A167-E171 PolarHBondContact O-N 3.39Å
168R89.4Confident86.2Confident29 Ų2954.4 Ų54.411%0.10927%0.268CS..Hα-helixtrans-68.7-38.3176.9-175.757.1177.31663.6111.9G118 R119 Q120 W122 L164 S165 V166 E171 L172G118-R168 PolarHBondContact O-NH2 3.21Å; R119-R168 PolarHBondContact O-NE 2.9Å; R119-R168 PolarHBondContact O-NH2 3.35Å; Q120-R168 VanDerWaalsContact C-NH2 3.34Å; Q120-R168 PolarHBondContact O-NH2 2.98Å; W122-R168 PolarHBondContact O-NH1 3.24Å; W122-R168 PolarHBondContact O-NH2 3.38Å; L164-R168 HydrophobicContact CD1-CG 4.26Å; L164-R168 HydrophobicContact CD2-CG 4.15Å; S165-R168 WeakPolarHBondContact O-CB 3.47Å; S165-R168 PolarHBondContact O-N 3.41Å; S165-R168 WeakPolarHBondContact OG-CB 3.36Å; S165-R168 PolarHBondContact OG-N 2.92Å; V166-R168 VanDerWaalsContact C-N 3.27Å; V166-R168 PolarHBondContact O-N 2.74Å; R168-E171 WeakPolarHBondContact CD-OE2 3.14Å; R168-E171 IonicContact CZ-OE2 3.26Å; R168-E171 IonicContact NE-OE2 3.67Å; R168-E171 IonicContact NH1-OE1 2.71Å; R168-E171 IonicContact NH1-OE2 4Å; R168-E171 PolarHBondContact NH1-OE2 3.21Å; R168-E171 PolarHBondContact O-N 3.42Å; R168-L172 HydrophobicContact CG-CD1 4.17Å; R168-L172 HydrophobicContact CG-CG 4.42Å; R168-L172 WeakPolarHBondContact O-CB 3.5Å; R168-L172 VanDerWaalsContact O-CG 3.27Å; R168-L172 WeakPolarHBondContact O-CG 3.36Å; R168-L172 PolarHBondContact O-N 3.2Å
169K90.1Very high86.6Confident39 Ų3957.1 Ų57.117%0.1728%0.28CS..Hα-helixtrans-61-46.2175.3-58.5-177169.6178.50111.6P160 R161 L164 S165 V166 R173 N1106P160-K169 HydrophobicContact CB-CG 4.14Å; P160-K169 HydrophobicContact CG-CB 3.7Å; P160-K169 HydrophobicContact CG-CD 3.82Å; P160-K169 HydrophobicContact CG-CG 3.41Å; P160-K169 VanDerWaalsContact CG-CG 3.41Å; R161-K169 WeakPolarHBondContact O-CE 3.37Å; R161-K169 PolarHBondContact O-NZ 3.17Å; R161-K169 VanDerWaalsContact O-NZ 3.09Å; L164-K169 HydrophobicContact CB-CG 4.01Å; L164-K169 WeakPolarHBondContact O-CE 3.41Å; S165-K169 WeakPolarHBondContact O-CG 3.39Å; S165-K169 PolarHBondContact O-N 3.46Å; S165-K169 VanDerWaalsContact O-N 3.12Å; V166-K169 WeakPolarHBondContact O-CB 3.39Å; V166-K169 PolarHBondContact O-N 3.45Å; V166-K169 VanDerWaalsContact O-N 3.1Å; K169-R173 WeakPolarHBondContact O-CB 3.34Å; K169-R173 PolarHBondContact O-N 2.88Å; K169-N1106 PolarHBondContact NZ-OD1 3.35Å
170E88.6Confident87.4Confident94 Ų9453.9 Ų53.944%0.43926%0.258SS..Hα-helixtrans-62.9-43.5177.4-71.1175.2168.900111.8V166 R173 K174V166-E170 HydrophobicContact CG1-CG 4.34Å; V166-E170 WeakPolarHBondContact O-CG 3.37Å; V166-E170 PolarHBondContact O-N 3.47Å; E170-R173 PolarHBondContact O-N 2.97Å; E170-K174 WeakPolarHBondContact O-CB 3.28Å; E170-K174 PolarHBondContact O-N 3.16Å
171E92.7Very high88.1Confident79 Ų7957.6 Ų57.637%0.36927%0.274SS..Hα-helixtrans-60.6-52176.5-175.8-173.2-156.300111.7A167 R168 R173 K174 L175A167-E171 WeakPolarHBondContact O-CB 3.21Å; A167-E171 PolarHBondContact O-N 3.39Å; R168-E171 WeakPolarHBondContact CD-OE2 3.14Å; R168-E171 IonicContact CZ-OE2 3.26Å; R168-E171 IonicContact NE-OE2 3.67Å; R168-E171 IonicContact NH1-OE1 2.71Å; R168-E171 IonicContact NH1-OE2 4Å; R168-E171 PolarHBondContact NH1-OE2 3.21Å; R168-E171 PolarHBondContact O-N 3.42Å; E171-R173 VanDerWaalsContact C-N 3.33Å; E171-R173 PolarHBondContact O-N 3.07Å; E171-K174 WeakPolarHBondContact O-CB 3.29Å; E171-K174 PolarHBondContact O-N 3.18Å; E171-L175 HydrophobicContact CG-CD1 3.99Å; E171-L175 VanDerWaalsContact O-CG 3.32Å; E171-L175 WeakPolarHBondContact O-CG 3.43Å; E171-L175 PolarHBondContact O-N 3.29Å
172L92.8Very high89Confident0 Ų053.4 Ų53.40%027%0.266CS..Hα-helixtrans-58.4-44.5178.8-72.7173.3000111.8R119 W122 L157 L164 R168 K174 L175 L176R119-L172 HydrophobicContact CG-CD1 4.12Å; W122-L172 HydrophobicContact CE3-CD2 4.06Å; L157-L172 HydrophobicContact CB-CB 4.45Å; L157-L172 HydrophobicContact CD2-CD2 3.9Å; L157-L172 HydrophobicContact CG-CD1 4.23Å; L157-L172 HydrophobicContact CG-CD2 4.06Å; L164-L172 HydrophobicContact CD1-CD1 3.89Å; R168-L172 HydrophobicContact CG-CD1 4.17Å; R168-L172 HydrophobicContact CG-CG 4.42Å; R168-L172 WeakPolarHBondContact O-CB 3.5Å; R168-L172 VanDerWaalsContact O-CG 3.27Å; R168-L172 WeakPolarHBondContact O-CG 3.36Å; R168-L172 PolarHBondContact O-N 3.2Å; L172-K174 VanDerWaalsContact C-N 3.34Å; L172-K174 PolarHBondContact O-N 3.06Å; L172-L175 PolarHBondContact O-N 3.02Å; L172-L176 WeakPolarHBondContact O-CG 3.33Å; L172-L176 PolarHBondContact O-N 3.35Å
173R91.5Very high90.4Very high99 Ų9950.4 Ų50.437%0.37425%0.252SS..Hα-helixtrans-60.9-43.7177.5-171.5179.4-175.9101.7-0.3111.4A158 K169 E170 E171 L176 L177 W259A158-R173 PolarHBondContact O-NH1 3.28Å; K169-R173 WeakPolarHBondContact O-CB 3.34Å; K169-R173 PolarHBondContact O-N 2.88Å; E170-R173 PolarHBondContact O-N 2.97Å; E171-R173 VanDerWaalsContact C-N 3.33Å; E171-R173 PolarHBondContact O-N 3.07Å; R173-L176 PolarHBondContact O-N 3.27Å; R173-L177 HydrophobicContact CG-CD1 4.36Å; R173-L177 VanDerWaalsContact O-CG 3.27Å; R173-L177 WeakPolarHBondContact O-CG 3.39Å; R173-L177 PolarHBondContact O-N 2.98Å; R173-W259 PolarHBondContact NH2-O 3.31Å
174K91.8Very high91Very high143 Ų14349.6 Ų49.662%0.62225%0.248SC*.Hα-helixtrans-61.7-47.7176.8-174.9-178.3176.6-176.10111.6E170 E171 L172 L176 L177 D178E170-K174 WeakPolarHBondContact O-CB 3.28Å; E170-K174 PolarHBondContact O-N 3.16Å; E171-K174 WeakPolarHBondContact O-CB 3.29Å; E171-K174 PolarHBondContact O-N 3.18Å; L172-K174 VanDerWaalsContact C-N 3.34Å; L172-K174 PolarHBondContact O-N 3.06Å; K174-L176 VanDerWaalsContact C-N 3.31Å; K174-L176 PolarHBondContact O-N 2.9Å; K174-L177 WeakPolarHBondContact O-CB 3.4Å; K174-L177 PolarHBondContact O-N 3.13Å; K174-D178 PolarHBondContact O-N 3.47Å; K174-D178 VanDerWaalsContact O-N 3.16Å
175L93.8Very high91.4Very high37 Ų3751.8 Ų51.819%0.19427%0.27CS..Hα-helixtrans-61.2-39.8178.7-68.4165.4000112.3W122 P123 E171 L172 D178 Q179W122-L175 HydrophobicContact CE3-CB 4.41Å; W122-L175 HydrophobicContact CE3-CD1 4.24Å; W122-L175 HydrophobicContact CH2-CB 3.51Å; W122-L175 HydrophobicContact CZ2-CB 4.17Å; W122-L175 HydrophobicContact CZ3-CB 3.65Å; W122-L175 HydrophobicContact CZ3-CD1 4.28Å; P123-L175 HydrophobicContact CG-CD1 4.19Å; P123-L175 HydrophobicContact CG-CD2 4.27Å; E171-L175 HydrophobicContact CG-CD1 3.99Å; E171-L175 VanDerWaalsContact O-CG 3.32Å; E171-L175 WeakPolarHBondContact O-CG 3.43Å; E171-L175 PolarHBondContact O-N 3.29Å; L172-L175 PolarHBondContact O-N 3.02Å; L175-D178 PolarHBondContact O-N 3.18Å; L175-Q179 WeakPolarHBondContact O-CG 3.31Å
176L93.3Very high91.7Very high10 Ų1052.3 Ų52.35%0.05227%0.271CS..Hα-helixtrans-66.5-42.2175.3-74.7-179.6000112.1W122 F130 T153 L157 A158 L172 R173 K174 D178 Q179 V180 W259W122-L176 HydrophobicContact CH2-CD2 4.09Å; W122-L176 HydrophobicContact CZ3-CD2 3.99Å; W122-L176 HydrophobicContact CZ3-CG 4.22Å; F130-L176 HydrophobicContact CD2-CD2 4.42Å; F130-L176 HydrophobicContact CE2-CD2 3.82Å; F130-L176 HydrophobicContact CZ-CD2 4.49Å; T153-L176 HydrophobicContact CG2-CD2 4.24Å; L157-L176 HydrophobicContact CB-CD1 3.58Å; L157-L176 HydrophobicContact CB-CG 4.29Å; L157-L176 HydrophobicContact CD2-CD2 4.46Å; A158-L176 HydrophobicContact CB-CD1 3.82Å; L172-L176 WeakPolarHBondContact O-CG 3.33Å; L172-L176 PolarHBondContact O-N 3.35Å; R173-L176 PolarHBondContact O-N 3.27Å; K174-L176 VanDerWaalsContact C-N 3.31Å; K174-L176 PolarHBondContact O-N 2.9Å; L176-D178 PolarHBondContact O-N 2.96Å; L176-Q179 PolarHBondContact O-N 2.69Å; L176-V180 WeakPolarHBondContact O-CG2 3.41Å; L176-V180 PolarHBondContact O-N 3.23Å; L176-W259 HydrophobicContact CB-CH2 3.85Å; L176-W259 HydrophobicContact CB-CZ3 4.5Å; L176-W259 HydrophobicContact CD1-CH2 4.32Å; L176-W259 HydrophobicContact CD1-CZ2 4.45Å
177L92.5Very high92.1Very high62 Ų6251 Ų5133%0.32526%0.264SS..Hα-helixtrans-57-39.2177.4-75.6170000111.9R173 K174 Q179 V180 W259 P261R173-L177 HydrophobicContact CG-CD1 4.36Å; R173-L177 VanDerWaalsContact O-CG 3.27Å; R173-L177 WeakPolarHBondContact O-CG 3.39Å; R173-L177 PolarHBondContact O-N 2.98Å; K174-L177 WeakPolarHBondContact O-CB 3.4Å; K174-L177 PolarHBondContact O-N 3.13Å; L177-Q179 PolarHBondContact O-N 3.39Å; L177-V180 HydrophobicContact CD2-CG2 4.43Å; L177-V180 PolarHBondContact O-N 2.91Å; L177-W259 HydrophobicContact CD2-CE3 4.47Å; L177-W259 HydrophobicContact CD2-CZ3 3.76Å; L177-W259 HydrophobicContact CG-CZ3 4.13Å; L177-P261 HydrophobicContact CD2-CG 3.99Å
178D91.9Very high92.3Very high108 Ų10849.2 Ų49.258%0.57825%0.248SC*.Hα-helixtrans-62.9-22.6176.7-66.3-20.2000112.8K174 L175 L176K174-D178 PolarHBondContact O-N 3.47Å; K174-D178 VanDerWaalsContact O-N 3.16Å; L175-D178 PolarHBondContact O-N 3.18Å; L176-D178 PolarHBondContact O-N 2.96Å
179Q93Very high92.5Very high59 Ų5949 Ų4928%0.27626%0.255SS..Hα-helixtrans-97.4-10.6-179.6-58.6-58-47.500114.1F130 L175 L176 L177 Q181 T182 V183F130-Q179 HydrophobicContact CD1-CB 4.26Å; F130-Q179 HydrophobicContact CD1-CG 3.8Å; F130-Q179 HydrophobicContact CE1-CB 3.49Å; F130-Q179 VanDerWaalsContact CE1-CB 3.49Å; F130-Q179 HydrophobicContact CE1-CG 3.56Å; F130-Q179 HydrophobicContact CZ-CB 3.83Å; F130-Q179 HydrophobicContact CZ-CG 4.16Å; L175-Q179 WeakPolarHBondContact O-CG 3.31Å; L176-Q179 PolarHBondContact O-N 2.69Å; L177-Q179 PolarHBondContact O-N 3.39Å; Q179-Q181 PolarHBondContact O-N 3.26Å; Q179-T182 PolarHBondContact O-N 3.28Å; Q179-V183 WeakPolarHBondContact O-CG2 3.28Å; Q179-V183 PolarHBondContact O-N 3.39Å
180V91.9Very high92.7Very high6 Ų648.4 Ų48.44%0.03625%0.253CS..Hα-helixtrans-55.8-45.8-171.1166.70000112.3L176 L177 T182 V183 L184 W259 I260L176-V180 WeakPolarHBondContact O-CG2 3.41Å; L176-V180 PolarHBondContact O-N 3.23Å; L177-V180 HydrophobicContact CD2-CG2 4.43Å; L177-V180 PolarHBondContact O-N 2.91Å; V180-T182 PolarHBondContact O-N 3.2Å; V180-V183 PolarHBondContact O-N 3.03Å; V180-L184 HydrophobicContact CG1-CD1 3.73Å; V180-L184 HydrophobicContact CG1-CG 4.08Å; V180-L184 WeakPolarHBondContact O-CB 3.48Å; V180-L184 WeakPolarHBondContact O-CG 3.21Å; V180-L184 PolarHBondContact O-N 2.94Å; V180-W259 HydrophobicContact CG2-CH2 3.99Å; V180-W259 HydrophobicContact CG2-CZ3 4.5Å; V180-I260 HydrophobicContact CG1-CB 4.49Å; V180-I260 HydrophobicContact CG1-CD1 3.98Å; V180-I260 HydrophobicContact CG1-CG2 4.12Å; V180-I260 HydrophobicContact CG2-CG2 3.71Å
181Q90.3Very high92.8Very high98 Ų9844 Ų4446%0.45823%0.232SC..Hα-helixtrans-62-43.6-177.7-64.5-63.9-20.400112.2Q179 L184 G185 A264Q179-Q181 PolarHBondContact O-N 3.26Å; Q181-L184 PolarHBondContact O-N 2.94Å; Q181-G185 PolarHBondContact O-N 3.03Å; Q181-A264 PolarHBondContact NE2-O 3.42Å
182T92.8Very high92.8Very high72 Ų7243.4 Ų43.444%0.44223%0.23SC..Hα-helixtrans-62-45.2176.6-53.10000110.8L134 Q179 V180 G185 L186L134-T182 HydrophobicContact CD1-CG2 4.28Å; Q179-T182 PolarHBondContact O-N 3.28Å; V180-T182 PolarHBondContact O-N 3.2Å; T182-G185 PolarHBondContact O-N 3.47Å; T182-L186 HydrophobicContact CG2-CD1 4.32Å; T182-L186 WeakPolarHBondContact O-CG 3.49Å; T182-L186 PolarHBondContact O-N 3.08Å
183V94.6Very high92.6Very high5 Ų548 Ų483%0.0326%0.258CS..Hα-helixtrans-64.3-47.2179.7172.10000111.5F130 L134 L150 Q179 V180 G185 L186 L187 L256F130-V183 HydrophobicContact CE1-CG2 4.11Å; F130-V183 HydrophobicContact CZ-CG2 3.86Å; L134-V183 HydrophobicContact CD2-CG2 4.16Å; L150-V183 HydrophobicContact CD1-CG1 4.03Å; L150-V183 HydrophobicContact CD1-CG2 4.08Å; L150-V183 HydrophobicContact CD2-CG1 3.64Å; L150-V183 HydrophobicContact CG-CG1 4.35Å; Q179-V183 WeakPolarHBondContact O-CG2 3.28Å; Q179-V183 PolarHBondContact O-N 3.39Å; V180-V183 PolarHBondContact O-N 3.03Å; V183-G185 VanDerWaalsContact C-N 3.32Å; V183-G185 PolarHBondContact O-N 2.89Å; V183-L186 PolarHBondContact O-N 3.22Å; V183-L187 HydrophobicContact CG1-CD1 3.86Å; V183-L187 HydrophobicContact CG1-CG 4.29Å; V183-L187 WeakPolarHBondContact O-CG 3.3Å; V183-L187 PolarHBondContact O-N 3.5Å; V183-L256 HydrophobicContact CG1-CD1 3.73Å
184L93Very high92.5Very high5 Ų544 Ų443%0.02624%0.244CC..Hα-helixtrans-61.3-41.3177.7-69.4179.6000111.5V180 Q181 L186 L187 T188 L253 L256 F257 I260 S265 L270V180-L184 HydrophobicContact CG1-CD1 3.73Å; V180-L184 HydrophobicContact CG1-CG 4.08Å; V180-L184 WeakPolarHBondContact O-CB 3.48Å; V180-L184 WeakPolarHBondContact O-CG 3.21Å; V180-L184 PolarHBondContact O-N 2.94Å; Q181-L184 PolarHBondContact O-N 2.94Å; L184-L186 PolarHBondContact O-N 3.18Å; L184-L187 PolarHBondContact O-N 2.93Å; L184-T188 WeakPolarHBondContact O-CB 3.5Å; L184-T188 PolarHBondContact O-N 3.25Å; L184-T188 PolarHBondContact O-OG1 3.41Å; L184-L253 HydrophobicContact CD2-CD2 3.6Å; L184-L256 HydrophobicContact CD2-CD1 4.22Å; L184-F257 HydrophobicContact CD2-CE1 4.2Å; L184-I260 HydrophobicContact CD1-CD1 4.1Å; L184-S265 VanDerWaalsContact CD1-O 3.31Å; L184-S265 WeakPolarHBondContact CD1-O 3.5Å; L184-L270 HydrophobicContact CD2-CD2 4.15Å
185G92.4Very high92.3Very high46 Ų4637.6 Ų37.647%0.47422%0.216SC..Hα-helixtrans-59.6-43.8174.300000112.8Q181 T182 V183 G189Q181-G185 PolarHBondContact O-N 3.03Å; T182-G185 PolarHBondContact O-N 3.47Å; V183-G185 VanDerWaalsContact C-N 3.32Å; V183-G185 PolarHBondContact O-N 2.89Å; G185-G189 PolarHBondContact O-N 3.22Å
186L94Very high91.9Very high36 Ų3640.5 Ų40.519%0.18823%0.232CC..Hα-helixtrans-65.5-47.2177.1-71.5169.2000112.5L134 Q138 T182 V183 L184 T188 G189 I190L134-L186 HydrophobicContact CD2-CD1 3.76Å; Q138-L186 HydrophobicContact CG-CD2 4.03Å; T182-L186 HydrophobicContact CG2-CD1 4.32Å; T182-L186 WeakPolarHBondContact O-CG 3.49Å; T182-L186 PolarHBondContact O-N 3.08Å; V183-L186 PolarHBondContact O-N 3.22Å; L184-L186 PolarHBondContact O-N 3.18Å; L186-T188 VanDerWaalsContact C-N 3.34Å; L186-T188 PolarHBondContact O-N 3.31Å; L186-G189 PolarHBondContact O-N 3.23Å; L186-I190 VanDerWaalsContact O-CG1 3.27Å; L186-I190 WeakPolarHBondContact O-CG1 3.11Å; L186-I190 PolarHBondContact O-N 2.87Å
187L95.4Very high91.4Very high0 Ų046.6 Ų46.60%026%0.258CS..Hα-helixtrans-62.7-42.4179.2-67.3175.2000111.4L147 L150 V183 L184 I190 L191 A249 C252 L253 L256L147-L187 HydrophobicContact CD2-CD2 3.4Å; L150-L187 HydrophobicContact CD2-CD1 4.32Å; L150-L187 HydrophobicContact CD2-CD2 4.12Å; L150-L187 HydrophobicContact CD2-CG 4.41Å; V183-L187 HydrophobicContact CG1-CD1 3.86Å; V183-L187 HydrophobicContact CG1-CG 4.29Å; V183-L187 WeakPolarHBondContact O-CG 3.3Å; V183-L187 PolarHBondContact O-N 3.5Å; L184-L187 PolarHBondContact O-N 2.93Å; L187-I190 PolarHBondContact O-N 3.18Å; L187-L191 WeakPolarHBondContact O-CG 3.37Å; L187-L191 PolarHBondContact O-N 2.94Å; L187-A249 HydrophobicContact CD2-CB 4.13Å; L187-C252 HydrophobicContact CD1-CB 3.81Å; L187-C252 HydrophobicContact CD2-CB 4.11Å; L187-L253 HydrophobicContact CB-CD2 4.03Å; L187-L253 HydrophobicContact CB-CG 4.22Å; L187-L253 HydrophobicContact CD1-CD2 3.75Å; L187-L253 HydrophobicContact CD1-CG 3.95Å; L187-L256 HydrophobicContact CD1-CD1 3.72Å
188T93.5Very high90.8Very high7 Ų745 Ų454%0.04325%0.249CC..Hα-helixtrans-60.8-48.9174.9-51.60000110.7L184 L186 I190 L191 E192 L270L184-T188 WeakPolarHBondContact O-CB 3.5Å; L184-T188 PolarHBondContact O-N 3.25Å; L184-T188 PolarHBondContact O-OG1 3.41Å; L186-T188 VanDerWaalsContact C-N 3.34Å; L186-T188 PolarHBondContact O-N 3.31Å; T188-I190 VanDerWaalsContact C-N 3.34Å; T188-I190 PolarHBondContact O-N 3.07Å; T188-L191 PolarHBondContact O-N 3.45Å; T188-E192 HydrophobicContact CG2-CG 4.34Å; T188-E192 WeakPolarHBondContact CG2-OE1 3.35Å; T188-E192 WeakPolarHBondContact O-CG 3.49Å; T188-E192 PolarHBondContact O-N 3.11Å; T188-L270 HydrophobicContact CG2-CB 4.3Å; T188-L270 WeakPolarHBondContact OG1-CD1 3.48Å
189G92.6Very high89.9Confident25 Ų2541.6 Ų41.626%0.25823%0.233SC..Hα-helixtrans-62.9-35.4-179.300000113.7G185 L186 T193G185-G189 PolarHBondContact O-N 3.22Å; L186-G189 PolarHBondContact O-N 3.23Å; G189-T193 VanDerWaalsContact O-CB 3.25Å; G189-T193 WeakPolarHBondContact O-CB 3.22Å; G189-T193 PolarHBondContact O-N 2.88Å; G189-T193 PolarHBondContact O-OG1 3.29Å
190I93.3Very high88.3Confident26 Ų2644.7 Ų44.713%0.13326%0.256CS..Hα-helixtrans-62.9-49.4174.2-69.6162.8000110.5I137 T143 L147 L186 L187 T188 T193 V194 I245I137-I190 HydrophobicContact CG2-CD1 3.48Å; I137-I190 VanDerWaalsContact CG2-CD1 3.48Å; T143-I190 HydrophobicContact CG2-CD1 4.27Å; L147-I190 HydrophobicContact CD2-CD1 4.15Å; L186-I190 VanDerWaalsContact O-CG1 3.27Å; L186-I190 WeakPolarHBondContact O-CG1 3.11Å; L186-I190 PolarHBondContact O-N 2.87Å; L187-I190 PolarHBondContact O-N 3.18Å; T188-I190 VanDerWaalsContact C-N 3.34Å; T188-I190 PolarHBondContact O-N 3.07Å; I190-T193 PolarHBondContact O-N 2.76Å; I190-V194 WeakPolarHBondContact O-CG2 3.49Å; I190-V194 PolarHBondContact O-N 3.49Å; I190-I245 HydrophobicContact CG2-CG2 3.6Å
191L92.6Very high86.2Confident0 Ų049.8 Ų49.80%029%0.287CS..Hα-helixtrans-62.6-43.7-179.7-69.3174.3000111.6L187 T188 W195 C246 A249 L250 L253 T273 F277L187-L191 WeakPolarHBondContact O-CG 3.37Å; L187-L191 PolarHBondContact O-N 2.94Å; T188-L191 PolarHBondContact O-N 3.45Å; L191-W195 WeakPolarHBondContact O-CB 3.13Å; L191-W195 PolarHBondContact O-N 3.44Å; L191-C246 HydrophobicContact CD2-CB 3.89Å; L191-A249 HydrophobicContact CD2-CB 4Å; L191-A249 HydrophobicContact CG-CB 4.18Å; L191-L250 HydrophobicContact CD1-CD2 4.03Å; L191-L250 HydrophobicContact CD2-CG 4.38Å; L191-L253 HydrophobicContact CD1-CD1 3.78Å; L191-T273 HydrophobicContact CB-CG2 3.5Å; L191-T273 HydrophobicContact CD1-CG2 4.14Å; L191-T273 HydrophobicContact CG-CG2 4.48Å; L191-F277 HydrophobicContact CB-CE2 3.8Å; L191-F277 HydrophobicContact CB-CZ 4.33Å; L191-F277 HydrophobicContact CD2-CD2 4.34Å; L191-F277 HydrophobicContact CD2-CE1 4.28Å; L191-F277 HydrophobicContact CD2-CE2 3.89Å; L191-F277 HydrophobicContact CD2-CZ 3.84Å; L191-F277 HydrophobicContact CG-CE2 4.36Å
192E91.3Very high83.9Confident67 Ų6748.8 Ų48.831%0.31330%0.296SS..Hα-helixtrans-64.2-45.4176.5-72.6174.2174.800111.9T188 V194 W195 D196 T273T188-E192 HydrophobicContact CG2-CG 4.34Å; T188-E192 WeakPolarHBondContact CG2-OE1 3.35Å; T188-E192 WeakPolarHBondContact O-CG 3.49Å; T188-E192 PolarHBondContact O-N 3.11Å; E192-V194 VanDerWaalsContact C-N 3.35Å; E192-V194 PolarHBondContact O-N 2.98Å; E192-W195 WeakPolarHBondContact O-CB 3.3Å; E192-W195 PolarHBondContact O-N 3.08Å; E192-D196 WeakPolarHBondContact O-CB 3.39Å; E192-D196 PolarHBondContact O-N 3.03Å; E192-T273 HydrophobicContact CG-CG2 4.04Å; E192-T273 WeakPolarHBondContact CG-OG1 3.45Å; E192-T273 PolarHBondContact OE1-OG1 2.98Å; E192-T273 VanDerWaalsContact OE1-OG1 3.12Å
193T90Very high81.2Confident97 Ų9750 Ų5060%0.59531%0.313SS*.Hα-helixtrans-61.8-42.5179.1-58.40000111.7G189 I190 K197G189-T193 VanDerWaalsContact O-CB 3.25Å; G189-T193 WeakPolarHBondContact O-CB 3.22Å; G189-T193 PolarHBondContact O-N 2.88Å; G189-T193 PolarHBondContact O-OG1 3.29Å; I190-T193 PolarHBondContact O-N 2.76Å; T193-K197 VanDerWaalsContact O-CB 3.23Å; T193-K197 WeakPolarHBondContact O-CB 3.47Å; T193-K197 PolarHBondContact O-N 3.03Å
194V88.8Confident78.5Confident15 Ų1555.7 Ų55.79%0.09135%0.348CS..Hα-helixtrans-66.2-42.1177.2171.40000110.9I190 E192 H198 L238 C246I190-V194 WeakPolarHBondContact O-CG2 3.49Å; I190-V194 PolarHBondContact O-N 3.49Å; E192-V194 VanDerWaalsContact C-N 3.35Å; E192-V194 PolarHBondContact O-N 2.98Å; V194-H198 PolarHBondContact O-N 3.25Å; V194-H198 PolarHBondContact O-ND1 3.27Å; V194-L238 HydrophobicContact CG1-CD2 3.9Å; V194-C246 VanDerWaalsContact CG1-SG 3.56Å
195W86.6Confident75.8Confident8 Ų860.9 Ų60.93%0.0338%0.382CS..Hα-helixtrans-59.1-56.7176.2-175.9-86.9000111L191 E192 K197 H198 S199 P236 H276 F277 F280L191-W195 WeakPolarHBondContact O-CB 3.13Å; L191-W195 PolarHBondContact O-N 3.44Å; E192-W195 WeakPolarHBondContact O-CB 3.3Å; E192-W195 PolarHBondContact O-N 3.08Å; W195-K197 VanDerWaalsContact C-N 3.34Å; W195-K197 PolarHBondContact O-N 3.46Å; W195-H198 PolarHBondContact O-N 2.83Å; W195-H198 VanDerWaalsContact O-N 3.12Å; W195-S199 PolarHBondContact NE1-OG 3.48Å; W195-S199 PolarHBondContact O-N 3.12Å; W195-S199 PolarHBondContact O-OG 2.88Å; W195-S199 VanDerWaalsContact O-OG 3.05Å; W195-P236 HydrophobicContact CD2-CG 4.01Å; W195-P236 HydrophobicContact CE3-CG 3.8Å; W195-P236 HydrophobicContact CH2-CG 4.28Å; W195-P236 HydrophobicContact CZ2-CG 4.47Å; W195-P236 HydrophobicContact CZ3-CG 3.96Å; W195-H276 HydrophobicContact CD2-CB 4.41Å; W195-H276 HydrophobicContact CE3-CB 4.14Å; W195-H276 HydrophobicContact CH2-CB 3.87Å; W195-H276 HydrophobicContact CZ2-CB 4.14Å; W195-H276 HydrophobicContact CZ3-CB 3.85Å; W195-F277 HydrophobicContact CE3-CD2 4.45Å; W195-F277 HydrophobicContact CE3-CE2 4.11Å; W195-F277 HydrophobicContact CE3-CZ 4.32Å; W195-F280 HydrophobicContact CE3-CE2 4.3Å; W195-F280 HydrophobicContact CZ3-CD2 4.47Å; W195-F280 AromaticContact CZ3-CE2 3.7Å; W195-F280 HydrophobicContact CZ3-CE2 3.7Å; W195-F280 HydrophobicContact CZ3-CZ 4.43Å
196D85.8Confident73Confident98 Ų9864.3 Ų64.352%0.52440%0.396SS..Hα-helixtrans-61-40.6-176.5-72.7-17.8000112.5E192 H198 S199 V200E192-D196 WeakPolarHBondContact O-CB 3.39Å; E192-D196 PolarHBondContact O-N 3.03Å; D196-H198 PolarHBondContact O-N 3.26Å; D196-S199 PolarHBondContact O-N 3.45Å; D196-V200 WeakPolarHBondContact O-CG2 3.32Å
197K83.8Confident70.2Confident139 Ų13968.4 Ų68.460%0.60443%0.425SS*.Hα-helixtrans-56.6-36.8177.3178.9-178.1172.1-165.20112.6T193 W195T193-K197 VanDerWaalsContact O-CB 3.23Å; T193-K197 WeakPolarHBondContact O-CB 3.47Å; T193-K197 PolarHBondContact O-N 3.03Å; W195-K197 VanDerWaalsContact C-N 3.34Å; W195-K197 PolarHBondContact O-N 3.46Å
198H80.2Confident67.1Low29 Ų2972.8 Ų72.813%0.13446%0.455CS..Hα-helixtrans-100.7-10-174.5-63.885.4000113.5V194 W195 D196 P236 I237 L238 D239 S242V194-H198 PolarHBondContact O-N 3.25Å; V194-H198 PolarHBondContact O-ND1 3.27Å; W195-H198 PolarHBondContact O-N 2.83Å; W195-H198 VanDerWaalsContact O-N 3.12Å; D196-H198 PolarHBondContact O-N 3.26Å; H198-P236 HydrophobicContact CB-CB 3.68Å; H198-I237 PolarHBondContact CD2-O 3.02Å; H198-L238 HydrophobicContact CB-CD2 3.95Å; H198-D239 IonicContact CE1-OD1 2.98Å; H198-D239 IonicContact NE2-OD1 2.98Å; H198-D239 PolarHBondContact NE2-OD1 2.8Å; H198-S242 PolarHBondContact CE1-OG 2.92Å; H198-S242 VanDerWaalsContact CE1-OG 3.28Å
199S72.3Confident64.2Low35 Ų3578.8 Ų78.825%0.24550%0.495CS..Hα-helixtrans-79.1-24.3174.7-68.50000113.6W195 D196W195-S199 PolarHBondContact NE1-OG 3.48Å; W195-S199 PolarHBondContact O-N 3.12Å; W195-S199 PolarHBondContact O-OG 2.88Å; W195-S199 VanDerWaalsContact O-OG 3.05Å; D196-S199 PolarHBondContact O-N 3.45Å
200V58.5Low61.3Low124 Ų12483.9 Ų83.975%0.75252%0.521SS*.THydrogen-bonded Turntrans-84.5-19.2-173.7179.20000113.7D196 A202D196-V200 WeakPolarHBondContact O-CG2 3.32Å; V200-A202 VanDerWaalsContact C-N 3.35Å; V200-A202 PolarHBondContact O-N 3.43Å
201T48.2Very low58.4Low113 Ų11387.3 Ų87.369%0.69355%0.547SS*.THydrogen-bonded Turntrans-81.6-0.3-172.820.80000115.7A203T201-A203 VanDerWaalsContact C-N 3.28Å; T201-A203 PolarHBondContact O-N 3.1Å; T201-A203 VanDerWaalsContact O-N 3.11Å
202A41.2Very low55.4Low77 Ų7791 Ų9164%0.63659%0.585SS**  trans-85.761.6172.700000111.9V200 T204V200-A202 VanDerWaalsContact C-N 3.35Å; V200-A202 PolarHBondContact O-N 3.43Å; A202-T204 PolarHBondContact O-N 3.1Å
203A37Very low52.6Low98 Ų9896.9 Ų96.981%0.8161%0.613SS**  trans-79.391.6166.300000109.4T201T201-A203 VanDerWaalsContact C-N 3.28Å; T201-A203 PolarHBondContact O-N 3.1Å; T201-A203 VanDerWaalsContact O-N 3.11Å
204T38.3Very low49.9Very low124 Ų12497.8 Ų97.876%0.76162%0.623SS**  trans-120.4151.4163.740.80000110.3A202A202-T204 PolarHBondContact O-N 3.1Å
205P36.3Very low47.4Very low114 Ų114100.2 Ų100.274%0.7465%0.651SS**PPolyproline II helixtrans-69.7167.2-168.1-3.920.2000112.4
206P34Very low45.6Very low119 Ų119102.4 Ų102.477%0.77366%0.664SS**PPolyproline II helixtrans-61.5146.4-172.926.6-34000112.2
207P34.9Very low43.9Very low122 Ų122102.7 Ų102.779%0.79266%0.664SS**PPolyproline II helixtrans-72.8141.3-179.529.4-32.3000111.6
208S30.6Very low42.2Very low91 Ų9196.6 Ų96.664%0.63664%0.639SS**PPolyproline II helixtrans-65148169.2-58.20000111.5T210S208-T210 VanDerWaalsContact C-N 3.28Å; S208-T210 PolarHBondContact O-N 3.35Å
209P32.1Very low40.8Very low134 Ų13498.3 Ų98.387%0.8765%0.653SS**SBendtrans-82.858.3-169.735.8-36.6000112.9
210T30.5Very low39.6Very low131 Ų131103.1 Ų103.180%0.80468%0.676SS**  trans-140.914.9-177.739.40000116.6S208S208-T210 VanDerWaalsContact C-N 3.28Å; S208-T210 PolarHBondContact O-N 3.35Å
211S32.5Very low39.2Very low99 Ų99100.7 Ų100.769%0.69266%0.659SS**SBendtrans-110.7103.8164.455.20000109.5E213S211-E213 PolarHBondContact O-N 3.15Å; S211-E213 VanDerWaalsContact O-N 3.13Å
212G30.2Very low39.4Very low77 Ų7796.1 Ų96.179%0.79463%0.63SS**  trans-58.1114.217300000110.6S214G212-S214 PolarHBondContact O-N 3.43Å; G212-S214 VanDerWaalsContact O-N 3.11Å
213E33.3Very low39.5Very low190 Ų190101.5 Ų101.589%0.88864%0.642SS**  trans-69.399164.9-72.3-178.2159.700107.9S211 G215S211-E213 PolarHBondContact O-N 3.15Å; S211-E213 VanDerWaalsContact O-N 3.13Å; E213-G215 PolarHBondContact O-N 3.32Å
214S32.5Very low39.9Very low117 Ų11798.6 Ų98.682%0.81862%0.616SS**  trans-57.6118.3161.5-44.30000107.7G212 D216G212-S214 PolarHBondContact O-N 3.43Å; G212-S214 VanDerWaalsContact O-N 3.11Å; S214-D216 PolarHBondContact O-N 3.21Å
215G36.9Very low40Very low66 Ų6697.7 Ų97.768%0.6861%0.612SS**  trans-45.3124-168.900000114.6E213 L217E213-G215 PolarHBondContact O-N 3.32Å; G215-L217 PolarHBondContact O-N 3.3Å
216D47.7Very low40.4Very low54 Ų5495.9 Ų95.929%0.28960%0.602SS.*  trans-73.1110.5178.1-143.20.1000108.5S214 L218 S219 N232 Q345S214-D216 PolarHBondContact O-N 3.21Å; D216-L218 PolarHBondContact O-N 2.95Å; D216-L218 VanDerWaalsContact O-N 3.08Å; D216-S219 WeakPolarHBondContact O-CB 3.43Å; D216-S219 PolarHBondContact O-N 3.45Å; D216-S219 PolarHBondContact O-OG 2.86Å; D216-N232 PolarHBondContact OD2-ND2 3.14Å; D216-Q345 PolarHBondContact OD1-NE2 3.09Å
217L49.9Very low41Very low103 Ų10392 Ų9254%0.53958%0.578SS.*Hα-helixtrans-52.1-32.4-179.2-81.1158.8000112.7G215 S219 N220 L221G215-L217 PolarHBondContact O-N 3.3Å; L217-S219 VanDerWaalsContact C-N 3.33Å; L217-S219 PolarHBondContact O-N 2.76Å; L217-N220 PolarHBondContact O-N 2.9Å; L217-L221 PolarHBondContact O-N 3.42Å
218L48.8Very low41.7Very low12 Ų1287.2 Ų87.26%0.06355%0.549CS..Hα-helixtrans-62.6-33.2173.7-79.5163.1000113.7D216 N220 L221 L222 F341 Y342D216-L218 PolarHBondContact O-N 2.95Å; D216-L218 VanDerWaalsContact O-N 3.08Å; L218-N220 VanDerWaalsContact C-N 3.29Å; L218-N220 PolarHBondContact O-N 3.49Å; L218-L221 PolarHBondContact O-N 2.81Å; L218-L222 HydrophobicContact CB-CD1 4.27Å; L218-L222 HydrophobicContact CD2-CD1 4.24Å; L218-L222 VanDerWaalsContact O-CB 3.31Å; L218-L222 WeakPolarHBondContact O-CB 3.34Å; L218-L222 VanDerWaalsContact O-CG 3.25Å; L218-L222 WeakPolarHBondContact O-CG 3.29Å; L218-L222 PolarHBondContact O-N 2.96Å; L218-F341 HydrophobicContact CD2-CB 4.4Å; L218-Y342 HydrophobicContact CD1-CD2 3.79Å; L218-Y342 HydrophobicContact CD1-CG 4.44Å
219S50Low42.7Very low64 Ų6490.5 Ų90.545%0.44855%0.552SS.*Hα-helixtrans-68.9-28-179.368.90000112.9D216 L217D216-S219 WeakPolarHBondContact O-CB 3.43Å; D216-S219 PolarHBondContact O-N 3.45Å; D216-S219 PolarHBondContact O-OG 2.86Å; L217-S219 VanDerWaalsContact C-N 3.33Å; L217-S219 PolarHBondContact O-N 2.76Å
220N47.8Very low43.7Very low136 Ų13688.2 Ų88.273%0.72753%0.532SS*.Hα-helixtrans-83.6-28.4175.6-70.2-24.3000112.6L217 L218L217-N220 PolarHBondContact O-N 2.9Å; L218-N220 VanDerWaalsContact C-N 3.29Å; L218-N220 PolarHBondContact O-N 3.49Å
221L50Low45Very low73 Ų7382.3 Ų82.338%0.38250%0.495SS..Hα-helixtrans-84.2-30.7179.8-80.8161.4000113.3L217 L218 Q223 P393L217-L221 PolarHBondContact O-N 3.42Å; L218-L221 PolarHBondContact O-N 2.81Å; L221-Q223 PolarHBondContact O-N 3.3Å; L221-P393 HydrophobicContact CD1-CB 4.18Å; L221-P393 HydrophobicContact CD1-CG 3.89Å; L221-P393 HydrophobicContact CD2-CB 3.7Å; L221-P393 HydrophobicContact CD2-CG 3.81Å; L221-P393 HydrophobicContact CG-CG 4.48Å
222L53Low46.1Very low18 Ų1881.7 Ų81.79%0.09448%0.484CS..  trans-91.294.5179-63.4168.2000109.6L218 S224 A228 L231 Q338L218-L222 HydrophobicContact CB-CD1 4.27Å; L218-L222 HydrophobicContact CD2-CD1 4.24Å; L218-L222 VanDerWaalsContact O-CB 3.31Å; L218-L222 WeakPolarHBondContact O-CB 3.34Å; L218-L222 VanDerWaalsContact O-CG 3.25Å; L218-L222 WeakPolarHBondContact O-CG 3.29Å; L218-L222 PolarHBondContact O-N 2.96Å; L222-S224 PolarHBondContact O-N 3.44Å; L222-A228 HydrophobicContact CD1-CB 4.33Å; L222-L231 HydrophobicContact CD1-CD1 3.69Å; L222-Q338 VanDerWaalsContact CD2-CD 3.47Å; L222-Q338 HydrophobicContact CD2-CG 3.83Å
223Q42.8Very low47.7Very low190 Ų19081.2 Ų81.289%0.88846%0.461SS*.  trans-6415.3172.1-66.7-178.4-3.100114.1L221L221-Q223 PolarHBondContact O-N 3.3Å
224S44.9Very low49.3Very low36 Ų3676.3 Ų76.325%0.25245%0.446SS..  trans-123.8105.7-176.2157.10000109.9L222 S226 S227L222-S224 PolarHBondContact O-N 3.44Å; S224-S226 PolarHBondContact O-N 2.99Å; S224-S226 VanDerWaalsContact O-N 3.15Å; S224-S226 PolarHBondContact OG-OG 3.36Å; S224-S227 PolarHBondContact O-N 3.46Å; S224-S227 WeakPolarHBondContact OG-CB 3.38Å; S224-S227 PolarHBondContact OG-N 3.26Å; S224-S227 PolarHBondContact OG-OG 3.42Å
225P41.3Very low51.4Low105 Ų10571.3 Ų71.368%0.68241%0.41SS*.Hα-helixtrans-60.8-21177.1-21.431.3000113.9K229P225-K229 WeakPolarHBondContact O-CG 3.37Å
226S45.2Very low53.5Low77 Ų7768.6 Ų68.654%0.53838%0.38SS..Hα-helixtrans-77.6-39.517935.90000112.9S224 K229 L230S224-S226 PolarHBondContact O-N 2.99Å; S224-S226 VanDerWaalsContact O-N 3.15Å; S224-S226 PolarHBondContact OG-OG 3.36Å; S226-K229 PolarHBondContact O-N 3.27Å; S226-L230 PolarHBondContact O-N 2.92Å
227S46.4Very low54.9Low36 Ų3671.9 Ų71.925%0.25240%0.396SS..Hα-helixtrans-71.3-39.9-177.2-53.80000111.8S224 K229 L230 L231S224-S227 PolarHBondContact O-N 3.46Å; S224-S227 WeakPolarHBondContact OG-CB 3.38Å; S224-S227 PolarHBondContact OG-N 3.26Å; S224-S227 PolarHBondContact OG-OG 3.42Å; S227-K229 VanDerWaalsContact C-N 3.33Å; S227-K229 PolarHBondContact O-N 3.05Å; S227-L230 PolarHBondContact O-N 3.5Å; S227-L231 WeakPolarHBondContact O-CG 3.34Å; S227-L231 PolarHBondContact O-N 2.98Å; S227-L231 VanDerWaalsContact O-N 3.17Å
228A48.6Very low56.5Low23 Ų2367.3 Ų67.319%0.1937%0.372CS..Hα-helixtrans-63.4-35.8176.500000112.8L222 L231 N232L222-A228 HydrophobicContact CD1-CB 4.33Å; A228-L231 PolarHBondContact O-N 3.34Å; A228-N232 WeakPolarHBondContact O-CB 3.48Å; A228-N232 PolarHBondContact O-N 2.75Å; A228-N232 VanDerWaalsContact O-N 3.12Å
229K51.9Low58.1Low159 Ų15970 Ų7069%0.69139%0.387SS*.Hα-helixtrans-66.5-35.3176.7-77.5-179.2-179.7-177.40113.4P225 S226 S227 Q233P225-K229 WeakPolarHBondContact O-CG 3.37Å; S226-K229 PolarHBondContact O-N 3.27Å; S227-K229 VanDerWaalsContact C-N 3.33Å; S227-K229 PolarHBondContact O-N 3.05Å; K229-Q233 WeakPolarHBondContact O-CG 3.3Å
230L53.2Low59.7Low86 Ų8672.1 Ų72.145%0.4540%0.397SS..Hα-helixtrans-73.3-35.1176.3-84.9150000112.3S226 S227 R279S226-L230 PolarHBondContact O-N 2.92Å; S227-L230 PolarHBondContact O-N 3.5Å; L230-R279 PolarHBondContact O-NH1 2.93Å
231L57.1Low61.5Low7 Ų771.1 Ų71.14%0.03739%0.388CS..Hα-helixtrans-72.2-31177.6-66.1170.7000112.8L222 S227 A228 R279 Q339 Y342L222-L231 HydrophobicContact CD1-CD1 3.69Å; S227-L231 WeakPolarHBondContact O-CG 3.34Å; S227-L231 PolarHBondContact O-N 2.98Å; S227-L231 VanDerWaalsContact O-N 3.17Å; A228-L231 PolarHBondContact O-N 3.34Å; L231-R279 PolarHBondContact O-NH1 3.07Å; L231-R279 VanDerWaalsContact O-NH1 3.08Å; L231-Q339 VanDerWaalsContact CD2-CD 3.48Å; L231-Q339 VanDerWaalsContact CD2-NE2 3.33Å; L231-Q339 VanDerWaalsContact CD2-OE1 3.28Å; L231-Y342 HydrophobicContact CB-CD2 4.11Å; L231-Y342 HydrophobicContact CB-CE2 4.27Å; L231-Y342 VanDerWaalsContact O-CE2 3.22Å; L231-Y342 WeakPolarHBondContact O-CE2 3.32Å; L231-Y342 VanDerWaalsContact O-CZ 3.27Å; L231-Y342 PolarHBondContact O-OH 3.38Å; L231-Y342 VanDerWaalsContact O-OH 3.14Å
232N56.5Low63.4Low87 Ų8768.1 Ų68.147%0.46537%0.373SS..THydrogen-bonded Turntrans-94.312.8-176.5-74.8-7000115D216 A228D216-N232 PolarHBondContact OD2-ND2 3.14Å; A228-N232 WeakPolarHBondContact O-CB 3.48Å; A228-N232 PolarHBondContact O-N 2.75Å; A228-N232 VanDerWaalsContact O-N 3.12Å
233Q64.6Low65.1Low66 Ų6668 Ų6831%0.30837%0.372SS..PPolyproline II helixtrans-65.9136.8172.7-67.8-173.4-4.300111.4K229K229-Q233 WeakPolarHBondContact O-CG 3.3Å
234P66.4Low67.3Low88 Ų8862.9 Ų62.957%0.57135%0.345SS*.PPolyproline II helixtrans-65.4140.8176.928.1-33.1000110.2
235I76.9Confident69.5Low12 Ų1262 Ų626%0.06234%0.338CS..PPolyproline II helixtrans-62.4124.8175.7-58.8167.8000108.1R279 F280 D283I235-R279 HydrophobicContact CD1-CB 4.08Å; I235-R279 VanDerWaalsContact CD1-O 3.25Å; I235-R279 WeakPolarHBondContact CD1-O 3.4Å; I235-R279 HydrophobicContact CG1-CB 4.2Å; I235-F280 HydrophobicContact CG2-CD1 3.67Å; I235-F280 HydrophobicContact CG2-CD2 4.15Å; I235-F280 HydrophobicContact CG2-CE1 3.44Å; I235-F280 VanDerWaalsContact CG2-CE1 3.44Å; I235-F280 HydrophobicContact CG2-CE2 3.98Å; I235-F280 HydrophobicContact CG2-CG 4.02Å; I235-F280 HydrophobicContact CG2-CZ 3.61Å; I235-D283 HydrophobicContact CD1-CB 3.79Å
236P79.6Confident72Confident9 Ų957 Ų576%0.05831%0.305CS..PPolyproline II helixtrans-69.1153-178.626.8-32000111.7W195 H198 L238 F280W195-P236 HydrophobicContact CD2-CG 4.01Å; W195-P236 HydrophobicContact CE3-CG 3.8Å; W195-P236 HydrophobicContact CH2-CG 4.28Å; W195-P236 HydrophobicContact CZ2-CG 4.47Å; W195-P236 HydrophobicContact CZ3-CG 3.96Å; H198-P236 HydrophobicContact CB-CB 3.68Å; P236-L238 HydrophobicContact CB-CD2 4.44Å; P236-L238 HydrophobicContact CG-CD2 4.34Å; P236-F280 HydrophobicContact CG-CZ 4.16Å
237I78Confident74.3Confident122 Ų12253.6 Ų53.663%0.62628%0.281SS*.  trans-91.4111.4172.3-59.2173.1000107.5H198H198-I237 PolarHBondContact CD2-O 3.02Å
238L82.6Confident76.6Confident7 Ų752.4 Ų52.44%0.03727%0.272CS..  trans-88.7146.7179-55.2-179.1000111V194 H198 P236 F277 F280 L308V194-L238 HydrophobicContact CG1-CD2 3.9Å; H198-L238 HydrophobicContact CB-CD2 3.95Å; P236-L238 HydrophobicContact CB-CD2 4.44Å; P236-L238 HydrophobicContact CG-CD2 4.34Å; L238-F277 HydrophobicContact CD1-CE1 4.32Å; L238-F280 HydrophobicContact CD1-CE1 4.15Å; L238-F280 HydrophobicContact CD1-CE2 4.34Å; L238-F280 HydrophobicContact CD1-CZ 3.65Å; L238-F280 HydrophobicContact CG-CE1 4.28Å; L238-F280 HydrophobicContact CG-CZ 3.91Å; L238-L308 HydrophobicContact CD1-CD1 3.73Å
239D84.1Confident78.9Confident68 Ų6851.3 Ų51.336%0.36426%0.263SS..  trans-81.4161.3164.767.3-44.8000111.2H198 E241 S242 E243H198-D239 IonicContact CE1-OD1 2.98Å; H198-D239 IonicContact NE2-OD1 2.98Å; H198-D239 PolarHBondContact NE2-OD1 2.8Å; D239-E241 PolarHBondContact O-N 3.12Å; D239-S242 PolarHBondContact O-N 3.42Å; D239-S242 VanDerWaalsContact O-N 3.15Å; D239-S242 WeakPolarHBondContact OD1-CB 3.33Å; D239-S242 PolarHBondContact OD1-OG 3.18Å; D239-E243 WeakPolarHBondContact O-CB 3.49Å; D239-E243 PolarHBondContact O-N 3.31Å
240V83.8Confident81Confident109 Ų10943.8 Ų43.866%0.66123%0.23SC*.Hα-helixtrans-57.1-36.6-173.4-179.30000112.2Y244V240-Y244 WeakPolarHBondContact O-CB 3.34Å; V240-Y244 PolarHBondContact O-N 2.92Å
241E85.4Confident83Confident116 Ų11641.3 Ų41.354%0.54222%0.216SC..Hα-helixtrans-68.7-46.8178.8-173.2173.2-166.700111.7D239 E243 Y244 I245D239-E241 PolarHBondContact O-N 3.12Å; E241-E243 VanDerWaalsContact C-N 3.33Å; E241-E243 PolarHBondContact O-N 3.4Å; E241-Y244 PolarHBondContact O-N 2.69Å; E241-I245 HydrophobicContact CG-CD1 4.18Å; E241-I245 WeakPolarHBondContact O-CG1 3.24Å; E241-I245 PolarHBondContact O-N 3.38Å
242S88.9Confident84.8Confident9 Ų941 Ų416%0.06322%0.215CC..Hα-helixtrans-63.8-38.2176.3-63.80000112.5H198 D239 I245 C246H198-S242 PolarHBondContact CE1-OG 2.92Å; H198-S242 VanDerWaalsContact CE1-OG 3.28Å; D239-S242 PolarHBondContact O-N 3.42Å; D239-S242 VanDerWaalsContact O-N 3.15Å; D239-S242 WeakPolarHBondContact OD1-CB 3.33Å; D239-S242 PolarHBondContact OD1-OG 3.18Å; S242-I245 PolarHBondContact O-N 3.49Å; S242-C246 WeakPolarHBondContact O-CB 3.47Å; S242-C246 PolarHBondContact O-N 3.07Å; S242-C246 PolarHBondContact O-SG 3.24Å
243E88.2Confident86.6Confident15 Ų1536.9 Ų36.97%0.0719%0.193CC..Hα-helixtrans-63.7-42.8175.8178.9165.1-174.400111.9D239 E241 C246 S247 R305 L308D239-E243 WeakPolarHBondContact O-CB 3.49Å; D239-E243 PolarHBondContact O-N 3.31Å; E241-E243 VanDerWaalsContact C-N 3.33Å; E241-E243 PolarHBondContact O-N 3.4Å; E243-C246 PolarHBondContact O-N 3.48Å; E243-S247 WeakPolarHBondContact O-CB 3.35Å; E243-S247 PolarHBondContact O-N 3.48Å; E243-S247 PolarHBondContact O-OG 3.18Å; E243-R305 VanDerWaalsContact OE1-CA 3.26Å; E243-R305 WeakPolarHBondContact OE1-CA 3.46Å; E243-R305 PolarHBondContact OE1-N 3.31Å; E243-R305 VanDerWaalsContact OE1-N 3.13Å; E243-L308 HydrophobicContact CG-CD1 4.02Å; E243-L308 HydrophobicContact CG-CG 4.26Å
244Y89.6Confident88Confident84 Ų8434.8 Ų34.833%0.32919%0.186SC..Hα-helixtrans-63.4-43.7174.8-177.5-120.1000112.3R107 P144 V240 E241 S247 L248R107-Y244 PolarHBondContact NH2-OH 3.17Å; P144-Y244 HydrophobicContact CB-CD1 4.23Å; P144-Y244 HydrophobicContact CB-CE1 3.91Å; V240-Y244 WeakPolarHBondContact O-CB 3.34Å; V240-Y244 PolarHBondContact O-N 2.92Å; E241-Y244 PolarHBondContact O-N 2.69Å; Y244-S247 WeakPolarHBondContact O-CB 3.37Å; Y244-S247 PolarHBondContact O-N 3.31Å; Y244-L248 HydrophobicContact CD1-CD1 4.13Å; Y244-L248 HydrophobicContact CE1-CD1 3.69Å; Y244-L248 HydrophobicContact CE2-CD1 4.26Å; Y244-L248 HydrophobicContact CE2-CG 4.32Å; Y244-L248 WeakPolarHBondContact O-CG 3.14Å; Y244-L248 PolarHBondContact O-N 3.03Å
245I92.1Very high89.2Confident18 Ų1832.7 Ų32.79%0.09217%0.169CC..Hα-helixtrans-62.3-46.5177.1-70.2167.6000111.1T143 P144 L147 I190 E241 S242 S247 L248 A249T143-I245 HydrophobicContact CG2-CG2 4.16Å; P144-I245 HydrophobicContact CG-CD1 4.28Å; P144-I245 HydrophobicContact CG-CG1 3.9Å; L147-I245 HydrophobicContact CD1-CG2 4.05Å; I190-I245 HydrophobicContact CG2-CG2 3.6Å; E241-I245 HydrophobicContact CG-CD1 4.18Å; E241-I245 WeakPolarHBondContact O-CG1 3.24Å; E241-I245 PolarHBondContact O-N 3.38Å; S242-I245 PolarHBondContact O-N 3.49Å; I245-S247 VanDerWaalsContact C-N 3.32Å; I245-S247 PolarHBondContact O-N 2.79Å; I245-L248 PolarHBondContact O-N 3.35Å; I245-A249 PolarHBondContact O-N 3.37Å
246C93.6Very high90Very high0 Ų032.6 Ų32.60%017%0.168CC..Hα-helixtrans-63.5-39178.2-66.50000111.8L191 V194 S242 E243 A249 L250 F277 L308L191-C246 HydrophobicContact CD2-CB 3.89Å; V194-C246 VanDerWaalsContact CG1-SG 3.56Å; S242-C246 WeakPolarHBondContact O-CB 3.47Å; S242-C246 PolarHBondContact O-N 3.07Å; S242-C246 PolarHBondContact O-SG 3.24Å; E243-C246 PolarHBondContact O-N 3.48Å; C246-A249 PolarHBondContact O-N 2.9Å; C246-L250 WeakPolarHBondContact O-CB 3.38Å; C246-L250 WeakPolarHBondContact O-CG 3.34Å; C246-L250 PolarHBondContact O-N 3.17Å; C246-F277 HydrophobicContact CB-CD1 4.42Å; C246-F277 HydrophobicContact CB-CE1 3.72Å; C246-F277 HydrophobicContact CB-CZ 4.3Å; C246-F277 VanDerWaalsContact SG-CE1 3.55Å; C246-L308 HydrophobicContact CB-CD2 3.8Å
247S93.8Very high90.5Very high4 Ų432.1 Ų32.13%0.02817%0.166CC..Hα-helixtrans-59-48.6175.4-60.50000111.3E243 Y244 I245 A249 L250 E251 L308E243-S247 WeakPolarHBondContact O-CB 3.35Å; E243-S247 PolarHBondContact O-N 3.48Å; E243-S247 PolarHBondContact O-OG 3.18Å; Y244-S247 WeakPolarHBondContact O-CB 3.37Å; Y244-S247 PolarHBondContact O-N 3.31Å; I245-S247 VanDerWaalsContact C-N 3.32Å; I245-S247 PolarHBondContact O-N 2.79Å; S247-A249 PolarHBondContact O-N 3.29Å; S247-L250 PolarHBondContact O-N 3.11Å; S247-E251 WeakPolarHBondContact O-CB 3.47Å; S247-E251 VanDerWaalsContact O-CG 3.32Å; S247-E251 WeakPolarHBondContact O-CG 3.36Å; S247-E251 PolarHBondContact O-N 3Å; S247-L308 WeakPolarHBondContact OG-CD2 3.38Å
248L94Very high91.1Very high12 Ų1228.7 Ų28.76%0.06315%0.152CC..Hα-helixtrans-62.8-40.8177.3-70.8172.8000112.3P144 L147 I148 Y244 I245 E251 C252P144-L248 HydrophobicContact CB-CD1 4.06Å; L147-L248 HydrophobicContact CB-CB 3.95Å; L147-L248 HydrophobicContact CB-CD1 4.37Å; L147-L248 HydrophobicContact CD1-CB 3.93Å; I148-L248 HydrophobicContact CD1-CD1 4.34Å; I148-L248 HydrophobicContact CG1-CD1 4.02Å; I148-L248 HydrophobicContact CG1-CD2 3.86Å; Y244-L248 HydrophobicContact CD1-CD1 4.13Å; Y244-L248 HydrophobicContact CE1-CD1 3.69Å; Y244-L248 HydrophobicContact CE2-CD1 4.26Å; Y244-L248 HydrophobicContact CE2-CG 4.32Å; Y244-L248 WeakPolarHBondContact O-CG 3.14Å; Y244-L248 PolarHBondContact O-N 3.03Å; I245-L248 PolarHBondContact O-N 3.35Å; L248-E251 PolarHBondContact O-N 3.15Å; L248-C252 PolarHBondContact O-N 3.42Å; L248-C252 PolarHBondContact O-SG 3.47Å
249A96.3Very high91.4Very high0 Ų029.1 Ų29.10%015%0.153CC..Hα-helixtrans-65.1-42.8178.600000112.1L147 L187 L191 I245 C246 S247 C252 L253L147-A249 HydrophobicContact CD1-CB 4.34Å; L187-A249 HydrophobicContact CD2-CB 4.13Å; L191-A249 HydrophobicContact CD2-CB 4Å; L191-A249 HydrophobicContact CG-CB 4.18Å; I245-A249 PolarHBondContact O-N 3.37Å; C246-A249 PolarHBondContact O-N 2.9Å; S247-A249 PolarHBondContact O-N 3.29Å; A249-C252 WeakPolarHBondContact O-CB 3.27Å; A249-C252 PolarHBondContact O-N 3.38Å; A249-L253 WeakPolarHBondContact O-CG 3.4Å; A249-L253 PolarHBondContact O-N 3.46Å
250L96Very high91.7Very high0 Ų026.1 Ų26.10%014%0.137CC..Hα-helixtrans-66.7-40.6175.3-69.4169.7000111.8L191 C246 S247 C252 L253 A254 F277 L308 L311 A312 C315L191-L250 HydrophobicContact CD1-CD2 4.03Å; L191-L250 HydrophobicContact CD2-CG 4.38Å; C246-L250 WeakPolarHBondContact O-CB 3.38Å; C246-L250 WeakPolarHBondContact O-CG 3.34Å; C246-L250 PolarHBondContact O-N 3.17Å; S247-L250 PolarHBondContact O-N 3.11Å; L250-C252 VanDerWaalsContact C-N 3.3Å; L250-C252 PolarHBondContact O-N 3.37Å; L250-L253 HydrophobicContact CD2-CD1 4.4Å; L250-L253 PolarHBondContact O-N 3.39Å; L250-A254 PolarHBondContact O-N 3.18Å; L250-F277 HydrophobicContact CD1-CB 4.28Å; L250-F277 HydrophobicContact CD1-CD1 4.4Å; L250-F277 HydrophobicContact CD1-CG 4.48Å; L250-L308 HydrophobicContact CD1-CD2 4.15Å; L250-L311 HydrophobicContact CB-CB 3.95Å; L250-L311 HydrophobicContact CD1-CB 4.06Å; L250-A312 HydrophobicContact CD1-CB 4.22Å; L250-A312 HydrophobicContact CD2-CB 4.31Å; L250-C315 PolarHBondContact O-SG 2.79Å
251E95.1Very high91.9Very high34 Ų3424.1 Ų24.116%0.15913%0.127CC..Hα-helixtrans-61-38.8173.7-74.8178-16200112.1K151 S247 L248 H255 R307 L311K151-E251 HydrophobicContact CD-CB 4.18Å; K151-E251 IonicContact NZ-OE2 2.57Å; K151-E251 PolarHBondContact NZ-OE2 3.21Å; S247-E251 WeakPolarHBondContact O-CB 3.47Å; S247-E251 VanDerWaalsContact O-CG 3.32Å; S247-E251 WeakPolarHBondContact O-CG 3.36Å; S247-E251 PolarHBondContact O-N 3Å; L248-E251 PolarHBondContact O-N 3.15Å; E251-H255 PolarHBondContact O-N 3.35Å; E251-H255 VanDerWaalsContact O-N 3.17Å; E251-R307 IonicContact OE1-CZ 3.63Å; E251-R307 IonicContact OE1-NH2 3.4Å; E251-R307 PolarHBondContact OE1-NH2 3.36Å; E251-L311 HydrophobicContact CG-CD1 4.18Å; E251-L311 HydrophobicContact CG-CD2 3.73Å
252C95.1Very high91.7Very high2 Ų219 Ų191%0.01410%0.103CC..Hα-helixtrans-62.2-47.2172.6-670000111.4L147 L187 L248 A249 L250 H255 L256L147-C252 PolarHBondContact O-SG 2.87Å; L187-C252 HydrophobicContact CD1-CB 3.81Å; L187-C252 HydrophobicContact CD2-CB 4.11Å; L248-C252 PolarHBondContact O-N 3.42Å; L248-C252 PolarHBondContact O-SG 3.47Å; A249-C252 WeakPolarHBondContact O-CB 3.27Å; A249-C252 PolarHBondContact O-N 3.38Å; L250-C252 VanDerWaalsContact C-N 3.3Å; L250-C252 PolarHBondContact O-N 3.37Å; C252-H255 PolarHBondContact O-N 2.87Å; C252-L256 WeakPolarHBondContact O-CB 3.26Å; C252-L256 VanDerWaalsContact O-CG 3.22Å; C252-L256 WeakPolarHBondContact O-CG 3.49Å; C252-L256 PolarHBondContact O-N 3.13Å
253L94.9Very high91.1Very high0 Ų021.5 Ų21.50%012%0.12CC..Hα-helixtrans-60.7-47.1179.4-74.3171.4000111.9L184 L187 L191 A249 L250 H255 L256 F257 L270 I274L184-L253 HydrophobicContact CD2-CD2 3.6Å; L187-L253 HydrophobicContact CB-CD2 4.03Å; L187-L253 HydrophobicContact CB-CG 4.22Å; L187-L253 HydrophobicContact CD1-CD2 3.75Å; L187-L253 HydrophobicContact CD1-CG 3.95Å; L191-L253 HydrophobicContact CD1-CD1 3.78Å; A249-L253 WeakPolarHBondContact O-CG 3.4Å; A249-L253 PolarHBondContact O-N 3.46Å; L250-L253 HydrophobicContact CD2-CD1 4.4Å; L250-L253 PolarHBondContact O-N 3.39Å; L253-H255 PolarHBondContact O-N 3.42Å; L253-L256 PolarHBondContact O-N 2.95Å; L253-F257 HydrophobicContact CB-CE2 4.48Å; L253-F257 HydrophobicContact CD2-CZ 4.34Å; L253-F257 WeakPolarHBondContact O-CB 3.39Å; L253-F257 VanDerWaalsContact O-CG 3.24Å; L253-F257 WeakPolarHBondContact O-CG 3.38Å; L253-F257 PolarHBondContact O-N 3.03Å; L253-L270 HydrophobicContact CD1-CD1 3.86Å; L253-L270 HydrophobicContact CD2-CD1 3.95Å; L253-L270 HydrophobicContact CD2-CD2 4.43Å; L253-I274 HydrophobicContact CD1-CD1 4.39Å; L253-I274 HydrophobicContact CD1-CG1 4.28Å
254A92.8Very high90.4Very high21 Ų2123.8 Ų23.817%0.17414%0.142CC..Hα-helixtrans-56.2-49.2177.500000111.4L250 F257 S258L250-A254 PolarHBondContact O-N 3.18Å; A254-F257 PolarHBondContact O-N 3.39Å; A254-S258 PolarHBondContact O-N 3.43Å
255H92.6Very high89.9Confident45 Ų4520.1 Ų20.121%0.20813%0.129CC..Hα-helixtrans-66.3-41179-171.8-89.8000112.3S154 E155 E251 C252 L253 F257 S258 W259S154-H255 PolarHBondContact O-CE1 3.23Å; S154-H255 PolarHBondContact OG-CE1 3.28Å; S154-H255 PolarHBondContact OG-ND1 2.8Å; E155-H255 VanDerWaalsContact CA-CE1 3.43Å; E155-H255 WeakPolarHBondContact CA-CE1 3.32Å; E155-H255 PolarHBondContact N-CE1 3.38Å; E251-H255 PolarHBondContact O-N 3.35Å; E251-H255 VanDerWaalsContact O-N 3.17Å; C252-H255 PolarHBondContact O-N 2.87Å; L253-H255 PolarHBondContact O-N 3.42Å; H255-F257 VanDerWaalsContact C-N 3.34Å; H255-F257 PolarHBondContact O-N 3.42Å; H255-S258 WeakPolarHBondContact O-CB 3.5Å; H255-S258 PolarHBondContact O-N 3.35Å; H255-S258 PolarHBondContact O-OG 3.21Å; H255-W259 AromaticContact ND1-NE1 3.91Å
256L92.9Very high89.4Confident9 Ų920 Ų205%0.04713%0.128CC..Hα-helixtrans-58.8-45.5175-73.4169.1000111.6V183 L184 L187 C252 L253 S258 W259 I260V183-L256 HydrophobicContact CG1-CD1 3.73Å; L184-L256 HydrophobicContact CD2-CD1 4.22Å; L187-L256 HydrophobicContact CD1-CD1 3.72Å; C252-L256 WeakPolarHBondContact O-CB 3.26Å; C252-L256 VanDerWaalsContact O-CG 3.22Å; C252-L256 WeakPolarHBondContact O-CG 3.49Å; C252-L256 PolarHBondContact O-N 3.13Å; L253-L256 PolarHBondContact O-N 2.95Å; L256-S258 PolarHBondContact O-N 2.88Å; L256-S258 VanDerWaalsContact O-N 3.17Å; L256-W259 HydrophobicContact CD2-CZ2 3.57Å; L256-W259 PolarHBondContact O-N 3.28Å; L256-I260 WeakPolarHBondContact O-CG1 3.48Å; L256-I260 WeakPolarHBondContact O-CG2 3.42Å; L256-I260 PolarHBondContact O-N 3.34Å; L256-I260 VanDerWaalsContact O-N 3.08Å
257F91.4Very high88.9Confident0 Ų022.6 Ų22.60%014%0.144CC..Hα-helixtrans-60.5-26.1179.2-67.9-17.2000113.4L184 L253 A254 H255 W259 I260 L262 L270 I274 C315 E318 L319 K322L184-F257 HydrophobicContact CD2-CE1 4.2Å; L253-F257 HydrophobicContact CB-CE2 4.48Å; L253-F257 HydrophobicContact CD2-CZ 4.34Å; L253-F257 WeakPolarHBondContact O-CB 3.39Å; L253-F257 VanDerWaalsContact O-CG 3.24Å; L253-F257 WeakPolarHBondContact O-CG 3.38Å; L253-F257 PolarHBondContact O-N 3.03Å; A254-F257 PolarHBondContact O-N 3.39Å; H255-F257 VanDerWaalsContact C-N 3.34Å; H255-F257 PolarHBondContact O-N 3.42Å; F257-W259 VanDerWaalsContact C-N 3.27Å; F257-W259 PolarHBondContact O-N 2.72Å; F257-I260 HydrophobicContact CD1-CD1 3.94Å; F257-I260 HydrophobicContact CE1-CD1 4.38Å; F257-L262 HydrophobicContact CB-CD2 4.25Å; F257-L262 HydrophobicContact CD1-CD2 3.61Å; F257-L262 HydrophobicContact CE1-CD2 4.24Å; F257-L262 HydrophobicContact CG-CD2 4.11Å; F257-L270 HydrophobicContact CE1-CD2 4.17Å; F257-L270 HydrophobicContact CZ-CD2 3.89Å; F257-L270 HydrophobicContact CZ-CG 4.43Å; F257-I274 HydrophobicContact CE2-CD1 3.74Å; F257-I274 HydrophobicContact CZ-CD1 3.93Å; F257-C315 HydrophobicContact CD2-CB 4.36Å; F257-C315 HydrophobicContact CE2-CB 4.21Å; F257-E318 HydrophobicContact CB-CB 4.01Å; F257-L319 HydrophobicContact CD2-CB 4.31Å; F257-L319 HydrophobicContact CE2-CB 4.47Å; F257-L319 HydrophobicContact CE2-CD1 4.22Å; F257-L319 HydrophobicContact CZ-CD1 4.36Å; F257-K322 WeakPolarHBondContact O-CE 3.28Å; F257-K322 PolarHBondContact O-NZ 2.95Å
258S90.3Very high88.2Confident49 Ų4923.2 Ų23.234%0.34315%0.148SC..Hα-helixtrans-62.2-28.7177.377.30000113.7A254 H255 L256 K322A254-S258 PolarHBondContact O-N 3.43Å; H255-S258 WeakPolarHBondContact O-CB 3.5Å; H255-S258 PolarHBondContact O-N 3.35Å; H255-S258 PolarHBondContact O-OG 3.21Å; L256-S258 PolarHBondContact O-N 2.88Å; L256-S258 VanDerWaalsContact O-N 3.17Å; S258-K322 PolarHBondContact O-NZ 3.07Å
259W89.4Confident87.6Confident17 Ų1725 Ų256%0.06416%0.161CC..Hα-helixtrans-128.7-18.2-172.765.3-95.1000116.2S154 A158 R173 L176 L177 V180 H255 L256 F257S154-W259 PolarHBondContact OG-NE1 3.33Å; A158-W259 HydrophobicContact CB-CD2 3.54Å; A158-W259 HydrophobicContact CB-CE3 4.01Å; A158-W259 HydrophobicContact CB-CG 3.92Å; A158-W259 HydrophobicContact CB-CH2 4.21Å; A158-W259 HydrophobicContact CB-CZ2 3.73Å; A158-W259 HydrophobicContact CB-CZ3 4.32Å; R173-W259 PolarHBondContact NH2-O 3.31Å; L176-W259 HydrophobicContact CB-CH2 3.85Å; L176-W259 HydrophobicContact CB-CZ3 4.5Å; L176-W259 HydrophobicContact CD1-CH2 4.32Å; L176-W259 HydrophobicContact CD1-CZ2 4.45Å; L177-W259 HydrophobicContact CD2-CE3 4.47Å; L177-W259 HydrophobicContact CD2-CZ3 3.76Å; L177-W259 HydrophobicContact CG-CZ3 4.13Å; V180-W259 HydrophobicContact CG2-CH2 3.99Å; V180-W259 HydrophobicContact CG2-CZ3 4.5Å; H255-W259 AromaticContact ND1-NE1 3.91Å; L256-W259 HydrophobicContact CD2-CZ2 3.57Å; L256-W259 PolarHBondContact O-N 3.28Å; F257-W259 VanDerWaalsContact C-N 3.27Å; F257-W259 PolarHBondContact O-N 2.72Å
260I90.4Very high87.2Confident4 Ų425 Ų252%0.02116%0.161CC..SBendtrans-74.3153.8-179.469.7176.8000112.9V180 L184 L256 F257 L262V180-I260 HydrophobicContact CG1-CB 4.49Å; V180-I260 HydrophobicContact CG1-CD1 3.98Å; V180-I260 HydrophobicContact CG1-CG2 4.12Å; V180-I260 HydrophobicContact CG2-CG2 3.71Å; L184-I260 HydrophobicContact CD1-CD1 4.1Å; L256-I260 WeakPolarHBondContact O-CG1 3.48Å; L256-I260 WeakPolarHBondContact O-CG2 3.42Å; L256-I260 PolarHBondContact O-N 3.34Å; L256-I260 VanDerWaalsContact O-N 3.08Å; F257-I260 HydrophobicContact CD1-CD1 3.94Å; F257-I260 HydrophobicContact CE1-CD1 4.38Å; I260-L262 HydrophobicContact CD1-CD2 3.93Å; I260-L262 HydrophobicContact CG1-CD2 3.7Å; I260-L262 HydrophobicContact CG1-CG 4.49Å; I260-L262 PolarHBondContact O-N 3.27Å; I260-L262 VanDerWaalsContact O-N 3.15Å
261P86.7Confident86.8Confident68 Ų6825.1 Ų25.144%0.44216%0.162SC..  trans-7399.9167.929.6-33.3000110.7L177 S263 S265L177-P261 HydrophobicContact CD2-CG 3.99Å; P261-S263 PolarHBondContact O-N 2.92Å; P261-S265 WeakPolarHBondContact O-CB 3.18Å; P261-S265 PolarHBondContact O-OG 2.93Å
262L81.8Confident86.3Confident8 Ų824.6 Ų24.64%0.04216%0.161CC..G310 helixtrans-65.8-32.1-172-70.9-176.5000114.9F257 I260 A264 S265 I266 K322 C324F257-L262 HydrophobicContact CB-CD2 4.25Å; F257-L262 HydrophobicContact CD1-CD2 3.61Å; F257-L262 HydrophobicContact CE1-CD2 4.24Å; F257-L262 HydrophobicContact CG-CD2 4.11Å; I260-L262 HydrophobicContact CD1-CD2 3.93Å; I260-L262 HydrophobicContact CG1-CD2 3.7Å; I260-L262 HydrophobicContact CG1-CG 4.49Å; I260-L262 PolarHBondContact O-N 3.27Å; I260-L262 VanDerWaalsContact O-N 3.15Å; L262-A264 PolarHBondContact O-N 3.32Å; L262-S265 PolarHBondContact O-N 2.91Å; L262-I266 HydrophobicContact CB-CD1 3.66Å; L262-I266 HydrophobicContact CB-CG1 4.21Å; L262-I266 HydrophobicContact CD1-CD1 4.09Å; L262-I266 HydrophobicContact CD2-CD1 3.91Å; L262-I266 HydrophobicContact CD2-CG1 4Å; L262-I266 HydrophobicContact CG-CD1 4.1Å; L262-I266 PolarHBondContact O-N 2.82Å; L262-I266 VanDerWaalsContact O-N 3.13Å; L262-K322 HydrophobicContact CD1-CB 3.86Å; L262-K322 HydrophobicContact CD1-CD 3.57Å; L262-K322 HydrophobicContact CD1-CG 4.14Å; L262-K322 HydrophobicContact CG-CD 4.11Å; L262-C324 VanDerWaalsContact C-SG 3.54Å; L262-C324 HydrophobicContact CB-CB 4.21Å
263S76.5Confident86Confident61 Ų6124.8 Ų24.843%0.42716%0.162SC..G310 helixtrans-61.4-29.8-173.251.60000114.2P261 C324P261-S263 PolarHBondContact O-N 2.92Å; S263-C324 WeakPolarHBondContact CA-SG 3.32Å; S263-C324 PolarHBondContact N-SG 2.86Å; S263-C324 VanDerWaalsContact N-SG 3.41Å
264A73Confident85.9Confident63 Ų6324.9 Ų24.952%0.52116%0.162SC..G310 helixtrans-100-4.6177.600000113.5Q181 L262Q181-A264 PolarHBondContact NE2-O 3.42Å; L262-A264 PolarHBondContact O-N 3.32Å
265S79.8Confident85.7Confident8 Ų823.9 Ų23.96%0.05615%0.154CC..THydrogen-bonded Turntrans-117.2-23.2-165.6-49.10000114.9L184 P261 L262L184-S265 VanDerWaalsContact CD1-O 3.31Å; L184-S265 WeakPolarHBondContact CD1-O 3.5Å; P261-S265 WeakPolarHBondContact O-CB 3.18Å; P261-S265 PolarHBondContact O-OG 2.93Å; L262-S265 PolarHBondContact O-N 2.91Å
266I81.7Confident85.5Confident16 Ų1622.4 Ų22.48%0.08215%0.147CC..  trans-83.6128.4-179.4-62.2165.1000110.4L262 L319 Y332L262-I266 HydrophobicContact CB-CD1 3.66Å; L262-I266 HydrophobicContact CB-CG1 4.21Å; L262-I266 HydrophobicContact CD1-CD1 4.09Å; L262-I266 HydrophobicContact CD2-CD1 3.91Å; L262-I266 HydrophobicContact CD2-CG1 4Å; L262-I266 HydrophobicContact CG-CD1 4.1Å; L262-I266 PolarHBondContact O-N 2.82Å; L262-I266 VanDerWaalsContact O-N 3.13Å; I266-L319 HydrophobicContact CD1-CD1 3.45Å; I266-L319 VanDerWaalsContact CD1-CD1 3.45Å; I266-L319 HydrophobicContact CD1-CG 3.77Å; I266-L319 HydrophobicContact CG1-CD1 3.99Å; I266-L319 HydrophobicContact CG2-CD1 4.14Å; I266-Y332 HydrophobicContact CG2-CD2 4.38Å; I266-Y332 HydrophobicContact CG2-CE2 4.2Å
267T82.1Confident85.4Confident53 Ų5322 Ų2233%0.32515%0.145SC..  trans-102.1151.8169.663.80000111.3S269 L270 L271T267-S269 PolarHBondContact O-N 3.01Å; T267-S269 PolarHBondContact OG1-OG 2.89Å; T267-S269 VanDerWaalsContact OG1-OG 3.07Å; T267-L270 PolarHBondContact O-N 3.08Å; T267-L270 WeakPolarHBondContact OG1-CB 3.33Å; T267-L270 PolarHBondContact OG1-N 3.14Å; T267-L271 PolarHBondContact O-N 3.38Å
268P78.9Confident85.3Confident18 Ų1822 Ų2212%0.11715%0.145CC..Hα-helixtrans-60-31174.4-24.533.4000113.8T272 E328 R335P268-T272 WeakPolarHBondContact O-CB 3.18Å; P268-T272 PolarHBondContact O-N 2.76Å; P268-T272 VanDerWaalsContact O-N 3.09Å; P268-T272 PolarHBondContact O-OG1 3.17Å; P268-E328 WeakPolarHBondContact CD-OE2 3.35Å; P268-E328 WeakPolarHBondContact CG-OE2 3.24Å; P268-R335 PolarHBondContact O-NH1 3.16Å
269S82.9Confident85.2Confident50 Ų5019.7 Ų19.735%0.3513%0.129SC..Hα-helixtrans-65.4-51.6177.156.70000111.8T267 L271 T272 T273T267-S269 PolarHBondContact O-N 3.01Å; T267-S269 PolarHBondContact OG1-OG 2.89Å; T267-S269 VanDerWaalsContact OG1-OG 3.07Å; S269-L271 VanDerWaalsContact C-N 3.27Å; S269-L271 PolarHBondContact O-N 3.42Å; S269-T272 WeakPolarHBondContact O-CB 3.29Å; S269-T272 PolarHBondContact O-N 3.05Å; S269-T273 PolarHBondContact O-N 3.49Å; S269-T273 PolarHBondContact O-OG1 3.41Å
270L87.9Confident85.1Confident0 Ų019.5 Ų19.50%013%0.129CC..Hα-helixtrans-54.4-45.5176.6171.657.5000111.3L184 T188 L253 F257 T267 T272 T273 I274L184-L270 HydrophobicContact CD2-CD2 4.15Å; T188-L270 HydrophobicContact CG2-CB 4.3Å; T188-L270 WeakPolarHBondContact OG1-CD1 3.48Å; L253-L270 HydrophobicContact CD1-CD1 3.86Å; L253-L270 HydrophobicContact CD2-CD1 3.95Å; L253-L270 HydrophobicContact CD2-CD2 4.43Å; F257-L270 HydrophobicContact CE1-CD2 4.17Å; F257-L270 HydrophobicContact CZ-CD2 3.89Å; F257-L270 HydrophobicContact CZ-CG 4.43Å; T267-L270 PolarHBondContact O-N 3.08Å; T267-L270 WeakPolarHBondContact OG1-CB 3.33Å; T267-L270 PolarHBondContact OG1-N 3.14Å; L270-T272 VanDerWaalsContact C-N 3.33Å; L270-T272 PolarHBondContact O-N 2.78Å; L270-T273 PolarHBondContact O-N 3.47Å; L270-I274 HydrophobicContact CD1-CD1 3.75Å; L270-I274 HydrophobicContact CD1-CG1 4.03Å; L270-I274 HydrophobicContact CG-CD1 3.99Å; L270-I274 WeakPolarHBondContact O-CG1 3.34Å; L270-I274 PolarHBondContact O-N 3.15Å
271L86.4Confident84.8Confident1 Ų119.6 Ų19.61%0.00513%0.131CC..Hα-helixtrans-58.6-46.8177.3-17467000111.8T267 S269 T273 I274 F275 L319 Y332 R335 M336T267-L271 PolarHBondContact O-N 3.38Å; S269-L271 VanDerWaalsContact C-N 3.27Å; S269-L271 PolarHBondContact O-N 3.42Å; L271-T273 VanDerWaalsContact C-N 3.32Å; L271-T273 PolarHBondContact O-N 2.55Å; L271-I274 PolarHBondContact O-N 3.24Å; L271-F275 HydrophobicContact CD1-CD2 4.05Å; L271-F275 HydrophobicContact CD1-CE2 3.66Å; L271-F275 HydrophobicContact CD2-CE2 4.38Å; L271-F275 HydrophobicContact CG-CD2 3.91Å; L271-F275 HydrophobicContact CG-CE2 3.83Å; L271-F275 VanDerWaalsContact O-CD2 3.24Å; L271-F275 WeakPolarHBondContact O-CD2 3.45Å; L271-F275 PolarHBondContact O-N 2.93Å; L271-L319 HydrophobicContact CD1-CD1 4.03Å; L271-L319 HydrophobicContact CD1-CD2 3.97Å; L271-Y332 HydrophobicContact CD1-CE2 4.33Å; L271-Y332 HydrophobicContact CD2-CD2 3.67Å; L271-Y332 HydrophobicContact CD2-CE2 3.78Å; L271-R335 HydrophobicContact CD2-CB 4.32Å; L271-M336 HydrophobicContact CD1-SD 3.67Å; L271-M336 HydrophobicContact CD2-CG 3.84Å; L271-M336 HydrophobicContact CD2-SD 3.67Å; L271-M336 HydrophobicContact CG-SD 4.14Å
272T85.2Confident84.4Confident23 Ų2316.4 Ų16.414%0.14111%0.11CC..Hα-helixtrans-62.5-42.8-179.5-56.50000111P268 S269 L270 F275 H276 R335P268-T272 WeakPolarHBondContact O-CB 3.18Å; P268-T272 PolarHBondContact O-N 2.76Å; P268-T272 VanDerWaalsContact O-N 3.09Å; P268-T272 PolarHBondContact O-OG1 3.17Å; S269-T272 WeakPolarHBondContact O-CB 3.29Å; S269-T272 PolarHBondContact O-N 3.05Å; L270-T272 VanDerWaalsContact C-N 3.33Å; L270-T272 PolarHBondContact O-N 2.78Å; T272-F275 PolarHBondContact O-N 2.89Å; T272-H276 PolarHBondContact O-CD2 3.47Å; T272-H276 VanDerWaalsContact O-CG 3.31Å; T272-H276 PolarHBondContact O-N 3.46Å; T272-R335 PolarHBondContact OG1-NH1 3.14Å
273T89.4Confident84.1Confident7 Ų718 Ų184%0.04312%0.119CC..Hα-helixtrans-62.5-46.3177.6-62.30000111.4L191 E192 S269 L270 L271 F275 H276 F277L191-T273 HydrophobicContact CB-CG2 3.5Å; L191-T273 HydrophobicContact CD1-CG2 4.14Å; L191-T273 HydrophobicContact CG-CG2 4.48Å; E192-T273 HydrophobicContact CG-CG2 4.04Å; E192-T273 WeakPolarHBondContact CG-OG1 3.45Å; E192-T273 PolarHBondContact OE1-OG1 2.98Å; E192-T273 VanDerWaalsContact OE1-OG1 3.12Å; S269-T273 PolarHBondContact O-N 3.49Å; S269-T273 PolarHBondContact O-OG1 3.41Å; L270-T273 PolarHBondContact O-N 3.47Å; L271-T273 VanDerWaalsContact C-N 3.32Å; L271-T273 PolarHBondContact O-N 2.55Å; T273-F275 VanDerWaalsContact C-N 3.33Å; T273-F275 PolarHBondContact O-N 2.6Å; T273-H276 WeakPolarHBondContact O-CB 3.44Å; T273-H276 PolarHBondContact O-N 3.1Å; T273-H276 VanDerWaalsContact O-N 3.15Å; T273-F277 HydrophobicContact CG2-CD2 4.4Å; T273-F277 HydrophobicContact CG2-CE2 4.36Å; T273-F277 WeakPolarHBondContact O-CD2 3.45Å; T273-F277 PolarHBondContact O-N 2.7Å
274I91.7Very high83.7Confident1 Ų116.2 Ų16.21%0.00510%0.104CC..Hα-helixtrans-61-43.3176-62163.7000110.7L253 F257 L270 L271 H276 F277 A278 A312 C315 I316L253-I274 HydrophobicContact CD1-CD1 4.39Å; L253-I274 HydrophobicContact CD1-CG1 4.28Å; F257-I274 HydrophobicContact CE2-CD1 3.74Å; F257-I274 HydrophobicContact CZ-CD1 3.93Å; L270-I274 HydrophobicContact CD1-CD1 3.75Å; L270-I274 HydrophobicContact CD1-CG1 4.03Å; L270-I274 HydrophobicContact CG-CD1 3.99Å; L270-I274 WeakPolarHBondContact O-CG1 3.34Å; L270-I274 PolarHBondContact O-N 3.15Å; L271-I274 PolarHBondContact O-N 3.24Å; I274-H276 VanDerWaalsContact C-N 3.32Å; I274-H276 PolarHBondContact O-N 2.67Å; I274-F277 PolarHBondContact O-N 3.49Å; I274-F277 VanDerWaalsContact O-N 3.13Å; I274-A278 PolarHBondContact O-N 3.28Å; I274-A312 HydrophobicContact CG2-CB 4.12Å; I274-A312 WeakPolarHBondContact CG2-O 3.39Å; I274-C315 HydrophobicContact CD1-CB 4.31Å; I274-C315 HydrophobicContact CG2-CB 3.85Å; I274-I316 HydrophobicContact CG2-CD1 4.05Å; I274-I316 HydrophobicContact CG2-CG1 3.67Å
275F89Confident83.2Confident0 Ų019.7 Ų19.70%010%0.104CC..Hα-helixtrans-64.2-33175.9-85.3-69.2000113.6L271 T272 T273 F277 A278 R279 I316 M336 Q339 L343 F374L271-F275 HydrophobicContact CD1-CD2 4.05Å; L271-F275 HydrophobicContact CD1-CE2 3.66Å; L271-F275 HydrophobicContact CD2-CE2 4.38Å; L271-F275 HydrophobicContact CG-CD2 3.91Å; L271-F275 HydrophobicContact CG-CE2 3.83Å; L271-F275 VanDerWaalsContact O-CD2 3.24Å; L271-F275 WeakPolarHBondContact O-CD2 3.45Å; L271-F275 PolarHBondContact O-N 2.93Å; T272-F275 PolarHBondContact O-N 2.89Å; T273-F275 VanDerWaalsContact C-N 3.33Å; T273-F275 PolarHBondContact O-N 2.6Å; F275-F277 VanDerWaalsContact C-N 3.31Å; F275-F277 PolarHBondContact O-N 2.9Å; F275-A278 WeakPolarHBondContact O-CB 3.32Å; F275-A278 PolarHBondContact O-N 3.03Å; F275-R279 WeakPolarHBondContact O-CG 3.46Å; F275-R279 PolarHBondContact O-N 3.22Å; F275-I316 HydrophobicContact CD1-CD1 3.56Å; F275-I316 HydrophobicContact CE1-CD1 3.52Å; F275-I316 HydrophobicContact CE1-CG1 4.23Å; F275-I316 HydrophobicContact CE1-CG2 4.26Å; F275-I316 HydrophobicContact CE2-CD1 4.49Å; F275-I316 HydrophobicContact CG-CD1 4.1Å; F275-I316 HydrophobicContact CZ-CD1 4Å; F275-I316 HydrophobicContact CZ-CG1 4.21Å; F275-I316 HydrophobicContact CZ-CG2 3.95Å; F275-M336 HydrophobicContact CE2-CE 4.05Å; F275-M336 HydrophobicContact CE2-SD 3.59Å; F275-M336 VanDerWaalsContact CE2-SD 3.59Å; F275-M336 HydrophobicContact CZ-CE 3.67Å; F275-M336 HydrophobicContact CZ-SD 3.86Å; F275-Q339 HydrophobicContact CB-CB 4.07Å; F275-Q339 HydrophobicContact CB-CG 3.85Å; F275-Q339 HydrophobicContact CD1-CB 3.48Å; F275-Q339 VanDerWaalsContact CD1-CB 3.48Å; F275-Q339 HydrophobicContact CD1-CG 4.2Å; F275-Q339 HydrophobicContact CD2-CB 3.84Å; F275-Q339 HydrophobicContact CD2-CG 3.82Å; F275-Q339 HydrophobicContact CE1-CB 3.77Å; F275-Q339 HydrophobicContact CE2-CB 4.11Å; F275-Q339 HydrophobicContact CE2-CG 4.42Å; F275-Q339 HydrophobicContact CG-CB 3.53Å; F275-Q339 HydrophobicContact CG-CG 3.7Å; F275-Q339 HydrophobicContact CZ-CB 4.09Å; F275-L343 HydrophobicContact CD1-CD1 3.91Å; F275-L343 HydrophobicContact CE1-CD1 4.15Å; F275-F374 HydrophobicContact CE1-CZ 4.22Å; F275-F374 HydrophobicContact CZ-CE2 4.44Å; F275-F374 HydrophobicContact CZ-CZ 4.17Å
276H88Confident81.9Confident14 Ų1420 Ų207%0.06511%0.107CC..Hα-helixtrans-60.3-42.9171.7-70.2173.5000111.3W195 T272 T273 I274 R279W195-H276 HydrophobicContact CD2-CB 4.41Å; W195-H276 HydrophobicContact CE3-CB 4.14Å; W195-H276 HydrophobicContact CH2-CB 3.87Å; W195-H276 HydrophobicContact CZ2-CB 4.14Å; W195-H276 HydrophobicContact CZ3-CB 3.85Å; T272-H276 PolarHBondContact O-CD2 3.47Å; T272-H276 VanDerWaalsContact O-CG 3.31Å; T272-H276 PolarHBondContact O-N 3.46Å; T273-H276 WeakPolarHBondContact O-CB 3.44Å; T273-H276 PolarHBondContact O-N 3.1Å; T273-H276 VanDerWaalsContact O-N 3.15Å; I274-H276 VanDerWaalsContact C-N 3.32Å; I274-H276 PolarHBondContact O-N 2.67Å; H276-R279 PolarHBondContact CD2-NH2 3.3Å; H276-R279 VanDerWaalsContact O-CB 3.29Å; H276-R279 WeakPolarHBondContact O-CB 3.42Å; H276-R279 PolarHBondContact O-N 2.51Å
277F90.4Very high80.4Confident1 Ų125.2 Ų25.20%0.00413%0.126CC..Hα-helixtrans-71.2-31.7176.7-81.4-91.5000113.2L191 W195 L238 C246 L250 T273 I274 F275 R279 F280 L308 A312L191-F277 HydrophobicContact CB-CE2 3.8Å; L191-F277 HydrophobicContact CB-CZ 4.33Å; L191-F277 HydrophobicContact CD2-CD2 4.34Å; L191-F277 HydrophobicContact CD2-CE1 4.28Å; L191-F277 HydrophobicContact CD2-CE2 3.89Å; L191-F277 HydrophobicContact CD2-CZ 3.84Å; L191-F277 HydrophobicContact CG-CE2 4.36Å; W195-F277 HydrophobicContact CE3-CD2 4.45Å; W195-F277 HydrophobicContact CE3-CE2 4.11Å; W195-F277 HydrophobicContact CE3-CZ 4.32Å; L238-F277 HydrophobicContact CD1-CE1 4.32Å; C246-F277 HydrophobicContact CB-CD1 4.42Å; C246-F277 HydrophobicContact CB-CE1 3.72Å; C246-F277 HydrophobicContact CB-CZ 4.3Å; C246-F277 VanDerWaalsContact SG-CE1 3.55Å; L250-F277 HydrophobicContact CD1-CB 4.28Å; L250-F277 HydrophobicContact CD1-CD1 4.4Å; L250-F277 HydrophobicContact CD1-CG 4.48Å; T273-F277 HydrophobicContact CG2-CD2 4.4Å; T273-F277 HydrophobicContact CG2-CE2 4.36Å; T273-F277 WeakPolarHBondContact O-CD2 3.45Å; T273-F277 PolarHBondContact O-N 2.7Å; I274-F277 PolarHBondContact O-N 3.49Å; I274-F277 VanDerWaalsContact O-N 3.13Å; F275-F277 VanDerWaalsContact C-N 3.31Å; F275-F277 PolarHBondContact O-N 2.9Å; F277-R279 PolarHBondContact O-N 2.92Å; F277-R279 VanDerWaalsContact O-N 3.15Å; F277-F280 HydrophobicContact CD1-CD2 4.13Å; F277-F280 AromaticContact CD1-CE2 3.91Å; F277-F280 HydrophobicContact CD1-CE2 3.91Å; F277-F280 HydrophobicContact CE1-CE2 4.17Å; F277-F280 WeakPolarHBondContact O-CB 3.42Å; F277-F280 WeakPolarHBondContact O-CD2 3.36Å; F277-F280 PolarHBondContact O-N 3.38Å; F277-F280 VanDerWaalsContact O-N 3.08Å; F277-L308 HydrophobicContact CD1-CD1 4.36Å; F277-L308 HydrophobicContact CE1-CD1 4.45Å; F277-A312 HydrophobicContact CB-CB 3.87Å
278A90.8Very high78.8Confident0 Ų028.9 Ų28.90%014%0.137CC..Hα-helixtrans-57.5-29.4172.600000112.4I274 F275 F280 G281 A312 M313 I316 L343 Y367I274-A278 PolarHBondContact O-N 3.28Å; F275-A278 WeakPolarHBondContact O-CB 3.32Å; F275-A278 PolarHBondContact O-N 3.03Å; A278-F280 PolarHBondContact O-N 3.13Å; A278-F280 VanDerWaalsContact O-N 3.16Å; A278-G281 PolarHBondContact O-N 2.88Å; A278-G281 VanDerWaalsContact O-N 3.14Å; A278-A312 HydrophobicContact CB-CB 4.09Å; A278-M313 HydrophobicContact CB-CG 4.28Å; A278-M313 HydrophobicContact CB-SD 3.84Å; A278-I316 HydrophobicContact CB-CD1 3.9Å; A278-L343 HydrophobicContact CB-CD1 4.2Å; A278-Y367 WeakPolarHBondContact O-CE2 3.43Å; A278-Y367 PolarHBondContact O-OH 3.43Å
279R87.9Confident77.3Confident0 Ų034.9 Ų34.90%017%0.165CC..G310 helixtrans-61.5-23.1177.6-59.7176.7-178.6166.68.8113.8L230 L231 I235 F275 H276 F277 G281 C282 Y342 L343L230-R279 PolarHBondContact O-NH1 2.93Å; L231-R279 PolarHBondContact O-NH1 3.07Å; L231-R279 VanDerWaalsContact O-NH1 3.08Å; I235-R279 HydrophobicContact CD1-CB 4.08Å; I235-R279 VanDerWaalsContact CD1-O 3.25Å; I235-R279 WeakPolarHBondContact CD1-O 3.4Å; I235-R279 HydrophobicContact CG1-CB 4.2Å; F275-R279 WeakPolarHBondContact O-CG 3.46Å; F275-R279 PolarHBondContact O-N 3.22Å; H276-R279 PolarHBondContact CD2-NH2 3.3Å; H276-R279 VanDerWaalsContact O-CB 3.29Å; H276-R279 WeakPolarHBondContact O-CB 3.42Å; H276-R279 PolarHBondContact O-N 2.51Å; F277-R279 PolarHBondContact O-N 2.92Å; F277-R279 VanDerWaalsContact O-N 3.15Å; R279-G281 PolarHBondContact O-N 3.31Å; R279-C282 WeakPolarHBondContact O-CB 3.29Å; R279-C282 PolarHBondContact O-N 3.04Å; R279-Y342 HydrophobicContact CG-CE1 3.92Å; R279-Y342 VanDerWaalsContact NE-CE1 3.29Å; R279-L343 HydrophobicContact CG-CD2 3.99Å
280F86.3Confident75.4Confident13 Ų1334.2 Ų34.26%0.05716%0.163CC..G310 helixtrans-60.2-33.7176.3-82.3-89.9000111.9W195 I235 P236 L238 F277 A278 C282 D283 L308W195-F280 HydrophobicContact CE3-CE2 4.3Å; W195-F280 HydrophobicContact CZ3-CD2 4.47Å; W195-F280 AromaticContact CZ3-CE2 3.7Å; W195-F280 HydrophobicContact CZ3-CE2 3.7Å; W195-F280 HydrophobicContact CZ3-CZ 4.43Å; I235-F280 HydrophobicContact CG2-CD1 3.67Å; I235-F280 HydrophobicContact CG2-CD2 4.15Å; I235-F280 HydrophobicContact CG2-CE1 3.44Å; I235-F280 VanDerWaalsContact CG2-CE1 3.44Å; I235-F280 HydrophobicContact CG2-CE2 3.98Å; I235-F280 HydrophobicContact CG2-CG 4.02Å; I235-F280 HydrophobicContact CG2-CZ 3.61Å; P236-F280 HydrophobicContact CG-CZ 4.16Å; L238-F280 HydrophobicContact CD1-CE1 4.15Å; L238-F280 HydrophobicContact CD1-CE2 4.34Å; L238-F280 HydrophobicContact CD1-CZ 3.65Å; L238-F280 HydrophobicContact CG-CE1 4.28Å; L238-F280 HydrophobicContact CG-CZ 3.91Å; F277-F280 HydrophobicContact CD1-CD2 4.13Å; F277-F280 AromaticContact CD1-CE2 3.91Å; F277-F280 HydrophobicContact CD1-CE2 3.91Å; F277-F280 HydrophobicContact CE1-CE2 4.17Å; F277-F280 WeakPolarHBondContact O-CB 3.42Å; F277-F280 WeakPolarHBondContact O-CD2 3.36Å; F277-F280 PolarHBondContact O-N 3.38Å; F277-F280 VanDerWaalsContact O-N 3.08Å; A278-F280 PolarHBondContact O-N 3.13Å; A278-F280 VanDerWaalsContact O-N 3.16Å; F280-C282 PolarHBondContact O-N 3.43Å; F280-D283 PolarHBondContact O-N 2.97Å; F280-L308 HydrophobicContact CB-CB 4.3Å; F280-L308 HydrophobicContact CG-CB 4.42Å
281G83.8Confident73.4Confident7 Ų739 Ų397%0.07220%0.197CC..G310 helixtrans-67.1-16.4176.100000114.1A278 R279A278-G281 PolarHBondContact O-N 2.88Å; A278-G281 VanDerWaalsContact O-N 3.14Å; R279-G281 PolarHBondContact O-N 3.31Å
282C79.6Confident71.5Confident0 Ų044.7 Ų44.70%023%0.231CC..G310 helixtrans-92.1-2.2176.9-59.40000113.8R279 F280 K346 R359 Y367R279-C282 WeakPolarHBondContact O-CB 3.29Å; R279-C282 PolarHBondContact O-N 3.04Å; F280-C282 PolarHBondContact O-N 3.43Å; C282-K346 HydrophobicContact CB-CD 3.94Å; C282-K346 HydrophobicContact CB-CG 4.25Å; C282-R359 PolarHBondContact O-NH2 3.33Å; C282-Y367 PolarHBondContact SG-OH 3.45Å
283D76Confident69.4Low42 Ų4249 Ų4923%0.22525%0.254CS..  trans-92.9108.3-172.7-162.2-7.2000113.1I235 F280 R285I235-D283 HydrophobicContact CD1-CB 3.79Å; F280-D283 PolarHBondContact O-N 2.97Å; D283-R285 VanDerWaalsContact OD1-CB 3.23Å; D283-R285 WeakPolarHBondContact OD1-CB 3.28Å; D283-R285 VanDerWaalsContact OD1-CG 3.26Å; D283-R285 WeakPolarHBondContact OD1-CG 3.5Å; D283-R285 IonicContact OD1-CZ 2.64Å; D283-R285 PolarHBondContact OD1-N 3.32Å; D283-R285 IonicContact OD1-NE 2.81Å; D283-R285 PolarHBondContact OD1-NE 3.28Å; D283-R285 IonicContact OD1-NH2 3Å; D283-R285 IonicContact OD2-CZ 3.14Å; D283-R285 IonicContact OD2-NE 2.89Å; D283-R285 PolarHBondContact OD2-NE 2.97Å; D283-R285 VanDerWaalsContact OD2-NE 3.14Å; D283-R285 IonicContact OD2-NH2 2.6Å; D283-R285 PolarHBondContact OD2-NH2 2.94Å
284I66.3Low66.9Low24 Ų2452.5 Ų52.512%0.12329%0.29CS..THydrogen-bonded Turntrans-85.6-11.1-178.5-58.7154.5000111.7A286 R287 K288 R359 E362 L363I284-A286 PolarHBondContact O-N 2.78Å; I284-R287 PolarHBondContact O-N 3.41Å; I284-K288 PolarHBondContact O-N 3.46Å; I284-R359 HydrophobicContact CD1-CG 3.6Å; I284-R359 VanDerWaalsContact CD1-NE 3.3Å; I284-E362 HydrophobicContact CD1-CB 4.29Å; I284-E362 HydrophobicContact CG1-CB 4.34Å; I284-E362 HydrophobicContact CG2-CB 4.25Å; I284-L363 HydrophobicContact CD1-CD2 4.24Å; I284-L363 HydrophobicContact CG1-CD2 3.88Å
285R63Low64.3Low135 Ų13554.8 Ų54.851%0.50931%0.307SS..Hα-helixtrans-60.9-30.4-176.6-66.3177.2-70.5174.36.1112.5D283 K288 M289D283-R285 VanDerWaalsContact OD1-CB 3.23Å; D283-R285 WeakPolarHBondContact OD1-CB 3.28Å; D283-R285 VanDerWaalsContact OD1-CG 3.26Å; D283-R285 WeakPolarHBondContact OD1-CG 3.5Å; D283-R285 IonicContact OD1-CZ 2.64Å; D283-R285 PolarHBondContact OD1-N 3.32Å; D283-R285 IonicContact OD1-NE 2.81Å; D283-R285 PolarHBondContact OD1-NE 3.28Å; D283-R285 IonicContact OD1-NH2 3Å; D283-R285 IonicContact OD2-CZ 3.14Å; D283-R285 IonicContact OD2-NE 2.89Å; D283-R285 PolarHBondContact OD2-NE 2.97Å; D283-R285 VanDerWaalsContact OD2-NE 3.14Å; D283-R285 IonicContact OD2-NH2 2.6Å; D283-R285 PolarHBondContact OD2-NH2 2.94Å; R285-K288 PolarHBondContact O-N 3.3Å; R285-M289 PolarHBondContact O-N 2.84Å
286A52Low61.9Low16 Ų1660.3 Ų60.313%0.13235%0.345CS..Hα-helixtrans-65.3-41.5178.900000113I284I284-A286 PolarHBondContact O-N 2.78Å
287R50.7Low59.5Low125 Ų12568.2 Ų68.247%0.47238%0.382SS..Hα-helixtrans-68.4-38.1177-86.5-176.9-179.1171.8-1.2112.4I284 A290 S291 E362 L363I284-R287 PolarHBondContact O-N 3.41Å; R287-A290 PolarHBondContact O-N 3.19Å; R287-S291 PolarHBondContact O-N 3.09Å; R287-E362 PolarHBondContact NH1-O 3.03Å; R287-L363 PolarHBondContact NH1-O 2.89Å; R287-L363 PolarHBondContact NH2-O 3.37Å
288K49.6Very low57Low129 Ų12972.3 Ų72.356%0.56140%0.404SS*.Hα-helixtrans-68.6-36.2-179-75.4-178.5178.7172.50113.2I284 R285 S291 V292I284-K288 PolarHBondContact O-N 3.46Å; R285-K288 PolarHBondContact O-N 3.3Å; K288-S291 PolarHBondContact O-N 3.46Å; K288-V292 WeakPolarHBondContact O-CG2 3.41Å; K288-V292 PolarHBondContact O-N 3.08Å
289M45.8Very low54.3Low144 Ų14476 Ų7671%0.70943%0.429SS*.Hα-helixtrans-68.7-31.8175.2-83-172175.500113.3R285R285-M289 PolarHBondContact O-N 2.84Å
290A43.6Very low52.1Low37 Ų3780.2 Ų80.231%0.30646%0.455SS..Hα-helixtrans-67.7-35175.400000112.5R287R287-A290 PolarHBondContact O-N 3.19Å
291S45.5Very low50Low101 Ų10182.3 Ų82.371%0.70647%0.471SS*.Hα-helixtrans-72.8-28.1179.6175.40000114.2R287 K288R287-S291 PolarHBondContact O-N 3.09Å; K288-S291 PolarHBondContact O-N 3.46Å
292V47.6Very low48Very low120 Ų12082.9 Ų82.973%0.72748%0.476SS*.Hα-helixtrans-82.6-26.2-174.8174.90000112.4K288K288-V292 WeakPolarHBondContact O-CG2 3.41Å; K288-V292 PolarHBondContact O-N 3.08Å
293N40.8Very low46.6Very low114 Ų11490.2 Ų90.261%0.6151%0.511SS*.SBendtrans-96.811.1-170.1-86.5-4.6000116.1S295N293-S295 WeakPolarHBondContact O-CB 3.48Å; N293-S295 PolarHBondContact O-N 2.94Å; N293-S295 PolarHBondContact O-OG 2.99Å
294G37.4Very low45.5Very low79 Ų7992.1 Ų92.181%0.81452%0.518SS*.  trans52.19.4164.800000117.7
295S37.5Very low45.2Very low50 Ų5094.6 Ų94.635%0.3553%0.526SS..  trans-108.6105.2-171.836.30000107.9N293 Q297 N298N293-S295 WeakPolarHBondContact O-CB 3.48Å; N293-S295 PolarHBondContact O-N 2.94Å; N293-S295 PolarHBondContact O-OG 2.99Å; S295-Q297 PolarHBondContact O-N 3.43Å; S295-N298 PolarHBondContact O-N 3.35Å; S295-N298 VanDerWaalsContact O-N 3.1Å
296S38.5Very low45.4Very low116 Ų11688.8 Ų88.881%0.81151%0.508SS*.THydrogen-bonded Turntrans-59.61.8177.637.50000114.8
297Q37.7Very low46.9Very low179 Ų17993.4 Ų93.484%0.83652%0.522SS*.THydrogen-bonded Turntrans-95.9-15.3173.8-77.5-179-2300114.4S295S295-Q297 PolarHBondContact O-N 3.43Å
298N35.9Very low48.8Very low88 Ų8887.5 Ų87.547%0.47150%0.5SS..SBendtrans-97.11.9-177.5-86.7-19.4000114.9S295 V300 S301S295-N298 PolarHBondContact O-N 3.35Å; S295-N298 VanDerWaalsContact O-N 3.1Å; N298-V300 PolarHBondContact O-N 2.9Å; N298-S301 PolarHBondContact O-N 3.1Å
299C35.4Very low50.7Low77 Ų7781.3 Ų81.352%0.5247%0.473SS..Hα-helixtrans-62.8-23.8178.1-58.50000113.2
300V40.8Very low52.9Low89 Ų8975.6 Ų75.654%0.53945%0.446SS..Hα-helixtrans-70.2-41-178.2-173.50000112.1N298 G302 Q303 E304N298-V300 PolarHBondContact O-N 2.9Å; V300-G302 VanDerWaalsContact C-N 3.27Å; V300-G302 PolarHBondContact O-N 2.89Å; V300-Q303 PolarHBondContact O-N 3.5Å; V300-E304 PolarHBondContact O-N 2.89Å
301S42.5Very low55.3Low57 Ų5775.1 Ų75.140%0.39944%0.439SS..Hα-helixtrans-70.8-19.7-175.879.20000114.5N298N298-S301 PolarHBondContact O-N 3.1Å
302G42.6Very low57.6Low18 Ų1870.3 Ų70.319%0.18641%0.405CS..Hα-helixtrans-77-29.9176.600000113.6V300V300-G302 VanDerWaalsContact C-N 3.27Å; V300-G302 PolarHBondContact O-N 2.89Å
303Q48.5Very low59.8Low154 Ų15464.6 Ų64.672%0.7237%0.37SS*.Hα-helixtrans-76.5-32.8172.3-91.8177.9-37.400111.8V300V300-Q303 PolarHBondContact O-N 3.5Å
304E53.2Low62.4Low82 Ų8260.7 Ų60.738%0.38335%0.352SS..Hα-helixtrans-66.6-38.3-177.9-71179.2158.300112.6V300 G306 R307V300-E304 PolarHBondContact O-N 2.89Å; E304-G306 VanDerWaalsContact C-N 3.34Å; E304-G306 PolarHBondContact O-N 2.63Å; E304-R307 WeakPolarHBondContact O-CB 3.45Å; E304-R307 PolarHBondContact O-N 3.01Å
305R59.6Low65Low76 Ų7656.9 Ų56.929%0.28731%0.313SS..Hα-helixtrans-67.5-30.6-178.1-70.6-178.2175.9-179.50.2114.6E243 R307E243-R305 VanDerWaalsContact OE1-CA 3.26Å; E243-R305 WeakPolarHBondContact OE1-CA 3.46Å; E243-R305 PolarHBondContact OE1-N 3.31Å; E243-R305 VanDerWaalsContact OE1-N 3.13Å; R305-R307 PolarHBondContact O-N 3.1Å
306G67.4Low67.6Low13 Ų1354.6 Ų54.613%0.13430%0.296CS..Hα-helixtrans-64.1-30.5173.400000112.2E304 L308 G309 V310E304-G306 VanDerWaalsContact C-N 3.34Å; E304-G306 PolarHBondContact O-N 2.63Å; G306-L308 VanDerWaalsContact C-N 3.32Å; G306-L308 PolarHBondContact O-N 3.1Å; G306-G309 WeakPolarHBondContact O-CA 3.46Å; G306-G309 PolarHBondContact O-N 2.87Å; G306-V310 PolarHBondContact O-N 3.24Å; G306-V310 VanDerWaalsContact O-N 3.08Å
307R84.3Confident70.2Confident113 Ų11349.7 Ų49.743%0.42626%0.261SS..Hα-helixtrans-58.3-40-179-170.8-177.4168.9-176.2-4.4112.7E251 E304 R305 G309 V310 L311E251-R307 IonicContact OE1-CZ 3.63Å; E251-R307 IonicContact OE1-NH2 3.4Å; E251-R307 PolarHBondContact OE1-NH2 3.36Å; E304-R307 WeakPolarHBondContact O-CB 3.45Å; E304-R307 PolarHBondContact O-N 3.01Å; R305-R307 PolarHBondContact O-N 3.1Å; R307-G309 VanDerWaalsContact C-N 3.28Å; R307-G309 PolarHBondContact O-N 3.19Å; R307-V310 PolarHBondContact O-N 3.38Å; R307-L311 HydrophobicContact CG-CD1 4.05Å; R307-L311 HydrophobicContact CG-CG 4.24Å; R307-L311 WeakPolarHBondContact O-CB 3.35Å; R307-L311 WeakPolarHBondContact O-CG 3.11Å; R307-L311 PolarHBondContact O-N 3.4Å
308L89.8Confident72.7Confident1 Ų144.7 Ų44.71%0.00524%0.238CC..Hα-helixtrans-61-39.9176.6-70.9-178.7000111.7L238 E243 C246 S247 L250 F277 F280 G306 A312L238-L308 HydrophobicContact CD1-CD1 3.73Å; E243-L308 HydrophobicContact CG-CD1 4.02Å; E243-L308 HydrophobicContact CG-CG 4.26Å; C246-L308 HydrophobicContact CB-CD2 3.8Å; S247-L308 WeakPolarHBondContact OG-CD2 3.38Å; L250-L308 HydrophobicContact CD1-CD2 4.15Å; F277-L308 HydrophobicContact CD1-CD1 4.36Å; F277-L308 HydrophobicContact CE1-CD1 4.45Å; F280-L308 HydrophobicContact CB-CB 4.3Å; F280-L308 HydrophobicContact CG-CB 4.42Å; G306-L308 VanDerWaalsContact C-N 3.32Å; G306-L308 PolarHBondContact O-N 3.1Å; L308-A312 VanDerWaalsContact O-CB 3.26Å; L308-A312 WeakPolarHBondContact O-CB 3.21Å; L308-A312 PolarHBondContact O-N 2.95Å
309G90.7Very high75.2Confident0 Ų040.6 Ų40.60%022%0.216CC..Hα-helixtrans-62-46.5173.700000112G306 R307 A312 M313G306-G309 WeakPolarHBondContact O-CA 3.46Å; G306-G309 PolarHBondContact O-N 2.87Å; R307-G309 VanDerWaalsContact C-N 3.28Å; R307-G309 PolarHBondContact O-N 3.19Å; G309-A312 PolarHBondContact O-N 3.3Å; G309-M313 WeakPolarHBondContact O-CB 3.33Å; G309-M313 WeakPolarHBondContact O-CG 3.33Å; G309-M313 PolarHBondContact O-N 2.95Å
310V92Very high77.4Confident24 Ų2437 Ų3715%0.14519%0.191CC..Hα-helixtrans-63.5-44.6178.4-178.20000111.9G306 R307 M313 S314 K370G306-V310 PolarHBondContact O-N 3.24Å; G306-V310 VanDerWaalsContact O-N 3.08Å; R307-V310 PolarHBondContact O-N 3.38Å; V310-M313 PolarHBondContact O-N 3.47Å; V310-S314 WeakPolarHBondContact O-CB 3.44Å; V310-S314 PolarHBondContact O-N 2.8Å; V310-S314 PolarHBondContact O-OG 3.22Å; V310-K370 HydrophobicContact CG1-CG 4.15Å
311L93.8Very high79.6Confident27 Ų2735.3 Ų35.314%0.14118%0.184CC..Hα-helixtrans-64.4-42.3178.5-72174.5000111.4L250 E251 R307 S314 C315L250-L311 HydrophobicContact CB-CB 3.95Å; L250-L311 HydrophobicContact CD1-CB 4.06Å; E251-L311 HydrophobicContact CG-CD1 4.18Å; E251-L311 HydrophobicContact CG-CD2 3.73Å; R307-L311 HydrophobicContact CG-CD1 4.05Å; R307-L311 HydrophobicContact CG-CG 4.24Å; R307-L311 WeakPolarHBondContact O-CB 3.35Å; R307-L311 WeakPolarHBondContact O-CG 3.11Å; R307-L311 PolarHBondContact O-N 3.4Å; L311-S314 WeakPolarHBondContact O-CB 3.34Å; L311-S314 PolarHBondContact O-N 3.26Å; L311-C315 PolarHBondContact O-N 2.92Å; L311-C315 PolarHBondContact O-SG 3.4Å
312A94.6Very high81.5Confident0 Ų035.6 Ų35.60%018%0.178CC..Hα-helixtrans-65.2-42.917600000111.9L250 I274 F277 A278 L308 G309 S314 C315 I316L250-A312 HydrophobicContact CD1-CB 4.22Å; L250-A312 HydrophobicContact CD2-CB 4.31Å; I274-A312 HydrophobicContact CG2-CB 4.12Å; I274-A312 WeakPolarHBondContact CG2-O 3.39Å; F277-A312 HydrophobicContact CB-CB 3.87Å; A278-A312 HydrophobicContact CB-CB 4.09Å; L308-A312 VanDerWaalsContact O-CB 3.26Å; L308-A312 WeakPolarHBondContact O-CB 3.21Å; L308-A312 PolarHBondContact O-N 2.95Å; G309-A312 PolarHBondContact O-N 3.3Å; A312-S314 VanDerWaalsContact C-N 3.3Å; A312-S314 PolarHBondContact O-N 3.42Å; A312-C315 WeakPolarHBondContact O-CB 3.47Å; A312-C315 PolarHBondContact O-N 3.04Å; A312-I316 WeakPolarHBondContact O-CG1 3.49Å; A312-I316 PolarHBondContact O-N 3.48Å
313M93.8Very high82.8Confident0 Ų039.9 Ų39.90%020%0.196CC..Hα-helixtrans-62.7-36.4173.4-74.6-55.8-50.400112.5A278 G309 V310 I316 N317 L343 Y367 K370 F371 F374A278-M313 HydrophobicContact CB-CG 4.28Å; A278-M313 HydrophobicContact CB-SD 3.84Å; G309-M313 WeakPolarHBondContact O-CB 3.33Å; G309-M313 WeakPolarHBondContact O-CG 3.33Å; G309-M313 PolarHBondContact O-N 2.95Å; V310-M313 PolarHBondContact O-N 3.47Å; M313-I316 PolarHBondContact O-N 3.17Å; M313-I316 HydrophobicContact SD-CD1 3.82Å; M313-N317 PolarHBondContact O-N 2.7Å; M313-L343 HydrophobicContact SD-CD1 4.35Å; M313-Y367 HydrophobicContact CG-CD2 3.95Å; M313-Y367 HydrophobicContact CG-CE2 3.41Å; M313-Y367 VanDerWaalsContact CG-CE2 3.41Å; M313-Y367 HydrophobicContact SD-CE2 4.38Å; M313-K370 HydrophobicContact CB-CB 3.84Å; M313-F371 HydrophobicContact CE-CB 4.42Å; M313-F371 HydrophobicContact CE-CD2 3.9Å; M313-F371 HydrophobicContact SD-CD2 4.23Å; M313-F374 HydrophobicContact CE-CB 3.44Å; M313-F374 VanDerWaalsContact CE-CB 3.44Å; M313-F374 HydrophobicContact CE-CD1 4.07Å; M313-F374 HydrophobicContact CE-CD2 4.45Å; M313-F374 HydrophobicContact CE-CG 3.74Å
314S94.4Very high83.8Confident31 Ų3132.9 Ų32.922%0.21717%0.165CC..Hα-helixtrans-62.4-42.7173.5-56.80000111.4V310 L311 A312 I316 N317 E318V310-S314 WeakPolarHBondContact O-CB 3.44Å; V310-S314 PolarHBondContact O-N 2.8Å; V310-S314 PolarHBondContact O-OG 3.22Å; L311-S314 WeakPolarHBondContact O-CB 3.34Å; L311-S314 PolarHBondContact O-N 3.26Å; A312-S314 VanDerWaalsContact C-N 3.3Å; A312-S314 PolarHBondContact O-N 3.42Å; S314-I316 VanDerWaalsContact C-N 3.32Å; S314-I316 PolarHBondContact O-N 3.23Å; S314-N317 PolarHBondContact O-N 3.1Å; S314-E318 WeakPolarHBondContact O-CG 3.46Å; S314-E318 PolarHBondContact O-N 3.38Å
315C93.1Very high84.5Confident0 Ų032.6 Ų32.60%017%0.168CC..Hα-helixtrans-59.8-42.4173.2-62.30000111.9L250 F257 I274 L311 A312 L319L250-C315 PolarHBondContact O-SG 2.79Å; F257-C315 HydrophobicContact CD2-CB 4.36Å; F257-C315 HydrophobicContact CE2-CB 4.21Å; I274-C315 HydrophobicContact CD1-CB 4.31Å; I274-C315 HydrophobicContact CG2-CB 3.85Å; L311-C315 PolarHBondContact O-N 2.92Å; L311-C315 PolarHBondContact O-SG 3.4Å; A312-C315 WeakPolarHBondContact O-CB 3.47Å; A312-C315 PolarHBondContact O-N 3.04Å; C315-L319 WeakPolarHBondContact O-CB 3.49Å; C315-L319 PolarHBondContact O-N 3.35Å; C315-L319 VanDerWaalsContact O-N 3.12Å
316I91.8Very high84.8Confident1 Ų129.4 Ų29.41%0.00516%0.157CC..Hα-helixtrans-64.4-44178-66.7160.3000110.4I274 F275 A278 A312 M313 S314 L319 M320 F374I274-I316 HydrophobicContact CG2-CD1 4.05Å; I274-I316 HydrophobicContact CG2-CG1 3.67Å; F275-I316 HydrophobicContact CD1-CD1 3.56Å; F275-I316 HydrophobicContact CE1-CD1 3.52Å; F275-I316 HydrophobicContact CE1-CG1 4.23Å; F275-I316 HydrophobicContact CE1-CG2 4.26Å; F275-I316 HydrophobicContact CE2-CD1 4.49Å; F275-I316 HydrophobicContact CG-CD1 4.1Å; F275-I316 HydrophobicContact CZ-CD1 4Å; F275-I316 HydrophobicContact CZ-CG1 4.21Å; F275-I316 HydrophobicContact CZ-CG2 3.95Å; A278-I316 HydrophobicContact CB-CD1 3.9Å; A312-I316 WeakPolarHBondContact O-CG1 3.49Å; A312-I316 PolarHBondContact O-N 3.48Å; M313-I316 PolarHBondContact O-N 3.17Å; M313-I316 HydrophobicContact SD-CD1 3.82Å; S314-I316 VanDerWaalsContact C-N 3.32Å; S314-I316 PolarHBondContact O-N 3.23Å; I316-L319 PolarHBondContact O-N 3.04Å; I316-M320 HydrophobicContact CG2-CG 4.05Å; I316-M320 WeakPolarHBondContact O-CB 3.38Å; I316-M320 WeakPolarHBondContact O-CG 3.32Å; I316-M320 PolarHBondContact O-N 3.39Å; I316-F374 HydrophobicContact CG2-CD2 3.48Å; I316-F374 VanDerWaalsContact CG2-CD2 3.48Å; I316-F374 HydrophobicContact CG2-CE2 3.46Å; I316-F374 VanDerWaalsContact CG2-CE2 3.46Å; I316-F374 HydrophobicContact CG2-CG 4.38Å; I316-F374 HydrophobicContact CG2-CZ 4.33Å
317N92.3Very high84.6Confident13 Ų1337.4 Ų37.47%0.0719%0.194CC..Hα-helixtrans-64-42.5179.5-73-9.8000112.3M313 S314 L319 M320 S321 K370 D373 F374 L377M313-N317 PolarHBondContact O-N 2.7Å; S314-N317 PolarHBondContact O-N 3.1Å; N317-L319 VanDerWaalsContact C-N 3.28Å; N317-L319 PolarHBondContact O-N 3.29Å; N317-M320 PolarHBondContact O-N 2.97Å; N317-S321 VanDerWaalsContact O-CB 3.31Å; N317-S321 WeakPolarHBondContact O-CB 3.48Å; N317-S321 PolarHBondContact O-N 3.46Å; N317-S321 PolarHBondContact O-OG 3.35Å; N317-K370 PolarHBondContact ND2-O 2.74Å; N317-D373 WeakPolarHBondContact ND2-CB 3.38Å; N317-F374 WeakPolarHBondContact OD1-CA 3.27Å; N317-F374 WeakPolarHBondContact OD1-CB 3.17Å; N317-F374 PolarHBondContact OD1-N 3.32Å; N317-L377 HydrophobicContact CB-CD1 4.09Å; N317-L377 WeakPolarHBondContact O-CD1 3.33Å
318E90.7Very high83.8Confident75 Ų7537.2 Ų37.235%0.3520%0.198SC..Hα-helixtrans-60.7-37.8173.5-73.8-59.314700112.7F257 S314 S321F257-E318 HydrophobicContact CB-CB 4.01Å; S314-E318 WeakPolarHBondContact O-CG 3.46Å; S314-E318 PolarHBondContact O-N 3.38Å; E318-S321 PolarHBondContact O-OG 3.35Å; E318-S321 VanDerWaalsContact O-OG 3.05Å
319L87.3Confident82.8Confident1 Ų139.8 Ų39.81%0.00521%0.209CC..Hα-helixtrans-71.4-34.9176.9174.5147000112F257 I266 L271 C315 I316 N317 Y332 M336F257-L319 HydrophobicContact CD2-CB 4.31Å; F257-L319 HydrophobicContact CE2-CB 4.47Å; F257-L319 HydrophobicContact CE2-CD1 4.22Å; F257-L319 HydrophobicContact CZ-CD1 4.36Å; I266-L319 HydrophobicContact CD1-CD1 3.45Å; I266-L319 VanDerWaalsContact CD1-CD1 3.45Å; I266-L319 HydrophobicContact CD1-CG 3.77Å; I266-L319 HydrophobicContact CG1-CD1 3.99Å; I266-L319 HydrophobicContact CG2-CD1 4.14Å; L271-L319 HydrophobicContact CD1-CD1 4.03Å; L271-L319 HydrophobicContact CD1-CD2 3.97Å; C315-L319 WeakPolarHBondContact O-CB 3.49Å; C315-L319 PolarHBondContact O-N 3.35Å; C315-L319 VanDerWaalsContact O-N 3.12Å; I316-L319 PolarHBondContact O-N 3.04Å; N317-L319 VanDerWaalsContact C-N 3.28Å; N317-L319 PolarHBondContact O-N 3.29Å; L319-Y332 HydrophobicContact CD2-CE2 4.09Å; L319-Y332 WeakPolarHBondContact CD2-OH 3.33Å; L319-M336 HydrophobicContact CD2-SD 4.24Å
320M83.2Confident81.8Confident1 Ų147 Ų471%0.00524%0.242CC..Hα-helixtrans-83.4-29.7-178-71.8-64-80.100114.3I316 N317 K322 M336 F374 L377 F378 H382I316-M320 HydrophobicContact CG2-CG 4.05Å; I316-M320 WeakPolarHBondContact O-CB 3.38Å; I316-M320 WeakPolarHBondContact O-CG 3.32Å; I316-M320 PolarHBondContact O-N 3.39Å; N317-M320 PolarHBondContact O-N 2.97Å; M320-K322 PolarHBondContact O-N 3.48Å; M320-M336 HydrophobicContact CE-CE 3.63Å; M320-M336 HydrophobicContact CG-CE 3.99Å; M320-M336 HydrophobicContact SD-CE 3.2Å; M320-M336 WeakPolarHBondContact SD-CE 3.4Å; M320-M336 HydrophobicContact SD-SD 4.08Å; M320-F374 HydrophobicContact CE-CE2 4.02Å; M320-F374 HydrophobicContact CG-CD2 4.11Å; M320-F374 HydrophobicContact CG-CE2 3.92Å; M320-F374 HydrophobicContact SD-CE2 4.49Å; M320-L377 HydrophobicContact CB-CB 4.1Å; M320-L377 HydrophobicContact CB-CD1 4.12Å; M320-F378 HydrophobicContact CE-CB 4.09Å; M320-F378 HydrophobicContact CE-CD2 3.83Å; M320-F378 HydrophobicContact CE-CG 4.45Å; M320-H382 HydrophobicContact CE-CB 4.32Å; M320-H382 WeakPolarHBondContact CE-CD2 3.35Å; M320-H382 PolarHBondContact O-NE2 3.26Å
321S86.3Confident80.8Confident55 Ų5549.8 Ų49.839%0.38525%0.254SS..Hα-helixtrans-64.6-28.9177.769.30000111.8N317 E318N317-S321 VanDerWaalsContact O-CB 3.31Å; N317-S321 WeakPolarHBondContact O-CB 3.48Å; N317-S321 PolarHBondContact O-N 3.46Å; N317-S321 PolarHBondContact O-OG 3.35Å; E318-S321 PolarHBondContact O-OG 3.35Å; E318-S321 VanDerWaalsContact O-OG 3.05Å
322K81.4Confident79.9Confident62 Ų6248.7 Ų48.727%0.2725%0.248SC..SBendtrans-84.1135.2174.9-63.7-170.4177.2-177.30110.2F257 S258 L262 M320 C324F257-K322 WeakPolarHBondContact O-CE 3.28Å; F257-K322 PolarHBondContact O-NZ 2.95Å; S258-K322 PolarHBondContact O-NZ 3.07Å; L262-K322 HydrophobicContact CD1-CB 3.86Å; L262-K322 HydrophobicContact CD1-CD 3.57Å; L262-K322 HydrophobicContact CD1-CG 4.14Å; L262-K322 HydrophobicContact CG-CD 4.11Å; M320-K322 PolarHBondContact O-N 3.48Å; K322-C324 PolarHBondContact O-N 3.38Å
323N69.7Low78.7Confident108 Ų10849.7 Ų49.758%0.57825%0.253SS*.  trans-7051.8173.9-92.6-57.8000112.5V381 R385N323-V381 WeakPolarHBondContact OD1-CG1 3.49Å; N323-R385 PolarHBondContact OD1-NH2 3.27Å; N323-R385 VanDerWaalsContact OD1-NH2 3.09Å
324C69.8Low77.8Confident8 Ų852 Ų525%0.05427%0.265CS..  trans-71.5138.6-176.4-169.10000111.3L262 S263 K322L262-C324 VanDerWaalsContact C-SG 3.54Å; L262-C324 HydrophobicContact CB-CB 4.21Å; S263-C324 WeakPolarHBondContact CA-SG 3.32Å; S263-C324 PolarHBondContact N-SG 2.86Å; S263-C324 VanDerWaalsContact N-SG 3.41Å; K322-C324 PolarHBondContact O-N 3.38Å
325V67.9Low76.9Confident76 Ų7653.8 Ų53.846%0.46127%0.267SS..  trans-125.991.7168.4-178.50000106.1F329V325-F329 HydrophobicContact CB-CD2 4.17Å; V325-F329 HydrophobicContact CB-CE2 4.3Å; V325-F329 HydrophobicContact CG1-CB 4.27Å; V325-F329 HydrophobicContact CG1-CD2 3.51Å; V325-F329 HydrophobicContact CG1-CE2 3.91Å; V325-F329 HydrophobicContact CG1-CG 3.87Å; V325-F329 HydrophobicContact CG2-CE2 4.2Å
326P67.4Low76.1Confident8 Ų853.9 Ų53.95%0.05227%0.268CS..  trans-62.2159.8178.1-26.137.2000112.3E328 F329 Y332P326-E328 VanDerWaalsContact C-N 3.25Å; P326-E328 PolarHBondContact O-N 2.68Å; P326-F329 WeakPolarHBondContact O-CB 3.42Å; P326-F329 PolarHBondContact O-N 3.35Å; P326-Y332 HydrophobicContact CB-CG 4.46Å; P326-Y332 HydrophobicContact CG-CD1 3.93Å; P326-Y332 HydrophobicContact CG-CD2 3.8Å; P326-Y332 HydrophobicContact CG-CE1 4.2Å; P326-Y332 HydrophobicContact CG-CE2 4.08Å; P326-Y332 HydrophobicContact CG-CG 3.72Å
327M63.5Low75.5Confident182 Ų18254.7 Ų54.790%0.89727%0.271SS*.THydrogen-bonded Turntrans-60.6-34.2177.3-68-149.7173.200113F329M327-F329 VanDerWaalsContact C-N 3.33Å; M327-F329 PolarHBondContact O-N 2.96Å
328E67.4Low74.9Confident109 Ų10955.2 Ų55.251%0.50927%0.273SS..THydrogen-bonded Turntrans-96.454.4173-66.1174.3172.800110.9P268 P326 E330 E331 Y332P268-E328 WeakPolarHBondContact CD-OE2 3.35Å; P268-E328 WeakPolarHBondContact CG-OE2 3.24Å; P326-E328 VanDerWaalsContact C-N 3.25Å; P326-E328 PolarHBondContact O-N 2.68Å; E328-E330 VanDerWaalsContact C-N 3.35Å; E328-E330 PolarHBondContact O-N 3.29Å; E328-E331 PolarHBondContact O-N 3.08Å; E328-Y332 WeakPolarHBondContact O-CB 3.47Å; E328-Y332 PolarHBondContact O-N 3.1Å
329F68.6Low74.5Confident55 Ų5552.1 Ų52.124%0.24126%0.259CS..Hα-helixtrans-56.2-42.6-168.7-175.8-116.2000114.1V325 P326 M327 Y332 L333 R385V325-F329 HydrophobicContact CB-CD2 4.17Å; V325-F329 HydrophobicContact CB-CE2 4.3Å; V325-F329 HydrophobicContact CG1-CB 4.27Å; V325-F329 HydrophobicContact CG1-CD2 3.51Å; V325-F329 HydrophobicContact CG1-CE2 3.91Å; V325-F329 HydrophobicContact CG1-CG 3.87Å; V325-F329 HydrophobicContact CG2-CE2 4.2Å; P326-F329 WeakPolarHBondContact O-CB 3.42Å; P326-F329 PolarHBondContact O-N 3.35Å; M327-F329 VanDerWaalsContact C-N 3.33Å; M327-F329 PolarHBondContact O-N 2.96Å; F329-Y332 PolarHBondContact O-N 3.36Å; F329-L333 HydrophobicContact CD1-CD1 3.99Å; F329-L333 HydrophobicContact CD2-CG 4.34Å; F329-L333 HydrophobicContact CE1-CD1 3.36Å; F329-L333 HydrophobicContact CE1-CG 4.15Å; F329-L333 HydrophobicContact CE2-CD1 4.03Å; F329-L333 HydrophobicContact CE2-CD2 4.12Å; F329-L333 HydrophobicContact CE2-CG 3.97Å; F329-L333 HydrophobicContact CZ-CD1 3.39Å; F329-L333 HydrophobicContact CZ-CD2 4.15Å; F329-L333 HydrophobicContact CZ-CG 3.87Å; F329-L333 WeakPolarHBondContact O-CG 3.42Å; F329-L333 PolarHBondContact O-N 3.4Å; F329-R385 HydrophobicContact CZ-CB 4.45Å
330E68.8Low74.2Confident150 Ų15052 Ų5270%0.70126%0.258SS*.Hα-helixtrans-67.1-44.4-177.5-66.8-174.5171.400112.3E328 L333 L334E328-E330 VanDerWaalsContact C-N 3.35Å; E328-E330 PolarHBondContact O-N 3.29Å; E330-L333 PolarHBondContact O-N 3.11Å; E330-L334 VanDerWaalsContact O-CB 3.3Å; E330-L334 WeakPolarHBondContact O-CB 3.31Å; E330-L334 PolarHBondContact O-N 3.41Å
331E71.7Confident74.2Confident84 Ų8452.5 Ų52.539%0.39326%0.26SS..Hα-helixtrans-68.5-38.1178.2-174.2172.1178.200111.6E328 L334 R335E328-E331 PolarHBondContact O-N 3.08Å; E331-L334 PolarHBondContact O-N 3.4Å; E331-R335 WeakPolarHBondContact O-CG 3.43Å; E331-R335 PolarHBondContact O-N 3.32Å; E331-R335 IonicContact OE1-CZ 2.75Å; E331-R335 VanDerWaalsContact OE1-CZ 3.27Å; E331-R335 IonicContact OE1-NE 3.86Å; E331-R335 PolarHBondContact OE1-NE 3.45Å; E331-R335 VanDerWaalsContact OE1-NE 3.17Å; E331-R335 IonicContact OE1-NH2 3.24Å; E331-R335 PolarHBondContact OE1-NH2 2.86Å
332Y73.9Confident74.1Confident4 Ų450.9 Ų50.92%0.01625%0.246CC..Hα-helixtrans-58.9-51.4172.8171.3-93.9000111.4I266 L271 L319 P326 E328 F329 L334 R335 M336I266-Y332 HydrophobicContact CG2-CD2 4.38Å; I266-Y332 HydrophobicContact CG2-CE2 4.2Å; L271-Y332 HydrophobicContact CD1-CE2 4.33Å; L271-Y332 HydrophobicContact CD2-CD2 3.67Å; L271-Y332 HydrophobicContact CD2-CE2 3.78Å; L319-Y332 HydrophobicContact CD2-CE2 4.09Å; L319-Y332 WeakPolarHBondContact CD2-OH 3.33Å; P326-Y332 HydrophobicContact CB-CG 4.46Å; P326-Y332 HydrophobicContact CG-CD1 3.93Å; P326-Y332 HydrophobicContact CG-CD2 3.8Å; P326-Y332 HydrophobicContact CG-CE1 4.2Å; P326-Y332 HydrophobicContact CG-CE2 4.08Å; P326-Y332 HydrophobicContact CG-CG 3.72Å; E328-Y332 WeakPolarHBondContact O-CB 3.47Å; E328-Y332 PolarHBondContact O-N 3.1Å; F329-Y332 PolarHBondContact O-N 3.36Å; Y332-L334 VanDerWaalsContact C-N 3.33Å; Y332-L334 PolarHBondContact O-N 2.83Å; Y332-R335 PolarHBondContact O-N 2.94Å; Y332-M336 HydrophobicContact CD1-CG 4.22Å; Y332-M336 HydrophobicContact CD2-CG 4.49Å; Y332-M336 HydrophobicContact CE1-CG 3.9Å; Y332-M336 HydrophobicContact CE2-CG 4.19Å; Y332-M336 HydrophobicContact CE2-SD 4.36Å; Y332-M336 HydrophobicContact CG-CG 4.5Å; Y332-M336 WeakPolarHBondContact O-CB 3.46Å; Y332-M336 WeakPolarHBondContact O-CG 3.43Å; Y332-M336 PolarHBondContact O-N 2.98Å
333L70.1Confident74.3Confident20 Ų2047.9 Ų47.911%0.10523%0.233CC..Hα-helixtrans-61.3-41.7177.5-74.4-174.8000112F329 E330 M336 F337 I386F329-L333 HydrophobicContact CD1-CD1 3.99Å; F329-L333 HydrophobicContact CD2-CG 4.34Å; F329-L333 HydrophobicContact CE1-CD1 3.36Å; F329-L333 HydrophobicContact CE1-CG 4.15Å; F329-L333 HydrophobicContact CE2-CD1 4.03Å; F329-L333 HydrophobicContact CE2-CD2 4.12Å; F329-L333 HydrophobicContact CE2-CG 3.97Å; F329-L333 HydrophobicContact CZ-CD1 3.39Å; F329-L333 HydrophobicContact CZ-CD2 4.15Å; F329-L333 HydrophobicContact CZ-CG 3.87Å; F329-L333 WeakPolarHBondContact O-CG 3.42Å; F329-L333 PolarHBondContact O-N 3.4Å; E330-L333 PolarHBondContact O-N 3.11Å; L333-M336 WeakPolarHBondContact O-CB 3.26Å; L333-M336 PolarHBondContact O-N 2.96Å; L333-F337 WeakPolarHBondContact O-CD1 3.48Å; L333-F337 PolarHBondContact O-N 3.05Å; L333-I386 HydrophobicContact CD1-CG1 4.31Å; L333-I386 HydrophobicContact CD2-CD1 4.12Å; L333-I386 HydrophobicContact CD2-CG1 3.79Å; L333-I386 HydrophobicContact CG-CG1 4.45Å
334L74.1Confident75.1Confident50 Ų5042.8 Ų42.826%0.26221%0.205SC..Hα-helixtrans-58.5-50.7178-178.961.3000111.5E330 E331 Y332 F337 Q338E330-L334 VanDerWaalsContact O-CB 3.3Å; E330-L334 WeakPolarHBondContact O-CB 3.31Å; E330-L334 PolarHBondContact O-N 3.41Å; E331-L334 PolarHBondContact O-N 3.4Å; Y332-L334 VanDerWaalsContact C-N 3.33Å; Y332-L334 PolarHBondContact O-N 2.83Å; L334-F337 VanDerWaalsContact CA-CE1 3.5Å; L334-F337 HydrophobicContact CB-CE1 4.24Å; L334-F337 HydrophobicContact CD1-CD1 4.38Å; L334-F337 HydrophobicContact CD1-CE1 3.31Å; L334-F337 HydrophobicContact CD1-CE2 4.31Å; L334-F337 HydrophobicContact CD1-CZ 3.25Å; L334-F337 HydrophobicContact CG-CE1 4.31Å; L334-F337 WeakPolarHBondContact O-CD1 3.34Å; L334-Q338 HydrophobicContact CD1-CG 4.37Å; L334-Q338 VanDerWaalsContact CD1-NE2 3.26Å; L334-Q338 WeakPolarHBondContact O-CB 3.41Å; L334-Q338 WeakPolarHBondContact O-CG 3.49Å; L334-Q338 PolarHBondContact O-N 3.5Å; L334-Q338 VanDerWaalsContact O-N 3.07Å
335R76.1Confident75.8Confident68 Ų6844.3 Ų44.326%0.25721%0.212SC..Hα-helixtrans-64.7-42.1177.7-69.8-177.1-173.8-152.77.6111.8P268 L271 T272 E331 Y332 Q338 Q339P268-R335 PolarHBondContact O-NH1 3.16Å; L271-R335 HydrophobicContact CD2-CB 4.32Å; T272-R335 PolarHBondContact OG1-NH1 3.14Å; E331-R335 WeakPolarHBondContact O-CG 3.43Å; E331-R335 PolarHBondContact O-N 3.32Å; E331-R335 IonicContact OE1-CZ 2.75Å; E331-R335 VanDerWaalsContact OE1-CZ 3.27Å; E331-R335 IonicContact OE1-NE 3.86Å; E331-R335 PolarHBondContact OE1-NE 3.45Å; E331-R335 VanDerWaalsContact OE1-NE 3.17Å; E331-R335 IonicContact OE1-NH2 3.24Å; E331-R335 PolarHBondContact OE1-NH2 2.86Å; Y332-R335 PolarHBondContact O-N 2.94Å; R335-Q338 PolarHBondContact O-N 2.97Å; R335-Q339 WeakPolarHBondContact O-CG 3.18Å; R335-Q339 PolarHBondContact O-N 2.69Å
336M77.4Confident76.5Confident2 Ų242.7 Ų42.71%0.0120%0.199CC..Hα-helixtrans-53.8-56.4176.6-80.5-61.2-46.300111.3L271 F275 L319 M320 Y332 L333 Q338 Q339 T340 F374L271-M336 HydrophobicContact CD1-SD 3.67Å; L271-M336 HydrophobicContact CD2-CG 3.84Å; L271-M336 HydrophobicContact CD2-SD 3.67Å; L271-M336 HydrophobicContact CG-SD 4.14Å; F275-M336 HydrophobicContact CE2-CE 4.05Å; F275-M336 HydrophobicContact CE2-SD 3.59Å; F275-M336 VanDerWaalsContact CE2-SD 3.59Å; F275-M336 HydrophobicContact CZ-CE 3.67Å; F275-M336 HydrophobicContact CZ-SD 3.86Å; L319-M336 HydrophobicContact CD2-SD 4.24Å; M320-M336 HydrophobicContact CE-CE 3.63Å; M320-M336 HydrophobicContact CG-CE 3.99Å; M320-M336 HydrophobicContact SD-CE 3.2Å; M320-M336 WeakPolarHBondContact SD-CE 3.4Å; M320-M336 HydrophobicContact SD-SD 4.08Å; Y332-M336 HydrophobicContact CD1-CG 4.22Å; Y332-M336 HydrophobicContact CD2-CG 4.49Å; Y332-M336 HydrophobicContact CE1-CG 3.9Å; Y332-M336 HydrophobicContact CE2-CG 4.19Å; Y332-M336 HydrophobicContact CE2-SD 4.36Å; Y332-M336 HydrophobicContact CG-CG 4.5Å; Y332-M336 WeakPolarHBondContact O-CB 3.46Å; Y332-M336 WeakPolarHBondContact O-CG 3.43Å; Y332-M336 PolarHBondContact O-N 2.98Å; L333-M336 WeakPolarHBondContact O-CB 3.26Å; L333-M336 PolarHBondContact O-N 2.96Å; M336-Q338 PolarHBondContact O-N 3.1Å; M336-Q339 PolarHBondContact O-N 2.6Å; M336-T340 PolarHBondContact O-N 3.14Å; M336-T340 PolarHBondContact O-OG1 3.37Å; M336-F374 HydrophobicContact CE-CE2 3.78Å; M336-F374 HydrophobicContact CE-CZ 4.05Å
337F78Confident77.4Confident17 Ų1742.4 Ų42.48%0.07520%0.197CC..Hα-helixtrans-69.1-37.6-176.982.5-110.2000112.2L333 L334 Q339 T340 F341 F378 I386 Y389 F392L333-F337 WeakPolarHBondContact O-CD1 3.48Å; L333-F337 PolarHBondContact O-N 3.05Å; L334-F337 VanDerWaalsContact CA-CE1 3.5Å; L334-F337 HydrophobicContact CB-CE1 4.24Å; L334-F337 HydrophobicContact CD1-CD1 4.38Å; L334-F337 HydrophobicContact CD1-CE1 3.31Å; L334-F337 HydrophobicContact CD1-CE2 4.31Å; L334-F337 HydrophobicContact CD1-CZ 3.25Å; L334-F337 HydrophobicContact CG-CE1 4.31Å; L334-F337 WeakPolarHBondContact O-CD1 3.34Å; F337-Q339 VanDerWaalsContact C-N 3.28Å; F337-Q339 PolarHBondContact O-N 3.41Å; F337-T340 WeakPolarHBondContact O-CB 3.25Å; F337-T340 PolarHBondContact O-N 2.99Å; F337-F341 HydrophobicContact CD2-CD2 4.29Å; F337-F341 HydrophobicContact CD2-CE2 4.49Å; F337-F341 VanDerWaalsContact O-CD2 3.28Å; F337-F341 WeakPolarHBondContact O-CD2 3.43Å; F337-F341 PolarHBondContact O-N 3.25Å; F337-F378 HydrophobicContact CB-CE2 4.43Å; F337-F378 HydrophobicContact CB-CZ 4.29Å; F337-I386 HydrophobicContact CB-CG2 4.29Å; F337-I386 HydrophobicContact CD1-CG2 4.26Å; F337-Y389 HydrophobicContact CE1-CD1 4.49Å; F337-F392 HydrophobicContact CB-CD2 4.27Å; F337-F392 HydrophobicContact CB-CE2 4.02Å; F337-F392 HydrophobicContact CD1-CD2 4.41Å; F337-F392 HydrophobicContact CD2-CD2 4.14Å; F337-F392 HydrophobicContact CD2-CE2 4.44Å; F337-F392 HydrophobicContact CG-CD2 4.06Å; F337-F392 HydrophobicContact CG-CE2 4.29Å
338Q79.7Confident78.3Confident25 Ų2534.5 Ų34.512%0.11716%0.159CC..Hα-helixtrans-58.3-42.6177.4-74.6174.6-1.100111.7L222 L334 R335 M336 Y342L222-Q338 VanDerWaalsContact CD2-CD 3.47Å; L222-Q338 HydrophobicContact CD2-CG 3.83Å; L334-Q338 HydrophobicContact CD1-CG 4.37Å; L334-Q338 VanDerWaalsContact CD1-NE2 3.26Å; L334-Q338 WeakPolarHBondContact O-CB 3.41Å; L334-Q338 WeakPolarHBondContact O-CG 3.49Å; L334-Q338 PolarHBondContact O-N 3.5Å; L334-Q338 VanDerWaalsContact O-N 3.07Å; R335-Q338 PolarHBondContact O-N 2.97Å; M336-Q338 PolarHBondContact O-N 3.1Å; Q338-Y342 WeakPolarHBondContact O-CB 3.43Å; Q338-Y342 PolarHBondContact O-N 2.89Å
339Q82.1Confident78.9Confident9 Ų936.1 Ų36.14%0.04216%0.164CC..Hα-helixtrans-72.8-37.8177.8-60.6-74.3-0.900111.8L231 F275 R335 M336 F337 F341 Y342 L343L231-Q339 VanDerWaalsContact CD2-CD 3.48Å; L231-Q339 VanDerWaalsContact CD2-NE2 3.33Å; L231-Q339 VanDerWaalsContact CD2-OE1 3.28Å; F275-Q339 HydrophobicContact CB-CB 4.07Å; F275-Q339 HydrophobicContact CB-CG 3.85Å; F275-Q339 HydrophobicContact CD1-CB 3.48Å; F275-Q339 VanDerWaalsContact CD1-CB 3.48Å; F275-Q339 HydrophobicContact CD1-CG 4.2Å; F275-Q339 HydrophobicContact CD2-CB 3.84Å; F275-Q339 HydrophobicContact CD2-CG 3.82Å; F275-Q339 HydrophobicContact CE1-CB 3.77Å; F275-Q339 HydrophobicContact CE2-CB 4.11Å; F275-Q339 HydrophobicContact CE2-CG 4.42Å; F275-Q339 HydrophobicContact CG-CB 3.53Å; F275-Q339 HydrophobicContact CG-CG 3.7Å; F275-Q339 HydrophobicContact CZ-CB 4.09Å; R335-Q339 WeakPolarHBondContact O-CG 3.18Å; R335-Q339 PolarHBondContact O-N 2.69Å; M336-Q339 PolarHBondContact O-N 2.6Å; F337-Q339 VanDerWaalsContact C-N 3.28Å; F337-Q339 PolarHBondContact O-N 3.41Å; Q339-F341 PolarHBondContact O-N 3Å; Q339-Y342 PolarHBondContact O-N 2.76Å; Q339-L343 WeakPolarHBondContact O-CG 3.33Å; Q339-L343 PolarHBondContact O-N 2.85Å
340T82.1Confident78.6Confident0 Ų038.6 Ų38.60%018%0.18CC..Hα-helixtrans-54.6-52171.1-57.80000111M336 F337 Y342 L343 L344 F374 L375 F397M336-T340 PolarHBondContact O-N 3.14Å; M336-T340 PolarHBondContact O-OG1 3.37Å; F337-T340 WeakPolarHBondContact O-CB 3.25Å; F337-T340 PolarHBondContact O-N 2.99Å; T340-Y342 PolarHBondContact O-N 2.73Å; T340-L343 PolarHBondContact O-N 2.91Å; T340-L344 VanDerWaalsContact O-CB 3.23Å; T340-L344 WeakPolarHBondContact O-CB 3.37Å; T340-L344 PolarHBondContact O-N 3.24Å; T340-F374 HydrophobicContact CG2-CE1 3.81Å; T340-F374 HydrophobicContact CG2-CZ 4.3Å; T340-F374 WeakPolarHBondContact OG1-CE1 3.46Å; T340-F374 WeakPolarHBondContact OG1-CZ 3.44Å; T340-L375 HydrophobicContact CG2-CD2 4.22Å; T340-F397 HydrophobicContact CG2-CE2 4.38Å
341F82.2Confident77.9Confident10 Ų1034 Ų344%0.04416%0.16CC..Hα-helixtrans-60.5-46.2179.1-93.4-100.9000111.8L218 F337 Q339 L344 Q345 F392 P393 E396 F397 L400L218-F341 HydrophobicContact CD2-CB 4.4Å; F337-F341 HydrophobicContact CD2-CD2 4.29Å; F337-F341 HydrophobicContact CD2-CE2 4.49Å; F337-F341 VanDerWaalsContact O-CD2 3.28Å; F337-F341 WeakPolarHBondContact O-CD2 3.43Å; F337-F341 PolarHBondContact O-N 3.25Å; Q339-F341 PolarHBondContact O-N 3Å; F341-L344 PolarHBondContact O-N 3.21Å; F341-Q345 WeakPolarHBondContact O-CB 3.33Å; F341-Q345 PolarHBondContact O-N 3.42Å; F341-F392 HydrophobicContact CE2-CD2 4.31Å; F341-F392 AromaticContact CE2-CE2 3.56Å; F341-F392 HydrophobicContact CE2-CE2 3.56Å; F341-F392 HydrophobicContact CE2-CZ 4.04Å; F341-F392 HydrophobicContact CZ-CE2 4.26Å; F341-F392 HydrophobicContact CZ-CZ 4.49Å; F341-P393 HydrophobicContact CE1-CG 3.79Å; F341-P393 HydrophobicContact CE2-CG 4.36Å; F341-P393 HydrophobicContact CZ-CG 3.59Å; F341-P393 WeakPolarHBondContact CZ-O 3.49Å; F341-E396 HydrophobicContact CE1-CB 3.99Å; F341-F397 HydrophobicContact CE1-CB 4.12Å; F341-F397 HydrophobicContact CE2-CB 3.91Å; F341-F397 HydrophobicContact CE2-CD2 4.21Å; F341-F397 HydrophobicContact CE2-CG 4.47Å; F341-F397 HydrophobicContact CZ-CB 3.41Å; F341-F397 VanDerWaalsContact CZ-CB 3.41Å; F341-F397 HydrophobicContact CZ-CD2 4.45Å; F341-F397 HydrophobicContact CZ-CG 4.4Å; F341-L400 HydrophobicContact CD1-CD1 3.94Å; F341-L400 HydrophobicContact CE1-CD1 4.37Å
342Y83.9Confident76.9Confident21 Ų2136.7 Ų36.78%0.08218%0.177CC..Hα-helixtrans-58.4-50178.2175.1-89.5000112.1L218 L231 R279 Q338 Q339 T340 K346L218-Y342 HydrophobicContact CD1-CD2 3.79Å; L218-Y342 HydrophobicContact CD1-CG 4.44Å; L231-Y342 HydrophobicContact CB-CD2 4.11Å; L231-Y342 HydrophobicContact CB-CE2 4.27Å; L231-Y342 VanDerWaalsContact O-CE2 3.22Å; L231-Y342 WeakPolarHBondContact O-CE2 3.32Å; L231-Y342 VanDerWaalsContact O-CZ 3.27Å; L231-Y342 PolarHBondContact O-OH 3.38Å; L231-Y342 VanDerWaalsContact O-OH 3.14Å; R279-Y342 HydrophobicContact CG-CE1 3.92Å; R279-Y342 VanDerWaalsContact NE-CE1 3.29Å; Q338-Y342 WeakPolarHBondContact O-CB 3.43Å; Q338-Y342 PolarHBondContact O-N 2.89Å; Q339-Y342 PolarHBondContact O-N 2.76Å; T340-Y342 PolarHBondContact O-N 2.73Å; Y342-K346 HydrophobicContact CE1-CD 3.95Å; Y342-K346 VanDerWaalsContact O-CB 3.23Å; Y342-K346 WeakPolarHBondContact O-CB 3.48Å; Y342-K346 PolarHBondContact O-N 3.12Å; Y342-K346 PolarHBondContact OH-NZ 2.83Å
343L86.4Confident75.5Confident0 Ų041.5 Ų41.50%022%0.217CC..Hα-helixtrans-63.9-46.8179.1-69.8178.4000111.1F275 A278 R279 M313 Q339 T340 Q345 K346 I347 F371F275-L343 HydrophobicContact CD1-CD1 3.91Å; F275-L343 HydrophobicContact CE1-CD1 4.15Å; A278-L343 HydrophobicContact CB-CD1 4.2Å; R279-L343 HydrophobicContact CG-CD2 3.99Å; M313-L343 HydrophobicContact SD-CD1 4.35Å; Q339-L343 WeakPolarHBondContact O-CG 3.33Å; Q339-L343 PolarHBondContact O-N 2.85Å; T340-L343 PolarHBondContact O-N 2.91Å; L343-Q345 PolarHBondContact O-N 3.32Å; L343-K346 PolarHBondContact O-N 3.42Å; L343-I347 WeakPolarHBondContact O-CB 3.47Å; L343-I347 VanDerWaalsContact O-CG1 3.25Å; L343-I347 WeakPolarHBondContact O-CG1 3.36Å; L343-I347 PolarHBondContact O-N 3.43Å; L343-F371 HydrophobicContact CB-CE2 3.7Å; L343-F371 HydrophobicContact CB-CZ 4.13Å; L343-F371 HydrophobicContact CD1-CE2 4.14Å
344L86.2Confident74.2Confident0 Ų049.2 Ų49.20%025%0.253CS..Hα-helixtrans-62.6-45.2-179.1-169.864.5000111.5T340 F341 K346 I347 T348 F371 L375 F397 L400 Y404T340-L344 VanDerWaalsContact O-CB 3.23Å; T340-L344 WeakPolarHBondContact O-CB 3.37Å; T340-L344 PolarHBondContact O-N 3.24Å; F341-L344 PolarHBondContact O-N 3.21Å; L344-K346 VanDerWaalsContact C-N 3.32Å; L344-K346 PolarHBondContact O-N 3.42Å; L344-I347 PolarHBondContact O-N 3.24Å; L344-T348 HydrophobicContact CD1-CG2 4.34Å; L344-T348 WeakPolarHBondContact O-CB 3.38Å; L344-T348 WeakPolarHBondContact O-CG2 3.49Å; L344-T348 PolarHBondContact O-N 3.3Å; L344-T348 PolarHBondContact O-OG1 3.33Å; L344-F371 HydrophobicContact CB-CZ 4.09Å; L344-F371 HydrophobicContact CD1-CE1 3.65Å; L344-F371 HydrophobicContact CD1-CZ 3.99Å; L344-L375 HydrophobicContact CD1-CD1 4.08Å; L344-L375 HydrophobicContact CD1-CD2 4.47Å; L344-F397 HydrophobicContact CD2-CD2 4.26Å; L344-F397 HydrophobicContact CD2-CE2 4.2Å; L344-L400 HydrophobicContact CD2-CB 3.44Å; L344-L400 VanDerWaalsContact CD2-CB 3.44Å; L344-L400 HydrophobicContact CD2-CD1 4.35Å; L344-L400 HydrophobicContact CG-CB 3.77Å; L344-L400 HydrophobicContact CG-CD1 4.5Å; L344-Y404 HydrophobicContact CD1-CD2 3.98Å; L344-Y404 HydrophobicContact CD1-CG 3.94Å
345Q84.9Confident72.9Confident40 Ų4050.9 Ų50.919%0.18727%0.265CS..Hα-helixtrans-62.5-39.8175.1-171.5-171.5-6.500111.4D216 F341 L343 K349 L400D216-Q345 PolarHBondContact OD1-NE2 3.09Å; F341-Q345 WeakPolarHBondContact O-CB 3.33Å; F341-Q345 PolarHBondContact O-N 3.42Å; L343-Q345 PolarHBondContact O-N 3.32Å; Q345-K349 WeakPolarHBondContact O-CB 3.33Å; Q345-K349 PolarHBondContact O-N 3.09Å; Q345-K349 VanDerWaalsContact O-N 3.09Å; Q345-L400 HydrophobicContact CB-CD1 4.16Å; Q345-L400 HydrophobicContact CB-CD2 4.31Å; Q345-L400 HydrophobicContact CG-CD2 4.44Å
346K82.9Confident71.6Confident42 Ų4255 Ų5518%0.18330%0.298CS..Hα-helixtrans-66.4-41.7178.4-171.2171.9-173.4172.20111.6C282 Y342 L343 L344 R359C282-K346 HydrophobicContact CB-CD 3.94Å; C282-K346 HydrophobicContact CB-CG 4.25Å; Y342-K346 HydrophobicContact CE1-CD 3.95Å; Y342-K346 VanDerWaalsContact O-CB 3.23Å; Y342-K346 WeakPolarHBondContact O-CB 3.48Å; Y342-K346 PolarHBondContact O-N 3.12Å; Y342-K346 PolarHBondContact OH-NZ 2.83Å; L343-K346 PolarHBondContact O-N 3.42Å; L344-K346 VanDerWaalsContact C-N 3.32Å; L344-K346 PolarHBondContact O-N 3.42Å; K346-R359 PolarHBondContact O-NH1 2.63Å
347I85.1Confident70.6Confident3 Ų361.4 Ų61.42%0.01533%0.325CS..Hα-helixtrans-71-36.4179.8-68.6165000111.2L343 L344 L360 L363 Y367 F371 Y404L343-I347 WeakPolarHBondContact O-CB 3.47Å; L343-I347 VanDerWaalsContact O-CG1 3.25Å; L343-I347 WeakPolarHBondContact O-CG1 3.36Å; L343-I347 PolarHBondContact O-N 3.43Å; L344-I347 PolarHBondContact O-N 3.24Å; I347-L360 HydrophobicContact CG2-CD2 3.24Å; I347-L360 HydrophobicContact CG2-CG 4.11Å; I347-L363 HydrophobicContact CG1-CD1 4.23Å; I347-L363 HydrophobicContact CG2-CD1 3.94Å; I347-Y367 HydrophobicContact CD1-CE1 3.88Å; I347-F371 HydrophobicContact CD1-CD1 3.83Å; I347-F371 HydrophobicContact CD1-CD2 4.07Å; I347-F371 HydrophobicContact CD1-CE1 3.73Å; I347-F371 HydrophobicContact CD1-CE2 4Å; I347-F371 HydrophobicContact CD1-CG 3.99Å; I347-F371 HydrophobicContact CD1-CZ 3.82Å; I347-Y404 HydrophobicContact CG2-CD2 4.19Å; I347-Y404 HydrophobicContact CG2-CE2 4.11Å
348T82.7Confident70.2Confident15 Ų1561.4 Ų61.49%0.09233%0.327CS..THydrogen-bonded Turntrans-91.99.6-178.758.90000114.4L344 D350 K403 Y404L344-T348 HydrophobicContact CD1-CG2 4.34Å; L344-T348 WeakPolarHBondContact O-CB 3.38Å; L344-T348 WeakPolarHBondContact O-CG2 3.49Å; L344-T348 PolarHBondContact O-N 3.3Å; L344-T348 PolarHBondContact O-OG1 3.33Å; T348-D350 PolarHBondContact O-N 2.86Å; T348-K403 HydrophobicContact CG2-CB 4.17Å; T348-Y404 HydrophobicContact CG2-CD2 4.24Å
349K79.5Confident70.2Confident143 Ų14362 Ų6262%0.62233%0.329SS*.PPolyproline II helixtrans-69.9124.1178.7-171.8172.8-177.6171.50110.3Q345 N351Q345-K349 WeakPolarHBondContact O-CB 3.33Å; Q345-K349 PolarHBondContact O-N 3.09Å; Q345-K349 VanDerWaalsContact O-N 3.09Å; K349-N351 PolarHBondContact O-N 2.93Å
350D64.1Low70.3Confident107 Ų10761.7 Ų61.757%0.57233%0.327SS*.PPolyproline II helixtrans-57.6127.6177.7-55.5-38.6000110.3T348 K403T348-D350 PolarHBondContact O-N 2.86Å; D350-K403 IonicContact OD2-NZ 3.53Å
351N54Low70.3Confident53 Ų5366.1 Ų66.128%0.28335%0.348SS..PPolyproline II helixtrans-69.1151.5167.8-88.6-18.7000108.6K349 T355K349-N351 PolarHBondContact O-N 2.93Å; N351-T355 WeakPolarHBondContact CB-OG1 3.31Å
352N49.4Very low70.3Confident142 Ų14268.1 Ų68.176%0.75936%0.357SS*.  trans-39.6144.2-179.3-68.1-19.1000112.3H354 T355N352-H354 PolarHBondContact O-N 3.04Å; N352-T355 PolarHBondContact O-N 3.47Å; N352-T355 PolarHBondContact O-OG1 3.33Å
353A45.1Very low70.3Confident104 Ų10467.6 Ų67.686%0.8636%0.356SS*.THydrogen-bonded Turntrans-52.65.9-170.300000118.3
354H43.5Very low70.2Confident183 Ų18369.9 Ų69.985%0.84737%0.368SS*.THydrogen-bonded Turntrans-1150.2-178.5-62.1-46.9000114.7N352N352-H354 PolarHBondContact O-N 3.04Å
355T45.1Very low70.3Confident84 Ų8476.7 Ų76.752%0.51540%0.4SS..  trans-115.3122.3174.948.80000111.5N351 N352 K357N351-T355 WeakPolarHBondContact CB-OG1 3.31Å; N352-T355 PolarHBondContact O-N 3.47Å; N352-T355 PolarHBondContact O-OG1 3.33Å; T355-K357 VanDerWaalsContact C-N 3.28Å; T355-K357 PolarHBondContact O-N 3.5Å
356V49.3Very low70.5Confident156 Ų15677.5 Ų77.595%0.94541%0.41SS*.  trans-76.6-12.9179.8-178.40000112.7
357K56.6Low70.9Confident136 Ų13675.6 Ų75.659%0.59140%0.402SS*.SBendtrans-84.4136.1-174.7-67.5-168.5169.7-154.40113T355 E361T355-K357 VanDerWaalsContact C-N 3.28Å; T355-K357 PolarHBondContact O-N 3.5Å; K357-E361 WeakPolarHBondContact CD-OE2 3.39Å
358S70.3Confident71.2Confident17 Ų1776.2 Ų76.212%0.11941%0.405CS..  trans-63.3139.9174.5173.20000110.4L360 E361 H407S358-L360 PolarHBondContact O-N 2.64Å; S358-L360 VanDerWaalsContact O-N 3.17Å; S358-L360 WeakPolarHBondContact OG-CB 3.48Å; S358-L360 PolarHBondContact OG-N 3.15Å; S358-E361 WeakPolarHBondContact O-CB 3.37Å; S358-E361 PolarHBondContact O-N 2.89Å; S358-E361 VanDerWaalsContact O-N 3.16Å; S358-H407 PolarHBondContact OG-O 3.46Å; S358-H407 VanDerWaalsContact OG-O 3.04Å
359R79.3Confident71.6Confident38 Ų3880.4 Ų80.414%0.14342%0.423CS..G310 helixtrans-58.3-27.6173.1-175.8173.8176174.8-6.3112.1C282 I284 K346 E361 E362C282-R359 PolarHBondContact O-NH2 3.33Å; I284-R359 HydrophobicContact CD1-CG 3.6Å; I284-R359 VanDerWaalsContact CD1-NE 3.3Å; K346-R359 PolarHBondContact O-NH1 2.63Å; R359-E361 VanDerWaalsContact C-N 3.32Å; R359-E361 PolarHBondContact O-N 3.22Å; R359-E362 PolarHBondContact O-N 3.39Å; R359-E362 VanDerWaalsContact O-N 3.15Å
360L84.1Confident72.3Confident2 Ų276.2 Ų76.21%0.0141%0.405CS..G310 helixtrans-62.4-36.6178.2-72.2165.4000112.3I347 S358 E362 L363 I368 Y404 H407I347-L360 HydrophobicContact CG2-CD2 3.24Å; I347-L360 HydrophobicContact CG2-CG 4.11Å; S358-L360 PolarHBondContact O-N 2.64Å; S358-L360 VanDerWaalsContact O-N 3.17Å; S358-L360 WeakPolarHBondContact OG-CB 3.48Å; S358-L360 PolarHBondContact OG-N 3.15Å; L360-E362 PolarHBondContact O-N 3.48Å; L360-L363 HydrophobicContact CD2-CD1 4.29Å; L360-L363 PolarHBondContact O-N 3.43Å; L360-L363 VanDerWaalsContact O-N 3.13Å; L360-I368 HydrophobicContact CD2-CD1 4.44Å; L360-I368 HydrophobicContact CD2-CG1 4.45Å; L360-I368 WeakPolarHBondContact O-CD1 3.5Å; L360-Y404 HydrophobicContact CD1-CD2 4.18Å; L360-Y404 HydrophobicContact CD1-CE2 4.39Å; L360-Y404 HydrophobicContact CD2-CD2 4.1Å; L360-Y404 HydrophobicContact CD2-CE2 3.7Å; L360-H407 HydrophobicContact CD1-CB 3.81Å; L360-H407 VanDerWaalsContact CD1-O 3.26Å; L360-H407 WeakPolarHBondContact CD1-O 3.44Å
361E82.1Confident73.7Confident92 Ų9271.2 Ų71.243%0.4338%0.378SS..G310 helixtrans-61.6-25.9176.3-68.2170.6-140.700112.5K357 S358 R359 P409K357-E361 WeakPolarHBondContact CD-OE2 3.39Å; S358-E361 WeakPolarHBondContact O-CB 3.37Å; S358-E361 PolarHBondContact O-N 2.89Å; S358-E361 VanDerWaalsContact O-N 3.16Å; R359-E361 VanDerWaalsContact C-N 3.32Å; R359-E361 PolarHBondContact O-N 3.22Å; E361-P409 HydrophobicContact CG-CB 3.9Å
362E81.4Confident75.6Confident52 Ų5269.1 Ų69.124%0.24337%0.367CS..G310 helixtrans-85.7-7.8-178.8-60-173.8160.900113.3I284 R287 R359 L360I284-E362 HydrophobicContact CD1-CB 4.29Å; I284-E362 HydrophobicContact CG1-CB 4.34Å; I284-E362 HydrophobicContact CG2-CB 4.25Å; R287-E362 PolarHBondContact NH1-O 3.03Å; R359-E362 PolarHBondContact O-N 3.39Å; R359-E362 VanDerWaalsContact O-N 3.15Å; L360-E362 PolarHBondContact O-N 3.48Å
363L84.4Confident77.7Confident11 Ų1165.1 Ų65.16%0.05835%0.346CS..SBendtrans-87.4173.8-179.3-59.4-176.7000112.2I284 R287 I347 L360 I368I284-L363 HydrophobicContact CD1-CD2 4.24Å; I284-L363 HydrophobicContact CG1-CD2 3.88Å; R287-L363 PolarHBondContact NH1-O 2.89Å; R287-L363 PolarHBondContact NH2-O 3.37Å; I347-L363 HydrophobicContact CG1-CD1 4.23Å; I347-L363 HydrophobicContact CG2-CD1 3.94Å; L360-L363 HydrophobicContact CD2-CD1 4.29Å; L360-L363 PolarHBondContact O-N 3.43Å; L360-L363 VanDerWaalsContact O-N 3.13Å; L363-I368 HydrophobicContact CB-CD1 4.15Å; L363-I368 HydrophobicContact CB-CG1 4.17Å
364D84.4Confident80Confident48 Ų4860.1 Ų60.126%0.25731%0.305SS..  trans-78.3127.3171-173-15.8000109.4S366 Y367 I368D364-S366 VanDerWaalsContact C-N 3.28Å; D364-S366 PolarHBondContact O-N 3.02Å; D364-S366 PolarHBondContact OD1-N 3.29Å; D364-Y367 WeakPolarHBondContact O-CB 3.24Å; D364-Y367 PolarHBondContact O-N 2.9Å; D364-I368 WeakPolarHBondContact O-CG1 3.35Å; D364-I368 PolarHBondContact O-N 2.83Å; D364-I368 VanDerWaalsContact O-N 3.08Å
365E87.3Confident82.4Confident143 Ų14351.4 Ų51.467%0.66827%0.265SS*.Hα-helixtrans-57.2-41.8179.3-175.2175.5-169.900111.7Y367 I368 E369E365-Y367 PolarHBondContact O-N 3.24Å; E365-I368 PolarHBondContact O-N 3.37Å; E365-I368 VanDerWaalsContact O-N 3.12Å; E365-E369 PolarHBondContact O-N 2.87Å
366S89.3Confident84.8Confident57 Ų5753.5 Ų53.540%0.39926%0.263SS..Hα-helixtrans-62.2-31.9176.8-66.50000112.2D364 K370D364-S366 VanDerWaalsContact C-N 3.28Å; D364-S366 PolarHBondContact O-N 3.02Å; D364-S366 PolarHBondContact OD1-N 3.29Å; S366-K370 WeakPolarHBondContact O-CG 3.43Å; S366-K370 PolarHBondContact O-N 3.38Å
367Y91Very high86.8Confident1 Ų147.9 Ų47.90%0.00423%0.228CC..Hα-helixtrans-73.3-41175.5-179.3-95.7000111.7A278 C282 M313 I347 D364 E365 E369 K370 F371A278-Y367 WeakPolarHBondContact O-CE2 3.43Å; A278-Y367 PolarHBondContact O-OH 3.43Å; C282-Y367 PolarHBondContact SG-OH 3.45Å; M313-Y367 HydrophobicContact CG-CD2 3.95Å; M313-Y367 HydrophobicContact CG-CE2 3.41Å; M313-Y367 VanDerWaalsContact CG-CE2 3.41Å; M313-Y367 HydrophobicContact SD-CE2 4.38Å; I347-Y367 HydrophobicContact CD1-CE1 3.88Å; D364-Y367 WeakPolarHBondContact O-CB 3.24Å; D364-Y367 PolarHBondContact O-N 2.9Å; E365-Y367 PolarHBondContact O-N 3.24Å; Y367-E369 VanDerWaalsContact C-N 3.34Å; Y367-K370 PolarHBondContact O-N 2.94Å; Y367-F371 HydrophobicContact CE1-CB 4.48Å; Y367-F371 VanDerWaalsContact O-CB 3.29Å; Y367-F371 WeakPolarHBondContact O-CB 3.29Å; Y367-F371 PolarHBondContact O-N 3.14Å
368I91.4Very high88.3Confident17 Ų1741.4 Ų41.49%0.08720%0.2CC..Hα-helixtrans-62-43.5176.8-61.7171.3000110.4L360 L363 D364 E365 F371 T372 Y404 P409L360-I368 HydrophobicContact CD2-CD1 4.44Å; L360-I368 HydrophobicContact CD2-CG1 4.45Å; L360-I368 WeakPolarHBondContact O-CD1 3.5Å; L363-I368 HydrophobicContact CB-CD1 4.15Å; L363-I368 HydrophobicContact CB-CG1 4.17Å; D364-I368 WeakPolarHBondContact O-CG1 3.35Å; D364-I368 PolarHBondContact O-N 2.83Å; D364-I368 VanDerWaalsContact O-N 3.08Å; E365-I368 PolarHBondContact O-N 3.37Å; E365-I368 VanDerWaalsContact O-N 3.12Å; I368-F371 PolarHBondContact O-N 2.99Å; I368-T372 WeakPolarHBondContact O-CB 3.49Å; I368-T372 PolarHBondContact O-N 3.34Å; I368-T372 PolarHBondContact O-OG1 3.18Å; I368-Y404 WeakPolarHBondContact CG2-OH 3.4Å; I368-Y404 PolarHBondContact O-OH 2.95Å; I368-P409 HydrophobicContact CD1-CG 4.41Å
369E92.3Very high89.2Confident102 Ų10240.9 Ų40.948%0.47720%0.196SC..Hα-helixtrans-57.1-54.5175.3-170.9-163137.800110.7E365 Y367 F371 T372 D373E365-E369 PolarHBondContact O-N 2.87Å; Y367-E369 VanDerWaalsContact C-N 3.34Å; E369-F371 VanDerWaalsContact C-N 3.28Å; E369-F371 PolarHBondContact O-N 2.99Å; E369-T372 WeakPolarHBondContact O-CB 3.38Å; E369-T372 PolarHBondContact O-N 2.86Å; E369-D373 PolarHBondContact O-N 2.96Å
370K93.2Very high89.7Confident56 Ų5642 Ų4224%0.24321%0.209CC..Hα-helixtrans-63.1-32.8179.4-64.4-60.3168.9-141.70113.4V310 M313 N317 S366 Y367 D373 F374V310-K370 HydrophobicContact CG1-CG 4.15Å; M313-K370 HydrophobicContact CB-CB 3.84Å; N317-K370 PolarHBondContact ND2-O 2.74Å; S366-K370 WeakPolarHBondContact O-CG 3.43Å; S366-K370 PolarHBondContact O-N 3.38Å; Y367-K370 PolarHBondContact O-N 2.94Å; K370-D373 IonicContact NZ-OD2 3.86Å; K370-F374 WeakPolarHBondContact O-CB 3.29Å; K370-F374 PolarHBondContact O-N 2.87Å
371F93.8Very high89.7Confident1 Ų143.4 Ų43.40%0.00422%0.218CC..Hα-helixtrans-72.9-32.9174.8-171-101.3000112.6M313 L343 L344 I347 Y367 I368 E369 F374 L375 Y404M313-F371 HydrophobicContact CE-CB 4.42Å; M313-F371 HydrophobicContact CE-CD2 3.9Å; M313-F371 HydrophobicContact SD-CD2 4.23Å; L343-F371 HydrophobicContact CB-CE2 3.7Å; L343-F371 HydrophobicContact CB-CZ 4.13Å; L343-F371 HydrophobicContact CD1-CE2 4.14Å; L344-F371 HydrophobicContact CB-CZ 4.09Å; L344-F371 HydrophobicContact CD1-CE1 3.65Å; L344-F371 HydrophobicContact CD1-CZ 3.99Å; I347-F371 HydrophobicContact CD1-CD1 3.83Å; I347-F371 HydrophobicContact CD1-CD2 4.07Å; I347-F371 HydrophobicContact CD1-CE1 3.73Å; I347-F371 HydrophobicContact CD1-CE2 4Å; I347-F371 HydrophobicContact CD1-CG 3.99Å; I347-F371 HydrophobicContact CD1-CZ 3.82Å; Y367-F371 HydrophobicContact CE1-CB 4.48Å; Y367-F371 VanDerWaalsContact O-CB 3.29Å; Y367-F371 WeakPolarHBondContact O-CB 3.29Å; Y367-F371 PolarHBondContact O-N 3.14Å; I368-F371 PolarHBondContact O-N 2.99Å; E369-F371 VanDerWaalsContact C-N 3.28Å; E369-F371 PolarHBondContact O-N 2.99Å; F371-F374 HydrophobicContact CD2-CD1 4.16Å; F371-F374 AromaticContact CE2-CD1 3.99Å; F371-F374 HydrophobicContact CE2-CD1 3.99Å; F371-F374 HydrophobicContact CE2-CE1 4.37Å; F371-F374 WeakPolarHBondContact O-CB 3.49Å; F371-F374 PolarHBondContact O-N 3.45Å; F371-L375 HydrophobicContact CD1-CD1 4.12Å; F371-L375 HydrophobicContact CD1-CG 4.39Å; F371-L375 HydrophobicContact CE1-CD1 3.77Å; F371-L375 HydrophobicContact CE1-CD2 4.38Å; F371-L375 HydrophobicContact CE1-CG 4.06Å; F371-L375 HydrophobicContact CZ-CD2 4.35Å; F371-L375 HydrophobicContact CZ-CG 4.42Å; F371-L375 WeakPolarHBondContact O-CG 3.39Å; F371-L375 PolarHBondContact O-N 3.12Å; F371-Y404 AromaticContact CD1-CE2 3.79Å; F371-Y404 HydrophobicContact CD1-CE2 3.79Å; F371-Y404 AromaticContact CD1-CZ 3.82Å; F371-Y404 HydrophobicContact CE1-CD2 4.4Å; F371-Y404 AromaticContact CE1-CE2 3.99Å; F371-Y404 HydrophobicContact CE1-CE2 3.99Å
372T94.6Very high89.7Confident9 Ų939.1 Ų39.16%0.05520%0.198CC..Hα-helixtrans-69.6-42.9174.1-53.10000110.8I368 E369 F374 L375 R376 Y404 I420I368-T372 WeakPolarHBondContact O-CB 3.49Å; I368-T372 PolarHBondContact O-N 3.34Å; I368-T372 PolarHBondContact O-OG1 3.18Å; E369-T372 WeakPolarHBondContact O-CB 3.38Å; E369-T372 PolarHBondContact O-N 2.86Å; T372-F374 VanDerWaalsContact C-N 3.27Å; T372-F374 PolarHBondContact O-N 3.38Å; T372-L375 PolarHBondContact O-N 2.8Å; T372-R376 PolarHBondContact O-N 3.42Å; T372-Y404 PolarHBondContact OG1-OH 2.96Å; T372-I420 HydrophobicContact CG2-CD1 3.97Å
373D93.9Very high89.8Confident58 Ų5836.6 Ų36.631%0.3119%0.186SC..Hα-helixtrans-54.8-44.5170.2-74.6-21.3000111.6N317 E369 K370 R376 L377N317-D373 WeakPolarHBondContact ND2-CB 3.38Å; E369-D373 PolarHBondContact O-N 2.96Å; K370-D373 IonicContact NZ-OD2 3.86Å; D373-R376 WeakPolarHBondContact O-CB 3.36Å; D373-R376 PolarHBondContact O-N 2.98Å; D373-L377 WeakPolarHBondContact O-CG 3.4Å; D373-L377 PolarHBondContact O-N 3.4Å
374F93Very high89.7Confident0 Ų044.8 Ų44.80%022%0.216CC..Hα-helixtrans-58.9-49176.3170.3-116.9000112.1F275 M313 I316 N317 M320 M336 T340 K370 F371 T372 R376 L377 F378F275-F374 HydrophobicContact CE1-CZ 4.22Å; F275-F374 HydrophobicContact CZ-CE2 4.44Å; F275-F374 HydrophobicContact CZ-CZ 4.17Å; M313-F374 HydrophobicContact CE-CB 3.44Å; M313-F374 VanDerWaalsContact CE-CB 3.44Å; M313-F374 HydrophobicContact CE-CD1 4.07Å; M313-F374 HydrophobicContact CE-CD2 4.45Å; M313-F374 HydrophobicContact CE-CG 3.74Å; I316-F374 HydrophobicContact CG2-CD2 3.48Å; I316-F374 VanDerWaalsContact CG2-CD2 3.48Å; I316-F374 HydrophobicContact CG2-CE2 3.46Å; I316-F374 VanDerWaalsContact CG2-CE2 3.46Å; I316-F374 HydrophobicContact CG2-CG 4.38Å; I316-F374 HydrophobicContact CG2-CZ 4.33Å; N317-F374 WeakPolarHBondContact OD1-CA 3.27Å; N317-F374 WeakPolarHBondContact OD1-CB 3.17Å; N317-F374 PolarHBondContact OD1-N 3.32Å; M320-F374 HydrophobicContact CE-CE2 4.02Å; M320-F374 HydrophobicContact CG-CD2 4.11Å; M320-F374 HydrophobicContact CG-CE2 3.92Å; M320-F374 HydrophobicContact SD-CE2 4.49Å; M336-F374 HydrophobicContact CE-CE2 3.78Å; M336-F374 HydrophobicContact CE-CZ 4.05Å; T340-F374 HydrophobicContact CG2-CE1 3.81Å; T340-F374 HydrophobicContact CG2-CZ 4.3Å; T340-F374 WeakPolarHBondContact OG1-CE1 3.46Å; T340-F374 WeakPolarHBondContact OG1-CZ 3.44Å; K370-F374 WeakPolarHBondContact O-CB 3.29Å; K370-F374 PolarHBondContact O-N 2.87Å; F371-F374 HydrophobicContact CD2-CD1 4.16Å; F371-F374 AromaticContact CE2-CD1 3.99Å; F371-F374 HydrophobicContact CE2-CD1 3.99Å; F371-F374 HydrophobicContact CE2-CE1 4.37Å; F371-F374 WeakPolarHBondContact O-CB 3.49Å; F371-F374 PolarHBondContact O-N 3.45Å; T372-F374 VanDerWaalsContact C-N 3.27Å; T372-F374 PolarHBondContact O-N 3.38Å; F374-R376 VanDerWaalsContact C-N 3.29Å; F374-R376 PolarHBondContact O-N 3.32Å; F374-L377 PolarHBondContact O-N 2.99Å; F374-F378 VanDerWaalsContact O-CB 3.27Å; F374-F378 WeakPolarHBondContact O-CB 3.43Å; F374-F378 PolarHBondContact O-N 3.12Å
375L93.9Very high89.4Confident0 Ų046.2 Ų46.20%022%0.218CC..Hα-helixtrans-61.2-39.4177.7-69.6175.8000111.5T340 L344 F371 T372 F378 V379 F397 L401 Y404 I420T340-L375 HydrophobicContact CG2-CD2 4.22Å; L344-L375 HydrophobicContact CD1-CD1 4.08Å; L344-L375 HydrophobicContact CD1-CD2 4.47Å; F371-L375 HydrophobicContact CD1-CD1 4.12Å; F371-L375 HydrophobicContact CD1-CG 4.39Å; F371-L375 HydrophobicContact CE1-CD1 3.77Å; F371-L375 HydrophobicContact CE1-CD2 4.38Å; F371-L375 HydrophobicContact CE1-CG 4.06Å; F371-L375 HydrophobicContact CZ-CD2 4.35Å; F371-L375 HydrophobicContact CZ-CG 4.42Å; F371-L375 WeakPolarHBondContact O-CG 3.39Å; F371-L375 PolarHBondContact O-N 3.12Å; T372-L375 PolarHBondContact O-N 2.8Å; L375-F378 PolarHBondContact O-N 2.75Å; L375-V379 WeakPolarHBondContact O-CB 3.43Å; L375-V379 WeakPolarHBondContact O-CG2 3.34Å; L375-V379 PolarHBondContact O-N 2.84Å; L375-F397 HydrophobicContact CD2-CE2 4.34Å; L375-L401 HydrophobicContact CD1-CD1 4.22Å; L375-Y404 HydrophobicContact CD1-CD1 3.78Å; L375-Y404 HydrophobicContact CD1-CE1 3.71Å; L375-Y404 HydrophobicContact CD1-CG 4.39Å; L375-I420 HydrophobicContact CB-CD1 3.73Å
376R94.6Very high89Confident127 Ų12739.6 Ų39.648%0.47919%0.187SC..Hα-helixtrans-62.3-47175.1-173.3-177.8-179.3175.15.3112.2T372 D373 F374 V379 S380 I420 L423T372-R376 PolarHBondContact O-N 3.42Å; D373-R376 WeakPolarHBondContact O-CB 3.36Å; D373-R376 PolarHBondContact O-N 2.98Å; F374-R376 VanDerWaalsContact C-N 3.29Å; F374-R376 PolarHBondContact O-N 3.32Å; R376-V379 PolarHBondContact O-N 3.39Å; R376-S380 VanDerWaalsContact O-CB 3.3Å; R376-S380 WeakPolarHBondContact O-CB 3.41Å; R376-S380 PolarHBondContact O-N 3.19Å; R376-S380 PolarHBondContact O-OG 2.9Å; R376-I420 HydrophobicContact CB-CD1 4.22Å; R376-I420 HydrophobicContact CB-CG1 3.86Å; R376-I420 HydrophobicContact CG-CG1 4.34Å; R376-L423 HydrophobicContact CG-CD1 3.84Å
377L91Very high88.4Confident39 Ų3937.3 Ų37.320%0.20417%0.17CC..Hα-helixtrans-64.1-41.4175.7-70.2174.3000111.7N317 M320 D373 F374 S380 V381N317-L377 HydrophobicContact CB-CD1 4.09Å; N317-L377 WeakPolarHBondContact O-CD1 3.33Å; M320-L377 HydrophobicContact CB-CB 4.1Å; M320-L377 HydrophobicContact CB-CD1 4.12Å; D373-L377 WeakPolarHBondContact O-CG 3.4Å; D373-L377 PolarHBondContact O-N 3.4Å; F374-L377 PolarHBondContact O-N 2.99Å; L377-S380 PolarHBondContact O-OG 2.99Å; L377-V381 VanDerWaalsContact O-CB 3.31Å; L377-V381 WeakPolarHBondContact O-CB 3.48Å; L377-V381 PolarHBondContact O-N 2.86Å
378F88.4Confident87.6Confident0 Ų041.9 Ų41.90%020%0.202CC..Iπ-helixtrans-60.1-48.6177-178.3-93.3000111.6M320 F337 F374 L375 H382 L383 I386 F392 F397M320-F378 HydrophobicContact CE-CB 4.09Å; M320-F378 HydrophobicContact CE-CD2 3.83Å; M320-F378 HydrophobicContact CE-CG 4.45Å; F337-F378 HydrophobicContact CB-CE2 4.43Å; F337-F378 HydrophobicContact CB-CZ 4.29Å; F374-F378 VanDerWaalsContact O-CB 3.27Å; F374-F378 WeakPolarHBondContact O-CB 3.43Å; F374-F378 PolarHBondContact O-N 3.12Å; L375-F378 PolarHBondContact O-N 2.75Å; F378-H382 CarbonylContact O-C 3.6Å; F378-H382 PolarHBondContact O-N 3.29Å; F378-H382 VanDerWaalsContact O-N 3.12Å; F378-L383 HydrophobicContact CE1-CD1 4.42Å; F378-L383 PolarHBondContact O-N 3.3Å; F378-I386 HydrophobicContact CD2-CD1 4.23Å; F378-I386 HydrophobicContact CE2-CD1 3.34Å; F378-I386 HydrophobicContact CZ-CD1 3.58Å; F378-F392 HydrophobicContact CE1-CZ 4.5Å; F378-F392 HydrophobicContact CZ-CE2 4.38Å; F378-F392 HydrophobicContact CZ-CZ 4.46Å; F378-F397 HydrophobicContact CD1-CE2 4.28Å; F378-F397 HydrophobicContact CD1-CZ 4.14Å; F378-F397 HydrophobicContact CE1-CE2 4.09Å; F378-F397 HydrophobicContact CE1-CZ 4.16Å
379V90.6Very high86.8Confident6 Ų645.3 Ų45.34%0.03621%0.214CC..Iπ-helixtrans-69.8-44.8-179.8172.90000112.1L375 R376 L383 F397 I420 L423 F424L375-V379 WeakPolarHBondContact O-CB 3.43Å; L375-V379 WeakPolarHBondContact O-CG2 3.34Å; L375-V379 PolarHBondContact O-N 2.84Å; R376-V379 PolarHBondContact O-N 3.39Å; V379-L383 HydrophobicContact CG1-CD2 4.08Å; V379-L383 WeakPolarHBondContact O-CB 3.48Å; V379-F397 HydrophobicContact CG2-CE1 4.1Å; V379-F397 HydrophobicContact CG2-CZ 3.94Å; V379-I420 HydrophobicContact CB-CG2 4Å; V379-I420 HydrophobicContact CG1-CG2 4.28Å; V379-I420 HydrophobicContact CG2-CG2 3.66Å; V379-L423 HydrophobicContact CG1-CB 4.07Å; V379-F424 HydrophobicContact CG1-CB 4.03Å
380S89.6Confident85.6Confident62 Ų6245.9 Ų45.943%0.43423%0.23SC..Iπ-helixtrans-71.8-40.5-176.3550000113.9R376 L377R376-S380 VanDerWaalsContact O-CB 3.3Å; R376-S380 WeakPolarHBondContact O-CB 3.41Å; R376-S380 PolarHBondContact O-N 3.19Å; R376-S380 PolarHBondContact O-OG 2.9Å; L377-S380 PolarHBondContact O-OG 2.99Å
381V84.3Confident84.5Confident30 Ų3048.4 Ų48.418%0.18224%0.243CC..Iπ-helixtrans-100.5-42.7-169.9-177.20000112.2N323 L377N323-V381 WeakPolarHBondContact OD1-CG1 3.49Å; L377-V381 VanDerWaalsContact O-CB 3.31Å; L377-V381 WeakPolarHBondContact O-CB 3.48Å; L377-V381 PolarHBondContact O-N 2.86Å
382H80.6Confident83.7Confident2 Ų248.6 Ų48.61%0.00924%0.243CC..Iπ-helixtrans-110.6-26.5-163-62.9-77.6000114.5M320 F378 R384 R385 I386M320-H382 HydrophobicContact CE-CB 4.32Å; M320-H382 WeakPolarHBondContact CE-CD2 3.35Å; M320-H382 PolarHBondContact O-NE2 3.26Å; F378-H382 CarbonylContact O-C 3.6Å; F378-H382 PolarHBondContact O-N 3.29Å; F378-H382 VanDerWaalsContact O-N 3.12Å; H382-R384 VanDerWaalsContact C-N 3.3Å; H382-R384 PolarHBondContact O-N 2.96Å; H382-R385 PolarHBondContact O-N 2.55Å; H382-I386 HydrophobicContact CB-CD1 3.98Å; H382-I386 WeakPolarHBondContact O-CG1 3.5Å; H382-I386 PolarHBondContact O-N 3.48Å; H382-I386 VanDerWaalsContact O-N 3.09Å
383L83.9Confident83.2Confident0 Ų048.8 Ų48.80%025%0.245CC..Hα-helixtrans-54.4-42.7-176179.468.6000113F378 V379 R385 I386 E387 F392 F424 Y427F378-L383 HydrophobicContact CE1-CD1 4.42Å; F378-L383 PolarHBondContact O-N 3.3Å; V379-L383 HydrophobicContact CG1-CD2 4.08Å; V379-L383 WeakPolarHBondContact O-CB 3.48Å; L383-R385 PolarHBondContact O-N 2.96Å; L383-R385 VanDerWaalsContact O-N 3.16Å; L383-I386 PolarHBondContact O-N 3.13Å; L383-I386 VanDerWaalsContact O-N 3.14Å; L383-E387 HydrophobicContact CD1-CB 4.33Å; L383-E387 VanDerWaalsContact O-CB 3.3Å; L383-E387 WeakPolarHBondContact O-CB 3.22Å; L383-E387 PolarHBondContact O-N 3.04Å; L383-F392 HydrophobicContact CD1-CE1 3.97Å; L383-F392 HydrophobicContact CD1-CZ 4.17Å; L383-F424 HydrophobicContact CD2-CD2 3.55Å; L383-F424 HydrophobicContact CD2-CE2 4.03Å; L383-Y427 HydrophobicContact CD2-CD1 4.24Å
384R82.4Confident82.7Confident182 Ų18246 Ų4669%0.68723%0.23SC*.Hα-helixtrans-55.1-35178.2176.8167.8-173.9-171.13.5112.9H382 Y427H382-R384 VanDerWaalsContact C-N 3.3Å; H382-R384 PolarHBondContact O-N 2.96Å; R384-Y427 HydrophobicContact CB-CD2 4.13Å; R384-Y427 HydrophobicContact CB-CE2 3.57Å; R384-Y427 HydrophobicContact CG-CD2 4.43Å; R384-Y427 HydrophobicContact CG-CE2 3.63Å
385R79.4Confident82.4Confident79 Ų7948.9 Ų48.930%0.29825%0.247SC..Hα-helixtrans-80.3-43.6179.3-55.1-178.8-166.6165.65.7110.2N323 F329 H382 L383 S388N323-R385 PolarHBondContact OD1-NH2 3.27Å; N323-R385 VanDerWaalsContact OD1-NH2 3.09Å; F329-R385 HydrophobicContact CZ-CB 4.45Å; H382-R385 PolarHBondContact O-N 2.55Å; L383-R385 PolarHBondContact O-N 2.96Å; L383-R385 VanDerWaalsContact O-N 3.16Å; R385-S388 PolarHBondContact O-N 3.17Å; R385-S388 PolarHBondContact O-OG 2.92Å
386I77.6Confident82Confident3 Ų352.7 Ų52.72%0.01527%0.265CS..Hα-helixtrans-70.7-42-175.5-63.2169.6000112.3L333 F337 F378 H382 L383 S388 Y389 F392L333-I386 HydrophobicContact CD1-CG1 4.31Å; L333-I386 HydrophobicContact CD2-CD1 4.12Å; L333-I386 HydrophobicContact CD2-CG1 3.79Å; L333-I386 HydrophobicContact CG-CG1 4.45Å; F337-I386 HydrophobicContact CB-CG2 4.29Å; F337-I386 HydrophobicContact CD1-CG2 4.26Å; F378-I386 HydrophobicContact CD2-CD1 4.23Å; F378-I386 HydrophobicContact CE2-CD1 3.34Å; F378-I386 HydrophobicContact CZ-CD1 3.58Å; H382-I386 HydrophobicContact CB-CD1 3.98Å; H382-I386 WeakPolarHBondContact O-CG1 3.5Å; H382-I386 PolarHBondContact O-N 3.48Å; H382-I386 VanDerWaalsContact O-N 3.09Å; L383-I386 PolarHBondContact O-N 3.13Å; L383-I386 VanDerWaalsContact O-N 3.14Å; I386-S388 PolarHBondContact O-N 3.07Å; I386-Y389 WeakPolarHBondContact O-CB 3.37Å; I386-Y389 PolarHBondContact O-N 3.22Å; I386-F392 HydrophobicContact CG2-CB 4.31Å; I386-F392 HydrophobicContact CG2-CD1 4.29Å; I386-F392 HydrophobicContact CG2-CD2 3.34Å; I386-F392 HydrophobicContact CG2-CE1 4.48Å; I386-F392 HydrophobicContact CG2-CE2 3.55Å; I386-F392 HydrophobicContact CG2-CG 3.74Å; I386-F392 HydrophobicContact CG2-CZ 4.15Å
387E77.7Confident81.8Confident9 Ų946.6 Ų46.64%0.04224%0.242CC..THydrogen-bonded Turntrans-66.9-18.5-178.2-168.5-118.1162.600112.8L383 Y389 F392 V394 Y427 K431 Y446L383-E387 HydrophobicContact CD1-CB 4.33Å; L383-E387 VanDerWaalsContact O-CB 3.3Å; L383-E387 WeakPolarHBondContact O-CB 3.22Å; L383-E387 PolarHBondContact O-N 3.04Å; E387-Y389 PolarHBondContact O-N 3.43Å; E387-F392 HydrophobicContact CB-CD1 4.35Å; E387-F392 HydrophobicContact CG-CD1 4.48Å; E387-V394 HydrophobicContact CG-CG2 4.31Å; E387-Y427 WeakPolarHBondContact OE2-CE1 3.13Å; E387-Y427 VanDerWaalsContact OE2-CZ 3.31Å; E387-Y427 PolarHBondContact OE2-OH 3.28Å; E387-K431 IonicContact OE1-NZ 2.75Å; E387-K431 PolarHBondContact OE1-NZ 3.34Å; E387-K431 IonicContact OE2-NZ 3.74Å; E387-K431 PolarHBondContact OE2-NZ 2.9Å; E387-Y446 VanDerWaalsContact CD-OH 3.26Å; E387-Y446 PolarHBondContact OE1-OH 2.95Å
388S73.9Confident81.8Confident97 Ų9744.9 Ų44.968%0.67823%0.233SC*.THydrogen-bonded Turntrans-71.6-18.4171.377.70000113.2R385 I386R385-S388 PolarHBondContact O-N 3.17Å; R385-S388 PolarHBondContact O-OG 2.92Å; I386-S388 PolarHBondContact O-N 3.07Å
389Y74.3Confident81.9Confident89 Ų8948.1 Ų48.135%0.34925%0.253SS..SBendtrans-79.2123.5177.6-168-112000110.4F337 I386 E387 Q391 F392F337-Y389 HydrophobicContact CE1-CD1 4.49Å; I386-Y389 WeakPolarHBondContact O-CB 3.37Å; I386-Y389 PolarHBondContact O-N 3.22Å; E387-Y389 PolarHBondContact O-N 3.43Å; Y389-Q391 HydrophobicContact CD1-CB 3.9Å; Y389-Q391 HydrophobicContact CD1-CG 4.42Å; Y389-Q391 HydrophobicContact CE1-CB 3.57Å; Y389-Q391 HydrophobicContact CE1-CG 3.78Å; Y389-Q391 VanDerWaalsContact CE1-OE1 3.23Å; Y389-Q391 PolarHBondContact O-N 3.26Å; Y389-Q391 VanDerWaalsContact O-N 3.12Å; Y389-Q391 PolarHBondContact OH-OE1 3.3Å; Y389-F392 WeakPolarHBondContact O-CB 3.37Å; Y389-F392 PolarHBondContact O-N 3.22Å
390S66.8Low81.9Confident115 Ų11548.9 Ų48.980%0.80426%0.257SS*.THydrogen-bonded Turntrans-61.9-24.4-17055.90000114.9F392S390-F392 VanDerWaalsContact C-N 3.34Å
391Q69.8Low82.1Confident109 Ų10945.9 Ų45.951%0.50924%0.236SC..THydrogen-bonded Turntrans-86.3-3.7179.9-54.8176.3-16.900113.1Y389 P393Y389-Q391 HydrophobicContact CD1-CB 3.9Å; Y389-Q391 HydrophobicContact CD1-CG 4.42Å; Y389-Q391 HydrophobicContact CE1-CB 3.57Å; Y389-Q391 HydrophobicContact CE1-CG 3.78Å; Y389-Q391 VanDerWaalsContact CE1-OE1 3.23Å; Y389-Q391 PolarHBondContact O-N 3.26Å; Y389-Q391 VanDerWaalsContact O-N 3.12Å; Y389-Q391 PolarHBondContact OH-OE1 3.3Å; Q391-P393 VanDerWaalsContact O-CD 3.27Å; Q391-P393 WeakPolarHBondContact O-CD 3.36Å
392F78.3Confident82.5Confident4 Ų446.1 Ų46.12%0.01824%0.235CC..  trans-75.6116.9-177.4-177.6-109.3000111.6F337 F341 F378 L383 I386 E387 Y389 S390 V394 F397F337-F392 HydrophobicContact CB-CD2 4.27Å; F337-F392 HydrophobicContact CB-CE2 4.02Å; F337-F392 HydrophobicContact CD1-CD2 4.41Å; F337-F392 HydrophobicContact CD2-CD2 4.14Å; F337-F392 HydrophobicContact CD2-CE2 4.44Å; F337-F392 HydrophobicContact CG-CD2 4.06Å; F337-F392 HydrophobicContact CG-CE2 4.29Å; F341-F392 HydrophobicContact CE2-CD2 4.31Å; F341-F392 AromaticContact CE2-CE2 3.56Å; F341-F392 HydrophobicContact CE2-CE2 3.56Å; F341-F392 HydrophobicContact CE2-CZ 4.04Å; F341-F392 HydrophobicContact CZ-CE2 4.26Å; F341-F392 HydrophobicContact CZ-CZ 4.49Å; F378-F392 HydrophobicContact CE1-CZ 4.5Å; F378-F392 HydrophobicContact CZ-CE2 4.38Å; F378-F392 HydrophobicContact CZ-CZ 4.46Å; L383-F392 HydrophobicContact CD1-CE1 3.97Å; L383-F392 HydrophobicContact CD1-CZ 4.17Å; I386-F392 HydrophobicContact CG2-CB 4.31Å; I386-F392 HydrophobicContact CG2-CD1 4.29Å; I386-F392 HydrophobicContact CG2-CD2 3.34Å; I386-F392 HydrophobicContact CG2-CE1 4.48Å; I386-F392 HydrophobicContact CG2-CE2 3.55Å; I386-F392 HydrophobicContact CG2-CG 3.74Å; I386-F392 HydrophobicContact CG2-CZ 4.15Å; E387-F392 HydrophobicContact CB-CD1 4.35Å; E387-F392 HydrophobicContact CG-CD1 4.48Å; Y389-F392 WeakPolarHBondContact O-CB 3.37Å; Y389-F392 PolarHBondContact O-N 3.22Å; S390-F392 VanDerWaalsContact C-N 3.34Å; F392-V394 VanDerWaalsContact C-N 3.3Å; F392-V394 HydrophobicContact CD1-CB 3.79Å; F392-V394 HydrophobicContact CD1-CG2 4.37Å; F392-V394 HydrophobicContact CE1-CB 3.7Å; F392-V394 HydrophobicContact CE1-CG2 3.85Å; F392-V394 PolarHBondContact O-N 3.14Å; F392-F397 HydrophobicContact CZ-CB 4.23Å; F392-F397 HydrophobicContact CZ-CG 4.38Å
393P82.7Confident83.1Confident14 Ų1449.2 Ų49.29%0.09125%0.248CC..  trans-8571.1-176.334.8-31.9000110.5L221 F341 Q391 V395 E396 F397L221-P393 HydrophobicContact CD1-CB 4.18Å; L221-P393 HydrophobicContact CD1-CG 3.89Å; L221-P393 HydrophobicContact CD2-CB 3.7Å; L221-P393 HydrophobicContact CD2-CG 3.81Å; L221-P393 HydrophobicContact CG-CG 4.48Å; F341-P393 HydrophobicContact CE1-CG 3.79Å; F341-P393 HydrophobicContact CE2-CG 4.36Å; F341-P393 HydrophobicContact CZ-CG 3.59Å; F341-P393 WeakPolarHBondContact CZ-O 3.49Å; Q391-P393 VanDerWaalsContact O-CD 3.27Å; Q391-P393 WeakPolarHBondContact O-CD 3.36Å; P393-V395 VanDerWaalsContact C-N 3.26Å; P393-V395 PolarHBondContact O-N 2.96Å; P393-E396 VanDerWaalsContact C-OE2 3.23Å; P393-E396 WeakPolarHBondContact CA-OE2 3.48Å; P393-E396 HydrophobicContact CB-CB 4.18Å; P393-E396 HydrophobicContact CB-CG 4.24Å; P393-E396 WeakPolarHBondContact CB-OE2 3.48Å; P393-E396 PolarHBondContact O-N 3.43Å; P393-F397 PolarHBondContact O-N 3.09Å
394V84.9Confident83.5Confident0 Ų049.2 Ų49.20%025%0.248CC..Hα-helixtrans-59.3-34-173.569.20000113.3E387 F392 E396 F397 L398 Y446E387-V394 HydrophobicContact CG-CG2 4.31Å; F392-V394 VanDerWaalsContact C-N 3.3Å; F392-V394 HydrophobicContact CD1-CB 3.79Å; F392-V394 HydrophobicContact CD1-CG2 4.37Å; F392-V394 HydrophobicContact CE1-CB 3.7Å; F392-V394 HydrophobicContact CE1-CG2 3.85Å; F392-V394 PolarHBondContact O-N 3.14Å; V394-E396 VanDerWaalsContact C-N 3.34Å; V394-E396 PolarHBondContact O-N 2.99Å; V394-F397 WeakPolarHBondContact O-CB 2.93Å; V394-F397 PolarHBondContact O-N 2.91Å; V394-L398 HydrophobicContact CG2-CD1 4.42Å; V394-L398 HydrophobicContact CG2-CG 4.42Å; V394-L398 VanDerWaalsContact O-CG 3.29Å; V394-L398 WeakPolarHBondContact O-CG 3.19Å; V394-L398 PolarHBondContact O-N 3.46Å; V394-Y446 HydrophobicContact CB-CE1 4.37Å; V394-Y446 HydrophobicContact CG1-CE1 3.68Å; V394-Y446 WeakPolarHBondContact CG1-OH 3.33Å; V394-Y446 HydrophobicContact CG2-CE1 3.73Å
395V85.9Confident84.1Confident59 Ų5940.6 Ų40.636%0.35822%0.216SC..Hα-helixtrans-68.5-39.5-177.8178.60000110.2P393 L398 T399P393-V395 VanDerWaalsContact C-N 3.26Å; P393-V395 PolarHBondContact O-N 2.96Å; V395-L398 PolarHBondContact O-N 3.38Å; V395-T399 WeakPolarHBondContact O-CB 3.48Å; V395-T399 PolarHBondContact O-N 2.9Å; V395-T399 PolarHBondContact O-OG1 3.29Å
396E86.4Confident84.7Confident80 Ų8038.2 Ų38.237%0.37421%0.208SC..Hα-helixtrans-66.7-40174.5-63.882.9166.400111F341 P393 V394 T399 L400F341-E396 HydrophobicContact CE1-CB 3.99Å; P393-E396 VanDerWaalsContact C-OE2 3.23Å; P393-E396 WeakPolarHBondContact CA-OE2 3.48Å; P393-E396 HydrophobicContact CB-CB 4.18Å; P393-E396 HydrophobicContact CB-CG 4.24Å; P393-E396 WeakPolarHBondContact CB-OE2 3.48Å; P393-E396 PolarHBondContact O-N 3.43Å; V394-E396 VanDerWaalsContact C-N 3.34Å; V394-E396 PolarHBondContact O-N 2.99Å; E396-T399 PolarHBondContact O-N 3.16Å; E396-L400 WeakPolarHBondContact O-CG 3.32Å; E396-L400 PolarHBondContact O-N 3.3Å
397F89Confident85.3Confident0 Ų042 Ų420%023%0.225CC..Hα-helixtrans-57.1-50.5171.4174-107000111.1T340 F341 L344 L375 F378 V379 F392 P393 V394 T399 L400 L401T340-F397 HydrophobicContact CG2-CE2 4.38Å; F341-F397 HydrophobicContact CE1-CB 4.12Å; F341-F397 HydrophobicContact CE2-CB 3.91Å; F341-F397 HydrophobicContact CE2-CD2 4.21Å; F341-F397 HydrophobicContact CE2-CG 4.47Å; F341-F397 HydrophobicContact CZ-CB 3.41Å; F341-F397 VanDerWaalsContact CZ-CB 3.41Å; F341-F397 HydrophobicContact CZ-CD2 4.45Å; F341-F397 HydrophobicContact CZ-CG 4.4Å; L344-F397 HydrophobicContact CD2-CD2 4.26Å; L344-F397 HydrophobicContact CD2-CE2 4.2Å; L375-F397 HydrophobicContact CD2-CE2 4.34Å; F378-F397 HydrophobicContact CD1-CE2 4.28Å; F378-F397 HydrophobicContact CD1-CZ 4.14Å; F378-F397 HydrophobicContact CE1-CE2 4.09Å; F378-F397 HydrophobicContact CE1-CZ 4.16Å; V379-F397 HydrophobicContact CG2-CE1 4.1Å; V379-F397 HydrophobicContact CG2-CZ 3.94Å; F392-F397 HydrophobicContact CZ-CB 4.23Å; F392-F397 HydrophobicContact CZ-CG 4.38Å; P393-F397 PolarHBondContact O-N 3.09Å; V394-F397 WeakPolarHBondContact O-CB 2.93Å; V394-F397 PolarHBondContact O-N 2.91Å; F397-T399 VanDerWaalsContact C-N 3.28Å; F397-T399 PolarHBondContact O-N 3.44Å; F397-L400 PolarHBondContact O-N 3.05Å; F397-L401 HydrophobicContact CE1-CD2 4.09Å; F397-L401 HydrophobicContact CZ-CD2 4.36Å; F397-L401 WeakPolarHBondContact O-CB 3.48Å; F397-L401 PolarHBondContact O-N 3.3Å
398L91.4Very high85.8Confident2 Ų242.2 Ų42.21%0.0123%0.226CC..Hα-helixtrans-63.7-35.4-179.4-66.6177.4000111.8V394 V395 L401 F402 W421 F424 Y446 A449V394-L398 HydrophobicContact CG2-CD1 4.42Å; V394-L398 HydrophobicContact CG2-CG 4.42Å; V394-L398 VanDerWaalsContact O-CG 3.29Å; V394-L398 WeakPolarHBondContact O-CG 3.19Å; V394-L398 PolarHBondContact O-N 3.46Å; V395-L398 PolarHBondContact O-N 3.38Å; L398-L401 PolarHBondContact O-N 2.96Å; L398-F402 WeakPolarHBondContact O-CB 3.26Å; L398-F402 PolarHBondContact O-N 3.48Å; L398-W421 HydrophobicContact CB-CH2 4.16Å; L398-W421 HydrophobicContact CD2-CH2 3.89Å; L398-W421 HydrophobicContact CD2-CZ3 3.73Å; L398-F424 HydrophobicContact CD1-CE1 4.05Å; L398-F424 HydrophobicContact CD1-CE2 4.44Å; L398-F424 HydrophobicContact CD1-CZ 3.72Å; L398-F424 HydrophobicContact CD2-CD1 4.22Å; L398-F424 HydrophobicContact CD2-CD2 4.23Å; L398-F424 HydrophobicContact CD2-CE1 3.97Å; L398-F424 HydrophobicContact CD2-CE2 3.99Å; L398-F424 HydrophobicContact CD2-CG 4.35Å; L398-F424 HydrophobicContact CD2-CZ 3.86Å; L398-F424 HydrophobicContact CG-CZ 4.37Å; L398-Y446 HydrophobicContact CD1-CD1 3.64Å; L398-Y446 HydrophobicContact CD1-CE1 3.89Å; L398-A449 HydrophobicContact CB-CB 4.41Å; L398-A449 HydrophobicContact CD1-CB 4.18Å
399T90.8Very high86.3Confident69 Ų6940.4 Ų40.442%0.42321%0.212SC..Hα-helixtrans-63.9-43175.1-57.70000111.3V395 E396 F397 F402 K403V395-T399 WeakPolarHBondContact O-CB 3.48Å; V395-T399 PolarHBondContact O-N 2.9Å; V395-T399 PolarHBondContact O-OG1 3.29Å; E396-T399 PolarHBondContact O-N 3.16Å; F397-T399 VanDerWaalsContact C-N 3.28Å; F397-T399 PolarHBondContact O-N 3.44Å; T399-F402 WeakPolarHBondContact O-CB 3.48Å; T399-F402 PolarHBondContact O-N 3.22Å; T399-K403 WeakPolarHBondContact O-CG 3.48Å; T399-K403 PolarHBondContact O-N 2.95Å
400L90.5Very high86.9Confident21 Ų2139.1 Ų39.111%0.1121%0.213CC..Hα-helixtrans-70.6-39.4176.7-68.8175.7000112.1F341 L344 Q345 E396 F397 F402 K403 Y404F341-L400 HydrophobicContact CD1-CD1 3.94Å; F341-L400 HydrophobicContact CE1-CD1 4.37Å; L344-L400 HydrophobicContact CD2-CB 3.44Å; L344-L400 VanDerWaalsContact CD2-CB 3.44Å; L344-L400 HydrophobicContact CD2-CD1 4.35Å; L344-L400 HydrophobicContact CG-CB 3.77Å; L344-L400 HydrophobicContact CG-CD1 4.5Å; Q345-L400 HydrophobicContact CB-CD1 4.16Å; Q345-L400 HydrophobicContact CB-CD2 4.31Å; Q345-L400 HydrophobicContact CG-CD2 4.44Å; E396-L400 WeakPolarHBondContact O-CG 3.32Å; E396-L400 PolarHBondContact O-N 3.3Å; F397-L400 PolarHBondContact O-N 3.05Å; L400-F402 VanDerWaalsContact C-N 3.32Å; L400-K403 PolarHBondContact O-N 3.03Å; L400-Y404 WeakPolarHBondContact O-CB 3.45Å; L400-Y404 PolarHBondContact O-N 2.93Å
401L93.3Very high87.8Confident0 Ų035.2 Ų35.20%018%0.182CC..Hα-helixtrans-63.1-40.4174.2-179.363.1000111L375 F397 L398 Y404 T405 I420 W421L375-L401 HydrophobicContact CD1-CD1 4.22Å; F397-L401 HydrophobicContact CE1-CD2 4.09Å; F397-L401 HydrophobicContact CZ-CD2 4.36Å; F397-L401 WeakPolarHBondContact O-CB 3.48Å; F397-L401 PolarHBondContact O-N 3.3Å; L398-L401 PolarHBondContact O-N 2.96Å; L401-Y404 PolarHBondContact O-N 3.26Å; L401-T405 WeakPolarHBondContact O-CB 3.47Å; L401-T405 PolarHBondContact O-N 3.5Å; L401-T405 PolarHBondContact O-OG1 3.09Å; L401-I420 HydrophobicContact CD1-CG2 4.28Å; L401-I420 HydrophobicContact CD2-CG2 4.11Å; L401-W421 HydrophobicContact CB-CZ2 4.12Å; L401-W421 HydrophobicContact CD2-CD2 4.15Å; L401-W421 HydrophobicContact CD2-CE3 4.47Å; L401-W421 HydrophobicContact CD2-CH2 4.24Å; L401-W421 HydrophobicContact CD2-CZ2 3.86Å; L401-W421 HydrophobicContact CG-CZ2 3.79Å
402F94Very high88.7Confident34 Ų3435.8 Ų35.815%0.14919%0.185CC..Hα-helixtrans-58.6-52.5173.8176.8-83.7000110.1L398 T399 L400 Y404 T405 F406 W421 L452 E456L398-F402 WeakPolarHBondContact O-CB 3.26Å; L398-F402 PolarHBondContact O-N 3.48Å; T399-F402 WeakPolarHBondContact O-CB 3.48Å; T399-F402 PolarHBondContact O-N 3.22Å; L400-F402 VanDerWaalsContact C-N 3.32Å; F402-Y404 VanDerWaalsContact C-N 3.33Å; F402-Y404 PolarHBondContact O-N 2.93Å; F402-T405 PolarHBondContact O-N 2.98Å; F402-F406 HydrophobicContact CD1-CD2 4.08Å; F402-F406 AromaticContact CD2-CD2 3.73Å; F402-F406 HydrophobicContact CD2-CD2 3.73Å; F402-F406 AromaticContact CD2-CE2 3.41Å; F402-F406 HydrophobicContact CD2-CE2 3.41Å; F402-F406 VanDerWaalsContact CD2-CE2 3.41Å; F402-F406 AromaticContact CE1-CD2 3.92Å; F402-F406 HydrophobicContact CE1-CD2 3.92Å; F402-F406 HydrophobicContact CE1-CE2 4.45Å; F402-F406 AromaticContact CE2-CD2 3.56Å; F402-F406 HydrophobicContact CE2-CD2 3.56Å; F402-F406 AromaticContact CE2-CE2 3.24Å; F402-F406 HydrophobicContact CE2-CE2 3.24Å; F402-F406 HydrophobicContact CE2-CZ 4.22Å; F402-F406 AromaticContact CG-CD2 3.97Å; F402-F406 HydrophobicContact CG-CD2 3.97Å; F402-F406 HydrophobicContact CG-CE2 4.09Å; F402-F406 AromaticContact CZ-CD2 3.66Å; F402-F406 HydrophobicContact CZ-CD2 3.66Å; F402-F406 AromaticContact CZ-CE2 3.82Å; F402-F406 HydrophobicContact CZ-CE2 3.82Å; F402-F406 VanDerWaalsContact O-CD2 3.24Å; F402-F406 WeakPolarHBondContact O-CD2 3.44Å; F402-F406 PolarHBondContact O-N 3.14Å; F402-F406 VanDerWaalsContact O-N 3.12Å; F402-W421 HydrophobicContact CB-CZ2 4.09Å; F402-L452 HydrophobicContact CD1-CD2 4.3Å; F402-L452 HydrophobicContact CD2-CD2 4.25Å; F402-L452 HydrophobicContact CD2-CG 4.27Å; F402-L452 HydrophobicContact CE1-CD2 4.12Å; F402-L452 HydrophobicContact CE1-CG 4.37Å; F402-L452 HydrophobicContact CE2-CD2 4.06Å; F402-L452 HydrophobicContact CE2-CG 3.69Å; F402-L452 HydrophobicContact CG-CD2 4.39Å; F402-L452 HydrophobicContact CZ-CD1 4.31Å; F402-L452 HydrophobicContact CZ-CD2 4Å; F402-L452 HydrophobicContact CZ-CG 3.76Å; F402-E456 HydrophobicContact CE2-CB 3.74Å; F402-E456 HydrophobicContact CE2-CG 4.24Å; F402-E456 HydrophobicContact CZ-CB 3.65Å; F402-E456 HydrophobicContact CZ-CG 3.79Å
403K92Very high89.3Confident67 Ų6736 Ų3629%0.29119%0.189SC..Hα-helixtrans-55.6-48.9175.1-73.6-172.2174.7-1580111.2T348 D350 T399 L400 T405 F406 H407T348-K403 HydrophobicContact CG2-CB 4.17Å; D350-K403 IonicContact OD2-NZ 3.53Å; T399-K403 WeakPolarHBondContact O-CG 3.48Å; T399-K403 PolarHBondContact O-N 2.95Å; L400-K403 PolarHBondContact O-N 3.03Å; K403-T405 VanDerWaalsContact C-N 3.3Å; K403-T405 PolarHBondContact O-N 3.12Å; K403-F406 PolarHBondContact O-N 2.98Å; K403-H407 VanDerWaalsContact O-CB 3.29Å; K403-H407 WeakPolarHBondContact O-CB 3.49Å; K403-H407 PolarHBondContact O-N 3.06Å; K403-H407 VanDerWaalsContact O-N 3.12Å; K403-H407 PolarHBondContact O-ND1 2.97Å
404Y93.3Very high89.8Confident1 Ų135.5 Ų35.50%0.00419%0.185CC..Hα-helixtrans-58.6-40.4179.5-176.6-100.4000112.9L344 I347 T348 L360 I368 F371 T372 L375 L400 L401 F402 Q408 C417L344-Y404 HydrophobicContact CD1-CD2 3.98Å; L344-Y404 HydrophobicContact CD1-CG 3.94Å; I347-Y404 HydrophobicContact CG2-CD2 4.19Å; I347-Y404 HydrophobicContact CG2-CE2 4.11Å; T348-Y404 HydrophobicContact CG2-CD2 4.24Å; L360-Y404 HydrophobicContact CD1-CD2 4.18Å; L360-Y404 HydrophobicContact CD1-CE2 4.39Å; L360-Y404 HydrophobicContact CD2-CD2 4.1Å; L360-Y404 HydrophobicContact CD2-CE2 3.7Å; I368-Y404 WeakPolarHBondContact CG2-OH 3.4Å; I368-Y404 PolarHBondContact O-OH 2.95Å; F371-Y404 AromaticContact CD1-CE2 3.79Å; F371-Y404 HydrophobicContact CD1-CE2 3.79Å; F371-Y404 AromaticContact CD1-CZ 3.82Å; F371-Y404 HydrophobicContact CE1-CD2 4.4Å; F371-Y404 AromaticContact CE1-CE2 3.99Å; F371-Y404 HydrophobicContact CE1-CE2 3.99Å; T372-Y404 PolarHBondContact OG1-OH 2.96Å; L375-Y404 HydrophobicContact CD1-CD1 3.78Å; L375-Y404 HydrophobicContact CD1-CE1 3.71Å; L375-Y404 HydrophobicContact CD1-CG 4.39Å; L400-Y404 WeakPolarHBondContact O-CB 3.45Å; L400-Y404 PolarHBondContact O-N 2.93Å; L401-Y404 PolarHBondContact O-N 3.26Å; F402-Y404 VanDerWaalsContact C-N 3.33Å; F402-Y404 PolarHBondContact O-N 2.93Å; Y404-Q408 WeakPolarHBondContact O-CG 3.34Å; Y404-Q408 PolarHBondContact O-NE2 3.28Å; Y404-Q408 VanDerWaalsContact O-NE2 3.1Å; Y404-Q408 PolarHBondContact OH-NE2 2.94Å; Y404-C417 VanDerWaalsContact CE1-SG 3.59Å
405T94.4Very high90.2Very high1 Ų136 Ų361%0.00619%0.187CC..Hα-helixtrans-65.1-50.7-178.9-58.50000111.8L401 F402 K403 H407 Q408 Y414 C417 L418 W421L401-T405 WeakPolarHBondContact O-CB 3.47Å; L401-T405 PolarHBondContact O-N 3.5Å; L401-T405 PolarHBondContact O-OG1 3.09Å; F402-T405 PolarHBondContact O-N 2.98Å; K403-T405 VanDerWaalsContact C-N 3.3Å; K403-T405 PolarHBondContact O-N 3.12Å; T405-H407 VanDerWaalsContact C-N 3.33Å; T405-H407 PolarHBondContact O-N 2.76Å; T405-Q408 WeakPolarHBondContact O-CG 3.15Å; T405-Q408 PolarHBondContact O-N 3.16Å; T405-Y414 HydrophobicContact CG2-CD2 4.01Å; T405-Y414 HydrophobicContact CG2-CE2 4.13Å; T405-C417 HydrophobicContact CG2-CB 3.65Å; T405-L418 HydrophobicContact CG2-CD2 4.47Å; T405-W421 PolarHBondContact OG1-NE1 3.38Å
406F91.4Very high90.6Very high29 Ų2935.5 Ų35.513%0.12719%0.186CC..Hα-helixtrans-86.1-5.4-173.1-64.1-71.4000113.9F402 K403 Y414 L453 E456 V457 R460F402-F406 HydrophobicContact CD1-CD2 4.08Å; F402-F406 AromaticContact CD2-CD2 3.73Å; F402-F406 HydrophobicContact CD2-CD2 3.73Å; F402-F406 AromaticContact CD2-CE2 3.41Å; F402-F406 HydrophobicContact CD2-CE2 3.41Å; F402-F406 VanDerWaalsContact CD2-CE2 3.41Å; F402-F406 AromaticContact CE1-CD2 3.92Å; F402-F406 HydrophobicContact CE1-CD2 3.92Å; F402-F406 HydrophobicContact CE1-CE2 4.45Å; F402-F406 AromaticContact CE2-CD2 3.56Å; F402-F406 HydrophobicContact CE2-CD2 3.56Å; F402-F406 AromaticContact CE2-CE2 3.24Å; F402-F406 HydrophobicContact CE2-CE2 3.24Å; F402-F406 HydrophobicContact CE2-CZ 4.22Å; F402-F406 AromaticContact CG-CD2 3.97Å; F402-F406 HydrophobicContact CG-CD2 3.97Å; F402-F406 HydrophobicContact CG-CE2 4.09Å; F402-F406 AromaticContact CZ-CD2 3.66Å; F402-F406 HydrophobicContact CZ-CD2 3.66Å; F402-F406 AromaticContact CZ-CE2 3.82Å; F402-F406 HydrophobicContact CZ-CE2 3.82Å; F402-F406 VanDerWaalsContact O-CD2 3.24Å; F402-F406 WeakPolarHBondContact O-CD2 3.44Å; F402-F406 PolarHBondContact O-N 3.14Å; F402-F406 VanDerWaalsContact O-N 3.12Å; K403-F406 PolarHBondContact O-N 2.98Å; F406-Y414 HydrophobicContact CD1-CE2 4.17Å; F406-Y414 AromaticContact CE1-CE2 3.85Å; F406-Y414 HydrophobicContact CE1-CE2 3.85Å; F406-L453 HydrophobicContact CE2-CD1 4.04Å; F406-L453 HydrophobicContact CZ-CD1 4.01Å; F406-E456 HydrophobicContact CD1-CB 4.49Å; F406-E456 HydrophobicContact CD1-CG 3.57Å; F406-E456 HydrophobicContact CD2-CB 4.41Å; F406-E456 HydrophobicContact CD2-CG 3.86Å; F406-E456 HydrophobicContact CE1-CB 4.07Å; F406-E456 HydrophobicContact CE1-CG 3.61Å; F406-E456 HydrophobicContact CE2-CB 4.02Å; F406-E456 HydrophobicContact CE2-CG 3.93Å; F406-E456 HydrophobicContact CG-CG 3.7Å; F406-E456 HydrophobicContact CZ-CB 3.83Å; F406-E456 HydrophobicContact CZ-CG 3.8Å; F406-V457 HydrophobicContact CE1-CG2 4.27Å; F406-V457 HydrophobicContact CZ-CG2 3.86Å; F406-R460 HydrophobicContact CD1-CG 3.88Å; F406-R460 HydrophobicContact CE1-CG 3.87Å
407H89.8Confident91.1Very high82 Ų8231.7 Ų31.738%0.3817%0.168SC..THydrogen-bonded Turntrans-100.65.1171.4-70.382.9000113.4S358 L360 K403 T405S358-H407 PolarHBondContact OG-O 3.46Å; S358-H407 VanDerWaalsContact OG-O 3.04Å; L360-H407 HydrophobicContact CD1-CB 3.81Å; L360-H407 VanDerWaalsContact CD1-O 3.26Å; L360-H407 WeakPolarHBondContact CD1-O 3.44Å; K403-H407 VanDerWaalsContact O-CB 3.29Å; K403-H407 WeakPolarHBondContact O-CB 3.49Å; K403-H407 PolarHBondContact O-N 3.06Å; K403-H407 VanDerWaalsContact O-N 3.12Å; K403-H407 PolarHBondContact O-ND1 2.97Å; T405-H407 VanDerWaalsContact C-N 3.33Å; T405-H407 PolarHBondContact O-N 2.76Å
408Q89.5Confident91.4Very high14 Ų1431.7 Ų31.77%0.06517%0.168CC..  trans-57.9134.8177-75.9-59.7-43.500111.1Y404 T405 T410Y404-Q408 WeakPolarHBondContact O-CG 3.34Å; Y404-Q408 PolarHBondContact O-NE2 3.28Å; Y404-Q408 VanDerWaalsContact O-NE2 3.1Å; Y404-Q408 PolarHBondContact OH-NE2 2.94Å; T405-Q408 WeakPolarHBondContact O-CG 3.15Å; T405-Q408 PolarHBondContact O-N 3.16Å; Q408-T410 VanDerWaalsContact C-N 3.34Å
409P83.8Confident91.6Very high58 Ų5834.2 Ų34.238%0.37718%0.182SC..SBendtrans-77.1-21.2-177.730.8-34.1000113E361 I368E361-P409 HydrophobicContact CG-CB 3.9Å; I368-P409 HydrophobicContact CD1-CG 4.41Å
410T87.1Confident91.9Very high62 Ų6231 Ų3138%0.3816%0.162SC..SBendtrans-125.5153.9-175.163.50000111.9Q408 E412 G413 Y414Q408-T410 VanDerWaalsContact C-N 3.34Å; T410-E412 VanDerWaalsContact C-N 3.34Å; T410-G413 PolarHBondContact O-N 3.21Å; T410-G413 PolarHBondContact OG1-N 2.82Å; T410-G413 VanDerWaalsContact OG1-N 3.15Å; T410-Y414 PolarHBondContact O-N 3.41Å
411H86.1Confident92.2Very high33 Ų3330 Ų3015%0.15316%0.157CC..Hα-helixtrans-63.4-38.8174.8-65.5-55000112.4G413 Y414 F415 Y489H411-G413 PolarHBondContact O-N 2.91Å; H411-Y414 WeakPolarHBondContact O-CB 3.42Å; H411-Y414 PolarHBondContact O-N 3.47Å; H411-Y414 VanDerWaalsContact O-N 3.17Å; H411-F415 VanDerWaalsContact O-CG 3.27Å; H411-F415 WeakPolarHBondContact O-CG 3.3Å; H411-F415 PolarHBondContact O-N 2.97Å; H411-Y489 AromaticContact ND1-CE2 3.73Å
412E88.9Confident92.3Very high122 Ų12231.4 Ų31.457%0.5717%0.165SC*.Hα-helixtrans-61.3-40.7174-68.2-59.6151.100112.7T410 F415 S416T410-E412 VanDerWaalsContact C-N 3.34Å; E412-F415 PolarHBondContact O-N 2.85Å; E412-S416 WeakPolarHBondContact O-CB 3.3Å; E412-S416 PolarHBondContact O-N 3.44Å; E412-S416 PolarHBondContact O-OG 3.22Å
413G90.6Very high92.4Very high9 Ų932.5 Ų32.59%0.09317%0.173CC..Hα-helixtrans-64.1-41.1173.800000112T410 H411 S416 C417T410-G413 PolarHBondContact O-N 3.21Å; T410-G413 PolarHBondContact OG1-N 2.82Å; T410-G413 VanDerWaalsContact OG1-N 3.15Å; H411-G413 PolarHBondContact O-N 2.91Å; G413-S416 PolarHBondContact O-N 3.44Å; G413-C417 PolarHBondContact O-N 3.31Å; G413-C417 PolarHBondContact O-SG 3.15Å
414Y92.8Very high92.5Very high3 Ų329.4 Ų29.41%0.01216%0.159CC..Hα-helixtrans-61.8-46.1174171.2-111.1000111.9T405 F406 T410 H411 C417 L418 Y489 S493T405-Y414 HydrophobicContact CG2-CD2 4.01Å; T405-Y414 HydrophobicContact CG2-CE2 4.13Å; F406-Y414 HydrophobicContact CD1-CE2 4.17Å; F406-Y414 AromaticContact CE1-CE2 3.85Å; F406-Y414 HydrophobicContact CE1-CE2 3.85Å; T410-Y414 PolarHBondContact O-N 3.41Å; H411-Y414 WeakPolarHBondContact O-CB 3.42Å; H411-Y414 PolarHBondContact O-N 3.47Å; H411-Y414 VanDerWaalsContact O-N 3.17Å; Y414-C417 CarbonylContact O-C 3.58Å; Y414-C417 WeakPolarHBondContact O-CA 3.27Å; Y414-C417 WeakPolarHBondContact O-CB 3.38Å; Y414-C417 PolarHBondContact O-N 3.27Å; Y414-C417 VanDerWaalsContact O-N 3.1Å; Y414-L418 HydrophobicContact CD1-CD1 4.27Å; Y414-L418 HydrophobicContact CD1-CG 4.47Å; Y414-L418 HydrophobicContact CD2-CD2 4.46Å; Y414-L418 HydrophobicContact CD2-CG 4.44Å; Y414-L418 HydrophobicContact CE1-CD1 3.6Å; Y414-L418 HydrophobicContact CE1-CG 4.09Å; Y414-L418 HydrophobicContact CE2-CD1 4.33Å; Y414-L418 HydrophobicContact CE2-CD2 3.74Å; Y414-L418 HydrophobicContact CE2-CG 4.03Å; Y414-L418 WeakPolarHBondContact O-CG 3.19Å; Y414-L418 PolarHBondContact O-N 3.02Å; Y414-Y489 HydrophobicContact CD1-CD2 4.48Å; Y414-Y489 AromaticContact CD1-CE2 3.71Å; Y414-Y489 HydrophobicContact CD1-CE2 3.71Å; Y414-Y489 HydrophobicContact CE1-CD2 4.47Å; Y414-Y489 AromaticContact CE1-CE2 3.65Å; Y414-Y489 HydrophobicContact CE1-CE2 3.65Å; Y414-Y489 AromaticContact CE1-CZ 3.82Å; Y414-S493 PolarHBondContact OH-OG 3.46Å
415F92.7Very high92.6Very high9 Ų929.3 Ų29.34%0.03916%0.159CC..Hα-helixtrans-60.2-46.2176-67.4-18.9000112.5H411 E412 C417 L418 D419 Y489H411-F415 VanDerWaalsContact O-CG 3.27Å; H411-F415 WeakPolarHBondContact O-CG 3.3Å; H411-F415 PolarHBondContact O-N 2.97Å; E412-F415 PolarHBondContact O-N 2.85Å; F415-C417 PolarHBondContact O-N 3.01Å; F415-L418 PolarHBondContact O-N 3.4Å; F415-D419 PolarHBondContact O-N 3.47Å; F415-Y489 AromaticContact CE1-CD2 3.43Å; F415-Y489 HydrophobicContact CE1-CD2 3.43Å; F415-Y489 VanDerWaalsContact CE1-CD2 3.43Å; F415-Y489 HydrophobicContact CE1-CE2 4.11Å; F415-Y489 HydrophobicContact CE1-CG 4.08Å; F415-Y489 AromaticContact CZ-CD2 3.61Å; F415-Y489 HydrophobicContact CZ-CD2 3.61Å; F415-Y489 HydrophobicContact CZ-CG 4.16Å
416S94.8Very high92.5Very high49 Ų4932.6 Ų32.634%0.34318%0.176SC..Hα-helixtrans-57.6-35.4175-60.80000111.6E412 G413 I420E412-S416 WeakPolarHBondContact O-CB 3.3Å; E412-S416 PolarHBondContact O-N 3.44Å; E412-S416 PolarHBondContact O-OG 3.22Å; G413-S416 PolarHBondContact O-N 3.44Å; S416-I420 WeakPolarHBondContact O-CG1 3.4Å; S416-I420 PolarHBondContact O-N 3.28Å
417C96.1Very high92.5Very high0 Ų033.1 Ų33.10%018%0.178CC..Hα-helixtrans-72.6-39173.7-66.10000113.1Y404 T405 G413 Y414 F415 D419 I420 W421Y404-C417 VanDerWaalsContact CE1-SG 3.59Å; T405-C417 HydrophobicContact CG2-CB 3.65Å; G413-C417 PolarHBondContact O-N 3.31Å; G413-C417 PolarHBondContact O-SG 3.15Å; Y414-C417 CarbonylContact O-C 3.58Å; Y414-C417 WeakPolarHBondContact O-CA 3.27Å; Y414-C417 WeakPolarHBondContact O-CB 3.38Å; Y414-C417 PolarHBondContact O-N 3.27Å; Y414-C417 VanDerWaalsContact O-N 3.1Å; F415-C417 PolarHBondContact O-N 3.01Å; C417-D419 VanDerWaalsContact C-N 3.25Å; C417-D419 PolarHBondContact O-N 2.84Å; C417-I420 WeakPolarHBondContact O-CB 3.39Å; C417-I420 PolarHBondContact O-N 3.24Å; C417-I420 VanDerWaalsContact O-N 3.11Å; C417-W421 PolarHBondContact O-N 3.42Å
418L96.1Very high92.6Very high0 Ų029.3 Ų29.30%016%0.16CC..Hα-helixtrans-62.1-33.7174.3-65.9-169.9000112.2T405 Y414 F415 I420 W421 T422 Q492 V496T405-L418 HydrophobicContact CG2-CD2 4.47Å; Y414-L418 HydrophobicContact CD1-CD1 4.27Å; Y414-L418 HydrophobicContact CD1-CG 4.47Å; Y414-L418 HydrophobicContact CD2-CD2 4.46Å; Y414-L418 HydrophobicContact CD2-CG 4.44Å; Y414-L418 HydrophobicContact CE1-CD1 3.6Å; Y414-L418 HydrophobicContact CE1-CG 4.09Å; Y414-L418 HydrophobicContact CE2-CD1 4.33Å; Y414-L418 HydrophobicContact CE2-CD2 3.74Å; Y414-L418 HydrophobicContact CE2-CG 4.03Å; Y414-L418 WeakPolarHBondContact O-CG 3.19Å; Y414-L418 PolarHBondContact O-N 3.02Å; F415-L418 PolarHBondContact O-N 3.4Å; L418-I420 VanDerWaalsContact C-N 3.33Å; L418-W421 PolarHBondContact O-N 3.17Å; L418-T422 WeakPolarHBondContact O-CB 3.38Å; L418-T422 PolarHBondContact O-N 3.26Å; L418-T422 PolarHBondContact O-OG1 2.96Å; L418-Q492 HydrophobicContact CB-CG 4.48Å; L418-Q492 HydrophobicContact CD1-CB 4.48Å; L418-Q492 HydrophobicContact CD1-CG 4.16Å; L418-V496 HydrophobicContact CB-CG2 4.1Å; L418-V496 HydrophobicContact CD2-CG2 4.1Å; L418-V496 HydrophobicContact CG-CG2 4.47Å
419D96.1Very high92.6Very high56 Ų5629.1 Ų29.130%0.29916%0.16SC..Hα-helixtrans-64.4-39172.9-72.4-6.6000111.5F415 C417 T422 L423 Q492F415-D419 PolarHBondContact O-N 3.47Å; C417-D419 VanDerWaalsContact C-N 3.25Å; C417-D419 PolarHBondContact O-N 2.84Å; D419-T422 WeakPolarHBondContact O-CB 3.28Å; D419-T422 PolarHBondContact O-N 2.89Å; D419-L423 WeakPolarHBondContact O-CG 3.43Å; D419-L423 PolarHBondContact O-N 2.95Å; D419-Q492 PolarHBondContact OD1-NE2 3.29Å
420I96.3Very high92.9Very high0 Ų029.7 Ų29.70%017%0.165CC..Hα-helixtrans-63.6-44.6174.2-61.4168.4000110.5T372 L375 R376 V379 L401 S416 C417 L418 T422 L423 F424T372-I420 HydrophobicContact CG2-CD1 3.97Å; L375-I420 HydrophobicContact CB-CD1 3.73Å; R376-I420 HydrophobicContact CB-CD1 4.22Å; R376-I420 HydrophobicContact CB-CG1 3.86Å; R376-I420 HydrophobicContact CG-CG1 4.34Å; V379-I420 HydrophobicContact CB-CG2 4Å; V379-I420 HydrophobicContact CG1-CG2 4.28Å; V379-I420 HydrophobicContact CG2-CG2 3.66Å; L401-I420 HydrophobicContact CD1-CG2 4.28Å; L401-I420 HydrophobicContact CD2-CG2 4.11Å; S416-I420 WeakPolarHBondContact O-CG1 3.4Å; S416-I420 PolarHBondContact O-N 3.28Å; C417-I420 WeakPolarHBondContact O-CB 3.39Å; C417-I420 PolarHBondContact O-N 3.24Å; C417-I420 VanDerWaalsContact O-N 3.11Å; L418-I420 VanDerWaalsContact C-N 3.33Å; I420-T422 VanDerWaalsContact C-N 3.32Å; I420-T422 PolarHBondContact O-N 3.12Å; I420-L423 PolarHBondContact O-N 3.33Å; I420-F424 PolarHBondContact O-N 3.14Å
421W96.9Very high92.8Very high2 Ų228.1 Ų28.11%0.00815%0.153CC..Hα-helixtrans-60.7-42.2174.1-78.9108.7000112L398 L401 F402 T405 C417 L418 L423 F424 L425 L453L398-W421 HydrophobicContact CB-CH2 4.16Å; L398-W421 HydrophobicContact CD2-CH2 3.89Å; L398-W421 HydrophobicContact CD2-CZ3 3.73Å; L401-W421 HydrophobicContact CB-CZ2 4.12Å; L401-W421 HydrophobicContact CD2-CD2 4.15Å; L401-W421 HydrophobicContact CD2-CE3 4.47Å; L401-W421 HydrophobicContact CD2-CH2 4.24Å; L401-W421 HydrophobicContact CD2-CZ2 3.86Å; L401-W421 HydrophobicContact CG-CZ2 3.79Å; F402-W421 HydrophobicContact CB-CZ2 4.09Å; T405-W421 PolarHBondContact OG1-NE1 3.38Å; C417-W421 PolarHBondContact O-N 3.42Å; L418-W421 PolarHBondContact O-N 3.17Å; W421-L423 PolarHBondContact O-N 3.37Å; W421-F424 HydrophobicContact CE3-CD1 4.19Å; W421-F424 HydrophobicContact CZ3-CD1 4.26Å; W421-F424 WeakPolarHBondContact O-CB 3.48Å; W421-F424 PolarHBondContact O-N 3.44Å; W421-F424 VanDerWaalsContact O-N 3.15Å; W421-L425 VanDerWaalsContact O-CG 3.24Å; W421-L425 WeakPolarHBondContact O-CG 3.29Å; W421-L425 PolarHBondContact O-N 3.29Å; W421-L453 HydrophobicContact CD2-CD1 3.93Å; W421-L453 HydrophobicContact CD2-CD2 3.79Å; W421-L453 HydrophobicContact CE3-CD1 4.4Å; W421-L453 HydrophobicContact CE3-CD2 3.53Å; W421-L453 HydrophobicContact CG-CD1 4.21Å; W421-L453 HydrophobicContact CG-CD2 4.23Å; W421-L453 HydrophobicContact CZ2-CD1 4.22Å; W421-L453 HydrophobicContact CZ3-CD2 3.95Å
422T96.3Very high92.8Very high28 Ų2827.2 Ų27.217%0.17215%0.149CC..Hα-helixtrans-59.9-46.2177.2-650000111.6L418 D419 I420 F424 L425 D426 K499L418-T422 WeakPolarHBondContact O-CB 3.38Å; L418-T422 PolarHBondContact O-N 3.26Å; L418-T422 PolarHBondContact O-OG1 2.96Å; D419-T422 WeakPolarHBondContact O-CB 3.28Å; D419-T422 PolarHBondContact O-N 2.89Å; I420-T422 VanDerWaalsContact C-N 3.32Å; I420-T422 PolarHBondContact O-N 3.12Å; T422-F424 VanDerWaalsContact C-N 3.3Å; T422-F424 PolarHBondContact O-N 3.15Å; T422-L425 PolarHBondContact O-N 3.35Å; T422-D426 PolarHBondContact O-N 3.22Å; T422-K499 HydrophobicContact CG2-CD 3.79Å; T422-K499 VanDerWaalsContact CG2-CE 3.47Å
423L94.9Very high92.6Very high58 Ų5827.6 Ų27.630%0.30415%0.149SC..Hα-helixtrans-59.2-40.7174.2-70.9165.4000112.1R376 V379 D419 I420 W421 Y427R376-L423 HydrophobicContact CG-CD1 3.84Å; V379-L423 HydrophobicContact CG1-CB 4.07Å; D419-L423 WeakPolarHBondContact O-CG 3.43Å; D419-L423 PolarHBondContact O-N 2.95Å; I420-L423 PolarHBondContact O-N 3.33Å; W421-L423 PolarHBondContact O-N 3.37Å; L423-Y427 WeakPolarHBondContact O-CB 3.3Å; L423-Y427 PolarHBondContact O-N 3.09Å; L423-Y427 VanDerWaalsContact O-N 3.09Å
424F94.7Very high92.1Very high1 Ų131.2 Ų31.20%0.00417%0.173CC..Hα-helixtrans-65.2-44.8175.5174.3-100000112.5V379 L383 L398 I420 W421 T422 Y427 L428 Y446 L450V379-F424 HydrophobicContact CG1-CB 4.03Å; L383-F424 HydrophobicContact CD2-CD2 3.55Å; L383-F424 HydrophobicContact CD2-CE2 4.03Å; L398-F424 HydrophobicContact CD1-CE1 4.05Å; L398-F424 HydrophobicContact CD1-CE2 4.44Å; L398-F424 HydrophobicContact CD1-CZ 3.72Å; L398-F424 HydrophobicContact CD2-CD1 4.22Å; L398-F424 HydrophobicContact CD2-CD2 4.23Å; L398-F424 HydrophobicContact CD2-CE1 3.97Å; L398-F424 HydrophobicContact CD2-CE2 3.99Å; L398-F424 HydrophobicContact CD2-CG 4.35Å; L398-F424 HydrophobicContact CD2-CZ 3.86Å; L398-F424 HydrophobicContact CG-CZ 4.37Å; I420-F424 PolarHBondContact O-N 3.14Å; W421-F424 HydrophobicContact CE3-CD1 4.19Å; W421-F424 HydrophobicContact CZ3-CD1 4.26Å; W421-F424 WeakPolarHBondContact O-CB 3.48Å; W421-F424 PolarHBondContact O-N 3.44Å; W421-F424 VanDerWaalsContact O-N 3.15Å; T422-F424 VanDerWaalsContact C-N 3.3Å; T422-F424 PolarHBondContact O-N 3.15Å; F424-Y427 WeakPolarHBondContact O-CB 3.37Å; F424-Y427 PolarHBondContact O-N 2.81Å; F424-L428 HydrophobicContact CE1-CD2 4.32Å; F424-L428 PolarHBondContact O-N 3.39Å; F424-Y446 AromaticContact CZ-CD1 3.97Å; F424-Y446 HydrophobicContact CZ-CD1 3.97Å; F424-Y446 AromaticContact CZ-CE1 3.9Å; F424-Y446 HydrophobicContact CZ-CE1 3.9Å; F424-L450 HydrophobicContact CE1-CD2 4.5Å
425L95Very high91.2Very high0 Ų037.7 Ų37.70%020%0.197CC..Hα-helixtrans-64.9-41.3179.7-66.7169.1000111.1W421 T422 Y427 L428 T429 L450 V496 K499 V500 L503W421-L425 VanDerWaalsContact O-CG 3.24Å; W421-L425 WeakPolarHBondContact O-CG 3.29Å; W421-L425 PolarHBondContact O-N 3.29Å; T422-L425 PolarHBondContact O-N 3.35Å; L425-Y427 VanDerWaalsContact C-N 3.34Å; L425-Y427 PolarHBondContact O-N 2.97Å; L425-L428 PolarHBondContact O-N 3.45Å; L425-T429 WeakPolarHBondContact O-CB 3.35Å; L425-T429 PolarHBondContact O-N 3.01Å; L425-T429 PolarHBondContact O-OG1 3.27Å; L425-T429 VanDerWaalsContact O-OG1 3.08Å; L425-L450 HydrophobicContact CD2-CD2 3.47Å; L425-L450 VanDerWaalsContact CD2-CD2 3.47Å; L425-V496 HydrophobicContact CD1-CG1 4.08Å; L425-K499 HydrophobicContact CB-CB 4.1Å; L425-K499 HydrophobicContact CB-CD 4.36Å; L425-K499 HydrophobicContact CD1-CB 3.68Å; L425-K499 HydrophobicContact CD1-CD 4.48Å; L425-K499 HydrophobicContact CG-CB 4.45Å; L425-V500 HydrophobicContact CD1-CG2 4.07Å; L425-V500 HydrophobicContact CD2-CG2 4.11Å; L425-L503 HydrophobicContact CD2-CD1 3.72Å
426D93.8Very high89.8Confident69 Ų6943.9 Ų43.937%0.36923%0.23SC..Hα-helixtrans-63.2-40.5175.2-73.4-31.5000112.3T422 S430 K499T422-D426 PolarHBondContact O-N 3.22Å; D426-S430 WeakPolarHBondContact O-CB 3.45Å; D426-S430 PolarHBondContact O-N 2.97Å; D426-K499 IonicContact OD1-NZ 4Å; D426-K499 PolarHBondContact OD1-NZ 3.18Å; D426-K499 IonicContact OD2-NZ 2.88Å; D426-K499 PolarHBondContact OD2-NZ 3.06Å
427Y91.1Very high88.5Confident41 Ų4145.3 Ų45.316%0.16125%0.253CS..Hα-helixtrans-58.5-48.5171.6166.8-107.5000111.7L383 R384 E387 L423 F424 L425 S430 K431L383-Y427 HydrophobicContact CD2-CD1 4.24Å; R384-Y427 HydrophobicContact CB-CD2 4.13Å; R384-Y427 HydrophobicContact CB-CE2 3.57Å; R384-Y427 HydrophobicContact CG-CD2 4.43Å; R384-Y427 HydrophobicContact CG-CE2 3.63Å; E387-Y427 WeakPolarHBondContact OE2-CE1 3.13Å; E387-Y427 VanDerWaalsContact OE2-CZ 3.31Å; E387-Y427 PolarHBondContact OE2-OH 3.28Å; L423-Y427 WeakPolarHBondContact O-CB 3.3Å; L423-Y427 PolarHBondContact O-N 3.09Å; L423-Y427 VanDerWaalsContact O-N 3.09Å; F424-Y427 WeakPolarHBondContact O-CB 3.37Å; F424-Y427 PolarHBondContact O-N 2.81Å; L425-Y427 VanDerWaalsContact C-N 3.34Å; L425-Y427 PolarHBondContact O-N 2.97Å; Y427-S430 PolarHBondContact O-N 3.37Å; Y427-K431 HydrophobicContact CE1-CD 4.41Å; Y427-K431 WeakPolarHBondContact O-CB 3.38Å; Y427-K431 PolarHBondContact O-N 3.44Å
428L90.6Very high87.4Confident1 Ų150.1 Ų50.11%0.00528%0.278CS..Hα-helixtrans-64.3-43.9-179.6-177.857.2000111.9F424 L425 S430 K431 I432 V442 Y446 L450 L503F424-L428 HydrophobicContact CE1-CD2 4.32Å; F424-L428 PolarHBondContact O-N 3.39Å; L425-L428 PolarHBondContact O-N 3.45Å; L428-S430 PolarHBondContact O-N 3.16Å; L428-K431 WeakPolarHBondContact O-CB 3.41Å; L428-K431 PolarHBondContact O-N 3.33Å; L428-I432 HydrophobicContact CD1-CD1 3.99Å; L428-I432 HydrophobicContact CD1-CG1 4.34Å; L428-I432 HydrophobicContact CG-CD1 3.91Å; L428-I432 WeakPolarHBondContact O-CD1 3.37Å; L428-I432 WeakPolarHBondContact O-CG1 3.24Å; L428-I432 PolarHBondContact O-N 3.37Å; L428-V442 HydrophobicContact CD1-CG1 4.14Å; L428-Y446 HydrophobicContact CD1-CD2 3.76Å; L428-Y446 HydrophobicContact CD1-CE2 3.94Å; L428-Y446 HydrophobicContact CD2-CD2 4.18Å; L428-Y446 HydrophobicContact CD2-CG 4.19Å; L428-L450 HydrophobicContact CD2-CD1 3.92Å; L428-L503 HydrophobicContact CD2-CD1 3.96Å; L428-L503 HydrophobicContact CG-CD1 4.32Å; L428-L503 HydrophobicContact CG-CD2 4.32Å
429T90.6Very high86.6Confident11 Ų1155 Ų557%0.06730%0.299CS..Hα-helixtrans-57.6-47174.5-660000111.3L425 I432 K433 E502 L503L425-T429 WeakPolarHBondContact O-CB 3.35Å; L425-T429 PolarHBondContact O-N 3.01Å; L425-T429 PolarHBondContact O-OG1 3.27Å; L425-T429 VanDerWaalsContact O-OG1 3.08Å; T429-I432 PolarHBondContact O-N 2.86Å; T429-K433 HydrophobicContact CG2-CD 4.06Å; T429-K433 VanDerWaalsContact CG2-NZ 3.32Å; T429-K433 WeakPolarHBondContact O-CG 3.46Å; T429-K433 PolarHBondContact O-N 3.44Å; T429-E502 WeakPolarHBondContact CG2-OE1 3.29Å; T429-L503 WeakPolarHBondContact OG1-CD2 3.12Å
430S89.4Confident85.8Confident70 Ų7059.5 Ų59.549%0.4932%0.319SS..Hα-helixtrans-62.2-42.7176.2-175.50000112.1D426 Y427 L428 I432 K433 S434D426-S430 WeakPolarHBondContact O-CB 3.45Å; D426-S430 PolarHBondContact O-N 2.97Å; Y427-S430 PolarHBondContact O-N 3.37Å; L428-S430 PolarHBondContact O-N 3.16Å; S430-I432 PolarHBondContact O-N 3.07Å; S430-K433 PolarHBondContact O-N 3.25Å; S430-S434 PolarHBondContact O-N 2.79Å
431K85.5Confident85.2Confident28 Ų2862.8 Ų62.812%0.12235%0.346CS..Hα-helixtrans-60.5-46177.2-176.7175.5-179.1169.20111.8E387 Y427 L428 S434 R435 V442E387-K431 IonicContact OE1-NZ 2.75Å; E387-K431 PolarHBondContact OE1-NZ 3.34Å; E387-K431 IonicContact OE2-NZ 3.74Å; E387-K431 PolarHBondContact OE2-NZ 2.9Å; Y427-K431 HydrophobicContact CE1-CD 4.41Å; Y427-K431 WeakPolarHBondContact O-CB 3.38Å; Y427-K431 PolarHBondContact O-N 3.44Å; L428-K431 WeakPolarHBondContact O-CB 3.41Å; L428-K431 PolarHBondContact O-N 3.33Å; K431-S434 PolarHBondContact O-N 3.24Å; K431-S434 PolarHBondContact O-OG 3.29Å; K431-R435 PolarHBondContact O-N 3.12Å; K431-R435 VanDerWaalsContact O-N 3.11Å; K431-V442 HydrophobicContact CD-CG1 4.5Å
432I85.6Confident84.5Confident14 Ų1463.7 Ų63.77%0.07235%0.351CS..Hα-helixtrans-64.1-44.6178.1-71.1159.9000111.1L428 T429 S430 S434 R435 K439 V442 L443 L503L428-I432 HydrophobicContact CD1-CD1 3.99Å; L428-I432 HydrophobicContact CD1-CG1 4.34Å; L428-I432 HydrophobicContact CG-CD1 3.91Å; L428-I432 WeakPolarHBondContact O-CD1 3.37Å; L428-I432 WeakPolarHBondContact O-CG1 3.24Å; L428-I432 PolarHBondContact O-N 3.37Å; T429-I432 PolarHBondContact O-N 2.86Å; S430-I432 PolarHBondContact O-N 3.07Å; I432-S434 PolarHBondContact O-N 3.37Å; I432-R435 PolarHBondContact O-N 3.4Å; I432-K439 HydrophobicContact CG2-CB 4.41Å; I432-K439 HydrophobicContact CG2-CD 3.82Å; I432-K439 HydrophobicContact CG2-CG 3.71Å; I432-V442 HydrophobicContact CG1-CG1 4.31Å; I432-L443 HydrophobicContact CD1-CD1 4.38Å; I432-L443 HydrophobicContact CD1-CD2 3.41Å; I432-L443 VanDerWaalsContact CD1-CD2 3.41Å; I432-L443 HydrophobicContact CD1-CG 3.73Å; I432-L443 HydrophobicContact CG1-CG 4.41Å; I432-L503 HydrophobicContact CD1-CD2 3.49Å; I432-L503 VanDerWaalsContact CD1-CD2 3.49Å
433K84.5Confident84Confident130 Ų13063.2 Ų63.257%0.56535%0.348SS*.Hα-helixtrans-59.4-32.7176-72.9172.8-176.8166.80111.8T429 S430 E502T429-K433 HydrophobicContact CG2-CD 4.06Å; T429-K433 VanDerWaalsContact CG2-NZ 3.32Å; T429-K433 WeakPolarHBondContact O-CG 3.46Å; T429-K433 PolarHBondContact O-N 3.44Å; S430-K433 PolarHBondContact O-N 3.25Å; K433-E502 IonicContact NZ-OE1 2.64Å; K433-E502 PolarHBondContact NZ-OE1 2.9Å
434S81.1Confident83.6Confident86 Ų8665.2 Ų65.260%0.60136%0.359SS*.Hα-helixtrans-81.3-23.9178.875.80000115.7S430 K431 I432S430-S434 PolarHBondContact O-N 2.79Å; K431-S434 PolarHBondContact O-N 3.24Å; K431-S434 PolarHBondContact O-OG 3.29Å; I432-S434 PolarHBondContact O-N 3.37Å
435R72.5Confident83.3Confident139 Ų13971 Ų7153%0.52538%0.38SS..  trans-119.961.3-175-67.6-168.9179.4-166.9-0112K431 I432 G437 D438 K439K431-R435 PolarHBondContact O-N 3.12Å; K431-R435 VanDerWaalsContact O-N 3.11Å; I432-R435 PolarHBondContact O-N 3.4Å; R435-G437 PolarHBondContact O-N 3.04Å; R435-G437 VanDerWaalsContact O-N 3.13Å; R435-D438 PolarHBondContact O-N 2.73Å; R435-K439 PolarHBondContact O-N 3.12Å
436L64.5Low83Confident139 Ų13971 Ų7173%0.72838%0.381SS*.G310 helixtrans-56.8-30.6-173.6-69.1168.4000114.5
437G67.1Low82.9Confident79 Ų7970 Ų7081%0.81437%0.374SS*.G310 helixtrans-73.3-26.1-178.600000115.6R435R435-G437 PolarHBondContact O-N 3.04Å; R435-G437 VanDerWaalsContact O-N 3.13Å
438D73.4Confident82.9Confident100 Ų10074.7 Ų74.754%0.53540%0.402SS..G310 helixtrans-11620.1-175.9-66.9-30000112.3R435 E440 A441 V442R435-D438 PolarHBondContact O-N 2.73Å; D438-E440 PolarHBondContact O-N 2.89Å; D438-A441 PolarHBondContact O-N 2.85Å; D438-V442 HydrophobicContact CB-CG2 4.49Å; D438-V442 WeakPolarHBondContact O-CG2 3.45Å; D438-V442 PolarHBondContact O-N 3.38Å
439K78.6Confident83Confident102 Ų10275.5 Ų75.544%0.44341%0.408SS..Hα-helixtrans-52.6-49.7-173.2170.5172.2-180-170.40112.7I432 R435 V442 L443I432-K439 HydrophobicContact CG2-CB 4.41Å; I432-K439 HydrophobicContact CG2-CD 3.82Å; I432-K439 HydrophobicContact CG2-CG 3.71Å; R435-K439 PolarHBondContact O-N 3.12Å; K439-V442 PolarHBondContact O-N 3.47Å; K439-L443 HydrophobicContact CG-CD1 3.84Å; K439-L443 WeakPolarHBondContact O-CB 3.5Å; K439-L443 WeakPolarHBondContact O-CG 3.2Å; K439-L443 PolarHBondContact O-N 2.82Å
440E80.4Confident83.2Confident152 Ų15275 Ų7571%0.7141%0.405SS*.Hα-helixtrans-66.3-43.5-177.4-68.1-177173.700111.7D438 V442 L443 N444D438-E440 PolarHBondContact O-N 2.89Å; E440-V442 VanDerWaalsContact C-N 3.31Å; E440-V442 PolarHBondContact O-N 3.02Å; E440-L443 PolarHBondContact O-N 3.34Å; E440-N444 WeakPolarHBondContact O-CB 3.47Å; E440-N444 PolarHBondContact O-N 3.2Å; E440-N444 PolarHBondContact O-ND2 3.42Å; E440-N444 PolarHBondContact O-OD1 3.28Å
441A82.6Confident83.5Confident68 Ų6873.3 Ų73.356%0.56239%0.392SS*.Hα-helixtrans-62.4-38.1178.500000112.4D438D438-A441 PolarHBondContact O-N 2.85Å
442V82.8Confident84Confident21 Ų2176.3 Ų76.313%0.12741%0.409CS..Hα-helixtrans-69.3-44.4175.9175.70000110.9L428 K431 I432 D438 K439 E440 R445 Y446L428-V442 HydrophobicContact CD1-CG1 4.14Å; K431-V442 HydrophobicContact CD-CG1 4.5Å; I432-V442 HydrophobicContact CG1-CG1 4.31Å; D438-V442 HydrophobicContact CB-CG2 4.49Å; D438-V442 WeakPolarHBondContact O-CG2 3.45Å; D438-V442 PolarHBondContact O-N 3.38Å; K439-V442 PolarHBondContact O-N 3.47Å; E440-V442 VanDerWaalsContact C-N 3.31Å; E440-V442 PolarHBondContact O-N 3.02Å; V442-R445 WeakPolarHBondContact O-CB 3.45Å; V442-R445 PolarHBondContact O-N 3.5Å; V442-Y446 HydrophobicContact CG1-CE2 4.35Å; V442-Y446 VanDerWaalsContact O-CD2 3.23Å; V442-Y446 WeakPolarHBondContact O-CD2 3.17Å
443L85.1Confident84.5Confident18 Ų1875.6 Ų75.69%0.09441%0.405CS..Hα-helixtrans-64.3-46.1179.9-82.5169000112.4I432 K439 E440 R445 Y446 E447 L503 L504I432-L443 HydrophobicContact CD1-CD1 4.38Å; I432-L443 HydrophobicContact CD1-CD2 3.41Å; I432-L443 VanDerWaalsContact CD1-CD2 3.41Å; I432-L443 HydrophobicContact CD1-CG 3.73Å; I432-L443 HydrophobicContact CG1-CG 4.41Å; K439-L443 HydrophobicContact CG-CD1 3.84Å; K439-L443 WeakPolarHBondContact O-CB 3.5Å; K439-L443 WeakPolarHBondContact O-CG 3.2Å; K439-L443 PolarHBondContact O-N 2.82Å; E440-L443 PolarHBondContact O-N 3.34Å; L443-R445 PolarHBondContact O-N 3.16Å; L443-R445 VanDerWaalsContact O-N 3.11Å; L443-Y446 PolarHBondContact O-N 3.13Å; L443-E447 PolarHBondContact O-N 2.63Å; L443-L503 HydrophobicContact CD2-CB 4.38Å; L443-L503 HydrophobicContact CD2-CD2 4.37Å; L443-L504 HydrophobicContact CD2-CD2 4.19Å
444N86.7Confident85Confident101 Ų10169.5 Ų69.554%0.5438%0.379SS..Hα-helixtrans-59.2-27.2-179.5-66-3.8000112.3E440 Y446E440-N444 WeakPolarHBondContact O-CB 3.47Å; E440-N444 PolarHBondContact O-N 3.2Å; E440-N444 PolarHBondContact O-ND2 3.42Å; E440-N444 PolarHBondContact O-OD1 3.28Å; N444-Y446 VanDerWaalsContact C-N 3.31Å; N444-Y446 PolarHBondContact O-N 3.01Å
445R87.6Confident85.7Confident121 Ų12167.7 Ų67.746%0.45736%0.364SS..Hα-helixtrans-66.7-30.8175.1-176.4178.4-178.7-179.41.5113.1V442 L443V442-R445 WeakPolarHBondContact O-CB 3.45Å; V442-R445 PolarHBondContact O-N 3.5Å; L443-R445 PolarHBondContact O-N 3.16Å; L443-R445 VanDerWaalsContact O-N 3.11Å
446Y90.3Very high86.8Confident2 Ų264 Ų641%0.00835%0.353CS..Hα-helixtrans-105.8-8.2-174.5-66.9-69.6000113.5E387 V394 L398 F424 L428 V442 L443 N444 D448 A449 L450E387-Y446 VanDerWaalsContact CD-OH 3.26Å; E387-Y446 PolarHBondContact OE1-OH 2.95Å; V394-Y446 HydrophobicContact CB-CE1 4.37Å; V394-Y446 HydrophobicContact CG1-CE1 3.68Å; V394-Y446 WeakPolarHBondContact CG1-OH 3.33Å; V394-Y446 HydrophobicContact CG2-CE1 3.73Å; L398-Y446 HydrophobicContact CD1-CD1 3.64Å; L398-Y446 HydrophobicContact CD1-CE1 3.89Å; F424-Y446 AromaticContact CZ-CD1 3.97Å; F424-Y446 HydrophobicContact CZ-CD1 3.97Å; F424-Y446 AromaticContact CZ-CE1 3.9Å; F424-Y446 HydrophobicContact CZ-CE1 3.9Å; L428-Y446 HydrophobicContact CD1-CD2 3.76Å; L428-Y446 HydrophobicContact CD1-CE2 3.94Å; L428-Y446 HydrophobicContact CD2-CD2 4.18Å; L428-Y446 HydrophobicContact CD2-CG 4.19Å; V442-Y446 HydrophobicContact CG1-CE2 4.35Å; V442-Y446 VanDerWaalsContact O-CD2 3.23Å; V442-Y446 WeakPolarHBondContact O-CD2 3.17Å; L443-Y446 PolarHBondContact O-N 3.13Å; N444-Y446 VanDerWaalsContact C-N 3.31Å; N444-Y446 PolarHBondContact O-N 3.01Å; Y446-D448 PolarHBondContact O-N 2.99Å; Y446-A449 PolarHBondContact O-N 3.07Å; Y446-L450 WeakPolarHBondContact O-CG 3.4Å; Y446-L450 PolarHBondContact O-N 3.33Å
447E91.3Very high88.3Confident48 Ų4857.3 Ų57.322%0.22432%0.318CS..Hα-helixtrans-51.3-57.6-170.9-173176.1168.500113L443 A449 L450 V451 L504 H507L443-E447 PolarHBondContact O-N 2.63Å; E447-A449 VanDerWaalsContact C-N 3.3Å; E447-A449 PolarHBondContact O-N 2.95Å; E447-L450 PolarHBondContact O-N 3.45Å; E447-L450 VanDerWaalsContact O-N 3.15Å; E447-V451 WeakPolarHBondContact O-CG2 3.25Å; E447-V451 PolarHBondContact O-N 3.05Å; E447-L504 HydrophobicContact CG-CD1 4.31Å; E447-H507 IonicContact OE1-CE1 3.45Å; E447-H507 PolarHBondContact OE1-CE1 3.43Å; E447-H507 IonicContact OE1-ND1 3.62Å; E447-H507 IonicContact OE1-NE2 3.95Å; E447-H507 PolarHBondContact OE1-NE2 3.24Å
448D91.6Very high89.7Confident139 Ų13953.9 Ų53.974%0.74328%0.281SS*.Hα-helixtrans-57.9-42-178.1-67.5-29.4000112.5Y446 L452Y446-D448 PolarHBondContact O-N 2.99Å; D448-L452 VanDerWaalsContact O-CB 3.28Å; D448-L452 WeakPolarHBondContact O-CB 3.44Å; D448-L452 PolarHBondContact O-N 2.95Å
449A92.4Very high90.7Very high18 Ų1850.6 Ų50.615%0.14926%0.263CS..Hα-helixtrans-67.2-39.3-179.700000111.9L398 Y446 E447 L453L398-A449 HydrophobicContact CB-CB 4.41Å; L398-A449 HydrophobicContact CD1-CB 4.18Å; Y446-A449 PolarHBondContact O-N 3.07Å; E447-A449 VanDerWaalsContact C-N 3.3Å; E447-A449 PolarHBondContact O-N 2.95Å; A449-L453 WeakPolarHBondContact O-CB 3.38Å; A449-L453 PolarHBondContact O-N 3.45Å
450L95.4Very high91.4Very high0 Ų047.1 Ų47.10%025%0.247CC..Hα-helixtrans-72-38.9178.2-66.6-179.2000112F424 L425 L428 Y446 E447 L452 L453 L454 V500 L503 L504F424-L450 HydrophobicContact CE1-CD2 4.5Å; L425-L450 HydrophobicContact CD2-CD2 3.47Å; L425-L450 VanDerWaalsContact CD2-CD2 3.47Å; L428-L450 HydrophobicContact CD2-CD1 3.92Å; Y446-L450 WeakPolarHBondContact O-CG 3.4Å; Y446-L450 PolarHBondContact O-N 3.33Å; E447-L450 PolarHBondContact O-N 3.45Å; E447-L450 VanDerWaalsContact O-N 3.15Å; L450-L452 VanDerWaalsContact C-N 3.35Å; L450-L453 PolarHBondContact O-N 2.89Å; L450-L454 WeakPolarHBondContact O-CB 3.26Å; L450-L454 PolarHBondContact O-N 2.79Å; L450-V500 HydrophobicContact CB-CG1 4.26Å; L450-L503 HydrophobicContact CD1-CD1 4.21Å; L450-L504 HydrophobicContact CB-CD1 3.6Å; L450-L504 HydrophobicContact CD1-CD1 3.87Å; L450-L504 HydrophobicContact CD1-CG 4.27Å; L450-L504 HydrophobicContact CG-CD1 4.37Å
451V94.9Very high92.1Very high35 Ų3539.9 Ų39.921%0.21221%0.214CC..Hα-helixtrans-66.4-39.3175.31740000110.8E447 L454 T455 L504 H507E447-V451 WeakPolarHBondContact O-CG2 3.25Å; E447-V451 PolarHBondContact O-N 3.05Å; V451-L454 PolarHBondContact O-N 3.42Å; V451-T455 WeakPolarHBondContact O-CB 3.21Å; V451-T455 PolarHBondContact O-N 3.17Å; V451-T455 PolarHBondContact O-OG1 3.41Å; V451-L504 HydrophobicContact CG2-CD1 4.13Å; V451-H507 HydrophobicContact CG2-CB 3.95Å
452L94.9Very high92.7Very high90 Ų9036.8 Ų36.847%0.47119%0.187SC..Hα-helixtrans-65.1-46174.6-173.867.5000111.6F402 D448 L450 L454 T455 E456F402-L452 HydrophobicContact CD1-CD2 4.3Å; F402-L452 HydrophobicContact CD2-CD2 4.25Å; F402-L452 HydrophobicContact CD2-CG 4.27Å; F402-L452 HydrophobicContact CE1-CD2 4.12Å; F402-L452 HydrophobicContact CE1-CG 4.37Å; F402-L452 HydrophobicContact CE2-CD2 4.06Å; F402-L452 HydrophobicContact CE2-CG 3.69Å; F402-L452 HydrophobicContact CG-CD2 4.39Å; F402-L452 HydrophobicContact CZ-CD1 4.31Å; F402-L452 HydrophobicContact CZ-CD2 4Å; F402-L452 HydrophobicContact CZ-CG 3.76Å; D448-L452 VanDerWaalsContact O-CB 3.28Å; D448-L452 WeakPolarHBondContact O-CB 3.44Å; D448-L452 PolarHBondContact O-N 2.95Å; L450-L452 VanDerWaalsContact C-N 3.35Å; L452-L454 PolarHBondContact O-N 2.92Å; L452-T455 PolarHBondContact O-N 3.33Å; L452-E456 PolarHBondContact O-N 3.23Å
453L96.3Very high93.2Very high0 Ų036 Ų360%018%0.182CC..Hα-helixtrans-55.9-50.6174.6177.867.5000111.1F406 W421 A449 L450 T455 E456 V457 V496 V500F406-L453 HydrophobicContact CE2-CD1 4.04Å; F406-L453 HydrophobicContact CZ-CD1 4.01Å; W421-L453 HydrophobicContact CD2-CD1 3.93Å; W421-L453 HydrophobicContact CD2-CD2 3.79Å; W421-L453 HydrophobicContact CE3-CD1 4.4Å; W421-L453 HydrophobicContact CE3-CD2 3.53Å; W421-L453 HydrophobicContact CG-CD1 4.21Å; W421-L453 HydrophobicContact CG-CD2 4.23Å; W421-L453 HydrophobicContact CZ2-CD1 4.22Å; W421-L453 HydrophobicContact CZ3-CD2 3.95Å; A449-L453 WeakPolarHBondContact O-CB 3.38Å; A449-L453 PolarHBondContact O-N 3.45Å; L450-L453 PolarHBondContact O-N 2.89Å; L453-T455 VanDerWaalsContact C-N 3.33Å; L453-T455 PolarHBondContact O-N 2.96Å; L453-E456 PolarHBondContact O-N 3.19Å; L453-V457 HydrophobicContact CD1-CG2 4.09Å; L453-V457 HydrophobicContact CG-CG2 4.4Å; L453-V457 WeakPolarHBondContact O-CB 3.4Å; L453-V457 VanDerWaalsContact O-CG2 3.27Å; L453-V457 WeakPolarHBondContact O-CG2 3.5Å; L453-V457 PolarHBondContact O-N 3.34Å; L453-V496 HydrophobicContact CD2-CG1 3.85Å; L453-V496 HydrophobicContact CG-CG1 4.2Å; L453-V500 HydrophobicContact CD2-CG2 4.27Å
454L96.3Very high93.5Very high2 Ų239.9 Ų39.91%0.0120%0.196CC..Hα-helixtrans-55.3-49.6177.517171000111.5L450 V451 L452 E456 V457 L458 V497 V500 A508 T511L450-L454 WeakPolarHBondContact O-CB 3.26Å; L450-L454 PolarHBondContact O-N 2.79Å; V451-L454 PolarHBondContact O-N 3.42Å; L452-L454 PolarHBondContact O-N 2.92Å; L454-E456 VanDerWaalsContact C-N 3.34Å; L454-E456 PolarHBondContact O-N 3.03Å; L454-V457 PolarHBondContact O-N 3.42Å; L454-L458 HydrophobicContact CD1-CD1 4Å; L454-L458 HydrophobicContact CD1-CG 4.25Å; L454-L458 HydrophobicContact CG-CD1 4.1Å; L454-L458 WeakPolarHBondContact O-CB 3.37Å; L454-L458 VanDerWaalsContact O-CG 3.29Å; L454-L458 WeakPolarHBondContact O-CG 3.34Å; L454-L458 PolarHBondContact O-N 3.26Å; L454-V497 HydrophobicContact CD1-CB 4.2Å; L454-V497 HydrophobicContact CD1-CG1 3.69Å; L454-V497 HydrophobicContact CD1-CG2 4.07Å; L454-V500 HydrophobicContact CB-CG1 4.14Å; L454-A508 VanDerWaalsContact CD2-CA 3.47Å; L454-A508 HydrophobicContact CD2-CB 3.87Å; L454-T511 HydrophobicContact CD2-CG2 4.22Å
455T95.8Very high93.7Very high48 Ų4841.4 Ų41.429%0.29420%0.195SC..Hα-helixtrans-61.5-45.2-176.5-56.70000110.7V451 L452 L453 L458 N459V451-T455 WeakPolarHBondContact O-CB 3.21Å; V451-T455 PolarHBondContact O-N 3.17Å; V451-T455 PolarHBondContact O-OG1 3.41Å; L452-T455 PolarHBondContact O-N 3.33Å; L453-T455 VanDerWaalsContact C-N 3.33Å; L453-T455 PolarHBondContact O-N 2.96Å; T455-L458 PolarHBondContact O-N 3.44Å; T455-N459 VanDerWaalsContact O-CG 3.22Å; T455-N459 PolarHBondContact O-N 3.3Å; T455-N459 PolarHBondContact O-ND2 2.91Å; T455-N459 PolarHBondContact O-OD1 3.25Å
456E95.7Very high93.8Very high60 Ų6036.3 Ų36.328%0.2818%0.177SC..Hα-helixtrans-72.8-38.6-178-16659.2-159.600112.4F402 F406 L452 L453 L454 L458 N459 R460F402-E456 HydrophobicContact CE2-CB 3.74Å; F402-E456 HydrophobicContact CE2-CG 4.24Å; F402-E456 HydrophobicContact CZ-CB 3.65Å; F402-E456 HydrophobicContact CZ-CG 3.79Å; F406-E456 HydrophobicContact CD1-CB 4.49Å; F406-E456 HydrophobicContact CD1-CG 3.57Å; F406-E456 HydrophobicContact CD2-CB 4.41Å; F406-E456 HydrophobicContact CD2-CG 3.86Å; F406-E456 HydrophobicContact CE1-CB 4.07Å; F406-E456 HydrophobicContact CE1-CG 3.61Å; F406-E456 HydrophobicContact CE2-CB 4.02Å; F406-E456 HydrophobicContact CE2-CG 3.93Å; F406-E456 HydrophobicContact CG-CG 3.7Å; F406-E456 HydrophobicContact CZ-CB 3.83Å; F406-E456 HydrophobicContact CZ-CG 3.8Å; L452-E456 PolarHBondContact O-N 3.23Å; L453-E456 PolarHBondContact O-N 3.19Å; L454-E456 VanDerWaalsContact C-N 3.34Å; L454-E456 PolarHBondContact O-N 3.03Å; E456-L458 VanDerWaalsContact C-N 3.28Å; E456-L458 PolarHBondContact O-N 3.02Å; E456-N459 WeakPolarHBondContact O-CB 3.45Å; E456-N459 PolarHBondContact O-N 3.4Å; E456-N459 VanDerWaalsContact O-N 3.1Å; E456-N459 PolarHBondContact OE2-ND2 3.25Å; E456-N459 VanDerWaalsContact OE2-ND2 3.14Å; E456-R460 WeakPolarHBondContact O-CG 3.43Å; E456-R460 PolarHBondContact O-N 2.95Å
457V96.2Very high93.7Very high0 Ų037.8 Ų37.80%018%0.184CC..Hα-helixtrans-59.5-41.5172174.80000110.8F406 L453 L454 N459 R460 I461 S493 V496 V497F406-V457 HydrophobicContact CE1-CG2 4.27Å; F406-V457 HydrophobicContact CZ-CG2 3.86Å; L453-V457 HydrophobicContact CD1-CG2 4.09Å; L453-V457 HydrophobicContact CG-CG2 4.4Å; L453-V457 WeakPolarHBondContact O-CB 3.4Å; L453-V457 VanDerWaalsContact O-CG2 3.27Å; L453-V457 WeakPolarHBondContact O-CG2 3.5Å; L453-V457 PolarHBondContact O-N 3.34Å; L454-V457 PolarHBondContact O-N 3.42Å; V457-N459 VanDerWaalsContact C-N 3.35Å; V457-R460 PolarHBondContact O-N 2.88Å; V457-I461 PolarHBondContact O-N 3.04Å; V457-S493 WeakPolarHBondContact CG1-O 3.23Å; V457-V496 HydrophobicContact CG2-CG1 4.35Å; V457-V497 HydrophobicContact CB-CG2 4.36Å; V457-V497 HydrophobicContact CG1-CG2 3.73Å
458L95.4Very high93.5Very high7 Ų738.9 Ų38.94%0.03720%0.201CC..Hα-helixtrans-64.3-38.2174.3-71.5176.3000112.1L454 T455 E456 R460 I461 Q462 V497 T511 L512L454-L458 HydrophobicContact CD1-CD1 4Å; L454-L458 HydrophobicContact CD1-CG 4.25Å; L454-L458 HydrophobicContact CG-CD1 4.1Å; L454-L458 WeakPolarHBondContact O-CB 3.37Å; L454-L458 VanDerWaalsContact O-CG 3.29Å; L454-L458 WeakPolarHBondContact O-CG 3.34Å; L454-L458 PolarHBondContact O-N 3.26Å; T455-L458 PolarHBondContact O-N 3.44Å; E456-L458 VanDerWaalsContact C-N 3.28Å; E456-L458 PolarHBondContact O-N 3.02Å; L458-R460 VanDerWaalsContact C-N 3.32Å; L458-R460 PolarHBondContact O-N 3.3Å; L458-I461 HydrophobicContact CD2-CD1 4.06Å; L458-I461 WeakPolarHBondContact O-CG1 3.39Å; L458-Q462 VanDerWaalsContact O-CG 3.31Å; L458-Q462 WeakPolarHBondContact O-CG 3.43Å; L458-V497 HydrophobicContact CD2-CG2 4.13Å; L458-V497 HydrophobicContact CG-CG2 4.46Å; L458-T511 HydrophobicContact CD1-CG2 4.06Å; L458-L512 HydrophobicContact CD1-CB 4.33Å; L458-L512 HydrophobicContact CD1-CD1 4.1Å; L458-L512 HydrophobicContact CD2-CD1 3.73Å
459N94.8Very high93.3Very high31 Ų3135.3 Ų35.317%0.16618%0.18CC..Hα-helixtrans-63.5-40.1174.8-67.5-22.4000111.6T455 E456 V457 I461 Q462 Y465T455-N459 VanDerWaalsContact O-CG 3.22Å; T455-N459 PolarHBondContact O-N 3.3Å; T455-N459 PolarHBondContact O-ND2 2.91Å; T455-N459 PolarHBondContact O-OD1 3.25Å; E456-N459 WeakPolarHBondContact O-CB 3.45Å; E456-N459 PolarHBondContact O-N 3.4Å; E456-N459 VanDerWaalsContact O-N 3.1Å; E456-N459 PolarHBondContact OE2-ND2 3.25Å; E456-N459 VanDerWaalsContact OE2-ND2 3.14Å; V457-N459 VanDerWaalsContact C-N 3.35Å; N459-I461 VanDerWaalsContact C-N 3.32Å; N459-I461 PolarHBondContact O-N 3.11Å; N459-Q462 PolarHBondContact O-N 2.84Å; N459-Q462 VanDerWaalsContact O-N 3.14Å; N459-Y465 HydrophobicContact CB-CD2 3.71Å; N459-Y465 HydrophobicContact CB-CE2 4.23Å; N459-Y465 HydrophobicContact CB-CG 4.2Å; N459-Y465 WeakPolarHBondContact OD1-CD2 3.26Å; N459-Y465 WeakPolarHBondContact OD1-CE2 3.42Å
460R93.3Very high93.2Very high29 Ų2934.6 Ų34.611%0.10917%0.173CC..Hα-helixtrans-67.5-28-175.6-68.8-73.1-70.2161.32.7114.1F406 E456 V457 L458 Q462 N466 L470F406-R460 HydrophobicContact CD1-CG 3.88Å; F406-R460 HydrophobicContact CE1-CG 3.87Å; E456-R460 WeakPolarHBondContact O-CG 3.43Å; E456-R460 PolarHBondContact O-N 2.95Å; V457-R460 PolarHBondContact O-N 2.88Å; L458-R460 VanDerWaalsContact C-N 3.32Å; L458-R460 PolarHBondContact O-N 3.3Å; R460-Q462 VanDerWaalsContact C-N 3.32Å; R460-N466 VanDerWaalsContact NH1-CG 3.35Å; R460-N466 PolarHBondContact NH1-ND2 3.43Å; R460-N466 PolarHBondContact NH1-OD1 2.94Å; R460-N466 PolarHBondContact O-ND2 2.86Å; R460-L470 WeakPolarHBondContact O-CD2 3.36Å
461I94.7Very high93Very high0 Ų039.5 Ų39.50%020%0.196CC..THydrogen-bonded Turntrans-85.4-3.1175.865.8168.3000113.6V457 L458 N459 Y489 L490 L494 S559V457-I461 PolarHBondContact O-N 3.04Å; L458-I461 HydrophobicContact CD2-CD1 4.06Å; L458-I461 WeakPolarHBondContact O-CG1 3.39Å; N459-I461 VanDerWaalsContact C-N 3.32Å; N459-I461 PolarHBondContact O-N 3.11Å; I461-Y489 HydrophobicContact CG2-CE1 4.28Å; I461-L490 HydrophobicContact CB-CD1 3.89Å; I461-L490 HydrophobicContact CD1-CD1 4.01Å; I461-L490 HydrophobicContact CG2-CD1 3.9Å; I461-L494 HydrophobicContact CD1-CD2 3.9Å; I461-S559 PolarHBondContact O-OG 3.24Å
462Q94.8Very high92.8Very high2 Ų244.9 Ų44.91%0.00922%0.219CC..  trans-105125.7-179.3-67-174.9-6200111.8L458 N459 R460 R464 Y465 N466 D556L458-Q462 VanDerWaalsContact O-CG 3.31Å; L458-Q462 WeakPolarHBondContact O-CG 3.43Å; N459-Q462 PolarHBondContact O-N 2.84Å; N459-Q462 VanDerWaalsContact O-N 3.14Å; R460-Q462 VanDerWaalsContact C-N 3.32Å; Q462-R464 HydrophobicContact CB-CG 4.07Å; Q462-R464 PolarHBondContact O-N 3.09Å; Q462-Y465 HydrophobicContact CB-CD2 4.17Å; Q462-Y465 PolarHBondContact O-N 2.99Å; Q462-Y465 VanDerWaalsContact O-N 3.09Å; Q462-N466 PolarHBondContact O-N 3.41Å; Q462-D556 VanDerWaalsContact C-OD1 3.24Å; Q462-D556 WeakPolarHBondContact CA-OD1 3.46Å; Q462-D556 WeakPolarHBondContact CB-OD1 3.38Å; Q462-D556 HydrophobicContact CG-CB 4.48Å
463F93.8Very high92.6Very high6 Ų641.2 Ų41.23%0.02620%0.2CC..Hα-helixtrans-55.3-34.7172.3-73.1-100.4000112Y465 N466 Q467 L470 E471 W486 C552 R555 D556F463-Y465 PolarHBondContact O-N 2.97Å; F463-N466 PolarHBondContact O-N 2.95Å; F463-Q467 HydrophobicContact CD1-CG 4.44Å; F463-Q467 WeakPolarHBondContact O-CA 3.23Å; F463-Q467 VanDerWaalsContact O-CB 3.24Å; F463-Q467 WeakPolarHBondContact O-CB 3.34Å; F463-Q467 PolarHBondContact O-N 3.37Å; F463-L470 HydrophobicContact CD1-CB 4.09Å; F463-L470 HydrophobicContact CD2-CD1 3.86Å; F463-L470 HydrophobicContact CE1-CB 3.67Å; F463-L470 HydrophobicContact CE2-CB 4.14Å; F463-L470 HydrophobicContact CE2-CD1 4.03Å; F463-L470 HydrophobicContact CG-CB 4.48Å; F463-L470 HydrophobicContact CG-CD1 4.1Å; F463-L470 HydrophobicContact CZ-CB 3.69Å; F463-L470 HydrophobicContact CZ-CD1 4.43Å; F463-E471 HydrophobicContact CD1-CG 4.41Å; F463-E471 HydrophobicContact CE1-CG 4.07Å; F463-W486 HydrophobicContact CD2-CH2 4.4Å; F463-W486 AromaticContact CE2-CH2 3.45Å; F463-W486 HydrophobicContact CE2-CH2 3.45Å; F463-W486 VanDerWaalsContact CE2-CH2 3.45Å; F463-W486 HydrophobicContact CE2-CZ2 4.04Å; F463-W486 AromaticContact CE2-CZ3 3.87Å; F463-W486 HydrophobicContact CE2-CZ3 3.87Å; F463-W486 HydrophobicContact CZ-CH2 4.04Å; F463-W486 HydrophobicContact CZ-CZ3 4.01Å; F463-C552 HydrophobicContact CB-CB 4.05Å; F463-R555 HydrophobicContact CD2-CB 3.43Å; F463-R555 VanDerWaalsContact CD2-CB 3.43Å; F463-R555 HydrophobicContact CD2-CG 4.36Å; F463-R555 HydrophobicContact CE2-CB 3.54Å; F463-R555 HydrophobicContact CE2-CG 4.17Å; F463-R555 HydrophobicContact CG-CB 4.05Å; F463-R555 HydrophobicContact CZ-CB 4.23Å; F463-R555 HydrophobicContact CZ-CG 4.38Å; F463-D556 WeakPolarHBondContact CA-OD1 3.21Å; F463-D556 WeakPolarHBondContact CB-OD1 3.43Å; F463-D556 PolarHBondContact N-OD1 3.45Å
464R91.3Very high92.2Very high98 Ų9843.4 Ų43.437%0.3721%0.212SC..Hα-helixtrans-57.8-24176.874.1-171.4-178.5156.93.7114.4Q462 V515 D556Q462-R464 HydrophobicContact CB-CG 4.07Å; Q462-R464 PolarHBondContact O-N 3.09Å; R464-V515 VanDerWaalsContact NH2-CG1 3.28Å; R464-D556 VanDerWaalsContact CB-OD2 3.27Å; R464-D556 WeakPolarHBondContact CB-OD2 3.15Å; R464-D556 WeakPolarHBondContact CD-OD2 3.46Å; R464-D556 VanDerWaalsContact CG-OD2 3.32Å; R464-D556 WeakPolarHBondContact CG-OD2 3.32Å; R464-D556 PolarHBondContact N-OD2 3.35Å
465Y90.7Very high91.9Very high133 Ų13346.3 Ų46.352%0.52223%0.227SC..Hα-helixtrans-113-30.7178.8-58.9-60.9000113.7N459 Q462 F463N459-Y465 HydrophobicContact CB-CD2 3.71Å; N459-Y465 HydrophobicContact CB-CE2 4.23Å; N459-Y465 HydrophobicContact CB-CG 4.2Å; N459-Y465 WeakPolarHBondContact OD1-CD2 3.26Å; N459-Y465 WeakPolarHBondContact OD1-CE2 3.42Å; Q462-Y465 HydrophobicContact CB-CD2 4.17Å; Q462-Y465 PolarHBondContact O-N 2.99Å; Q462-Y465 VanDerWaalsContact O-N 3.09Å; F463-Y465 PolarHBondContact O-N 2.97Å
466N89.4Confident91.4Very high14 Ų1452.3 Ų52.38%0.07525%0.252CS..Hα-helixtrans-126.526.8-171-163.431.6000113.8R460 Q462 F463 A468 Q469 L470R460-N466 VanDerWaalsContact NH1-CG 3.35Å; R460-N466 PolarHBondContact NH1-ND2 3.43Å; R460-N466 PolarHBondContact NH1-OD1 2.94Å; R460-N466 PolarHBondContact O-ND2 2.86Å; Q462-N466 PolarHBondContact O-N 3.41Å; F463-N466 PolarHBondContact O-N 2.95Å; N466-A468 VanDerWaalsContact C-N 3.33Å; N466-A468 PolarHBondContact O-N 3.08Å; N466-Q469 PolarHBondContact O-N 2.97Å; N466-Q469 PolarHBondContact OD1-OE1 2.98Å; N466-L470 HydrophobicContact CB-CD1 4.12Å; N466-L470 HydrophobicContact CB-CG 4.17Å; N466-L470 WeakPolarHBondContact O-CG 3.48Å; N466-L470 PolarHBondContact O-N 2.71Å; N466-L470 VanDerWaalsContact O-N 3.12Å
467Q89.8Confident91Very high34 Ų3454 Ų5416%0.15927%0.266CS..Hα-helixtrans-46-51.2-175.6-177.5167.217.200113.8F463 Q469 L470 E471 R548F463-Q467 HydrophobicContact CD1-CG 4.44Å; F463-Q467 WeakPolarHBondContact O-CA 3.23Å; F463-Q467 VanDerWaalsContact O-CB 3.24Å; F463-Q467 WeakPolarHBondContact O-CB 3.34Å; F463-Q467 PolarHBondContact O-N 3.37Å; Q467-Q469 VanDerWaalsContact C-N 3.26Å; Q467-Q469 PolarHBondContact O-N 2.78Å; Q467-L470 PolarHBondContact O-N 2.86Å; Q467-E471 VanDerWaalsContact CG-CD 3.46Å; Q467-E471 HydrophobicContact CG-CG 4.06Å; Q467-E471 WeakPolarHBondContact CG-OE1 3.43Å; Q467-E471 PolarHBondContact NE2-OE1 2.7Å; Q467-E471 WeakPolarHBondContact O-CB 3.35Å; Q467-E471 WeakPolarHBondContact O-CG 3.36Å; Q467-E471 PolarHBondContact O-N 2.88Å; Q467-R548 VanDerWaalsContact CD-NH2 3.26Å; Q467-R548 VanDerWaalsContact NE2-NH2 3.2Å
468A87.2Confident90.6Very high71 Ų7159.1 Ų59.159%0.58729%0.293SS*.Hα-helixtrans-58.5-36.9-17200000113.1N466 E472N466-A468 VanDerWaalsContact C-N 3.33Å; N466-A468 PolarHBondContact O-N 3.08Å; A468-E472 WeakPolarHBondContact O-CG 3.47Å
469Q86.6Confident90.1Very high63 Ų6361.5 Ų61.529%0.29431%0.306SS..Hα-helixtrans-84.8-37.2179.4-63.9-176.4-0.800111.9N466 Q467 E471 E472N466-Q469 PolarHBondContact O-N 2.97Å; N466-Q469 PolarHBondContact OD1-OE1 2.98Å; Q467-Q469 VanDerWaalsContact C-N 3.26Å; Q467-Q469 PolarHBondContact O-N 2.78Å; Q469-E471 VanDerWaalsContact C-N 3.27Å; Q469-E471 PolarHBondContact O-N 2.89Å; Q469-E472 PolarHBondContact O-N 2.98Å; Q469-E472 VanDerWaalsContact O-N 3.17Å
470L91Very high89.7Confident4 Ų468.2 Ų68.22%0.02134%0.342CS..Hα-helixtrans-70.4-24.7-178.8-60.2176.4000112.7R460 F463 N466 Q467 E472 L473 W486 Y489R460-L470 WeakPolarHBondContact O-CD2 3.36Å; F463-L470 HydrophobicContact CD1-CB 4.09Å; F463-L470 HydrophobicContact CD2-CD1 3.86Å; F463-L470 HydrophobicContact CE1-CB 3.67Å; F463-L470 HydrophobicContact CE2-CB 4.14Å; F463-L470 HydrophobicContact CE2-CD1 4.03Å; F463-L470 HydrophobicContact CG-CB 4.48Å; F463-L470 HydrophobicContact CG-CD1 4.1Å; F463-L470 HydrophobicContact CZ-CB 3.69Å; F463-L470 HydrophobicContact CZ-CD1 4.43Å; N466-L470 HydrophobicContact CB-CD1 4.12Å; N466-L470 HydrophobicContact CB-CG 4.17Å; N466-L470 WeakPolarHBondContact O-CG 3.48Å; N466-L470 PolarHBondContact O-N 2.71Å; N466-L470 VanDerWaalsContact O-N 3.12Å; Q467-L470 PolarHBondContact O-N 2.86Å; L470-E472 VanDerWaalsContact C-N 3.32Å; L470-L473 HydrophobicContact CD2-CD1 4.05Å; L470-W486 HydrophobicContact CB-CZ3 3.92Å; L470-W486 HydrophobicContact CD1-CH2 4.36Å; L470-W486 HydrophobicContact CD1-CZ3 4.16Å; L470-W486 HydrophobicContact CD2-CE3 4.47Å; L470-W486 HydrophobicContact CD2-CH2 4.43Å; L470-W486 HydrophobicContact CD2-CZ3 3.61Å; L470-W486 HydrophobicContact CG-CZ3 4.06Å; L470-Y489 HydrophobicContact CD2-CD1 4.06Å; L470-Y489 HydrophobicContact CD2-CE1 3.54Å
471E90.1Very high89.1Confident102 Ų10272 Ų7248%0.47736%0.364SS..THydrogen-bonded Turntrans-75.6-17.3172.6-73.5178.7165.600113.5F463 Q467 Q469F463-E471 HydrophobicContact CD1-CG 4.41Å; F463-E471 HydrophobicContact CE1-CG 4.07Å; Q467-E471 VanDerWaalsContact CG-CD 3.46Å; Q467-E471 HydrophobicContact CG-CG 4.06Å; Q467-E471 WeakPolarHBondContact CG-OE1 3.43Å; Q467-E471 PolarHBondContact NE2-OE1 2.7Å; Q467-E471 WeakPolarHBondContact O-CB 3.35Å; Q467-E471 WeakPolarHBondContact O-CG 3.36Å; Q467-E471 PolarHBondContact O-N 2.88Å; Q469-E471 VanDerWaalsContact C-N 3.27Å; Q469-E471 PolarHBondContact O-N 2.89Å
472E90.3Very high88.6Confident148 Ų14879.4 Ų79.469%0.69240%0.399SS*.THydrogen-bonded Turntrans-83.8-19.4177.4-71176.6178.200112.8A468 Q469 L470A468-E472 WeakPolarHBondContact O-CG 3.47Å; Q469-E472 PolarHBondContact O-N 2.98Å; Q469-E472 VanDerWaalsContact O-N 3.17Å; L470-E472 VanDerWaalsContact C-N 3.32Å
473L91.1Very high88.2Confident13 Ų1381.5 Ų81.57%0.06841%0.409CS..SBendtrans-73.9133.9-179.3-62.2173000111.3L470 E485 W486 Y489L470-L473 HydrophobicContact CD2-CD1 4.05Å; L473-E485 HydrophobicContact CD2-CG 3.96Å; L473-E485 WeakPolarHBondContact CD2-OE1 3.32Å; L473-W486 HydrophobicContact CB-CB 4.42Å; L473-W486 HydrophobicContact CD1-CE3 3.86Å; L473-W486 HydrophobicContact CD1-CZ3 4.37Å; L473-Y489 HydrophobicContact CD1-CD1 3.98Å; L473-Y489 HydrophobicContact CD1-CD2 4.02Å; L473-Y489 HydrophobicContact CD1-CG 3.68Å
474D89Confident88.1Confident47 Ų4781.4 Ų81.425%0.25141%0.409SS..  trans-70.5129.8176.3-17945.5000112.5E476 T477 E485 W486D474-E476 PolarHBondContact OD1-N 2.94Å; D474-E476 VanDerWaalsContact OD1-N 3.17Å; D474-T477 WeakPolarHBondContact OD2-CA 3.24Å; D474-T477 WeakPolarHBondContact OD2-CB 3.4Å; D474-T477 WeakPolarHBondContact OD2-CG2 3.46Å; D474-T477 PolarHBondContact OD2-N 3.37Å; D474-T477 PolarHBondContact OD2-OG1 3.46Å; D474-E485 HydrophobicContact CB-CB 4.12Å; D474-E485 PolarHBondContact N-OE2 3.37Å; D474-E485 WeakPolarHBondContact O-CB 3.41Å; D474-E485 PolarHBondContact O-N 3.35Å; D474-W486 PolarHBondContact O-N 3.25Å
475D88.1Confident88.1Confident62 Ų6280.5 Ų80.533%0.33241%0.409SS..SBendtrans-119.815.1178.5-158.115.7000111.8T484 W486 R555D475-T484 PolarHBondContact OD1-OG1 2.97Å; D475-W486 HydrophobicContact CB-CB 4.06Å; D475-W486 HydrophobicContact CB-CG 4.47Å; D475-W486 VanDerWaalsContact OD1-CD1 3.26Å; D475-R555 IonicContact OD2-CZ 2.76Å; D475-R555 IonicContact OD2-NH1 3.65Å; D475-R555 PolarHBondContact OD2-NH1 2.87Å; D475-R555 VanDerWaalsContact OD2-NH1 3.17Å; D475-R555 IonicContact OD2-NH2 3.61Å; D475-R555 PolarHBondContact OD2-NH2 3.5Å
476E86.2Confident88.2Confident174 Ų17474.5 Ų74.581%0.81339%0.385SS*.SBendtrans-118.6-42.6-177.8-62.8-168.5170.400114.1D474D474-E476 PolarHBondContact OD1-N 2.94Å; D474-E476 VanDerWaalsContact OD1-N 3.17Å
477T87.5Confident88.3Confident96 Ų9677.4 Ų77.459%0.58940%0.398SS*.  trans-87.5138.7-176.375.50000111.4D474 T484D474-T477 WeakPolarHBondContact OD2-CA 3.24Å; D474-T477 WeakPolarHBondContact OD2-CB 3.4Å; D474-T477 WeakPolarHBondContact OD2-CG2 3.46Å; D474-T477 PolarHBondContact OD2-N 3.37Å; D474-T477 PolarHBondContact OD2-OG1 3.46Å; T477-T484 WeakPolarHBondContact O-CA 3.49Å
478L87.3Confident88.3Confident108 Ų10880.7 Ų80.757%0.56541%0.409SS*.  trans-98.4132.8178.9-60.5178.5000109.7Q483 T484L478-Q483 WeakPolarHBondContact CA-O 3.29Å; L478-T484 HydrophobicContact CD2-CG2 3.79Å
479D85.8Confident88.6Confident57 Ų5777.3 Ų77.331%0.30538%0.381SS..  trans-76.4-177.1170.670.82.6000112.3D481 Q482 Q483 R488D479-D481 PolarHBondContact O-N 3.01Å; D479-D481 VanDerWaalsContact O-N 3.15Å; D479-D481 WeakPolarHBondContact OD1-CA 2.98Å; D479-D481 WeakPolarHBondContact OD1-CB 3.47Å; D479-D481 PolarHBondContact OD1-N 3.2Å; D479-Q482 PolarHBondContact O-N 2.91Å; D479-Q482 PolarHBondContact OD1-N 2.9Å; D479-Q483 VanDerWaalsContact CG-O 3.28Å; D479-Q483 PolarHBondContact N-O 3.22Å; D479-Q483 PolarHBondContact OD1-N 3.06Å; D479-Q483 VanDerWaalsContact OD1-O 3.13Å; D479-R488 IonicContact OD2-NH1 3.29Å
480D85Confident89Confident172 Ų17274.3 Ų74.392%0.9237%0.367SS*.THydrogen-bonded Turntrans-59.6-22.8178.4-68.6-27.2000112.9Q482D480-Q482 VanDerWaalsContact C-N 3.32Å
481D81.3Confident89.1Confident108 Ų10881.5 Ų81.558%0.57839%0.394SS*.THydrogen-bonded Turntrans-89.86.3176.9-70.3-41.4000112.9D479 Q483D479-D481 PolarHBondContact O-N 3.01Å; D479-D481 VanDerWaalsContact O-N 3.15Å; D479-D481 WeakPolarHBondContact OD1-CA 2.98Å; D479-D481 WeakPolarHBondContact OD1-CB 3.47Å; D479-D481 PolarHBondContact OD1-N 3.2Å; D481-Q483 VanDerWaalsContact C-N 3.31Å; D481-Q483 HydrophobicContact CB-CG 4.42Å; D481-Q483 PolarHBondContact O-N 3.45Å
482Q84.6Confident89.2Confident156 Ų15678.5 Ų78.573%0.72938%0.38SS*.SBendtrans59.935.9-174.1-54.6-179.211.900113.3D479 D480D479-Q482 PolarHBondContact O-N 2.91Å; D479-Q482 PolarHBondContact OD1-N 2.9Å; D480-Q482 VanDerWaalsContact C-N 3.32Å
483Q87.3Confident89.5Confident45 Ų4571.4 Ų71.421%0.2135%0.347CS..  trans-121.6147.4177.9-55.1-168-14.200111L478 D479 D481 Q487 R491L478-Q483 WeakPolarHBondContact CA-O 3.29Å; D479-Q483 VanDerWaalsContact CG-O 3.28Å; D479-Q483 PolarHBondContact N-O 3.22Å; D479-Q483 PolarHBondContact OD1-N 3.06Å; D479-Q483 VanDerWaalsContact OD1-O 3.13Å; D481-Q483 VanDerWaalsContact C-N 3.31Å; D481-Q483 HydrophobicContact CB-CG 4.42Å; D481-Q483 PolarHBondContact O-N 3.45Å; Q483-Q487 HydrophobicContact CB-CB 4.31Å; Q483-R491 VanDerWaalsContact OE1-NH1 3.14Å
484T91.3Very high89.7Confident4 Ų471.3 Ų71.33%0.02535%0.346CS..  trans-80.6162.1169.966.70000110.8D475 T477 L478 W486 Q487 R488D475-T484 PolarHBondContact OD1-OG1 2.97Å; T477-T484 WeakPolarHBondContact O-CA 3.49Å; L478-T484 HydrophobicContact CD2-CG2 3.79Å; T484-W486 VanDerWaalsContact C-N 3.27Å; T484-W486 PolarHBondContact O-N 3.42Å; T484-Q487 WeakPolarHBondContact O-CB 3.36Å; T484-Q487 PolarHBondContact O-N 2.98Å; T484-Q487 VanDerWaalsContact O-N 3.09Å; T484-Q487 WeakPolarHBondContact OG1-CG 3.41Å; T484-Q487 PolarHBondContact OG1-N 3.26Å; T484-R488 PolarHBondContact O-N 3.46Å
485E91Very high89.9Confident80 Ų8072.2 Ų72.237%0.37435%0.349SS..Hα-helixtrans-57.6-43.2175-170.1-171.6-173.700111.2L473 D474 Q487 R488 Y489L473-E485 HydrophobicContact CD2-CG 3.96Å; L473-E485 WeakPolarHBondContact CD2-OE1 3.32Å; D474-E485 HydrophobicContact CB-CB 4.12Å; D474-E485 PolarHBondContact N-OE2 3.37Å; D474-E485 WeakPolarHBondContact O-CB 3.41Å; D474-E485 PolarHBondContact O-N 3.35Å; E485-Q487 PolarHBondContact O-N 2.94Å; E485-R488 PolarHBondContact O-N 3.48Å; E485-Y489 WeakPolarHBondContact O-CB 3.43Å; E485-Y489 PolarHBondContact O-N 2.9Å
486W91.4Very high90.3Very high7 Ų769.3 Ų69.33%0.02733%0.333CS..Hα-helixtrans-55.9-46.9172.2167.7-109.3000112.6F463 L470 L473 D474 D475 T484 Y489 L490 S559F463-W486 HydrophobicContact CD2-CH2 4.4Å; F463-W486 AromaticContact CE2-CH2 3.45Å; F463-W486 HydrophobicContact CE2-CH2 3.45Å; F463-W486 VanDerWaalsContact CE2-CH2 3.45Å; F463-W486 HydrophobicContact CE2-CZ2 4.04Å; F463-W486 AromaticContact CE2-CZ3 3.87Å; F463-W486 HydrophobicContact CE2-CZ3 3.87Å; F463-W486 HydrophobicContact CZ-CH2 4.04Å; F463-W486 HydrophobicContact CZ-CZ3 4.01Å; L470-W486 HydrophobicContact CB-CZ3 3.92Å; L470-W486 HydrophobicContact CD1-CH2 4.36Å; L470-W486 HydrophobicContact CD1-CZ3 4.16Å; L470-W486 HydrophobicContact CD2-CE3 4.47Å; L470-W486 HydrophobicContact CD2-CH2 4.43Å; L470-W486 HydrophobicContact CD2-CZ3 3.61Å; L470-W486 HydrophobicContact CG-CZ3 4.06Å; L473-W486 HydrophobicContact CB-CB 4.42Å; L473-W486 HydrophobicContact CD1-CE3 3.86Å; L473-W486 HydrophobicContact CD1-CZ3 4.37Å; D474-W486 PolarHBondContact O-N 3.25Å; D475-W486 HydrophobicContact CB-CB 4.06Å; D475-W486 HydrophobicContact CB-CG 4.47Å; D475-W486 VanDerWaalsContact OD1-CD1 3.26Å; T484-W486 VanDerWaalsContact C-N 3.27Å; T484-W486 PolarHBondContact O-N 3.42Å; W486-Y489 PolarHBondContact O-N 3.44Å; W486-L490 HydrophobicContact CZ2-CD2 4.33Å; W486-L490 WeakPolarHBondContact O-CB 3.24Å; W486-L490 PolarHBondContact O-N 2.9Å; W486-S559 WeakPolarHBondContact CZ2-OG 3.39Å
487Q91.6Very high90.8Very high74 Ų7461.1 Ų61.135%0.34630%0.296SS..Hα-helixtrans-65.2-41.1179.7-73.4166.811.900111.9Q483 T484 E485 L490 R491Q483-Q487 HydrophobicContact CB-CB 4.31Å; T484-Q487 WeakPolarHBondContact O-CB 3.36Å; T484-Q487 PolarHBondContact O-N 2.98Å; T484-Q487 VanDerWaalsContact O-N 3.09Å; T484-Q487 WeakPolarHBondContact OG1-CG 3.41Å; T484-Q487 PolarHBondContact OG1-N 3.26Å; E485-Q487 PolarHBondContact O-N 2.94Å; Q487-L490 PolarHBondContact O-N 3.45Å; Q487-R491 VanDerWaalsContact O-CB 3.23Å; Q487-R491 WeakPolarHBondContact O-CB 3.35Å; Q487-R491 PolarHBondContact O-N 2.98Å
488R91.6Very high91.2Very high103 Ų10356.6 Ų56.639%0.38927%0.268SS..Hα-helixtrans-61-47.7175.1-173.1-178.7-177.21001.6111D479 T484 E485 L490 R491 Q492D479-R488 IonicContact OD2-NH1 3.29Å; T484-R488 PolarHBondContact O-N 3.46Å; E485-R488 PolarHBondContact O-N 3.48Å; R488-L490 PolarHBondContact O-N 3.36Å; R488-R491 PolarHBondContact O-N 3.33Å; R488-Q492 PolarHBondContact O-N 3.39Å
489Y93.3Very high91.5Very high0 Ų052.7 Ų52.70%025%0.246CC..Hα-helixtrans-57.3-48.5177.4-178.5-87.7000112.6H411 Y414 F415 I461 L470 L473 E485 W486 S493H411-Y489 AromaticContact ND1-CE2 3.73Å; Y414-Y489 HydrophobicContact CD1-CD2 4.48Å; Y414-Y489 AromaticContact CD1-CE2 3.71Å; Y414-Y489 HydrophobicContact CD1-CE2 3.71Å; Y414-Y489 HydrophobicContact CE1-CD2 4.47Å; Y414-Y489 AromaticContact CE1-CE2 3.65Å; Y414-Y489 HydrophobicContact CE1-CE2 3.65Å; Y414-Y489 AromaticContact CE1-CZ 3.82Å; F415-Y489 AromaticContact CE1-CD2 3.43Å; F415-Y489 HydrophobicContact CE1-CD2 3.43Å; F415-Y489 VanDerWaalsContact CE1-CD2 3.43Å; F415-Y489 HydrophobicContact CE1-CE2 4.11Å; F415-Y489 HydrophobicContact CE1-CG 4.08Å; F415-Y489 AromaticContact CZ-CD2 3.61Å; F415-Y489 HydrophobicContact CZ-CD2 3.61Å; F415-Y489 HydrophobicContact CZ-CG 4.16Å; I461-Y489 HydrophobicContact CG2-CE1 4.28Å; L470-Y489 HydrophobicContact CD2-CD1 4.06Å; L470-Y489 HydrophobicContact CD2-CE1 3.54Å; L473-Y489 HydrophobicContact CD1-CD1 3.98Å; L473-Y489 HydrophobicContact CD1-CD2 4.02Å; L473-Y489 HydrophobicContact CD1-CG 3.68Å; E485-Y489 WeakPolarHBondContact O-CB 3.43Å; E485-Y489 PolarHBondContact O-N 2.9Å; W486-Y489 PolarHBondContact O-N 3.44Å; Y489-S493 WeakPolarHBondContact O-CB 3.07Å; Y489-S493 PolarHBondContact O-N 3.01Å; Y489-S493 PolarHBondContact O-OG 3.41Å
490L93.8Very high92Very high1 Ų150 Ų501%0.00523%0.232CC..Hα-helixtrans-65.3-47.1180-177.559.7000110.7I461 W486 Q487 R488 Q492 S493 L494 Q562I461-L490 HydrophobicContact CB-CD1 3.89Å; I461-L490 HydrophobicContact CD1-CD1 4.01Å; I461-L490 HydrophobicContact CG2-CD1 3.9Å; W486-L490 HydrophobicContact CZ2-CD2 4.33Å; W486-L490 WeakPolarHBondContact O-CB 3.24Å; W486-L490 PolarHBondContact O-N 2.9Å; Q487-L490 PolarHBondContact O-N 3.45Å; R488-L490 PolarHBondContact O-N 3.36Å; L490-Q492 PolarHBondContact O-N 3.49Å; L490-S493 PolarHBondContact O-N 3.33Å; L490-L494 HydrophobicContact CD1-CD1 4.01Å; L490-L494 HydrophobicContact CD1-CD2 4.43Å; L490-L494 HydrophobicContact CD1-CG 4Å; L490-L494 HydrophobicContact CG-CD1 3.92Å; L490-L494 HydrophobicContact CG-CG 4.27Å; L490-L494 WeakPolarHBondContact O-CB 3.29Å; L490-L494 VanDerWaalsContact O-CG 3.25Å; L490-L494 WeakPolarHBondContact O-CG 2.76Å; L490-L494 PolarHBondContact O-N 3.13Å; L490-Q562 HydrophobicContact CD2-CB 4.25Å; L490-Q562 VanDerWaalsContact CD2-CD 3.46Å; L490-Q562 HydrophobicContact CD2-CG 4.45Å
491R93.2Very high92.3Very high155 Ų15541.9 Ų41.959%0.58519%0.188SC*.Hα-helixtrans-59.1-47.2-179.1-177.7-178.6177.4-170.5-0112.4Q483 Q487 R488 S493 L494 E495Q483-R491 VanDerWaalsContact OE1-NH1 3.14Å; Q487-R491 VanDerWaalsContact O-CB 3.23Å; Q487-R491 WeakPolarHBondContact O-CB 3.35Å; Q487-R491 PolarHBondContact O-N 2.98Å; R488-R491 PolarHBondContact O-N 3.33Å; R491-S493 VanDerWaalsContact C-N 3.34Å; R491-S493 PolarHBondContact O-N 3.14Å; R491-L494 PolarHBondContact O-N 3.35Å; R491-E495 PolarHBondContact O-N 3.23Å
492Q92.6Very high92.8Very high38 Ų3840.4 Ų40.418%0.17818%0.178CC..Hα-helixtrans-67-37.6-178.6-162.5168.99.300111.7L418 D419 R488 L490 E495L418-Q492 HydrophobicContact CB-CG 4.48Å; L418-Q492 HydrophobicContact CD1-CB 4.48Å; L418-Q492 HydrophobicContact CD1-CG 4.16Å; D419-Q492 PolarHBondContact OD1-NE2 3.29Å; R488-Q492 PolarHBondContact O-N 3.39Å; L490-Q492 PolarHBondContact O-N 3.49Å; Q492-E495 PolarHBondContact O-N 3.49Å
493S95.8Very high93.2Very high0 Ų033.7 Ų33.70%015%0.147CC..Hα-helixtrans-63.8-44.5172.8-61.30000111.8Y414 V457 Y489 L490 R491 E495 V496 V497Y414-S493 PolarHBondContact OH-OG 3.46Å; V457-S493 WeakPolarHBondContact CG1-O 3.23Å; Y489-S493 WeakPolarHBondContact O-CB 3.07Å; Y489-S493 PolarHBondContact O-N 3.01Å; Y489-S493 PolarHBondContact O-OG 3.41Å; L490-S493 PolarHBondContact O-N 3.33Å; R491-S493 VanDerWaalsContact C-N 3.34Å; R491-S493 PolarHBondContact O-N 3.14Å; S493-E495 VanDerWaalsContact C-N 3.31Å; S493-E495 PolarHBondContact O-N 2.81Å; S493-V496 PolarHBondContact O-N 3Å; S493-V497 PolarHBondContact O-N 3.42Å
494L95.3Very high93.4Very high11 Ų1132.2 Ų32.26%0.05814%0.14CC..Hα-helixtrans-68.3-26.3179.7-69.2-177.4000113.6I461 L490 R491 V496 V497 A498 Q562 A563I461-L494 HydrophobicContact CD1-CD2 3.9Å; L490-L494 HydrophobicContact CD1-CD1 4.01Å; L490-L494 HydrophobicContact CD1-CD2 4.43Å; L490-L494 HydrophobicContact CD1-CG 4Å; L490-L494 HydrophobicContact CG-CD1 3.92Å; L490-L494 HydrophobicContact CG-CG 4.27Å; L490-L494 WeakPolarHBondContact O-CB 3.29Å; L490-L494 VanDerWaalsContact O-CG 3.25Å; L490-L494 WeakPolarHBondContact O-CG 2.76Å; L490-L494 PolarHBondContact O-N 3.13Å; R491-L494 PolarHBondContact O-N 3.35Å; L494-V496 VanDerWaalsContact C-N 3.33Å; L494-V497 WeakPolarHBondContact O-CB 3.42Å; L494-V497 PolarHBondContact O-N 3.42Å; L494-A498 WeakPolarHBondContact O-CB 3.37Å; L494-A498 PolarHBondContact O-N 3.26Å; L494-Q562 HydrophobicContact CD1-CB 4.15Å; L494-A563 HydrophobicContact CD1-CB 4.44Å; L494-A563 HydrophobicContact CD2-CB 3.46Å; L494-A563 VanDerWaalsContact CD2-CB 3.46Å
495E94.9Very high93.4Very high65 Ų6534.1 Ų34.130%0.30415%0.153SC..Hα-helixtrans-66.7-36.7175-172.256.5-153.600111.8R491 Q492 S493 A498 K499 R566R491-E495 PolarHBondContact O-N 3.23Å; Q492-E495 PolarHBondContact O-N 3.49Å; S493-E495 VanDerWaalsContact C-N 3.31Å; S493-E495 PolarHBondContact O-N 2.81Å; E495-A498 PolarHBondContact O-N 3.48Å; E495-K499 WeakPolarHBondContact O-CG 3.3Å; E495-K499 PolarHBondContact O-N 3.38Å; E495-K499 WeakPolarHBondContact OE1-CE 3.45Å; E495-R566 IonicContact OE1-NH2 3.67Å; E495-R566 IonicContact OE2-CZ 2.61Å; E495-R566 IonicContact OE2-NE 2.73Å; E495-R566 PolarHBondContact OE2-NE 3.28Å; E495-R566 IonicContact OE2-NH2 2.74Å; E495-R566 PolarHBondContact OE2-NH2 3.07Å
496V96.1Very high93.3Very high1 Ų135.1 Ų35.11%0.00617%0.165CC..Hα-helixtrans-65.6-42.8172177.10000110.7L418 L425 L453 V457 S493 L494 A498 K499 V500L418-V496 HydrophobicContact CB-CG2 4.1Å; L418-V496 HydrophobicContact CD2-CG2 4.1Å; L418-V496 HydrophobicContact CG-CG2 4.47Å; L425-V496 HydrophobicContact CD1-CG1 4.08Å; L453-V496 HydrophobicContact CD2-CG1 3.85Å; L453-V496 HydrophobicContact CG-CG1 4.2Å; V457-V496 HydrophobicContact CG2-CG1 4.35Å; S493-V496 PolarHBondContact O-N 3Å; L494-V496 VanDerWaalsContact C-N 3.33Å; V496-A498 VanDerWaalsContact C-N 3.32Å; V496-A498 PolarHBondContact O-N 2.96Å; V496-K499 PolarHBondContact O-N 2.88Å; V496-V500 WeakPolarHBondContact O-CG2 3.28Å; V496-V500 PolarHBondContact O-N 3.16Å
497V96.2Very high93.4Very high3 Ų338.1 Ų38.12%0.01818%0.179CC..Hα-helixtrans-58.1-44.2174.3173.80000111.3L454 V457 L458 S493 L494 V500 M501L454-V497 HydrophobicContact CD1-CB 4.2Å; L454-V497 HydrophobicContact CD1-CG1 3.69Å; L454-V497 HydrophobicContact CD1-CG2 4.07Å; V457-V497 HydrophobicContact CB-CG2 4.36Å; V457-V497 HydrophobicContact CG1-CG2 3.73Å; L458-V497 HydrophobicContact CD2-CG2 4.13Å; L458-V497 HydrophobicContact CG-CG2 4.46Å; S493-V497 PolarHBondContact O-N 3.42Å; L494-V497 WeakPolarHBondContact O-CB 3.42Å; L494-V497 PolarHBondContact O-N 3.42Å; V497-V500 PolarHBondContact O-N 3.13Å; V497-M501 PolarHBondContact O-N 3.28Å
498A95.1Very high93.4Very high0 Ų034.7 Ų34.70%016%0.163CC..Hα-helixtrans-62.7-45.3178.400000112.2L494 E495 V496 V500 M501 E502 R566 L567 Y570L494-A498 WeakPolarHBondContact O-CB 3.37Å; L494-A498 PolarHBondContact O-N 3.26Å; E495-A498 PolarHBondContact O-N 3.48Å; V496-A498 VanDerWaalsContact C-N 3.32Å; V496-A498 PolarHBondContact O-N 2.96Å; A498-V500 VanDerWaalsContact C-N 3.34Å; A498-V500 PolarHBondContact O-N 2.9Å; A498-M501 WeakPolarHBondContact O-CA 3.25Å; A498-M501 WeakPolarHBondContact O-CB 3.26Å; A498-M501 PolarHBondContact O-N 3.49Å; A498-M501 VanDerWaalsContact O-N 3.1Å; A498-E502 PolarHBondContact O-N 3.04Å; A498-R566 HydrophobicContact CB-CG 4.25Å; A498-L567 HydrophobicContact CB-CD2 4.23Å; A498-Y570 HydrophobicContact CB-CE2 3.93Å; A498-Y570 PolarHBondContact O-OH 2.94Å; A498-Y570 VanDerWaalsContact O-OH 3.1Å
499K95Very high93.4Very high26 Ų2631.4 Ų31.411%0.11315%0.152CC..Hα-helixtrans-64.6-36.7176.4-73178.1-176.4-111.50112.8T422 L425 D426 E495 V496 E502 L503T422-K499 HydrophobicContact CG2-CD 3.79Å; T422-K499 VanDerWaalsContact CG2-CE 3.47Å; L425-K499 HydrophobicContact CB-CB 4.1Å; L425-K499 HydrophobicContact CB-CD 4.36Å; L425-K499 HydrophobicContact CD1-CB 3.68Å; L425-K499 HydrophobicContact CD1-CD 4.48Å; L425-K499 HydrophobicContact CG-CB 4.45Å; D426-K499 IonicContact OD1-NZ 4Å; D426-K499 PolarHBondContact OD1-NZ 3.18Å; D426-K499 IonicContact OD2-NZ 2.88Å; D426-K499 PolarHBondContact OD2-NZ 3.06Å; E495-K499 WeakPolarHBondContact O-CG 3.3Å; E495-K499 PolarHBondContact O-N 3.38Å; E495-K499 WeakPolarHBondContact OE1-CE 3.45Å; V496-K499 PolarHBondContact O-N 2.88Å; K499-E502 PolarHBondContact O-N 2.81Å; K499-L503 PolarHBondContact O-N 3.49Å
500V95.3Very high93.4Very high1 Ų134.6 Ų34.61%0.00617%0.174CC..Hα-helixtrans-67.3-37.1172178.60000111.1L425 L450 L453 L454 V496 V497 A498 E502 L503 L504L425-V500 HydrophobicContact CD1-CG2 4.07Å; L425-V500 HydrophobicContact CD2-CG2 4.11Å; L450-V500 HydrophobicContact CB-CG1 4.26Å; L453-V500 HydrophobicContact CD2-CG2 4.27Å; L454-V500 HydrophobicContact CB-CG1 4.14Å; V496-V500 WeakPolarHBondContact O-CG2 3.28Å; V496-V500 PolarHBondContact O-N 3.16Å; V497-V500 PolarHBondContact O-N 3.13Å; A498-V500 VanDerWaalsContact C-N 3.34Å; A498-V500 PolarHBondContact O-N 2.9Å; V500-E502 PolarHBondContact O-N 2.87Å; V500-L503 PolarHBondContact O-N 3.25Å; V500-L503 VanDerWaalsContact O-N 3.17Å; V500-L504 PolarHBondContact O-N 3.43Å
501M92.3Very high93.5Very high2 Ų236.1 Ų36.11%0.0118%0.183CC..Hα-helixtrans-62.1-37.4173.6-176.981.6160.200112.6V497 A498 L503 P505 A508 L567 Y570 F571V497-M501 PolarHBondContact O-N 3.28Å; A498-M501 WeakPolarHBondContact O-CA 3.25Å; A498-M501 WeakPolarHBondContact O-CB 3.26Å; A498-M501 PolarHBondContact O-N 3.49Å; A498-M501 VanDerWaalsContact O-N 3.1Å; M501-L503 PolarHBondContact O-N 2.85Å; M501-P505 VanDerWaalsContact O-CA 3.27Å; M501-P505 WeakPolarHBondContact O-CA 3.47Å; M501-P505 WeakPolarHBondContact O-CD 3.42Å; M501-A508 HydrophobicContact CB-CB 4.1Å; M501-A508 HydrophobicContact CG-CB 4.39Å; M501-A508 HydrophobicContact SD-CB 3.47Å; M501-A508 WeakPolarHBondContact SD-CB 3.34Å; M501-L567 HydrophobicContact CB-CD2 3.8Å; M501-L567 HydrophobicContact CE-CB 4.48Å; M501-L567 HydrophobicContact CE-CD1 4.27Å; M501-L567 HydrophobicContact CG-CD1 4.49Å; M501-L567 HydrophobicContact CG-CD2 3.9Å; M501-L567 HydrophobicContact SD-CD1 4.2Å; M501-Y570 HydrophobicContact CB-CD2 4.33Å; M501-Y570 HydrophobicContact CB-CE2 4.45Å; M501-Y570 HydrophobicContact CG-CD2 3.86Å; M501-Y570 HydrophobicContact CG-CE2 4.46Å; M501-Y570 HydrophobicContact CG-CG 3.91Å; M501-F571 HydrophobicContact CE-CE1 4.33Å; M501-F571 HydrophobicContact CE-CE2 4.04Å; M501-F571 HydrophobicContact CE-CZ 3.66Å
502E91.8Very high93.5Very high76 Ų7629 Ų2936%0.35516%0.157SC..Hα-helixtrans-59-37.1174.4-168.6-177.7166.300111.4T429 K433 A498 K499 V500 Y570T429-E502 WeakPolarHBondContact CG2-OE1 3.29Å; K433-E502 IonicContact NZ-OE1 2.64Å; K433-E502 PolarHBondContact NZ-OE1 2.9Å; A498-E502 PolarHBondContact O-N 3.04Å; K499-E502 PolarHBondContact O-N 2.81Å; V500-E502 PolarHBondContact O-N 2.87Å; E502-Y570 HydrophobicContact CB-CD1 4.43Å; E502-Y570 HydrophobicContact CB-CE1 3.68Å; E502-Y570 HydrophobicContact CG-CE1 4.11Å
503L91.9Very high93.6Very high15 Ų1528.9 Ų28.98%0.07916%0.156CC..Hα-helixtrans-86.5-45.8-176-68.2168.7000113.3L425 L428 T429 I432 L443 L450 K499 V500 M501 P505L425-L503 HydrophobicContact CD2-CD1 3.72Å; L428-L503 HydrophobicContact CD2-CD1 3.96Å; L428-L503 HydrophobicContact CG-CD1 4.32Å; L428-L503 HydrophobicContact CG-CD2 4.32Å; T429-L503 WeakPolarHBondContact OG1-CD2 3.12Å; I432-L503 HydrophobicContact CD1-CD2 3.49Å; I432-L503 VanDerWaalsContact CD1-CD2 3.49Å; L443-L503 HydrophobicContact CD2-CB 4.38Å; L443-L503 HydrophobicContact CD2-CD2 4.37Å; L450-L503 HydrophobicContact CD1-CD1 4.21Å; K499-L503 PolarHBondContact O-N 3.49Å; V500-L503 PolarHBondContact O-N 3.25Å; V500-L503 VanDerWaalsContact O-N 3.17Å; M501-L503 PolarHBondContact O-N 2.85Å; L503-P505 VanDerWaalsContact C-CD 3.41Å; L503-P505 WeakPolarHBondContact O-CD 3.09Å
504L92.2Very high93.6Very high14 Ų1431.9 Ų31.97%0.07318%0.175CC..  trans-126.863.9-174.5-61.8178.5000111.6L443 E447 L450 V451 V500 T506 H507 A508L443-L504 HydrophobicContact CD2-CD2 4.19Å; E447-L504 HydrophobicContact CG-CD1 4.31Å; L450-L504 HydrophobicContact CB-CD1 3.6Å; L450-L504 HydrophobicContact CD1-CD1 3.87Å; L450-L504 HydrophobicContact CD1-CG 4.27Å; L450-L504 HydrophobicContact CG-CD1 4.37Å; V451-L504 HydrophobicContact CG2-CD1 4.13Å; V500-L504 PolarHBondContact O-N 3.43Å; L504-T506 PolarHBondContact O-N 3.18Å; L504-H507 HydrophobicContact CB-CB 4.24Å; L504-H507 PolarHBondContact O-N 2.95Å; L504-A508 WeakPolarHBondContact O-CB 3.39Å; L504-A508 PolarHBondContact O-N 3.19Å
505P90.8Very high93.5Very high44 Ų4432.8 Ų32.829%0.28618%0.181SC..Hα-helixtrans-58.3-42.5-17117.3-30.4000114.3M501 L503 F509 R579M501-P505 VanDerWaalsContact O-CA 3.27Å; M501-P505 WeakPolarHBondContact O-CA 3.47Å; M501-P505 WeakPolarHBondContact O-CD 3.42Å; L503-P505 VanDerWaalsContact C-CD 3.41Å; L503-P505 WeakPolarHBondContact O-CD 3.09Å; P505-F509 WeakPolarHBondContact O-CB 3.49Å; P505-F509 PolarHBondContact O-N 2.77Å; P505-F509 VanDerWaalsContact O-N 3.1Å; P505-R579 VanDerWaalsContact C-NH2 3.27Å; P505-R579 PolarHBondContact O-NH2 3.25Å
506T89.8Confident93.5Very high101 Ų10129.8 Ų29.862%0.6217%0.167SC*.Hα-helixtrans-68.3-47-177.8-50.50000111.3L504 F509 S510L504-T506 PolarHBondContact O-N 3.18Å; T506-F509 PolarHBondContact O-N 3Å; T506-S510 WeakPolarHBondContact O-CB 3.4Å; T506-S510 PolarHBondContact O-N 3.42Å; T506-S510 PolarHBondContact O-OG 3.35Å
507H92Very high93.5Very high70 Ų7030.8 Ų30.832%0.32417%0.172SC..Hα-helixtrans-62-47.1177.4-68.6104.4000111E447 V451 L504 F509 S510 T511E447-H507 IonicContact OE1-CE1 3.45Å; E447-H507 PolarHBondContact OE1-CE1 3.43Å; E447-H507 IonicContact OE1-ND1 3.62Å; E447-H507 IonicContact OE1-NE2 3.95Å; E447-H507 PolarHBondContact OE1-NE2 3.24Å; V451-H507 HydrophobicContact CG2-CB 3.95Å; L504-H507 HydrophobicContact CB-CB 4.24Å; L504-H507 PolarHBondContact O-N 2.95Å; H507-F509 VanDerWaalsContact C-N 3.32Å; H507-F509 PolarHBondContact O-N 3.44Å; H507-S510 WeakPolarHBondContact CA-OG 3.47Å; H507-S510 PolarHBondContact O-N 3.34Å; H507-S510 VanDerWaalsContact O-N 3.09Å; H507-S510 PolarHBondContact O-OG 3.05Å; H507-T511 PolarHBondContact O-N 3.25Å; H507-T511 PolarHBondContact O-OG1 3.32Å; H507-T511 VanDerWaalsContact O-OG1 3.1Å
508A92.6Very high93.4Very high2 Ų235 Ų352%0.01719%0.194CC..Hα-helixtrans-59.4-42.3179.900000113L454 M501 L504 T511 L512L454-A508 VanDerWaalsContact CD2-CA 3.47Å; L454-A508 HydrophobicContact CD2-CB 3.87Å; M501-A508 HydrophobicContact CB-CB 4.1Å; M501-A508 HydrophobicContact CG-CB 4.39Å; M501-A508 HydrophobicContact SD-CB 3.47Å; M501-A508 WeakPolarHBondContact SD-CB 3.34Å; L504-A508 WeakPolarHBondContact O-CB 3.39Å; L504-A508 PolarHBondContact O-N 3.19Å; A508-T511 PolarHBondContact O-N 2.8Å; A508-L512 WeakPolarHBondContact O-CB 3.33Å; A508-L512 PolarHBondContact O-N 2.93Å
509F92.4Very high93.4Very high35 Ų3535.5 Ų35.515%0.15420%0.197CC..Hα-helixtrans-65-44.6173.5-172.3-98.3000112.5P505 T506 H507 T511 L512 F513 F571 D582 V586P505-F509 WeakPolarHBondContact O-CB 3.49Å; P505-F509 PolarHBondContact O-N 2.77Å; P505-F509 VanDerWaalsContact O-N 3.1Å; T506-F509 PolarHBondContact O-N 3Å; H507-F509 VanDerWaalsContact C-N 3.32Å; H507-F509 PolarHBondContact O-N 3.44Å; F509-T511 VanDerWaalsContact C-N 3.25Å; F509-T511 PolarHBondContact O-N 3.01Å; F509-L512 PolarHBondContact O-N 3.5Å; F509-F513 HydrophobicContact CD1-CB 4.34Å; F509-F513 HydrophobicContact CD2-CB 4.42Å; F509-F513 HydrophobicContact CE1-CB 4.05Å; F509-F513 HydrophobicContact CE1-CD1 4.38Å; F509-F513 HydrophobicContact CE1-CG 4.11Å; F509-F513 HydrophobicContact CE2-CB 4.14Å; F509-F513 HydrophobicContact CE2-CD2 4.09Å; F509-F513 HydrophobicContact CE2-CG 4.22Å; F509-F513 HydrophobicContact CZ-CB 3.95Å; F509-F513 HydrophobicContact CZ-CD1 4.27Å; F509-F513 AromaticContact CZ-CD2 3.87Å; F509-F513 HydrophobicContact CZ-CD2 3.87Å; F509-F513 HydrophobicContact CZ-CE2 4.49Å; F509-F513 AromaticContact CZ-CG 3.75Å; F509-F513 HydrophobicContact CZ-CG 3.75Å; F509-F513 VanDerWaalsContact O-CB 3.26Å; F509-F513 WeakPolarHBondContact O-CB 3.4Å; F509-F513 PolarHBondContact O-N 2.93Å; F509-F571 HydrophobicContact CD2-CE1 4.49Å; F509-F571 AromaticContact CD2-CZ 3.97Å; F509-F571 HydrophobicContact CD2-CZ 3.97Å; F509-F571 HydrophobicContact CE2-CZ 4.19Å; F509-D582 HydrophobicContact CD2-CB 4.46Å; F509-D582 HydrophobicContact CE1-CB 4.09Å; F509-D582 HydrophobicContact CE2-CB 4.03Å; F509-D582 HydrophobicContact CZ-CB 3.83Å; F509-V586 HydrophobicContact CE2-CG2 3.71Å; F509-V586 HydrophobicContact CZ-CG2 4.17Å
510S93Very high93.5Very high66 Ų6634.4 Ų34.446%0.46219%0.192SC..Hα-helixtrans-65.6-25.5-179.671.10000113.8T506 H507 P514T506-S510 WeakPolarHBondContact O-CB 3.4Å; T506-S510 PolarHBondContact O-N 3.42Å; T506-S510 PolarHBondContact O-OG 3.35Å; H507-S510 WeakPolarHBondContact CA-OG 3.47Å; H507-S510 PolarHBondContact O-N 3.34Å; H507-S510 VanDerWaalsContact O-N 3.09Å; H507-S510 PolarHBondContact O-OG 3.05Å; S510-P514 WeakPolarHBondContact O-CD 3.42Å; S510-P514 WeakPolarHBondContact O-CG 3.4Å
511T94.4Very high93.5Very high33 Ų3339.6 Ų39.620%0.20222%0.216CC..Hα-helixtrans-83.6-44.8174.9-55.50000111.5L454 L458 H507 A508 F509L454-T511 HydrophobicContact CD2-CG2 4.22Å; L458-T511 HydrophobicContact CD1-CG2 4.06Å; H507-T511 PolarHBondContact O-N 3.25Å; H507-T511 PolarHBondContact O-OG1 3.32Å; H507-T511 VanDerWaalsContact O-OG1 3.1Å; A508-T511 PolarHBondContact O-N 2.8Å; F509-T511 VanDerWaalsContact C-N 3.25Å; F509-T511 PolarHBondContact O-N 3.01Å
512L94.6Very high93.6Very high7 Ų742.5 Ų42.54%0.03723%0.234CC..Hα-helixtrans-76.2-46.4-174.3179.367000113.1L458 A508 F509 V515 L516 L560 A563 V564 L567L458-L512 HydrophobicContact CD1-CB 4.33Å; L458-L512 HydrophobicContact CD1-CD1 4.1Å; L458-L512 HydrophobicContact CD2-CD1 3.73Å; A508-L512 WeakPolarHBondContact O-CB 3.33Å; A508-L512 PolarHBondContact O-N 2.93Å; F509-L512 PolarHBondContact O-N 3.5Å; L512-V515 PolarHBondContact O-N 2.91Å; L512-L516 PolarHBondContact O-N 3.34Å; L512-L516 VanDerWaalsContact O-N 3.07Å; L512-L560 HydrophobicContact CD1-CD2 3.71Å; L512-A563 HydrophobicContact CD1-CB 4.15Å; L512-A563 HydrophobicContact CD2-CB 4.35Å; L512-V564 HydrophobicContact CD2-CG2 3.9Å; L512-V564 HydrophobicContact CG-CG2 4.37Å; L512-L567 HydrophobicContact CD2-CD1 3.42Å; L512-L567 VanDerWaalsContact CD2-CD1 3.42Å
513F94.4Very high93.8Very high35 Ų3539 Ų3915%0.15422%0.218CC..Hα-helixtrans-65.8-40.9-168-172.7-100.3000114F509 V515 L516 Q517 T585 V586 R589F509-F513 HydrophobicContact CD1-CB 4.34Å; F509-F513 HydrophobicContact CD2-CB 4.42Å; F509-F513 HydrophobicContact CE1-CB 4.05Å; F509-F513 HydrophobicContact CE1-CD1 4.38Å; F509-F513 HydrophobicContact CE1-CG 4.11Å; F509-F513 HydrophobicContact CE2-CB 4.14Å; F509-F513 HydrophobicContact CE2-CD2 4.09Å; F509-F513 HydrophobicContact CE2-CG 4.22Å; F509-F513 HydrophobicContact CZ-CB 3.95Å; F509-F513 HydrophobicContact CZ-CD1 4.27Å; F509-F513 AromaticContact CZ-CD2 3.87Å; F509-F513 HydrophobicContact CZ-CD2 3.87Å; F509-F513 HydrophobicContact CZ-CE2 4.49Å; F509-F513 AromaticContact CZ-CG 3.75Å; F509-F513 HydrophobicContact CZ-CG 3.75Å; F509-F513 VanDerWaalsContact O-CB 3.26Å; F509-F513 WeakPolarHBondContact O-CB 3.4Å; F509-F513 PolarHBondContact O-N 2.93Å; F513-V515 VanDerWaalsContact C-N 3.33Å; F513-V515 PolarHBondContact O-N 3.42Å; F513-L516 HydrophobicContact CD2-CD2 4.12Å; F513-L516 HydrophobicContact CE2-CD2 4.24Å; F513-L516 WeakPolarHBondContact O-CB 3.29Å; F513-L516 PolarHBondContact O-N 3.42Å; F513-Q517 WeakPolarHBondContact O-CB 3.27Å; F513-Q517 PolarHBondContact O-N 3.39Å; F513-T585 HydrophobicContact CE1-CG2 4.11Å; F513-T585 HydrophobicContact CE2-CG2 4.4Å; F513-T585 HydrophobicContact CZ-CG2 3.63Å; F513-V586 HydrophobicContact CD2-CG2 3.86Å; F513-V586 HydrophobicContact CE2-CG2 3.78Å; F513-R589 HydrophobicContact CZ-CG 4.47Å
514P94.9Very high93.9Very high63 Ų6339.6 Ų39.641%0.40922%0.221SC..Hα-helixtrans-60.5-41.7175.1-25.836.9000112.7S510 L516 Q517 D518S510-P514 WeakPolarHBondContact O-CD 3.42Å; S510-P514 WeakPolarHBondContact O-CG 3.4Å; P514-L516 VanDerWaalsContact C-N 3.34Å; P514-L516 PolarHBondContact O-N 3.39Å; P514-Q517 WeakPolarHBondContact O-CB 3.31Å; P514-Q517 PolarHBondContact O-N 3.42Å; P514-Q517 VanDerWaalsContact O-N 3.13Å; P514-D518 PolarHBondContact O-N 3.34Å
515V94.3Very high94Very high30 Ų3040 Ų4018%0.18223%0.229CC..Hα-helixtrans-65.7-38.7179.3179.80000111.5R464 L512 F513 N519 L560R464-V515 VanDerWaalsContact NH2-CG1 3.28Å; L512-V515 PolarHBondContact O-N 2.91Å; F513-V515 VanDerWaalsContact C-N 3.33Å; F513-V515 PolarHBondContact O-N 3.42Å; V515-N519 PolarHBondContact O-N 3.27Å; V515-N519 PolarHBondContact O-ND2 3Å; V515-L560 HydrophobicContact CG1-CD1 3.89Å; V515-L560 HydrophobicContact CG1-CD2 4.22Å
516L95.5Very high94.1Very high2 Ų238.1 Ų38.11%0.0122%0.216CC..Hα-helixtrans-61.1-48.2170176.777000111L512 F513 P514 D518 N519 L520 L557 L560 L561 V564L512-L516 PolarHBondContact O-N 3.34Å; L512-L516 VanDerWaalsContact O-N 3.07Å; F513-L516 HydrophobicContact CD2-CD2 4.12Å; F513-L516 HydrophobicContact CE2-CD2 4.24Å; F513-L516 WeakPolarHBondContact O-CB 3.29Å; F513-L516 PolarHBondContact O-N 3.42Å; P514-L516 VanDerWaalsContact C-N 3.34Å; P514-L516 PolarHBondContact O-N 3.39Å; L516-D518 VanDerWaalsContact C-N 3.34Å; L516-D518 PolarHBondContact O-N 3.48Å; L516-N519 PolarHBondContact O-N 3.14Å; L516-L520 HydrophobicContact CD1-CD1 4.35Å; L516-L520 HydrophobicContact CD1-CG 4.32Å; L516-L520 HydrophobicContact CD2-CD1 4.13Å; L516-L520 HydrophobicContact CG-CD1 3.84Å; L516-L520 HydrophobicContact CG-CG 4.16Å; L516-L520 WeakPolarHBondContact O-CB 3.45Å; L516-L520 VanDerWaalsContact O-CG 3.32Å; L516-L520 WeakPolarHBondContact O-CG 3.41Å; L516-L520 PolarHBondContact O-N 3.35Å; L516-L557 HydrophobicContact CD1-CD1 3.95Å; L516-L560 HydrophobicContact CD1-CB 3.79Å; L516-L561 HydrophobicContact CD1-CD2 4.27Å; L516-L561 HydrophobicContact CD1-CG 4.48Å; L516-V564 HydrophobicContact CD1-CG2 4.29Å; L516-V564 HydrophobicContact CD2-CG2 3.69Å; L516-V564 HydrophobicContact CG-CG2 4.45Å
517Q95.1Very high94.1Very high21 Ų2139.1 Ų39.110%0.09821%0.214CC..Hα-helixtrans-60.2-42.7-175.8-17856.73300111.8F513 P514 N519 L520 E521F513-Q517 WeakPolarHBondContact O-CB 3.27Å; F513-Q517 PolarHBondContact O-N 3.39Å; P514-Q517 WeakPolarHBondContact O-CB 3.31Å; P514-Q517 PolarHBondContact O-N 3.42Å; P514-Q517 VanDerWaalsContact O-N 3.13Å; Q517-N519 PolarHBondContact O-N 2.81Å; Q517-L520 WeakPolarHBondContact O-CB 3.32Å; Q517-L520 PolarHBondContact O-N 2.82Å; Q517-E521 PolarHBondContact NE2-OE1 2.93Å; Q517-E521 WeakPolarHBondContact O-CG 3.31Å; Q517-E521 PolarHBondContact O-N 3.19Å
518D94.4Very high94Very high92 Ų9242.8 Ų42.849%0.49223%0.231SC..Hα-helixtrans-59.1-46.5176.2-68.2-15.5000111.8P514 L516 E521 V522P514-D518 PolarHBondContact O-N 3.34Å; L516-D518 VanDerWaalsContact C-N 3.34Å; L516-D518 PolarHBondContact O-N 3.48Å; D518-E521 PolarHBondContact O-N 3Å; D518-V522 PolarHBondContact O-N 3.28Å
519N95.3Very high94Very high11 Ų1146.9 Ų46.96%0.05925%0.249CC..Hα-helixtrans-68.5-36178.9-78.2-77.1000112.3V515 L516 Q517 E521 V522 Y523 S553 L557 L560V515-N519 PolarHBondContact O-N 3.27Å; V515-N519 PolarHBondContact O-ND2 3Å; L516-N519 PolarHBondContact O-N 3.14Å; Q517-N519 PolarHBondContact O-N 2.81Å; N519-E521 VanDerWaalsContact C-N 3.33Å; N519-E521 PolarHBondContact O-N 2.96Å; N519-V522 PolarHBondContact O-N 3.42Å; N519-Y523 PolarHBondContact O-N 3.39Å; N519-Y523 VanDerWaalsContact O-N 3.17Å; N519-S553 PolarHBondContact OD1-O 3.44Å; N519-L557 HydrophobicContact CB-CB 4.1Å; N519-L557 HydrophobicContact CB-CD1 4.12Å; N519-L560 HydrophobicContact CB-CD1 4.38Å
520L96Very high93.8Very high2 Ų246.9 Ų46.91%0.0125%0.25CC..Hα-helixtrans-63.2-39173.8-76-179.6000112.2L516 Q517 V522 Y523 L524 L557 R589 V593L516-L520 HydrophobicContact CD1-CD1 4.35Å; L516-L520 HydrophobicContact CD1-CG 4.32Å; L516-L520 HydrophobicContact CD2-CD1 4.13Å; L516-L520 HydrophobicContact CG-CD1 3.84Å; L516-L520 HydrophobicContact CG-CG 4.16Å; L516-L520 WeakPolarHBondContact O-CB 3.45Å; L516-L520 VanDerWaalsContact O-CG 3.32Å; L516-L520 WeakPolarHBondContact O-CG 3.41Å; L516-L520 PolarHBondContact O-N 3.35Å; Q517-L520 WeakPolarHBondContact O-CB 3.32Å; Q517-L520 PolarHBondContact O-N 2.82Å; L520-V522 VanDerWaalsContact C-N 3.34Å; L520-Y523 PolarHBondContact O-N 3.23Å; L520-L524 WeakPolarHBondContact O-CB 3.42Å; L520-L524 VanDerWaalsContact O-CG 3.24Å; L520-L524 WeakPolarHBondContact O-CG 3.33Å; L520-L524 PolarHBondContact O-N 3.33Å; L520-L557 HydrophobicContact CD2-CD1 3.54Å; L520-L557 HydrophobicContact CD2-CD2 4.07Å; L520-L557 HydrophobicContact CD2-CG 4.42Å; L520-L557 HydrophobicContact CG-CD1 3.93Å; L520-R589 HydrophobicContact CD1-CB 4.27Å; L520-V593 HydrophobicContact CD1-CG2 4.38Å; L520-V593 HydrophobicContact CD2-CB 4.31Å; L520-V593 HydrophobicContact CD2-CG1 4.05Å; L520-V593 HydrophobicContact CD2-CG2 3.46Å; L520-V593 VanDerWaalsContact CD2-CG2 3.46Å; L520-V593 HydrophobicContact CG-CG2 4.41Å
521E95.2Very high93.6Very high110 Ų11047.2 Ų47.251%0.51425%0.249SC..Hα-helixtrans-64.7-38.2177.5-75177.2-169.500112.1Q517 D518 N519 G525Q517-E521 PolarHBondContact NE2-OE1 2.93Å; Q517-E521 WeakPolarHBondContact O-CG 3.31Å; Q517-E521 PolarHBondContact O-N 3.19Å; D518-E521 PolarHBondContact O-N 3Å; N519-E521 VanDerWaalsContact C-N 3.33Å; N519-E521 PolarHBondContact O-N 2.96Å; E521-G525 PolarHBondContact O-N 2.94Å
522V94.6Very high92.9Very high64 Ų6450.8 Ų50.839%0.38827%0.271SS..Hα-helixtrans-60.4-48.9172.4176.60000110.9D518 N519 L520 G525 L526D518-V522 PolarHBondContact O-N 3.28Å; N519-V522 PolarHBondContact O-N 3.42Å; L520-V522 VanDerWaalsContact C-N 3.34Å; V522-G525 PolarHBondContact O-N 3.36Å; V522-L526 PolarHBondContact O-N 3.1Å
523Y95.6Very high91.4Very high1 Ų154 Ų540%0.00429%0.293CS..Hα-helixtrans-63.9-47.1-179.5-175.7-101.9000112.9N519 L520 G525 L526 L554 L557 V593 Y596 L602 L617 V620N519-Y523 PolarHBondContact O-N 3.39Å; N519-Y523 VanDerWaalsContact O-N 3.17Å; L520-Y523 PolarHBondContact O-N 3.23Å; Y523-G525 PolarHBondContact O-N 3.38Å; Y523-L526 HydrophobicContact CD2-CD1 3.96Å; Y523-L526 HydrophobicContact CE2-CD1 4.4Å; Y523-L526 WeakPolarHBondContact O-CB 3.43Å; Y523-L526 WeakPolarHBondContact O-CG 3.23Å; Y523-L526 PolarHBondContact O-N 3.46Å; Y523-L526 VanDerWaalsContact O-N 3.15Å; Y523-L554 HydrophobicContact CD2-CD2 3.57Å; Y523-L554 HydrophobicContact CE2-CD2 4.11Å; Y523-L557 HydrophobicContact CD2-CD2 4.36Å; Y523-L557 HydrophobicContact CG-CD2 4.01Å; Y523-V593 HydrophobicContact CD1-CG1 3.99Å; Y523-V593 HydrophobicContact CE1-CG1 3.98Å; Y523-Y596 AromaticContact CD1-CD1 3.99Å; Y523-Y596 HydrophobicContact CD1-CD1 3.99Å; Y523-Y596 AromaticContact CD1-CE1 3.94Å; Y523-Y596 HydrophobicContact CD1-CE1 3.94Å; Y523-Y596 AromaticContact CE1-CD1 3.71Å; Y523-Y596 HydrophobicContact CE1-CD1 3.71Å; Y523-Y596 AromaticContact CE1-CE1 3.88Å; Y523-Y596 HydrophobicContact CE1-CE1 3.88Å; Y523-Y596 VanDerWaalsContact O-CE1 3.26Å; Y523-Y596 WeakPolarHBondContact O-CE1 3.31Å; Y523-Y596 PolarHBondContact O-OH 2.93Å; Y523-Y596 VanDerWaalsContact O-OH 3.07Å; Y523-L602 HydrophobicContact CE1-CD1 3.97Å; Y523-L602 HydrophobicContact CE2-CD1 3.96Å; Y523-L602 WeakPolarHBondContact OH-CD1 3.4Å; Y523-L617 HydrophobicContact CD2-CD2 4.43Å; Y523-L617 HydrophobicContact CE2-CD2 3.81Å; Y523-V620 HydrophobicContact CD1-CG1 4.45Å; Y523-V620 HydrophobicContact CD2-CG1 3.84Å; Y523-V620 HydrophobicContact CE1-CG1 4.25Å; Y523-V620 HydrophobicContact CE2-CB 4.15Å; Y523-V620 HydrophobicContact CE2-CG1 3.59Å; Y523-V620 HydrophobicContact CG-CG1 4.25Å
524L94.9Very high89.7Confident29 Ų2956.6 Ų56.615%0.15233%0.331CS..Hα-helixtrans-66.6-25.7177.2-67.8175.1000112.2L520 L526 K592 V593 Y596L520-L524 WeakPolarHBondContact O-CB 3.42Å; L520-L524 VanDerWaalsContact O-CG 3.24Å; L520-L524 WeakPolarHBondContact O-CG 3.33Å; L520-L524 PolarHBondContact O-N 3.33Å; L524-L526 VanDerWaalsContact C-N 3.3Å; L524-K592 HydrophobicContact CD1-CD 4.39Å; L524-V593 HydrophobicContact CD1-CG2 4.19Å; L524-V593 HydrophobicContact CD2-CG2 4.06Å; L524-V593 HydrophobicContact CG-CG2 4.26Å; L524-Y596 HydrophobicContact CD2-CD1 3.68Å; L524-Y596 HydrophobicContact CD2-CD2 4.02Å; L524-Y596 HydrophobicContact CD2-CE1 4.2Å; L524-Y596 HydrophobicContact CD2-CG 3.57Å; L524-Y596 WeakPolarHBondContact O-CE2 3.2Å; L524-Y596 PolarHBondContact O-OH 2.92Å; L524-Y596 VanDerWaalsContact O-OH 3.1Å
525G93.6Very high87.7Confident22 Ų2258.2 Ų58.223%0.22734%0.343CS..G310 helixtrans-75.3-12.1174.600000114.3E521 V522 Y523 Q527 Q528E521-G525 PolarHBondContact O-N 2.94Å; V522-G525 PolarHBondContact O-N 3.36Å; Y523-G525 PolarHBondContact O-N 3.38Å; G525-Q527 PolarHBondContact O-N 2.97Å; G525-Q527 VanDerWaalsContact O-N 3.12Å; G525-Q528 WeakPolarHBondContact O-CG 3.42Å; G525-Q528 PolarHBondContact O-N 3.35Å; G525-Q528 PolarHBondContact O-NE2 3.49Å
526L93.5Very high86.7Confident4 Ų458.1 Ų58.12%0.02135%0.349CS..G310 helixtrans-60.2-26.2-176.1-69.2176.4000113.7V522 Y523 L524 Q528 F529 L539 I541 L550 Y596 L602 L617V522-L526 PolarHBondContact O-N 3.1Å; Y523-L526 HydrophobicContact CD2-CD1 3.96Å; Y523-L526 HydrophobicContact CE2-CD1 4.4Å; Y523-L526 WeakPolarHBondContact O-CB 3.43Å; Y523-L526 WeakPolarHBondContact O-CG 3.23Å; Y523-L526 PolarHBondContact O-N 3.46Å; Y523-L526 VanDerWaalsContact O-N 3.15Å; L524-L526 VanDerWaalsContact C-N 3.3Å; L526-Q528 PolarHBondContact O-N 2.89Å; L526-Q528 VanDerWaalsContact O-N 3.14Å; L526-F529 PolarHBondContact O-N 3.12Å; L526-L539 HydrophobicContact CD2-CD1 4.45Å; L526-I541 HydrophobicContact CD2-CD1 4.09Å; L526-L550 HydrophobicContact CD1-CD1 4.48Å; L526-L550 HydrophobicContact CD2-CD1 3.84Å; L526-L550 HydrophobicContact CD2-CD2 4.22Å; L526-Y596 PolarHBondContact N-OH 3.04Å; L526-L602 HydrophobicContact CD1-CD2 4.43Å; L526-L617 HydrophobicContact CD1-CD2 3.92Å
527Q89.6Confident86.2Confident122 Ų12262.7 Ų62.757%0.5737%0.37SS*.G310 helixtrans-54.8-34.2-179.7-173.6175.9-1.500113.1G525 F529 I530 Y596 I600G525-Q527 PolarHBondContact O-N 2.97Å; G525-Q527 VanDerWaalsContact O-N 3.12Å; Q527-F529 PolarHBondContact O-N 2.93Å; Q527-I530 PolarHBondContact O-N 2.92Å; Q527-Y596 HydrophobicContact CB-CE2 4.07Å; Q527-Y596 PolarHBondContact N-OH 3.4Å; Q527-I600 HydrophobicContact CB-CD1 3.88Å; Q527-I600 HydrophobicContact CG-CD1 3.89Å
528Q91Very high85.9Confident148 Ų14867.1 Ų67.169%0.69239%0.386SS*.G310 helixtrans-67.3-18.2179.777.4-162.2-43.300113.4G525 L526G525-Q528 WeakPolarHBondContact O-CG 3.42Å; G525-Q528 PolarHBondContact O-N 3.35Å; G525-Q528 PolarHBondContact O-NE2 3.49Å; L526-Q528 PolarHBondContact O-N 2.89Å; L526-Q528 VanDerWaalsContact O-N 3.14Å
529F90.8Very high85.7Confident88 Ų8862.8 Ų62.839%0.38636%0.363SS..G310 helixtrans-100.82.2178.9-57.7-73000112.8L526 Q527 L539 N540 I541L526-F529 PolarHBondContact O-N 3.12Å; Q527-F529 PolarHBondContact O-N 2.93Å; F529-L539 HydrophobicContact CB-CD1 3.94Å; F529-N540 VanDerWaalsContact O-CB 3.29Å; F529-N540 WeakPolarHBondContact O-CB 3.4Å; F529-N540 PolarHBondContact O-N 3.48Å; F529-I541 HydrophobicContact CB-CD1 4.2Å; F529-I541 HydrophobicContact CB-CG1 4.05Å; F529-I541 HydrophobicContact CD1-CG1 4.39Å; F529-I541 HydrophobicContact CD2-CD1 4.11Å; F529-I541 HydrophobicContact CG-CD1 4.11Å; F529-I541 HydrophobicContact CG-CG1 4.11Å
530I89.8Confident85.4Confident35 Ų3566.7 Ų66.718%0.17938%0.383CS..EExtended strand (participates in β ladder)trans-87.2123.6179.3-59.2172000109.5Q527 H537 R538 L539 I600 L602 I605Q527-I530 PolarHBondContact O-N 2.92Å; I530-H537 HydrophobicContact CG2-CB 4.04Å; I530-R538 WeakPolarHBondContact CA-O 3.48Å; I530-L539 HydrophobicContact CG1-CD1 4.37Å; I530-I600 HydrophobicContact CD1-CG2 3.36Å; I530-L602 HydrophobicContact CD1-CD2 4.21Å; I530-I605 HydrophobicContact CD1-CD1 3.55Å; I530-I605 HydrophobicContact CG1-CD1 4.08Å; I530-I605 HydrophobicContact CG2-CD1 4.17Å
531V87.6Confident85.1Confident73 Ų7367.7 Ų67.744%0.44239%0.388SS..EExtended strand (participates in β ladder)trans-111.1132.1176-176.50000109.3S533 R538 N540V531-S533 PolarHBondContact O-N 3.3Å; V531-R538 PolarHBondContact N-O 3.28Å; V531-R538 PolarHBondContact O-N 2.83Å; V531-N540 HydrophobicContact CG2-CB 3.82Å
532T80.3Confident84.7Confident108 Ų10866.3 Ų66.366%0.66339%0.388SS*.EExtended strand (participates in β ladder)trans-81.5111.6170.639.70000109.9H537T532-H537 WeakPolarHBondContact CG2-ND1 3.35Å
533S63.1Low84.5Confident73 Ų7365.5 Ų65.551%0.5139%0.388SS..EExtended strand (participates in β ladder)trans-102.7158.1167.7-171.80000109.5V531 S535 G536V531-S533 PolarHBondContact O-N 3.3Å; S533-S535 PolarHBondContact O-N 2.99Å; S533-G536 PolarHBondContact N-O 3.36Å; S533-G536 PolarHBondContact O-N 3.31Å
534G57.9Low84.1Confident91 Ų9173.4 Ų73.494%0.93843%0.425SS*.THydrogen-bonded Turntrans-57.8-10.2-176.900000115.8
535S54.6Low83.9Confident96 Ų9677.7 Ų77.767%0.67145%0.448SS*.THydrogen-bonded Turntrans-106.8-7.6175.257.70000115.1S533S533-S535 PolarHBondContact O-N 2.99Å
536G72.9Confident83.8Confident29 Ų2980.4 Ų80.430%0.29946%0.457SS..EExtended strand (participates in β ladder)trans156.4-175.8-177.100000115.3S533S533-G536 PolarHBondContact N-O 3.36Å; S533-G536 PolarHBondContact O-N 3.31Å
537H84.9Confident83.7Confident98 Ų9880.7 Ų80.745%0.45446%0.46SS..EExtended strand (participates in β ladder)trans-87.6127.8172.2-63.4-70.8000109.8I530 T532 I605 E606I530-H537 HydrophobicContact CG2-CB 4.04Å; T532-H537 WeakPolarHBondContact CG2-ND1 3.35Å; H537-I605 HydrophobicContact CB-CD1 4.17Å; H537-I605 HydrophobicContact CB-CG1 3.91Å; H537-E606 PolarHBondContact O-N 3.33Å
538R87.4Confident83.8Confident114 Ų11481.4 Ų81.443%0.4346%0.457SS..EExtended strand (participates in β ladder)trans-122.1138.1178.9179178.6173.9-179.21111.1I530 V531 E606I530-R538 WeakPolarHBondContact CA-O 3.48Å; V531-R538 PolarHBondContact N-O 3.28Å; V531-R538 PolarHBondContact O-N 2.83Å; R538-E606 CarbonylContact C-O 3.14Å; R538-E606 WeakPolarHBondContact CA-O 3.37Å; R538-E606 HydrophobicContact CB-CB 4.24Å; R538-E606 HydrophobicContact CG-CB 4.26Å
539L90.4Very high83.8Confident1 Ų182.7 Ų82.71%0.00546%0.455CS..EExtended strand (participates in β ladder)trans-80.3116.5170.1-172.865.6000109.8L526 F529 I530 I541 L550 I605 E606 T607L526-L539 HydrophobicContact CD2-CD1 4.45Å; F529-L539 HydrophobicContact CB-CD1 3.94Å; I530-L539 HydrophobicContact CG1-CD1 4.37Å; L539-I541 HydrophobicContact CD1-CD1 4.07Å; L539-I541 HydrophobicContact CD1-CG1 4.34Å; L539-I541 HydrophobicContact CD2-CD1 4.24Å; L539-I541 HydrophobicContact CG-CB 4.31Å; L539-I541 HydrophobicContact CG-CD1 4.16Å; L539-I541 HydrophobicContact CG-CG1 4.16Å; L539-I541 PolarHBondContact O-N 3.34Å; L539-I541 VanDerWaalsContact O-N 3.11Å; L539-L550 HydrophobicContact CD2-CD2 3.89Å; L539-I605 HydrophobicContact CB-CG2 3.9Å; L539-E606 PolarHBondContact N-O 3.44Å; L539-T607 HydrophobicContact CB-CG2 4.33Å; L539-T607 HydrophobicContact CD2-CG2 4.25Å
540N90Very high84Confident92 Ų9279 Ų7949%0.49244%0.44SS..  trans-87.450.5-178.4-166.833.7000112.2F529 V531F529-N540 VanDerWaalsContact O-CB 3.29Å; F529-N540 WeakPolarHBondContact O-CB 3.4Å; F529-N540 PolarHBondContact O-N 3.48Å; V531-N540 HydrophobicContact CG2-CB 3.82Å
541I89.1Confident84.1Confident23 Ų2378.8 Ų78.812%0.11844%0.438CS..  trans-118.9104.1170.6-60173.9000105.7L526 F529 L539 D546 C547 L550 A608L526-I541 HydrophobicContact CD2-CD1 4.09Å; F529-I541 HydrophobicContact CB-CD1 4.2Å; F529-I541 HydrophobicContact CB-CG1 4.05Å; F529-I541 HydrophobicContact CD1-CG1 4.39Å; F529-I541 HydrophobicContact CD2-CD1 4.11Å; F529-I541 HydrophobicContact CG-CD1 4.11Å; F529-I541 HydrophobicContact CG-CG1 4.11Å; L539-I541 HydrophobicContact CD1-CD1 4.07Å; L539-I541 HydrophobicContact CD1-CG1 4.34Å; L539-I541 HydrophobicContact CD2-CD1 4.24Å; L539-I541 HydrophobicContact CG-CB 4.31Å; L539-I541 HydrophobicContact CG-CD1 4.16Å; L539-I541 HydrophobicContact CG-CG1 4.16Å; L539-I541 PolarHBondContact O-N 3.34Å; L539-I541 VanDerWaalsContact O-N 3.11Å; I541-D546 HydrophobicContact CG2-CB 3.81Å; I541-C547 PolarHBondContact O-SG 2.94Å; I541-L550 HydrophobicContact CD1-CD2 3.91Å; I541-A608 WeakPolarHBondContact O-CB 3.46Å
542T87.2Confident84.5Confident82 Ų8275.9 Ų75.950%0.50342%0.421SS..  trans-122.3-19.2-169.654.30000113.5A608T542-A608 HydrophobicContact CG2-CB 4.08Å
543A90.3Very high85.2Confident47 Ų4772.3 Ų72.339%0.38840%0.4SS..  trans-69.4131.7176.500000110.2N545 D546 C547A543-N545 VanDerWaalsContact C-N 3.33Å; A543-N545 PolarHBondContact O-N 2.61Å; A543-D546 HydrophobicContact CB-CB 4.28Å; A543-D546 PolarHBondContact O-N 2.93Å; A543-C547 PolarHBondContact O-N 2.87Å; A543-C547 PolarHBondContact O-SG 3.46Å; A543-C547 VanDerWaalsContact O-SG 3.41Å
544E88.3Confident86.8Confident167 Ų16769 Ų6978%0.7838%0.376SS*.Hα-helixtrans-55.4-44.9-174.3-173.4-179.6173.500113D546 C547 R548E544-D546 VanDerWaalsContact C-N 3.33Å; E544-D546 PolarHBondContact O-N 2.85Å; E544-C547 WeakPolarHBondContact O-CB 3.2Å; E544-C547 PolarHBondContact O-N 3.22Å; E544-R548 PolarHBondContact O-N 2.79Å
545N90.1Very high88.6Confident119 Ų11966.1 Ų66.164%0.63634%0.337SS*.Hα-helixtrans-63.6-37.5177.8-72.8-30000112.8A543 R548 R549A543-N545 VanDerWaalsContact C-N 3.33Å; A543-N545 PolarHBondContact O-N 2.61Å; N545-R548 PolarHBondContact O-N 3.31Å; N545-R549 WeakPolarHBondContact O-CB 3.37Å; N545-R549 VanDerWaalsContact O-CG 3.29Å; N545-R549 WeakPolarHBondContact O-CG 3.17Å; N545-R549 PolarHBondContact O-N 3.44Å
546D91.4Very high90.6Very high78 Ų7861.7 Ų61.742%0.41731%0.306SS..Hα-helixtrans-74-37.3178.8-63.9-30.6000110.8I541 A543 E544 R549 L550I541-D546 HydrophobicContact CG2-CB 3.81Å; A543-D546 HydrophobicContact CB-CB 4.28Å; A543-D546 PolarHBondContact O-N 2.93Å; E544-D546 VanDerWaalsContact C-N 3.33Å; E544-D546 PolarHBondContact O-N 2.85Å; D546-R549 PolarHBondContact O-N 3.39Å; D546-L550 WeakPolarHBondContact O-CB 3.4Å; D546-L550 PolarHBondContact O-N 2.8Å
547C91.1Very high91.7Very high11 Ų1160.3 Ų60.37%0.07429%0.292CS..Hα-helixtrans-60.1-45.6170.5-69.40000111.6I541 A543 E544 L550 H551 L613I541-C547 PolarHBondContact O-SG 2.94Å; A543-C547 PolarHBondContact O-N 2.87Å; A543-C547 PolarHBondContact O-SG 3.46Å; A543-C547 VanDerWaalsContact O-SG 3.41Å; E544-C547 WeakPolarHBondContact O-CB 3.2Å; E544-C547 PolarHBondContact O-N 3.22Å; C547-L550 PolarHBondContact O-N 2.73Å; C547-H551 WeakPolarHBondContact O-CB 3.33Å; C547-H551 PolarHBondContact O-N 2.68Å; C547-L613 HydrophobicContact CB-CD1 4.4Å
548R90.7Very high92.3Very high137 Ų13755.8 Ų55.852%0.51727%0.271SS..Hα-helixtrans-64.2-42.2178-176176.4175.1154.15.1112.1Q467 E544 N545 H551 C552Q467-R548 VanDerWaalsContact CD-NH2 3.26Å; Q467-R548 VanDerWaalsContact NE2-NH2 3.2Å; E544-R548 PolarHBondContact O-N 2.79Å; N545-R548 PolarHBondContact O-N 3.31Å; R548-H551 WeakPolarHBondContact O-CB 3.46Å; R548-H551 PolarHBondContact O-N 3.36Å; R548-C552 PolarHBondContact O-N 2.92Å; R548-C552 PolarHBondContact O-SG 2.95Å
549R92.2Very high92.7Very high174 Ų17450.4 Ų50.466%0.65725%0.251SS*.Hα-helixtrans-63.3-42.5175.1-75.8173.2176.8178.9-2.4112N545 D546 C552 S553N545-R549 WeakPolarHBondContact O-CB 3.37Å; N545-R549 VanDerWaalsContact O-CG 3.29Å; N545-R549 WeakPolarHBondContact O-CG 3.17Å; N545-R549 PolarHBondContact O-N 3.44Å; D546-R549 PolarHBondContact O-N 3.39Å; R549-C552 PolarHBondContact O-N 2.96Å; R549-S553 WeakPolarHBondContact O-CB 3.49Å; R549-S553 PolarHBondContact O-N 3.5Å; R549-S553 PolarHBondContact O-OG 3.36Å
550L94.1Very high93.1Very high11 Ų1150.4 Ų50.46%0.05825%0.251CS..Hα-helixtrans-63.4-46.8176178.659.6000111L526 L539 I541 D546 C547 C552 S553 L554 L613L526-L550 HydrophobicContact CD1-CD1 4.48Å; L526-L550 HydrophobicContact CD2-CD1 3.84Å; L526-L550 HydrophobicContact CD2-CD2 4.22Å; L539-L550 HydrophobicContact CD2-CD2 3.89Å; I541-L550 HydrophobicContact CD1-CD2 3.91Å; D546-L550 WeakPolarHBondContact O-CB 3.4Å; D546-L550 PolarHBondContact O-N 2.8Å; C547-L550 PolarHBondContact O-N 2.73Å; L550-C552 PolarHBondContact O-N 3.29Å; L550-S553 PolarHBondContact O-N 3.2Å; L550-S553 VanDerWaalsContact O-N 3.17Å; L550-L554 HydrophobicContact CD1-CD1 4.03Å; L550-L554 HydrophobicContact CD1-CD2 4.21Å; L550-L554 HydrophobicContact CD1-CG 3.88Å; L550-L554 HydrophobicContact CG-CD1 3.9Å; L550-L554 HydrophobicContact CG-CG 4.2Å; L550-L554 VanDerWaalsContact O-CG 3.27Å; L550-L554 WeakPolarHBondContact O-CG 3.17Å; L550-L554 PolarHBondContact O-N 3.01Å; L550-L613 HydrophobicContact CB-CD2 4.32Å; L550-L613 HydrophobicContact CD2-CD1 4.28Å; L550-L613 HydrophobicContact CD2-CD2 4.1Å; L550-L613 HydrophobicContact CG-CD2 4.05Å
551H93.2Very high93.4Very high31 Ų3146 Ų4614%0.14423%0.227CC..Hα-helixtrans-52.2-53.1174.7170.461.8000111.6C547 R548 S553 L554 R555 V612 L613 D616C547-H551 WeakPolarHBondContact O-CB 3.33Å; C547-H551 PolarHBondContact O-N 2.68Å; R548-H551 WeakPolarHBondContact O-CB 3.46Å; R548-H551 PolarHBondContact O-N 3.36Å; H551-S553 VanDerWaalsContact C-N 3.33Å; H551-S553 PolarHBondContact O-N 3.32Å; H551-L554 PolarHBondContact O-N 3.18Å; H551-R555 WeakPolarHBondContact O-CG 3.3Å; H551-R555 PolarHBondContact O-N 2.96Å; H551-V612 HydrophobicContact CB-CG1 4.16Å; H551-V612 VanDerWaalsContact ND1-CG1 3.34Å; H551-V612 WeakPolarHBondContact ND1-CG1 3.34Å; H551-L613 HydrophobicContact CB-CD2 4.05Å; H551-D616 IonicContact CE1-OD1 3.86Å; H551-D616 IonicContact CE1-OD2 3.84Å; H551-D616 IonicContact CG-OD2 3.14Å; H551-D616 VanDerWaalsContact ND1-CG 3.35Å; H551-D616 IonicContact ND1-OD1 2.69Å; H551-D616 PolarHBondContact ND1-OD1 2.89Å; H551-D616 IonicContact ND1-OD2 3.35Å; H551-D616 PolarHBondContact ND1-OD2 3.03Å
552C94.5Very high93.8Very high12 Ų1247.3 Ų47.38%0.08123%0.233CC..Hα-helixtrans-59.2-43.5178.2-60.50000111.8F463 R548 R549 L550 L554 R555 D556F463-C552 HydrophobicContact CB-CB 4.05Å; R548-C552 PolarHBondContact O-N 2.92Å; R548-C552 PolarHBondContact O-SG 2.95Å; R549-C552 PolarHBondContact O-N 2.96Å; L550-C552 PolarHBondContact O-N 3.29Å; C552-L554 PolarHBondContact O-N 2.94Å; C552-R555 PolarHBondContact O-N 2.88Å; C552-D556 VanDerWaalsContact O-CB 3.32Å; C552-D556 WeakPolarHBondContact O-CB 3.47Å; C552-D556 PolarHBondContact O-N 2.96Å
553S96Very high94.2Very high32 Ų3243.4 Ų43.422%0.22421%0.209CC..Hα-helixtrans-66-36.3179.9-530000112.5N519 R549 L550 H551 L557N519-S553 PolarHBondContact OD1-O 3.44Å; R549-S553 WeakPolarHBondContact O-CB 3.49Å; R549-S553 PolarHBondContact O-N 3.5Å; R549-S553 PolarHBondContact O-OG 3.36Å; L550-S553 PolarHBondContact O-N 3.2Å; L550-S553 VanDerWaalsContact O-N 3.17Å; H551-S553 VanDerWaalsContact C-N 3.33Å; H551-S553 PolarHBondContact O-N 3.32Å; S553-L557 VanDerWaalsContact O-CB 3.31Å; S553-L557 WeakPolarHBondContact O-CB 3.37Å; S553-L557 PolarHBondContact O-N 2.56Å
554L96.1Very high94.4Very high3 Ų341.4 Ų41.42%0.01619%0.192CC..Hα-helixtrans-71.2-42.1176.9-66.6174.8000111.4Y523 L550 H551 C552 L557 S558 L613 D616 L617 V620Y523-L554 HydrophobicContact CD2-CD2 3.57Å; Y523-L554 HydrophobicContact CE2-CD2 4.11Å; L550-L554 HydrophobicContact CD1-CD1 4.03Å; L550-L554 HydrophobicContact CD1-CD2 4.21Å; L550-L554 HydrophobicContact CD1-CG 3.88Å; L550-L554 HydrophobicContact CG-CD1 3.9Å; L550-L554 HydrophobicContact CG-CG 4.2Å; L550-L554 VanDerWaalsContact O-CG 3.27Å; L550-L554 WeakPolarHBondContact O-CG 3.17Å; L550-L554 PolarHBondContact O-N 3.01Å; H551-L554 PolarHBondContact O-N 3.18Å; C552-L554 PolarHBondContact O-N 2.94Å; L554-L557 PolarHBondContact O-N 2.63Å; L554-S558 PolarHBondContact O-N 3.25Å; L554-L613 HydrophobicContact CD1-CD2 4.36Å; L554-D616 HydrophobicContact CB-CB 3.74Å; L554-D616 HydrophobicContact CD1-CB 3.61Å; L554-D616 HydrophobicContact CG-CB 4.32Å; L554-L617 HydrophobicContact CD1-CD2 3.9Å; L554-L617 HydrophobicContact CD1-CG 4.1Å; L554-L617 HydrophobicContact CD2-CD2 4.12Å; L554-V620 HydrophobicContact CB-CG2 4.01Å; L554-V620 HydrophobicContact CD2-CG2 4.07Å; L554-V620 WeakPolarHBondContact O-CG2 3.42Å
555R95.5Very high94.8Very high32 Ų3234 Ų3412%0.12116%0.161CC..Hα-helixtrans-65.1-42174.5-67.7-68.3-68.1-171.2-4.2111.5F463 D475 H551 C552 L557 S558 S559 D616F463-R555 HydrophobicContact CD2-CB 3.43Å; F463-R555 VanDerWaalsContact CD2-CB 3.43Å; F463-R555 HydrophobicContact CD2-CG 4.36Å; F463-R555 HydrophobicContact CE2-CB 3.54Å; F463-R555 HydrophobicContact CE2-CG 4.17Å; F463-R555 HydrophobicContact CG-CB 4.05Å; F463-R555 HydrophobicContact CZ-CB 4.23Å; F463-R555 HydrophobicContact CZ-CG 4.38Å; D475-R555 IonicContact OD2-CZ 2.76Å; D475-R555 IonicContact OD2-NH1 3.65Å; D475-R555 PolarHBondContact OD2-NH1 2.87Å; D475-R555 VanDerWaalsContact OD2-NH1 3.17Å; D475-R555 IonicContact OD2-NH2 3.61Å; D475-R555 PolarHBondContact OD2-NH2 3.5Å; H551-R555 WeakPolarHBondContact O-CG 3.3Å; H551-R555 PolarHBondContact O-N 2.96Å; C552-R555 PolarHBondContact O-N 2.88Å; R555-L557 VanDerWaalsContact C-N 3.33Å; R555-L557 PolarHBondContact O-N 2.9Å; R555-S558 WeakPolarHBondContact O-CB 3.49Å; R555-S558 PolarHBondContact O-N 2.83Å; R555-S559 PolarHBondContact O-N 3.45Å; R555-S559 PolarHBondContact O-OG 3.06Å; R555-D616 WeakPolarHBondContact CD-OD1 3.19Å
556D96.8Very high95Very high2 Ų231.7 Ų31.71%0.01114%0.143CC..Hα-helixtrans-58.6-45.8173-74.4-5.3000111.4Q462 F463 R464 C552 S558 S559 L560Q462-D556 VanDerWaalsContact C-OD1 3.24Å; Q462-D556 WeakPolarHBondContact CA-OD1 3.46Å; Q462-D556 WeakPolarHBondContact CB-OD1 3.38Å; Q462-D556 HydrophobicContact CG-CB 4.48Å; F463-D556 WeakPolarHBondContact CA-OD1 3.21Å; F463-D556 WeakPolarHBondContact CB-OD1 3.43Å; F463-D556 PolarHBondContact N-OD1 3.45Å; R464-D556 VanDerWaalsContact CB-OD2 3.27Å; R464-D556 WeakPolarHBondContact CB-OD2 3.15Å; R464-D556 WeakPolarHBondContact CD-OD2 3.46Å; R464-D556 VanDerWaalsContact CG-OD2 3.32Å; R464-D556 WeakPolarHBondContact CG-OD2 3.32Å; R464-D556 PolarHBondContact N-OD2 3.35Å; C552-D556 VanDerWaalsContact O-CB 3.32Å; C552-D556 WeakPolarHBondContact O-CB 3.47Å; C552-D556 PolarHBondContact O-N 2.96Å; D556-S558 VanDerWaalsContact C-N 3.32Å; D556-S558 PolarHBondContact O-N 3.03Å; D556-S559 PolarHBondContact O-N 2.91Å; D556-L560 WeakPolarHBondContact O-CB 3.27Å; D556-L560 WeakPolarHBondContact O-CD1 3.45Å; D556-L560 WeakPolarHBondContact O-CG 3.49Å; D556-L560 PolarHBondContact O-N 3.36Å
557L97.6Very high95Very high1 Ų128.3 Ų28.31%0.00513%0.125CC..Hα-helixtrans-61.1-41.8176.7-179.553.5000111.8L516 N519 L520 Y523 S553 L554 R555 L560 L561 V620L516-L557 HydrophobicContact CD1-CD1 3.95Å; N519-L557 HydrophobicContact CB-CB 4.1Å; N519-L557 HydrophobicContact CB-CD1 4.12Å; L520-L557 HydrophobicContact CD2-CD1 3.54Å; L520-L557 HydrophobicContact CD2-CD2 4.07Å; L520-L557 HydrophobicContact CD2-CG 4.42Å; L520-L557 HydrophobicContact CG-CD1 3.93Å; Y523-L557 HydrophobicContact CD2-CD2 4.36Å; Y523-L557 HydrophobicContact CG-CD2 4.01Å; S553-L557 VanDerWaalsContact O-CB 3.31Å; S553-L557 WeakPolarHBondContact O-CB 3.37Å; S553-L557 PolarHBondContact O-N 2.56Å; L554-L557 PolarHBondContact O-N 2.63Å; R555-L557 VanDerWaalsContact C-N 3.33Å; R555-L557 PolarHBondContact O-N 2.9Å; L557-L560 PolarHBondContact O-N 3.26Å; L557-L561 HydrophobicContact CD1-CD1 4.07Å; L557-L561 HydrophobicContact CD1-CD2 4.45Å; L557-L561 HydrophobicContact CD1-CG 3.92Å; L557-L561 HydrophobicContact CG-CD1 3.93Å; L557-L561 HydrophobicContact CG-CG 4.29Å; L557-L561 WeakPolarHBondContact O-CB 3.17Å; L557-L561 WeakPolarHBondContact O-CG 3.47Å; L557-L561 PolarHBondContact O-N 3.06Å; L557-V620 HydrophobicContact CB-CG2 4.29Å; L557-V620 HydrophobicContact CD2-CG1 3.55Å; L557-V620 HydrophobicContact CD2-CG2 4.33Å; L557-V620 HydrophobicContact CG-CG1 4.04Å; L557-V620 HydrophobicContact CG-CG2 4.37Å
558S96.3Very high95.1Very high3 Ų328 Ų282%0.02112%0.123CC..Hα-helixtrans-58.5-48.8175.3-178.60000111.9L554 R555 D556 L560 L561 Q562 D619 Q623L554-S558 PolarHBondContact O-N 3.25Å; R555-S558 WeakPolarHBondContact O-CB 3.49Å; R555-S558 PolarHBondContact O-N 2.83Å; D556-S558 VanDerWaalsContact C-N 3.32Å; D556-S558 PolarHBondContact O-N 3.03Å; S558-L560 PolarHBondContact O-N 3.24Å; S558-L561 PolarHBondContact O-N 3.46Å; S558-Q562 WeakPolarHBondContact O-CG 3.4Å; S558-Q562 PolarHBondContact O-N 3.08Å; S558-Q562 VanDerWaalsContact O-N 3.16Å; S558-D619 WeakPolarHBondContact CB-OD2 3.4Å; S558-D619 PolarHBondContact OG-OD2 3.15Å; S558-Q623 VanDerWaalsContact OG-CG 3.23Å; S558-Q623 WeakPolarHBondContact OG-CG 3.35Å
559S96.8Very high95.2Very high0 Ų026.4 Ų26.40%012%0.122CC..Hα-helixtrans-59.7-43.3175.7-61.40000112.4I461 W486 R555 D556 Q562 A563I461-S559 PolarHBondContact O-OG 3.24Å; W486-S559 WeakPolarHBondContact CZ2-OG 3.39Å; R555-S559 PolarHBondContact O-N 3.45Å; R555-S559 PolarHBondContact O-OG 3.06Å; D556-S559 PolarHBondContact O-N 2.91Å; S559-Q562 PolarHBondContact O-N 3.23Å; S559-A563 PolarHBondContact O-N 3.18Å
560L97.3Very high95.1Very high1 Ų119.9 Ų19.91%0.00510%0.097CC..Hα-helixtrans-70.6-34.9-179.5-67.2166.7000112.7L512 V515 L516 N519 D556 L557 S558 Q562 A563 V564L512-L560 HydrophobicContact CD1-CD2 3.71Å; V515-L560 HydrophobicContact CG1-CD1 3.89Å; V515-L560 HydrophobicContact CG1-CD2 4.22Å; L516-L560 HydrophobicContact CD1-CB 3.79Å; N519-L560 HydrophobicContact CB-CD1 4.38Å; D556-L560 WeakPolarHBondContact O-CB 3.27Å; D556-L560 WeakPolarHBondContact O-CD1 3.45Å; D556-L560 WeakPolarHBondContact O-CG 3.49Å; D556-L560 PolarHBondContact O-N 3.36Å; L557-L560 PolarHBondContact O-N 3.26Å; S558-L560 PolarHBondContact O-N 3.24Å; L560-Q562 VanDerWaalsContact C-N 3.32Å; L560-A563 WeakPolarHBondContact O-CB 3.44Å; L560-A563 PolarHBondContact O-N 3.04Å; L560-V564 VanDerWaalsContact O-CG2 3.26Å; L560-V564 WeakPolarHBondContact O-CG2 3.19Å; L560-V564 PolarHBondContact O-N 2.96Å
561L97.5Very high95.1Very high0 Ų019.5 Ų19.50%010%0.095CC..Hα-helixtrans-63.2-41.1173.5-74.7168.1000110.9L516 L557 S558 V564 G565 L590 V620 Q623 A627L516-L561 HydrophobicContact CD1-CD2 4.27Å; L516-L561 HydrophobicContact CD1-CG 4.48Å; L557-L561 HydrophobicContact CD1-CD1 4.07Å; L557-L561 HydrophobicContact CD1-CD2 4.45Å; L557-L561 HydrophobicContact CD1-CG 3.92Å; L557-L561 HydrophobicContact CG-CD1 3.93Å; L557-L561 HydrophobicContact CG-CG 4.29Å; L557-L561 WeakPolarHBondContact O-CB 3.17Å; L557-L561 WeakPolarHBondContact O-CG 3.47Å; L557-L561 PolarHBondContact O-N 3.06Å; S558-L561 PolarHBondContact O-N 3.46Å; L561-V564 PolarHBondContact O-N 3.5Å; L561-G565 PolarHBondContact O-N 3.09Å; L561-L590 HydrophobicContact CD2-CD2 3.48Å; L561-L590 VanDerWaalsContact CD2-CD2 3.48Å; L561-V620 HydrophobicContact CD1-CG1 4.21Å; L561-Q623 HydrophobicContact CB-CB 3.93Å; L561-Q623 HydrophobicContact CD1-CB 4.11Å; L561-A627 HydrophobicContact CB-CB 4.44Å; L561-A627 WeakPolarHBondContact O-CB 3.1Å
562Q96.4Very high95Very high50 Ų5020.3 Ų20.323%0.23410%0.1CC..Hα-helixtrans-64-41.5172.9-69.7-178.365.600111.9L490 L494 S558 S559 L560 V564 G565 R566 Q623L490-Q562 HydrophobicContact CD2-CB 4.25Å; L490-Q562 VanDerWaalsContact CD2-CD 3.46Å; L490-Q562 HydrophobicContact CD2-CG 4.45Å; L494-Q562 HydrophobicContact CD1-CB 4.15Å; S558-Q562 WeakPolarHBondContact O-CG 3.4Å; S558-Q562 PolarHBondContact O-N 3.08Å; S558-Q562 VanDerWaalsContact O-N 3.16Å; S559-Q562 PolarHBondContact O-N 3.23Å; L560-Q562 VanDerWaalsContact C-N 3.32Å; Q562-V564 PolarHBondContact O-N 3.24Å; Q562-G565 PolarHBondContact O-N 3.12Å; Q562-R566 PolarHBondContact O-N 2.9Å; Q562-Q623 HydrophobicContact CG-CG 4.09Å; Q562-Q623 VanDerWaalsContact CG-OE1 3.24Å
563A95.8Very high94.8Very high1 Ų121.6 Ų21.61%0.00812%0.116CC..Hα-helixtrans-56.3-51.1174.300000111.3L494 L512 S559 L560 G565 R566 L567L494-A563 HydrophobicContact CD1-CB 4.44Å; L494-A563 HydrophobicContact CD2-CB 3.46Å; L494-A563 VanDerWaalsContact CD2-CB 3.46Å; L512-A563 HydrophobicContact CD1-CB 4.15Å; L512-A563 HydrophobicContact CD2-CB 4.35Å; S559-A563 PolarHBondContact O-N 3.18Å; L560-A563 WeakPolarHBondContact O-CB 3.44Å; L560-A563 PolarHBondContact O-N 3.04Å; A563-G565 VanDerWaalsContact C-N 3.32Å; A563-G565 PolarHBondContact O-N 2.97Å; A563-R566 PolarHBondContact O-N 2.89Å; A563-L567 WeakPolarHBondContact O-CG 3.37Å; A563-L567 PolarHBondContact O-N 3.22Å
564V95.4Very high94.3Very high5 Ų528.5 Ų28.53%0.0315%0.15CC..Hα-helixtrans-65.6-35.5-179.4174.50000112.2L512 L516 L560 L561 Q562 L567 V586 Y631L512-V564 HydrophobicContact CD2-CG2 3.9Å; L512-V564 HydrophobicContact CG-CG2 4.37Å; L516-V564 HydrophobicContact CD1-CG2 4.29Å; L516-V564 HydrophobicContact CD2-CG2 3.69Å; L516-V564 HydrophobicContact CG-CG2 4.45Å; L560-V564 VanDerWaalsContact O-CG2 3.26Å; L560-V564 WeakPolarHBondContact O-CG2 3.19Å; L560-V564 PolarHBondContact O-N 2.96Å; L561-V564 PolarHBondContact O-N 3.5Å; Q562-V564 PolarHBondContact O-N 3.24Å; V564-L567 PolarHBondContact O-N 2.94Å; V564-V586 HydrophobicContact CG1-CG1 3.32Å; V564-Y631 HydrophobicContact CG1-CE2 4.12Å; V564-Y631 WeakPolarHBondContact O-CE2 3.33Å; V564-Y631 PolarHBondContact O-OH 2.86Å; V564-Y631 VanDerWaalsContact O-OH 3.06Å
565G95.4Very high93.9Very high11 Ų1131.5 Ų31.511%0.11317%0.168CC..Hα-helixtrans-62.2-46.2172.300000112.3L561 Q562 A563 L567 A568 A630L561-G565 PolarHBondContact O-N 3.09Å; Q562-G565 PolarHBondContact O-N 3.12Å; A563-G565 VanDerWaalsContact C-N 3.32Å; A563-G565 PolarHBondContact O-N 2.97Å; G565-L567 PolarHBondContact O-N 3.14Å; G565-A568 VanDerWaalsContact O-CB 3.29Å; G565-A568 WeakPolarHBondContact O-CB 3.49Å; G565-A568 PolarHBondContact O-N 2.95Å; G565-A568 VanDerWaalsContact O-N 3.16Å; G565-A630 VanDerWaalsContact O-CB 3.31Å; G565-A630 WeakPolarHBondContact O-CB 3.31Å
566R94.5Very high93.7Very high71 Ų7130.1 Ų30.127%0.26816%0.163SC..Hα-helixtrans-59.3-31.2176.6175.863-172.588.8-5.4112.6E495 A498 Q562 A563 A568 E569E495-R566 IonicContact OE1-NH2 3.67Å; E495-R566 IonicContact OE2-CZ 2.61Å; E495-R566 IonicContact OE2-NE 2.73Å; E495-R566 PolarHBondContact OE2-NE 3.28Å; E495-R566 IonicContact OE2-NH2 2.74Å; E495-R566 PolarHBondContact OE2-NH2 3.07Å; A498-R566 HydrophobicContact CB-CG 4.25Å; Q562-R566 PolarHBondContact O-N 2.9Å; A563-R566 PolarHBondContact O-N 2.89Å; R566-A568 VanDerWaalsContact C-N 3.33Å; R566-E569 IonicContact CZ-OE1 2.76Å; R566-E569 VanDerWaalsContact NH1-CD 3.3Å; R566-E569 IonicContact NH1-OE1 3.6Å; R566-E569 PolarHBondContact NH1-OE1 3.39Å; R566-E569 IonicContact NH1-OE2 3.69Å; R566-E569 IonicContact NH2-OE1 3.87Å
567L91.4Very high93.3Very high6 Ų633.9 Ų33.93%0.03119%0.194CC..G310 helixtrans-83.1-1.9-178.6-61.4-178.6000114.7A498 M501 L512 A563 V564 G565 E569 Y570 F571A498-L567 HydrophobicContact CB-CD2 4.23Å; M501-L567 HydrophobicContact CB-CD2 3.8Å; M501-L567 HydrophobicContact CE-CB 4.48Å; M501-L567 HydrophobicContact CE-CD1 4.27Å; M501-L567 HydrophobicContact CG-CD1 4.49Å; M501-L567 HydrophobicContact CG-CD2 3.9Å; M501-L567 HydrophobicContact SD-CD1 4.2Å; L512-L567 HydrophobicContact CD2-CD1 3.42Å; L512-L567 VanDerWaalsContact CD2-CD1 3.42Å; A563-L567 WeakPolarHBondContact O-CG 3.37Å; A563-L567 PolarHBondContact O-N 3.22Å; V564-L567 PolarHBondContact O-N 2.94Å; G565-L567 PolarHBondContact O-N 3.14Å; L567-E569 PolarHBondContact O-N 3.11Å; L567-Y570 HydrophobicContact CB-CD2 4.38Å; L567-Y570 HydrophobicContact CD2-CD2 3.95Å; L567-Y570 HydrophobicContact CD2-CE2 4.01Å; L567-Y570 PolarHBondContact O-N 3.43Å; L567-F571 WeakPolarHBondContact O-CD2 3.49Å
568A93.6Very high92.9Very high6 Ų638.1 Ų38.15%0.0523%0.23CC..G310 helixtrans-57.2-33.7-17600000113.7G565 R566 Y570 F571 A630 Y631G565-A568 VanDerWaalsContact O-CB 3.29Å; G565-A568 WeakPolarHBondContact O-CB 3.49Å; G565-A568 PolarHBondContact O-N 2.95Å; G565-A568 VanDerWaalsContact O-N 3.16Å; R566-A568 VanDerWaalsContact C-N 3.33Å; A568-Y570 PolarHBondContact O-N 3.45Å; A568-F571 PolarHBondContact O-N 2.91Å; A568-A630 HydrophobicContact CB-CB 3.97Å; A568-A630 WeakPolarHBondContact CB-O 3.38Å; A568-Y631 HydrophobicContact CB-CD1 4.25Å; A568-Y631 HydrophobicContact CB-CD2 3.81Å; A568-Y631 HydrophobicContact CB-CE1 4.21Å; A568-Y631 HydrophobicContact CB-CE2 3.74Å; A568-Y631 HydrophobicContact CB-CG 4.05Å
569E92.6Very high92.6Very high103 Ų10339 Ų3948%0.48123%0.232SC..G310 helixtrans-67.6-19179.567.6-179.7-170.900114.1R566 L567 F571 I572R566-E569 IonicContact CZ-OE1 2.76Å; R566-E569 VanDerWaalsContact NH1-CD 3.3Å; R566-E569 IonicContact NH1-OE1 3.6Å; R566-E569 PolarHBondContact NH1-OE1 3.39Å; R566-E569 IonicContact NH1-OE2 3.69Å; R566-E569 IonicContact NH2-OE1 3.87Å; L567-E569 PolarHBondContact O-N 3.11Å; E569-F571 PolarHBondContact O-N 3.17Å; E569-I572 WeakPolarHBondContact O-CG1 3.31Å
570Y91.3Very high92.4Very high36 Ų3640.9 Ų40.914%0.14124%0.241CC..G310 helixtrans-84.86.8178-60.2-74000113.6A498 M501 E502 L567 A568 V575A498-Y570 HydrophobicContact CB-CE2 3.93Å; A498-Y570 PolarHBondContact O-OH 2.94Å; A498-Y570 VanDerWaalsContact O-OH 3.1Å; M501-Y570 HydrophobicContact CB-CD2 4.33Å; M501-Y570 HydrophobicContact CB-CE2 4.45Å; M501-Y570 HydrophobicContact CG-CD2 3.86Å; M501-Y570 HydrophobicContact CG-CE2 4.46Å; M501-Y570 HydrophobicContact CG-CG 3.91Å; E502-Y570 HydrophobicContact CB-CD1 4.43Å; E502-Y570 HydrophobicContact CB-CE1 3.68Å; E502-Y570 HydrophobicContact CG-CE1 4.11Å; L567-Y570 HydrophobicContact CB-CD2 4.38Å; L567-Y570 HydrophobicContact CD2-CD2 3.95Å; L567-Y570 HydrophobicContact CD2-CE2 4.01Å; L567-Y570 PolarHBondContact O-N 3.43Å; A568-Y570 PolarHBondContact O-N 3.45Å; Y570-V575 WeakPolarHBondContact O-CG2 3.19Å
571F92.8Very high92.1Very high3 Ų346.3 Ų46.31%0.01327%0.27CS..G310 helixtrans-1142.8176.5-63.2-74.2000113.6M501 F509 L567 A568 E569 F576 R579 D582 A583 Y631 W634M501-F571 HydrophobicContact CE-CE1 4.33Å; M501-F571 HydrophobicContact CE-CE2 4.04Å; M501-F571 HydrophobicContact CE-CZ 3.66Å; F509-F571 HydrophobicContact CD2-CE1 4.49Å; F509-F571 AromaticContact CD2-CZ 3.97Å; F509-F571 HydrophobicContact CD2-CZ 3.97Å; F509-F571 HydrophobicContact CE2-CZ 4.19Å; L567-F571 WeakPolarHBondContact O-CD2 3.49Å; A568-F571 PolarHBondContact O-N 2.91Å; E569-F571 PolarHBondContact O-N 3.17Å; F571-F576 WeakPolarHBondContact O-CA 3.46Å; F571-F576 WeakPolarHBondContact O-CD2 3.32Å; F571-R579 HydrophobicContact CD1-CB 3.84Å; F571-R579 HydrophobicContact CE1-CB 4.29Å; F571-D582 HydrophobicContact CE1-CB 3.86Å; F571-A583 HydrophobicContact CB-CB 3.83Å; F571-A583 HydrophobicContact CD1-CB 3.72Å; F571-A583 HydrophobicContact CD2-CB 4.5Å; F571-A583 HydrophobicContact CE1-CB 4.39Å; F571-A583 HydrophobicContact CG-CB 3.77Å; F571-Y631 AromaticContact CD2-CE1 3.83Å; F571-Y631 HydrophobicContact CD2-CE1 3.83Å; F571-Y631 HydrophobicContact CE2-CE1 4.29Å; F571-Y631 WeakPolarHBondContact CE2-OH 3.38Å; F571-W634 VanDerWaalsContact O-CD1 3.28Å
572I92.2Very high91.9Very high49 Ų4948.7 Ų48.725%0.25128%0.282SS..SBendtrans-111.3167.8-177.859.6167.6000112.4E569 V575 H633 W634E569-I572 WeakPolarHBondContact O-CG1 3.31Å; I572-V575 VanDerWaalsContact O-CG2 3.29Å; I572-V575 WeakPolarHBondContact O-CG2 3.45Å; I572-H633 HydrophobicContact CD1-CB 4.36Å; I572-H633 HydrophobicContact CG2-CB 4.46Å; I572-W634 HydrophobicContact CG2-CB 3.79Å; I572-W634 HydrophobicContact CG2-CG 4.46Å
573G90.4Very high91.8Very high39 Ų3946.3 Ų46.340%0.40227%0.271SS..G310 helixtrans75.6-137.417500000112.1V575 F576G573-V575 PolarHBondContact O-N 3.26Å; G573-V575 VanDerWaalsContact O-N 3.16Å; G573-F576 WeakPolarHBondContact O-CB 3.44Å; G573-F576 PolarHBondContact O-N 3.4Å; G573-F576 VanDerWaalsContact O-N 3.07Å
574D85.6Confident91.7Very high177 Ų17747 Ų4795%0.94728%0.275SS*.G310 helixtrans-63-24.7-173.9-63.5-25.3000113.5
575V86.8Confident91.6Very high65 Ų6549.4 Ų49.439%0.39429%0.29SS..G310 helixtrans-90.4-4.8179.4-65.10000113.7Y570 I572 G573 A577 A578 R579Y570-V575 WeakPolarHBondContact O-CG2 3.19Å; I572-V575 VanDerWaalsContact O-CG2 3.29Å; I572-V575 WeakPolarHBondContact O-CG2 3.45Å; G573-V575 PolarHBondContact O-N 3.26Å; G573-V575 VanDerWaalsContact O-N 3.16Å; V575-A577 PolarHBondContact O-N 3.01Å; V575-A578 PolarHBondContact O-N 3.32Å; V575-R579 PolarHBondContact O-N 3.48Å; V575-R579 VanDerWaalsContact O-N 3.1Å
576F91.1Very high91.6Very high4 Ų449 Ų492%0.01829%0.285CS..THydrogen-bonded Turntrans-53.8-52.9-175178.1-93.9000112.3F571 G573 A578 R579 F580 W634 Q637 E641F571-F576 WeakPolarHBondContact O-CA 3.46Å; F571-F576 WeakPolarHBondContact O-CD2 3.32Å; G573-F576 WeakPolarHBondContact O-CB 3.44Å; G573-F576 PolarHBondContact O-N 3.4Å; G573-F576 VanDerWaalsContact O-N 3.07Å; F576-A578 PolarHBondContact O-N 2.95Å; F576-R579 PolarHBondContact O-N 3.4Å; F576-F580 AromaticContact CE1-CD2 3.77Å; F576-F580 HydrophobicContact CE1-CD2 3.77Å; F576-F580 HydrophobicContact CE1-CE2 4.26Å; F576-F580 HydrophobicContact CE2-CD2 4.29Å; F576-F580 AromaticContact CZ-CD2 3.6Å; F576-F580 HydrophobicContact CZ-CD2 3.6Å; F576-F580 AromaticContact CZ-CE2 3.84Å; F576-F580 HydrophobicContact CZ-CE2 3.84Å; F576-F580 WeakPolarHBondContact O-CA 3.46Å; F576-F580 WeakPolarHBondContact O-CB 3.32Å; F576-F580 PolarHBondContact O-N 2.97Å; F576-W634 AromaticContact CD2-CD1 3.6Å; F576-W634 AromaticContact CD2-NE1 3.6Å; F576-W634 AromaticContact CE2-CD1 3.46Å; F576-W634 VanDerWaalsContact CE2-CD1 3.46Å; F576-W634 HydrophobicContact CE2-CD2 4.3Å; F576-W634 AromaticContact CE2-CE2 3.82Å; F576-W634 HydrophobicContact CE2-CG 4.09Å; F576-W634 AromaticContact CE2-NE1 3.25Å; F576-W634 VanDerWaalsContact CE2-NE1 3.25Å; F576-Q637 HydrophobicContact CD2-CB 3.96Å; F576-Q637 VanDerWaalsContact CD2-OE1 3.29Å; F576-Q637 HydrophobicContact CE2-CB 3.71Å; F576-Q637 HydrophobicContact CZ-CB 4.14Å; F576-E641 WeakPolarHBondContact CD1-OE1 3.16Å; F576-E641 VanDerWaalsContact CE1-CD 3.4Å; F576-E641 HydrophobicContact CE1-CG 4.33Å; F576-E641 WeakPolarHBondContact CE1-OE1 3.31Å; F576-E641 WeakPolarHBondContact CE1-OE2 3.28Å
577A89.1Confident91.7Very high81 Ų8145.7 Ų45.767%0.66927%0.272SS*.THydrogen-bonded Turntrans-65.1-37.9-177.900000112.7V575 R579V575-A577 PolarHBondContact O-N 3.01Å; A577-R579 VanDerWaalsContact C-N 3.33Å; A577-R579 PolarHBondContact O-N 2.94Å
578A89.3Confident91.9Very high90 Ų9049.3 Ų49.374%0.74429%0.289SS*.THydrogen-bonded Turntrans-69.6-31.3-178.400000112.6V575 F576V575-A578 PolarHBondContact O-N 3.32Å; F576-A578 PolarHBondContact O-N 2.95Å
579R90Very high92Very high20 Ų2052.9 Ų52.98%0.07530%0.301CS..THydrogen-bonded Turntrans-115.816.1-174.7-51.9-163.177.8-176.611.5113.8P505 F571 V575 F576 A577 N581 D582 A583P505-R579 VanDerWaalsContact C-NH2 3.27Å; P505-R579 PolarHBondContact O-NH2 3.25Å; F571-R579 HydrophobicContact CD1-CB 3.84Å; F571-R579 HydrophobicContact CE1-CB 4.29Å; V575-R579 PolarHBondContact O-N 3.48Å; V575-R579 VanDerWaalsContact O-N 3.1Å; F576-R579 PolarHBondContact O-N 3.4Å; A577-R579 VanDerWaalsContact C-N 3.33Å; A577-R579 PolarHBondContact O-N 2.94Å; R579-N581 VanDerWaalsContact C-N 3.3Å; R579-N581 PolarHBondContact O-N 2.89Å; R579-D582 IonicContact CZ-OD2 2.69Å; R579-D582 IonicContact NE-OD2 3.69Å; R579-D582 PolarHBondContact NE-OD2 3.16Å; R579-D582 IonicContact NH2-OD2 3.6Å; R579-D582 PolarHBondContact O-N 3.4Å; R579-A583 PolarHBondContact O-N 3.5Å; R579-A583 VanDerWaalsContact O-N 3.11Å
580F91.9Very high92.2Very high41 Ų4148.1 Ų48.118%0.1828%0.279CS..Hα-helixtrans-55.6-44.9-177.2179.4-96.7000112.1F576 A583 L584 W634 Y638F576-F580 AromaticContact CE1-CD2 3.77Å; F576-F580 HydrophobicContact CE1-CD2 3.77Å; F576-F580 HydrophobicContact CE1-CE2 4.26Å; F576-F580 HydrophobicContact CE2-CD2 4.29Å; F576-F580 AromaticContact CZ-CD2 3.6Å; F576-F580 HydrophobicContact CZ-CD2 3.6Å; F576-F580 AromaticContact CZ-CE2 3.84Å; F576-F580 HydrophobicContact CZ-CE2 3.84Å; F576-F580 WeakPolarHBondContact O-CA 3.46Å; F576-F580 WeakPolarHBondContact O-CB 3.32Å; F576-F580 PolarHBondContact O-N 2.97Å; F580-A583 PolarHBondContact O-N 3.49Å; F580-L584 HydrophobicContact CE1-CB 4.43Å; F580-L584 HydrophobicContact CE1-CD2 3.81Å; F580-L584 HydrophobicContact CZ-CD2 4.34Å; F580-L584 WeakPolarHBondContact O-CB 3.29Å; F580-L584 PolarHBondContact O-N 3.33Å; F580-W634 AromaticContact CD2-CZ2 3.78Å; F580-W634 HydrophobicContact CD2-CZ2 3.78Å; F580-W634 HydrophobicContact CE2-CH2 4.14Å; F580-W634 AromaticContact CE2-CZ2 3.68Å; F580-W634 HydrophobicContact CE2-CZ2 3.68Å; F580-W634 HydrophobicContact CZ-CZ2 4.38Å; F580-Y638 HydrophobicContact CE2-CD1 4.36Å; F580-Y638 AromaticContact CE2-CD2 3.68Å; F580-Y638 HydrophobicContact CE2-CD2 3.68Å; F580-Y638 AromaticContact CE2-CE2 3.95Å; F580-Y638 HydrophobicContact CE2-CE2 3.95Å; F580-Y638 AromaticContact CE2-CG 3.95Å; F580-Y638 HydrophobicContact CE2-CG 3.95Å; F580-Y638 HydrophobicContact CZ-CD1 4.43Å; F580-Y638 AromaticContact CZ-CD2 3.86Å; F580-Y638 HydrophobicContact CZ-CD2 3.86Å; F580-Y638 HydrophobicContact CZ-CE1 4.2Å; F580-Y638 AromaticContact CZ-CE2 3.6Å; F580-Y638 HydrophobicContact CZ-CE2 3.6Å; F580-Y638 HydrophobicContact CZ-CG 4.31Å; F580-Y638 AromaticContact CZ-CZ 3.8Å
581N91.7Very high92.5Very high114 Ų11446.7 Ų46.761%0.6127%0.274SS*.Hα-helixtrans-67.8-37.9-178.5-67.2-42.2000112.8R579 T585R579-N581 VanDerWaalsContact C-N 3.3Å; R579-N581 PolarHBondContact O-N 2.89Å; N581-T585 WeakPolarHBondContact O-CB 3.39Å; N581-T585 PolarHBondContact O-N 3.49Å; N581-T585 PolarHBondContact O-OG1 2.93Å
582D92.7Very high92.6Very high51 Ų5151.9 Ų51.927%0.27330%0.297SS..Hα-helixtrans-61.4-51.1176.3-63.9-12.4000109.7F509 F571 R579 T585 V586F509-D582 HydrophobicContact CD2-CB 4.46Å; F509-D582 HydrophobicContact CE1-CB 4.09Å; F509-D582 HydrophobicContact CE2-CB 4.03Å; F509-D582 HydrophobicContact CZ-CB 3.83Å; F571-D582 HydrophobicContact CE1-CB 3.86Å; R579-D582 IonicContact CZ-OD2 2.69Å; R579-D582 IonicContact NE-OD2 3.69Å; R579-D582 PolarHBondContact NE-OD2 3.16Å; R579-D582 IonicContact NH2-OD2 3.6Å; R579-D582 PolarHBondContact O-N 3.4Å; D582-T585 PolarHBondContact O-N 2.96Å; D582-V586 WeakPolarHBondContact O-CG2 3.13Å; D582-V586 PolarHBondContact O-N 2.95Å; D582-V586 VanDerWaalsContact O-N 3.13Å
583A93.9Very high92.8Very high0 Ų049.6 Ų49.60%029%0.285CS..Hα-helixtrans-64.5-43.3179.500000112.3F571 R579 F580 T585 V586 V587 Y631 W634F571-A583 HydrophobicContact CB-CB 3.83Å; F571-A583 HydrophobicContact CD1-CB 3.72Å; F571-A583 HydrophobicContact CD2-CB 4.5Å; F571-A583 HydrophobicContact CE1-CB 4.39Å; F571-A583 HydrophobicContact CG-CB 3.77Å; R579-A583 PolarHBondContact O-N 3.5Å; R579-A583 VanDerWaalsContact O-N 3.11Å; F580-A583 PolarHBondContact O-N 3.49Å; A583-T585 VanDerWaalsContact C-N 3.31Å; A583-T585 PolarHBondContact O-N 3.23Å; A583-V586 WeakPolarHBondContact O-CB 3.32Å; A583-V586 PolarHBondContact O-N 3.41Å; A583-V587 WeakPolarHBondContact O-CG2 3.11Å; A583-V587 PolarHBondContact O-N 2.86Å; A583-Y631 HydrophobicContact CB-CE1 4.5Å; A583-W634 HydrophobicContact CB-CD2 4.18Å; A583-W634 VanDerWaalsContact CB-CE2 3.47Å; A583-W634 HydrophobicContact CB-CG 4.42Å; A583-W634 HydrophobicContact CB-CZ2 3.79Å; A583-W634 VanDerWaalsContact CB-NE1 3.28Å
584L93.9Very high93Very high15 Ų1547.8 Ų47.88%0.07927%0.266CS..Hα-helixtrans-59.2-44.1176.7178.463.9000111F580 V586 V587 E588 W634 Y638F580-L584 HydrophobicContact CE1-CB 4.43Å; F580-L584 HydrophobicContact CE1-CD2 3.81Å; F580-L584 HydrophobicContact CZ-CD2 4.34Å; F580-L584 WeakPolarHBondContact O-CB 3.29Å; F580-L584 PolarHBondContact O-N 3.33Å; L584-V586 VanDerWaalsContact C-N 3.32Å; L584-V586 PolarHBondContact O-N 3.42Å; L584-V587 PolarHBondContact O-N 3.35Å; L584-E588 HydrophobicContact CD1-CG 4.05Å; L584-E588 HydrophobicContact CG-CG 4.37Å; L584-E588 WeakPolarHBondContact O-CB 3.3Å; L584-E588 WeakPolarHBondContact O-CG 3.44Å; L584-E588 PolarHBondContact O-N 3.43Å; L584-W634 HydrophobicContact CB-CH2 3.97Å; L584-W634 HydrophobicContact CB-CZ2 4.19Å; L584-W634 HydrophobicContact CD1-CH2 4.01Å; L584-Y638 HydrophobicContact CD1-CE1 4.44Å
585T93.9Very high93.5Very high56 Ų5640.9 Ų40.934%0.34423%0.229SC..Hα-helixtrans-59.7-44177.4-57.50000111.1F513 N581 D582 A583 R589F513-T585 HydrophobicContact CE1-CG2 4.11Å; F513-T585 HydrophobicContact CE2-CG2 4.4Å; F513-T585 HydrophobicContact CZ-CG2 3.63Å; N581-T585 WeakPolarHBondContact O-CB 3.39Å; N581-T585 PolarHBondContact O-N 3.49Å; N581-T585 PolarHBondContact O-OG1 2.93Å; D582-T585 PolarHBondContact O-N 2.96Å; A583-T585 VanDerWaalsContact C-N 3.31Å; A583-T585 PolarHBondContact O-N 3.23Å; T585-R589 WeakPolarHBondContact O-CG 3.39Å; T585-R589 PolarHBondContact O-N 3.11Å
586V95.6Very high93.9Very high3 Ų338.8 Ų38.82%0.01821%0.214CC..Hα-helixtrans-61.4-52175.5170.40000111.1F509 F513 V564 D582 A583 L584 E588 R589 L590 Y631F509-V586 HydrophobicContact CE2-CG2 3.71Å; F509-V586 HydrophobicContact CZ-CG2 4.17Å; F513-V586 HydrophobicContact CD2-CG2 3.86Å; F513-V586 HydrophobicContact CE2-CG2 3.78Å; V564-V586 HydrophobicContact CG1-CG1 3.32Å; D582-V586 WeakPolarHBondContact O-CG2 3.13Å; D582-V586 PolarHBondContact O-N 2.95Å; D582-V586 VanDerWaalsContact O-N 3.13Å; A583-V586 WeakPolarHBondContact O-CB 3.32Å; A583-V586 PolarHBondContact O-N 3.41Å; L584-V586 VanDerWaalsContact C-N 3.32Å; L584-V586 PolarHBondContact O-N 3.42Å; V586-E588 PolarHBondContact O-N 3.31Å; V586-R589 WeakPolarHBondContact O-CB 3.44Å; V586-R589 PolarHBondContact O-N 3.38Å; V586-R589 VanDerWaalsContact O-N 3.13Å; V586-L590 HydrophobicContact CG1-CD1 3.86Å; V586-L590 HydrophobicContact CG1-CG 4.24Å; V586-L590 WeakPolarHBondContact O-CG 3.34Å; V586-L590 PolarHBondContact O-N 3.03Å; V586-Y631 HydrophobicContact CG1-CE1 4.32Å; V586-Y631 HydrophobicContact CG1-CE2 4.07Å
587V96.4Very high94Very high0 Ų038.6 Ų38.60%021%0.213CC..Hα-helixtrans-63.5-41.4-175.81750000111.5A583 L584 R589 L590 V591 L628 Y631 W634 L635 L653A583-V587 WeakPolarHBondContact O-CG2 3.11Å; A583-V587 PolarHBondContact O-N 2.86Å; L584-V587 PolarHBondContact O-N 3.35Å; V587-R589 VanDerWaalsContact C-N 3.29Å; V587-R589 PolarHBondContact O-N 3.08Å; V587-L590 PolarHBondContact O-N 3.2Å; V587-V591 HydrophobicContact CG1-CG2 4.39Å; V587-V591 WeakPolarHBondContact O-CG2 3.32Å; V587-V591 PolarHBondContact O-N 3.41Å; V587-L628 HydrophobicContact CG1-CD1 3.95Å; V587-Y631 HydrophobicContact CG2-CD1 3.48Å; V587-Y631 VanDerWaalsContact CG2-CD1 3.48Å; V587-Y631 HydrophobicContact CG2-CD2 4.48Å; V587-Y631 HydrophobicContact CG2-CE1 4.18Å; V587-Y631 HydrophobicContact CG2-CG 3.67Å; V587-W634 HydrophobicContact CB-CZ3 4.17Å; V587-W634 HydrophobicContact CG1-CZ3 4.27Å; V587-W634 HydrophobicContact CG2-CE3 3.87Å; V587-W634 HydrophobicContact CG2-CZ3 3.88Å; V587-L635 HydrophobicContact CG1-CD2 4.23Å; V587-L653 HydrophobicContact CG1-CD1 4.24Å; V587-L653 HydrophobicContact CG1-CD2 3.83Å; V587-L653 HydrophobicContact CG1-CG 4.41Å
588E95.5Very high94.2Very high82 Ų8234.8 Ų34.838%0.38318%0.182SC..Hα-helixtrans-60.4-39.2175.1-75.3-176.516000112L584 V586 K592 Q649 L653L584-E588 HydrophobicContact CD1-CG 4.05Å; L584-E588 HydrophobicContact CG-CG 4.37Å; L584-E588 WeakPolarHBondContact O-CB 3.3Å; L584-E588 WeakPolarHBondContact O-CG 3.44Å; L584-E588 PolarHBondContact O-N 3.43Å; V586-E588 PolarHBondContact O-N 3.31Å; E588-K592 WeakPolarHBondContact O-CB 3.39Å; E588-K592 PolarHBondContact O-N 2.88Å; E588-Q649 PolarHBondContact OE1-NE2 3.41Å; E588-L653 HydrophobicContact CG-CD1 4.28Å
589R95.4Very high94.3Very high82 Ų8237 Ų3731%0.30918%0.177SC..Hα-helixtrans-67.8-43.9175.7-68.3-69.3174.71645111.9F513 L520 T585 V586 V587 K592 V593F513-R589 HydrophobicContact CZ-CG 4.47Å; L520-R589 HydrophobicContact CD1-CB 4.27Å; T585-R589 WeakPolarHBondContact O-CG 3.39Å; T585-R589 PolarHBondContact O-N 3.11Å; V586-R589 WeakPolarHBondContact O-CB 3.44Å; V586-R589 PolarHBondContact O-N 3.38Å; V586-R589 VanDerWaalsContact O-N 3.13Å; V587-R589 VanDerWaalsContact C-N 3.29Å; V587-R589 PolarHBondContact O-N 3.08Å; R589-K592 PolarHBondContact O-N 2.64Å; R589-V593 WeakPolarHBondContact O-CB 3.23Å; R589-V593 WeakPolarHBondContact O-CG2 3.45Å; R589-V593 PolarHBondContact O-N 2.9Å
590L97Very high94.3Very high2 Ų237.5 Ų37.51%0.0118%0.181CC..Hα-helixtrans-59.2-49.5176.1-68175.7000111.1L561 V586 V587 K592 V593 T594 A627 L628 Y631L561-L590 HydrophobicContact CD2-CD2 3.48Å; L561-L590 VanDerWaalsContact CD2-CD2 3.48Å; V586-L590 HydrophobicContact CG1-CD1 3.86Å; V586-L590 HydrophobicContact CG1-CG 4.24Å; V586-L590 WeakPolarHBondContact O-CG 3.34Å; V586-L590 PolarHBondContact O-N 3.03Å; V587-L590 PolarHBondContact O-N 3.2Å; L590-K592 VanDerWaalsContact C-N 3.32Å; L590-K592 PolarHBondContact O-N 3.23Å; L590-V593 PolarHBondContact O-N 2.95Å; L590-T594 PolarHBondContact O-N 2.93Å; L590-T594 PolarHBondContact O-OG1 3.5Å; L590-A627 HydrophobicContact CD1-CB 4.07Å; L590-A627 HydrophobicContact CD2-CB 3.86Å; L590-L628 HydrophobicContact CB-CB 4.3Å; L590-L628 HydrophobicContact CB-CD1 4.28Å; L590-Y631 HydrophobicContact CD1-CD2 4.12Å; L590-Y631 HydrophobicContact CD1-CE2 4.2Å
591V97Very high94.3Very high6 Ų640.8 Ų40.84%0.03620%0.195CC..Hα-helixtrans-58.1-43.8177172.10000111.5V587 V593 L595 L628 L653 T656 T657V587-V591 HydrophobicContact CG1-CG2 4.39Å; V587-V591 WeakPolarHBondContact O-CG2 3.32Å; V587-V591 PolarHBondContact O-N 3.41Å; V591-V593 PolarHBondContact O-N 3.44Å; V591-L595 VanDerWaalsContact O-CB 3.28Å; V591-L595 WeakPolarHBondContact O-CB 3.39Å; V591-L595 PolarHBondContact O-N 3.37Å; V591-L628 HydrophobicContact CG2-CD1 3.79Å; V591-L628 HydrophobicContact CG2-CD2 3.75Å; V591-L628 HydrophobicContact CG2-CG 4.46Å; V591-L653 HydrophobicContact CB-CD1 4.1Å; V591-L653 HydrophobicContact CG1-CD1 4.33Å; V591-L653 HydrophobicContact CG2-CD1 3.67Å; V591-L653 HydrophobicContact CG2-CG 4.26Å; V591-T656 HydrophobicContact CG1-CG2 3.56Å; V591-T657 WeakPolarHBondContact CG2-OG1 3.36Å
592K95.9Very high94.1Very high112 Ų11235.4 Ų35.449%0.48717%0.166SC..Hα-helixtrans-60.7-44.2177.5-176.8180179.9-178.80112.1L524 E588 R589 L590 Y596L524-K592 HydrophobicContact CD1-CD 4.39Å; E588-K592 WeakPolarHBondContact O-CB 3.39Å; E588-K592 PolarHBondContact O-N 2.88Å; R589-K592 PolarHBondContact O-N 2.64Å; L590-K592 VanDerWaalsContact C-N 3.32Å; L590-K592 PolarHBondContact O-N 3.23Å; K592-Y596 VanDerWaalsContact O-CB 3.28Å; K592-Y596 WeakPolarHBondContact O-CB 3.25Å; K592-Y596 PolarHBondContact O-N 3.47Å
593V95.5Very high93.8Very high2 Ų233.3 Ų33.31%0.01216%0.155CC..Hα-helixtrans-70.8-43.3-176.3172.20000111.2L520 Y523 L524 R589 L590 V591 Y596 G597L520-V593 HydrophobicContact CD1-CG2 4.38Å; L520-V593 HydrophobicContact CD2-CB 4.31Å; L520-V593 HydrophobicContact CD2-CG1 4.05Å; L520-V593 HydrophobicContact CD2-CG2 3.46Å; L520-V593 VanDerWaalsContact CD2-CG2 3.46Å; L520-V593 HydrophobicContact CG-CG2 4.41Å; Y523-V593 HydrophobicContact CD1-CG1 3.99Å; Y523-V593 HydrophobicContact CE1-CG1 3.98Å; L524-V593 HydrophobicContact CD1-CG2 4.19Å; L524-V593 HydrophobicContact CD2-CG2 4.06Å; L524-V593 HydrophobicContact CG-CG2 4.26Å; R589-V593 WeakPolarHBondContact O-CB 3.23Å; R589-V593 WeakPolarHBondContact O-CG2 3.45Å; R589-V593 PolarHBondContact O-N 2.9Å; L590-V593 PolarHBondContact O-N 2.95Å; V591-V593 PolarHBondContact O-N 3.44Å; V593-Y596 PolarHBondContact O-N 3.11Å; V593-G597 PolarHBondContact O-N 3.05Å
594T95.7Very high93.5Very high1 Ų137.4 Ų37.41%0.00618%0.177CC..Hα-helixtrans-62.6-44.2174.3-55.90000111.3L590 Y596 G597 S598 H621 S624 L625 A660L590-T594 PolarHBondContact O-N 2.93Å; L590-T594 PolarHBondContact O-OG1 3.5Å; T594-Y596 PolarHBondContact O-N 3.4Å; T594-G597 PolarHBondContact O-N 3.39Å; T594-S598 PolarHBondContact O-N 3.25Å; T594-S598 VanDerWaalsContact O-N 3.1Å; T594-S598 PolarHBondContact O-OG 2.88Å; T594-H621 PolarHBondContact O-NE2 3.34Å; T594-S624 PolarHBondContact OG1-OG 3.17Å; T594-L625 HydrophobicContact CG2-CD2 3.27Å; T594-L625 HydrophobicContact CG2-CG 3.76Å; T594-A660 HydrophobicContact CG2-CB 3.89Å
595L96.1Very high93.3Very high31 Ų3137 Ų3716%0.16217%0.174CC..Hα-helixtrans-60.7-45.9176.1-175.771.5000111.7V591 S598 Q599 T656 D659 A660V591-L595 VanDerWaalsContact O-CB 3.28Å; V591-L595 WeakPolarHBondContact O-CB 3.39Å; V591-L595 PolarHBondContact O-N 3.37Å; L595-S598 PolarHBondContact O-N 3.42Å; L595-Q599 HydrophobicContact CD1-CG 4.18Å; L595-Q599 HydrophobicContact CG-CG 4.16Å; L595-Q599 WeakPolarHBondContact O-CB 3.49Å; L595-Q599 VanDerWaalsContact O-CG 3.31Å; L595-Q599 WeakPolarHBondContact O-CG 3.46Å; L595-Q599 PolarHBondContact O-N 3.22Å; L595-T656 HydrophobicContact CB-CG2 4.34Å; L595-T656 HydrophobicContact CD1-CG2 4.22Å; L595-T656 HydrophobicContact CD2-CG2 3.56Å; L595-T656 HydrophobicContact CG-CG2 4.24Å; L595-D659 HydrophobicContact CD1-CB 4.14Å; L595-A660 HydrophobicContact CB-CB 4.11Å; L595-A660 HydrophobicContact CD1-CB 3.95Å
596Y95.4Very high93Very high21 Ų2139 Ų398%0.08218%0.18CC..Hα-helixtrans-58.7-47.5178.4170.4-95.3000111.8Y523 L524 L526 Q527 K592 V593 T594 S598 Q599 I600 L602Y523-Y596 AromaticContact CD1-CD1 3.99Å; Y523-Y596 HydrophobicContact CD1-CD1 3.99Å; Y523-Y596 AromaticContact CD1-CE1 3.94Å; Y523-Y596 HydrophobicContact CD1-CE1 3.94Å; Y523-Y596 AromaticContact CE1-CD1 3.71Å; Y523-Y596 HydrophobicContact CE1-CD1 3.71Å; Y523-Y596 AromaticContact CE1-CE1 3.88Å; Y523-Y596 HydrophobicContact CE1-CE1 3.88Å; Y523-Y596 VanDerWaalsContact O-CE1 3.26Å; Y523-Y596 WeakPolarHBondContact O-CE1 3.31Å; Y523-Y596 PolarHBondContact O-OH 2.93Å; Y523-Y596 VanDerWaalsContact O-OH 3.07Å; L524-Y596 HydrophobicContact CD2-CD1 3.68Å; L524-Y596 HydrophobicContact CD2-CD2 4.02Å; L524-Y596 HydrophobicContact CD2-CE1 4.2Å; L524-Y596 HydrophobicContact CD2-CG 3.57Å; L524-Y596 WeakPolarHBondContact O-CE2 3.2Å; L524-Y596 PolarHBondContact O-OH 2.92Å; L524-Y596 VanDerWaalsContact O-OH 3.1Å; L526-Y596 PolarHBondContact N-OH 3.04Å; Q527-Y596 HydrophobicContact CB-CE2 4.07Å; Q527-Y596 PolarHBondContact N-OH 3.4Å; K592-Y596 VanDerWaalsContact O-CB 3.28Å; K592-Y596 WeakPolarHBondContact O-CB 3.25Å; K592-Y596 PolarHBondContact O-N 3.47Å; V593-Y596 PolarHBondContact O-N 3.11Å; T594-Y596 PolarHBondContact O-N 3.4Å; Y596-S598 VanDerWaalsContact C-N 3.33Å; Y596-S598 PolarHBondContact O-N 3.05Å; Y596-Q599 PolarHBondContact O-N 2.88Å; Y596-I600 HydrophobicContact CD2-CD1 3.52Å; Y596-I600 HydrophobicContact CD2-CG1 4.35Å; Y596-I600 HydrophobicContact CE1-CD1 4.25Å; Y596-I600 HydrophobicContact CE2-CD1 3.06Å; Y596-I600 HydrophobicContact CE2-CG1 4.29Å; Y596-I600 HydrophobicContact CG-CD1 4.26Å; Y596-I600 VanDerWaalsContact CZ-CD1 3.47Å; Y596-I600 WeakPolarHBondContact O-CB 3.4Å; Y596-I600 PolarHBondContact O-N 3.39Å; Y596-L602 HydrophobicContact CD1-CD1 3.93Å; Y596-L602 HydrophobicContact CE1-CD1 3.39Å
597G92.8Very high92.8Very high0 Ų039.4 Ų39.40%018%0.182CC..Hα-helixtrans-57.6-43176.500000113V593 T594 K601 L602V593-G597 PolarHBondContact O-N 3.05Å; T594-G597 PolarHBondContact O-N 3.39Å; G597-K601 WeakPolarHBondContact O-CA 3.36Å; G597-K601 PolarHBondContact O-N 3.46Å; G597-L602 PolarHBondContact O-N 3.24Å
598S93.3Very high92.3Very high2 Ų241.3 Ų41.31%0.01420%0.198CC..Hα-helixtrans-71.8-40.9178.1-74.20000114.2T594 L595 Y596 K601 H621 A660 L664T594-S598 PolarHBondContact O-N 3.25Å; T594-S598 VanDerWaalsContact O-N 3.1Å; T594-S598 PolarHBondContact O-OG 2.88Å; L595-S598 PolarHBondContact O-N 3.42Å; Y596-S598 VanDerWaalsContact C-N 3.33Å; Y596-S598 PolarHBondContact O-N 3.05Å; S598-K601 WeakPolarHBondContact O-CG 3.19Å; S598-H621 PolarHBondContact N-CE1 3.22Å; S598-H621 VanDerWaalsContact N-CE1 3.32Å; S598-H621 PolarHBondContact OG-CE1 3.32Å; S598-H621 VanDerWaalsContact OG-CE1 3.29Å; S598-H621 PolarHBondContact OG-NE2 2.62Å; S598-A660 VanDerWaalsContact CB-O 3.25Å; S598-A660 WeakPolarHBondContact CB-O 3.31Å; S598-A660 PolarHBondContact OG-O 2.9Å; S598-L664 WeakPolarHBondContact OG-CD1 3.1Å; S598-L664 WeakPolarHBondContact OG-CG 3.45Å
599Q91.8Very high91.9Very high135 Ų13540.1 Ų40.163%0.63120%0.196SC*.Hα-helixtrans-68.5-44.8-178.6-76.6-178.5-5.200112L595 Y596 K601L595-Q599 HydrophobicContact CD1-CG 4.18Å; L595-Q599 HydrophobicContact CG-CG 4.16Å; L595-Q599 WeakPolarHBondContact O-CB 3.49Å; L595-Q599 VanDerWaalsContact O-CG 3.31Å; L595-Q599 WeakPolarHBondContact O-CG 3.46Å; L595-Q599 PolarHBondContact O-N 3.22Å; Y596-Q599 PolarHBondContact O-N 2.88Å; Q599-K601 VanDerWaalsContact C-N 3.34Å
600I90Very high91.5Very high31 Ų3139.9 Ų39.916%0.15921%0.205CC..Hα-helixtrans-80.4-21.4-179.1-62.4-173.4000111.6Q527 I530 Y596 L602 I605Q527-I600 HydrophobicContact CB-CD1 3.88Å; Q527-I600 HydrophobicContact CG-CD1 3.89Å; I530-I600 HydrophobicContact CD1-CG2 3.36Å; Y596-I600 HydrophobicContact CD2-CD1 3.52Å; Y596-I600 HydrophobicContact CD2-CG1 4.35Å; Y596-I600 HydrophobicContact CE1-CD1 4.25Å; Y596-I600 HydrophobicContact CE2-CD1 3.06Å; Y596-I600 HydrophobicContact CE2-CG1 4.29Å; Y596-I600 HydrophobicContact CG-CD1 4.26Å; Y596-I600 VanDerWaalsContact CZ-CD1 3.47Å; Y596-I600 WeakPolarHBondContact O-CB 3.4Å; Y596-I600 PolarHBondContact O-N 3.39Å; I600-L602 HydrophobicContact CB-CG 4.31Å; I600-L602 HydrophobicContact CG2-CD2 4.17Å; I600-L602 HydrophobicContact CG2-CG 3.91Å; I600-I605 HydrophobicContact CG2-CD1 3.86Å
601K90.9Very high91.1Very high110 Ų11044.5 Ų44.548%0.47824%0.238SC..THydrogen-bonded Turntrans58.346.9-174.9-52.8175.1-178.4170.70111.6G597 S598 Q599 Y603 N604G597-K601 WeakPolarHBondContact O-CA 3.36Å; G597-K601 PolarHBondContact O-N 3.46Å; S598-K601 WeakPolarHBondContact O-CG 3.19Å; Q599-K601 VanDerWaalsContact C-N 3.34Å; K601-Y603 HydrophobicContact CB-CE1 4.04Å; K601-Y603 HydrophobicContact CG-CE1 4.36Å; K601-Y603 PolarHBondContact O-N 2.93Å; K601-Y603 VanDerWaalsContact O-N 3.08Å; K601-N604 HydrophobicContact CB-CB 4.42Å; K601-N604 PolarHBondContact O-N 3.04Å
602L87.3Confident90.7Very high1 Ų146.9 Ų46.91%0.00525%0.252CS..G310 helixtrans-52.1-33.6-179.7-81.2164.3000112.9Y523 L526 I530 Y596 G597 I600 N604 I605 L617Y523-L602 HydrophobicContact CE1-CD1 3.97Å; Y523-L602 HydrophobicContact CE2-CD1 3.96Å; Y523-L602 WeakPolarHBondContact OH-CD1 3.4Å; L526-L602 HydrophobicContact CD1-CD2 4.43Å; I530-L602 HydrophobicContact CD1-CD2 4.21Å; Y596-L602 HydrophobicContact CD1-CD1 3.93Å; Y596-L602 HydrophobicContact CE1-CD1 3.39Å; G597-L602 PolarHBondContact O-N 3.24Å; I600-L602 HydrophobicContact CB-CG 4.31Å; I600-L602 HydrophobicContact CG2-CD2 4.17Å; I600-L602 HydrophobicContact CG2-CG 3.91Å; L602-N604 PolarHBondContact O-N 2.76Å; L602-I605 HydrophobicContact CD2-CD1 3.96Å; L602-I605 PolarHBondContact O-N 2.8Å; L602-L617 HydrophobicContact CB-CD2 4.48Å; L602-L617 HydrophobicContact CD2-CD2 4.45Å
603Y86.5Confident90.5Very high8 Ų841.7 Ų41.73%0.03123%0.23CC..G310 helixtrans-63.3-16.4175.858.3-92.3000114.9K601 K614 H621 L664 V669 L673K601-Y603 HydrophobicContact CB-CE1 4.04Å; K601-Y603 HydrophobicContact CG-CE1 4.36Å; K601-Y603 PolarHBondContact O-N 2.93Å; K601-Y603 VanDerWaalsContact O-N 3.08Å; Y603-K614 WeakPolarHBondContact O-CE 3.43Å; Y603-H621 AromaticContact CD1-ND1 3.71Å; Y603-L664 HydrophobicContact CE1-CD2 3.68Å; Y603-V669 HydrophobicContact CE2-CG1 4.39Å; Y603-V669 HydrophobicContact CE2-CG2 4.11Å; Y603-L673 HydrophobicContact CD1-CD1 4.12Å; Y603-L673 HydrophobicContact CD2-CD1 4.19Å; Y603-L673 HydrophobicContact CG-CD1 3.71Å
604N88.4Confident90.4Very high86 Ų8644.9 Ų44.946%0.4624%0.244SC..G310 helixtrans-111.73.7179.3-81.1-8.7000113.5K601 L602K601-N604 HydrophobicContact CB-CB 4.42Å; K601-N604 PolarHBondContact O-N 3.04Å; L602-N604 PolarHBondContact O-N 2.76Å
605I89.3Confident90.2Very high6 Ų648 Ų483%0.03126%0.263CS..  trans-76.7142.9-178.1-75.1-175.9000111.1I530 H537 L539 I600 L602I530-I605 HydrophobicContact CD1-CD1 3.55Å; I530-I605 HydrophobicContact CG1-CD1 4.08Å; I530-I605 HydrophobicContact CG2-CD1 4.17Å; H537-I605 HydrophobicContact CB-CD1 4.17Å; H537-I605 HydrophobicContact CB-CG1 3.91Å; L539-I605 HydrophobicContact CB-CG2 3.9Å; I600-I605 HydrophobicContact CG2-CD1 3.86Å; L602-I605 HydrophobicContact CD2-CD1 3.96Å; L602-I605 PolarHBondContact O-N 2.8Å
606E88.1Confident90.1Very high98 Ų9846.8 Ų46.846%0.45826%0.257SS..BIsolated β-bridgetrans-72.8126.6171-67.9-179.5-179.700110H537 R538 L539H537-E606 PolarHBondContact O-N 3.33Å; R538-E606 CarbonylContact C-O 3.14Å; R538-E606 WeakPolarHBondContact CA-O 3.37Å; R538-E606 HydrophobicContact CB-CB 4.24Å; R538-E606 HydrophobicContact CG-CB 4.26Å; L539-E606 PolarHBondContact N-O 3.44Å
607T90.2Very high90.1Very high12 Ų1245.9 Ų45.97%0.07425%0.254CS..  trans-116.5159.5178.563.80000110.8L539 V609 P610 L613 L617L539-T607 HydrophobicContact CB-CG2 4.33Å; L539-T607 HydrophobicContact CD2-CG2 4.25Å; T607-V609 VanDerWaalsContact C-N 3.27Å; T607-V609 PolarHBondContact O-N 2.95Å; T607-P610 WeakPolarHBondContact O-CG 3.44Å; T607-P610 WeakPolarHBondContact OG1-CA 3.19Å; T607-L613 HydrophobicContact CG2-CB 4.19Å; T607-L617 HydrophobicContact CG2-CD1 4.12Å
608A85.6Confident90.1Very high40 Ų4046.3 Ų46.333%0.33126%0.256SS..SBendtrans-65.5-30.6178.600000113I541 T542I541-A608 WeakPolarHBondContact O-CB 3.46Å; T542-A608 HydrophobicContact CG2-CB 4.08Å
609V88.2Confident90.2Very high56 Ų5646.7 Ų46.734%0.33926%0.258SS..SBendtrans-127.379.7178.3-167.70000109.3T607 S611 V612 L613T607-V609 VanDerWaalsContact C-N 3.27Å; T607-V609 PolarHBondContact O-N 2.95Å; V609-S611 VanDerWaalsContact C-N 3.29Å; V609-S611 PolarHBondContact O-N 3.32Å; V609-V612 HydrophobicContact CG1-CB 4.05Å; V609-V612 HydrophobicContact CG1-CG2 3.84Å; V609-V612 PolarHBondContact O-N 3.05Å; V609-L613 PolarHBondContact O-N 3.28Å; V609-L613 VanDerWaalsContact O-N 3.09Å
610P86.6Confident90.4Very high77 Ų7740.3 Ų40.350%0.523%0.228SC..Hα-helixtrans-62.4-30.4-172.3-25.235000114.8T607 V612 K614 P615T607-P610 WeakPolarHBondContact O-CG 3.44Å; T607-P610 WeakPolarHBondContact OG1-CA 3.19Å; P610-V612 PolarHBondContact O-N 3.24Å; P610-K614 WeakPolarHBondContact O-CB 3.31Å; P610-P615 WeakPolarHBondContact O-CD 3.47Å
611S87.9Confident90.7Very high100 Ų10038.9 Ų38.970%0.69922%0.221SC*.Hα-helixtrans-68.3-20.4179.851.10000113.7V609V609-S611 VanDerWaalsContact C-N 3.29Å; V609-S611 PolarHBondContact O-N 3.32Å
612V89.4Confident90.9Very high56 Ų5633.7 Ų33.734%0.33920%0.199SC..Hα-helixtrans-110.1-61.8-176179.90000110.4H551 V609 P610 K614 P615 D616H551-V612 HydrophobicContact CB-CG1 4.16Å; H551-V612 VanDerWaalsContact ND1-CG1 3.34Å; H551-V612 WeakPolarHBondContact ND1-CG1 3.34Å; V609-V612 HydrophobicContact CG1-CB 4.05Å; V609-V612 HydrophobicContact CG1-CG2 3.84Å; V609-V612 PolarHBondContact O-N 3.05Å; P610-V612 PolarHBondContact O-N 3.24Å; V612-K614 PolarHBondContact O-N 3.26Å; V612-P615 VanDerWaalsContact O-CD 3.28Å; V612-P615 WeakPolarHBondContact O-CD 3.31Å; V612-D616 VanDerWaalsContact O-CG 3.27Å; V612-D616 PolarHBondContact O-N 3.48Å
613L92.5Very high91.3Very high2 Ų235.3 Ų35.31%0.0121%0.206CC..Hα-helixtrans-71.6-27.7-170.5-67.3177.1000113.7C547 L550 H551 L554 T607 V609 D616 L617C547-L613 HydrophobicContact CB-CD1 4.4Å; L550-L613 HydrophobicContact CB-CD2 4.32Å; L550-L613 HydrophobicContact CD2-CD1 4.28Å; L550-L613 HydrophobicContact CD2-CD2 4.1Å; L550-L613 HydrophobicContact CG-CD2 4.05Å; H551-L613 HydrophobicContact CB-CD2 4.05Å; L554-L613 HydrophobicContact CD1-CD2 4.36Å; T607-L613 HydrophobicContact CG2-CB 4.19Å; V609-L613 PolarHBondContact O-N 3.28Å; V609-L613 VanDerWaalsContact O-N 3.09Å; L613-D616 PolarHBondContact O-N 3.01Å; L613-L617 VanDerWaalsContact O-CG 3.25Å; L613-L617 WeakPolarHBondContact O-CG 3.44Å; L613-L617 PolarHBondContact O-N 3.41Å
614K91.8Very high91.9Very high70 Ų7034.9 Ų34.930%0.30421%0.205SC..Hα-helixtrans-69.6-51.5-179.7-173.1178.8178.2176.70110.6Y603 P610 V612 D616 L617 I618Y603-K614 WeakPolarHBondContact O-CE 3.43Å; P610-K614 WeakPolarHBondContact O-CB 3.31Å; V612-K614 PolarHBondContact O-N 3.26Å; K614-D616 VanDerWaalsContact C-N 3.27Å; K614-D616 PolarHBondContact O-N 3.47Å; K614-L617 PolarHBondContact O-N 3.08Å; K614-I618 HydrophobicContact CG-CD1 3.89Å; K614-I618 VanDerWaalsContact O-CD1 3.28Å; K614-I618 WeakPolarHBondContact O-CD1 3.34Å; K614-I618 WeakPolarHBondContact O-CG1 3.38Å; K614-I618 PolarHBondContact O-N 2.84Å
615P92.1Very high92.3Very high65 Ų6530.8 Ų30.842%0.42218%0.183SC..Hα-helixtrans-49.3-44.8169-29.534.2000113.8P610 V612 L617 I618 D619P610-P615 WeakPolarHBondContact O-CD 3.47Å; V612-P615 VanDerWaalsContact O-CD 3.28Å; V612-P615 WeakPolarHBondContact O-CD 3.31Å; P615-L617 PolarHBondContact O-N 3.21Å; P615-I618 WeakPolarHBondContact O-CB 3.37Å; P615-I618 PolarHBondContact O-N 3.06Å; P615-D619 WeakPolarHBondContact O-CB 3.27Å; P615-D619 PolarHBondContact O-N 3Å
616D93.8Very high92.7Very high7 Ų732 Ų324%0.03719%0.194CC..Hα-helixtrans-60.8-45.4179.2-61.1-31.1000112.8H551 L554 R555 V612 L613 K614 I618 D619 V620H551-D616 IonicContact CE1-OD1 3.86Å; H551-D616 IonicContact CE1-OD2 3.84Å; H551-D616 IonicContact CG-OD2 3.14Å; H551-D616 VanDerWaalsContact ND1-CG 3.35Å; H551-D616 IonicContact ND1-OD1 2.69Å; H551-D616 PolarHBondContact ND1-OD1 2.89Å; H551-D616 IonicContact ND1-OD2 3.35Å; H551-D616 PolarHBondContact ND1-OD2 3.03Å; L554-D616 HydrophobicContact CB-CB 3.74Å; L554-D616 HydrophobicContact CD1-CB 3.61Å; L554-D616 HydrophobicContact CG-CB 4.32Å; R555-D616 WeakPolarHBondContact CD-OD1 3.19Å; V612-D616 VanDerWaalsContact O-CG 3.27Å; V612-D616 PolarHBondContact O-N 3.48Å; L613-D616 PolarHBondContact O-N 3.01Å; K614-D616 VanDerWaalsContact C-N 3.27Å; K614-D616 PolarHBondContact O-N 3.47Å; D616-I618 VanDerWaalsContact C-N 3.31Å; D616-I618 PolarHBondContact O-N 2.95Å; D616-D619 PolarHBondContact O-N 3.43Å; D616-V620 WeakPolarHBondContact O-CG2 3.34Å; D616-V620 PolarHBondContact O-N 3.29Å
617L95.1Very high93.1Very high1 Ų127.5 Ų27.51%0.00517%0.173CC..Hα-helixtrans-64.9-36.9178.6-71.4170.5000112.1Y523 L526 L554 L602 T607 L613 K614 P615 H621Y523-L617 HydrophobicContact CD2-CD2 4.43Å; Y523-L617 HydrophobicContact CE2-CD2 3.81Å; L526-L617 HydrophobicContact CD1-CD2 3.92Å; L554-L617 HydrophobicContact CD1-CD2 3.9Å; L554-L617 HydrophobicContact CD1-CG 4.1Å; L554-L617 HydrophobicContact CD2-CD2 4.12Å; L602-L617 HydrophobicContact CB-CD2 4.48Å; L602-L617 HydrophobicContact CD2-CD2 4.45Å; T607-L617 HydrophobicContact CG2-CD1 4.12Å; L613-L617 VanDerWaalsContact O-CG 3.25Å; L613-L617 WeakPolarHBondContact O-CG 3.44Å; L613-L617 PolarHBondContact O-N 3.41Å; K614-L617 PolarHBondContact O-N 3.08Å; P615-L617 PolarHBondContact O-N 3.21Å; L617-H621 WeakPolarHBondContact O-CB 3.49Å; L617-H621 PolarHBondContact O-N 2.79Å
618I94.3Very high93.4Very high9 Ų927 Ų275%0.04617%0.17CC..Hα-helixtrans-65.9-45174.1-70.6153.2000109.9K614 P615 D616 H621 A622 L673K614-I618 HydrophobicContact CG-CD1 3.89Å; K614-I618 VanDerWaalsContact O-CD1 3.28Å; K614-I618 WeakPolarHBondContact O-CD1 3.34Å; K614-I618 WeakPolarHBondContact O-CG1 3.38Å; K614-I618 PolarHBondContact O-N 2.84Å; P615-I618 WeakPolarHBondContact O-CB 3.37Å; P615-I618 PolarHBondContact O-N 3.06Å; D616-I618 VanDerWaalsContact C-N 3.31Å; D616-I618 PolarHBondContact O-N 2.95Å; I618-H621 PolarHBondContact O-N 3.43Å; I618-A622 WeakPolarHBondContact O-CB 3.36Å; I618-A622 PolarHBondContact O-N 3.08Å; I618-L673 HydrophobicContact CB-CD1 4.5Å; I618-L673 HydrophobicContact CG1-CD1 4.32Å; I618-L673 HydrophobicContact CG2-CD1 4.08Å; I618-L673 HydrophobicContact CG2-CG 4.02Å
619D93.6Very high94Very high11 Ų1127.6 Ų27.66%0.05917%0.166CC..Hα-helixtrans-66.8-48-177.4-168.348.2000111.8S558 P615 D616 H621 A622 Q623 K672S558-D619 WeakPolarHBondContact CB-OD2 3.4Å; S558-D619 PolarHBondContact OG-OD2 3.15Å; P615-D619 WeakPolarHBondContact O-CB 3.27Å; P615-D619 PolarHBondContact O-N 3Å; D616-D619 PolarHBondContact O-N 3.43Å; D619-H621 PolarHBondContact O-N 3.39Å; D619-A622 PolarHBondContact O-N 3.14Å; D619-A622 VanDerWaalsContact O-N 3.12Å; D619-Q623 WeakPolarHBondContact O-CG 3.11Å; D619-Q623 PolarHBondContact O-N 2.84Å; D619-Q623 PolarHBondContact OD1-NE2 3.03Å; D619-K672 WeakPolarHBondContact OD1-CE 3.5Å; D619-K672 IonicContact OD1-NZ 2.64Å; D619-K672 PolarHBondContact OD1-NZ 3.21Å
620V96.5Very high94.4Very high0 Ų026.8 Ų26.80%017%0.165CC..Hα-helixtrans-54.1-43.8174.1168.50000111.4Y523 L554 L557 L561 D616 S624Y523-V620 HydrophobicContact CD1-CG1 4.45Å; Y523-V620 HydrophobicContact CD2-CG1 3.84Å; Y523-V620 HydrophobicContact CE1-CG1 4.25Å; Y523-V620 HydrophobicContact CE2-CB 4.15Å; Y523-V620 HydrophobicContact CE2-CG1 3.59Å; Y523-V620 HydrophobicContact CG-CG1 4.25Å; L554-V620 HydrophobicContact CB-CG2 4.01Å; L554-V620 HydrophobicContact CD2-CG2 4.07Å; L554-V620 WeakPolarHBondContact O-CG2 3.42Å; L557-V620 HydrophobicContact CB-CG2 4.29Å; L557-V620 HydrophobicContact CD2-CG1 3.55Å; L557-V620 HydrophobicContact CD2-CG2 4.33Å; L557-V620 HydrophobicContact CG-CG1 4.04Å; L557-V620 HydrophobicContact CG-CG2 4.37Å; L561-V620 HydrophobicContact CD1-CG1 4.21Å; D616-V620 WeakPolarHBondContact O-CG2 3.34Å; D616-V620 PolarHBondContact O-N 3.29Å; V620-S624 WeakPolarHBondContact O-CB 3.41Å; V620-S624 PolarHBondContact O-N 2.96Å
621H96.2Very high94.9Very high1 Ų123.2 Ų23.21%0.00514%0.141CC..Hα-helixtrans-69.6-42.2179.9-169.6-176.8000111.5T594 S598 Y603 L617 I618 D619 S624 L625 L673T594-H621 PolarHBondContact O-NE2 3.34Å; S598-H621 PolarHBondContact N-CE1 3.22Å; S598-H621 VanDerWaalsContact N-CE1 3.32Å; S598-H621 PolarHBondContact OG-CE1 3.32Å; S598-H621 VanDerWaalsContact OG-CE1 3.29Å; S598-H621 PolarHBondContact OG-NE2 2.62Å; Y603-H621 AromaticContact CD1-ND1 3.71Å; L617-H621 WeakPolarHBondContact O-CB 3.49Å; L617-H621 PolarHBondContact O-N 2.79Å; I618-H621 PolarHBondContact O-N 3.43Å; D619-H621 PolarHBondContact O-N 3.39Å; H621-S624 PolarHBondContact O-N 3.44Å; H621-S624 PolarHBondContact O-OG 3Å; H621-L625 PolarHBondContact O-N 3.39Å; H621-L673 HydrophobicContact CB-CD2 3.76Å
622A95.9Very high95.3Very high2 Ų218.9 Ų18.92%0.01711%0.111CC..Hα-helixtrans-60.2-45.7174.400000111.7I618 D619 S624 L625 A626 K672 L673I618-A622 WeakPolarHBondContact O-CB 3.36Å; I618-A622 PolarHBondContact O-N 3.08Å; D619-A622 PolarHBondContact O-N 3.14Å; D619-A622 VanDerWaalsContact O-N 3.12Å; A622-S624 VanDerWaalsContact C-N 3.33Å; A622-S624 PolarHBondContact O-N 2.64Å; A622-L625 WeakPolarHBondContact O-CB 3.32Å; A622-L625 PolarHBondContact O-N 2.95Å; A622-A626 PolarHBondContact O-N 2.91Å; A622-K672 HydrophobicContact CB-CD 4.4Å; A622-K672 HydrophobicContact CB-CG 4.03Å; A622-L673 HydrophobicContact CB-CD2 3.96Å
623Q96.1Very high95.6Very high34 Ų3421.5 Ų21.516%0.15912%0.119CC..Hα-helixtrans-67.7-30.8176.9-62.7-49.1-24.600112.8S558 L561 Q562 D619 L625 A626 A627S558-Q623 VanDerWaalsContact OG-CG 3.23Å; S558-Q623 WeakPolarHBondContact OG-CG 3.35Å; L561-Q623 HydrophobicContact CB-CB 3.93Å; L561-Q623 HydrophobicContact CD1-CB 4.11Å; Q562-Q623 HydrophobicContact CG-CG 4.09Å; Q562-Q623 VanDerWaalsContact CG-OE1 3.24Å; D619-Q623 WeakPolarHBondContact O-CG 3.11Å; D619-Q623 PolarHBondContact O-N 2.84Å; D619-Q623 PolarHBondContact OD1-NE2 3.03Å; Q623-L625 VanDerWaalsContact C-N 3.32Å; Q623-L625 PolarHBondContact O-N 2.79Å; Q623-A626 PolarHBondContact O-N 3.23Å; Q623-A627 WeakPolarHBondContact O-CB 3.32Å; Q623-A627 PolarHBondContact O-N 3.5Å
624S97.2Very high95.8Very high0 Ų021.4 Ų21.40%012%0.119CC..Hα-helixtrans-64.3-39.4173.6770000111.8T594 V620 H621 A622 L628T594-S624 PolarHBondContact OG1-OG 3.17Å; V620-S624 WeakPolarHBondContact O-CB 3.41Å; V620-S624 PolarHBondContact O-N 2.96Å; H621-S624 PolarHBondContact O-N 3.44Å; H621-S624 PolarHBondContact O-OG 3Å; A622-S624 VanDerWaalsContact C-N 3.33Å; A622-S624 PolarHBondContact O-N 2.64Å; S624-L628 WeakPolarHBondContact O-CB 3.41Å; S624-L628 PolarHBondContact O-N 3.41Å
625L97.6Very high95.9Very high0 Ų018.2 Ų18.20%011%0.105CC..Hα-helixtrans-67-45.4174.9-71.1159.3000111.1T594 H621 A622 Q623 L628 Q629 I661 L664 L673 A677 L680T594-L625 HydrophobicContact CG2-CD2 3.27Å; T594-L625 HydrophobicContact CG2-CG 3.76Å; H621-L625 PolarHBondContact O-N 3.39Å; A622-L625 WeakPolarHBondContact O-CB 3.32Å; A622-L625 PolarHBondContact O-N 2.95Å; Q623-L625 VanDerWaalsContact C-N 3.32Å; Q623-L625 PolarHBondContact O-N 2.79Å; L625-L628 PolarHBondContact O-N 3.07Å; L625-Q629 WeakPolarHBondContact O-CB 3.47Å; L625-Q629 PolarHBondContact O-N 3.39Å; L625-I661 HydrophobicContact CD2-CG1 4.27Å; L625-L664 HydrophobicContact CD1-CD1 3.67Å; L625-L664 HydrophobicContact CD2-CD1 4.35Å; L625-L673 HydrophobicContact CD1-CD2 4.38Å; L625-A677 HydrophobicContact CD1-CB 4.41Å; L625-L680 HydrophobicContact CD2-CD2 3.81Å
626A96.9Very high96Very high32 Ų3216 Ų1626%0.2649%0.092SC..Hα-helixtrans-65.6-41.6178.800000112.2A622 Q623 Q629 A630A622-A626 PolarHBondContact O-N 2.91Å; Q623-A626 PolarHBondContact O-N 3.23Å; A626-Q629 WeakPolarHBondContact O-CB 3.21Å; A626-Q629 PolarHBondContact O-N 2.97Å; A626-A630 PolarHBondContact O-N 2.95Å
627A97.3Very high95.9Very high3 Ų318.7 Ų18.73%0.02511%0.105CC..Hα-helixtrans-61.2-45.9173.600000110.8L561 L590 Q623 Q629 A630 Y631L561-A627 HydrophobicContact CB-CB 4.44Å; L561-A627 WeakPolarHBondContact O-CB 3.1Å; L590-A627 HydrophobicContact CD1-CB 4.07Å; L590-A627 HydrophobicContact CD2-CB 3.86Å; Q623-A627 WeakPolarHBondContact O-CB 3.32Å; Q623-A627 PolarHBondContact O-N 3.5Å; A627-Q629 VanDerWaalsContact C-N 3.29Å; A627-Q629 PolarHBondContact O-N 3.02Å; A627-A630 WeakPolarHBondContact O-CB 3.28Å; A627-A630 PolarHBondContact O-N 3.49Å; A627-Y631 WeakPolarHBondContact O-CD2 3.27Å
628L97.5Very high95.7Very high0 Ų019.1 Ų19.10%011%0.106CC..Hα-helixtrans-63-36.4175.9-17756.3000112.2V587 L590 V591 S624 L625 A630 Y631 T657 L680V587-L628 HydrophobicContact CG1-CD1 3.95Å; L590-L628 HydrophobicContact CB-CB 4.3Å; L590-L628 HydrophobicContact CB-CD1 4.28Å; V591-L628 HydrophobicContact CG2-CD1 3.79Å; V591-L628 HydrophobicContact CG2-CD2 3.75Å; V591-L628 HydrophobicContact CG2-CG 4.46Å; S624-L628 WeakPolarHBondContact O-CB 3.41Å; S624-L628 PolarHBondContact O-N 3.41Å; L625-L628 PolarHBondContact O-N 3.07Å; L628-A630 VanDerWaalsContact C-N 3.33Å; L628-A630 PolarHBondContact O-N 3.03Å; L628-Y631 PolarHBondContact O-N 3.48Å; L628-T657 HydrophobicContact CD2-CG2 3.75Å; L628-L680 HydrophobicContact CB-CD2 4.36Å; L628-L680 HydrophobicContact CD2-CD2 3.84Å; L628-L680 HydrophobicContact CG-CD1 4.21Å; L628-L680 HydrophobicContact CG-CD2 4.14Å
629Q97.4Very high95.4Very high54 Ų5419.2 Ų19.225%0.25211%0.108SC..Hα-helixtrans-61.5-39.7175-175-166.2-1600112.1L625 A626 A627 Y631 S632 L680 S683L625-Q629 WeakPolarHBondContact O-CB 3.47Å; L625-Q629 PolarHBondContact O-N 3.39Å; A626-Q629 WeakPolarHBondContact O-CB 3.21Å; A626-Q629 PolarHBondContact O-N 2.97Å; A627-Q629 VanDerWaalsContact C-N 3.29Å; A627-Q629 PolarHBondContact O-N 3.02Å; Q629-Y631 PolarHBondContact O-N 3.22Å; Q629-S632 WeakPolarHBondContact O-CB 3.42Å; Q629-S632 PolarHBondContact O-N 3.34Å; Q629-S632 PolarHBondContact O-OG 3.37Å; Q629-L680 HydrophobicContact CB-CB 4.38Å; Q629-L680 HydrophobicContact CB-CD1 3.95Å; Q629-S683 WeakPolarHBondContact CG-OG 3.44Å; Q629-S683 PolarHBondContact NE2-OG 2.92Å
630A97Very high95Very high38 Ų3821 Ų2131%0.31412%0.121SC..Hα-helixtrans-59.5-30.3178.400000112.6G565 A568 A626 A627 L628 S632G565-A630 VanDerWaalsContact O-CB 3.31Å; G565-A630 WeakPolarHBondContact O-CB 3.31Å; A568-A630 HydrophobicContact CB-CB 3.97Å; A568-A630 WeakPolarHBondContact CB-O 3.38Å; A626-A630 PolarHBondContact O-N 2.95Å; A627-A630 WeakPolarHBondContact O-CB 3.28Å; A627-A630 PolarHBondContact O-N 3.49Å; L628-A630 VanDerWaalsContact C-N 3.33Å; L628-A630 PolarHBondContact O-N 3.03Å; A630-S632 PolarHBondContact O-N 2.89Å
631Y97.4Very high94.3Very high2 Ų226 Ų261%0.00814%0.144CC..THydrogen-bonded Turntrans-80.58.9175.9-75.3-100.1000113.9V564 A568 F571 A583 V586 V587 L590 A627 L628 Q629 H633 W634 L635V564-Y631 HydrophobicContact CG1-CE2 4.12Å; V564-Y631 WeakPolarHBondContact O-CE2 3.33Å; V564-Y631 PolarHBondContact O-OH 2.86Å; V564-Y631 VanDerWaalsContact O-OH 3.06Å; A568-Y631 HydrophobicContact CB-CD1 4.25Å; A568-Y631 HydrophobicContact CB-CD2 3.81Å; A568-Y631 HydrophobicContact CB-CE1 4.21Å; A568-Y631 HydrophobicContact CB-CE2 3.74Å; A568-Y631 HydrophobicContact CB-CG 4.05Å; F571-Y631 AromaticContact CD2-CE1 3.83Å; F571-Y631 HydrophobicContact CD2-CE1 3.83Å; F571-Y631 HydrophobicContact CE2-CE1 4.29Å; F571-Y631 WeakPolarHBondContact CE2-OH 3.38Å; A583-Y631 HydrophobicContact CB-CE1 4.5Å; V586-Y631 HydrophobicContact CG1-CE1 4.32Å; V586-Y631 HydrophobicContact CG1-CE2 4.07Å; V587-Y631 HydrophobicContact CG2-CD1 3.48Å; V587-Y631 VanDerWaalsContact CG2-CD1 3.48Å; V587-Y631 HydrophobicContact CG2-CD2 4.48Å; V587-Y631 HydrophobicContact CG2-CE1 4.18Å; V587-Y631 HydrophobicContact CG2-CG 3.67Å; L590-Y631 HydrophobicContact CD1-CD2 4.12Å; L590-Y631 HydrophobicContact CD1-CE2 4.2Å; A627-Y631 WeakPolarHBondContact O-CD2 3.27Å; L628-Y631 PolarHBondContact O-N 3.48Å; Q629-Y631 PolarHBondContact O-N 3.22Å; Y631-H633 VanDerWaalsContact C-N 3.32Å; Y631-H633 PolarHBondContact O-N 3.35Å; Y631-W634 HydrophobicContact CD1-CB 4.19Å; Y631-W634 HydrophobicContact CD1-CG 4.36Å; Y631-W634 WeakPolarHBondContact O-CB 3.35Å; Y631-W634 PolarHBondContact O-N 3.3Å; Y631-W634 VanDerWaalsContact O-N 3.12Å; Y631-L635 WeakPolarHBondContact O-CG 3.27Å; Y631-L635 PolarHBondContact O-N 3.12Å
632S96.3Very high93.1Very high10 Ų1026.4 Ų26.47%0.0715%0.147CC..Hα-helixtrans-58.5-37.9179.257.30000113.8Q629 A630 L635 A636 V688Q629-S632 WeakPolarHBondContact O-CB 3.42Å; Q629-S632 PolarHBondContact O-N 3.34Å; Q629-S632 PolarHBondContact O-OG 3.37Å; A630-S632 PolarHBondContact O-N 2.89Å; S632-L635 PolarHBondContact O-N 2.71Å; S632-A636 WeakPolarHBondContact O-CB 3.36Å; S632-A636 PolarHBondContact O-N 3.18Å; S632-V688 WeakPolarHBondContact O-CG2 3.43Å
633H95.6Very high91.3Very high110 Ų11032 Ų3251%0.50917%0.173SC..Hα-helixtrans-68.4-38174.9-72.5-72.4000112.5I572 Y631 A636 Q637 T687I572-H633 HydrophobicContact CD1-CB 4.36Å; I572-H633 HydrophobicContact CG2-CB 4.46Å; Y631-H633 VanDerWaalsContact C-N 3.32Å; Y631-H633 PolarHBondContact O-N 3.35Å; H633-A636 WeakPolarHBondContact O-CB 3.18Å; H633-A636 PolarHBondContact O-N 2.86Å; H633-Q637 PolarHBondContact O-N 3.27Å; H633-T687 WeakPolarHBondContact ND1-CG2 3.34Å
634W96Very high89.3Confident1 Ų141.4 Ų41.40%0.00421%0.206CC..Hα-helixtrans-64-44.4173.3-178.188000111.3F571 I572 F576 F580 A583 L584 V587 Y631 A636 Q637 Y638F571-W634 VanDerWaalsContact O-CD1 3.28Å; I572-W634 HydrophobicContact CG2-CB 3.79Å; I572-W634 HydrophobicContact CG2-CG 4.46Å; F576-W634 AromaticContact CD2-CD1 3.6Å; F576-W634 AromaticContact CD2-NE1 3.6Å; F576-W634 AromaticContact CE2-CD1 3.46Å; F576-W634 VanDerWaalsContact CE2-CD1 3.46Å; F576-W634 HydrophobicContact CE2-CD2 4.3Å; F576-W634 AromaticContact CE2-CE2 3.82Å; F576-W634 HydrophobicContact CE2-CG 4.09Å; F576-W634 AromaticContact CE2-NE1 3.25Å; F576-W634 VanDerWaalsContact CE2-NE1 3.25Å; F580-W634 AromaticContact CD2-CZ2 3.78Å; F580-W634 HydrophobicContact CD2-CZ2 3.78Å; F580-W634 HydrophobicContact CE2-CH2 4.14Å; F580-W634 AromaticContact CE2-CZ2 3.68Å; F580-W634 HydrophobicContact CE2-CZ2 3.68Å; F580-W634 HydrophobicContact CZ-CZ2 4.38Å; A583-W634 HydrophobicContact CB-CD2 4.18Å; A583-W634 VanDerWaalsContact CB-CE2 3.47Å; A583-W634 HydrophobicContact CB-CG 4.42Å; A583-W634 HydrophobicContact CB-CZ2 3.79Å; A583-W634 VanDerWaalsContact CB-NE1 3.28Å; L584-W634 HydrophobicContact CB-CH2 3.97Å; L584-W634 HydrophobicContact CB-CZ2 4.19Å; L584-W634 HydrophobicContact CD1-CH2 4.01Å; V587-W634 HydrophobicContact CB-CZ3 4.17Å; V587-W634 HydrophobicContact CG1-CZ3 4.27Å; V587-W634 HydrophobicContact CG2-CE3 3.87Å; V587-W634 HydrophobicContact CG2-CZ3 3.88Å; Y631-W634 HydrophobicContact CD1-CB 4.19Å; Y631-W634 HydrophobicContact CD1-CG 4.36Å; Y631-W634 WeakPolarHBondContact O-CB 3.35Å; Y631-W634 PolarHBondContact O-N 3.3Å; Y631-W634 VanDerWaalsContact O-N 3.12Å; W634-A636 VanDerWaalsContact C-N 3.27Å; W634-A636 PolarHBondContact O-N 3.04Å; W634-Q637 PolarHBondContact O-N 3.49Å; W634-Y638 AromaticContact CH2-CD1 3.88Å; W634-Y638 HydrophobicContact CH2-CD1 3.88Å; W634-Y638 HydrophobicContact CH2-CE1 4.44Å; W634-Y638 HydrophobicContact CH2-CG 4.46Å; W634-Y638 AromaticContact CZ3-CD1 3.95Å; W634-Y638 HydrophobicContact CZ3-CD1 3.95Å; W634-Y638 PolarHBondContact O-N 3.49Å
635L94.8Very high87.2Confident3 Ų348.8 Ų48.82%0.01624%0.241CC..Hα-helixtrans-60.8-34.6173.9-72.8171.7000112.3V587 Y631 S632 Y638 C639 F650 L653 I654 L684 V688V587-L635 HydrophobicContact CG1-CD2 4.23Å; Y631-L635 WeakPolarHBondContact O-CG 3.27Å; Y631-L635 PolarHBondContact O-N 3.12Å; S632-L635 PolarHBondContact O-N 2.71Å; L635-Y638 PolarHBondContact O-N 3.09Å; L635-C639 VanDerWaalsContact O-CB 3.31Å; L635-C639 WeakPolarHBondContact O-CB 3.3Å; L635-C639 PolarHBondContact O-N 3.14Å; L635-F650 HydrophobicContact CD2-CE2 4.16Å; L635-L653 HydrophobicContact CD2-CD2 3.73Å; L635-I654 HydrophobicContact CD1-CD1 4.42Å; L635-I654 HydrophobicContact CD2-CD1 4.41Å; L635-L684 HydrophobicContact CD1-CD2 4.23Å; L635-V688 HydrophobicContact CB-CG1 4.21Å; L635-V688 HydrophobicContact CB-CG2 3.65Å; L635-V688 HydrophobicContact CD1-CG2 4.48Å
636A93.4Very high85.5Confident18 Ų1854.2 Ų54.215%0.14927%0.27CS..Hα-helixtrans-69.4-40.3176.100000112.6S632 H633 W634 C639 S640 T687S632-A636 WeakPolarHBondContact O-CB 3.36Å; S632-A636 PolarHBondContact O-N 3.18Å; H633-A636 WeakPolarHBondContact O-CB 3.18Å; H633-A636 PolarHBondContact O-N 2.86Å; W634-A636 VanDerWaalsContact C-N 3.27Å; W634-A636 PolarHBondContact O-N 3.04Å; A636-C639 PolarHBondContact O-N 3.38Å; A636-S640 PolarHBondContact O-N 3.26Å; A636-S640 VanDerWaalsContact O-N 3.09Å; A636-S640 PolarHBondContact O-OG 3.28Å; A636-T687 HydrophobicContact CB-CG2 4.22Å
637Q91.8Very high84.5Confident63 Ų6356.8 Ų56.829%0.29428%0.283SS..Hα-helixtrans-64.2-44.7171.6-72-172.1-11.800110.8F576 H633 W634 C639 S640 E641F576-Q637 HydrophobicContact CD2-CB 3.96Å; F576-Q637 VanDerWaalsContact CD2-OE1 3.29Å; F576-Q637 HydrophobicContact CE2-CB 3.71Å; F576-Q637 HydrophobicContact CZ-CB 4.14Å; H633-Q637 PolarHBondContact O-N 3.27Å; W634-Q637 PolarHBondContact O-N 3.49Å; Q637-C639 PolarHBondContact O-N 3.47Å; Q637-S640 WeakPolarHBondContact O-CB 3.49Å; Q637-S640 PolarHBondContact O-N 2.9Å; Q637-S640 VanDerWaalsContact O-N 3.1Å; Q637-E641 PolarHBondContact O-N 3.03Å
638Y91.4Very high83.9Confident11 Ų1163.3 Ų63.34%0.04331%0.313CS..Hα-helixtrans-59.6-45.8174.8-173.2-161.9000111.7F580 L584 W634 L635 S640 E641 V642 F650F580-Y638 HydrophobicContact CE2-CD1 4.36Å; F580-Y638 AromaticContact CE2-CD2 3.68Å; F580-Y638 HydrophobicContact CE2-CD2 3.68Å; F580-Y638 AromaticContact CE2-CE2 3.95Å; F580-Y638 HydrophobicContact CE2-CE2 3.95Å; F580-Y638 AromaticContact CE2-CG 3.95Å; F580-Y638 HydrophobicContact CE2-CG 3.95Å; F580-Y638 HydrophobicContact CZ-CD1 4.43Å; F580-Y638 AromaticContact CZ-CD2 3.86Å; F580-Y638 HydrophobicContact CZ-CD2 3.86Å; F580-Y638 HydrophobicContact CZ-CE1 4.2Å; F580-Y638 AromaticContact CZ-CE2 3.6Å; F580-Y638 HydrophobicContact CZ-CE2 3.6Å; F580-Y638 HydrophobicContact CZ-CG 4.31Å; F580-Y638 AromaticContact CZ-CZ 3.8Å; L584-Y638 HydrophobicContact CD1-CE1 4.44Å; W634-Y638 AromaticContact CH2-CD1 3.88Å; W634-Y638 HydrophobicContact CH2-CD1 3.88Å; W634-Y638 HydrophobicContact CH2-CE1 4.44Å; W634-Y638 HydrophobicContact CH2-CG 4.46Å; W634-Y638 AromaticContact CZ3-CD1 3.95Å; W634-Y638 HydrophobicContact CZ3-CD1 3.95Å; W634-Y638 PolarHBondContact O-N 3.49Å; L635-Y638 PolarHBondContact O-N 3.09Å; Y638-S640 PolarHBondContact O-N 3.04Å; Y638-E641 PolarHBondContact O-N 3.04Å; Y638-E641 VanDerWaalsContact O-N 3.11Å; Y638-V642 HydrophobicContact CD2-CG2 3.44Å; Y638-V642 VanDerWaalsContact CD2-CG2 3.44Å; Y638-V642 HydrophobicContact CE2-CG2 3.27Å; Y638-V642 HydrophobicContact CG-CG2 4.23Å; Y638-V642 WeakPolarHBondContact O-CB 3.38Å; Y638-V642 WeakPolarHBondContact O-CG2 3.27Å; Y638-V642 PolarHBondContact O-N 3.2Å; Y638-F650 AromaticContact CD1-CD2 3.46Å; Y638-F650 HydrophobicContact CD1-CD2 3.46Å; Y638-F650 VanDerWaalsContact CD1-CD2 3.46Å; Y638-F650 HydrophobicContact CD1-CE2 4.06Å; Y638-F650 HydrophobicContact CD1-CG 4.43Å; Y638-F650 HydrophobicContact CE1-CB 4.05Å; Y638-F650 AromaticContact CE1-CD2 3.69Å; Y638-F650 HydrophobicContact CE1-CD2 3.69Å; Y638-F650 HydrophobicContact CE1-CG 4.35Å; Y638-F650 AromaticContact CG-CD2 4Å; Y638-F650 HydrophobicContact CG-CD2 4Å; Y638-F650 HydrophobicContact CG-CE2 4.42Å
639C88.3Confident83.5Confident11 Ų1166.8 Ų66.87%0.07433%0.329CS..Hα-helixtrans-57.1-36.4175.4-169.80000112.8L635 A636 Q637 H643 F650 V688L635-C639 VanDerWaalsContact O-CB 3.31Å; L635-C639 WeakPolarHBondContact O-CB 3.3Å; L635-C639 PolarHBondContact O-N 3.14Å; A636-C639 PolarHBondContact O-N 3.38Å; Q637-C639 PolarHBondContact O-N 3.47Å; C639-H643 PolarHBondContact O-ND1 3.41Å; C639-H643 VanDerWaalsContact O-ND1 3.14Å; C639-F650 HydrophobicContact CB-CE1 3.84Å; C639-F650 HydrophobicContact CB-CE2 4.21Å; C639-F650 HydrophobicContact CB-CZ 3.5Å; C639-F650 VanDerWaalsContact CB-CZ 3.5Å; C639-V688 HydrophobicContact CB-CG1 4.24Å
640S84.8Confident83.2Confident49 Ų4964.3 Ų64.334%0.34332%0.317SS..Hα-helixtrans-70.5-39.7178.1-60.40000111.6A636 Q637 Y638 N736A636-S640 PolarHBondContact O-N 3.26Å; A636-S640 VanDerWaalsContact O-N 3.09Å; A636-S640 PolarHBondContact O-OG 3.28Å; Q637-S640 WeakPolarHBondContact O-CB 3.49Å; Q637-S640 PolarHBondContact O-N 2.9Å; Q637-S640 VanDerWaalsContact O-N 3.1Å; Y638-S640 PolarHBondContact O-N 3.04Å; S640-N736 PolarHBondContact OG-ND2 3.09Å
641E81.6Confident82.9Confident103 Ų10364.1 Ų64.148%0.48131%0.312SS..Hα-helixtrans-77.2-25.6178-69.2-164.1-171.500114.3F576 Q637 Y638 H643 R644F576-E641 WeakPolarHBondContact CD1-OE1 3.16Å; F576-E641 VanDerWaalsContact CE1-CD 3.4Å; F576-E641 HydrophobicContact CE1-CG 4.33Å; F576-E641 WeakPolarHBondContact CE1-OE1 3.31Å; F576-E641 WeakPolarHBondContact CE1-OE2 3.28Å; Q637-E641 PolarHBondContact O-N 3.03Å; Y638-E641 PolarHBondContact O-N 3.04Å; Y638-E641 VanDerWaalsContact O-N 3.11Å; E641-H643 PolarHBondContact O-N 2.94Å; E641-H643 VanDerWaalsContact O-N 3.1Å; E641-R644 WeakPolarHBondContact O-CB 3.43Å; E641-R644 PolarHBondContact O-N 3.13Å
642V70Confident82.7Confident11 Ų1167.5 Ų67.57%0.06733%0.333CS..THydrogen-bonded Turntrans-60-21.4179.3164.50000113.3Y638 R644 Q645 T647 F650Y638-V642 HydrophobicContact CD2-CG2 3.44Å; Y638-V642 VanDerWaalsContact CD2-CG2 3.44Å; Y638-V642 HydrophobicContact CE2-CG2 3.27Å; Y638-V642 HydrophobicContact CG-CG2 4.23Å; Y638-V642 WeakPolarHBondContact O-CB 3.38Å; Y638-V642 WeakPolarHBondContact O-CG2 3.27Å; Y638-V642 PolarHBondContact O-N 3.2Å; V642-R644 PolarHBondContact O-N 2.86Å; V642-R644 VanDerWaalsContact O-N 3.16Å; V642-Q645 WeakPolarHBondContact CA-O 3.48Å; V642-Q645 PolarHBondContact O-N 3.2Å; V642-T647 HydrophobicContact CG1-CG2 4.13Å; V642-F650 HydrophobicContact CG1-CB 4.4Å; V642-F650 HydrophobicContact CG2-CB 3.78Å; V642-F650 HydrophobicContact CG2-CD1 4.46Å; V642-F650 HydrophobicContact CG2-CD2 4.48Å; V642-F650 HydrophobicContact CG2-CG 4Å
643H59.7Low82.6Confident119 Ų11967.7 Ų67.755%0.55133%0.333SS*.THydrogen-bonded Turntrans-64.8-12.5170.7-6883.8000112.9C639 E641C639-H643 PolarHBondContact O-ND1 3.41Å; C639-H643 VanDerWaalsContact O-ND1 3.14Å; E641-H643 PolarHBondContact O-N 2.94Å; E641-H643 VanDerWaalsContact O-N 3.1Å
644R53.8Low82.6Confident231 Ų23162.5 Ų62.587%0.87231%0.309SS*.THydrogen-bonded Turntrans-103.1-33174.1-75-179.272.1132.6-2.6114.7E641 V642E641-R644 WeakPolarHBondContact O-CB 3.43Å; E641-R644 PolarHBondContact O-N 3.13Å; V642-R644 PolarHBondContact O-N 2.86Å; V642-R644 VanDerWaalsContact O-N 3.16Å
645Q53.4Low82.6Confident155 Ų15563.9 Ų63.972%0.72432%0.319SS*.SBendtrans-155.1149.7179.4-67-171.8-11.200113.6V642V642-Q645 WeakPolarHBondContact CA-O 3.48Å; V642-Q645 PolarHBondContact O-N 3.2Å
646N61.2Low82.7Confident115 Ų11565.4 Ų65.462%0.61533%0.328SS*.  trans57.552.8167.1-70.2-12.3000119.4Q648N646-Q648 VanDerWaalsContact C-N 3.3Å; N646-Q648 PolarHBondContact O-N 2.82Å
647T76.2Confident82.8Confident86 Ų8664.6 Ų64.653%0.52832%0.322SS..Hα-helixtrans-56.6-33177.5-42.20000115.6V642 V651V642-T647 HydrophobicContact CG1-CG2 4.13Å; T647-V651 HydrophobicContact CG2-CG2 4.22Å; T647-V651 VanDerWaalsContact O-CG2 3.23Å; T647-V651 WeakPolarHBondContact O-CG2 3.49Å; T647-V651 PolarHBondContact O-N 3.03Å
648Q84.6Confident83Confident139 Ų13961.6 Ų61.665%0.6531%0.308SS*.Hα-helixtrans-69.3-42.2-172.2-168.36620.500113.2N646 F650 V651 T652N646-Q648 VanDerWaalsContact C-N 3.3Å; N646-Q648 PolarHBondContact O-N 2.82Å; Q648-F650 PolarHBondContact O-N 2.94Å; Q648-V651 PolarHBondContact O-N 3.36Å; Q648-T652 PolarHBondContact O-N 3.38Å; Q648-T652 PolarHBondContact O-OG1 3.3Å; Q648-T652 VanDerWaalsContact O-OG1 3.12Å
649Q88.8Confident83.2Confident73 Ų7365 Ų6534%0.34133%0.327SS..Hα-helixtrans-65.7-42.3-176.7-172.9178.211.100111.3E588 T652 L653E588-Q649 PolarHBondContact OE1-NE2 3.41Å; Q649-T652 PolarHBondContact O-N 2.89Å; Q649-L653 WeakPolarHBondContact O-CB 3.32Å; Q649-L653 PolarHBondContact O-N 3.19Å
650F90.6Very high83.5Confident2 Ų264.5 Ų64.51%0.00932%0.323CS..Hα-helixtrans-64.3-43.7176.2-177.2-104.9000112.4L635 Y638 C639 V642 Q648 T652 L653 I654 V688 P690 F692L635-F650 HydrophobicContact CD2-CE2 4.16Å; Y638-F650 AromaticContact CD1-CD2 3.46Å; Y638-F650 HydrophobicContact CD1-CD2 3.46Å; Y638-F650 VanDerWaalsContact CD1-CD2 3.46Å; Y638-F650 HydrophobicContact CD1-CE2 4.06Å; Y638-F650 HydrophobicContact CD1-CG 4.43Å; Y638-F650 HydrophobicContact CE1-CB 4.05Å; Y638-F650 AromaticContact CE1-CD2 3.69Å; Y638-F650 HydrophobicContact CE1-CD2 3.69Å; Y638-F650 HydrophobicContact CE1-CG 4.35Å; Y638-F650 AromaticContact CG-CD2 4Å; Y638-F650 HydrophobicContact CG-CD2 4Å; Y638-F650 HydrophobicContact CG-CE2 4.42Å; C639-F650 HydrophobicContact CB-CE1 3.84Å; C639-F650 HydrophobicContact CB-CE2 4.21Å; C639-F650 HydrophobicContact CB-CZ 3.5Å; C639-F650 VanDerWaalsContact CB-CZ 3.5Å; V642-F650 HydrophobicContact CG1-CB 4.4Å; V642-F650 HydrophobicContact CG2-CB 3.78Å; V642-F650 HydrophobicContact CG2-CD1 4.46Å; V642-F650 HydrophobicContact CG2-CD2 4.48Å; V642-F650 HydrophobicContact CG2-CG 4Å; Q648-F650 PolarHBondContact O-N 2.94Å; F650-T652 VanDerWaalsContact C-N 3.31Å; F650-T652 PolarHBondContact O-N 3.26Å; F650-L653 PolarHBondContact O-N 3.1Å; F650-I654 HydrophobicContact CD1-CG1 4.38Å; F650-I654 HydrophobicContact CD2-CG1 4.42Å; F650-I654 HydrophobicContact CE1-CG1 3.92Å; F650-I654 HydrophobicContact CE2-CD1 4.11Å; F650-I654 HydrophobicContact CE2-CG1 3.99Å; F650-I654 HydrophobicContact CZ-CD1 3.99Å; F650-I654 HydrophobicContact CZ-CG1 3.7Å; F650-I654 WeakPolarHBondContact O-CG1 3.41Å; F650-I654 PolarHBondContact O-N 3.19Å; F650-V688 HydrophobicContact CZ-CG1 3.87Å; F650-P690 HydrophobicContact CE1-CB 4.27Å; F650-F692 HydrophobicContact CD1-CE1 4.23Å; F650-F692 HydrophobicContact CD1-CZ 4.09Å; F650-F692 HydrophobicContact CE1-CE1 4.23Å; F650-F692 HydrophobicContact CE1-CZ 4.07Å
651V91.4Very high84Confident35 Ų3562.2 Ų62.221%0.21231%0.307CS..Hα-helixtrans-59.4-43.6175.4171.80000110.9T647 Q648 S655 F692T647-V651 HydrophobicContact CG2-CG2 4.22Å; T647-V651 VanDerWaalsContact O-CG2 3.23Å; T647-V651 WeakPolarHBondContact O-CG2 3.49Å; T647-V651 PolarHBondContact O-N 3.03Å; Q648-V651 PolarHBondContact O-N 3.36Å; V651-S655 VanDerWaalsContact O-CB 3.26Å; V651-S655 WeakPolarHBondContact O-CB 3.42Å; V651-S655 PolarHBondContact O-N 3.17Å; V651-S655 PolarHBondContact O-OG 2.98Å; V651-F692 HydrophobicContact CB-CE2 4.37Å; V651-F692 HydrophobicContact CB-CZ 4.18Å; V651-F692 HydrophobicContact CG1-CD2 4.45Å; V651-F692 HydrophobicContact CG1-CE2 4.2Å; V651-F692 HydrophobicContact CG1-CZ 4.49Å; V651-F692 HydrophobicContact CG2-CD1 4.08Å; V651-F692 HydrophobicContact CG2-CE1 3.64Å; V651-F692 HydrophobicContact CG2-CE2 4.19Å; V651-F692 HydrophobicContact CG2-CZ 3.7Å
652T92.8Very high84.6Confident72 Ų7258.4 Ų58.444%0.44229%0.291SS..Hα-helixtrans-62-46.8176.5-62.60000111.1Q648 Q649 F650 I654 S655 T656Q648-T652 PolarHBondContact O-N 3.38Å; Q648-T652 PolarHBondContact O-OG1 3.3Å; Q648-T652 VanDerWaalsContact O-OG1 3.12Å; Q649-T652 PolarHBondContact O-N 2.89Å; F650-T652 VanDerWaalsContact C-N 3.31Å; F650-T652 PolarHBondContact O-N 3.26Å; T652-I654 PolarHBondContact O-N 3.11Å; T652-S655 PolarHBondContact O-N 3.39Å; T652-T656 WeakPolarHBondContact O-CB 3.32Å; T652-T656 PolarHBondContact O-N 2.9Å; T652-T656 PolarHBondContact O-OG1 3.03Å
653L94.8Very high85.7Confident15 Ų1560.6 Ų60.68%0.07931%0.306CS..Hα-helixtrans-58-49.6-179.4-170.771.9000112.3V587 E588 V591 L635 Q649 F650 T657V587-L653 HydrophobicContact CG1-CD1 4.24Å; V587-L653 HydrophobicContact CG1-CD2 3.83Å; V587-L653 HydrophobicContact CG1-CG 4.41Å; E588-L653 HydrophobicContact CG-CD1 4.28Å; V591-L653 HydrophobicContact CB-CD1 4.1Å; V591-L653 HydrophobicContact CG1-CD1 4.33Å; V591-L653 HydrophobicContact CG2-CD1 3.67Å; V591-L653 HydrophobicContact CG2-CG 4.26Å; L635-L653 HydrophobicContact CD2-CD2 3.73Å; Q649-L653 WeakPolarHBondContact O-CB 3.32Å; Q649-L653 PolarHBondContact O-N 3.19Å; F650-L653 PolarHBondContact O-N 3.1Å; L653-T657 WeakPolarHBondContact O-CB 3.49Å; L653-T657 PolarHBondContact O-N 3.06Å; L653-T657 PolarHBondContact O-OG1 3.22Å
654I95.4Very high87.4Confident0 Ų055 Ų550%028%0.279CS..Hα-helixtrans-66.9-41.7178-61.6-60.5000111.2L635 F650 T652 T656 T657 M658 L684 P690 F692 L693 I696L635-I654 HydrophobicContact CD1-CD1 4.42Å; L635-I654 HydrophobicContact CD2-CD1 4.41Å; F650-I654 HydrophobicContact CD1-CG1 4.38Å; F650-I654 HydrophobicContact CD2-CG1 4.42Å; F650-I654 HydrophobicContact CE1-CG1 3.92Å; F650-I654 HydrophobicContact CE2-CD1 4.11Å; F650-I654 HydrophobicContact CE2-CG1 3.99Å; F650-I654 HydrophobicContact CZ-CD1 3.99Å; F650-I654 HydrophobicContact CZ-CG1 3.7Å; F650-I654 WeakPolarHBondContact O-CG1 3.41Å; F650-I654 PolarHBondContact O-N 3.19Å; T652-I654 PolarHBondContact O-N 3.11Å; I654-T656 PolarHBondContact O-N 3.29Å; I654-T657 WeakPolarHBondContact O-CB 3.12Å; I654-T657 PolarHBondContact O-N 3.04Å; I654-M658 WeakPolarHBondContact O-CG 3.39Å; I654-M658 PolarHBondContact O-N 3.41Å; I654-L684 HydrophobicContact CD1-CD2 4.03Å; I654-P690 HydrophobicContact CG2-CG 4.13Å; I654-F692 HydrophobicContact CB-CE2 4.11Å; I654-F692 HydrophobicContact CB-CZ 4.23Å; I654-F692 HydrophobicContact CG1-CZ 4.41Å; I654-F692 HydrophobicContact CG2-CE2 4.04Å; I654-F692 HydrophobicContact CG2-CZ 4.44Å; I654-L693 HydrophobicContact CG2-CD1 4.26Å; I654-I696 HydrophobicContact CG2-CD1 3.99Å
655S95.3Very high89.3Confident30 Ų3044 Ų4421%0.2124%0.238CC..Hα-helixtrans-62.8-44.1177.9-58.20000111.8V651 T652 T657 M658 D659V651-S655 VanDerWaalsContact O-CB 3.26Å; V651-S655 WeakPolarHBondContact O-CB 3.42Å; V651-S655 PolarHBondContact O-N 3.17Å; V651-S655 PolarHBondContact O-OG 2.98Å; T652-S655 PolarHBondContact O-N 3.39Å; S655-T657 VanDerWaalsContact C-N 3.34Å; S655-T657 PolarHBondContact O-N 3.17Å; S655-M658 WeakPolarHBondContact O-CB 3.31Å; S655-M658 PolarHBondContact O-N 3.43Å; S655-D659 PolarHBondContact O-N 3.03Å
656T96.3Very high91Very high35 Ų3537.7 Ų37.722%0.21521%0.211CC..Hα-helixtrans-64.8-38.8176.4-58.50000111.8V591 L595 T652 I654 M658 D659 A660V591-T656 HydrophobicContact CG1-CG2 3.56Å; L595-T656 HydrophobicContact CB-CG2 4.34Å; L595-T656 HydrophobicContact CD1-CG2 4.22Å; L595-T656 HydrophobicContact CD2-CG2 3.56Å; L595-T656 HydrophobicContact CG-CG2 4.24Å; T652-T656 WeakPolarHBondContact O-CB 3.32Å; T652-T656 PolarHBondContact O-N 2.9Å; T652-T656 PolarHBondContact O-OG1 3.03Å; I654-T656 PolarHBondContact O-N 3.29Å; T656-M658 VanDerWaalsContact C-N 3.31Å; T656-M658 PolarHBondContact O-N 3.47Å; T656-D659 PolarHBondContact O-N 2.86Å; T656-A660 PolarHBondContact O-N 3.36Å
657T96.7Very high92.2Very high2 Ų234.9 Ų34.91%0.01220%0.198CC..Hα-helixtrans-59-45172.8-58.40000110.8V591 L628 L653 I654 S655 A660 I661 L680 L684V591-T657 WeakPolarHBondContact CG2-OG1 3.36Å; L628-T657 HydrophobicContact CD2-CG2 3.75Å; L653-T657 WeakPolarHBondContact O-CB 3.49Å; L653-T657 PolarHBondContact O-N 3.06Å; L653-T657 PolarHBondContact O-OG1 3.22Å; I654-T657 WeakPolarHBondContact O-CB 3.12Å; I654-T657 PolarHBondContact O-N 3.04Å; S655-T657 VanDerWaalsContact C-N 3.34Å; S655-T657 PolarHBondContact O-N 3.17Å; T657-A660 WeakPolarHBondContact O-CB 3.25Å; T657-A660 PolarHBondContact O-N 3.42Å; T657-I661 HydrophobicContact CG2-CD1 3.8Å; T657-I661 VanDerWaalsContact O-CG1 3.3Å; T657-I661 WeakPolarHBondContact O-CG1 3.36Å; T657-I661 PolarHBondContact O-N 3.44Å; T657-I661 VanDerWaalsContact O-N 3.08Å; T657-L680 HydrophobicContact CG2-CD2 4.01Å; T657-L684 HydrophobicContact CG2-CD1 3.96Å
658M96Very high92.7Very high0 Ų039.2 Ų39.20%021%0.21CC..Hα-helixtrans-65.3-39.8177-71.6-53.8-39.600112.9I654 S655 T656 A660 I661 T662 L681 L684 L693 I696 A698 V699I654-M658 WeakPolarHBondContact O-CG 3.39Å; I654-M658 PolarHBondContact O-N 3.41Å; S655-M658 WeakPolarHBondContact O-CB 3.31Å; S655-M658 PolarHBondContact O-N 3.43Å; T656-M658 VanDerWaalsContact C-N 3.31Å; T656-M658 PolarHBondContact O-N 3.47Å; M658-A660 PolarHBondContact O-N 3.34Å; M658-I661 PolarHBondContact O-N 3.47Å; M658-I661 HydrophobicContact SD-CD1 4.41Å; M658-T662 WeakPolarHBondContact O-CB 3.41Å; M658-T662 PolarHBondContact O-N 3.11Å; M658-T662 PolarHBondContact O-OG1 3.4Å; M658-T662 VanDerWaalsContact O-OG1 3.11Å; M658-L681 HydrophobicContact CE-CD1 3.71Å; M658-L681 HydrophobicContact SD-CD1 3.81Å; M658-L684 HydrophobicContact SD-CD1 3.98Å; M658-L693 HydrophobicContact CG-CD1 4.08Å; M658-L693 HydrophobicContact SD-CD1 4.06Å; M658-I696 HydrophobicContact CB-CG2 4.07Å; M658-I696 HydrophobicContact CG-CD1 4.03Å; M658-I696 HydrophobicContact CG-CG2 4.44Å; M658-A698 HydrophobicContact CB-CB 3.96Å; M658-V699 HydrophobicContact CE-CG2 3.45Å; M658-V699 VanDerWaalsContact CE-CG2 3.45Å; M658-V699 HydrophobicContact CG-CG2 4.01Å; M658-V699 HydrophobicContact SD-CG2 3.93Å
659D95.4Very high93Very high83 Ų8333.1 Ų33.144%0.44418%0.182SC..Hα-helixtrans-61.9-29.6174.2-72.8-33.1000112.4L595 S655 T656 P663L595-D659 HydrophobicContact CD1-CB 4.14Å; S655-D659 PolarHBondContact O-N 3.03Å; T656-D659 PolarHBondContact O-N 2.86Å; D659-P663 WeakPolarHBondContact O-CD 3.49Å; D659-P663 WeakPolarHBondContact O-CG 3.37Å
660A95.3Very high93.1Very high0 Ų033.8 Ų33.80%019%0.185CC..Hα-helixtrans-76-37.7174.800000113T594 L595 S598 T656 T657 M658T594-A660 HydrophobicContact CG2-CB 3.89Å; L595-A660 HydrophobicContact CB-CB 4.11Å; L595-A660 HydrophobicContact CD1-CB 3.95Å; S598-A660 VanDerWaalsContact CB-O 3.25Å; S598-A660 WeakPolarHBondContact CB-O 3.31Å; S598-A660 PolarHBondContact OG-O 2.9Å; T656-A660 PolarHBondContact O-N 3.36Å; T657-A660 WeakPolarHBondContact O-CB 3.25Å; T657-A660 PolarHBondContact O-N 3.42Å; M658-A660 PolarHBondContact O-N 3.34Å
661I95.4Very high93Very high0 Ų037.8 Ų37.80%021%0.207CC..Hα-helixtrans-78.4-42.3-176.4-65.6165.7000112L625 T657 M658 P663 L664 I665 A677 L680 L681 L684L625-I661 HydrophobicContact CD2-CG1 4.27Å; T657-I661 HydrophobicContact CG2-CD1 3.8Å; T657-I661 VanDerWaalsContact O-CG1 3.3Å; T657-I661 WeakPolarHBondContact O-CG1 3.36Å; T657-I661 PolarHBondContact O-N 3.44Å; T657-I661 VanDerWaalsContact O-N 3.08Å; M658-I661 PolarHBondContact O-N 3.47Å; M658-I661 HydrophobicContact SD-CD1 4.41Å; I661-P663 VanDerWaalsContact C-CD 3.5Å; I661-L664 WeakPolarHBondContact O-CB 3.37Å; I661-L664 PolarHBondContact O-N 2.8Å; I661-I665 HydrophobicContact CG2-CD1 3.81Å; I661-I665 HydrophobicContact CG2-CG1 4.26Å; I661-I665 PolarHBondContact O-N 3.4Å; I661-A677 HydrophobicContact CG2-CB 4.01Å; I661-A677 WeakPolarHBondContact CG2-O 3.16Å; I661-L680 HydrophobicContact CD1-CB 4.17Å; I661-L680 HydrophobicContact CD1-CD2 3.5Å; I661-L680 HydrophobicContact CD1-CG 3.58Å; I661-L680 HydrophobicContact CG1-CD2 3.93Å; I661-L680 HydrophobicContact CG1-CG 4.44Å; I661-L681 HydrophobicContact CG2-CB 4.4Å; I661-L684 HydrophobicContact CD1-CD1 4.25Å
662T94.1Very high93Very high24 Ų2441 Ų4115%0.14722%0.218CC..G310 helixtrans-55.5-41.3-171.8-69.10000114.6M658 L664 I665 A698 K701 V702M658-T662 WeakPolarHBondContact O-CB 3.41Å; M658-T662 PolarHBondContact O-N 3.11Å; M658-T662 PolarHBondContact O-OG1 3.4Å; M658-T662 VanDerWaalsContact O-OG1 3.11Å; T662-L664 PolarHBondContact O-N 3.37Å; T662-I665 PolarHBondContact O-N 2.82Å; T662-A698 WeakPolarHBondContact OG1-CB 3.38Å; T662-A698 PolarHBondContact OG1-O 3.15Å; T662-A698 VanDerWaalsContact OG1-O 3.08Å; T662-K701 HydrophobicContact CG2-CB 4.27Å; T662-V702 HydrophobicContact CG2-CG2 3.93Å
663P93.5Very high93.1Very high57 Ų5737.5 Ų37.537%0.3720%0.197SC..G310 helixtrans-63.6-26175.5-22.934.4000114.3D659 I661D659-P663 WeakPolarHBondContact O-CD 3.49Å; D659-P663 WeakPolarHBondContact O-CG 3.37Å; I661-P663 VanDerWaalsContact C-CD 3.5Å
664L94.1Very high93.1Very high0 Ų037 Ų370%019%0.194CC..G310 helixtrans-80.6-24.3-177.6-57.6179.8000112.7S598 Y603 L625 I661 T662 S666 V669 L674 A677S598-L664 WeakPolarHBondContact OG-CD1 3.1Å; S598-L664 WeakPolarHBondContact OG-CG 3.45Å; Y603-L664 HydrophobicContact CE1-CD2 3.68Å; L625-L664 HydrophobicContact CD1-CD1 3.67Å; L625-L664 HydrophobicContact CD2-CD1 4.35Å; I661-L664 WeakPolarHBondContact O-CB 3.37Å; I661-L664 PolarHBondContact O-N 2.8Å; T662-L664 PolarHBondContact O-N 3.37Å; L664-S666 PolarHBondContact O-N 3.05Å; L664-V669 HydrophobicContact CD2-CG1 4.44Å; L664-L674 WeakPolarHBondContact O-CD1 3.43Å; L664-A677 HydrophobicContact CB-CB 3.77Å; L664-A677 HydrophobicContact CD1-CB 4Å
665I93.6Very high93.1Very high1 Ų139.2 Ų39.21%0.00521%0.205CC..SBendtrans-7675.6175.8-58.1167.6000108.8I661 T662 L674 L681 V702 R705 L714 V722I661-I665 HydrophobicContact CG2-CD1 3.81Å; I661-I665 HydrophobicContact CG2-CG1 4.26Å; I661-I665 PolarHBondContact O-N 3.4Å; T662-I665 PolarHBondContact O-N 2.82Å; I665-L674 HydrophobicContact CG2-CD1 4.49Å; I665-L681 HydrophobicContact CD1-CD2 3.82Å; I665-V702 HydrophobicContact CD1-CG1 4.1Å; I665-V702 HydrophobicContact CD1-CG2 3.89Å; I665-V702 HydrophobicContact CG2-CG1 4.47Å; I665-R705 PolarHBondContact O-NH1 2.92Å; I665-L714 HydrophobicContact CG2-CD1 3.7Å; I665-V722 HydrophobicContact CD1-CG2 4.5Å; I665-V722 HydrophobicContact CG2-CG2 3.95Å
666S90.5Very high93.1Very high22 Ų2238.7 Ų38.715%0.15420%0.202CC..SBendtrans-154.9146.9-177.2-164.50000113.8L664 K668 V669 R705L664-S666 PolarHBondContact O-N 3.05Å; S666-K668 PolarHBondContact O-N 3.39Å; S666-V669 PolarHBondContact O-N 2.86Å; S666-V669 VanDerWaalsContact O-N 3.16Å; S666-R705 VanDerWaalsContact CA-NH1 3.31Å; S666-R705 VanDerWaalsContact CB-NH1 3.31Å; S666-R705 PolarHBondContact OG-NH1 3.23Å; S666-R705 VanDerWaalsContact OG-NH1 3.16Å; S666-R705 PolarHBondContact OG-NH2 2.98Å
667T86.4Confident93.1Very high56 Ų5637 Ų3734%0.34419%0.192SC..THydrogen-bonded Turntrans-63-11.8176.454.40000114.6Q712 R713 L714T667-Q712 HydrophobicContact CG2-CB 4.04Å; T667-Q712 PolarHBondContact OG1-OE1 3.03Å; T667-R713 WeakPolarHBondContact CG2-O 3.47Å; T667-L714 HydrophobicContact CG2-CD2 4.06Å
668K86.7Confident93.1Very high177 Ų17737 Ų3777%0.7719%0.191SC*.THydrogen-bonded Turntrans-92.9-0.6179.1-61.1-175.3179-177.70113.7S666S666-K668 PolarHBondContact O-N 3.39Å
669V90Very high93.2Very high12 Ų1240.6 Ų40.67%0.07321%0.208CC..SBendtrans-105.8145.7-177.3179.10000108.1Y603 L664 S666 L673Y603-V669 HydrophobicContact CE2-CG1 4.39Å; Y603-V669 HydrophobicContact CE2-CG2 4.11Å; L664-V669 HydrophobicContact CD2-CG1 4.44Å; S666-V669 PolarHBondContact O-N 2.86Å; S666-V669 VanDerWaalsContact O-N 3.16Å; V669-L673 HydrophobicContact CG1-CB 3.75Å; V669-L673 HydrophobicContact CG1-CD1 4.37Å
670Q89.9Confident93.3Very high86 Ų8636.7 Ų36.740%0.40219%0.187SC..  trans-65.8148.2177.8-68.3-173-11.500112.2K672 L673 L674Q670-K672 VanDerWaalsContact C-N 3.33Å; Q670-K672 PolarHBondContact O-N 3.47Å; Q670-L673 PolarHBondContact O-N 3.46Å; Q670-L673 VanDerWaalsContact O-N 3.13Å; Q670-L674 PolarHBondContact O-N 3.35Å
671D90.3Very high93.4Very high87 Ų8736.8 Ų36.847%0.46519%0.188SC..Hα-helixtrans-56.2-41.5-172.3-68-3.3000113.5L673 L674 L675D671-L673 VanDerWaalsContact C-N 3.33Å; D671-L673 PolarHBondContact O-N 2.69Å; D671-L674 PolarHBondContact O-N 2.84Å; D671-L675 WeakPolarHBondContact O-CB 3.37Å; D671-L675 VanDerWaalsContact O-CG 3.23Å; D671-L675 WeakPolarHBondContact O-CG 3.21Å; D671-L675 PolarHBondContact O-N 2.91Å
672K90.8Very high93.4Very high101 Ų10137.4 Ų37.444%0.43919%0.192SC..Hα-helixtrans-56.9-44.6178.9-175.3171.3177.8173.10112.4D619 A622 Q670 S676D619-K672 WeakPolarHBondContact OD1-CE 3.5Å; D619-K672 IonicContact OD1-NZ 2.64Å; D619-K672 PolarHBondContact OD1-NZ 3.21Å; A622-K672 HydrophobicContact CB-CD 4.4Å; A622-K672 HydrophobicContact CB-CG 4.03Å; Q670-K672 VanDerWaalsContact C-N 3.33Å; Q670-K672 PolarHBondContact O-N 3.47Å; K672-S676 WeakPolarHBondContact O-CB 3.2Å; K672-S676 PolarHBondContact O-N 3.09Å; K672-S676 VanDerWaalsContact O-N 3.12Å; K672-S676 PolarHBondContact O-OG 3.38Å
673L94.1Very high93.6Very high0 Ų036.9 Ų36.90%019%0.188CC..Hα-helixtrans-74-42.3178.2-73.9170.2000112Y603 I618 H621 A622 L625 V669 Q670 D671 L675 S676 A677Y603-L673 HydrophobicContact CD1-CD1 4.12Å; Y603-L673 HydrophobicContact CD2-CD1 4.19Å; Y603-L673 HydrophobicContact CG-CD1 3.71Å; I618-L673 HydrophobicContact CB-CD1 4.5Å; I618-L673 HydrophobicContact CG1-CD1 4.32Å; I618-L673 HydrophobicContact CG2-CD1 4.08Å; I618-L673 HydrophobicContact CG2-CG 4.02Å; H621-L673 HydrophobicContact CB-CD2 3.76Å; A622-L673 HydrophobicContact CB-CD2 3.96Å; L625-L673 HydrophobicContact CD1-CD2 4.38Å; V669-L673 HydrophobicContact CG1-CB 3.75Å; V669-L673 HydrophobicContact CG1-CD1 4.37Å; Q670-L673 PolarHBondContact O-N 3.46Å; Q670-L673 VanDerWaalsContact O-N 3.13Å; D671-L673 VanDerWaalsContact C-N 3.33Å; D671-L673 PolarHBondContact O-N 2.69Å; L673-L675 VanDerWaalsContact C-N 3.34Å; L673-L675 PolarHBondContact O-N 3.31Å; L673-S676 PolarHBondContact O-N 3.17Å; L673-A677 VanDerWaalsContact O-CB 3.32Å; L673-A677 WeakPolarHBondContact O-CB 3.28Å; L673-A677 PolarHBondContact O-N 2.93Å
674L95.1Very high93.7Very high3 Ų334.1 Ų34.12%0.01617%0.171CC..Hα-helixtrans-57.1-49.1176.7173.960.2000110.5L664 I665 Q670 D671 A677 C678 A718L664-L674 WeakPolarHBondContact O-CD1 3.43Å; I665-L674 HydrophobicContact CG2-CD1 4.49Å; Q670-L674 PolarHBondContact O-N 3.35Å; D671-L674 PolarHBondContact O-N 2.84Å; L674-A677 PolarHBondContact O-N 2.92Å; L674-C678 PolarHBondContact O-N 3.17Å; L674-C678 PolarHBondContact O-SG 3.37Å; L674-A718 HydrophobicContact CD1-CB 4.26Å; L674-A718 HydrophobicContact CD2-CB 3.6Å; L674-A718 HydrophobicContact CG-CB 3.69Å
675L95.3Very high93.8Very high47 Ų4734.2 Ų34.225%0.24617%0.171CC..Hα-helixtrans-64.6-44.9179.1-68.3173.6000111.8D671 L673 A677 C678 H679 K717 A718 L721D671-L675 WeakPolarHBondContact O-CB 3.37Å; D671-L675 VanDerWaalsContact O-CG 3.23Å; D671-L675 WeakPolarHBondContact O-CG 3.21Å; D671-L675 PolarHBondContact O-N 2.91Å; L673-L675 VanDerWaalsContact C-N 3.34Å; L673-L675 PolarHBondContact O-N 3.31Å; L675-A677 VanDerWaalsContact C-N 3.3Å; L675-A677 PolarHBondContact O-N 2.91Å; L675-C678 WeakPolarHBondContact O-CB 3.36Å; L675-C678 PolarHBondContact O-N 3.45Å; L675-C678 VanDerWaalsContact O-N 3.1Å; L675-H679 PolarHBondContact O-CD2 3.33Å; L675-H679 PolarHBondContact O-N 3.33Å; L675-K717 HydrophobicContact CD2-CB 4Å; L675-A718 HydrophobicContact CD2-CB 4.12Å; L675-L721 HydrophobicContact CD2-CD1 4.04Å
676S95.4Very high93.9Very high20 Ų2035.9 Ų35.914%0.1418%0.182CC..Hα-helixtrans-58.3-42.8177.1-570000111.9K672 L673 H679 L680K672-S676 WeakPolarHBondContact O-CB 3.2Å; K672-S676 PolarHBondContact O-N 3.09Å; K672-S676 VanDerWaalsContact O-N 3.12Å; K672-S676 PolarHBondContact O-OG 3.38Å; L673-S676 PolarHBondContact O-N 3.17Å; S676-H679 PolarHBondContact O-N 3.5Å; S676-L680 PolarHBondContact O-N 3.09Å; S676-L680 VanDerWaalsContact O-N 3.11Å
677A96.8Very high94.1Very high0 Ų036.4 Ų36.40%018%0.184CC..Hα-helixtrans-64-41.2175.100000112.2L625 I661 L664 L673 L674 L675 L681L625-A677 HydrophobicContact CD1-CB 4.41Å; I661-A677 HydrophobicContact CG2-CB 4.01Å; I661-A677 WeakPolarHBondContact CG2-O 3.16Å; L664-A677 HydrophobicContact CB-CB 3.77Å; L664-A677 HydrophobicContact CD1-CB 4Å; L673-A677 VanDerWaalsContact O-CB 3.32Å; L673-A677 WeakPolarHBondContact O-CB 3.28Å; L673-A677 PolarHBondContact O-N 2.93Å; L674-A677 PolarHBondContact O-N 2.92Å; L675-A677 VanDerWaalsContact C-N 3.3Å; L675-A677 PolarHBondContact O-N 2.91Å; A677-L681 PolarHBondContact O-N 3.25Å; A677-L681 VanDerWaalsContact O-N 3.07Å
678C96.9Very high94.5Very high0 Ų033.8 Ų33.80%017%0.168CC..Hα-helixtrans-65.6-43176.6-64.50000112.2L674 L675 L681 V682 L721 V722L674-C678 PolarHBondContact O-N 3.17Å; L674-C678 PolarHBondContact O-SG 3.37Å; L675-C678 WeakPolarHBondContact O-CB 3.36Å; L675-C678 PolarHBondContact O-N 3.45Å; L675-C678 VanDerWaalsContact O-N 3.1Å; C678-L681 WeakPolarHBondContact O-CB 3.44Å; C678-L681 PolarHBondContact O-N 3Å; C678-V682 WeakPolarHBondContact O-CG2 3.49Å; C678-V682 PolarHBondContact O-N 3.15Å; C678-L721 HydrophobicContact CB-CB 3.78Å; C678-L721 HydrophobicContact CB-CD1 4.01Å; C678-V722 HydrophobicContact CB-CG2 4.33Å; C678-V722 WeakPolarHBondContact SG-CG2 3.28Å
679H97Very high94.8Very high76 Ų7628.5 Ų28.535%0.35214%0.143SC..Hα-helixtrans-64.4-39.2178.2-76.4-64.7000112.9L675 S676 V682 S683L675-H679 PolarHBondContact O-CD2 3.33Å; L675-H679 PolarHBondContact O-N 3.33Å; S676-H679 PolarHBondContact O-N 3.5Å; H679-V682 PolarHBondContact O-N 3.35Å; H679-S683 WeakPolarHBondContact O-CB 3.15Å; H679-S683 PolarHBondContact O-N 2.88Å; H679-S683 PolarHBondContact O-OG 3.23Å
680L97.3Very high94.8Very high2 Ų228 Ų281%0.0114%0.14CC..Hα-helixtrans-63.3-44.7172.4178.356.6000111.3L625 L628 Q629 T657 I661 S676 V682 S683 L684L625-L680 HydrophobicContact CD2-CD2 3.81Å; L628-L680 HydrophobicContact CB-CD2 4.36Å; L628-L680 HydrophobicContact CD2-CD2 3.84Å; L628-L680 HydrophobicContact CG-CD1 4.21Å; L628-L680 HydrophobicContact CG-CD2 4.14Å; Q629-L680 HydrophobicContact CB-CB 4.38Å; Q629-L680 HydrophobicContact CB-CD1 3.95Å; T657-L680 HydrophobicContact CG2-CD2 4.01Å; I661-L680 HydrophobicContact CD1-CB 4.17Å; I661-L680 HydrophobicContact CD1-CD2 3.5Å; I661-L680 HydrophobicContact CD1-CG 3.58Å; I661-L680 HydrophobicContact CG1-CD2 3.93Å; I661-L680 HydrophobicContact CG1-CG 4.44Å; S676-L680 PolarHBondContact O-N 3.09Å; S676-L680 VanDerWaalsContact O-N 3.11Å; L680-V682 VanDerWaalsContact C-N 3.35Å; L680-V682 PolarHBondContact O-N 2.89Å; L680-S683 PolarHBondContact O-N 3.23Å; L680-L684 HydrophobicContact CD1-CG 4.38Å; L680-L684 WeakPolarHBondContact O-CG 3.45Å; L680-L684 PolarHBondContact O-N 3.43Å
681L97.3Very high94.8Very high2 Ų226.3 Ų26.31%0.0114%0.135CC..Hα-helixtrans-60.1-43.3175.6-179.557.4000112.2M658 I661 I665 A677 C678 S683 L684 A685 A725M658-L681 HydrophobicContact CE-CD1 3.71Å; M658-L681 HydrophobicContact SD-CD1 3.81Å; I661-L681 HydrophobicContact CG2-CB 4.4Å; I665-L681 HydrophobicContact CD1-CD2 3.82Å; A677-L681 PolarHBondContact O-N 3.25Å; A677-L681 VanDerWaalsContact O-N 3.07Å; C678-L681 WeakPolarHBondContact O-CB 3.44Å; C678-L681 PolarHBondContact O-N 3Å; L681-S683 VanDerWaalsContact C-N 3.35Å; L681-S683 PolarHBondContact O-N 2.95Å; L681-L684 PolarHBondContact O-N 2.9Å; L681-A685 WeakPolarHBondContact O-CB 3.39Å; L681-A685 PolarHBondContact O-N 3.41Å; L681-A725 HydrophobicContact CB-CB 4.49Å; L681-A725 HydrophobicContact CD2-CB 4.14Å; L681-A725 HydrophobicContact CG-CB 3.72Å
682V97.2Very high94.9Very high13 Ų1324.7 Ų24.78%0.07912%0.124CC..Hα-helixtrans-58.7-47.4174170.50000110.2C678 H679 L680 L684 A685 T686 L721 A725C678-V682 WeakPolarHBondContact O-CG2 3.49Å; C678-V682 PolarHBondContact O-N 3.15Å; H679-V682 PolarHBondContact O-N 3.35Å; L680-V682 VanDerWaalsContact C-N 3.35Å; L680-V682 PolarHBondContact O-N 2.89Å; V682-L684 VanDerWaalsContact C-N 3.33Å; V682-L684 PolarHBondContact O-N 3.37Å; V682-A685 CarbonylContact O-C 3.59Å; V682-A685 WeakPolarHBondContact O-CA 3.44Å; V682-A685 WeakPolarHBondContact O-CB 3.38Å; V682-A685 PolarHBondContact O-N 3Å; V682-T686 HydrophobicContact CG1-CG2 4Å; V682-T686 WeakPolarHBondContact O-CG2 3.32Å; V682-T686 PolarHBondContact O-N 3.36Å; V682-T686 PolarHBondContact O-OG1 3.27Å; V682-L721 HydrophobicContact CG2-CB 4.22Å; V682-L721 HydrophobicContact CG2-CD2 4.26Å; V682-L721 VanDerWaalsContact CG2-O 3.22Å; V682-L721 WeakPolarHBondContact CG2-O 3.2Å; V682-A725 HydrophobicContact CB-CB 4.47Å; V682-A725 HydrophobicContact CG2-CB 3.86Å
683S97.1Very high95Very high12 Ų1220 Ų208%0.08410%0.104CC..Hα-helixtrans-63.6-36.6-178.5-56.70000112.8Q629 H679 L680 L681 T687 V688Q629-S683 WeakPolarHBondContact CG-OG 3.44Å; Q629-S683 PolarHBondContact NE2-OG 2.92Å; H679-S683 WeakPolarHBondContact O-CB 3.15Å; H679-S683 PolarHBondContact O-N 2.88Å; H679-S683 PolarHBondContact O-OG 3.23Å; L680-S683 PolarHBondContact O-N 3.23Å; L681-S683 VanDerWaalsContact C-N 3.35Å; L681-S683 PolarHBondContact O-N 2.95Å; S683-T687 VanDerWaalsContact O-CB 3.23Å; S683-T687 WeakPolarHBondContact O-CB 3.24Å; S683-T687 PolarHBondContact O-N 2.98Å; S683-T687 PolarHBondContact O-OG1 3.12Å; S683-V688 PolarHBondContact O-N 2.95Å
684L96.7Very high94.8Very high0 Ų022 Ų220%011%0.114CC..Iπ-helixtrans-66-38.6171.9-67.4176.1000111.8L635 I654 T657 M658 I661 L680 L681 V682 V688 R689L635-L684 HydrophobicContact CD1-CD2 4.23Å; I654-L684 HydrophobicContact CD1-CD2 4.03Å; T657-L684 HydrophobicContact CG2-CD1 3.96Å; M658-L684 HydrophobicContact SD-CD1 3.98Å; I661-L684 HydrophobicContact CD1-CD1 4.25Å; L680-L684 HydrophobicContact CD1-CG 4.38Å; L680-L684 WeakPolarHBondContact O-CG 3.45Å; L680-L684 PolarHBondContact O-N 3.43Å; L681-L684 PolarHBondContact O-N 2.9Å; V682-L684 VanDerWaalsContact C-N 3.33Å; V682-L684 PolarHBondContact O-N 3.37Å; L684-V688 HydrophobicContact CD2-CB 4.36Å; L684-V688 HydrophobicContact CD2-CG2 3.88Å; L684-R689 PolarHBondContact O-N 3.33Å
685A95.8Very high94.6Very high1 Ų125.5 Ų25.51%0.00814%0.139CC..Iπ-helixtrans-75.1-32.5179.800000114L681 V682 R689 A725 N728 I729L681-A685 WeakPolarHBondContact O-CB 3.39Å; L681-A685 PolarHBondContact O-N 3.41Å; V682-A685 CarbonylContact O-C 3.59Å; V682-A685 WeakPolarHBondContact O-CA 3.44Å; V682-A685 WeakPolarHBondContact O-CB 3.38Å; V682-A685 PolarHBondContact O-N 3Å; A685-R689 VanDerWaalsContact O-CG 3.25Å; A685-R689 WeakPolarHBondContact O-CG 3.29Å; A685-A725 HydrophobicContact CB-CB 4.04Å; A685-A725 WeakPolarHBondContact CB-O 3.24Å; A685-N728 HydrophobicContact CB-CB 4.12Å; A685-I729 HydrophobicContact CB-CD1 4.26Å; A685-I729 HydrophobicContact CB-CG1 3.69Å
686T94.9Very high94.6Very high36 Ų3623.7 Ų23.722%0.22113%0.13CC..Iπ-helixtrans-91.1-47.4-178.651.80000112.7V682 R689 N728 L732V682-T686 HydrophobicContact CG1-CG2 4Å; V682-T686 WeakPolarHBondContact O-CG2 3.32Å; V682-T686 PolarHBondContact O-N 3.36Å; V682-T686 PolarHBondContact O-OG1 3.27Å; T686-R689 VanDerWaalsContact O-CD 3.31Å; T686-R689 WeakPolarHBondContact O-CD 3.49Å; T686-R689 WeakPolarHBondContact O-CG 3.48Å; T686-R689 PolarHBondContact O-NE 3.31Å; T686-N728 WeakPolarHBondContact CG2-ND2 3.27Å; T686-L732 HydrophobicContact CG2-CD1 4.41Å
687T94.9Very high94.6Very high34 Ų3426.7 Ų26.721%0.20915%0.149CC..Iπ-helixtrans-96.9-54.1-164.8-50.90000110.7H633 A636 S683H633-T687 WeakPolarHBondContact ND1-CG2 3.34Å; A636-T687 HydrophobicContact CB-CG2 4.22Å; S683-T687 VanDerWaalsContact O-CB 3.23Å; S683-T687 WeakPolarHBondContact O-CB 3.24Å; S683-T687 PolarHBondContact O-N 2.98Å; S683-T687 PolarHBondContact O-OG1 3.12Å
688V94.1Very high94.4Very high0 Ų026.8 Ų26.80%015%0.15CC..Iπ-helixtrans-75.5-46.3-175.5-173.20000112.1S632 L635 C639 F650 S683 L684 P690S632-V688 WeakPolarHBondContact O-CG2 3.43Å; L635-V688 HydrophobicContact CB-CG1 4.21Å; L635-V688 HydrophobicContact CB-CG2 3.65Å; L635-V688 HydrophobicContact CD1-CG2 4.48Å; C639-V688 HydrophobicContact CB-CG1 4.24Å; F650-V688 HydrophobicContact CZ-CG1 3.87Å; S683-V688 PolarHBondContact O-N 2.95Å; L684-V688 HydrophobicContact CD2-CB 4.36Å; L684-V688 HydrophobicContact CD2-CG2 3.88Å; V688-P690 HydrophobicContact CG1-CG 4.17Å
689R93.2Very high94.3Very high66 Ų6626.9 Ų26.925%0.24915%0.15CC..  trans49.452.6177.5-65.5-179.8-70.8177.6-13.8115.2L684 A685 T686 P733 P735L684-R689 PolarHBondContact O-N 3.33Å; A685-R689 VanDerWaalsContact O-CG 3.25Å; A685-R689 WeakPolarHBondContact O-CG 3.29Å; T686-R689 VanDerWaalsContact O-CD 3.31Å; T686-R689 WeakPolarHBondContact O-CD 3.49Å; T686-R689 WeakPolarHBondContact O-CG 3.48Å; T686-R689 PolarHBondContact O-NE 3.31Å; R689-P733 PolarHBondContact NH1-O 3.19Å; R689-P735 HydrophobicContact CB-CG 4.4Å
690P91.6Very high94.2Very high2 Ų227.5 Ų27.51%0.01315%0.153CC..  trans-68.5135.3176.918.3-13.2000111.5F650 I654 V688 F692 L693F650-P690 HydrophobicContact CE1-CB 4.27Å; I654-P690 HydrophobicContact CG2-CG 4.13Å; V688-P690 HydrophobicContact CG1-CG 4.17Å; P690-F692 VanDerWaalsContact C-N 3.26Å; P690-F692 HydrophobicContact CB-CD1 4.25Å; P690-F692 HydrophobicContact CB-CE1 3.76Å; P690-F692 HydrophobicContact CB-CE2 4.31Å; P690-F692 HydrophobicContact CB-CZ 3.79Å; P690-F692 PolarHBondContact O-N 3.49Å; P690-L693 HydrophobicContact CG-CB 4.01Å; P690-L693 HydrophobicContact CG-CD1 4.46Å; P690-L693 HydrophobicContact CG-CD2 4.29Å; P690-L693 HydrophobicContact CG-CG 4.49Å; P690-L693 WeakPolarHBondContact O-CB 2.98Å; P690-L693 PolarHBondContact O-N 3Å; P690-L693 VanDerWaalsContact O-N 3.09Å
691V89.9Confident94Very high50 Ų5034 Ų3430%0.30318%0.181SC..THydrogen-bonded Turntrans-57.4-38.3-175.7-179.30000112.6L693 W734 L737V691-L693 VanDerWaalsContact C-N 3.31Å; V691-L693 PolarHBondContact O-N 3.47Å; V691-W734 HydrophobicContact CB-CD2 4.27Å; V691-W734 HydrophobicContact CG1-CD2 4.03Å; V691-W734 HydrophobicContact CG1-CE3 3.88Å; V691-W734 HydrophobicContact CG1-CH2 3.89Å; V691-W734 HydrophobicContact CG1-CZ2 4.03Å; V691-W734 HydrophobicContact CG1-CZ3 3.81Å; V691-W734 HydrophobicContact CG2-CB 4.17Å; V691-W734 HydrophobicContact CG2-CD2 3.99Å; V691-W734 HydrophobicContact CG2-CE3 4.26Å; V691-W734 HydrophobicContact CG2-CG 3.95Å; V691-L737 HydrophobicContact CG2-CD1 3.55Å
692F90.8Very high93.8Very high53 Ų5334.1 Ų34.123%0.23218%0.182CC..THydrogen-bonded Turntrans-82.7-1.3-177.158.8-93000114.1F650 V651 I654 P690 I694 S695 I696F650-F692 HydrophobicContact CD1-CE1 4.23Å; F650-F692 HydrophobicContact CD1-CZ 4.09Å; F650-F692 HydrophobicContact CE1-CE1 4.23Å; F650-F692 HydrophobicContact CE1-CZ 4.07Å; V651-F692 HydrophobicContact CB-CE2 4.37Å; V651-F692 HydrophobicContact CB-CZ 4.18Å; V651-F692 HydrophobicContact CG1-CD2 4.45Å; V651-F692 HydrophobicContact CG1-CE2 4.2Å; V651-F692 HydrophobicContact CG1-CZ 4.49Å; V651-F692 HydrophobicContact CG2-CD1 4.08Å; V651-F692 HydrophobicContact CG2-CE1 3.64Å; V651-F692 HydrophobicContact CG2-CE2 4.19Å; V651-F692 HydrophobicContact CG2-CZ 3.7Å; I654-F692 HydrophobicContact CB-CE2 4.11Å; I654-F692 HydrophobicContact CB-CZ 4.23Å; I654-F692 HydrophobicContact CG1-CZ 4.41Å; I654-F692 HydrophobicContact CG2-CE2 4.04Å; I654-F692 HydrophobicContact CG2-CZ 4.44Å; P690-F692 VanDerWaalsContact C-N 3.26Å; P690-F692 HydrophobicContact CB-CD1 4.25Å; P690-F692 HydrophobicContact CB-CE1 3.76Å; P690-F692 HydrophobicContact CB-CE2 4.31Å; P690-F692 HydrophobicContact CB-CZ 3.79Å; P690-F692 PolarHBondContact O-N 3.49Å; F692-I694 VanDerWaalsContact C-N 3.33Å; F692-I694 PolarHBondContact O-N 3.45Å; F692-S695 WeakPolarHBondContact O-CA 3.17Å; F692-S695 WeakPolarHBondContact O-CB 3.34Å; F692-S695 PolarHBondContact O-N 3.22Å; F692-I696 HydrophobicContact CD2-CD1 3.99Å; F692-I696 HydrophobicContact CD2-CG1 4.15Å; F692-I696 HydrophobicContact CE2-CD1 4.04Å; F692-I696 PolarHBondContact O-N 3.49Å
693L92.8Very high93.6Very high4 Ų434.7 Ų34.72%0.02118%0.184CC..G310 helixtrans-55.7-44.4-171.9-174.155000112.8I654 M658 P690 V691 S695 I696 V699 I729I654-L693 HydrophobicContact CG2-CD1 4.26Å; M658-L693 HydrophobicContact CG-CD1 4.08Å; M658-L693 HydrophobicContact SD-CD1 4.06Å; P690-L693 HydrophobicContact CG-CB 4.01Å; P690-L693 HydrophobicContact CG-CD1 4.46Å; P690-L693 HydrophobicContact CG-CD2 4.29Å; P690-L693 HydrophobicContact CG-CG 4.49Å; P690-L693 WeakPolarHBondContact O-CB 2.98Å; P690-L693 PolarHBondContact O-N 3Å; P690-L693 VanDerWaalsContact O-N 3.09Å; V691-L693 VanDerWaalsContact C-N 3.31Å; V691-L693 PolarHBondContact O-N 3.47Å; L693-S695 PolarHBondContact O-N 3.09Å; L693-I696 HydrophobicContact CD1-CD1 4.01Å; L693-I696 WeakPolarHBondContact O-CB 3.34Å; L693-I696 PolarHBondContact O-N 3.5Å; L693-V699 HydrophobicContact CD1-CG2 3.94Å; L693-V699 HydrophobicContact CG-CG2 4.39Å; L693-V699 WeakPolarHBondContact O-CG2 3.48Å; L693-I729 HydrophobicContact CD2-CD1 3.78Å; L693-I729 HydrophobicContact CD2-CG1 3.74Å; L693-I729 HydrophobicContact CG-CD1 4.04Å; L693-I729 HydrophobicContact CG-CG1 4.34Å
694I90.8Very high93.4Very high41 Ų4138.8 Ų38.821%0.2120%0.204CC..G310 helixtrans-67.6-22.5179-166.361.5000113.1F692 I696 V699 Q700 I729 L730F692-I694 VanDerWaalsContact C-N 3.33Å; F692-I694 PolarHBondContact O-N 3.45Å; I694-I696 VanDerWaalsContact C-N 3.33Å; I694-V699 HydrophobicContact CD1-CG1 4.35Å; I694-Q700 WeakPolarHBondContact O-CG 3.27Å; I694-Q700 PolarHBondContact O-NE2 2.98Å; I694-I729 HydrophobicContact CB-CG2 3.84Å; I694-I729 HydrophobicContact CD1-CG2 3.98Å; I694-I729 HydrophobicContact CG1-CG2 4.33Å; I694-L730 HydrophobicContact CD1-CD2 4.31Å; I694-L730 HydrophobicContact CG1-CD2 4.46Å
695S91.4Very high93.1Very high77 Ų7742.3 Ų42.354%0.53822%0.218SC..G310 helixtrans-82.8-12.2179.3-54.10000112.6F692 L693F692-S695 WeakPolarHBondContact O-CA 3.17Å; F692-S695 WeakPolarHBondContact O-CB 3.34Å; F692-S695 PolarHBondContact O-N 3.22Å; L693-S695 PolarHBondContact O-N 3.09Å
696I94.6Very high92.9Very high8 Ų843.2 Ų43.24%0.04122%0.222CC..SBendtrans-68.6126.4179.4-58.7180000109I654 M658 F692 L693 I694 A698 V699 Q700I654-I696 HydrophobicContact CG2-CD1 3.99Å; M658-I696 HydrophobicContact CB-CG2 4.07Å; M658-I696 HydrophobicContact CG-CD1 4.03Å; M658-I696 HydrophobicContact CG-CG2 4.44Å; F692-I696 HydrophobicContact CD2-CD1 3.99Å; F692-I696 HydrophobicContact CD2-CG1 4.15Å; F692-I696 HydrophobicContact CE2-CD1 4.04Å; F692-I696 PolarHBondContact O-N 3.49Å; L693-I696 HydrophobicContact CD1-CD1 4.01Å; L693-I696 WeakPolarHBondContact O-CB 3.34Å; L693-I696 PolarHBondContact O-N 3.5Å; I694-I696 VanDerWaalsContact C-N 3.33Å; I696-A698 HydrophobicContact CG2-CB 3.98Å; I696-A698 PolarHBondContact O-N 2.9Å; I696-A698 VanDerWaalsContact O-N 3.12Å; I696-V699 HydrophobicContact CB-CB 4.5Å; I696-V699 HydrophobicContact CB-CG2 4.15Å; I696-V699 PolarHBondContact O-N 3Å; I696-Q700 PolarHBondContact O-N 3.21Å; I696-Q700 VanDerWaalsContact O-N 3.1Å
697P94.6Very high92.7Very high84 Ų8443.1 Ų43.155%0.54522%0.222SC..Hα-helixtrans-55.9-34-178.2-2835.2000113.9Q700 K701P697-Q700 PolarHBondContact O-N 3.5Å; P697-K701 WeakPolarHBondContact O-CG 3.42Å; P697-K701 PolarHBondContact O-N 3.22Å
698A94.4Very high92.3Very high2 Ų245.3 Ų45.32%0.01723%0.232CC..Hα-helixtrans-62.6-42.1176.400000112.4M658 T662 I696 K701 V702M658-A698 HydrophobicContact CB-CB 3.96Å; T662-A698 WeakPolarHBondContact OG1-CB 3.38Å; T662-A698 PolarHBondContact OG1-O 3.15Å; T662-A698 VanDerWaalsContact OG1-O 3.08Å; I696-A698 HydrophobicContact CG2-CB 3.98Å; I696-A698 PolarHBondContact O-N 2.9Å; I696-A698 VanDerWaalsContact O-N 3.12Å; A698-K701 PolarHBondContact O-N 3.4Å; A698-V702 PolarHBondContact O-N 3.23Å
699V94.4Very high91.5Very high1 Ų148.5 Ų48.51%0.00626%0.258CS..Hα-helixtrans-67.6-42.3174.6177.50000110.8M658 L693 I694 I696 K701 V702 F703 L726 I729M658-V699 HydrophobicContact CE-CG2 3.45Å; M658-V699 VanDerWaalsContact CE-CG2 3.45Å; M658-V699 HydrophobicContact CG-CG2 4.01Å; M658-V699 HydrophobicContact SD-CG2 3.93Å; L693-V699 HydrophobicContact CD1-CG2 3.94Å; L693-V699 HydrophobicContact CG-CG2 4.39Å; L693-V699 WeakPolarHBondContact O-CG2 3.48Å; I694-V699 HydrophobicContact CD1-CG1 4.35Å; I696-V699 HydrophobicContact CB-CB 4.5Å; I696-V699 HydrophobicContact CB-CG2 4.15Å; I696-V699 PolarHBondContact O-N 3Å; V699-K701 VanDerWaalsContact C-N 3.29Å; V699-K701 PolarHBondContact O-N 3.46Å; V699-V702 PolarHBondContact O-N 2.99Å; V699-V702 VanDerWaalsContact O-N 3.1Å; V699-F703 PolarHBondContact O-N 3.46Å; V699-L726 HydrophobicContact CG1-CD2 4.34Å; V699-I729 HydrophobicContact CG1-CD1 4.2Å
700Q93.9Very high90.8Very high89 Ų8950 Ų5042%0.41628%0.279SS..Hα-helixtrans-61.1-37.3177.1-66.6178-4.400112.3I694 I696 P697 F703 N704I694-Q700 WeakPolarHBondContact O-CG 3.27Å; I694-Q700 PolarHBondContact O-NE2 2.98Å; I696-Q700 PolarHBondContact O-N 3.21Å; I696-Q700 VanDerWaalsContact O-N 3.1Å; P697-Q700 PolarHBondContact O-N 3.5Å; Q700-F703 PolarHBondContact O-N 3.49Å; Q700-N704 WeakPolarHBondContact O-CB 3.33Å; Q700-N704 PolarHBondContact O-N 2.86Å; Q700-N704 PolarHBondContact O-ND2 3.4Å
701K92.8Very high90.2Very high139 Ų13951.8 Ų51.860%0.60429%0.294SS*.Hα-helixtrans-61.3-42.5172.9-74.7172.2-176.8174.80112.2T662 P697 A698 V699 R705T662-K701 HydrophobicContact CG2-CB 4.27Å; P697-K701 WeakPolarHBondContact O-CG 3.42Å; P697-K701 PolarHBondContact O-N 3.22Å; A698-K701 PolarHBondContact O-N 3.4Å; V699-K701 VanDerWaalsContact C-N 3.29Å; V699-K701 PolarHBondContact O-N 3.46Å; K701-R705 WeakPolarHBondContact O-CB 3.4Å; K701-R705 PolarHBondContact O-N 3.03Å
702V93.6Very high89.7Confident4 Ų456.1 Ų56.12%0.02431%0.311CS..Hα-helixtrans-66.1-46.2176.4177.90000110.4T662 I665 A698 V699 N704 R705 I706 V722 L726T662-V702 HydrophobicContact CG2-CG2 3.93Å; I665-V702 HydrophobicContact CD1-CG1 4.1Å; I665-V702 HydrophobicContact CD1-CG2 3.89Å; I665-V702 HydrophobicContact CG2-CG1 4.47Å; A698-V702 PolarHBondContact O-N 3.23Å; V699-V702 PolarHBondContact O-N 2.99Å; V699-V702 VanDerWaalsContact O-N 3.1Å; V702-N704 PolarHBondContact O-N 3.31Å; V702-R705 PolarHBondContact O-N 2.83Å; V702-I706 HydrophobicContact CG1-CG1 4.47Å; V702-I706 WeakPolarHBondContact O-CG1 3.31Å; V702-I706 PolarHBondContact O-N 2.73Å; V702-V722 HydrophobicContact CG1-CG1 3.73Å; V702-L726 HydrophobicContact CG1-CD1 4.47Å
703F93.7Very high89.4Confident26 Ų2657.6 Ų57.611%0.11432%0.315CS..Hα-helixtrans-55.9-52176.9-172.4-86.4000111.2V699 Q700 R705 I706 T707 L726 L730 L754V699-F703 PolarHBondContact O-N 3.46Å; Q700-F703 PolarHBondContact O-N 3.49Å; F703-R705 VanDerWaalsContact C-N 3.32Å; F703-R705 PolarHBondContact O-N 3.31Å; F703-I706 PolarHBondContact O-N 3.39Å; F703-T707 HydrophobicContact CD1-CG2 4.14Å; F703-T707 HydrophobicContact CE1-CG2 3.79Å; F703-T707 HydrophobicContact CZ-CG2 4.13Å; F703-T707 WeakPolarHBondContact O-CG2 3.38Å; F703-T707 PolarHBondContact O-N 3Å; F703-T707 PolarHBondContact O-OG1 3.43Å; F703-T707 VanDerWaalsContact O-OG1 3.1Å; F703-L726 HydrophobicContact CB-CD2 4.4Å; F703-L726 HydrophobicContact CD2-CD1 4.23Å; F703-L726 HydrophobicContact CD2-CD2 4.3Å; F703-L730 HydrophobicContact CE2-CD1 4.1Å; F703-L754 HydrophobicContact CE2-CB 4.07Å; F703-L754 HydrophobicContact CE2-CD1 4.18Å; F703-L754 HydrophobicContact CE2-CD2 4.39Å; F703-L754 HydrophobicContact CE2-CG 4.44Å; F703-L754 HydrophobicContact CZ-CB 4.14Å
704N92.9Very high89.2Confident97 Ų9757.7 Ų57.752%0.51932%0.315SS..Hα-helixtrans-60.2-41.8179.4-69.8-19.2000111.9Q700 V702 I706 T707 D708Q700-N704 WeakPolarHBondContact O-CB 3.33Å; Q700-N704 PolarHBondContact O-N 2.86Å; Q700-N704 PolarHBondContact O-ND2 3.4Å; V702-N704 PolarHBondContact O-N 3.31Å; N704-I706 PolarHBondContact O-N 2.98Å; N704-T707 WeakPolarHBondContact CA-OG1 3.27Å; N704-T707 PolarHBondContact O-N 3.46Å; N704-T707 PolarHBondContact O-OG1 2.92Å; N704-T707 VanDerWaalsContact O-OG1 3.05Å; N704-D708 WeakPolarHBondContact O-CB 3.48Å; N704-D708 PolarHBondContact O-N 3.16Å
705R90.8Very high89.2Confident75 Ų7559.3 Ų59.328%0.28333%0.327SS..Hα-helixtrans-59.8-43.5176.6179.8-177.4-179.5147.210.6112.2I665 S666 K701 V702 F703 A711I665-R705 PolarHBondContact O-NH1 2.92Å; S666-R705 VanDerWaalsContact CA-NH1 3.31Å; S666-R705 VanDerWaalsContact CB-NH1 3.31Å; S666-R705 PolarHBondContact OG-NH1 3.23Å; S666-R705 VanDerWaalsContact OG-NH1 3.16Å; S666-R705 PolarHBondContact OG-NH2 2.98Å; K701-R705 WeakPolarHBondContact O-CB 3.4Å; K701-R705 PolarHBondContact O-N 3.03Å; V702-R705 PolarHBondContact O-N 2.83Å; F703-R705 VanDerWaalsContact C-N 3.32Å; F703-R705 PolarHBondContact O-N 3.31Å; R705-A711 HydrophobicContact CG-CB 4.36Å; R705-A711 VanDerWaalsContact O-CB 3.24Å; R705-A711 WeakPolarHBondContact O-CB 3.33Å
706I91.1Very high89Confident20 Ų2059.5 Ų59.510%0.10332%0.322CS..Hα-helixtrans-71.6-32.9-179.1-64.9-65.3000111.3V702 F703 N704 L714 V722 L726 L754 L758V702-I706 HydrophobicContact CG1-CG1 4.47Å; V702-I706 WeakPolarHBondContact O-CG1 3.31Å; V702-I706 PolarHBondContact O-N 2.73Å; F703-I706 PolarHBondContact O-N 3.39Å; N704-I706 PolarHBondContact O-N 2.98Å; I706-L714 HydrophobicContact CD1-CD1 4.24Å; I706-V722 HydrophobicContact CD1-CG1 3.94Å; I706-V722 HydrophobicContact CG1-CG1 3.83Å; I706-L726 HydrophobicContact CB-CD1 4.19Å; I706-L726 HydrophobicContact CG1-CD1 4.07Å; I706-L726 HydrophobicContact CG2-CD1 4.41Å; I706-L754 HydrophobicContact CG2-CD1 4.21Å; I706-L758 HydrophobicContact CG2-CD2 3.82Å
707T89.9Confident88.8Confident34 Ų3466.8 Ų66.821%0.20935%0.353CS..Hα-helixtrans-83.5-13.817856.90000114.4F703 N704 A709 L754 A757F703-T707 HydrophobicContact CD1-CG2 4.14Å; F703-T707 HydrophobicContact CE1-CG2 3.79Å; F703-T707 HydrophobicContact CZ-CG2 4.13Å; F703-T707 WeakPolarHBondContact O-CG2 3.38Å; F703-T707 PolarHBondContact O-N 3Å; F703-T707 PolarHBondContact O-OG1 3.43Å; F703-T707 VanDerWaalsContact O-OG1 3.1Å; N704-T707 WeakPolarHBondContact CA-OG1 3.27Å; N704-T707 PolarHBondContact O-N 3.46Å; N704-T707 PolarHBondContact O-OG1 2.92Å; N704-T707 VanDerWaalsContact O-OG1 3.05Å; T707-A709 PolarHBondContact O-N 2.8Å; T707-L754 HydrophobicContact CG2-CD1 4.06Å; T707-A757 HydrophobicContact CG2-CB 3.99Å
708D88.1Confident88.8Confident80 Ų8062.8 Ų62.843%0.42833%0.327SS..  trans-73.2123.3-179-175.3-9.1000111.1N704 S710 A711N704-D708 WeakPolarHBondContact O-CB 3.48Å; N704-D708 PolarHBondContact O-N 3.16Å; D708-S710 VanDerWaalsContact CG-OG 3.24Å; D708-S710 PolarHBondContact O-N 3.28Å; D708-S710 WeakPolarHBondContact OD1-CB 3.36Å; D708-S710 PolarHBondContact OD1-N 3.29Å; D708-S710 PolarHBondContact OD1-OG 3.42Å; D708-S710 PolarHBondContact OD2-OG 3.15Å; D708-S710 VanDerWaalsContact OD2-OG 3.14Å; D708-A711 HydrophobicContact CB-CB 4.12Å; D708-A711 PolarHBondContact O-N 3.07Å
709A76.1Confident88.8Confident66 Ų6663.3 Ų63.355%0.54533%0.329SS..THydrogen-bonded Turntrans-58.7-28.9178.200000114.2T707T707-A709 PolarHBondContact O-N 2.8Å
710S77.8Confident88.8Confident99 Ų9964.4 Ų64.469%0.69234%0.336SS*.THydrogen-bonded Turntrans-93.5-9.3-173.169.40000113.2D708D708-S710 VanDerWaalsContact CG-OG 3.24Å; D708-S710 PolarHBondContact O-N 3.28Å; D708-S710 WeakPolarHBondContact OD1-CB 3.36Å; D708-S710 PolarHBondContact OD1-N 3.29Å; D708-S710 PolarHBondContact OD1-OG 3.42Å; D708-S710 PolarHBondContact OD2-OG 3.15Å; D708-S710 VanDerWaalsContact OD2-OG 3.14Å
711A79.4Confident88.9Confident38 Ų3860.8 Ų60.831%0.31432%0.319SS..SBendtrans-73.6138.8-17900000111.4R705 D708 R713R705-A711 HydrophobicContact CG-CB 4.36Å; R705-A711 VanDerWaalsContact O-CB 3.24Å; R705-A711 WeakPolarHBondContact O-CB 3.33Å; D708-A711 HydrophobicContact CB-CB 4.12Å; D708-A711 PolarHBondContact O-N 3.07Å; A711-R713 PolarHBondContact O-N 3.25Å
712Q80.7Confident89.1Confident142 Ų14254.1 Ų54.166%0.66429%0.29SS*.PPolyproline II helixtrans-66.2129.9170-69.8177.8-19.300110T667T667-Q712 HydrophobicContact CG2-CB 4.04Å; T667-Q712 PolarHBondContact OG1-OE1 3.03Å
713R83.4Confident89.2Confident84 Ų8454 Ų5432%0.31729%0.289SS..PPolyproline II helixtrans-58.9142.3173.1-165.7-165.4173.398.22.4110.1T667 A711 D716 Q719 Q787T667-R713 WeakPolarHBondContact CG2-O 3.47Å; A711-R713 PolarHBondContact O-N 3.25Å; R713-D716 IonicContact CZ-OD1 3.73Å; R713-D716 IonicContact NE-OD1 2.66Å; R713-D716 PolarHBondContact NE-OD1 3.32Å; R713-D716 VanDerWaalsContact NE-OD1 3.11Å; R713-D716 IonicContact NH2-OD1 3.59Å; R713-D716 PolarHBondContact NH2-OD1 3.4Å; R713-Q719 HydrophobicContact CG-CG 4.12Å; R713-Q787 VanDerWaalsContact CZ-CB 3.5Å; R713-Q787 VanDerWaalsContact NH1-CB 3.33Å; R713-Q787 VanDerWaalsContact NH1-OE1 3.15Å; R713-Q787 PolarHBondContact NH2-O 3.01Å
714L89.3Confident89.3Confident6 Ų656 Ų563%0.03130%0.296CS..PPolyproline II helixtrans-73.3168.2170.7-59.5171.9000110.2I665 T667 I706 A718 Q719 V722I665-L714 HydrophobicContact CG2-CD1 3.7Å; T667-L714 HydrophobicContact CG2-CD2 4.06Å; I706-L714 HydrophobicContact CD1-CD1 4.24Å; L714-A718 HydrophobicContact CB-CB 4.26Å; L714-Q719 HydrophobicContact CB-CB 4.27Å; L714-V722 HydrophobicContact CD1-CG2 4.11Å
715V90.2Very high89.5Confident75 Ų7551.3 Ų51.346%0.45527%0.271SS..PPolyproline II helixtrans-54.6140.7168.5-179.80000109.3K717 A718 Q719V715-K717 PolarHBondContact O-N 2.89Å; V715-A718 WeakPolarHBondContact O-CA 3.45Å; V715-A718 WeakPolarHBondContact O-CB 3.32Å; V715-A718 PolarHBondContact O-N 3.39Å; V715-Q719 PolarHBondContact O-N 3.04Å
716D87.2Confident89.8Confident81 Ų8147.8 Ų47.843%0.43326%0.258SS..Hα-helixtrans-52.7-45.8-165.8-72.4-36.4000114.1R713 A718 Q719 V720R713-D716 IonicContact CZ-OD1 3.73Å; R713-D716 IonicContact NE-OD1 2.66Å; R713-D716 PolarHBondContact NE-OD1 3.32Å; R713-D716 VanDerWaalsContact NE-OD1 3.11Å; R713-D716 IonicContact NH2-OD1 3.59Å; R713-D716 PolarHBondContact NH2-OD1 3.4Å; D716-A718 PolarHBondContact O-N 2.76Å; D716-Q719 WeakPolarHBondContact O-CB 3.49Å; D716-Q719 PolarHBondContact O-N 3.28Å; D716-V720 WeakPolarHBondContact O-CG2 3.27Å; D716-V720 PolarHBondContact O-N 3.37Å
717K91.5Very high90Very high161 Ų16146.9 Ų46.970%0.725%0.253SS*.Hα-helixtrans-58.7-44.5175.8-69.7-174.4178.1-178.40112.7L675 V715 L721L675-K717 HydrophobicContact CD2-CB 4Å; V715-K717 PolarHBondContact O-N 2.89Å; K717-L721 WeakPolarHBondContact O-CG 3.47Å; K717-L721 PolarHBondContact O-N 3.25Å; K717-L721 VanDerWaalsContact O-N 3.14Å
718A93.6Very high90.3Very high0 Ų045.3 Ų45.30%024%0.244CC..Hα-helixtrans-68.7-38.8178.500000111.7L674 L675 L714 V715 D716 V720 L721 V722L674-A718 HydrophobicContact CD1-CB 4.26Å; L674-A718 HydrophobicContact CD2-CB 3.6Å; L674-A718 HydrophobicContact CG-CB 3.69Å; L675-A718 HydrophobicContact CD2-CB 4.12Å; L714-A718 HydrophobicContact CB-CB 4.26Å; V715-A718 WeakPolarHBondContact O-CA 3.45Å; V715-A718 WeakPolarHBondContact O-CB 3.32Å; V715-A718 PolarHBondContact O-N 3.39Å; D716-A718 PolarHBondContact O-N 2.76Å; A718-V720 PolarHBondContact O-N 3.14Å; A718-L721 PolarHBondContact O-N 2.76Å; A718-V722 WeakPolarHBondContact O-CG2 3.44Å; A718-V722 PolarHBondContact O-N 2.85Å
719Q93.9Very high90.7Very high13 Ų1342 Ų426%0.06123%0.226CC..Hα-helixtrans-59.3-47.6176.2-1736929.500111R713 L714 V715 D716 C723 V791R713-Q719 HydrophobicContact CG-CG 4.12Å; L714-Q719 HydrophobicContact CB-CB 4.27Å; V715-Q719 PolarHBondContact O-N 3.04Å; D716-Q719 WeakPolarHBondContact O-CB 3.49Å; D716-Q719 PolarHBondContact O-N 3.28Å; Q719-C723 WeakPolarHBondContact O-CB 3.34Å; Q719-C723 PolarHBondContact O-N 3.05Å; Q719-C723 PolarHBondContact O-SG 2.69Å; Q719-V791 HydrophobicContact CG-CG2 4.44Å
720V95.1Very high91.6Very high23 Ų2339 Ų3914%0.13920%0.201CC..Hα-helixtrans-58.4-51.4176.8172.40000110.6D716 A718 V722 C723 R724 V791 D794D716-V720 WeakPolarHBondContact O-CG2 3.27Å; D716-V720 PolarHBondContact O-N 3.37Å; A718-V720 PolarHBondContact O-N 3.14Å; V720-V722 PolarHBondContact O-N 3.11Å; V720-C723 PolarHBondContact O-N 3.15Å; V720-R724 WeakPolarHBondContact O-CB 3.36Å; V720-R724 PolarHBondContact O-N 3.32Å; V720-V791 HydrophobicContact CG2-CG2 3.92Å; V720-D794 HydrophobicContact CG1-CB 3.61Å; V720-D794 WeakPolarHBondContact CG1-OD2 3.29Å
721L96.1Very high92.4Very high13 Ų1334.3 Ų34.37%0.06817%0.168CC..Hα-helixtrans-61.6-42.4-178.8-68.6171.1000113.5L675 C678 V682 K717 A718 R724 A725L675-L721 HydrophobicContact CD2-CD1 4.04Å; C678-L721 HydrophobicContact CB-CB 3.78Å; C678-L721 HydrophobicContact CB-CD1 4.01Å; V682-L721 HydrophobicContact CG2-CB 4.22Å; V682-L721 HydrophobicContact CG2-CD2 4.26Å; V682-L721 VanDerWaalsContact CG2-O 3.22Å; V682-L721 WeakPolarHBondContact CG2-O 3.2Å; K717-L721 WeakPolarHBondContact O-CG 3.47Å; K717-L721 PolarHBondContact O-N 3.25Å; K717-L721 VanDerWaalsContact O-N 3.14Å; A718-L721 PolarHBondContact O-N 2.76Å; L721-R724 WeakPolarHBondContact O-CB 3.2Å; L721-R724 PolarHBondContact O-N 3.15Å; L721-A725 PolarHBondContact O-N 3.32Å
722V95.8Very high93.1Very high0 Ų032.9 Ų32.90%016%0.155CC..Hα-helixtrans-66.2-43.9177.6176.10000110.6I665 C678 V702 I706 L714 A718 V720 R724 A725 L726I665-V722 HydrophobicContact CD1-CG2 4.5Å; I665-V722 HydrophobicContact CG2-CG2 3.95Å; C678-V722 HydrophobicContact CB-CG2 4.33Å; C678-V722 WeakPolarHBondContact SG-CG2 3.28Å; V702-V722 HydrophobicContact CG1-CG1 3.73Å; I706-V722 HydrophobicContact CD1-CG1 3.94Å; I706-V722 HydrophobicContact CG1-CG1 3.83Å; L714-V722 HydrophobicContact CD1-CG2 4.11Å; A718-V722 WeakPolarHBondContact O-CG2 3.44Å; A718-V722 PolarHBondContact O-N 2.85Å; V720-V722 PolarHBondContact O-N 3.11Å; V722-R724 VanDerWaalsContact C-N 3.33Å; V722-R724 PolarHBondContact O-N 3.42Å; V722-A725 PolarHBondContact O-N 3.11Å; V722-L726 HydrophobicContact CG1-CD1 4.13Å; V722-L726 HydrophobicContact CG1-CG 4.36Å; V722-L726 WeakPolarHBondContact O-CG 3.36Å; V722-L726 PolarHBondContact O-N 2.91Å
723C95.8Very high93.6Very high0 Ų027.3 Ų27.30%013%0.131CC..Hα-helixtrans-63.1-41.2177.4-65.60000111.4Q719 V720 A725 L726 S727 L758 V791Q719-C723 WeakPolarHBondContact O-CB 3.34Å; Q719-C723 PolarHBondContact O-N 3.05Å; Q719-C723 PolarHBondContact O-SG 2.69Å; V720-C723 PolarHBondContact O-N 3.15Å; C723-A725 PolarHBondContact O-N 3.2Å; C723-L726 PolarHBondContact O-N 3.26Å; C723-S727 VanDerWaalsContact O-CB 3.29Å; C723-S727 WeakPolarHBondContact O-CB 3.28Å; C723-S727 PolarHBondContact O-N 3.32Å; C723-L758 HydrophobicContact CB-CD1 4.24Å; C723-V791 HydrophobicContact CB-CG1 3.59Å
724R96.4Very high94Very high68 Ų6824.1 Ų24.126%0.25712%0.119SC..Hα-helixtrans-55.4-50.4172.6-170.1-167.9-70.2-176.8-1.2111.3V720 L721 V722 S727 N728 D794 N798V720-R724 WeakPolarHBondContact O-CB 3.36Å; V720-R724 PolarHBondContact O-N 3.32Å; L721-R724 WeakPolarHBondContact O-CB 3.2Å; L721-R724 PolarHBondContact O-N 3.15Å; V722-R724 VanDerWaalsContact C-N 3.33Å; V722-R724 PolarHBondContact O-N 3.42Å; R724-S727 PolarHBondContact O-N 3.5Å; R724-N728 WeakPolarHBondContact O-CB 3.47Å; R724-N728 VanDerWaalsContact O-CG 3.26Å; R724-N728 PolarHBondContact O-N 2.94Å; R724-N728 PolarHBondContact O-OD1 3.28Å; R724-D794 WeakPolarHBondContact CB-OD2 3.37Å; R724-D794 WeakPolarHBondContact CG-OD2 3.24Å; R724-D794 IonicContact CZ-OD1 3.86Å; R724-D794 VanDerWaalsContact CZ-OD1 3.31Å; R724-D794 IonicContact CZ-OD2 2.85Å; R724-D794 IonicContact NE-OD1 3.26Å; R724-D794 PolarHBondContact NE-OD1 3.33Å; R724-D794 IonicContact NE-OD2 3.89Å; R724-D794 PolarHBondContact NE-OD2 3.43Å; R724-D794 IonicContact NH2-OD1 3.97Å; R724-D794 PolarHBondContact NH2-OD1 2.97Å; R724-D794 IonicContact NH2-OD2 3.81Å; R724-N798 WeakPolarHBondContact CG-ND2 3.37Å
725A96.9Very high93.9Very high0 Ų025.3 Ų25.30%013%0.127CC..Hα-helixtrans-63.1-47-179.700000112.1L681 V682 A685 L721 V722 C723 S727 N728 I729L681-A725 HydrophobicContact CB-CB 4.49Å; L681-A725 HydrophobicContact CD2-CB 4.14Å; L681-A725 HydrophobicContact CG-CB 3.72Å; V682-A725 HydrophobicContact CB-CB 4.47Å; V682-A725 HydrophobicContact CG2-CB 3.86Å; A685-A725 HydrophobicContact CB-CB 4.04Å; A685-A725 WeakPolarHBondContact CB-O 3.24Å; L721-A725 PolarHBondContact O-N 3.32Å; V722-A725 PolarHBondContact O-N 3.11Å; C723-A725 PolarHBondContact O-N 3.2Å; A725-S727 PolarHBondContact O-N 3.49Å; A725-N728 PolarHBondContact O-N 3.21Å; A725-I729 VanDerWaalsContact O-CG1 3.27Å; A725-I729 WeakPolarHBondContact O-CG1 3.19Å; A725-I729 PolarHBondContact O-N 3.47Å
726L96.5Very high93.6Very high1 Ų127.5 Ų27.51%0.00514%0.136CC..Hα-helixtrans-63.1-41.1178.2-66.8179.3000112V699 V702 F703 I706 V722 C723 I729 L730 L754V699-L726 HydrophobicContact CG1-CD2 4.34Å; V702-L726 HydrophobicContact CG1-CD1 4.47Å; F703-L726 HydrophobicContact CB-CD2 4.4Å; F703-L726 HydrophobicContact CD2-CD1 4.23Å; F703-L726 HydrophobicContact CD2-CD2 4.3Å; I706-L726 HydrophobicContact CB-CD1 4.19Å; I706-L726 HydrophobicContact CG1-CD1 4.07Å; I706-L726 HydrophobicContact CG2-CD1 4.41Å; V722-L726 HydrophobicContact CG1-CD1 4.13Å; V722-L726 HydrophobicContact CG1-CG 4.36Å; V722-L726 WeakPolarHBondContact O-CG 3.36Å; V722-L726 PolarHBondContact O-N 2.91Å; C723-L726 PolarHBondContact O-N 3.26Å; L726-I729 HydrophobicContact CD2-CD1 4.49Å; L726-L730 WeakPolarHBondContact O-CG 3.36Å; L726-L730 PolarHBondContact O-N 3.12Å; L726-L754 HydrophobicContact CB-CD2 3.96Å; L726-L754 HydrophobicContact CD1-CD1 4.47Å
727S96.7Very high93.5Very high0 Ų025.6 Ų25.60%013%0.126CC..Hα-helixtrans-63.1-44.4175-177.10000111C723 R724 A725 I729 L730 L731 H751 I795C723-S727 VanDerWaalsContact O-CB 3.29Å; C723-S727 WeakPolarHBondContact O-CB 3.28Å; C723-S727 PolarHBondContact O-N 3.32Å; R724-S727 PolarHBondContact O-N 3.5Å; A725-S727 PolarHBondContact O-N 3.49Å; S727-I729 PolarHBondContact O-N 3.42Å; S727-L730 CarbonylContact O-C 3.16Å; S727-L730 WeakPolarHBondContact O-CA 3.42Å; S727-L730 WeakPolarHBondContact O-CB 3.39Å; S727-L730 PolarHBondContact O-N 3.42Å; S727-L731 WeakPolarHBondContact O-CB 3.5Å; S727-L731 WeakPolarHBondContact O-CG 3.34Å; S727-L731 PolarHBondContact O-N 3.31Å; S727-L731 VanDerWaalsContact OG-CD1 3.3Å; S727-L731 WeakPolarHBondContact OG-CD1 3.41Å; S727-H751 PolarHBondContact OG-CD2 3.49Å; S727-H751 PolarHBondContact OG-NE2 2.99Å; S727-I795 WeakPolarHBondContact OG-CG2 3.38Å
728N96.3Very high93.3Very high1 Ų121 Ų211%0.00511%0.112CC..Hα-helixtrans-63.3-39.1178.7-80.24.2000114.1A685 T686 R724 A725 L730 L731 L732 N798A685-N728 HydrophobicContact CB-CB 4.12Å; T686-N728 WeakPolarHBondContact CG2-ND2 3.27Å; R724-N728 WeakPolarHBondContact O-CB 3.47Å; R724-N728 VanDerWaalsContact O-CG 3.26Å; R724-N728 PolarHBondContact O-N 2.94Å; R724-N728 PolarHBondContact O-OD1 3.28Å; A725-N728 PolarHBondContact O-N 3.21Å; N728-L730 PolarHBondContact O-N 3.17Å; N728-L730 VanDerWaalsContact O-N 3.12Å; N728-L731 PolarHBondContact O-N 3.34Å; N728-L732 HydrophobicContact CB-CD1 3.8Å; N728-L732 HydrophobicContact CB-CG 4.03Å; N728-L732 WeakPolarHBondContact O-CB 3.45Å; N728-L732 PolarHBondContact O-N 3.18Å; N728-N798 PolarHBondContact ND2-ND2 3.33Å; N728-N798 PolarHBondContact OD1-ND2 3.43Å
729I95.3Very high92.9Very high12 Ų1226.2 Ų26.26%0.06214%0.137CC..Hα-helixtrans-55.6-30172.2-68.4166.9000110.7A685 L693 I694 V699 A725 L726 S727 R747A685-I729 HydrophobicContact CB-CD1 4.26Å; A685-I729 HydrophobicContact CB-CG1 3.69Å; L693-I729 HydrophobicContact CD2-CD1 3.78Å; L693-I729 HydrophobicContact CD2-CG1 3.74Å; L693-I729 HydrophobicContact CG-CD1 4.04Å; L693-I729 HydrophobicContact CG-CG1 4.34Å; I694-I729 HydrophobicContact CB-CG2 3.84Å; I694-I729 HydrophobicContact CD1-CG2 3.98Å; I694-I729 HydrophobicContact CG1-CG2 4.33Å; V699-I729 HydrophobicContact CG1-CD1 4.2Å; A725-I729 VanDerWaalsContact O-CG1 3.27Å; A725-I729 WeakPolarHBondContact O-CG1 3.19Å; A725-I729 PolarHBondContact O-N 3.47Å; L726-I729 HydrophobicContact CD2-CD1 4.49Å; S727-I729 PolarHBondContact O-N 3.42Å; I729-R747 PolarHBondContact O-NE 2.9Å; I729-R747 PolarHBondContact O-NH2 2.94Å
730L95.3Very high92.5Very high2 Ų231.8 Ų31.81%0.0117%0.167CC..Hα-helixtrans-96.8-26.4-177.7-59.8172.7000114I694 F703 L726 S727 N728 R747 N750 H751 L754I694-L730 HydrophobicContact CD1-CD2 4.31Å; I694-L730 HydrophobicContact CG1-CD2 4.46Å; F703-L730 HydrophobicContact CE2-CD1 4.1Å; L726-L730 WeakPolarHBondContact O-CG 3.36Å; L726-L730 PolarHBondContact O-N 3.12Å; S727-L730 CarbonylContact O-C 3.16Å; S727-L730 WeakPolarHBondContact O-CA 3.42Å; S727-L730 WeakPolarHBondContact O-CB 3.39Å; S727-L730 PolarHBondContact O-N 3.42Å; N728-L730 PolarHBondContact O-N 3.17Å; N728-L730 VanDerWaalsContact O-N 3.12Å; L730-R747 HydrophobicContact CD2-CB 4.5Å; L730-R747 WeakPolarHBondContact O-CB 3.34Å; L730-R747 VanDerWaalsContact O-CZ 3.26Å; L730-R747 PolarHBondContact O-NE 2.88Å; L730-R747 PolarHBondContact O-NH2 3.36Å; L730-R747 VanDerWaalsContact O-NH2 3.16Å; L730-N750 HydrophobicContact CD1-CB 4.06Å; L730-N750 HydrophobicContact CD2-CB 3.85Å; L730-H751 HydrophobicContact CB-CB 4.13Å; L730-H751 HydrophobicContact CD1-CB 4.09Å; L730-L754 HydrophobicContact CD1-CD2 4.41Å
731L95.3Very high92.2Very high0 Ų035.4 Ų35.40%018%0.183CC..Hα-helixtrans-103.4-33.4-174.3-65.9-175.7000114.7S727 N728 W744 H751 I799 S806 I809 C810S727-L731 WeakPolarHBondContact O-CB 3.5Å; S727-L731 WeakPolarHBondContact O-CG 3.34Å; S727-L731 PolarHBondContact O-N 3.31Å; S727-L731 VanDerWaalsContact OG-CD1 3.3Å; S727-L731 WeakPolarHBondContact OG-CD1 3.41Å; N728-L731 PolarHBondContact O-N 3.34Å; L731-W744 WeakPolarHBondContact O-CH2 3.3Å; L731-H751 WeakPolarHBondContact CD1-NE2 3.45Å; L731-H751 HydrophobicContact CD2-CB 4.48Å; L731-I799 HydrophobicContact CB-CG2 4.32Å; L731-I799 HydrophobicContact CD1-CG2 3.86Å; L731-S806 WeakPolarHBondContact O-CB 3.31Å; L731-S806 PolarHBondContact O-OG 3.31Å; L731-I809 HydrophobicContact CD2-CB 3.96Å; L731-I809 HydrophobicContact CD2-CG2 3.59Å; L731-C810 HydrophobicContact CD1-CB 3.79Å; L731-C810 HydrophobicContact CD2-CB 4.34Å
732L94.3Very high91.8Very high8 Ų835 Ų354%0.04218%0.18CC..SBendtrans-78.6133.8-174.6-62.4-176.3000111.3T686 N728 W734 R747 E802T686-L732 HydrophobicContact CG2-CD1 4.41Å; N728-L732 HydrophobicContact CB-CD1 3.8Å; N728-L732 HydrophobicContact CB-CG 4.03Å; N728-L732 WeakPolarHBondContact O-CB 3.45Å; N728-L732 PolarHBondContact O-N 3.18Å; L732-W734 PolarHBondContact O-N 3.45Å; L732-R747 PolarHBondContact O-NH1 2.65Å; L732-R747 PolarHBondContact O-NH2 2.94Å; L732-E802 HydrophobicContact CD2-CG 3.6Å
733P91.7Very high91.7Very high26 Ų2640.3 Ų40.317%0.16921%0.205CC..PPolyproline II helixtrans-63.3139.8177.826.9-33.4000110.4R689 W744R689-P733 PolarHBondContact NH1-O 3.19Å; P733-W744 HydrophobicContact CB-CH2 4.23Å; P733-W744 HydrophobicContact CB-CZ2 4.17Å
734W90.9Very high91.5Very high17 Ų1741.1 Ų41.16%0.06421%0.208CC..PPolyproline II helixtrans-67.8134.4171.2-65.1-44.4000109.8V691 L732 L737 E741 Q742 Q743V691-W734 HydrophobicContact CB-CD2 4.27Å; V691-W734 HydrophobicContact CG1-CD2 4.03Å; V691-W734 HydrophobicContact CG1-CE3 3.88Å; V691-W734 HydrophobicContact CG1-CH2 3.89Å; V691-W734 HydrophobicContact CG1-CZ2 4.03Å; V691-W734 HydrophobicContact CG1-CZ3 3.81Å; V691-W734 HydrophobicContact CG2-CB 4.17Å; V691-W734 HydrophobicContact CG2-CD2 3.99Å; V691-W734 HydrophobicContact CG2-CE3 4.26Å; V691-W734 HydrophobicContact CG2-CG 3.95Å; L732-W734 PolarHBondContact O-N 3.45Å; W734-L737 HydrophobicContact CB-CD1 3.98Å; W734-L737 HydrophobicContact CD2-CD1 4.44Å; W734-L737 HydrophobicContact CE3-CD1 3.85Å; W734-E741 WeakPolarHBondContact CZ3-O 3.45Å; W734-Q742 WeakPolarHBondContact CZ3-O 3.46Å; W734-Q742 PolarHBondContact O-NE2 3.09Å; W734-Q743 HydrophobicContact CH2-CB 4.11Å; W734-Q743 HydrophobicContact CH2-CG 4.22Å; W734-Q743 HydrophobicContact CZ3-CB 4.17Å; W734-Q743 HydrophobicContact CZ3-CG 4.06Å
735P88Confident91.4Very high31 Ų3142.5 Ų42.520%0.20123%0.226CC..THydrogen-bonded Turntrans-64.9147.1-179.427.8-34000110.9R689 L737R689-P735 HydrophobicContact CB-CG 4.4Å; P735-L737 PolarHBondContact O-N 3.38Å; P735-L737 VanDerWaalsContact O-N 3.09Å
736N83.6Confident91.2Very high120 Ų12046.4 Ų46.464%0.64225%0.249SC*.THydrogen-bonded Turntrans61.113.6173.7-51-42.3000116.4S640S640-N736 PolarHBondContact OG-ND2 3.09Å
737L85.7Confident91Very high41 Ų4146.9 Ų46.922%0.21525%0.251CS..  trans-110.9138.5173.9-74.9177.7000112.1V691 W734 P735 Q742V691-L737 HydrophobicContact CG2-CD1 3.55Å; W734-L737 HydrophobicContact CB-CD1 3.98Å; W734-L737 HydrophobicContact CD2-CD1 4.44Å; W734-L737 HydrophobicContact CE3-CD1 3.85Å; P735-L737 PolarHBondContact O-N 3.38Å; P735-L737 VanDerWaalsContact O-N 3.09Å; L737-Q742 PolarHBondContact O-NE2 3.03Å
738P86.3Confident91Very high65 Ų6548.1 Ų48.142%0.42226%0.26SS..  trans-69.9157176.832.2-36.4000111.9N740 E741P738-N740 VanDerWaalsContact CB-OD1 3.22Å; P738-N740 WeakPolarHBondContact CB-OD1 3.29Å; P738-N740 WeakPolarHBondContact CG-OD1 3.47Å; P738-N740 PolarHBondContact O-N 2.9Å; P738-N740 VanDerWaalsContact O-N 3.1Å; P738-E741 HydrophobicContact CG-CB 4.24Å; P738-E741 HydrophobicContact CG-CG 4.07Å; P738-E741 PolarHBondContact O-N 2.93Å
739E85.4Confident90.9Very high110 Ų11053.7 Ų53.751%0.51429%0.288SS..G310 helixtrans-54.8-31.4-174.2-79.3-69.3165.100114.9E741 W744E739-E741 VanDerWaalsContact C-N 3.29Å; E739-E741 PolarHBondContact O-N 3.29Å; E739-W744 PolarHBondContact OE2-NE1 3.48Å
740N86.3Confident90.9Very high130 Ų13055.8 Ų55.870%0.69530%0.3SS*.G310 helixtrans-70.2-23.417860.4-43.1000113.4P738P738-N740 VanDerWaalsContact CB-OD1 3.22Å; P738-N740 WeakPolarHBondContact CB-OD1 3.29Å; P738-N740 WeakPolarHBondContact CG-OD1 3.47Å; P738-N740 PolarHBondContact O-N 2.9Å; P738-N740 VanDerWaalsContact O-N 3.1Å
741E87.3Confident90.9Very high99 Ų9955.7 Ų55.746%0.46330%0.299SS..G310 helixtrans-98.6-2.6-176.6-68.8177.2-15600113.1W734 P738 E739 Q743W734-E741 WeakPolarHBondContact CZ3-O 3.45Å; P738-E741 HydrophobicContact CG-CB 4.24Å; P738-E741 HydrophobicContact CG-CG 4.07Å; P738-E741 PolarHBondContact O-N 2.93Å; E739-E741 VanDerWaalsContact C-N 3.29Å; E739-E741 PolarHBondContact O-N 3.29Å; E741-Q743 PolarHBondContact O-N 2.74Å
742Q89.4Confident91Very high3 Ų357.7 Ų57.71%0.01432%0.315CS..SBendtrans-71.3-6-179.1-67.2-69-22.900114.7W734 L737 W744 R747W734-Q742 WeakPolarHBondContact CZ3-O 3.46Å; W734-Q742 PolarHBondContact O-NE2 3.09Å; L737-Q742 PolarHBondContact O-NE2 3.03Å; Q742-W744 HydrophobicContact CB-CD2 3.96Å; Q742-W744 VanDerWaalsContact CB-CE2 3.46Å; Q742-W744 HydrophobicContact CB-CG 4.12Å; Q742-W744 HydrophobicContact CB-CZ2 3.92Å; Q742-W744 VanDerWaalsContact CB-NE1 3.33Å; Q742-W744 HydrophobicContact CG-CZ2 4.05Å; Q742-W744 PolarHBondContact O-N 3.4Å; Q742-W744 VanDerWaalsContact O-N 3.14Å; Q742-R747 WeakPolarHBondContact O-CD 3.3Å
743Q91.9Very high91Very high112 Ų11260.4 Ų60.452%0.52334%0.335SS..  trans52.534.6179.9-58.2-1798.700114.5W734 E741 P745 V746 R747W734-Q743 HydrophobicContact CH2-CB 4.11Å; W734-Q743 HydrophobicContact CH2-CG 4.22Å; W734-Q743 HydrophobicContact CZ3-CB 4.17Å; W734-Q743 HydrophobicContact CZ3-CG 4.06Å; E741-Q743 PolarHBondContact O-N 2.74Å; Q743-P745 VanDerWaalsContact C-N 3.33Å; Q743-P745 VanDerWaalsContact O-N 3.15Å; Q743-V746 PolarHBondContact O-N 3.42Å; Q743-R747 WeakPolarHBondContact O-CG 3.48Å; Q743-R747 PolarHBondContact O-N 2.91Å
744W93.2Very high91.1Very high18 Ų1859.1 Ų59.17%0.06833%0.327CS..Hα-helixtrans-49.2-39.2-177.9-67126.3000115.9L731 P733 E739 Q742 V746 R747 S748 K805 I809L731-W744 WeakPolarHBondContact O-CH2 3.3Å; P733-W744 HydrophobicContact CB-CH2 4.23Å; P733-W744 HydrophobicContact CB-CZ2 4.17Å; E739-W744 PolarHBondContact OE2-NE1 3.48Å; Q742-W744 HydrophobicContact CB-CD2 3.96Å; Q742-W744 VanDerWaalsContact CB-CE2 3.46Å; Q742-W744 HydrophobicContact CB-CG 4.12Å; Q742-W744 HydrophobicContact CB-CZ2 3.92Å; Q742-W744 VanDerWaalsContact CB-NE1 3.33Å; Q742-W744 HydrophobicContact CG-CZ2 4.05Å; Q742-W744 PolarHBondContact O-N 3.4Å; Q742-W744 VanDerWaalsContact O-N 3.14Å; W744-V746 PolarHBondContact O-N 2.83Å; W744-R747 PolarHBondContact O-N 3.33Å; W744-S748 VanDerWaalsContact O-CB 3.22Å; W744-S748 WeakPolarHBondContact O-CB 3.25Å; W744-S748 PolarHBondContact O-N 3.48Å; W744-K805 HydrophobicContact CD2-CG 4.16Å; W744-K805 HydrophobicContact CG-CG 4.27Å; W744-I809 HydrophobicContact CB-CD1 4.3Å; W744-I809 HydrophobicContact CD2-CD1 4.01Å; W744-I809 HydrophobicContact CE3-CD1 3.45Å; W744-I809 VanDerWaalsContact CE3-CD1 3.45Å; W744-I809 HydrophobicContact CG-CD1 4.39Å; W744-I809 HydrophobicContact CZ3-CD1 4.08Å
745P93.1Very high91.4Very high96 Ų9658.4 Ų58.462%0.62332%0.324SS*.Hα-helixtrans-60.2-45.5-179.7-25.535.7000113.3Q743 I749Q743-P745 VanDerWaalsContact C-N 3.33Å; Q743-P745 VanDerWaalsContact O-N 3.15Å; P745-I749 WeakPolarHBondContact O-CG1 3.48Å; P745-I749 PolarHBondContact O-N 3.47Å
746V92.7Very high91.7Very high82 Ų8259.2 Ų59.250%0.49733%0.331SS..Hα-helixtrans-68.7-44.2179.8178.50000110.2Q743 W744 S748 I749 N750Q743-V746 PolarHBondContact O-N 3.42Å; W744-V746 PolarHBondContact O-N 2.83Å; V746-S748 VanDerWaalsContact C-N 3.32Å; V746-S748 PolarHBondContact O-N 2.72Å; V746-I749 PolarHBondContact O-N 3.34Å; V746-N750 PolarHBondContact O-N 3.41Å; V746-N750 PolarHBondContact O-ND2 3.25Å
747R93.3Very high92.1Very high11 Ų1154.8 Ų54.84%0.04231%0.311CS..Hα-helixtrans-62.6-39.5179.1-63.7176.970.6-171.91.8112I729 L730 L732 Q742 Q743 W744 N750 H751I729-R747 PolarHBondContact O-NE 2.9Å; I729-R747 PolarHBondContact O-NH2 2.94Å; L730-R747 HydrophobicContact CD2-CB 4.5Å; L730-R747 WeakPolarHBondContact O-CB 3.34Å; L730-R747 VanDerWaalsContact O-CZ 3.26Å; L730-R747 PolarHBondContact O-NE 2.88Å; L730-R747 PolarHBondContact O-NH2 3.36Å; L730-R747 VanDerWaalsContact O-NH2 3.16Å; L732-R747 PolarHBondContact O-NH1 2.65Å; L732-R747 PolarHBondContact O-NH2 2.94Å; Q742-R747 WeakPolarHBondContact O-CD 3.3Å; Q743-R747 WeakPolarHBondContact O-CG 3.48Å; Q743-R747 PolarHBondContact O-N 2.91Å; W744-R747 PolarHBondContact O-N 3.33Å; R747-N750 PolarHBondContact O-N 3.12Å; R747-H751 WeakPolarHBondContact O-CB 3.42Å; R747-H751 PolarHBondContact O-N 3.36Å
748S95.3Very high92.4Very high26 Ų2654.3 Ų54.318%0.18231%0.308CS..Hα-helixtrans-63.2-42.2176-173.50000112.5W744 V746 H751 A752W744-S748 VanDerWaalsContact O-CB 3.22Å; W744-S748 WeakPolarHBondContact O-CB 3.25Å; W744-S748 PolarHBondContact O-N 3.48Å; V746-S748 VanDerWaalsContact C-N 3.32Å; V746-S748 PolarHBondContact O-N 2.72Å; S748-H751 PolarHBondContact O-N 3.04Å; S748-A752 WeakPolarHBondContact O-CB 3.49Å; S748-A752 PolarHBondContact O-N 3.29Å
749I95.3Very high92.7Very high118 Ų11851.3 Ų51.361%0.60529%0.289SS*.Hα-helixtrans-64.7-46.2177.1-68.4165.6000110.4P745 V746 H751 A752 S753P745-I749 WeakPolarHBondContact O-CG1 3.48Å; P745-I749 PolarHBondContact O-N 3.47Å; V746-I749 PolarHBondContact O-N 3.34Å; I749-H751 VanDerWaalsContact C-N 3.32Å; I749-H751 PolarHBondContact O-N 3.47Å; I749-A752 PolarHBondContact O-N 3.42Å; I749-S753 PolarHBondContact O-N 3.05Å
750N94.2Very high92.9Very high57 Ų5750.2 Ų50.231%0.30528%0.28SS..Hα-helixtrans-63.9-38.2178.7-69.7-18.7000111.9L730 V746 R747 S753 L754L730-N750 HydrophobicContact CD1-CB 4.06Å; L730-N750 HydrophobicContact CD2-CB 3.85Å; V746-N750 PolarHBondContact O-N 3.41Å; V746-N750 PolarHBondContact O-ND2 3.25Å; R747-N750 PolarHBondContact O-N 3.12Å; N750-S753 WeakPolarHBondContact O-CB 3.11Å; N750-S753 PolarHBondContact O-N 3.3Å; N750-L754 PolarHBondContact O-N 3.4Å
751H96.7Very high93Very high0 Ų047.8 Ų47.80%027%0.267CS..Hα-helixtrans-67.6-43.4177.2-172.4-92.6000111.4S727 L730 L731 R747 S748 I749 S753 L754 I755 I809 S813S727-H751 PolarHBondContact OG-CD2 3.49Å; S727-H751 PolarHBondContact OG-NE2 2.99Å; L730-H751 HydrophobicContact CB-CB 4.13Å; L730-H751 HydrophobicContact CD1-CB 4.09Å; L731-H751 WeakPolarHBondContact CD1-NE2 3.45Å; L731-H751 HydrophobicContact CD2-CB 4.48Å; R747-H751 WeakPolarHBondContact O-CB 3.42Å; R747-H751 PolarHBondContact O-N 3.36Å; S748-H751 PolarHBondContact O-N 3.04Å; I749-H751 VanDerWaalsContact C-N 3.32Å; I749-H751 PolarHBondContact O-N 3.47Å; H751-S753 VanDerWaalsContact C-N 3.29Å; H751-S753 PolarHBondContact O-N 3.49Å; H751-L754 WeakPolarHBondContact O-CB 3.46Å; H751-L754 PolarHBondContact O-N 3.01Å; H751-I755 VanDerWaalsContact CE1-CG1 3.42Å; H751-I755 WeakPolarHBondContact CE1-CG1 3.31Å; H751-I755 WeakPolarHBondContact O-CG1 3.11Å; H751-I755 PolarHBondContact O-N 2.86Å; H751-I809 HydrophobicContact CB-CG2 4.44Å; H751-S813 WeakPolarHBondContact ND1-CB 3.35Å; H751-S813 PolarHBondContact ND1-OG 3.1Å
752A96.1Very high93.2Very high41 Ų4143 Ų4334%0.33925%0.245SC..Hα-helixtrans-59.8-40.1173.600000111.9S748 I749 S756S748-A752 WeakPolarHBondContact O-CB 3.49Å; S748-A752 PolarHBondContact O-N 3.29Å; I749-A752 PolarHBondContact O-N 3.42Å; A752-S756 WeakPolarHBondContact O-CB 3.24Å; A752-S756 PolarHBondContact O-N 3.38Å
753S94.3Very high93.1Very high65 Ų6545.2 Ų45.246%0.45525%0.253SS..Hα-helixtrans-62.7-42.8174.5-171.60000112.4I749 N750 H751 S756 A757I749-S753 PolarHBondContact O-N 3.05Å; N750-S753 WeakPolarHBondContact O-CB 3.11Å; N750-S753 PolarHBondContact O-N 3.3Å; H751-S753 VanDerWaalsContact C-N 3.29Å; H751-S753 PolarHBondContact O-N 3.49Å; S753-S756 PolarHBondContact O-N 3.37Å; S753-A757 PolarHBondContact O-N 2.92Å
754L95.1Very high92.8Very high0 Ų045.7 Ų45.70%026%0.259CS..Hα-helixtrans-61.7-53.3177.3178.363.6000111.1F703 I706 T707 L726 L730 N750 H751 S756 A757 L758F703-L754 HydrophobicContact CE2-CB 4.07Å; F703-L754 HydrophobicContact CE2-CD1 4.18Å; F703-L754 HydrophobicContact CE2-CD2 4.39Å; F703-L754 HydrophobicContact CE2-CG 4.44Å; F703-L754 HydrophobicContact CZ-CB 4.14Å; I706-L754 HydrophobicContact CG2-CD1 4.21Å; T707-L754 HydrophobicContact CG2-CD1 4.06Å; L726-L754 HydrophobicContact CB-CD2 3.96Å; L726-L754 HydrophobicContact CD1-CD1 4.47Å; L730-L754 HydrophobicContact CD1-CD2 4.41Å; N750-L754 PolarHBondContact O-N 3.4Å; H751-L754 WeakPolarHBondContact O-CB 3.46Å; H751-L754 PolarHBondContact O-N 3.01Å; L754-S756 VanDerWaalsContact C-N 3.29Å; L754-S756 PolarHBondContact O-N 3.06Å; L754-A757 PolarHBondContact O-N 3.29Å; L754-L758 HydrophobicContact CD1-CD1 4.02Å; L754-L758 HydrophobicContact CD1-CG 4.29Å; L754-L758 HydrophobicContact CG-CD1 3.95Å; L754-L758 WeakPolarHBondContact O-CG 3.2Å; L754-L758 PolarHBondContact O-N 3.29Å
755I96Very high92.4Very high1 Ų146.4 Ų46.41%0.00526%0.264CS..Hα-helixtrans-62.7-38.3179.6-61.8-54.9000111.4H751 A757 L758 S759 L792 I795 S813 L814H751-I755 VanDerWaalsContact CE1-CG1 3.42Å; H751-I755 WeakPolarHBondContact CE1-CG1 3.31Å; H751-I755 WeakPolarHBondContact O-CG1 3.11Å; H751-I755 PolarHBondContact O-N 2.86Å; I755-A757 PolarHBondContact O-N 3.06Å; I755-L758 PolarHBondContact O-N 3.21Å; I755-S759 WeakPolarHBondContact O-CB 3.41Å; I755-S759 PolarHBondContact O-N 2.9Å; I755-S759 PolarHBondContact O-OG 3.12Å; I755-L792 HydrophobicContact CD1-CD2 4.13Å; I755-L792 HydrophobicContact CG2-CD2 4.38Å; I755-I795 HydrophobicContact CD1-CD1 3.8Å; I755-S813 VanDerWaalsContact CG2-O 3.3Å; I755-S813 WeakPolarHBondContact CG2-O 2.87Å; I755-L814 HydrophobicContact CD1-CD2 4.36Å; I755-L814 HydrophobicContact CG2-CD2 3.92Å
756S93.6Very high91.6Very high49 Ų4947.1 Ų47.134%0.34326%0.257SS..Hα-helixtrans-59.9-45.9174.9-177.70000111.3A752 S753 L754 R760 R763A752-S756 WeakPolarHBondContact O-CB 3.24Å; A752-S756 PolarHBondContact O-N 3.38Å; S753-S756 PolarHBondContact O-N 3.37Å; L754-S756 VanDerWaalsContact C-N 3.29Å; L754-S756 PolarHBondContact O-N 3.06Å; S756-R760 PolarHBondContact O-N 3.17Å; S756-R760 VanDerWaalsContact O-N 3.13Å; S756-R763 VanDerWaalsContact C-NH2 3.25Å; S756-R763 PolarHBondContact O-NH2 2.98Å; S756-R763 PolarHBondContact OG-NH1 3.22Å; S756-R763 PolarHBondContact OG-NH2 2.7Å
757A92.4Very high90.1Very high26 Ų2647.1 Ų47.122%0.21526%0.259CS..Hα-helixtrans-63.5-47.1176.600000112.1T707 S753 L754 I755 S759 R760T707-A757 HydrophobicContact CG2-CB 3.99Å; S753-A757 PolarHBondContact O-N 2.92Å; L754-A757 PolarHBondContact O-N 3.29Å; I755-A757 PolarHBondContact O-N 3.06Å; A757-S759 VanDerWaalsContact C-N 3.33Å; A757-S759 PolarHBondContact O-N 2.71Å; A757-R760 PolarHBondContact O-N 2.85Å
758L92Very high88.2Confident32 Ų3250.3 Ų50.317%0.16828%0.283CS..Hα-helixtrans-64.6-34.2-178.2-68.1173.4000113.4I706 C723 L754 I755 V791I706-L758 HydrophobicContact CG2-CD2 3.82Å; C723-L758 HydrophobicContact CB-CD1 4.24Å; L754-L758 HydrophobicContact CD1-CD1 4.02Å; L754-L758 HydrophobicContact CD1-CG 4.29Å; L754-L758 HydrophobicContact CG-CD1 3.95Å; L754-L758 WeakPolarHBondContact O-CG 3.2Å; L754-L758 PolarHBondContact O-N 3.29Å; I755-L758 PolarHBondContact O-N 3.21Å; L758-V791 HydrophobicContact CD1-CG1 4.12Å
759S92.9Very high85.8Confident2 Ų254.3 Ų54.31%0.01432%0.318CS..THydrogen-bonded Turntrans-1018.5-177.166.80000113.9I755 A757 D761 Y762 R763 S817I755-S759 WeakPolarHBondContact O-CB 3.41Å; I755-S759 PolarHBondContact O-N 2.9Å; I755-S759 PolarHBondContact O-OG 3.12Å; A757-S759 VanDerWaalsContact C-N 3.33Å; A757-S759 PolarHBondContact O-N 2.71Å; S759-D761 PolarHBondContact O-N 3.42Å; S759-Y762 PolarHBondContact O-N 3.49Å; S759-R763 WeakPolarHBondContact O-CB 3.41Å; S759-R763 VanDerWaalsContact O-CG 3.29Å; S759-R763 WeakPolarHBondContact O-CG 3.33Å; S759-R763 PolarHBondContact O-N 2.74Å; S759-R763 PolarHBondContact O-NE 3.12Å; S759-R763 PolarHBondContact OG-NE 3.21Å; S759-S817 WeakPolarHBondContact CB-OG 3.5Å; S759-S817 PolarHBondContact OG-OG 3.15Å
760R89.9Confident83.2Confident86 Ų8655 Ų5533%0.32533%0.327SS..Hα-helixtrans-56-52.3-174-177.8-177.163.3-138.9-5.3112.6S756 A757 Y762 R763 N764S756-R760 PolarHBondContact O-N 3.17Å; S756-R760 VanDerWaalsContact O-N 3.13Å; A757-R760 PolarHBondContact O-N 2.85Å; R760-Y762 VanDerWaalsContact C-N 3.34Å; R760-R763 PolarHBondContact O-N 3.06Å; R760-N764 PolarHBondContact O-N 3.48Å; R760-N764 PolarHBondContact O-ND2 3.31Å
761D88.1Confident80.5Confident79 Ų7955.5 Ų55.542%0.42234%0.339SS..Hα-helixtrans-73-33.3-175-58.8-23.2000110.9S759 N764 I784S759-D761 PolarHBondContact O-N 3.42Å; D761-N764 WeakPolarHBondContact O-CB 3.35Å; D761-N764 PolarHBondContact O-N 2.9Å; D761-I784 HydrophobicContact CB-CG2 4.34Å
762Y90.8Very high77.8Confident0 Ų061.6 Ų61.60%038%0.379CS..Hα-helixtrans-62.2-43.9171.6-177.2-105.7000113S759 R760 N764 L765 I785 T788 L789 V820 S821 L824S759-Y762 PolarHBondContact O-N 3.49Å; R760-Y762 VanDerWaalsContact C-N 3.34Å; Y762-N764 VanDerWaalsContact C-N 3.25Å; Y762-N764 PolarHBondContact O-N 3.33Å; Y762-L765 HydrophobicContact CD2-CD1 4.17Å; Y762-L765 VanDerWaalsContact O-CB 3.26Å; Y762-L765 WeakPolarHBondContact O-CB 3.21Å; Y762-L765 WeakPolarHBondContact O-CG 3.45Å; Y762-L765 PolarHBondContact O-N 2.91Å; Y762-I785 HydrophobicContact CD2-CG1 4.27Å; Y762-I785 HydrophobicContact CE2-CB 4.36Å; Y762-I785 HydrophobicContact CE2-CG1 3.96Å; Y762-I785 HydrophobicContact CE2-CG2 4.24Å; Y762-T788 HydrophobicContact CD1-CG2 4.32Å; Y762-T788 HydrophobicContact CD2-CG2 4.5Å; Y762-T788 HydrophobicContact CG-CG2 3.96Å; Y762-L789 HydrophobicContact CE1-CD2 4.37Å; Y762-L789 HydrophobicContact CE2-CD2 4.32Å; Y762-L789 HydrophobicContact CE2-CG 4.35Å; Y762-V820 HydrophobicContact CD1-CG1 4.06Å; Y762-V820 HydrophobicContact CE1-CB 4.03Å; Y762-V820 HydrophobicContact CE1-CG1 3.69Å; Y762-S821 WeakPolarHBondContact OH-CA 3.48Å; Y762-S821 VanDerWaalsContact OH-CB 3.32Å; Y762-S821 WeakPolarHBondContact OH-CB 3.27Å; Y762-S821 PolarHBondContact OH-OG 3.28Å; Y762-L824 HydrophobicContact CE2-CD1 4.01Å
763R88.4Confident75.3Confident48 Ų4867.9 Ų67.918%0.18140%0.401CS..Hα-helixtrans-65.1-29.6178.1-73.7-177.6-68.7164.66.2112.7S756 S759 R760 L765 K766 E816 V820S756-R763 VanDerWaalsContact C-NH2 3.25Å; S756-R763 PolarHBondContact O-NH2 2.98Å; S756-R763 PolarHBondContact OG-NH1 3.22Å; S756-R763 PolarHBondContact OG-NH2 2.7Å; S759-R763 WeakPolarHBondContact O-CB 3.41Å; S759-R763 VanDerWaalsContact O-CG 3.29Å; S759-R763 WeakPolarHBondContact O-CG 3.33Å; S759-R763 PolarHBondContact O-N 2.74Å; S759-R763 PolarHBondContact O-NE 3.12Å; S759-R763 PolarHBondContact OG-NE 3.21Å; R760-R763 PolarHBondContact O-N 3.06Å; R763-L765 PolarHBondContact O-N 3.26Å; R763-K766 WeakPolarHBondContact O-CB 3.13Å; R763-K766 PolarHBondContact O-N 3.21Å; R763-E816 WeakPolarHBondContact CD-OE2 3.5Å; R763-E816 HydrophobicContact CG-CG 4.38Å; R763-E816 IonicContact CZ-OE2 2.88Å; R763-E816 IonicContact NE-OE2 2.94Å; R763-E816 IonicContact NH1-OE2 2.66Å; R763-E816 PolarHBondContact NH1-OE2 3.19Å; R763-V820 HydrophobicContact CG-CG2 4.42Å
764N86.4Confident72.9Confident122 Ų12276.5 Ų76.565%0.65242%0.424SS*.THydrogen-bonded Turntrans-69.1-12.9174.9-67.5-31.8000113.5R760 D761 Y762 K766R760-N764 PolarHBondContact O-N 3.48Å; R760-N764 PolarHBondContact O-ND2 3.31Å; D761-N764 WeakPolarHBondContact O-CB 3.35Å; D761-N764 PolarHBondContact O-N 2.9Å; Y762-N764 VanDerWaalsContact C-N 3.25Å; Y762-N764 PolarHBondContact O-N 3.33Å; N764-K766 VanDerWaalsContact C-N 3.26Å; N764-K766 PolarHBondContact O-N 3.41Å
765L84.5Confident70.7Confident33 Ų3386.2 Ų86.217%0.17347%0.466CS..THydrogen-bonded Turntrans-76.9-11.1175.9-58.7178000113.3Y762 R763 T781 I784 I785 L824Y762-L765 HydrophobicContact CD2-CD1 4.17Å; Y762-L765 VanDerWaalsContact O-CB 3.26Å; Y762-L765 WeakPolarHBondContact O-CB 3.21Å; Y762-L765 WeakPolarHBondContact O-CG 3.45Å; Y762-L765 PolarHBondContact O-N 2.91Å; R763-L765 PolarHBondContact O-N 3.26Å; L765-T781 HydrophobicContact CD1-CG2 3.93Å; L765-T781 HydrophobicContact CD2-CG2 3.94Å; L765-I784 HydrophobicContact CD1-CB 4.43Å; L765-I784 HydrophobicContact CD1-CG2 3.97Å; L765-I785 HydrophobicContact CD1-CG1 3.99Å; L765-L824 HydrophobicContact CB-CD1 4.12Å; L765-L824 HydrophobicContact CB-CD2 4.37Å
766K75.2Confident68.9Low111 Ų11190.5 Ų90.548%0.48349%0.487SS..SBendtrans-53.2126.3-177.9-171176.4-177.3173.80110.6R763 N764 S768 V820R763-K766 WeakPolarHBondContact O-CB 3.13Å; R763-K766 PolarHBondContact O-N 3.21Å; N764-K766 VanDerWaalsContact C-N 3.26Å; N764-K766 PolarHBondContact O-N 3.41Å; K766-S768 PolarHBondContact O-N 3.24Å; K766-V820 HydrophobicContact CB-CG2 4.31Å; K766-V820 HydrophobicContact CD-CG2 4.3Å; K766-V820 HydrophobicContact CG-CG2 4.5Å
767P62.6Low67.6Low82 Ų8291.6 Ų91.653%0.53249%0.493SS..  trans-61.5109.3178-18.529.6000109.6L824P767-L824 HydrophobicContact CG-CD2 4.29Å
768S52Low66.4Low79 Ų7995.8 Ų95.855%0.55251%0.511SS*.  trans-77.5127.7172.2179.50000108.7K766 V770K766-S768 PolarHBondContact O-N 3.24Å; S768-V770 PolarHBondContact O-N 3.2Å; S768-V770 PolarHBondContact OG-N 2.68Å
769A46.1Very low65.5Low109 Ų10999.7 Ų99.790%0.90153%0.532SS*.THydrogen-bonded Turntrans-62.2-2175.800000114.1
770V39.4Very low64.8Low133 Ų133103.4 Ų103.481%0.80655%0.552SS**THydrogen-bonded Turntrans-128.24.8-167.2-167.40000114.2S768S768-V770 PolarHBondContact O-N 3.2Å; S768-V770 PolarHBondContact OG-N 2.68Å
771A37Very low64.6Low68 Ų68100.2 Ų100.256%0.56254%0.542SS*.SBendtrans-140.4129.7177.500000113.3Q773A771-Q773 PolarHBondContact O-N 3.28Å
772P40.8Very low64.5Low127 Ų12798.5 Ų98.583%0.82553%0.531SS*.  trans-68.1119.1171.824.9-23.4000108.9R774P772-R774 PolarHBondContact O-N 3.4Å
773Q43.8Very low64.3Low174 Ų174101.8 Ų101.881%0.81355%0.551SS**  trans13.5101.6162.9-65.8175.9-16.600115.1A771 K775A771-Q773 PolarHBondContact O-N 3.28Å; Q773-K775 PolarHBondContact O-N 2.89Å
774R44.5Very low64.4Low246 Ų246100.9 Ų100.993%0.92855%0.549SS*.  trans-55.6114.3150.4-101.6-178.8176168-1105.7P772 M776P772-R774 PolarHBondContact O-N 3.4Å; R774-M776 PolarHBondContact O-N 3.02Å
775K48.1Very low64.6Low204 Ų20495.1 Ų95.189%0.88752%0.518SS*.  trans-65.872.6171.8-71.9-177.9175.5-1780109.1Q773Q773-K775 PolarHBondContact O-N 2.89Å
776M57.3Low64.9Low91 Ų9196.1 Ų96.145%0.44852%0.522SS..  trans-76137.4153.8-84.1-172.574.300107.3R774 L778 D780 I784R774-M776 PolarHBondContact O-N 3.02Å; M776-L778 PolarHBondContact O-N 3.15Å; M776-D780 HydrophobicContact CE-CB 3.81Å; M776-I784 HydrophobicContact CE-CD1 3.8Å
777P66.7Low65.6Low72 Ų7293.4 Ų93.447%0.46851%0.511SS..  trans-50.3139.9169.2-24.934.2000110.6D779 D780 T781P777-D779 PolarHBondContact O-N 3.45Å; P777-D780 HydrophobicContact CB-CB 4.44Å; P777-D780 VanDerWaalsContact CD-OD2 3.32Å; P777-D780 WeakPolarHBondContact CD-OD2 3.44Å; P777-D780 VanDerWaalsContact CG-OD2 3.32Å; P777-D780 WeakPolarHBondContact CG-OD2 3.15Å; P777-D780 PolarHBondContact O-N 3.42Å; P777-T781 PolarHBondContact O-N 3.16Å; P777-T781 PolarHBondContact O-OG1 3.2Å
778L68.4Low67.1Low113 Ų11390 Ų9059%0.59249%0.489SS*.Hα-helixtrans-56.2-37.2178.2-80158.9000111M776 T781 K782M776-L778 PolarHBondContact O-N 3.15Å; L778-T781 WeakPolarHBondContact O-CB 3.33Å; L778-T781 PolarHBondContact O-N 3.32Å; L778-K782 WeakPolarHBondContact O-CG 3.38Å; L778-K782 PolarHBondContact O-N 3.4Å
779D73.3Confident69.1Low114 Ų11486.2 Ų86.261%0.6146%0.463SS*.Hα-helixtrans-64.5-42.6179.1-64-24.5000112.8P777 T781 K782 V783P777-D779 PolarHBondContact O-N 3.45Å; D779-T781 PolarHBondContact O-N 3.39Å; D779-K782 WeakPolarHBondContact O-CB 3.24Å; D779-K782 PolarHBondContact O-N 3.17Å; D779-V783 WeakPolarHBondContact O-CG2 3.42Å; D779-V783 PolarHBondContact O-N 3.17Å
780D78.4Confident71.4Confident80 Ų8082.6 Ų82.643%0.42843%0.431SS..Hα-helixtrans-63.3-34.3176.6-67.2-20.1000111.4M776 P777 I784M776-D780 HydrophobicContact CE-CB 3.81Å; P777-D780 HydrophobicContact CB-CB 4.44Å; P777-D780 VanDerWaalsContact CD-OD2 3.32Å; P777-D780 WeakPolarHBondContact CD-OD2 3.44Å; P777-D780 VanDerWaalsContact CG-OD2 3.32Å; P777-D780 WeakPolarHBondContact CG-OD2 3.15Å; P777-D780 PolarHBondContact O-N 3.42Å; D780-I784 VanDerWaalsContact O-CG1 3.32Å; D780-I784 WeakPolarHBondContact O-CG1 3.46Å; D780-I784 PolarHBondContact O-N 2.92Å
781T83.7Confident74Confident19 Ų1976.5 Ų76.512%0.11739%0.394CS..Hα-helixtrans-68.4-43.5177.1-53.80000111.1L765 P777 L778 D779 V783 I784 I785 F828L765-T781 HydrophobicContact CD1-CG2 3.93Å; L765-T781 HydrophobicContact CD2-CG2 3.94Å; P777-T781 PolarHBondContact O-N 3.16Å; P777-T781 PolarHBondContact O-OG1 3.2Å; L778-T781 WeakPolarHBondContact O-CB 3.33Å; L778-T781 PolarHBondContact O-N 3.32Å; D779-T781 PolarHBondContact O-N 3.39Å; T781-V783 PolarHBondContact O-N 3.49Å; T781-I784 PolarHBondContact O-N 3.18Å; T781-I785 HydrophobicContact CG2-CD1 4.19Å; T781-I785 VanDerWaalsContact O-CG1 3.31Å; T781-I785 WeakPolarHBondContact O-CG1 3.38Å; T781-I785 PolarHBondContact O-N 3.34Å; T781-I785 VanDerWaalsContact O-N 3.13Å; T781-F828 HydrophobicContact CG2-CZ 3.84Å
782K86.2Confident76.8Confident43 Ų4373.3 Ų73.319%0.18737%0.367CS..Hα-helixtrans-59.4-46.3176.1-70.2-177.9165.3-154.50112L778 D779 I784 I785 H786 D833 V834L778-K782 WeakPolarHBondContact O-CG 3.38Å; L778-K782 PolarHBondContact O-N 3.4Å; D779-K782 WeakPolarHBondContact O-CB 3.24Å; D779-K782 PolarHBondContact O-N 3.17Å; K782-I784 VanDerWaalsContact C-N 3.33Å; K782-I784 PolarHBondContact O-N 3.08Å; K782-I785 PolarHBondContact O-N 3.22Å; K782-I785 VanDerWaalsContact O-N 3.14Å; K782-H786 PolarHBondContact O-CD2 2.78Å; K782-H786 PolarHBondContact O-N 3.22Å; K782-D833 IonicContact NZ-OD1 2.78Å; K782-D833 PolarHBondContact NZ-OD1 2.86Å; K782-D833 IonicContact NZ-OD2 2.93Å; K782-D833 PolarHBondContact NZ-OD2 3.23Å; K782-V834 HydrophobicContact CB-CG2 4.36Å; K782-V834 HydrophobicContact CD-CG2 4.24Å; K782-V834 HydrophobicContact CG-CG2 3.74Å
783V88.1Confident79.4Confident70 Ų7068.6 Ų68.642%0.42433%0.334SS..Hα-helixtrans-57.8-47179.21730000110.4D779 T781 I785 H786 Q787D779-V783 WeakPolarHBondContact O-CG2 3.42Å; D779-V783 PolarHBondContact O-N 3.17Å; T781-V783 PolarHBondContact O-N 3.49Å; V783-I785 VanDerWaalsContact C-N 3.31Å; V783-I785 PolarHBondContact O-N 3.2Å; V783-H786 PolarHBondContact O-N 3.17Å; V783-Q787 HydrophobicContact CG1-CG 4.13Å; V783-Q787 WeakPolarHBondContact O-CB 3.36Å; V783-Q787 VanDerWaalsContact O-CG 3.26Å; V783-Q787 WeakPolarHBondContact O-CG 3.18Å; V783-Q787 PolarHBondContact O-N 3.28Å
784I89.7Confident81.9Confident29 Ų2961.1 Ų61.115%0.14930%0.3CS..Hα-helixtrans-59.6-40.9177.9-67.5166.5000111.6D761 L765 M776 D780 T781 K782 T788D761-I784 HydrophobicContact CB-CG2 4.34Å; L765-I784 HydrophobicContact CD1-CB 4.43Å; L765-I784 HydrophobicContact CD1-CG2 3.97Å; M776-I784 HydrophobicContact CE-CD1 3.8Å; D780-I784 VanDerWaalsContact O-CG1 3.32Å; D780-I784 WeakPolarHBondContact O-CG1 3.46Å; D780-I784 PolarHBondContact O-N 2.92Å; T781-I784 PolarHBondContact O-N 3.18Å; K782-I784 VanDerWaalsContact C-N 3.33Å; K782-I784 PolarHBondContact O-N 3.08Å; I784-T788 VanDerWaalsContact O-CB 3.29Å; I784-T788 WeakPolarHBondContact O-CB 3.23Å; I784-T788 PolarHBondContact O-N 3.19Å; I784-T788 PolarHBondContact O-OG1 2.52Å
785I90.9Very high84.4Confident0 Ų049.4 Ų49.40%026%0.256CS..Hα-helixtrans-63.9-57179.3-63.9168.2000110.3Y762 L765 T781 K782 V783 Q787 T788 L789 F828 V834 M838Y762-I785 HydrophobicContact CD2-CG1 4.27Å; Y762-I785 HydrophobicContact CE2-CB 4.36Å; Y762-I785 HydrophobicContact CE2-CG1 3.96Å; Y762-I785 HydrophobicContact CE2-CG2 4.24Å; L765-I785 HydrophobicContact CD1-CG1 3.99Å; T781-I785 HydrophobicContact CG2-CD1 4.19Å; T781-I785 VanDerWaalsContact O-CG1 3.31Å; T781-I785 WeakPolarHBondContact O-CG1 3.38Å; T781-I785 PolarHBondContact O-N 3.34Å; T781-I785 VanDerWaalsContact O-N 3.13Å; K782-I785 PolarHBondContact O-N 3.22Å; K782-I785 VanDerWaalsContact O-N 3.14Å; V783-I785 VanDerWaalsContact C-N 3.31Å; V783-I785 PolarHBondContact O-N 3.2Å; I785-Q787 VanDerWaalsContact C-N 3.31Å; I785-Q787 PolarHBondContact O-N 3.01Å; I785-T788 PolarHBondContact O-N 3.49Å; I785-L789 HydrophobicContact CG2-CD1 3.6Å; I785-L789 HydrophobicContact CG2-CG 4.13Å; I785-L789 WeakPolarHBondContact O-CB 3.5Å; I785-L789 WeakPolarHBondContact O-CG 3.49Å; I785-L789 PolarHBondContact O-N 2.84Å; I785-F828 HydrophobicContact CD1-CD2 4.23Å; I785-F828 HydrophobicContact CD1-CE1 4.22Å; I785-F828 HydrophobicContact CD1-CE2 3.77Å; I785-F828 HydrophobicContact CD1-CZ 3.77Å; I785-V834 HydrophobicContact CD1-CG1 3.81Å; I785-V834 HydrophobicContact CG2-CG1 3.93Å; I785-M838 HydrophobicContact CG2-CG 4.43Å
786H90.6Very high86.6Confident54 Ų5439.7 Ų39.725%0.2521%0.213CC..Hα-helixtrans-56.7-46.7179.7-78.8-72.7000112K782 V783 T788 S790 D833 E837K782-H786 PolarHBondContact O-CD2 2.78Å; K782-H786 PolarHBondContact O-N 3.22Å; V783-H786 PolarHBondContact O-N 3.17Å; H786-T788 VanDerWaalsContact C-N 3.33Å; H786-T788 PolarHBondContact O-N 3.39Å; H786-S790 VanDerWaalsContact O-CB 3.25Å; H786-S790 WeakPolarHBondContact O-CB 3.41Å; H786-S790 PolarHBondContact O-N 3.17Å; H786-S790 PolarHBondContact O-OG 2.96Å; H786-D833 PolarHBondContact CE1-O 3.49Å; H786-D833 VanDerWaalsContact CE1-O 3.25Å; H786-E837 IonicContact CE1-OE2 3.38Å; H786-E837 IonicContact ND1-OE2 3.72Å; H786-E837 PolarHBondContact ND1-OE2 2.86Å
787Q90.3Very high88.4Confident54 Ų5440.8 Ų40.825%0.25222%0.217SC..Hα-helixtrans-64.8-33.8-178.2-85.4-170.54.200114.4R713 V783 I785 S790R713-Q787 VanDerWaalsContact CZ-CB 3.5Å; R713-Q787 VanDerWaalsContact NH1-CB 3.33Å; R713-Q787 VanDerWaalsContact NH1-OE1 3.15Å; R713-Q787 PolarHBondContact NH2-O 3.01Å; V783-Q787 HydrophobicContact CG1-CG 4.13Å; V783-Q787 WeakPolarHBondContact O-CB 3.36Å; V783-Q787 VanDerWaalsContact O-CG 3.26Å; V783-Q787 WeakPolarHBondContact O-CG 3.18Å; V783-Q787 PolarHBondContact O-N 3.28Å; I785-Q787 VanDerWaalsContact C-N 3.31Å; I785-Q787 PolarHBondContact O-N 3.01Å; Q787-S790 PolarHBondContact O-OG 3.45Å
788T93.3Very high89.7Confident11 Ų1139.9 Ų39.97%0.06721%0.208CC..Hα-helixtrans-83.2-48.2179.6-53.50000110.1Y762 I784 I785 H786 S790 V791 L792Y762-T788 HydrophobicContact CD1-CG2 4.32Å; Y762-T788 HydrophobicContact CD2-CG2 4.5Å; Y762-T788 HydrophobicContact CG-CG2 3.96Å; I784-T788 VanDerWaalsContact O-CB 3.29Å; I784-T788 WeakPolarHBondContact O-CB 3.23Å; I784-T788 PolarHBondContact O-N 3.19Å; I784-T788 PolarHBondContact O-OG1 2.52Å; I785-T788 PolarHBondContact O-N 3.49Å; H786-T788 VanDerWaalsContact C-N 3.33Å; H786-T788 PolarHBondContact O-N 3.39Å; T788-S790 PolarHBondContact O-N 3.02Å; T788-V791 PolarHBondContact O-N 3.27Å; T788-L792 HydrophobicContact CG2-CD1 4.02Å; T788-L792 HydrophobicContact CG2-CG 4.21Å; T788-L792 WeakPolarHBondContact O-CG 3.41Å; T788-L792 PolarHBondContact O-N 2.82Å
789L94.6Very high90.9Very high0 Ų034.5 Ų34.50%018%0.18CC..Hα-helixtrans-64.5-40.6-176.2-68-172.8000112.2Y762 I785 V791 L792 E793 E837 M838 F841Y762-L789 HydrophobicContact CE1-CD2 4.37Å; Y762-L789 HydrophobicContact CE2-CD2 4.32Å; Y762-L789 HydrophobicContact CE2-CG 4.35Å; I785-L789 HydrophobicContact CG2-CD1 3.6Å; I785-L789 HydrophobicContact CG2-CG 4.13Å; I785-L789 WeakPolarHBondContact O-CB 3.5Å; I785-L789 WeakPolarHBondContact O-CG 3.49Å; I785-L789 PolarHBondContact O-N 2.84Å; L789-V791 VanDerWaalsContact C-N 3.26Å; L789-V791 PolarHBondContact O-N 3.31Å; L789-L792 PolarHBondContact O-N 3.44Å; L789-L792 VanDerWaalsContact O-N 3.12Å; L789-E793 WeakPolarHBondContact O-CB 3.23Å; L789-E793 PolarHBondContact O-N 2.95Å; L789-E837 HydrophobicContact CB-CG 3.89Å; L789-E837 HydrophobicContact CD1-CG 4.17Å; L789-M838 HydrophobicContact CD1-CB 4.41Å; L789-M838 HydrophobicContact CD1-CG 3.72Å; L789-F841 HydrophobicContact CD2-CB 4.36Å; L789-F841 HydrophobicContact CD2-CD1 3.72Å; L789-F841 HydrophobicContact CD2-CE1 4.06Å; L789-F841 HydrophobicContact CD2-CG 3.97Å
790S94.4Very high91.6Very high33 Ų3331.4 Ų31.423%0.23117%0.167CC..Hα-helixtrans-55-39.4174.252.90000113.4H786 Q787 T788 D794 E837H786-S790 VanDerWaalsContact O-CB 3.25Å; H786-S790 WeakPolarHBondContact O-CB 3.41Å; H786-S790 PolarHBondContact O-N 3.17Å; H786-S790 PolarHBondContact O-OG 2.96Å; Q787-S790 PolarHBondContact O-OG 3.45Å; T788-S790 PolarHBondContact O-N 3.02Å; S790-D794 WeakPolarHBondContact O-CB 3.36Å; S790-D794 PolarHBondContact O-N 3.37Å; S790-E837 PolarHBondContact N-OE1 3.41Å
791V94.7Very high92Very high5 Ų531.2 Ų31.23%0.0318%0.184CC..Hα-helixtrans-73-42.8176.81760000111.5Q719 V720 C723 L758 T788 L789 I795Q719-V791 HydrophobicContact CG-CG2 4.44Å; V720-V791 HydrophobicContact CG2-CG2 3.92Å; C723-V791 HydrophobicContact CB-CG1 3.59Å; L758-V791 HydrophobicContact CD1-CG1 4.12Å; T788-V791 PolarHBondContact O-N 3.27Å; L789-V791 VanDerWaalsContact C-N 3.26Å; L789-V791 PolarHBondContact O-N 3.31Å; V791-I795 HydrophobicContact CG1-CD1 4.02Å; V791-I795 VanDerWaalsContact O-CG1 3.3Å; V791-I795 WeakPolarHBondContact O-CG1 3.37Å; V791-I795 PolarHBondContact O-N 2.85Å; V791-I795 VanDerWaalsContact O-N 3.15Å
792L95.8Very high92.4Very high0 Ų033.3 Ų33.30%019%0.193CC..Hα-helixtrans-70.5-38.1-179-61-172.6000112I755 T788 L789 I795 V796 L814 F841I755-L792 HydrophobicContact CD1-CD2 4.13Å; I755-L792 HydrophobicContact CG2-CD2 4.38Å; T788-L792 HydrophobicContact CG2-CD1 4.02Å; T788-L792 HydrophobicContact CG2-CG 4.21Å; T788-L792 WeakPolarHBondContact O-CG 3.41Å; T788-L792 PolarHBondContact O-N 2.82Å; L789-L792 PolarHBondContact O-N 3.44Å; L789-L792 VanDerWaalsContact O-N 3.12Å; L792-I795 PolarHBondContact O-N 2.9Å; L792-V796 VanDerWaalsContact O-CG2 3.27Å; L792-V796 WeakPolarHBondContact O-CG2 3.31Å; L792-V796 PolarHBondContact O-N 3.2Å; L792-V796 VanDerWaalsContact O-N 3.1Å; L792-L814 HydrophobicContact CB-CD2 4.18Å; L792-L814 HydrophobicContact CD1-CD2 4.03Å; L792-L814 HydrophobicContact CD2-CD2 3.66Å; L792-L814 HydrophobicContact CG-CD2 4.15Å; L792-F841 HydrophobicContact CB-CD2 4.31Å; L792-F841 HydrophobicContact CB-CE2 3.67Å; L792-F841 HydrophobicContact CB-CZ 4.2Å; L792-F841 HydrophobicContact CD1-CZ 4.42Å
793E95.7Very high92.4Very high28 Ų2833 Ų3313%0.13120%0.196CC..Hα-helixtrans-57.9-51.4173.5-179.2172176.300110.5L789 I795 V796 E797 S840 F841 T844L789-E793 WeakPolarHBondContact O-CB 3.23Å; L789-E793 PolarHBondContact O-N 2.95Å; E793-I795 VanDerWaalsContact C-N 3.33Å; E793-I795 PolarHBondContact O-N 2.92Å; E793-V796 PolarHBondContact O-N 2.91Å; E793-V796 VanDerWaalsContact O-N 3.1Å; E793-E797 PolarHBondContact O-N 2.89Å; E793-S840 WeakPolarHBondContact OE1-CB 3.46Å; E793-S840 PolarHBondContact OE1-OG 3.45Å; E793-S840 VanDerWaalsContact OE2-CB 3.27Å; E793-S840 WeakPolarHBondContact OE2-CB 3.32Å; E793-S840 PolarHBondContact OE2-OG 3.43Å; E793-F841 HydrophobicContact CB-CD2 4.15Å; E793-T844 HydrophobicContact CG-CG2 4.04Å; E793-T844 WeakPolarHBondContact O-CG2 3.25Å; E793-T844 PolarHBondContact OE1-OG1 3.27Å
794D95.7Very high92.6Very high18 Ų1833.4 Ų33.410%0.09620%0.199CC..Hα-helixtrans-57-44.1178.1-172.679.9000113.1V720 R724 S790 V796 E797 N798V720-D794 HydrophobicContact CG1-CB 3.61Å; V720-D794 WeakPolarHBondContact CG1-OD2 3.29Å; R724-D794 WeakPolarHBondContact CB-OD2 3.37Å; R724-D794 WeakPolarHBondContact CG-OD2 3.24Å; R724-D794 IonicContact CZ-OD1 3.86Å; R724-D794 VanDerWaalsContact CZ-OD1 3.31Å; R724-D794 IonicContact CZ-OD2 2.85Å; R724-D794 IonicContact NE-OD1 3.26Å; R724-D794 PolarHBondContact NE-OD1 3.33Å; R724-D794 IonicContact NE-OD2 3.89Å; R724-D794 PolarHBondContact NE-OD2 3.43Å; R724-D794 IonicContact NH2-OD1 3.97Å; R724-D794 PolarHBondContact NH2-OD1 2.97Å; R724-D794 IonicContact NH2-OD2 3.81Å; S790-D794 WeakPolarHBondContact O-CB 3.36Å; S790-D794 PolarHBondContact O-N 3.37Å; D794-V796 VanDerWaalsContact C-N 3.32Å; D794-V796 PolarHBondContact O-N 3.48Å; D794-E797 PolarHBondContact O-N 3.11Å; D794-N798 VanDerWaalsContact O-CB 3.3Å; D794-N798 WeakPolarHBondContact O-CB 3.49Å; D794-N798 PolarHBondContact O-N 2.54Å; D794-N798 VanDerWaalsContact O-N 3.12Å
795I95.9Very high92.6Very high0 Ų036.1 Ų36.10%021%0.209CC..Hα-helixtrans-61.3-41.8177.3-72.2168.6000111S727 I755 V791 L792 E793 I799S727-I795 WeakPolarHBondContact OG-CG2 3.38Å; I755-I795 HydrophobicContact CD1-CD1 3.8Å; V791-I795 HydrophobicContact CG1-CD1 4.02Å; V791-I795 VanDerWaalsContact O-CG1 3.3Å; V791-I795 WeakPolarHBondContact O-CG1 3.37Å; V791-I795 PolarHBondContact O-N 2.85Å; V791-I795 VanDerWaalsContact O-N 3.15Å; L792-I795 PolarHBondContact O-N 2.9Å; E793-I795 VanDerWaalsContact C-N 3.33Å; E793-I795 PolarHBondContact O-N 2.92Å; I795-I799 VanDerWaalsContact O-CG1 3.26Å; I795-I799 WeakPolarHBondContact O-CG1 3.38Å
796V95.8Very high92.8Very high0 Ų036.1 Ų36.10%021%0.209CC..Hα-helixtrans-71.3-43.5-179.5174.60000111.5L792 E793 D794 N798 I799 S800 L814 F841 T844 L845 L849L792-V796 VanDerWaalsContact O-CG2 3.27Å; L792-V796 WeakPolarHBondContact O-CG2 3.31Å; L792-V796 PolarHBondContact O-N 3.2Å; L792-V796 VanDerWaalsContact O-N 3.1Å; E793-V796 PolarHBondContact O-N 2.91Å; E793-V796 VanDerWaalsContact O-N 3.1Å; D794-V796 VanDerWaalsContact C-N 3.32Å; D794-V796 PolarHBondContact O-N 3.48Å; V796-N798 VanDerWaalsContact C-N 3.27Å; V796-N798 PolarHBondContact O-N 3.4Å; V796-I799 WeakPolarHBondContact O-CG1 3.26Å; V796-I799 PolarHBondContact O-N 2.82Å; V796-S800 PolarHBondContact O-N 3.31Å; V796-L814 HydrophobicContact CG2-CD1 3.31Å; V796-F841 HydrophobicContact CG2-CE2 4.42Å; V796-T844 HydrophobicContact CB-CG2 3.94Å; V796-T844 HydrophobicContact CG1-CG2 3.81Å; V796-L845 HydrophobicContact CG1-CD2 4.17Å; V796-L845 HydrophobicContact CG2-CD2 3.95Å; V796-L849 HydrophobicContact CB-CD1 4.47Å; V796-L849 HydrophobicContact CG1-CD1 3.85Å; V796-L849 HydrophobicContact CG1-CG 3.98Å; V796-L849 HydrophobicContact CG2-CD1 3.87Å
797E94.9Very high93Very high114 Ų11436.2 Ų36.253%0.53321%0.208SC..Hα-helixtrans-57.6-45179.3-173.9170.4-161.600110.7E793 D794 I799 S800 T844E793-E797 PolarHBondContact O-N 2.89Å; D794-E797 PolarHBondContact O-N 3.11Å; E797-I799 VanDerWaalsContact C-N 3.26Å; E797-I799 PolarHBondContact O-N 3.1Å; E797-S800 WeakPolarHBondContact O-CB 3.18Å; E797-S800 PolarHBondContact O-N 2.85Å; E797-S800 PolarHBondContact O-OG 3.32Å; E797-T844 HydrophobicContact CB-CG2 3.77Å
798N92.5Very high93.2Very high52 Ų5237.4 Ų37.428%0.27821%0.213SC..Hα-helixtrans-66.9-21-176.9-160.830.9000114.7R724 N728 D794 V796R724-N798 WeakPolarHBondContact CG-ND2 3.37Å; N728-N798 PolarHBondContact ND2-ND2 3.33Å; N728-N798 PolarHBondContact OD1-ND2 3.43Å; D794-N798 VanDerWaalsContact O-CB 3.3Å; D794-N798 WeakPolarHBondContact O-CB 3.49Å; D794-N798 PolarHBondContact O-N 2.54Å; D794-N798 VanDerWaalsContact O-N 3.12Å; V796-N798 VanDerWaalsContact C-N 3.27Å; V796-N798 PolarHBondContact O-N 3.4Å
799I93.8Very high93.3Very high0 Ų037 Ų370%021%0.211CC..Hα-helixtrans-106.42.1178.759.684.8000113.4L731 I795 V796 E797 G801 E802 R807 C810 L849L731-I799 HydrophobicContact CB-CG2 4.32Å; L731-I799 HydrophobicContact CD1-CG2 3.86Å; I795-I799 VanDerWaalsContact O-CG1 3.26Å; I795-I799 WeakPolarHBondContact O-CG1 3.38Å; V796-I799 WeakPolarHBondContact O-CG1 3.26Å; V796-I799 PolarHBondContact O-N 2.82Å; E797-I799 VanDerWaalsContact C-N 3.26Å; E797-I799 PolarHBondContact O-N 3.1Å; I799-G801 VanDerWaalsContact C-N 3.29Å; I799-G801 PolarHBondContact O-N 3.11Å; I799-E802 HydrophobicContact CB-CB 4.5Å; I799-E802 WeakPolarHBondContact O-CB 3.36Å; I799-E802 PolarHBondContact O-N 2.85Å; I799-E802 VanDerWaalsContact O-N 3.1Å; I799-R807 HydrophobicContact CD1-CG 3.85Å; I799-R807 WeakPolarHBondContact O-CG 3.49Å; I799-C810 HydrophobicContact CD1-CB 3.92Å; I799-C810 HydrophobicContact CG1-CB 4.16Å; I799-L849 HydrophobicContact CD1-CD1 4.24Å; I799-L849 HydrophobicContact CD1-CD2 3.55Å; I799-L849 HydrophobicContact CD1-CG 3.98Å
800S88.8Confident93.4Very high49 Ų4937 Ų3734%0.34321%0.211SC..THydrogen-bonded Turntrans-58.9-37.7-176.461.50000113.2V796 E797V796-S800 PolarHBondContact O-N 3.31Å; E797-S800 WeakPolarHBondContact O-CB 3.18Å; E797-S800 PolarHBondContact O-N 2.85Å; E797-S800 PolarHBondContact O-OG 3.32Å
801G87.2Confident93.5Very high76 Ų7636.5 Ų36.578%0.78420%0.204SC*.THydrogen-bonded Turntrans-87.3-1.5177.600000115.6I799I799-G801 VanDerWaalsContact C-N 3.29Å; I799-G801 PolarHBondContact O-N 3.11Å
802E90.7Very high93.5Very high64 Ų6441.8 Ų41.830%0.29923%0.228SC..SBendtrans-89.3175.9-170.1-70.3-66.415300114L732 I799 R807L732-E802 HydrophobicContact CD2-CG 3.6Å; I799-E802 HydrophobicContact CB-CB 4.5Å; I799-E802 WeakPolarHBondContact O-CB 3.36Å; I799-E802 PolarHBondContact O-N 2.85Å; I799-E802 VanDerWaalsContact O-N 3.1Å; E802-R807 PolarHBondContact O-NE 2.72Å
803S88.1Confident93.5Very high37 Ų3742.7 Ų42.726%0.25923%0.234SC..  trans-52150.1-179.2850000112.9K805 S806 R807S803-K805 PolarHBondContact O-N 3.17Å; S803-S806 PolarHBondContact O-N 3.41Å; S803-S806 PolarHBondContact OG-N 3.34Å; S803-S806 PolarHBondContact OG-OG 3.19Å; S803-R807 PolarHBondContact O-N 3.27Å; S803-R807 VanDerWaalsContact O-N 3.13Å
804T90.3Very high93.5Very high77 Ų7741.3 Ų41.347%0.47223%0.228SC..Hα-helixtrans-56.7-34.1177.2-54.40000111.9R807 Q808T804-R807 PolarHBondContact O-N 3.13Å; T804-Q808 HydrophobicContact CG2-CG 4.47Å; T804-Q808 WeakPolarHBondContact O-CB 3.5Å; T804-Q808 VanDerWaalsContact O-CG 3.25Å; T804-Q808 WeakPolarHBondContact O-CG 3.48Å; T804-Q808 PolarHBondContact O-N 3.14Å
805K91.7Very high93.5Very high86 Ų8644.7 Ų44.737%0.37424%0.243SC..Hα-helixtrans-68.6-45.2-179.8-170.464.5176.1-179.20111.9W744 S803 R807 Q808 I809W744-K805 HydrophobicContact CD2-CG 4.16Å; W744-K805 HydrophobicContact CG-CG 4.27Å; S803-K805 PolarHBondContact O-N 3.17Å; K805-R807 VanDerWaalsContact C-N 3.32Å; K805-R807 PolarHBondContact O-N 3.19Å; K805-Q808 WeakPolarHBondContact O-CB 3.19Å; K805-Q808 PolarHBondContact O-N 2.78Å; K805-I809 HydrophobicContact CG-CD1 4.25Å; K805-I809 WeakPolarHBondContact O-CG1 3.49Å; K805-I809 PolarHBondContact O-N 3.12Å
806S93.4Very high93.3Very high0 Ų049 Ų490%026%0.264CS..Hα-helixtrans-57.2-46.8174.4-55.80000111.1L731 S803 Q808 I809 C810L731-S806 WeakPolarHBondContact O-CB 3.31Å; L731-S806 PolarHBondContact O-OG 3.31Å; S803-S806 PolarHBondContact O-N 3.41Å; S803-S806 PolarHBondContact OG-N 3.34Å; S803-S806 PolarHBondContact OG-OG 3.19Å; S806-Q808 PolarHBondContact O-N 2.89Å; S806-I809 PolarHBondContact O-N 3.37Å; S806-C810 WeakPolarHBondContact O-CB 3.41Å; S806-C810 PolarHBondContact O-N 3.37Å
807R95.3Very high93.2Very high56 Ų5649.1 Ų49.121%0.21126%0.264CS..Hα-helixtrans-63.1-39.4176.3-71.1-171.9-77.1165.7-3113.2I799 E802 S803 T804 K805 Y811 G848 L849 Q852I799-R807 HydrophobicContact CD1-CG 3.85Å; I799-R807 WeakPolarHBondContact O-CG 3.49Å; E802-R807 PolarHBondContact O-NE 2.72Å; S803-R807 PolarHBondContact O-N 3.27Å; S803-R807 VanDerWaalsContact O-N 3.13Å; T804-R807 PolarHBondContact O-N 3.13Å; K805-R807 VanDerWaalsContact C-N 3.32Å; K805-R807 PolarHBondContact O-N 3.19Å; R807-Y811 WeakPolarHBondContact O-CB 3.5Å; R807-Y811 PolarHBondContact O-N 3.32Å; R807-G848 VanDerWaalsContact CD-O 3.29Å; R807-G848 WeakPolarHBondContact CD-O 3.4Å; R807-L849 HydrophobicContact CB-CD2 3.6Å; R807-L849 HydrophobicContact CG-CD2 3.91Å; R807-L849 WeakPolarHBondContact O-CD2 3.39Å; R807-Q852 HydrophobicContact CB-CG 4.16Å
808Q94.6Very high93.2Very high80 Ų8043.7 Ų43.737%0.37424%0.239SC..Hα-helixtrans-61.4-48.3174.7-78.7172.3-2.900111.9T804 K805 S806 Y811 Q812 Q852T804-Q808 HydrophobicContact CG2-CG 4.47Å; T804-Q808 WeakPolarHBondContact O-CB 3.5Å; T804-Q808 VanDerWaalsContact O-CG 3.25Å; T804-Q808 WeakPolarHBondContact O-CG 3.48Å; T804-Q808 PolarHBondContact O-N 3.14Å; K805-Q808 WeakPolarHBondContact O-CB 3.19Å; K805-Q808 PolarHBondContact O-N 2.78Å; S806-Q808 PolarHBondContact O-N 2.89Å; Q808-Y811 PolarHBondContact O-N 3.13Å; Q808-Q812 WeakPolarHBondContact O-CB 3.34Å; Q808-Q812 VanDerWaalsContact O-CG 3.23Å; Q808-Q812 WeakPolarHBondContact O-CG 3.5Å; Q808-Q812 PolarHBondContact O-N 3.31Å; Q808-Q852 HydrophobicContact CG-CG 4.14Å
809I95.7Very high93.3Very high3 Ų345.1 Ų45.12%0.01524%0.244CC..Hα-helixtrans-64.4-42.3180-65.1168.5000110.7L731 W744 H751 K805 S806 Q812 S813L731-I809 HydrophobicContact CD2-CB 3.96Å; L731-I809 HydrophobicContact CD2-CG2 3.59Å; W744-I809 HydrophobicContact CB-CD1 4.3Å; W744-I809 HydrophobicContact CD2-CD1 4.01Å; W744-I809 HydrophobicContact CE3-CD1 3.45Å; W744-I809 VanDerWaalsContact CE3-CD1 3.45Å; W744-I809 HydrophobicContact CG-CD1 4.39Å; W744-I809 HydrophobicContact CZ3-CD1 4.08Å; H751-I809 HydrophobicContact CB-CG2 4.44Å; K805-I809 HydrophobicContact CG-CD1 4.25Å; K805-I809 WeakPolarHBondContact O-CG1 3.49Å; K805-I809 PolarHBondContact O-N 3.12Å; S806-I809 PolarHBondContact O-N 3.37Å; I809-Q812 PolarHBondContact O-N 3.18Å; I809-S813 PolarHBondContact O-N 3.3Å; I809-S813 VanDerWaalsContact O-N 3.13Å; I809-S813 PolarHBondContact O-OG 3.37Å
810C96.6Very high93.2Very high0 Ų045.2 Ų45.20%024%0.244CC..Hα-helixtrans-57.6-53.9175.7-1720000111.1L731 I799 S806 Q812 S813 L814L731-C810 HydrophobicContact CD1-CB 3.79Å; L731-C810 HydrophobicContact CD2-CB 4.34Å; I799-C810 HydrophobicContact CD1-CB 3.92Å; I799-C810 HydrophobicContact CG1-CB 4.16Å; S806-C810 WeakPolarHBondContact O-CB 3.41Å; S806-C810 PolarHBondContact O-N 3.37Å; C810-Q812 PolarHBondContact O-N 3.3Å; C810-S813 PolarHBondContact O-N 3.08Å; C810-S813 VanDerWaalsContact O-N 3.15Å; C810-L814 WeakPolarHBondContact O-CG 3.35Å; C810-L814 PolarHBondContact O-N 3.33Å; C810-L814 VanDerWaalsContact SG-CD1 3.55Å
811Y96.1Very high93.5Very high22 Ų2242.9 Ų42.99%0.08623%0.228CC..Hα-helixtrans-61.9-43.1179.5178.9-110.9000112.8R807 Q808 S813 L814 Q815 Q852 M853R807-Y811 WeakPolarHBondContact O-CB 3.5Å; R807-Y811 PolarHBondContact O-N 3.32Å; Q808-Y811 PolarHBondContact O-N 3.13Å; Y811-S813 PolarHBondContact O-N 3.14Å; Y811-L814 CarbonylContact O-C 3.49Å; Y811-L814 PolarHBondContact O-N 3.11Å; Y811-L814 VanDerWaalsContact O-N 3.08Å; Y811-Q815 PolarHBondContact O-N 3.45Å; Y811-Q852 HydrophobicContact CD1-CB 4Å; Y811-Q852 WeakPolarHBondContact CD1-O 3.18Å; Y811-Q852 VanDerWaalsContact CE1-O 3.29Å; Y811-Q852 WeakPolarHBondContact CE1-O 3.44Å; Y811-Q852 HydrophobicContact CG-CB 3.96Å; Y811-M853 HydrophobicContact CD2-CG 3.87Å; Y811-M853 HydrophobicContact CE2-CB 4.19Å; Y811-M853 HydrophobicContact CE2-CG 3.42Å; Y811-M853 VanDerWaalsContact CE2-CG 3.42Å
812Q95.6Very high93.7Very high116 Ų11639.9 Ų39.954%0.54219%0.194SC..Hα-helixtrans-55.9-37.1176.4-78.5174.1-5.300112.2Q808 I809 C810Q808-Q812 WeakPolarHBondContact O-CB 3.34Å; Q808-Q812 VanDerWaalsContact O-CG 3.23Å; Q808-Q812 WeakPolarHBondContact O-CG 3.5Å; Q808-Q812 PolarHBondContact O-N 3.31Å; I809-Q812 PolarHBondContact O-N 3.18Å; C810-Q812 PolarHBondContact O-N 3.3Å
813S96.1Very high93.8Very high18 Ų1839.1 Ų39.113%0.12620%0.199CC..Hα-helixtrans-76.7-32.6178.8-53.20000112.5H751 I755 I809 C810 Y811H751-S813 WeakPolarHBondContact ND1-CB 3.35Å; H751-S813 PolarHBondContact ND1-OG 3.1Å; I755-S813 VanDerWaalsContact CG2-O 3.3Å; I755-S813 WeakPolarHBondContact CG2-O 2.87Å; I809-S813 PolarHBondContact O-N 3.3Å; I809-S813 VanDerWaalsContact O-N 3.13Å; I809-S813 PolarHBondContact O-OG 3.37Å; C810-S813 PolarHBondContact O-N 3.08Å; C810-S813 VanDerWaalsContact O-N 3.15Å; Y811-S813 PolarHBondContact O-N 3.14Å
814L95.4Very high93.9Very high0 Ų037.7 Ų37.70%019%0.188CC..Hα-helixtrans-86.7-15-178-73.2171.6000114.2I755 L792 V796 C810 Y811 E816 S817 V818 L849I755-L814 HydrophobicContact CD1-CD2 4.36Å; I755-L814 HydrophobicContact CG2-CD2 3.92Å; L792-L814 HydrophobicContact CB-CD2 4.18Å; L792-L814 HydrophobicContact CD1-CD2 4.03Å; L792-L814 HydrophobicContact CD2-CD2 3.66Å; L792-L814 HydrophobicContact CG-CD2 4.15Å; V796-L814 HydrophobicContact CG2-CD1 3.31Å; C810-L814 WeakPolarHBondContact O-CG 3.35Å; C810-L814 PolarHBondContact O-N 3.33Å; C810-L814 VanDerWaalsContact SG-CD1 3.55Å; Y811-L814 CarbonylContact O-C 3.49Å; Y811-L814 PolarHBondContact O-N 3.11Å; Y811-L814 VanDerWaalsContact O-N 3.08Å; L814-E816 VanDerWaalsContact C-N 3.26Å; L814-E816 PolarHBondContact O-N 2.69Å; L814-E816 VanDerWaalsContact O-N 3.09Å; L814-S817 WeakPolarHBondContact O-CA 3.36Å; L814-S817 WeakPolarHBondContact O-CB 3.24Å; L814-S817 PolarHBondContact O-N 3.12Å; L814-V818 HydrophobicContact CB-CG2 4.32Å; L814-V818 WeakPolarHBondContact O-CG2 3.47Å; L814-V818 PolarHBondContact O-N 3.37Å; L814-L849 HydrophobicContact CD1-CD1 4.11Å
815Q94.1Very high93.9Very high88 Ų8834 Ų3441%0.41117%0.165SC..Hα-helixtrans-49.8-43.8-167.8-173.8179.65.900113.3Y811 Q819Y811-Q815 PolarHBondContact O-N 3.45Å; Q815-Q819 WeakPolarHBondContact O-CG 3.44Å; Q815-Q819 PolarHBondContact O-N 3.45Å; Q815-Q819 VanDerWaalsContact O-N 3.15Å
816E92.9Very high93.8Very high92 Ų9232.7 Ų32.743%0.4317%0.166SC..Hα-helixtrans-67.3-43178.5-169.4179.7-17100112.1R763 L814 V818 Q819 V820R763-E816 WeakPolarHBondContact CD-OE2 3.5Å; R763-E816 HydrophobicContact CG-CG 4.38Å; R763-E816 IonicContact CZ-OE2 2.88Å; R763-E816 IonicContact NE-OE2 2.94Å; R763-E816 IonicContact NH1-OE2 2.66Å; R763-E816 PolarHBondContact NH1-OE2 3.19Å; L814-E816 VanDerWaalsContact C-N 3.26Å; L814-E816 PolarHBondContact O-N 2.69Å; L814-E816 VanDerWaalsContact O-N 3.09Å; E816-V818 PolarHBondContact O-N 2.91Å; E816-Q819 PolarHBondContact O-N 3.29Å; E816-V820 WeakPolarHBondContact O-CG2 3.33Å; E816-V820 PolarHBondContact O-N 3.07Å
817S94.4Very high93.5Very high1 Ų136.2 Ų36.21%0.00720%0.195CC..Hα-helixtrans-61.4-43176.9-51.80000111.3S759 L814 Q819 V820 S821S759-S817 WeakPolarHBondContact CB-OG 3.5Å; S759-S817 PolarHBondContact OG-OG 3.15Å; L814-S817 WeakPolarHBondContact O-CA 3.36Å; L814-S817 WeakPolarHBondContact O-CB 3.24Å; L814-S817 PolarHBondContact O-N 3.12Å; S817-Q819 VanDerWaalsContact C-N 3.34Å; S817-Q819 PolarHBondContact O-N 3.37Å; S817-V820 PolarHBondContact O-N 2.9Å; S817-S821 PolarHBondContact O-N 3.15Å; S817-S821 PolarHBondContact O-OG 3.04Å
818V94.8Very high93.1Very high0 Ų034.3 Ų34.30%019%0.188CC..Hα-helixtrans-62.5-40.8177.1-1760000111.7L814 E816 S821 L822 F841 F842 L845 F857L814-V818 HydrophobicContact CB-CG2 4.32Å; L814-V818 WeakPolarHBondContact O-CG2 3.47Å; L814-V818 PolarHBondContact O-N 3.37Å; E816-V818 PolarHBondContact O-N 2.91Å; V818-S821 PolarHBondContact O-N 3.31Å; V818-L822 PolarHBondContact O-N 3.2Å; V818-F841 HydrophobicContact CG2-CE1 4.2Å; V818-F841 HydrophobicContact CG2-CZ 4.04Å; V818-F842 HydrophobicContact CG1-CE1 4.1Å; V818-L845 HydrophobicContact CB-CD1 4.38Å; V818-L845 HydrophobicContact CG1-CD1 3.76Å; V818-L845 HydrophobicContact CG2-CD1 3.74Å; V818-L845 HydrophobicContact CG2-CD2 4.07Å; V818-F857 HydrophobicContact CG1-CE1 3.7Å; V818-F857 HydrophobicContact CG1-CZ 4.15Å
819Q93.2Very high92.7Very high83 Ų8331.2 Ų31.239%0.38817%0.174SC..Hα-helixtrans-65-39.7175.8-72.9176.6100112.2Q815 E816 S817 L822 A823 F857Q815-Q819 WeakPolarHBondContact O-CG 3.44Å; Q815-Q819 PolarHBondContact O-N 3.45Å; Q815-Q819 VanDerWaalsContact O-N 3.15Å; E816-Q819 PolarHBondContact O-N 3.29Å; S817-Q819 VanDerWaalsContact C-N 3.34Å; S817-Q819 PolarHBondContact O-N 3.37Å; Q819-L822 PolarHBondContact O-N 2.67Å; Q819-A823 WeakPolarHBondContact O-CB 3.46Å; Q819-A823 PolarHBondContact O-N 3.4Å; Q819-F857 HydrophobicContact CG-CE2 4.42Å; Q819-F857 HydrophobicContact CG-CZ 4.12Å
820V92.7Very high92.2Very high2 Ų237.9 Ų37.91%0.01220%0.204CC..Hα-helixtrans-64.1-43.9174.5172.20000110.4Y762 R763 K766 E816 S817 L822 A823 L824Y762-V820 HydrophobicContact CD1-CG1 4.06Å; Y762-V820 HydrophobicContact CE1-CB 4.03Å; Y762-V820 HydrophobicContact CE1-CG1 3.69Å; R763-V820 HydrophobicContact CG-CG2 4.42Å; K766-V820 HydrophobicContact CB-CG2 4.31Å; K766-V820 HydrophobicContact CD-CG2 4.3Å; K766-V820 HydrophobicContact CG-CG2 4.5Å; E816-V820 WeakPolarHBondContact O-CG2 3.33Å; E816-V820 PolarHBondContact O-N 3.07Å; S817-V820 PolarHBondContact O-N 2.9Å; V820-L822 VanDerWaalsContact C-N 3.33Å; V820-L822 PolarHBondContact O-N 2.96Å; V820-A823 PolarHBondContact O-N 3.28Å; V820-A823 VanDerWaalsContact O-N 3.17Å; V820-L824 HydrophobicContact CG1-CD1 3.7Å; V820-L824 HydrophobicContact CG1-CG 4.12Å; V820-L824 WeakPolarHBondContact O-CB 3.41Å; V820-L824 VanDerWaalsContact O-CG 3.32Å; V820-L824 WeakPolarHBondContact O-CG 3.47Å; V820-L824 PolarHBondContact O-N 3.41Å
821S93.9Very high91.7Very high0 Ų040.1 Ų40.10%022%0.215CC..Hα-helixtrans-57.1-45.6175.3-51.80000111.9Y762 S817 V818 A823 L824 F825 M838Y762-S821 WeakPolarHBondContact OH-CA 3.48Å; Y762-S821 VanDerWaalsContact OH-CB 3.32Å; Y762-S821 WeakPolarHBondContact OH-CB 3.27Å; Y762-S821 PolarHBondContact OH-OG 3.28Å; S817-S821 PolarHBondContact O-N 3.15Å; S817-S821 PolarHBondContact O-OG 3.04Å; V818-S821 PolarHBondContact O-N 3.31Å; S821-A823 VanDerWaalsContact C-N 3.33Å; S821-A823 PolarHBondContact O-N 3.5Å; S821-L824 PolarHBondContact O-N 3.33Å; S821-F825 PolarHBondContact O-N 3.41Å; S821-M838 WeakPolarHBondContact O-CE 3.45Å
822L93.2Very high91.3Very high13 Ų1341.5 Ų41.57%0.06823%0.228CC..Hα-helixtrans-65.4-37.4178.6-174.860.3000112.1V818 Q819 V820 P826 F842 F857 Q860 I861 T864V818-L822 PolarHBondContact O-N 3.2Å; Q819-L822 PolarHBondContact O-N 2.67Å; V820-L822 VanDerWaalsContact C-N 3.33Å; V820-L822 PolarHBondContact O-N 2.96Å; L822-P826 WeakPolarHBondContact O-CD 3.47Å; L822-F842 HydrophobicContact CB-CZ 4.07Å; L822-F842 HydrophobicContact CD1-CZ 4.43Å; L822-F857 HydrophobicContact CD2-CE2 3.81Å; L822-F857 HydrophobicContact CD2-CZ 4.09Å; L822-Q860 HydrophobicContact CD2-CG 4.26Å; L822-I861 HydrophobicContact CD1-CB 4.44Å; L822-I861 HydrophobicContact CD1-CG1 3.98Å; L822-I861 HydrophobicContact CD1-CG2 4.47Å; L822-I861 HydrophobicContact CD2-CG1 3.77Å; L822-I861 HydrophobicContact CG-CG1 4.42Å; L822-T864 HydrophobicContact CD1-CG2 4.09Å
823A91.2Very high90.9Very high48 Ų4838.5 Ų38.540%0.39722%0.216SC..Hα-helixtrans-71.1-31.7178.100000113.3Q819 V820 S821Q819-A823 WeakPolarHBondContact O-CB 3.46Å; Q819-A823 PolarHBondContact O-N 3.4Å; V820-A823 PolarHBondContact O-N 3.28Å; V820-A823 VanDerWaalsContact O-N 3.17Å; S821-A823 VanDerWaalsContact C-N 3.33Å; S821-A823 PolarHBondContact O-N 3.5Å
824L90.4Very high90.6Very high6 Ų637.7 Ų37.73%0.03121%0.21CC..Hα-helixtrans-79.6-27.5177.6-69.9176.9000112.6Y762 L765 P767 V820 S821 A827 F828 M838Y762-L824 HydrophobicContact CE2-CD1 4.01Å; L765-L824 HydrophobicContact CB-CD1 4.12Å; L765-L824 HydrophobicContact CB-CD2 4.37Å; P767-L824 HydrophobicContact CG-CD2 4.29Å; V820-L824 HydrophobicContact CG1-CD1 3.7Å; V820-L824 HydrophobicContact CG1-CG 4.12Å; V820-L824 WeakPolarHBondContact O-CB 3.41Å; V820-L824 VanDerWaalsContact O-CG 3.32Å; V820-L824 WeakPolarHBondContact O-CG 3.47Å; V820-L824 PolarHBondContact O-N 3.41Å; S821-L824 PolarHBondContact O-N 3.33Å; L824-A827 WeakPolarHBondContact O-CB 3.46Å; L824-A827 PolarHBondContact O-N 2.93Å; L824-F828 HydrophobicContact CB-CD2 4.3Å; L824-F828 HydrophobicContact CB-CE2 4.48Å; L824-F828 HydrophobicContact CD2-CE2 4.33Å; L824-F828 WeakPolarHBondContact O-CD2 3.5Å; L824-F828 PolarHBondContact O-N 3.2Å; L824-M838 HydrophobicContact CB-CE 3.91Å
825F90.6Very high90.4Very high0 Ų037.7 Ų37.70%021%0.21CC..Hα-helixtrans-52.1-47.2-172.2-173.9-94.5000113.8S821 A827 F828 I829 T835 M838 L839 F865 M868 F869S821-F825 PolarHBondContact O-N 3.41Å; F825-A827 PolarHBondContact O-N 3.21Å; F825-F828 PolarHBondContact O-N 3.42Å; F825-I829 HydrophobicContact CE1-CD1 3.97Å; F825-I829 HydrophobicContact CZ-CD1 4.01Å; F825-I829 PolarHBondContact O-N 2.98Å; F825-T835 HydrophobicContact CE2-CG2 3.92Å; F825-T835 HydrophobicContact CZ-CG2 4.15Å; F825-M838 HydrophobicContact CB-CE 3.9Å; F825-M838 HydrophobicContact CD2-CB 4.14Å; F825-M838 HydrophobicContact CD2-CE 4.28Å; F825-M838 HydrophobicContact CD2-SD 4.32Å; F825-L839 HydrophobicContact CE2-CD2 3.71Å; F825-L839 HydrophobicContact CE2-CG 4.02Å; F825-L839 HydrophobicContact CZ-CD2 3.93Å; F825-L839 HydrophobicContact CZ-CG 4.44Å; F825-F865 AromaticContact CD1-CD1 3.96Å; F825-F865 HydrophobicContact CD1-CD1 3.96Å; F825-F865 AromaticContact CD1-CE1 3.88Å; F825-F865 HydrophobicContact CD1-CE1 3.88Å; F825-F865 HydrophobicContact CD2-CE1 4.04Å; F825-F865 AromaticContact CE1-CD1 3.55Å; F825-F865 HydrophobicContact CE1-CD1 3.55Å; F825-F865 AromaticContact CE1-CE1 3.77Å; F825-F865 HydrophobicContact CE1-CE1 3.77Å; F825-F865 HydrophobicContact CE2-CD1 4.41Å; F825-F865 AromaticContact CE2-CE1 3.94Å; F825-F865 HydrophobicContact CE2-CE1 3.94Å; F825-F865 HydrophobicContact CG-CE1 4.01Å; F825-F865 AromaticContact CZ-CD1 3.81Å; F825-F865 HydrophobicContact CZ-CD1 3.81Å; F825-F865 AromaticContact CZ-CE1 3.81Å; F825-F865 HydrophobicContact CZ-CE1 3.81Å; F825-M868 HydrophobicContact CE1-CB 4.38Å; F825-F869 HydrophobicContact CE1-CE2 4.37Å; F825-F869 AromaticContact CZ-CE2 3.83Å; F825-F869 HydrophobicContact CZ-CE2 3.83Å; F825-F869 HydrophobicContact CZ-CZ 4.05Å
826P89.8Confident90.3Very high59 Ų5934.2 Ų34.238%0.38319%0.194SC..Hα-helixtrans-63.8-26.9178.1-21.934.8000114.2L822 F828 M868L822-P826 WeakPolarHBondContact O-CD 3.47Å; P826-F828 VanDerWaalsContact C-N 3.31Å; P826-M868 HydrophobicContact CB-SD 4.2Å
827A86.8Confident90.3Very high73 Ų7331.5 Ų31.560%0.60318%0.181SC*.Hα-helixtrans-75.3-2218000000112.7L824 F825L824-A827 WeakPolarHBondContact O-CB 3.46Å; L824-A827 PolarHBondContact O-N 2.93Å; F825-A827 PolarHBondContact O-N 3.21Å
828F87.5Confident90.3Very high17 Ų1731.4 Ų31.48%0.07518%0.181CC..Hα-helixtrans-113.33.8-174.4-72.5-77.8000114.2T781 I785 L824 F825 P826 H830 Q831 V834 T835 M838T781-F828 HydrophobicContact CG2-CZ 3.84Å; I785-F828 HydrophobicContact CD1-CD2 4.23Å; I785-F828 HydrophobicContact CD1-CE1 4.22Å; I785-F828 HydrophobicContact CD1-CE2 3.77Å; I785-F828 HydrophobicContact CD1-CZ 3.77Å; L824-F828 HydrophobicContact CB-CD2 4.3Å; L824-F828 HydrophobicContact CB-CE2 4.48Å; L824-F828 HydrophobicContact CD2-CE2 4.33Å; L824-F828 WeakPolarHBondContact O-CD2 3.5Å; L824-F828 PolarHBondContact O-N 3.2Å; F825-F828 PolarHBondContact O-N 3.42Å; P826-F828 VanDerWaalsContact C-N 3.31Å; F828-H830 PolarHBondContact O-N 3.43Å; F828-Q831 VanDerWaalsContact CD1-OE1 3.25Å; F828-Q831 WeakPolarHBondContact O-CA 3.38Å; F828-Q831 WeakPolarHBondContact O-CB 3.49Å; F828-Q831 PolarHBondContact O-N 3.41Å; F828-V834 HydrophobicContact CB-CB 4.28Å; F828-V834 HydrophobicContact CB-CG1 3.89Å; F828-V834 HydrophobicContact CD1-CB 4.23Å; F828-V834 HydrophobicContact CD1-CG1 3.93Å; F828-V834 HydrophobicContact CD1-CG2 4.2Å; F828-V834 HydrophobicContact CD2-CG1 4.47Å; F828-V834 HydrophobicContact CG-CB 4.45Å; F828-V834 HydrophobicContact CG-CG1 3.85Å; F828-T835 PolarHBondContact O-OG1 3.2Å; F828-M838 HydrophobicContact CB-SD 4.45Å
829I86.1Confident90.3Very high14 Ų1431.4 Ų31.47%0.07218%0.181CC..THydrogen-bonded Turntrans-54.6-31.4-175.2-170.959.9000114.5F825 Q831 T835 M868 F869 Q873F825-I829 HydrophobicContact CE1-CD1 3.97Å; F825-I829 HydrophobicContact CZ-CD1 4.01Å; F825-I829 PolarHBondContact O-N 2.98Å; I829-Q831 VanDerWaalsContact C-N 3.33Å; I829-T835 HydrophobicContact CD1-CG2 4.33Å; I829-M868 HydrophobicContact CD1-CB 4.47Å; I829-F869 HydrophobicContact CD1-CE1 3.99Å; I829-F869 HydrophobicContact CD1-CE2 4.49Å; I829-F869 HydrophobicContact CD1-CZ 3.95Å; I829-Q873 HydrophobicContact CG1-CG 4.27Å; I829-Q873 PolarHBondContact O-NE2 3.16Å
830H85.1Confident90.4Very high143 Ų14328.4 Ų28.466%0.66217%0.169SC*.THydrogen-bonded Turntrans-84.8-3178.3-56.7-63.3000113.7F828 Q873F828-H830 PolarHBondContact O-N 3.43Å; H830-Q873 PolarHBondContact CE1-OE1 3.35Å; H830-Q873 PolarHBondContact ND1-OE1 3.08Å; H830-Q873 VanDerWaalsContact ND1-OE1 3.08Å
831Q86.5Confident90.6Very high48 Ų4828.3 Ų28.322%0.22417%0.169CC..  trans-106.3101.5177-63.3-174.64.900109F828 I829 D833 V834 T835F828-Q831 VanDerWaalsContact CD1-OE1 3.25Å; F828-Q831 WeakPolarHBondContact O-CA 3.38Å; F828-Q831 WeakPolarHBondContact O-CB 3.49Å; F828-Q831 PolarHBondContact O-N 3.41Å; I829-Q831 VanDerWaalsContact C-N 3.33Å; Q831-D833 PolarHBondContact O-N 3.45Å; Q831-V834 HydrophobicContact CB-CB 4.38Å; Q831-V834 HydrophobicContact CB-CG2 4.33Å; Q831-V834 PolarHBondContact O-N 3.04Å; Q831-T835 WeakPolarHBondContact O-CB 3.38Å; Q831-T835 PolarHBondContact O-N 3.28Å; Q831-T835 PolarHBondContact O-OG1 3.23Å
832S86.5Confident90.7Very high51 Ų5128.3 Ų28.336%0.35717%0.169SC..Hα-helixtrans-65.2-35.9-171.855.50000113.2D836 T884S832-D836 WeakPolarHBondContact O-CB 3.42Å; S832-D836 PolarHBondContact O-N 3.22Å; S832-T884 WeakPolarHBondContact O-CG2 3.47Å
833D87.5Confident90.8Very high53 Ų5328.1 Ų28.128%0.28317%0.168SC..Hα-helixtrans-57.3-52.3174.356.8-26.4000112.6K782 H786 Q831 E837K782-D833 IonicContact NZ-OD1 2.78Å; K782-D833 PolarHBondContact NZ-OD1 2.86Å; K782-D833 IonicContact NZ-OD2 2.93Å; K782-D833 PolarHBondContact NZ-OD2 3.23Å; H786-D833 PolarHBondContact CE1-O 3.49Å; H786-D833 VanDerWaalsContact CE1-O 3.25Å; Q831-D833 PolarHBondContact O-N 3.45Å; D833-E837 PolarHBondContact O-N 3.02Å
834V89.8Confident91Very high0 Ų026.5 Ų26.50%015%0.152CC..Hα-helixtrans-70.9-40.7-179.4-175.70000111.1K782 I785 F828 Q831 D836 E837 M838K782-V834 HydrophobicContact CB-CG2 4.36Å; K782-V834 HydrophobicContact CD-CG2 4.24Å; K782-V834 HydrophobicContact CG-CG2 3.74Å; I785-V834 HydrophobicContact CD1-CG1 3.81Å; I785-V834 HydrophobicContact CG2-CG1 3.93Å; F828-V834 HydrophobicContact CB-CB 4.28Å; F828-V834 HydrophobicContact CB-CG1 3.89Å; F828-V834 HydrophobicContact CD1-CB 4.23Å; F828-V834 HydrophobicContact CD1-CG1 3.93Å; F828-V834 HydrophobicContact CD1-CG2 4.2Å; F828-V834 HydrophobicContact CD2-CG1 4.47Å; F828-V834 HydrophobicContact CG-CB 4.45Å; F828-V834 HydrophobicContact CG-CG1 3.85Å; Q831-V834 HydrophobicContact CB-CB 4.38Å; Q831-V834 HydrophobicContact CB-CG2 4.33Å; Q831-V834 PolarHBondContact O-N 3.04Å; V834-D836 VanDerWaalsContact C-N 3.31Å; V834-D836 PolarHBondContact O-N 3.19Å; V834-E837 PolarHBondContact O-N 3.44Å; V834-M838 HydrophobicContact CG1-CG 4.31Å; V834-M838 HydrophobicContact CG1-SD 3.96Å; V834-M838 VanDerWaalsContact O-CG 3.27Å; V834-M838 WeakPolarHBondContact O-CG 3.19Å; V834-M838 PolarHBondContact O-N 3.3Å
835T90.8Very high91.2Very high1 Ų126.2 Ų26.21%0.00615%0.151CC..Hα-helixtrans-63.9-38.9179.8-57.10000111.4F825 F828 I829 Q831 E837 M838 L839 F869 V888F825-T835 HydrophobicContact CE2-CG2 3.92Å; F825-T835 HydrophobicContact CZ-CG2 4.15Å; F828-T835 PolarHBondContact O-OG1 3.2Å; I829-T835 HydrophobicContact CD1-CG2 4.33Å; Q831-T835 WeakPolarHBondContact O-CB 3.38Å; Q831-T835 PolarHBondContact O-N 3.28Å; Q831-T835 PolarHBondContact O-OG1 3.23Å; T835-E837 PolarHBondContact O-N 3Å; T835-M838 PolarHBondContact O-N 3.43Å; T835-L839 HydrophobicContact CG2-CD1 4.31Å; T835-L839 HydrophobicContact CG2-CG 4.35Å; T835-L839 WeakPolarHBondContact O-CB 3.47Å; T835-L839 WeakPolarHBondContact O-CG 3.49Å; T835-L839 PolarHBondContact O-N 3.37Å; T835-F869 HydrophobicContact CG2-CZ 4.32Å; T835-V888 HydrophobicContact CG2-CG1 3.68Å; T835-V888 HydrophobicContact CG2-CG2 4.03Å
836D92.1Very high91.3Very high14 Ų1426.2 Ų26.28%0.07515%0.151CC..Hα-helixtrans-60.6-44.5177.2-175.151.4000111.7S832 V834 S840 T884 R887 V888 K891S832-D836 WeakPolarHBondContact O-CB 3.42Å; S832-D836 PolarHBondContact O-N 3.22Å; V834-D836 VanDerWaalsContact C-N 3.31Å; V834-D836 PolarHBondContact O-N 3.19Å; D836-S840 WeakPolarHBondContact O-CB 3.37Å; D836-S840 PolarHBondContact O-N 2.88Å; D836-T884 HydrophobicContact CB-CG2 3.69Å; D836-R887 WeakPolarHBondContact OD1-CB 3.41Å; D836-V888 HydrophobicContact CB-CG2 3.85Å; D836-K891 WeakPolarHBondContact O-CD 3.5Å; D836-K891 PolarHBondContact O-NZ 3.08Å; D836-K891 VanDerWaalsContact OD1-CD 3.29Å; D836-K891 WeakPolarHBondContact OD1-CD 3.47Å; D836-K891 VanDerWaalsContact OD1-CE 3.3Å; D836-K891 WeakPolarHBondContact OD1-CE 3.08Å; D836-K891 IonicContact OD1-NZ 3.55Å; D836-K891 PolarHBondContact OD1-NZ 3.31Å; D836-K891 IonicContact OD2-NZ 3.96Å; D836-K891 PolarHBondContact OD2-NZ 3.02Å
837E93.3Very high91.4Very high35 Ų3530.6 Ų30.616%0.16416%0.16CC..Hα-helixtrans-65.6-46.1176-167.978.7-154.800111.7H786 L789 S790 D833 V834 T835 L839 S840 F841H786-E837 IonicContact CE1-OE2 3.38Å; H786-E837 IonicContact ND1-OE2 3.72Å; H786-E837 PolarHBondContact ND1-OE2 2.86Å; L789-E837 HydrophobicContact CB-CG 3.89Å; L789-E837 HydrophobicContact CD1-CG 4.17Å; S790-E837 PolarHBondContact N-OE1 3.41Å; D833-E837 PolarHBondContact O-N 3.02Å; V834-E837 PolarHBondContact O-N 3.44Å; T835-E837 PolarHBondContact O-N 3Å; E837-L839 PolarHBondContact O-N 2.91Å; E837-S840 VanDerWaalsContact O-CB 3.28Å; E837-S840 WeakPolarHBondContact O-CB 3.32Å; E837-S840 PolarHBondContact O-N 3.28Å; E837-S840 VanDerWaalsContact O-N 3.12Å; E837-F841 PolarHBondContact O-N 3.23Å
838M94.6Very high91.5Very high0 Ų027.2 Ų27.20%013%0.133CC..Hα-helixtrans-62.4-43.2179.8-69-178.683.600111.8I785 L789 S821 L824 F825 F828 V834 T835 S840 F841 F842I785-M838 HydrophobicContact CG2-CG 4.43Å; L789-M838 HydrophobicContact CD1-CB 4.41Å; L789-M838 HydrophobicContact CD1-CG 3.72Å; S821-M838 WeakPolarHBondContact O-CE 3.45Å; L824-M838 HydrophobicContact CB-CE 3.91Å; F825-M838 HydrophobicContact CB-CE 3.9Å; F825-M838 HydrophobicContact CD2-CB 4.14Å; F825-M838 HydrophobicContact CD2-CE 4.28Å; F825-M838 HydrophobicContact CD2-SD 4.32Å; F828-M838 HydrophobicContact CB-SD 4.45Å; V834-M838 HydrophobicContact CG1-CG 4.31Å; V834-M838 HydrophobicContact CG1-SD 3.96Å; V834-M838 VanDerWaalsContact O-CG 3.27Å; V834-M838 WeakPolarHBondContact O-CG 3.19Å; V834-M838 PolarHBondContact O-N 3.3Å; T835-M838 PolarHBondContact O-N 3.43Å; M838-S840 VanDerWaalsContact C-N 3.31Å; M838-F841 PolarHBondContact O-N 2.95Å; M838-F842 WeakPolarHBondContact O-CD2 3.23Å; M838-F842 PolarHBondContact O-N 3.12Å
839L95Very high91.8Very high0 Ų026.4 Ų26.40%013%0.129CC..Hα-helixtrans-67.8-31.4174.7-71.4-176.3000112.4F825 T835 E837 F842 L843 F865 F869 V888 K891 F892 I895F825-L839 HydrophobicContact CE2-CD2 3.71Å; F825-L839 HydrophobicContact CE2-CG 4.02Å; F825-L839 HydrophobicContact CZ-CD2 3.93Å; F825-L839 HydrophobicContact CZ-CG 4.44Å; T835-L839 HydrophobicContact CG2-CD1 4.31Å; T835-L839 HydrophobicContact CG2-CG 4.35Å; T835-L839 WeakPolarHBondContact O-CB 3.47Å; T835-L839 WeakPolarHBondContact O-CG 3.49Å; T835-L839 PolarHBondContact O-N 3.37Å; E837-L839 PolarHBondContact O-N 2.91Å; L839-F842 PolarHBondContact O-N 3.08Å; L839-L843 VanDerWaalsContact O-CB 3.22Å; L839-L843 WeakPolarHBondContact O-CB 3.21Å; L839-L843 PolarHBondContact O-N 3.26Å; L839-F865 HydrophobicContact CD2-CD2 4.47Å; L839-F865 HydrophobicContact CD2-CE1 4.25Å; L839-F865 HydrophobicContact CD2-CE2 4.08Å; L839-F865 HydrophobicContact CD2-CZ 3.96Å; L839-F869 HydrophobicContact CD1-CE2 4.28Å; L839-F869 HydrophobicContact CD1-CZ 3.91Å; L839-F869 HydrophobicContact CD2-CE2 4.49Å; L839-V888 HydrophobicContact CD1-CB 4.43Å; L839-V888 HydrophobicContact CD1-CG1 3.76Å; L839-V888 WeakPolarHBondContact CD1-O 3.36Å; L839-K891 HydrophobicContact CB-CB 3.9Å; L839-K891 HydrophobicContact CB-CD 4.26Å; L839-K891 HydrophobicContact CD1-CB 4.31Å; L839-F892 HydrophobicContact CD1-CB 4.06Å; L839-I895 HydrophobicContact CD2-CD1 3.93Å
840S95.8Very high91.9Very high20 Ų2027.8 Ų27.814%0.1413%0.133CC..Hα-helixtrans-60.3-50.9172.8-148.30000110.3E793 D836 E837 M838 F842 L843 T844E793-S840 WeakPolarHBondContact OE1-CB 3.46Å; E793-S840 PolarHBondContact OE1-OG 3.45Å; E793-S840 VanDerWaalsContact OE2-CB 3.27Å; E793-S840 WeakPolarHBondContact OE2-CB 3.32Å; E793-S840 PolarHBondContact OE2-OG 3.43Å; D836-S840 WeakPolarHBondContact O-CB 3.37Å; D836-S840 PolarHBondContact O-N 2.88Å; E837-S840 VanDerWaalsContact O-CB 3.28Å; E837-S840 WeakPolarHBondContact O-CB 3.32Å; E837-S840 PolarHBondContact O-N 3.28Å; E837-S840 VanDerWaalsContact O-N 3.12Å; M838-S840 VanDerWaalsContact C-N 3.31Å; S840-F842 PolarHBondContact O-N 3.32Å; S840-L843 PolarHBondContact O-N 3.39Å; S840-T844 PolarHBondContact O-N 2.96Å; S840-T844 PolarHBondContact O-OG1 2.91Å
841F96.2Very high92.1Very high0 Ų026 Ų260%013%0.132CC..Hα-helixtrans-57.9-46.7175.5179-123.4000112.5L789 L792 E793 V796 V818 E837 M838 T844 L845L789-F841 HydrophobicContact CD2-CB 4.36Å; L789-F841 HydrophobicContact CD2-CD1 3.72Å; L789-F841 HydrophobicContact CD2-CE1 4.06Å; L789-F841 HydrophobicContact CD2-CG 3.97Å; L792-F841 HydrophobicContact CB-CD2 4.31Å; L792-F841 HydrophobicContact CB-CE2 3.67Å; L792-F841 HydrophobicContact CB-CZ 4.2Å; L792-F841 HydrophobicContact CD1-CZ 4.42Å; E793-F841 HydrophobicContact CB-CD2 4.15Å; V796-F841 HydrophobicContact CG2-CE2 4.42Å; V818-F841 HydrophobicContact CG2-CE1 4.2Å; V818-F841 HydrophobicContact CG2-CZ 4.04Å; E837-F841 PolarHBondContact O-N 3.23Å; M838-F841 PolarHBondContact O-N 2.95Å; F841-T844 PolarHBondContact O-N 3.36Å; F841-L845 HydrophobicContact CD1-CD1 3.94Å; F841-L845 HydrophobicContact CD2-CG 4.4Å; F841-L845 HydrophobicContact CE1-CD1 3.59Å; F841-L845 HydrophobicContact CE1-CG 4.39Å; F841-L845 HydrophobicContact CE2-CD1 4.17Å; F841-L845 HydrophobicContact CE2-CD2 4.22Å; F841-L845 HydrophobicContact CE2-CG 4.09Å; F841-L845 HydrophobicContact CG-CD1 4.4Å; F841-L845 HydrophobicContact CZ-CD1 3.72Å; F841-L845 HydrophobicContact CZ-CD2 4.17Å; F841-L845 HydrophobicContact CZ-CG 4.09Å; F841-L845 WeakPolarHBondContact O-CG 3.34Å; F841-L845 PolarHBondContact O-N 3.43Å
842F96.1Very high92.4Very high0 Ų025.1 Ų25.10%013%0.128CC..Hα-helixtrans-65.4-39.8177.2-80-66.7000113V818 L822 M838 L839 S840 T844 L845 F846 I861 F865 I895V818-F842 HydrophobicContact CG1-CE1 4.1Å; L822-F842 HydrophobicContact CB-CZ 4.07Å; L822-F842 HydrophobicContact CD1-CZ 4.43Å; M838-F842 WeakPolarHBondContact O-CD2 3.23Å; M838-F842 PolarHBondContact O-N 3.12Å; L839-F842 PolarHBondContact O-N 3.08Å; S840-F842 PolarHBondContact O-N 3.32Å; F842-T844 VanDerWaalsContact C-N 3.29Å; F842-T844 PolarHBondContact O-N 2.91Å; F842-L845 HydrophobicContact CD1-CD1 3.97Å; F842-L845 HydrophobicContact CE1-CD1 4.34Å; F842-L845 WeakPolarHBondContact O-CB 3.11Å; F842-L845 PolarHBondContact O-N 3.4Å; F842-F846 WeakPolarHBondContact O-CB 3.43Å; F842-F846 WeakPolarHBondContact O-CD2 3.33Å; F842-F846 PolarHBondContact O-N 3.17Å; F842-I861 HydrophobicContact CD1-CD1 4.29Å; F842-I861 HydrophobicContact CD1-CG2 4.2Å; F842-I861 HydrophobicContact CE1-CD1 3.95Å; F842-I861 HydrophobicContact CE1-CG1 4.34Å; F842-I861 HydrophobicContact CE1-CG2 4.3Å; F842-F865 HydrophobicContact CB-CE2 4.22Å; F842-F865 HydrophobicContact CB-CZ 4.05Å; F842-F865 HydrophobicContact CD1-CZ 4.26Å; F842-F865 HydrophobicContact CD2-CE1 4.3Å; F842-F865 AromaticContact CD2-CZ 3.55Å; F842-F865 HydrophobicContact CD2-CZ 3.55Å; F842-F865 HydrophobicContact CE2-CE1 4.4Å; F842-F865 AromaticContact CE2-CZ 3.99Å; F842-F865 HydrophobicContact CE2-CZ 3.99Å; F842-F865 HydrophobicContact CG-CE2 4.3Å; F842-F865 AromaticContact CG-CZ 3.7Å; F842-F865 HydrophobicContact CG-CZ 3.7Å; F842-I895 HydrophobicContact CB-CD1 4.13Å
843L95.4Very high92.6Very high9 Ų923.2 Ų23.25%0.04711%0.114CC..Hα-helixtrans-59.4-43.9175.2178.159.1000111L839 S840 F846 R847 K891 K894 I895 V898L839-L843 VanDerWaalsContact O-CB 3.22Å; L839-L843 WeakPolarHBondContact O-CB 3.21Å; L839-L843 PolarHBondContact O-N 3.26Å; S840-L843 PolarHBondContact O-N 3.39Å; L843-F846 PolarHBondContact O-N 3.24Å; L843-R847 HydrophobicContact CD1-CG 4.46Å; L843-R847 WeakPolarHBondContact O-CG 3.46Å; L843-R847 PolarHBondContact O-N 3.32Å; L843-K891 HydrophobicContact CD2-CG 4.46Å; L843-K894 HydrophobicContact CD1-CB 3.79Å; L843-K894 HydrophobicContact CD2-CB 3.81Å; L843-K894 HydrophobicContact CD2-CD 4.02Å; L843-K894 HydrophobicContact CG-CB 4.49Å; L843-I895 HydrophobicContact CB-CD1 4.28Å; L843-I895 HydrophobicContact CB-CG1 3.84Å; L843-I895 HydrophobicContact CD1-CG1 3.81Å; L843-I895 HydrophobicContact CG-CG1 4.4Å; L843-V898 HydrophobicContact CD1-CG2 4.45Å
844T95.6Very high92.7Very high13 Ų1321.9 Ų21.98%0.0811%0.113CC..Hα-helixtrans-65.6-40.4177.2-61.60000111.9E793 V796 E797 S840 F841 F842 F846 R847 G848E793-T844 HydrophobicContact CG-CG2 4.04Å; E793-T844 WeakPolarHBondContact O-CG2 3.25Å; E793-T844 PolarHBondContact OE1-OG1 3.27Å; V796-T844 HydrophobicContact CB-CG2 3.94Å; V796-T844 HydrophobicContact CG1-CG2 3.81Å; E797-T844 HydrophobicContact CB-CG2 3.77Å; S840-T844 PolarHBondContact O-N 2.96Å; S840-T844 PolarHBondContact O-OG1 2.91Å; F841-T844 PolarHBondContact O-N 3.36Å; F842-T844 VanDerWaalsContact C-N 3.29Å; F842-T844 PolarHBondContact O-N 2.91Å; T844-F846 PolarHBondContact O-N 3.44Å; T844-R847 PolarHBondContact O-N 2.89Å; T844-G848 PolarHBondContact O-N 2.94Å
845L95.1Very high92.6Very high0 Ų025 Ų250%013%0.131CC..Hα-helixtrans-60.4-43.8170.8-72.4171.7000112.6V796 V818 F841 F842 R847 G848 L849 R850 M853V796-L845 HydrophobicContact CG1-CD2 4.17Å; V796-L845 HydrophobicContact CG2-CD2 3.95Å; V818-L845 HydrophobicContact CB-CD1 4.38Å; V818-L845 HydrophobicContact CG1-CD1 3.76Å; V818-L845 HydrophobicContact CG2-CD1 3.74Å; V818-L845 HydrophobicContact CG2-CD2 4.07Å; F841-L845 HydrophobicContact CD1-CD1 3.94Å; F841-L845 HydrophobicContact CD2-CG 4.4Å; F841-L845 HydrophobicContact CE1-CD1 3.59Å; F841-L845 HydrophobicContact CE1-CG 4.39Å; F841-L845 HydrophobicContact CE2-CD1 4.17Å; F841-L845 HydrophobicContact CE2-CD2 4.22Å; F841-L845 HydrophobicContact CE2-CG 4.09Å; F841-L845 HydrophobicContact CG-CD1 4.4Å; F841-L845 HydrophobicContact CZ-CD1 3.72Å; F841-L845 HydrophobicContact CZ-CD2 4.17Å; F841-L845 HydrophobicContact CZ-CG 4.09Å; F841-L845 WeakPolarHBondContact O-CG 3.34Å; F841-L845 PolarHBondContact O-N 3.43Å; F842-L845 HydrophobicContact CD1-CD1 3.97Å; F842-L845 HydrophobicContact CE1-CD1 4.34Å; F842-L845 WeakPolarHBondContact O-CB 3.11Å; F842-L845 PolarHBondContact O-N 3.4Å; L845-R847 VanDerWaalsContact C-N 3.32Å; L845-R847 PolarHBondContact O-N 2.99Å; L845-G848 PolarHBondContact O-N 3.42Å; L845-L849 HydrophobicContact CD2-CB 4.46Å; L845-L849 HydrophobicContact CD2-CD1 4.04Å; L845-L849 CarbonylContact O-C 3.6Å; L845-L849 WeakPolarHBondContact O-CA 3.45Å; L845-L849 PolarHBondContact O-N 2.94Å; L845-R850 PolarHBondContact O-N 2.6Å; L845-R850 VanDerWaalsContact O-N 3.08Å; L845-M853 HydrophobicContact CB-SD 4.01Å
846F92.3Very high92.5Very high1 Ų129.6 Ų29.60%0.00416%0.162CC..Hα-helixtrans-66.1-35.4179.6-91.4-112.6000112.2F842 L843 T844 R850 M853 T858 I861 I862 I895 V898 V899F842-F846 WeakPolarHBondContact O-CB 3.43Å; F842-F846 WeakPolarHBondContact O-CD2 3.33Å; F842-F846 PolarHBondContact O-N 3.17Å; L843-F846 PolarHBondContact O-N 3.24Å; T844-F846 PolarHBondContact O-N 3.44Å; F846-R850 VanDerWaalsContact O-CB 3.27Å; F846-R850 WeakPolarHBondContact O-CB 3.26Å; F846-M853 HydrophobicContact CE2-CE 4.42Å; F846-T858 HydrophobicContact CD1-CG2 4.35Å; F846-T858 HydrophobicContact CE1-CG2 3.5Å; F846-T858 VanDerWaalsContact CE1-CG2 3.5Å; F846-T858 HydrophobicContact CZ-CG2 3.68Å; F846-I861 HydrophobicContact CE2-CB 4.37Å; F846-I861 HydrophobicContact CE2-CD1 4.28Å; F846-I861 HydrophobicContact CE2-CG2 3.84Å; F846-I861 HydrophobicContact CZ-CB 4.27Å; F846-I861 HydrophobicContact CZ-CG2 4Å; F846-I862 HydrophobicContact CE1-CD1 4.07Å; F846-I862 HydrophobicContact CE1-CG1 3.91Å; F846-I862 HydrophobicContact CZ-CD1 4.46Å; F846-I862 HydrophobicContact CZ-CG1 3.93Å; F846-I895 HydrophobicContact CD1-CG2 4.07Å; F846-I895 HydrophobicContact CE1-CG2 4.08Å; F846-I895 HydrophobicContact CG-CG2 4.28Å; F846-I895 HydrophobicContact CZ-CG2 4.3Å; F846-V898 HydrophobicContact CB-CG1 4.25Å; F846-V899 HydrophobicContact CD1-CG2 4.15Å; F846-V899 HydrophobicContact CE1-CG2 3.84Å
847R91.1Very high92.5Very high150 Ų15030.3 Ų30.357%0.56616%0.164SC*.Hα-helixtrans-73.1-42.6176.2-71.5173.5175-179.5-2.1112.3L843 T844 L845 V898L843-R847 HydrophobicContact CD1-CG 4.46Å; L843-R847 WeakPolarHBondContact O-CG 3.46Å; L843-R847 PolarHBondContact O-N 3.32Å; T844-R847 PolarHBondContact O-N 2.89Å; L845-R847 VanDerWaalsContact C-N 3.32Å; L845-R847 PolarHBondContact O-N 2.99Å; R847-V898 HydrophobicContact CG-CG2 4.1Å
848G90Very high92.3Very high3 Ų328.7 Ų28.73%0.03116%0.157CC..Hα-helixtrans-98.4-37.7-171.200000116.6R807 T844 L845R807-G848 VanDerWaalsContact CD-O 3.29Å; R807-G848 WeakPolarHBondContact CD-O 3.4Å; T844-G848 PolarHBondContact O-N 2.94Å; L845-G848 PolarHBondContact O-N 3.42Å
849L92.8Very high92Very high0 Ų033 Ų330%018%0.177CC..THydrogen-bonded Turntrans-126.44.7-164.6-69.9-177.8000115.4V796 I799 R807 L814 L845 V851 Q852 M853V796-L849 HydrophobicContact CB-CD1 4.47Å; V796-L849 HydrophobicContact CG1-CD1 3.85Å; V796-L849 HydrophobicContact CG1-CG 3.98Å; V796-L849 HydrophobicContact CG2-CD1 3.87Å; I799-L849 HydrophobicContact CD1-CD1 4.24Å; I799-L849 HydrophobicContact CD1-CD2 3.55Å; I799-L849 HydrophobicContact CD1-CG 3.98Å; R807-L849 HydrophobicContact CB-CD2 3.6Å; R807-L849 HydrophobicContact CG-CD2 3.91Å; R807-L849 WeakPolarHBondContact O-CD2 3.39Å; L814-L849 HydrophobicContact CD1-CD1 4.11Å; L845-L849 HydrophobicContact CD2-CB 4.46Å; L845-L849 HydrophobicContact CD2-CD1 4.04Å; L845-L849 CarbonylContact O-C 3.6Å; L845-L849 WeakPolarHBondContact O-CA 3.45Å; L845-L849 PolarHBondContact O-N 2.94Å; L849-V851 VanDerWaalsContact C-N 3.27Å; L849-V851 PolarHBondContact O-N 2.95Å; L849-V851 VanDerWaalsContact O-N 3.16Å; L849-Q852 WeakPolarHBondContact O-CB 3.3Å; L849-Q852 PolarHBondContact O-N 3.02Å; L849-Q852 PolarHBondContact O-OE1 3.24Å; L849-M853 WeakPolarHBondContact O-CG 3.18Å; L849-M853 PolarHBondContact O-N 2.75Å
850R89Confident91.8Very high42 Ų4238.1 Ų38.116%0.15820%0.201CC..Hα-helixtrans-52.3-39.7-178-174.6-168.564.2-152.6-9.8114.2L845 F846 Q852 M853 G854 T858 V898 E902L845-R850 PolarHBondContact O-N 2.6Å; L845-R850 VanDerWaalsContact O-N 3.08Å; F846-R850 VanDerWaalsContact O-CB 3.27Å; F846-R850 WeakPolarHBondContact O-CB 3.26Å; R850-Q852 VanDerWaalsContact C-N 3.32Å; R850-Q852 PolarHBondContact O-N 3.45Å; R850-M853 PolarHBondContact O-N 3.5Å; R850-G854 PolarHBondContact O-N 3.38Å; R850-T858 HydrophobicContact CG-CG2 4.05Å; R850-V898 PolarHBondContact NH1-O 3.33Å; R850-E902 IonicContact CZ-OE1 3.35Å; R850-E902 IonicContact CZ-OE2 2.64Å; R850-E902 IonicContact NE-OE2 3.66Å; R850-E902 IonicContact NH1-OE1 2.92Å; R850-E902 PolarHBondContact NH1-OE1 3.32Å; R850-E902 IonicContact NH1-OE2 3.17Å; R850-E902 IonicContact NH2-OE1 3.54Å; R850-E902 PolarHBondContact NH2-OE1 3.22Å; R850-E902 IonicContact NH2-OE2 3.27Å; R850-E902 PolarHBondContact NH2-OE2 3.35Å
851V88.6Confident91.7Very high106 Ų10637.2 Ų37.264%0.64219%0.194SC*.Hα-helixtrans-64-40.3178.71780000110.8L849 G854L849-V851 VanDerWaalsContact C-N 3.27Å; L849-V851 PolarHBondContact O-N 2.95Å; L849-V851 VanDerWaalsContact O-N 3.16Å; V851-G854 PolarHBondContact O-N 3.4Å
852Q92.7Very high91.4Very high30 Ų3037.3 Ų37.314%0.1420%0.195CC..Hα-helixtrans-73.4-33.3179.7-67.272.416.800112.1R807 Q808 Y811 L849 R850 G854R807-Q852 HydrophobicContact CB-CG 4.16Å; Q808-Q852 HydrophobicContact CG-CG 4.14Å; Y811-Q852 HydrophobicContact CD1-CB 4Å; Y811-Q852 WeakPolarHBondContact CD1-O 3.18Å; Y811-Q852 VanDerWaalsContact CE1-O 3.29Å; Y811-Q852 WeakPolarHBondContact CE1-O 3.44Å; Y811-Q852 HydrophobicContact CG-CB 3.96Å; L849-Q852 WeakPolarHBondContact O-CB 3.3Å; L849-Q852 PolarHBondContact O-N 3.02Å; L849-Q852 PolarHBondContact O-OE1 3.24Å; R850-Q852 VanDerWaalsContact C-N 3.32Å; R850-Q852 PolarHBondContact O-N 3.45Å; Q852-G854 PolarHBondContact O-N 2.96Å
853M91.6Very high91.1Very high10 Ų1041 Ų415%0.04921%0.212CC..Hα-helixtrans-61.4-28.6173.4-69.7169.763.900113.1Y811 L845 F846 L849 R850 F857 I861Y811-M853 HydrophobicContact CD2-CG 3.87Å; Y811-M853 HydrophobicContact CE2-CB 4.19Å; Y811-M853 HydrophobicContact CE2-CG 3.42Å; Y811-M853 VanDerWaalsContact CE2-CG 3.42Å; L845-M853 HydrophobicContact CB-SD 4.01Å; F846-M853 HydrophobicContact CE2-CE 4.42Å; L849-M853 WeakPolarHBondContact O-CG 3.18Å; L849-M853 PolarHBondContact O-N 2.75Å; R850-M853 PolarHBondContact O-N 3.5Å; M853-F857 HydrophobicContact CB-CD1 4.42Å; M853-F857 HydrophobicContact CE-CD1 3.98Å; M853-F857 HydrophobicContact CE-CE1 4.14Å; M853-I861 HydrophobicContact CE-CD1 3.26Å
854G89Confident91Very high26 Ų2642.1 Ų42.127%0.26822%0.219SC..  trans79.3154.8-177.700000113R850 V851 Q852 T858R850-G854 PolarHBondContact O-N 3.38Å; V851-G854 PolarHBondContact O-N 3.4Å; Q852-G854 PolarHBondContact O-N 2.96Å; G854-T858 WeakPolarHBondContact O-CB 3.46Å; G854-T858 PolarHBondContact O-N 3.1Å; G854-T858 VanDerWaalsContact O-N 3.16Å; G854-T858 PolarHBondContact O-OG1 3.12Å
855V87.2Confident90.8Very high64 Ų6441.6 Ų41.639%0.38822%0.216SC..Hα-helixtrans-57.5-51-177.21640000113.3F857 T858 E859 V906V855-F857 VanDerWaalsContact C-N 3.31Å; V855-F857 PolarHBondContact O-N 3.44Å; V855-T858 PolarHBondContact O-N 3.09Å; V855-E859 WeakPolarHBondContact O-CB 3.22Å; V855-E859 PolarHBondContact O-N 3.05Å; V855-V906 HydrophobicContact CB-CG1 4.04Å; V855-V906 HydrophobicContact CG1-CB 4.41Å; V855-V906 HydrophobicContact CG1-CG1 3.15Å; V855-V906 HydrophobicContact CG1-CG2 4.42Å; V855-V906 HydrophobicContact CG2-CG1 3.78Å; V855-V906 HydrophobicContact CG2-CG2 4.17Å
856P89.5Confident90.5Very high99 Ų9942.9 Ų42.964%0.64322%0.222SC*.Hα-helixtrans-63.5-36.7-172.6-22.534.4000113.1E859 Q860P856-E859 WeakPolarHBondContact O-CB 3.37Å; P856-Q860 PolarHBondContact O-N 3.38Å; P856-Q860 VanDerWaalsContact O-N 3.11Å
857F91Very high90.4Very high29 Ų2947.1 Ų47.113%0.12725%0.245CC..Hα-helixtrans-76.2-36.9179.6-170.1-120.9000111.9V818 Q819 L822 M853 V855 E859 Q860 I861V818-F857 HydrophobicContact CG1-CE1 3.7Å; V818-F857 HydrophobicContact CG1-CZ 4.15Å; Q819-F857 HydrophobicContact CG-CE2 4.42Å; Q819-F857 HydrophobicContact CG-CZ 4.12Å; L822-F857 HydrophobicContact CD2-CE2 3.81Å; L822-F857 HydrophobicContact CD2-CZ 4.09Å; M853-F857 HydrophobicContact CB-CD1 4.42Å; M853-F857 HydrophobicContact CE-CD1 3.98Å; M853-F857 HydrophobicContact CE-CE1 4.14Å; V855-F857 VanDerWaalsContact C-N 3.31Å; V855-F857 PolarHBondContact O-N 3.44Å; F857-E859 VanDerWaalsContact C-N 3.31Å; F857-E859 PolarHBondContact O-N 2.97Å; F857-Q860 WeakPolarHBondContact O-CB 3.39Å; F857-Q860 PolarHBondContact O-N 3.04Å; F857-I861 HydrophobicContact CD1-CD1 4.02Å; F857-I861 HydrophobicContact CE1-CD1 3.8Å; F857-I861 HydrophobicContact CZ-CD1 4.21Å; F857-I861 WeakPolarHBondContact O-CG1 3.44Å; F857-I861 PolarHBondContact O-N 2.89Å; F857-I861 VanDerWaalsContact O-N 3.11Å
858T88.9Confident90.3Very high1 Ų143.2 Ų43.21%0.00623%0.234CC..Hα-helixtrans-60.8-43.2172.4-53.90000110.9F846 R850 G854 V855 Q860 I861 I862 F907F846-T858 HydrophobicContact CD1-CG2 4.35Å; F846-T858 HydrophobicContact CE1-CG2 3.5Å; F846-T858 VanDerWaalsContact CE1-CG2 3.5Å; F846-T858 HydrophobicContact CZ-CG2 3.68Å; R850-T858 HydrophobicContact CG-CG2 4.05Å; G854-T858 WeakPolarHBondContact O-CB 3.46Å; G854-T858 PolarHBondContact O-N 3.1Å; G854-T858 VanDerWaalsContact O-N 3.16Å; G854-T858 PolarHBondContact O-OG1 3.12Å; V855-T858 PolarHBondContact O-N 3.09Å; T858-Q860 PolarHBondContact O-N 3.44Å; T858-I861 PolarHBondContact O-N 2.92Å; T858-I862 HydrophobicContact CG2-CD1 3.98Å; T858-I862 WeakPolarHBondContact O-CG1 3.32Å; T858-I862 PolarHBondContact O-N 3.13Å; T858-F907 HydrophobicContact CG2-CE1 3.72Å; T858-F907 HydrophobicContact CG2-CZ 3.59Å
859E88.4Confident90.3Very high90 Ų9043.1 Ų43.142%0.42123%0.233SC..Hα-helixtrans-57.9-47.2175-169.4177.3175.300111.9V855 P856 F857 I861 I862 Q863 F910V855-E859 WeakPolarHBondContact O-CB 3.22Å; V855-E859 PolarHBondContact O-N 3.05Å; P856-E859 WeakPolarHBondContact O-CB 3.37Å; F857-E859 VanDerWaalsContact C-N 3.31Å; F857-E859 PolarHBondContact O-N 2.97Å; E859-I861 VanDerWaalsContact C-N 3.33Å; E859-I861 PolarHBondContact O-N 3.36Å; E859-I862 PolarHBondContact O-N 3.5Å; E859-Q863 WeakPolarHBondContact O-CB 3.41Å; E859-Q863 PolarHBondContact O-N 2.66Å; E859-F910 HydrophobicContact CG-CE2 3.71Å; E859-F910 HydrophobicContact CG-CZ 3.41Å; E859-F910 VanDerWaalsContact CG-CZ 3.41Å
860Q92.2Very high90Very high108 Ų10846.4 Ų46.451%0.50525%0.253SS..Hα-helixtrans-58.2-42.4177.1-175.1-175.82.400112.6L822 P856 F857 T858 T864L822-Q860 HydrophobicContact CD2-CG 4.26Å; P856-Q860 PolarHBondContact O-N 3.38Å; P856-Q860 VanDerWaalsContact O-N 3.11Å; F857-Q860 WeakPolarHBondContact O-CB 3.39Å; F857-Q860 PolarHBondContact O-N 3.04Å; T858-Q860 PolarHBondContact O-N 3.44Å; Q860-T864 WeakPolarHBondContact O-CB 3.39Å; Q860-T864 PolarHBondContact O-N 2.83Å; Q860-T864 PolarHBondContact O-OG1 3.07Å
861I92.3Very high89.8Confident0 Ų051.4 Ų51.40%027%0.272CS..Hα-helixtrans-65.5-49.7179-66.1163.9000110.5L822 F842 F846 M853 F857 T858 E859 Q863 T864 F865L822-I861 HydrophobicContact CD1-CB 4.44Å; L822-I861 HydrophobicContact CD1-CG1 3.98Å; L822-I861 HydrophobicContact CD1-CG2 4.47Å; L822-I861 HydrophobicContact CD2-CG1 3.77Å; L822-I861 HydrophobicContact CG-CG1 4.42Å; F842-I861 HydrophobicContact CD1-CD1 4.29Å; F842-I861 HydrophobicContact CD1-CG2 4.2Å; F842-I861 HydrophobicContact CE1-CD1 3.95Å; F842-I861 HydrophobicContact CE1-CG1 4.34Å; F842-I861 HydrophobicContact CE1-CG2 4.3Å; F846-I861 HydrophobicContact CE2-CB 4.37Å; F846-I861 HydrophobicContact CE2-CD1 4.28Å; F846-I861 HydrophobicContact CE2-CG2 3.84Å; F846-I861 HydrophobicContact CZ-CB 4.27Å; F846-I861 HydrophobicContact CZ-CG2 4Å; M853-I861 HydrophobicContact CE-CD1 3.26Å; F857-I861 HydrophobicContact CD1-CD1 4.02Å; F857-I861 HydrophobicContact CE1-CD1 3.8Å; F857-I861 HydrophobicContact CZ-CD1 4.21Å; F857-I861 WeakPolarHBondContact O-CG1 3.44Å; F857-I861 PolarHBondContact O-N 2.89Å; F857-I861 VanDerWaalsContact O-N 3.11Å; T858-I861 PolarHBondContact O-N 2.92Å; E859-I861 VanDerWaalsContact C-N 3.33Å; E859-I861 PolarHBondContact O-N 3.36Å; I861-Q863 VanDerWaalsContact C-N 3.33Å; I861-Q863 PolarHBondContact O-N 2.75Å; I861-T864 WeakPolarHBondContact O-CB 3.5Å; I861-T864 PolarHBondContact O-N 3.29Å; I861-T864 VanDerWaalsContact O-N 3.14Å; I861-F865 HydrophobicContact CG2-CD2 3.93Å; I861-F865 HydrophobicContact CG2-CE1 4.08Å; I861-F865 HydrophobicContact CG2-CE2 3.35Å; I861-F865 HydrophobicContact CG2-CG 4.5Å; I861-F865 HydrophobicContact CG2-CZ 3.44Å; I861-F865 VanDerWaalsContact CG2-CZ 3.44Å; I861-F865 WeakPolarHBondContact O-CG 3.46Å; I861-F865 PolarHBondContact O-N 3.37Å
862I90.8Very high89.6Confident2 Ų254.2 Ų54.21%0.0128%0.278CS..Hα-helixtrans-59.5-46.2179.4-64162.3000110.4F846 T858 E859 T864 F865 L866 V899 F907 F910F846-I862 HydrophobicContact CE1-CD1 4.07Å; F846-I862 HydrophobicContact CE1-CG1 3.91Å; F846-I862 HydrophobicContact CZ-CD1 4.46Å; F846-I862 HydrophobicContact CZ-CG1 3.93Å; T858-I862 HydrophobicContact CG2-CD1 3.98Å; T858-I862 WeakPolarHBondContact O-CG1 3.32Å; T858-I862 PolarHBondContact O-N 3.13Å; E859-I862 PolarHBondContact O-N 3.5Å; I862-T864 VanDerWaalsContact C-N 3.28Å; I862-T864 PolarHBondContact O-N 2.93Å; I862-F865 PolarHBondContact O-N 3.05Å; I862-L866 HydrophobicContact CG2-CD1 3.8Å; I862-L866 HydrophobicContact CG2-CG 4.25Å; I862-L866 WeakPolarHBondContact O-CB 3.37Å; I862-L866 WeakPolarHBondContact O-CG 3.33Å; I862-L866 PolarHBondContact O-N 2.76Å; I862-V899 HydrophobicContact CD1-CB 4.35Å; I862-V899 HydrophobicContact CD1-CG1 3.83Å; I862-V899 HydrophobicContact CD1-CG2 3.48Å; I862-V899 VanDerWaalsContact CD1-CG2 3.48Å; I862-V899 HydrophobicContact CG1-CG2 3.96Å; I862-F907 HydrophobicContact CD1-CD1 3.9Å; I862-F907 HydrophobicContact CD1-CE1 3.93Å; I862-F910 HydrophobicContact CG2-CD1 4.21Å; I862-F910 HydrophobicContact CG2-CG 4.33Å
863Q90.8Very high89.2Confident79 Ų7953.6 Ų53.637%0.36928%0.275SS..Hα-helixtrans-61.8-38.4178.4-172.965.557.900111.6E859 I861 N867E859-Q863 WeakPolarHBondContact O-CB 3.41Å; E859-Q863 PolarHBondContact O-N 2.66Å; I861-Q863 VanDerWaalsContact C-N 3.33Å; I861-Q863 PolarHBondContact O-N 2.75Å; Q863-N867 PolarHBondContact NE2-OD1 3.3Å; Q863-N867 VanDerWaalsContact O-CB 3.3Å; Q863-N867 WeakPolarHBondContact O-CB 3.33Å; Q863-N867 PolarHBondContact O-N 3.18Å; Q863-N867 PolarHBondContact O-ND2 3.46Å; Q863-N867 PolarHBondContact O-OD1 2.96Å
864T92Very high88.9Confident32 Ų3253.1 Ų53.120%0.19627%0.273CS..Hα-helixtrans-64.7-46.8176.2-59.60000110.4L822 Q860 I861 I862 N867 M868L822-T864 HydrophobicContact CD1-CG2 4.09Å; Q860-T864 WeakPolarHBondContact O-CB 3.39Å; Q860-T864 PolarHBondContact O-N 2.83Å; Q860-T864 PolarHBondContact O-OG1 3.07Å; I861-T864 WeakPolarHBondContact O-CB 3.5Å; I861-T864 PolarHBondContact O-N 3.29Å; I861-T864 VanDerWaalsContact O-N 3.14Å; I862-T864 VanDerWaalsContact C-N 3.28Å; I862-T864 PolarHBondContact O-N 2.93Å; T864-N867 PolarHBondContact O-N 3.25Å; T864-M868 HydrophobicContact CG2-CG 4.29Å; T864-M868 WeakPolarHBondContact O-CB 3.38Å; T864-M868 WeakPolarHBondContact O-CG 3.42Å; T864-M868 PolarHBondContact O-N 2.85Å
865F92.4Very high88.8Confident2 Ų253.4 Ų53.41%0.00927%0.273CS..Hα-helixtrans-63.2-46.2177.7-62.8-18.4000112.6F825 L839 F842 I861 I862 N867 M868 F869 F892 I895F825-F865 AromaticContact CD1-CD1 3.96Å; F825-F865 HydrophobicContact CD1-CD1 3.96Å; F825-F865 AromaticContact CD1-CE1 3.88Å; F825-F865 HydrophobicContact CD1-CE1 3.88Å; F825-F865 HydrophobicContact CD2-CE1 4.04Å; F825-F865 AromaticContact CE1-CD1 3.55Å; F825-F865 HydrophobicContact CE1-CD1 3.55Å; F825-F865 AromaticContact CE1-CE1 3.77Å; F825-F865 HydrophobicContact CE1-CE1 3.77Å; F825-F865 HydrophobicContact CE2-CD1 4.41Å; F825-F865 AromaticContact CE2-CE1 3.94Å; F825-F865 HydrophobicContact CE2-CE1 3.94Å; F825-F865 HydrophobicContact CG-CE1 4.01Å; F825-F865 AromaticContact CZ-CD1 3.81Å; F825-F865 HydrophobicContact CZ-CD1 3.81Å; F825-F865 AromaticContact CZ-CE1 3.81Å; F825-F865 HydrophobicContact CZ-CE1 3.81Å; L839-F865 HydrophobicContact CD2-CD2 4.47Å; L839-F865 HydrophobicContact CD2-CE1 4.25Å; L839-F865 HydrophobicContact CD2-CE2 4.08Å; L839-F865 HydrophobicContact CD2-CZ 3.96Å; F842-F865 HydrophobicContact CB-CE2 4.22Å; F842-F865 HydrophobicContact CB-CZ 4.05Å; F842-F865 HydrophobicContact CD1-CZ 4.26Å; F842-F865 HydrophobicContact CD2-CE1 4.3Å; F842-F865 AromaticContact CD2-CZ 3.55Å; F842-F865 HydrophobicContact CD2-CZ 3.55Å; F842-F865 HydrophobicContact CE2-CE1 4.4Å; F842-F865 AromaticContact CE2-CZ 3.99Å; F842-F865 HydrophobicContact CE2-CZ 3.99Å; F842-F865 HydrophobicContact CG-CE2 4.3Å; F842-F865 AromaticContact CG-CZ 3.7Å; F842-F865 HydrophobicContact CG-CZ 3.7Å; I861-F865 HydrophobicContact CG2-CD2 3.93Å; I861-F865 HydrophobicContact CG2-CE1 4.08Å; I861-F865 HydrophobicContact CG2-CE2 3.35Å; I861-F865 HydrophobicContact CG2-CG 4.5Å; I861-F865 HydrophobicContact CG2-CZ 3.44Å; I861-F865 VanDerWaalsContact CG2-CZ 3.44Å; I861-F865 WeakPolarHBondContact O-CG 3.46Å; I861-F865 PolarHBondContact O-N 3.37Å; I862-F865 PolarHBondContact O-N 3.05Å; F865-N867 PolarHBondContact O-N 2.9Å; F865-M868 PolarHBondContact O-N 2.64Å; F865-M868 VanDerWaalsContact O-N 3.16Å; F865-F869 HydrophobicContact CB-CD2 4.4Å; F865-F869 WeakPolarHBondContact O-CD2 3.49Å; F865-F869 PolarHBondContact O-N 3.33Å; F865-F892 HydrophobicContact CB-CD2 4.16Å; F865-F892 HydrophobicContact CB-CE2 3.6Å; F865-F892 HydrophobicContact CB-CZ 4.38Å; F865-I895 HydrophobicContact CD2-CD1 4.42Å; F865-I895 HydrophobicContact CD2-CG2 4.5Å; F865-I895 HydrophobicContact CE2-CD1 3.91Å
866L89Confident88.6Confident26 Ų2655.9 Ų55.914%0.13628%0.28CS..Hα-helixtrans-60.7-33.4177-72.6173.4000112.6I862 F892 L896 F910 L917I862-L866 HydrophobicContact CG2-CD1 3.8Å; I862-L866 HydrophobicContact CG2-CG 4.25Å; I862-L866 WeakPolarHBondContact O-CB 3.37Å; I862-L866 WeakPolarHBondContact O-CG 3.33Å; I862-L866 PolarHBondContact O-N 2.76Å; L866-F892 HydrophobicContact CD2-CZ 4.17Å; L866-L896 HydrophobicContact CD2-CD2 4.46Å; L866-F910 HydrophobicContact CD1-CD1 3.97Å; L866-L917 HydrophobicContact CD2-CD2 4Å
867N90Very high88.3Confident91 Ų9151.8 Ų51.849%0.48725%0.254SS..Hα-helixtrans-77.8-27.7177.7-71.2-10.1000113.2Q863 T864 F865Q863-N867 PolarHBondContact NE2-OD1 3.3Å; Q863-N867 VanDerWaalsContact O-CB 3.3Å; Q863-N867 WeakPolarHBondContact O-CB 3.33Å; Q863-N867 PolarHBondContact O-N 3.18Å; Q863-N867 PolarHBondContact O-ND2 3.46Å; Q863-N867 PolarHBondContact O-OD1 2.96Å; T864-N867 PolarHBondContact O-N 3.25Å; F865-N867 PolarHBondContact O-N 2.9Å
868M88.4Confident87.9Confident68 Ų6850.8 Ų50.834%0.33525%0.249SC..Hα-helixtrans-90.8-33.2-175.6-63.8-67.380.600113.4F825 P826 I829 T864 F865 T870F825-M868 HydrophobicContact CE1-CB 4.38Å; P826-M868 HydrophobicContact CB-SD 4.2Å; I829-M868 HydrophobicContact CD1-CB 4.47Å; T864-M868 HydrophobicContact CG2-CG 4.29Å; T864-M868 WeakPolarHBondContact O-CB 3.38Å; T864-M868 WeakPolarHBondContact O-CG 3.42Å; T864-M868 PolarHBondContact O-N 2.85Å; F865-M868 PolarHBondContact O-N 2.64Å; F865-M868 VanDerWaalsContact O-N 3.16Å; M868-T870 VanDerWaalsContact C-N 3.3Å; M868-T870 PolarHBondContact O-N 3.47Å
869F88.8Confident87.1Confident1 Ų155.6 Ų55.60%0.00428%0.275CS..  trans-81.375.5175.2-76.2-69.6000111.6F825 I829 T835 L839 F865 L874 V888 F892F825-F869 HydrophobicContact CE1-CE2 4.37Å; F825-F869 AromaticContact CZ-CE2 3.83Å; F825-F869 HydrophobicContact CZ-CE2 3.83Å; F825-F869 HydrophobicContact CZ-CZ 4.05Å; I829-F869 HydrophobicContact CD1-CE1 3.99Å; I829-F869 HydrophobicContact CD1-CE2 4.49Å; I829-F869 HydrophobicContact CD1-CZ 3.95Å; T835-F869 HydrophobicContact CG2-CZ 4.32Å; L839-F869 HydrophobicContact CD1-CE2 4.28Å; L839-F869 HydrophobicContact CD1-CZ 3.91Å; L839-F869 HydrophobicContact CD2-CE2 4.49Å; F865-F869 HydrophobicContact CB-CD2 4.4Å; F865-F869 WeakPolarHBondContact O-CD2 3.49Å; F865-F869 PolarHBondContact O-N 3.33Å; F869-L874 HydrophobicContact CB-CD2 4.22Å; F869-L874 HydrophobicContact CB-CG 4.33Å; F869-L874 HydrophobicContact CD1-CD2 3.93Å; F869-L874 HydrophobicContact CG-CD2 4.39Å; F869-V888 HydrophobicContact CE1-CG1 3.62Å; F869-V888 HydrophobicContact CZ-CG1 3.69Å; F869-F892 HydrophobicContact CB-CD1 4.17Å; F869-F892 HydrophobicContact CB-CE1 3.63Å; F869-F892 HydrophobicContact CB-CZ 4.14Å; F869-F892 HydrophobicContact CD1-CD1 4.4Å; F869-F892 AromaticContact CD2-CD1 3.64Å; F869-F892 HydrophobicContact CD2-CD1 3.64Å; F869-F892 AromaticContact CD2-CD2 3.91Å; F869-F892 HydrophobicContact CD2-CD2 3.91Å; F869-F892 AromaticContact CD2-CE1 3.64Å; F869-F892 HydrophobicContact CD2-CE1 3.64Å; F869-F892 AromaticContact CD2-CE2 3.95Å; F869-F892 HydrophobicContact CD2-CE2 3.95Å; F869-F892 AromaticContact CD2-CG 3.77Å; F869-F892 HydrophobicContact CD2-CG 3.77Å; F869-F892 AromaticContact CD2-CZ 3.8Å; F869-F892 HydrophobicContact CD2-CZ 3.8Å; F869-F892 HydrophobicContact CE2-CB 4.18Å; F869-F892 HydrophobicContact CE2-CD1 4.14Å; F869-F892 HydrophobicContact CE2-CD2 4.03Å; F869-F892 HydrophobicContact CE2-CE2 4.48Å; F869-F892 AromaticContact CE2-CG 3.86Å; F869-F892 HydrophobicContact CE2-CG 3.86Å; F869-F892 AromaticContact CG-CD1 3.81Å; F869-F892 HydrophobicContact CG-CD1 3.81Å; F869-F892 AromaticContact CG-CE1 3.74Å; F869-F892 HydrophobicContact CG-CE1 3.74Å; F869-F892 HydrophobicContact CG-CG 4.36Å; F869-F892 HydrophobicContact CG-CZ 4.27Å; F869-F892 HydrophobicContact CZ-CB 4.48Å
870T87.9Confident86.2Confident68 Ų6857.8 Ų57.842%0.41729%0.285SS..  trans-73.7162.3172.769.10000111.3M868 E872 Q873 L874M868-T870 VanDerWaalsContact C-N 3.3Å; M868-T870 PolarHBondContact O-N 3.47Å; T870-E872 PolarHBondContact O-N 2.93Å; T870-Q873 PolarHBondContact O-N 3.13Å; T870-Q873 VanDerWaalsContact O-N 3.14Å; T870-Q873 PolarHBondContact OG1-N 3.17Å; T870-L874 WeakPolarHBondContact O-CG 3.36Å; T870-L874 PolarHBondContact O-N 3.05Å
871R85.1Confident84.7Confident148 Ų14858.3 Ų58.356%0.55829%0.287SS*.Hα-helixtrans-53.7-38.3175.5-175.1179178.6-176.10.7113.2A875 Q921R871-A875 VanDerWaalsContact O-CB 3.24Å; R871-A875 WeakPolarHBondContact O-CB 3.34Å; R871-A875 PolarHBondContact O-N 3.15Å; R871-Q921 HydrophobicContact CB-CB 4.46Å; R871-Q921 HydrophobicContact CB-CG 4.5Å
872E84.3Confident83.3Confident165 Ų16561.4 Ų61.477%0.77132%0.319SS*.Hα-helixtrans-65.7-46.7178.6-68175-176.200111.1T870 L874 A875 E876T870-E872 PolarHBondContact O-N 2.93Å; E872-L874 PolarHBondContact O-N 3.15Å; E872-A875 PolarHBondContact O-N 3.45Å; E872-E876 PolarHBondContact O-N 3.16Å
873Q83.7Confident82.8Confident17 Ų1763 Ų638%0.07933%0.33CS..Hα-helixtrans-64.9-39.7178.8-169.362.131.100112.2I829 H830 T870 S877I829-Q873 HydrophobicContact CG1-CG 4.27Å; I829-Q873 PolarHBondContact O-NE2 3.16Å; H830-Q873 PolarHBondContact CE1-OE1 3.35Å; H830-Q873 PolarHBondContact ND1-OE1 3.08Å; H830-Q873 VanDerWaalsContact ND1-OE1 3.08Å; T870-Q873 PolarHBondContact O-N 3.13Å; T870-Q873 VanDerWaalsContact O-N 3.14Å; T870-Q873 PolarHBondContact OG1-N 3.17Å; Q873-S877 WeakPolarHBondContact O-CB 3.29Å; Q873-S877 PolarHBondContact O-N 3.29Å; Q873-S877 PolarHBondContact O-OG 2.96Å
874L86.3Confident82.3Confident0 Ų060.9 Ų60.90%032%0.323CS..Hα-helixtrans-65.8-43.5175.1-69.2167.7000111F869 T870 E872 E876 S877 I878 V889 L917 Q921 V922 I925F869-L874 HydrophobicContact CB-CD2 4.22Å; F869-L874 HydrophobicContact CB-CG 4.33Å; F869-L874 HydrophobicContact CD1-CD2 3.93Å; F869-L874 HydrophobicContact CG-CD2 4.39Å; T870-L874 WeakPolarHBondContact O-CG 3.36Å; T870-L874 PolarHBondContact O-N 3.05Å; E872-L874 PolarHBondContact O-N 3.15Å; L874-E876 PolarHBondContact O-N 3.17Å; L874-S877 PolarHBondContact O-N 3.21Å; L874-I878 WeakPolarHBondContact O-CB 3.33Å; L874-I878 VanDerWaalsContact O-CD1 3.28Å; L874-I878 WeakPolarHBondContact O-CD1 3.47Å; L874-I878 WeakPolarHBondContact O-CG1 3.49Å; L874-I878 PolarHBondContact O-N 3.3Å; L874-I878 VanDerWaalsContact O-N 3.11Å; L874-V889 HydrophobicContact CD2-CG1 4.28Å; L874-V889 HydrophobicContact CD2-CG2 3.89Å; L874-L917 HydrophobicContact CD1-CD1 3.89Å; L874-Q921 HydrophobicContact CD1-CB 4.21Å; L874-V922 HydrophobicContact CD1-CG2 3.97Å; L874-I925 HydrophobicContact CB-CD1 4.08Å
875A85.8Confident82Confident32 Ų3259.6 Ų59.626%0.26432%0.316SS..Hα-helixtrans-61.3-46.1177.700000111.3R871 E872 S877 I878 L879 I925R871-A875 VanDerWaalsContact O-CB 3.24Å; R871-A875 WeakPolarHBondContact O-CB 3.34Å; R871-A875 PolarHBondContact O-N 3.15Å; E872-A875 PolarHBondContact O-N 3.45Å; A875-S877 PolarHBondContact O-N 3.17Å; A875-I878 PolarHBondContact O-N 3.48Å; A875-L879 WeakPolarHBondContact O-CG 3.44Å; A875-L879 PolarHBondContact O-N 3.49Å; A875-I925 HydrophobicContact CB-CD1 4.01Å
876E83.4Confident81.7Confident116 Ų11659.8 Ų59.854%0.54232%0.317SS..Hα-helixtrans-59.5-44.1176.3-172.4179.3-175.600112E872 L874 I878 L879E872-E876 PolarHBondContact O-N 3.16Å; L874-E876 PolarHBondContact O-N 3.17Å; E876-I878 VanDerWaalsContact C-N 3.28Å; E876-I878 PolarHBondContact O-N 3.21Å; E876-L879 PolarHBondContact O-N 2.94Å
877S83.3Confident81.6Confident13 Ų1363.9 Ų63.99%0.09133%0.331CS..Hα-helixtrans-67.4-26.5-178.5-57.70000113.4Q873 L874 A875 G885 C886Q873-S877 WeakPolarHBondContact O-CB 3.29Å; Q873-S877 PolarHBondContact O-N 3.29Å; Q873-S877 PolarHBondContact O-OG 2.96Å; L874-S877 PolarHBondContact O-N 3.21Å; A875-S877 PolarHBondContact O-N 3.17Å; S877-G885 CarbonylContact O-C 3.53Å; S877-G885 WeakPolarHBondContact O-CA 3.22Å; S877-C886 PolarHBondContact O-N 3.41Å
878I82.3Confident81.7Confident7 Ų759.7 Ų59.74%0.03631%0.309CS..THydrogen-bonded Turntrans-95.7-1.1-177-60.5164.4000111.9L874 A875 E876 H880 V889 I925 I926L874-I878 WeakPolarHBondContact O-CB 3.33Å; L874-I878 VanDerWaalsContact O-CD1 3.28Å; L874-I878 WeakPolarHBondContact O-CD1 3.47Å; L874-I878 WeakPolarHBondContact O-CG1 3.49Å; L874-I878 PolarHBondContact O-N 3.3Å; L874-I878 VanDerWaalsContact O-N 3.11Å; A875-I878 PolarHBondContact O-N 3.48Å; E876-I878 VanDerWaalsContact C-N 3.28Å; E876-I878 PolarHBondContact O-N 3.21Å; I878-H880 VanDerWaalsContact C-N 3.31Å; I878-H880 PolarHBondContact O-N 3.03Å; I878-V889 HydrophobicContact CD1-CG1 4.33Å; I878-V889 HydrophobicContact CD1-CG2 4.28Å; I878-V889 HydrophobicContact CG1-CG2 4.01Å; I878-I925 HydrophobicContact CB-CG2 4.08Å; I878-I925 HydrophobicContact CD1-CD1 4.41Å; I878-I925 HydrophobicContact CD1-CG2 4.05Å; I878-I925 HydrophobicContact CG2-CG2 3.85Å; I878-I926 HydrophobicContact CD1-CG2 4.28Å; I878-I926 HydrophobicContact CG2-CG2 3.96Å
879L72.9Confident81.9Confident102 Ų10256.5 Ų56.553%0.53429%0.293SS..SBendtrans-61.8-33.7-176-78.2171.2000114.1A875 E876A875-L879 WeakPolarHBondContact O-CG 3.44Å; A875-L879 PolarHBondContact O-N 3.49Å; E876-L879 PolarHBondContact O-N 2.94Å
880H68.2Low82.1Confident137 Ų13757.8 Ų57.863%0.63430%0.299SS*.SBendtrans-120.7118.2-177.9-65.9-63.3000110.5I878 S883 C886I878-H880 VanDerWaalsContact C-N 3.31Å; I878-H880 PolarHBondContact O-N 3.03Å; H880-S883 WeakPolarHBondContact O-CB 3.5Å; H880-S883 PolarHBondContact O-N 3.22Å; H880-S883 PolarHBondContact O-OG 3.21Å; H880-C886 PolarHBondContact O-SG 2.99Å; H880-C886 VanDerWaalsContact O-SG 3.39Å
881E60.3Low82.3Confident119 Ų11956.3 Ų56.356%0.55629%0.287SS*.THydrogen-bonded Turntrans-59.7142174.4-72.8166.8-155.700111.2S883 P930E881-S883 PolarHBondContact O-N 3.37Å; E881-S883 VanDerWaalsContact O-N 3.11Å; E881-P930 WeakPolarHBondContact CG-O 3.33Å; E881-P930 VanDerWaalsContact OE1-CD 3.3Å; E881-P930 WeakPolarHBondContact OE1-CD 3.45Å; E881-P930 WeakPolarHBondContact OE1-CG 3.46Å
882G63.1Low82.8Confident65 Ų6549.2 Ų49.267%0.6726%0.26SS*.THydrogen-bonded Turntrans68.23-176.300000115
883S81.2Confident83.3Confident35 Ų3541.4 Ų41.425%0.24522%0.224CC..SBendtrans-72.5158.9177.472.10000111.9H880 E881 G885 C886H880-S883 WeakPolarHBondContact O-CB 3.5Å; H880-S883 PolarHBondContact O-N 3.22Å; H880-S883 PolarHBondContact O-OG 3.21Å; E881-S883 PolarHBondContact O-N 3.37Å; E881-S883 VanDerWaalsContact O-N 3.11Å; S883-G885 PolarHBondContact O-N 2.92Å; S883-G885 VanDerWaalsContact O-N 3.14Å; S883-G885 PolarHBondContact OG-N 3.45Å; S883-C886 PolarHBondContact O-N 3.02Å
884T80.9Confident83.9Confident35 Ų3543 Ų4322%0.21523%0.23CC..Hα-helixtrans-57.6-25170.4-46.70000112.3S832 D836 R887 V888S832-T884 WeakPolarHBondContact O-CG2 3.47Å; D836-T884 HydrophobicContact CB-CG2 3.69Å; T884-R887 PolarHBondContact O-N 3.41Å; T884-R887 PolarHBondContact OG1-NH2 3.13Å; T884-V888 WeakPolarHBondContact O-CG2 3.42Å; T884-V888 PolarHBondContact O-N 3.18Å; T884-V888 VanDerWaalsContact O-N 3.11Å
885G84.5Confident84.3Confident5 Ų543 Ų435%0.05223%0.23CC..Hα-helixtrans-64.4-38.217300000113.6S877 S883 V888 V889S877-G885 CarbonylContact O-C 3.53Å; S877-G885 WeakPolarHBondContact O-CA 3.22Å; S883-G885 PolarHBondContact O-N 2.92Å; S883-G885 VanDerWaalsContact O-N 3.14Å; S883-G885 PolarHBondContact OG-N 3.45Å; G885-V888 WeakPolarHBondContact O-CB 3.42Å; G885-V888 PolarHBondContact O-N 2.94Å; G885-V889 PolarHBondContact O-N 2.92Å
886C86.1Confident84.7Confident5 Ų541.6 Ų41.63%0.03422%0.218CC..Hα-helixtrans-63.9-44174.9-70.40000111.2S877 H880 S883 V888 V889 E890 V934S877-C886 PolarHBondContact O-N 3.41Å; H880-C886 PolarHBondContact O-SG 2.99Å; H880-C886 VanDerWaalsContact O-SG 3.39Å; S883-C886 PolarHBondContact O-N 3.02Å; C886-V888 VanDerWaalsContact C-N 3.31Å; C886-V888 PolarHBondContact O-N 3.4Å; C886-V889 PolarHBondContact O-N 3.14Å; C886-E890 WeakPolarHBondContact O-CG 3.43Å; C886-E890 PolarHBondContact O-N 3Å; C886-V934 HydrophobicContact CB-CG2 4.1Å
887R88.3Confident85.2Confident112 Ų11236.2 Ų36.242%0.42319%0.193SC..Hα-helixtrans-60.4-37177-67.5-174.6-82.8169.1-2.1113.1D836 T884 E890 K891D836-R887 WeakPolarHBondContact OD1-CB 3.41Å; T884-R887 PolarHBondContact O-N 3.41Å; T884-R887 PolarHBondContact OG1-NH2 3.13Å; R887-E890 PolarHBondContact O-N 3.34Å; R887-K891 WeakPolarHBondContact O-CB 3.32Å; R887-K891 WeakPolarHBondContact O-CG 3.45Å; R887-K891 PolarHBondContact O-N 2.86Å
888V91Very high85.6Confident4 Ų436.3 Ų36.32%0.02419%0.193CC..Hα-helixtrans-58.5-49.1171.7167.50000110.9T835 D836 L839 F869 T884 G885 C886 K891 F892T835-V888 HydrophobicContact CG2-CG1 3.68Å; T835-V888 HydrophobicContact CG2-CG2 4.03Å; D836-V888 HydrophobicContact CB-CG2 3.85Å; L839-V888 HydrophobicContact CD1-CB 4.43Å; L839-V888 HydrophobicContact CD1-CG1 3.76Å; L839-V888 WeakPolarHBondContact CD1-O 3.36Å; F869-V888 HydrophobicContact CE1-CG1 3.62Å; F869-V888 HydrophobicContact CZ-CG1 3.69Å; T884-V888 WeakPolarHBondContact O-CG2 3.42Å; T884-V888 PolarHBondContact O-N 3.18Å; T884-V888 VanDerWaalsContact O-N 3.11Å; G885-V888 WeakPolarHBondContact O-CB 3.42Å; G885-V888 PolarHBondContact O-N 2.94Å; C886-V888 VanDerWaalsContact C-N 3.31Å; C886-V888 PolarHBondContact O-N 3.4Å; V888-K891 PolarHBondContact O-N 2.84Å; V888-F892 WeakPolarHBondContact O-CB 3.41Å; V888-F892 PolarHBondContact O-N 3.06Å
889V91.8Very high85.9Confident0 Ų036.1 Ų36.10%019%0.192CC..Hα-helixtrans-65.6-43.6179.8-179.80000110.9L874 I878 G885 C886 K891 F892 L893 V934L874-V889 HydrophobicContact CD2-CG1 4.28Å; L874-V889 HydrophobicContact CD2-CG2 3.89Å; I878-V889 HydrophobicContact CD1-CG1 4.33Å; I878-V889 HydrophobicContact CD1-CG2 4.28Å; I878-V889 HydrophobicContact CG1-CG2 4.01Å; G885-V889 PolarHBondContact O-N 2.92Å; C886-V889 PolarHBondContact O-N 3.14Å; V889-K891 PolarHBondContact O-N 3.21Å; V889-F892 PolarHBondContact O-N 3.37Å; V889-L893 HydrophobicContact CG1-CD1 4.11Å; V889-L893 HydrophobicContact CG1-CG 4.33Å; V889-L893 VanDerWaalsContact O-CG 3.31Å; V889-L893 WeakPolarHBondContact O-CG 3.42Å; V889-L893 PolarHBondContact O-N 3.19Å; V889-V934 HydrophobicContact CG1-CG1 3.84Å
890E93.1Very high86.7Confident29 Ų2931.4 Ų31.414%0.13617%0.167CC..Hα-helixtrans-56.3-50.7175.3-71.9164-139.900112.1C886 R887 F892 L893 K894 D933 V934 E937C886-E890 WeakPolarHBondContact O-CG 3.43Å; C886-E890 PolarHBondContact O-N 3Å; R887-E890 PolarHBondContact O-N 3.34Å; E890-F892 VanDerWaalsContact C-N 3.31Å; E890-F892 PolarHBondContact O-N 3.44Å; E890-L893 PolarHBondContact O-N 2.98Å; E890-K894 WeakPolarHBondContact O-CG 3.43Å; E890-K894 PolarHBondContact O-N 2.97Å; E890-D933 HydrophobicContact CG-CB 4.27Å; E890-D933 WeakPolarHBondContact OE1-CB 3.38Å; E890-V934 HydrophobicContact CG-CG2 4.24Å; E890-E937 HydrophobicContact CB-CG 4.25Å; E890-E937 HydrophobicContact CG-CG 4.18Å
891K93.5Very high87.8Confident36 Ų3627.5 Ų27.516%0.15715%0.15CC..Hα-helixtrans-62.8-39.3178.7-74.9174.4176164.80111.6D836 L839 L843 R887 V888 V889 K894 I895D836-K891 WeakPolarHBondContact O-CD 3.5Å; D836-K891 PolarHBondContact O-NZ 3.08Å; D836-K891 VanDerWaalsContact OD1-CD 3.29Å; D836-K891 WeakPolarHBondContact OD1-CD 3.47Å; D836-K891 VanDerWaalsContact OD1-CE 3.3Å; D836-K891 WeakPolarHBondContact OD1-CE 3.08Å; D836-K891 IonicContact OD1-NZ 3.55Å; D836-K891 PolarHBondContact OD1-NZ 3.31Å; D836-K891 IonicContact OD2-NZ 3.96Å; D836-K891 PolarHBondContact OD2-NZ 3.02Å; L839-K891 HydrophobicContact CB-CB 3.9Å; L839-K891 HydrophobicContact CB-CD 4.26Å; L839-K891 HydrophobicContact CD1-CB 4.31Å; L843-K891 HydrophobicContact CD2-CG 4.46Å; R887-K891 WeakPolarHBondContact O-CB 3.32Å; R887-K891 WeakPolarHBondContact O-CG 3.45Å; R887-K891 PolarHBondContact O-N 2.86Å; V888-K891 PolarHBondContact O-N 2.84Å; V889-K891 PolarHBondContact O-N 3.21Å; K891-K894 WeakPolarHBondContact O-CB 3.44Å; K891-K894 PolarHBondContact O-N 3.43Å; K891-I895 WeakPolarHBondContact O-CG1 3.34Å; K891-I895 PolarHBondContact O-N 3.03Å
892F94.8Very high88.9Confident0 Ų024.2 Ų24.20%013%0.134CC..Hα-helixtrans-61.7-46.7174.9175.9-135.4000111.8L839 F865 L866 F869 V888 V889 E890 K894 I895 L896 L917L839-F892 HydrophobicContact CD1-CB 4.06Å; F865-F892 HydrophobicContact CB-CD2 4.16Å; F865-F892 HydrophobicContact CB-CE2 3.6Å; F865-F892 HydrophobicContact CB-CZ 4.38Å; L866-F892 HydrophobicContact CD2-CZ 4.17Å; F869-F892 HydrophobicContact CB-CD1 4.17Å; F869-F892 HydrophobicContact CB-CE1 3.63Å; F869-F892 HydrophobicContact CB-CZ 4.14Å; F869-F892 HydrophobicContact CD1-CD1 4.4Å; F869-F892 AromaticContact CD2-CD1 3.64Å; F869-F892 HydrophobicContact CD2-CD1 3.64Å; F869-F892 AromaticContact CD2-CD2 3.91Å; F869-F892 HydrophobicContact CD2-CD2 3.91Å; F869-F892 AromaticContact CD2-CE1 3.64Å; F869-F892 HydrophobicContact CD2-CE1 3.64Å; F869-F892 AromaticContact CD2-CE2 3.95Å; F869-F892 HydrophobicContact CD2-CE2 3.95Å; F869-F892 AromaticContact CD2-CG 3.77Å; F869-F892 HydrophobicContact CD2-CG 3.77Å; F869-F892 AromaticContact CD2-CZ 3.8Å; F869-F892 HydrophobicContact CD2-CZ 3.8Å; F869-F892 HydrophobicContact CE2-CB 4.18Å; F869-F892 HydrophobicContact CE2-CD1 4.14Å; F869-F892 HydrophobicContact CE2-CD2 4.03Å; F869-F892 HydrophobicContact CE2-CE2 4.48Å; F869-F892 AromaticContact CE2-CG 3.86Å; F869-F892 HydrophobicContact CE2-CG 3.86Å; F869-F892 AromaticContact CG-CD1 3.81Å; F869-F892 HydrophobicContact CG-CD1 3.81Å; F869-F892 AromaticContact CG-CE1 3.74Å; F869-F892 HydrophobicContact CG-CE1 3.74Å; F869-F892 HydrophobicContact CG-CG 4.36Å; F869-F892 HydrophobicContact CG-CZ 4.27Å; F869-F892 HydrophobicContact CZ-CB 4.48Å; V888-F892 WeakPolarHBondContact O-CB 3.41Å; V888-F892 PolarHBondContact O-N 3.06Å; V889-F892 PolarHBondContact O-N 3.37Å; E890-F892 VanDerWaalsContact C-N 3.31Å; E890-F892 PolarHBondContact O-N 3.44Å; F892-K894 VanDerWaalsContact C-N 3.34Å; F892-K894 PolarHBondContact O-N 2.89Å; F892-I895 WeakPolarHBondContact O-CB 3.47Å; F892-I895 PolarHBondContact O-N 2.86Å; F892-L896 HydrophobicContact CD2-CG 4.43Å; F892-L896 HydrophobicContact CE1-CD1 4.32Å; F892-L896 HydrophobicContact CE2-CD1 4.04Å; F892-L896 HydrophobicContact CE2-CD2 4.15Å; F892-L896 HydrophobicContact CE2-CG 4.05Å; F892-L896 HydrophobicContact CZ-CD1 3.91Å; F892-L896 HydrophobicContact CZ-CG 4.42Å; F892-L896 PolarHBondContact O-N 3.26Å; F892-L896 VanDerWaalsContact O-N 3.13Å; F892-L917 HydrophobicContact CE1-CD1 4.41Å; F892-L917 HydrophobicContact CE1-CD2 3.54Å; F892-L917 HydrophobicContact CZ-CD2 3.75Å
893L95.4Very high89.4Confident1 Ų126.8 Ų26.81%0.00514%0.139CC..Hα-helixtrans-60.9-42175-65.8174.9000111.4V889 E890 I895 L896 Q897 V934 E937 L938 L941V889-L893 HydrophobicContact CG1-CD1 4.11Å; V889-L893 HydrophobicContact CG1-CG 4.33Å; V889-L893 VanDerWaalsContact O-CG 3.31Å; V889-L893 WeakPolarHBondContact O-CG 3.42Å; V889-L893 PolarHBondContact O-N 3.19Å; E890-L893 PolarHBondContact O-N 2.98Å; L893-I895 VanDerWaalsContact C-N 3.32Å; L893-I895 PolarHBondContact O-N 3.32Å; L893-L896 CarbonylContact O-C 3.59Å; L893-L896 WeakPolarHBondContact O-CB 3.27Å; L893-L896 PolarHBondContact O-N 3.42Å; L893-L896 VanDerWaalsContact O-N 3.12Å; L893-Q897 WeakPolarHBondContact O-CG 3.44Å; L893-Q897 PolarHBondContact O-N 3.06Å; L893-V934 HydrophobicContact CD1-CG1 4.22Å; L893-E937 HydrophobicContact CB-CB 4.22Å; L893-E937 HydrophobicContact CD1-CB 4.15Å; L893-L938 HydrophobicContact CD1-CB 4.13Å; L893-L938 HydrophobicContact CD2-CD1 4.29Å; L893-L941 HydrophobicContact CD2-CD2 3.79Å
894K95.6Very high89Confident50 Ų5026.7 Ų26.722%0.21714%0.144CC..Hα-helixtrans-59.2-37.8173.9-75.4175.2-178.8170.60113.2L843 E890 K891 F892 Q897 V898 E937L843-K894 HydrophobicContact CD1-CB 3.79Å; L843-K894 HydrophobicContact CD2-CB 3.81Å; L843-K894 HydrophobicContact CD2-CD 4.02Å; L843-K894 HydrophobicContact CG-CB 4.49Å; E890-K894 WeakPolarHBondContact O-CG 3.43Å; E890-K894 PolarHBondContact O-N 2.97Å; K891-K894 WeakPolarHBondContact O-CB 3.44Å; K891-K894 PolarHBondContact O-N 3.43Å; F892-K894 VanDerWaalsContact C-N 3.34Å; F892-K894 PolarHBondContact O-N 2.89Å; K894-Q897 WeakPolarHBondContact O-CB 3.01Å; K894-Q897 PolarHBondContact O-N 3.37Å; K894-V898 WeakPolarHBondContact O-CG2 3.5Å; K894-V898 PolarHBondContact O-N 2.86Å; K894-E937 WeakPolarHBondContact CE-OE1 3.3Å; K894-E937 WeakPolarHBondContact CE-OE2 3.35Å; K894-E937 VanDerWaalsContact CG-OE2 3.29Å; K894-E937 WeakPolarHBondContact CG-OE2 3.45Å; K894-E937 IonicContact NZ-OE1 3.7Å; K894-E937 PolarHBondContact NZ-OE1 3.32Å
895I94.3Very high88.8Confident0 Ų031.6 Ų31.60%016%0.164CC..Hα-helixtrans-63.3-46.8174.4-69.1167.9000109.6L839 F842 L843 F846 F865 K891 F892 L893 Q897 V898 V899L839-I895 HydrophobicContact CD2-CD1 3.93Å; F842-I895 HydrophobicContact CB-CD1 4.13Å; L843-I895 HydrophobicContact CB-CD1 4.28Å; L843-I895 HydrophobicContact CB-CG1 3.84Å; L843-I895 HydrophobicContact CD1-CG1 3.81Å; L843-I895 HydrophobicContact CG-CG1 4.4Å; F846-I895 HydrophobicContact CD1-CG2 4.07Å; F846-I895 HydrophobicContact CE1-CG2 4.08Å; F846-I895 HydrophobicContact CG-CG2 4.28Å; F846-I895 HydrophobicContact CZ-CG2 4.3Å; F865-I895 HydrophobicContact CD2-CD1 4.42Å; F865-I895 HydrophobicContact CD2-CG2 4.5Å; F865-I895 HydrophobicContact CE2-CD1 3.91Å; K891-I895 WeakPolarHBondContact O-CG1 3.34Å; K891-I895 PolarHBondContact O-N 3.03Å; F892-I895 WeakPolarHBondContact O-CB 3.47Å; F892-I895 PolarHBondContact O-N 2.86Å; L893-I895 VanDerWaalsContact C-N 3.32Å; L893-I895 PolarHBondContact O-N 3.32Å; I895-Q897 VanDerWaalsContact C-N 3.28Å; I895-Q897 PolarHBondContact O-N 2.93Å; I895-V898 WeakPolarHBondContact O-CB 3.46Å; I895-V898 PolarHBondContact O-N 2.68Å; I895-V898 VanDerWaalsContact O-N 3.15Å; I895-V899 WeakPolarHBondContact O-CG2 3.24Å; I895-V899 PolarHBondContact O-N 3.47Å
896L94.1Very high88.4Confident2 Ų234.4 Ų34.41%0.0118%0.18CC..Hα-helixtrans-63.4-34177.2-61.5-179000112.2L866 F892 L893 V898 V899 V900 I914 L917 L941L866-L896 HydrophobicContact CD2-CD2 4.46Å; F892-L896 HydrophobicContact CD2-CG 4.43Å; F892-L896 HydrophobicContact CE1-CD1 4.32Å; F892-L896 HydrophobicContact CE2-CD1 4.04Å; F892-L896 HydrophobicContact CE2-CD2 4.15Å; F892-L896 HydrophobicContact CE2-CG 4.05Å; F892-L896 HydrophobicContact CZ-CD1 3.91Å; F892-L896 HydrophobicContact CZ-CG 4.42Å; F892-L896 PolarHBondContact O-N 3.26Å; F892-L896 VanDerWaalsContact O-N 3.13Å; L893-L896 CarbonylContact O-C 3.59Å; L893-L896 WeakPolarHBondContact O-CB 3.27Å; L893-L896 PolarHBondContact O-N 3.42Å; L893-L896 VanDerWaalsContact O-N 3.12Å; L896-V898 VanDerWaalsContact C-N 3.31Å; L896-V898 PolarHBondContact O-N 3Å; L896-V899 WeakPolarHBondContact O-CB 2.97Å; L896-V899 PolarHBondContact O-N 2.97Å; L896-V899 VanDerWaalsContact O-N 3.11Å; L896-V900 PolarHBondContact O-N 3.36Å; L896-I914 HydrophobicContact CD1-CG1 4.47Å; L896-I914 HydrophobicContact CD1-CG2 4.34Å; L896-I914 HydrophobicContact CD2-CD1 4.19Å; L896-I914 HydrophobicContact CD2-CG1 4.15Å; L896-L917 HydrophobicContact CD1-CD2 3.5Å; L896-L917 VanDerWaalsContact CD1-CD2 3.5Å; L896-L941 HydrophobicContact CB-CD1 4Å; L896-L941 HydrophobicContact CB-CD2 3.85Å; L896-L941 HydrophobicContact CD1-CD2 4.2Å
897Q94.6Very high88.1Confident4 Ų435 Ų352%0.01918%0.182CC..Hα-helixtrans-59.1-42.8173.9-71.1170.616.300111.4L893 K894 I895 V899 V900 Q901 E937 L941L893-Q897 WeakPolarHBondContact O-CG 3.44Å; L893-Q897 PolarHBondContact O-N 3.06Å; K894-Q897 WeakPolarHBondContact O-CB 3.01Å; K894-Q897 PolarHBondContact O-N 3.37Å; I895-Q897 VanDerWaalsContact C-N 3.28Å; I895-Q897 PolarHBondContact O-N 2.93Å; Q897-V899 VanDerWaalsContact C-N 3.29Å; Q897-V899 PolarHBondContact O-N 3.13Å; Q897-V900 WeakPolarHBondContact O-CG2 3.03Å; Q897-Q901 VanDerWaalsContact O-CG 3.28Å; Q897-Q901 WeakPolarHBondContact O-CG 3.14Å; Q897-Q901 PolarHBondContact O-N 3.21Å; Q897-E937 PolarHBondContact NE2-O 3.28Å; Q897-E937 PolarHBondContact NE2-OE2 2.72Å; Q897-L941 HydrophobicContact CB-CD1 4.33Å; Q897-L941 HydrophobicContact CG-CB 3.78Å; Q897-L941 HydrophobicContact CG-CD1 3.87Å; Q897-L941 HydrophobicContact CG-CG 4.39Å
898V91.1Very high87.8Confident14 Ų1432.5 Ų32.59%0.08517%0.174CC..Hα-helixtrans-65-34.8176.21750000111.4L843 F846 R847 R850 K894 I895 L896L843-V898 HydrophobicContact CD1-CG2 4.45Å; F846-V898 HydrophobicContact CB-CG1 4.25Å; R847-V898 HydrophobicContact CG-CG2 4.1Å; R850-V898 PolarHBondContact NH1-O 3.33Å; K894-V898 WeakPolarHBondContact O-CG2 3.5Å; K894-V898 PolarHBondContact O-N 2.86Å; I895-V898 WeakPolarHBondContact O-CB 3.46Å; I895-V898 PolarHBondContact O-N 2.68Å; I895-V898 VanDerWaalsContact O-N 3.15Å; L896-V898 VanDerWaalsContact C-N 3.31Å; L896-V898 PolarHBondContact O-N 3Å
899V88.9Confident87.7Confident3 Ų336.7 Ų36.72%0.01820%0.202CC..Hα-helixtrans-69.6-46.8179175.50000111.5F846 I862 I895 L896 Q897 Q901 E902 F907 I914F846-V899 HydrophobicContact CD1-CG2 4.15Å; F846-V899 HydrophobicContact CE1-CG2 3.84Å; I862-V899 HydrophobicContact CD1-CB 4.35Å; I862-V899 HydrophobicContact CD1-CG1 3.83Å; I862-V899 HydrophobicContact CD1-CG2 3.48Å; I862-V899 VanDerWaalsContact CD1-CG2 3.48Å; I862-V899 HydrophobicContact CG1-CG2 3.96Å; I895-V899 WeakPolarHBondContact O-CG2 3.24Å; I895-V899 PolarHBondContact O-N 3.47Å; L896-V899 WeakPolarHBondContact O-CB 2.97Å; L896-V899 PolarHBondContact O-N 2.97Å; L896-V899 VanDerWaalsContact O-N 3.11Å; Q897-V899 VanDerWaalsContact C-N 3.29Å; Q897-V899 PolarHBondContact O-N 3.13Å; V899-Q901 VanDerWaalsContact C-N 3.29Å; V899-Q901 PolarHBondContact O-N 2.85Å; V899-E902 WeakPolarHBondContact O-CB 3.43Å; V899-E902 PolarHBondContact O-N 3.44Å; V899-F907 HydrophobicContact CG1-CB 3.75Å; V899-F907 HydrophobicContact CG1-CD1 4.3Å; V899-F907 HydrophobicContact CG1-CG 4.02Å; V899-I914 HydrophobicContact CG1-CD1 4.37Å
900V90.8Very high87.5Confident3 Ų337.2 Ų37.22%0.01820%0.204CC..Hα-helixtrans-72-21.7-176.8-59.30000113.3L896 Q897 E902 L911 I914 L941 R944 N949L896-V900 PolarHBondContact O-N 3.36Å; Q897-V900 WeakPolarHBondContact O-CG2 3.03Å; V900-E902 PolarHBondContact O-N 3.03Å; V900-L911 HydrophobicContact CB-CD2 4.3Å; V900-L911 HydrophobicContact CG1-CD2 3.86Å; V900-I914 HydrophobicContact CG1-CD1 3.8Å; V900-I914 HydrophobicContact CG1-CG2 4.23Å; V900-L941 HydrophobicContact CG1-CD1 4.17Å; V900-L941 HydrophobicContact CG2-CD1 3.8Å; V900-R944 HydrophobicContact CG2-CB 3.99Å; V900-N949 PolarHBondContact O-ND2 2.88Å
901Q90.1Very high87.3Confident56 Ų5636 Ų3626%0.26220%0.199SC..THydrogen-bonded Turntrans-74.6-11.6177.2-76.1-176.4-35.500114Q897 V899 R944Q897-Q901 VanDerWaalsContact O-CG 3.28Å; Q897-Q901 WeakPolarHBondContact O-CG 3.14Å; Q897-Q901 PolarHBondContact O-N 3.21Å; V899-Q901 VanDerWaalsContact C-N 3.29Å; V899-Q901 PolarHBondContact O-N 2.85Å; Q901-R944 HydrophobicContact CG-CB 4.17Å; Q901-R944 HydrophobicContact CG-CG 4.26Å
902E84.1Confident87.2Confident50 Ų5036.7 Ų36.723%0.23421%0.207CC..  trans-66.9128.2-175.7-78.9-59.8105.300112.8R850 V899 V900 G904 F907R850-E902 IonicContact CZ-OE1 3.35Å; R850-E902 IonicContact CZ-OE2 2.64Å; R850-E902 IonicContact NE-OE2 3.66Å; R850-E902 IonicContact NH1-OE1 2.92Å; R850-E902 PolarHBondContact NH1-OE1 3.32Å; R850-E902 IonicContact NH1-OE2 3.17Å; R850-E902 IonicContact NH2-OE1 3.54Å; R850-E902 PolarHBondContact NH2-OE1 3.22Å; R850-E902 IonicContact NH2-OE2 3.27Å; R850-E902 PolarHBondContact NH2-OE2 3.35Å; V899-E902 WeakPolarHBondContact O-CB 3.43Å; V899-E902 PolarHBondContact O-N 3.44Å; V900-E902 PolarHBondContact O-N 3.03Å; E902-G904 PolarHBondContact O-N 3.23Å; E902-F907 HydrophobicContact CB-CD2 4.01Å; E902-F907 HydrophobicContact CG-CD2 3.96Å; E902-F907 HydrophobicContact CG-CE2 4.22Å
903P74.2Confident87Confident118 Ų11839.8 Ų39.877%0.76623%0.228SC*.  trans-71.9-14-179.228-33.9000113.5
904G72.4Confident86.9Confident33 Ų3339.8 Ų39.834%0.3423%0.228SC..SBendtrans-73.4159.1-176.800000114.6E902 V906E902-G904 PolarHBondContact O-N 3.23Å; G904-V906 PolarHBondContact O-N 2.78Å
905Q75.4Confident86.8Confident138 Ų13837.6 Ų37.665%0.64522%0.219SC*.SBendtrans-75.5-12173.9-62.7-68.6-10.800113.1F907 K908Q905-F907 PolarHBondContact O-N 2.64Å; Q905-K908 VanDerWaalsContact CD-NZ 3.32Å; Q905-K908 VanDerWaalsContact NE2-NZ 3.15Å; Q905-K908 PolarHBondContact O-N 3.33Å; Q905-K908 VanDerWaalsContact OE1-CD 3.25Å
906V75.8Confident86.7Confident65 Ų6538.8 Ų38.839%0.39423%0.229SC..SBendtrans-60.2-46.2-170.2171.10000113.1V855 G904 P909V855-V906 HydrophobicContact CB-CG1 4.04Å; V855-V906 HydrophobicContact CG1-CB 4.41Å; V855-V906 HydrophobicContact CG1-CG1 3.15Å; V855-V906 HydrophobicContact CG1-CG2 4.42Å; V855-V906 HydrophobicContact CG2-CG1 3.78Å; V855-V906 HydrophobicContact CG2-CG2 4.17Å; G904-V906 PolarHBondContact O-N 2.78Å; V906-P909 VanDerWaalsContact O-CD 3.29Å; V906-P909 WeakPolarHBondContact O-CD 3.5Å
907F80.4Confident86.7Confident17 Ų1738.8 Ų38.88%0.07523%0.229CC..SBendtrans-97.6-1.5-173.7-60.1-64.5000113.7T858 I862 V899 E902 Q905 P909 F910T858-F907 HydrophobicContact CG2-CE1 3.72Å; T858-F907 HydrophobicContact CG2-CZ 3.59Å; I862-F907 HydrophobicContact CD1-CD1 3.9Å; I862-F907 HydrophobicContact CD1-CE1 3.93Å; V899-F907 HydrophobicContact CG1-CB 3.75Å; V899-F907 HydrophobicContact CG1-CD1 4.3Å; V899-F907 HydrophobicContact CG1-CG 4.02Å; E902-F907 HydrophobicContact CB-CD2 4.01Å; E902-F907 HydrophobicContact CG-CD2 3.96Å; E902-F907 HydrophobicContact CG-CE2 4.22Å; Q905-F907 PolarHBondContact O-N 2.64Å; F907-P909 VanDerWaalsContact C-N 3.34Å; F907-F910 HydrophobicContact CB-CD2 4.47Å; F907-F910 HydrophobicContact CD1-CD2 4.28Å; F907-F910 HydrophobicContact CD1-CE2 4.37Å; F907-F910 WeakPolarHBondContact O-CB 3.35Å; F907-F910 PolarHBondContact O-N 3.21Å; F907-F910 VanDerWaalsContact O-N 3.11Å
908K83.3Confident86.7Confident59 Ų5938.7 Ų38.726%0.25723%0.228SC..G310 helixtrans-60.5-31.8176.6-64.5-162.5-169.2164.70115.1Q905 F910 L911Q905-K908 VanDerWaalsContact CD-NZ 3.32Å; Q905-K908 VanDerWaalsContact NE2-NZ 3.15Å; Q905-K908 PolarHBondContact O-N 3.33Å; Q905-K908 VanDerWaalsContact OE1-CD 3.25Å; K908-F910 PolarHBondContact O-N 3.14Å; K908-F910 VanDerWaalsContact O-N 3.13Å; K908-L911 HydrophobicContact CB-CD1 4.09Å; K908-L911 HydrophobicContact CG-CD1 4.12Å; K908-L911 WeakPolarHBondContact O-CB 3.35Å; K908-L911 WeakPolarHBondContact O-CG 3.32Å; K908-L911 PolarHBondContact O-N 3.24Å; K908-L911 VanDerWaalsContact O-N 3.07Å
909P87.5Confident86.9Confident93 Ų9339.4 Ų39.460%0.60423%0.231SC*.G310 helixtrans-56.9-23.2173.3-26.936.6000114.1V906 F907 P912V906-P909 VanDerWaalsContact O-CD 3.29Å; V906-P909 WeakPolarHBondContact O-CD 3.5Å; F907-P909 VanDerWaalsContact C-N 3.34Å; P909-P912 WeakPolarHBondContact O-CD 3.19Å
910F87.1Confident87Confident11 Ų1145.6 Ų45.65%0.04826%0.26CS..G310 helixtrans-83.2-15.7177.8-64.4-70.7000114.3E859 I862 L866 F907 K908 P912 S913 I914E859-F910 HydrophobicContact CG-CE2 3.71Å; E859-F910 HydrophobicContact CG-CZ 3.41Å; E859-F910 VanDerWaalsContact CG-CZ 3.41Å; I862-F910 HydrophobicContact CG2-CD1 4.21Å; I862-F910 HydrophobicContact CG2-CG 4.33Å; L866-F910 HydrophobicContact CD1-CD1 3.97Å; F907-F910 HydrophobicContact CB-CD2 4.47Å; F907-F910 HydrophobicContact CD1-CD2 4.28Å; F907-F910 HydrophobicContact CD1-CE2 4.37Å; F907-F910 WeakPolarHBondContact O-CB 3.35Å; F907-F910 PolarHBondContact O-N 3.21Å; F907-F910 VanDerWaalsContact O-N 3.11Å; K908-F910 PolarHBondContact O-N 3.14Å; K908-F910 VanDerWaalsContact O-N 3.13Å; F910-P912 VanDerWaalsContact C-CD 3.49Å; F910-S913 PolarHBondContact O-N 3.5Å; F910-S913 VanDerWaalsContact O-N 3.08Å; F910-I914 HydrophobicContact CB-CD1 4.01Å; F910-I914 HydrophobicContact CB-CG1 4.41Å; F910-I914 WeakPolarHBondContact O-CG1 3.29Å; F910-I914 PolarHBondContact O-N 3.34Å
911L90.2Very high87Confident3 Ų348 Ų482%0.01627%0.271CS..Hα-helixtrans-54.1-44.9-176.1-67.6171.1000113.3V900 K908 S913 I914 I915 T945 N949 Y952V900-L911 HydrophobicContact CB-CD2 4.3Å; V900-L911 HydrophobicContact CG1-CD2 3.86Å; K908-L911 HydrophobicContact CB-CD1 4.09Å; K908-L911 HydrophobicContact CG-CD1 4.12Å; K908-L911 WeakPolarHBondContact O-CB 3.35Å; K908-L911 WeakPolarHBondContact O-CG 3.32Å; K908-L911 PolarHBondContact O-N 3.24Å; K908-L911 VanDerWaalsContact O-N 3.07Å; L911-S913 VanDerWaalsContact C-N 3.35Å; L911-S913 PolarHBondContact O-N 3.26Å; L911-I914 PolarHBondContact O-N 3.06Å; L911-I915 WeakPolarHBondContact O-CB 3.37Å; L911-I915 VanDerWaalsContact O-CG1 3.28Å; L911-I915 WeakPolarHBondContact O-CG1 3.41Å; L911-I915 PolarHBondContact O-N 3.47Å; L911-T945 HydrophobicContact CD2-CG2 4.3Å; L911-N949 HydrophobicContact CD1-CB 3.91Å; L911-N949 HydrophobicContact CD2-CB 4.46Å; L911-Y952 HydrophobicContact CB-CE2 4.42Å; L911-Y952 HydrophobicContact CD1-CD2 4.14Å; L911-Y952 HydrophobicContact CD1-CG 4.33Å
912P91.2Very high87Confident51 Ų5145.4 Ų45.433%0.33126%0.259SS..Hα-helixtrans-60.5-43177.3-21.933.7000112.5P909 F910 I915 A916 Y952P909-P912 WeakPolarHBondContact O-CD 3.19Å; F910-P912 VanDerWaalsContact C-CD 3.49Å; P912-I915 PolarHBondContact O-N 2.88Å; P912-A916 VanDerWaalsContact O-CB 3.3Å; P912-A916 WeakPolarHBondContact O-CB 3.41Å; P912-A916 PolarHBondContact O-N 2.95Å; P912-Y952 HydrophobicContact CG-CE2 4.33Å
913S90.9Very high87.5Confident64 Ų6444.9 Ų44.945%0.44826%0.255SS..Hα-helixtrans-67.3-37.9178.7-57.20000112.4F910 L911 L917F910-S913 PolarHBondContact O-N 3.5Å; F910-S913 VanDerWaalsContact O-N 3.08Å; L911-S913 VanDerWaalsContact C-N 3.35Å; L911-S913 PolarHBondContact O-N 3.26Å; S913-L917 WeakPolarHBondContact O-CB 3.34Å; S913-L917 PolarHBondContact O-N 3.42Å
914I93.2Very high88.3Confident1 Ų142.3 Ų42.31%0.00524%0.239CC..Hα-helixtrans-66.9-44.8176.3-66.8170.1000110.5L896 V899 V900 F910 L911 L917 C918 L941L896-I914 HydrophobicContact CD1-CG1 4.47Å; L896-I914 HydrophobicContact CD1-CG2 4.34Å; L896-I914 HydrophobicContact CD2-CD1 4.19Å; L896-I914 HydrophobicContact CD2-CG1 4.15Å; V899-I914 HydrophobicContact CG1-CD1 4.37Å; V900-I914 HydrophobicContact CG1-CD1 3.8Å; V900-I914 HydrophobicContact CG1-CG2 4.23Å; F910-I914 HydrophobicContact CB-CD1 4.01Å; F910-I914 HydrophobicContact CB-CG1 4.41Å; F910-I914 WeakPolarHBondContact O-CG1 3.29Å; F910-I914 PolarHBondContact O-N 3.34Å; L911-I914 PolarHBondContact O-N 3.06Å; I914-L917 WeakPolarHBondContact O-CB 3.46Å; I914-L917 PolarHBondContact O-N 2.92Å; I914-C918 PolarHBondContact O-N 3.19Å; I914-C918 PolarHBondContact O-SG 3.05Å; I914-L941 HydrophobicContact CG2-CD1 4.38Å; I914-L941 HydrophobicContact CG2-CD2 4.2Å
915I93.5Very high89.1Confident4 Ų441.5 Ų41.52%0.02123%0.226CC..Hα-helixtrans-64.5-42.8177.4-66.3165.9000110.4L911 P912 C918 M919 T945 Y952 F953 Q976 I980L911-I915 WeakPolarHBondContact O-CB 3.37Å; L911-I915 VanDerWaalsContact O-CG1 3.28Å; L911-I915 WeakPolarHBondContact O-CG1 3.41Å; L911-I915 PolarHBondContact O-N 3.47Å; P912-I915 PolarHBondContact O-N 2.88Å; I915-C918 PolarHBondContact O-N 3.3Å; I915-M919 HydrophobicContact CG2-CG 4.22Å; I915-M919 WeakPolarHBondContact O-CB 3.45Å; I915-M919 WeakPolarHBondContact O-CG 3.4Å; I915-M919 PolarHBondContact O-N 3.36Å; I915-T945 HydrophobicContact CD1-CG2 4.21Å; I915-T945 HydrophobicContact CG1-CG2 4.19Å; I915-Y952 HydrophobicContact CD1-CD1 4.43Å; I915-Y952 HydrophobicContact CD1-CE1 3.81Å; I915-F953 HydrophobicContact CD1-CE1 4.47Å; I915-F953 HydrophobicContact CD1-CZ 3.88Å; I915-Q976 HydrophobicContact CG2-CB 4.13Å; I915-Q976 HydrophobicContact CG2-CG 4.13Å; I915-I980 HydrophobicContact CG2-CD1 4.44Å
916A92.5Very high89.8Confident26 Ų2635 Ų3522%0.21520%0.196CC..Hα-helixtrans-62-44.217600000111.7P912 C918 M919 E920P912-A916 VanDerWaalsContact O-CB 3.3Å; P912-A916 WeakPolarHBondContact O-CB 3.41Å; P912-A916 PolarHBondContact O-N 2.95Å; A916-C918 VanDerWaalsContact C-N 3.34Å; A916-C918 PolarHBondContact O-N 2.8Å; A916-M919 PolarHBondContact O-N 3Å; A916-E920 WeakPolarHBondContact O-CA 3.25Å; A916-E920 WeakPolarHBondContact O-CB 3.26Å; A916-E920 PolarHBondContact O-N 3.33Å
917L93.5Very high90.3Very high2 Ų233 Ų331%0.0119%0.187CC..Iπ-helixtrans-55.6-49.3172.4177.378.2000111.3L866 L874 F892 L896 S913 I914 Q921 V922L866-L917 HydrophobicContact CD2-CD2 4Å; L874-L917 HydrophobicContact CD1-CD1 3.89Å; F892-L917 HydrophobicContact CE1-CD1 4.41Å; F892-L917 HydrophobicContact CE1-CD2 3.54Å; F892-L917 HydrophobicContact CZ-CD2 3.75Å; L896-L917 HydrophobicContact CD1-CD2 3.5Å; L896-L917 VanDerWaalsContact CD1-CD2 3.5Å; S913-L917 WeakPolarHBondContact O-CB 3.34Å; S913-L917 PolarHBondContact O-N 3.42Å; I914-L917 WeakPolarHBondContact O-CB 3.46Å; I914-L917 PolarHBondContact O-N 2.92Å; L917-Q921 HydrophobicContact CD1-CB 4.31Å; L917-Q921 WeakPolarHBondContact O-CB 3.4Å; L917-Q921 PolarHBondContact O-N 3.38Å; L917-V922 HydrophobicContact CG-CG2 4.35Å; L917-V922 PolarHBondContact O-N 2.78Å
918C94.6Very high90.3Very high1 Ų141.5 Ų41.51%0.00723%0.227CC..Iπ-helixtrans-62.6-50.7-178.8-66.50000112I914 I915 A916 Y923 L938 L941 L942I914-C918 PolarHBondContact O-N 3.19Å; I914-C918 PolarHBondContact O-SG 3.05Å; I915-C918 PolarHBondContact O-N 3.3Å; A916-C918 VanDerWaalsContact C-N 3.34Å; A916-C918 PolarHBondContact O-N 2.8Å; C918-Y923 WeakPolarHBondContact O-CB 3.49Å; C918-Y923 PolarHBondContact O-N 3.14Å; C918-L938 HydrophobicContact CB-CD1 3.73Å; C918-L941 WeakPolarHBondContact SG-CD2 3.23Å; C918-L942 HydrophobicContact CB-CD2 3.8Å
919M94.4Very high90.3Very high30 Ų3043.7 Ų43.715%0.14823%0.233CC..Iπ-helixtrans-88.6-31.4-169.3-61.8-51.2-56.200113.9I915 A916 Y923 P924 L942 A979 I980 A983I915-M919 HydrophobicContact CG2-CG 4.22Å; I915-M919 WeakPolarHBondContact O-CB 3.45Å; I915-M919 WeakPolarHBondContact O-CG 3.4Å; I915-M919 PolarHBondContact O-N 3.36Å; A916-M919 PolarHBondContact O-N 3Å; M919-Y923 HydrophobicContact CE-CD1 4.26Å; M919-Y923 HydrophobicContact CE-CG 4.45Å; M919-P924 WeakPolarHBondContact O-CD 3.27Å; M919-P924 WeakPolarHBondContact O-CG 3.35Å; M919-L942 HydrophobicContact SD-CD1 3.97Å; M919-L942 HydrophobicContact SD-CD2 4.13Å; M919-A979 HydrophobicContact CE-CB 3.93Å; M919-A979 WeakPolarHBondContact CE-O 3.42Å; M919-I980 HydrophobicContact CG-CG1 4.27Å; M919-I980 HydrophobicContact SD-CG1 3.98Å; M919-A983 HydrophobicContact CE-CB 4.14Å
920E91.3Very high89.7Confident133 Ų13343.4 Ų43.462%0.62123%0.231SC*.Iπ-helixtrans-100.2-24.6-175.3-53.7177.8-177.200112.9A916A916-E920 WeakPolarHBondContact O-CA 3.25Å; A916-E920 WeakPolarHBondContact O-CB 3.26Å; A916-E920 PolarHBondContact O-N 3.33Å
921Q90.5Very high89.5Confident54 Ų5443.3 Ų43.325%0.25223%0.232SC..Iπ-helixtrans-110.4-55.1-177-50.4-173.439.300112.5R871 L874 L917 I925R871-Q921 HydrophobicContact CB-CB 4.46Å; R871-Q921 HydrophobicContact CB-CG 4.5Å; L874-Q921 HydrophobicContact CD1-CB 4.21Å; L917-Q921 HydrophobicContact CD1-CB 4.31Å; L917-Q921 WeakPolarHBondContact O-CB 3.4Å; L917-Q921 PolarHBondContact O-N 3.38Å; Q921-I925 WeakPolarHBondContact O-CD1 3.43Å; Q921-I925 VanDerWaalsContact O-CG1 3.31Å; Q921-I925 WeakPolarHBondContact O-CG1 3.45Å
922V91.9Very high89.2Confident1 Ų145.7 Ų45.71%0.00625%0.248CC..Iπ-helixtrans-81.8-54.1-171.9-177.90000112.4L874 L917 P924 I925 I926 V934 L938L874-V922 HydrophobicContact CD1-CG2 3.97Å; L917-V922 HydrophobicContact CG-CG2 4.35Å; L917-V922 PolarHBondContact O-N 2.78Å; V922-P924 VanDerWaalsContact C-CD 3.5Å; V922-I925 WeakPolarHBondContact O-CB 3.32Å; V922-I925 PolarHBondContact O-N 3.06Å; V922-I926 HydrophobicContact CG1-CD1 4.29Å; V922-I926 PolarHBondContact O-N 3.12Å; V922-V934 HydrophobicContact CG1-CG1 4.37Å; V922-L938 HydrophobicContact CB-CD1 4.23Å; V922-L938 HydrophobicContact CG1-CD1 4.05Å; V922-L938 HydrophobicContact CG1-CD2 4.2Å
923Y92.8Very high89Confident39 Ų3947.3 Ų47.315%0.15325%0.254CS..Hα-helixtrans-54.3-44.1-176.5-175.7-105.3000113.3C918 M919 I925 I926 A927 L938 F939 A983C918-Y923 WeakPolarHBondContact O-CB 3.49Å; C918-Y923 PolarHBondContact O-N 3.14Å; M919-Y923 HydrophobicContact CE-CD1 4.26Å; M919-Y923 HydrophobicContact CE-CG 4.45Å; Y923-I925 PolarHBondContact O-N 3.25Å; Y923-I926 PolarHBondContact O-N 2.75Å; Y923-I926 VanDerWaalsContact O-N 3.15Å; Y923-A927 HydrophobicContact CE1-CB 4.17Å; Y923-A927 WeakPolarHBondContact O-CB 3.43Å; Y923-A927 PolarHBondContact O-N 3.41Å; Y923-L938 HydrophobicContact CD2-CD2 4.04Å; Y923-F939 HydrophobicContact CE2-CZ 4.19Å; Y923-A983 HydrophobicContact CD2-CB 4.16Å; Y923-A983 HydrophobicContact CE1-CB 4.15Å; Y923-A983 HydrophobicContact CE2-CB 3.59Å
924P91.7Very high89Confident64 Ų6444.3 Ų44.342%0.41623%0.232SC..Hα-helixtrans-63.7-23.6178.4-23.736.3000114.4M919 V922M919-P924 WeakPolarHBondContact O-CD 3.27Å; M919-P924 WeakPolarHBondContact O-CG 3.35Å; V922-P924 VanDerWaalsContact C-CD 3.5Å
925I89.4Confident89Confident16 Ų1644.9 Ų44.98%0.08224%0.235CC..Hα-helixtrans-76.3-40.1176.7-61.5165.6000110L874 A875 I878 Q921 V922 Y923 R929L874-I925 HydrophobicContact CB-CD1 4.08Å; A875-I925 HydrophobicContact CB-CD1 4.01Å; I878-I925 HydrophobicContact CB-CG2 4.08Å; I878-I925 HydrophobicContact CD1-CD1 4.41Å; I878-I925 HydrophobicContact CD1-CG2 4.05Å; I878-I925 HydrophobicContact CG2-CG2 3.85Å; Q921-I925 WeakPolarHBondContact O-CD1 3.43Å; Q921-I925 VanDerWaalsContact O-CG1 3.31Å; Q921-I925 WeakPolarHBondContact O-CG1 3.45Å; V922-I925 WeakPolarHBondContact O-CB 3.32Å; V922-I925 PolarHBondContact O-N 3.06Å; Y923-I925 PolarHBondContact O-N 3.25Å; I925-R929 WeakPolarHBondContact O-CD 3.42Å; I925-R929 WeakPolarHBondContact O-CG 3.36Å; I925-R929 PolarHBondContact O-NE 2.87Å
926I89.9Confident89Confident0 Ų045.8 Ų45.80%024%0.243CC..Hα-helixtrans-97.8-15.7-170.967.8175.5000114.4I878 V922 Y923 E928 R929 S931 V934 K935 L938I878-I926 HydrophobicContact CD1-CG2 4.28Å; I878-I926 HydrophobicContact CG2-CG2 3.96Å; V922-I926 HydrophobicContact CG1-CD1 4.29Å; V922-I926 PolarHBondContact O-N 3.12Å; Y923-I926 PolarHBondContact O-N 2.75Å; Y923-I926 VanDerWaalsContact O-N 3.15Å; I926-E928 VanDerWaalsContact C-N 3.3Å; I926-E928 PolarHBondContact O-N 3.14Å; I926-E928 VanDerWaalsContact O-N 3.15Å; I926-R929 PolarHBondContact O-N 2.93Å; I926-S931 WeakPolarHBondContact CB-OG 3.33Å; I926-S931 WeakPolarHBondContact CG2-OG 3.48Å; I926-V934 HydrophobicContact CD1-CG1 4.31Å; I926-V934 HydrophobicContact CG2-CG1 4.15Å; I926-K935 HydrophobicContact CB-CG 4.3Å; I926-K935 HydrophobicContact CD1-CB 4.36Å; I926-K935 HydrophobicContact CD1-CG 3.6Å; I926-K935 HydrophobicContact CG1-CG 4.16Å; I926-K935 WeakPolarHBondContact O-CE 3.46Å; I926-K935 PolarHBondContact O-NZ 3.23Å; I926-L938 HydrophobicContact CD1-CB 4.31Å; I926-L938 HydrophobicContact CD1-CD2 3.49Å; I926-L938 VanDerWaalsContact CD1-CD2 3.49Å; I926-L938 HydrophobicContact CG1-CD2 4.33Å
927A85.9Confident89.1Confident25 Ų2545.8 Ų45.821%0.20724%0.239CC..THydrogen-bonded Turntrans-49.1-48.4-171.100000113Y923 Q990Y923-A927 HydrophobicContact CE1-CB 4.17Å; Y923-A927 WeakPolarHBondContact O-CB 3.43Å; Y923-A927 PolarHBondContact O-N 3.41Å; A927-Q990 PolarHBondContact O-NE2 3.42Å
928E81Confident89.2Confident195 Ų19545.7 Ų45.791%0.91124%0.238SC*.THydrogen-bonded Turntrans-100.2-1.6-178.7-62.4-177.8173.600113.8I926I926-E928 VanDerWaalsContact C-N 3.3Å; I926-E928 PolarHBondContact O-N 3.14Å; I926-E928 VanDerWaalsContact O-N 3.15Å
929R82.6Confident89.4Confident105 Ų10545.8 Ų45.840%0.39624%0.238SC..SBendtrans-98.8145.2-176.1-62.9-172.5-176-179.50.5112.2I925 I926 S931 K935I925-R929 WeakPolarHBondContact O-CD 3.42Å; I925-R929 WeakPolarHBondContact O-CG 3.36Å; I925-R929 PolarHBondContact O-NE 2.87Å; I926-R929 PolarHBondContact O-N 2.93Å; R929-S931 VanDerWaalsContact C-N 3.26Å; R929-S931 PolarHBondContact O-N 3.01Å; R929-S931 PolarHBondContact O-OG 2.68Å; R929-K935 WeakPolarHBondContact O-CE 3.18Å; R929-K935 PolarHBondContact O-NZ 3.19Å
930P75.1Confident89.5Confident87 Ų8746.2 Ų46.257%0.56524%0.24SC*.  trans-76.471.417518.6-9.5000112.3E881 P932E881-P930 WeakPolarHBondContact CG-O 3.33Å; E881-P930 VanDerWaalsContact OE1-CD 3.3Å; E881-P930 WeakPolarHBondContact OE1-CD 3.45Å; E881-P930 WeakPolarHBondContact OE1-CG 3.46Å; P930-P932 VanDerWaalsContact C-CD 3.45Å; P930-P932 WeakPolarHBondContact O-CD 3.49Å
931S83.8Confident89.8Confident8 Ų839.9 Ų39.96%0.05621%0.21CC..  trans-112.271.3-179.935.60000111.5I926 R929 D933 K935I926-S931 WeakPolarHBondContact CB-OG 3.33Å; I926-S931 WeakPolarHBondContact CG2-OG 3.48Å; R929-S931 VanDerWaalsContact C-N 3.26Å; R929-S931 PolarHBondContact O-N 3.01Å; R929-S931 PolarHBondContact O-OG 2.68Å; S931-D933 PolarHBondContact O-N 3.22Å; S931-K935 VanDerWaalsContact O-CB 3.27Å; S931-K935 WeakPolarHBondContact O-CB 3.49Å; S931-K935 WeakPolarHBondContact O-CG 3.43Å; S931-K935 PolarHBondContact O-N 3.45Å
932P84.2Confident90.1Very high54 Ų5437.3 Ų37.335%0.35120%0.199SC..Hα-helixtrans-61-43.7-168.625.1-34.6000112.7P930 K935 A936P930-P932 VanDerWaalsContact C-CD 3.45Å; P930-P932 WeakPolarHBondContact O-CD 3.49Å; P932-K935 PolarHBondContact O-N 2.89Å; P932-A936 WeakPolarHBondContact O-CB 3.19Å; P932-A936 PolarHBondContact O-N 3.39Å
933D85.6Confident90.3Very high85 Ų8538.3 Ų38.346%0.45520%0.203SC..Hα-helixtrans-65.6-47.9-176.1-53.3-50.1000111.9E890 S931 K935 A936 E937E890-D933 HydrophobicContact CG-CB 4.27Å; E890-D933 WeakPolarHBondContact OE1-CB 3.38Å; S931-D933 PolarHBondContact O-N 3.22Å; D933-K935 PolarHBondContact O-N 3Å; D933-A936 PolarHBondContact O-N 2.84Å; D933-E937 WeakPolarHBondContact O-CG 3.09Å; D933-E937 PolarHBondContact O-N 3.01Å
934V91.4Very high90.5Very high1 Ų138.9 Ų38.91%0.00621%0.205CC..Hα-helixtrans-67.2-38.2177.3-178.40000111.3C886 V889 E890 L893 V922 I926 L938C886-V934 HydrophobicContact CB-CG2 4.1Å; V889-V934 HydrophobicContact CG1-CG1 3.84Å; E890-V934 HydrophobicContact CG-CG2 4.24Å; L893-V934 HydrophobicContact CD1-CG1 4.22Å; V922-V934 HydrophobicContact CG1-CG1 4.37Å; I926-V934 HydrophobicContact CD1-CG1 4.31Å; I926-V934 HydrophobicContact CG2-CG1 4.15Å; V934-L938 WeakPolarHBondContact O-CB 3.41Å; V934-L938 PolarHBondContact O-N 3.22Å
935K92.4Very high90.6Very high12 Ų1235.9 Ų35.95%0.05219%0.185CC..Hα-helixtrans-61.8-49.1175.6-78.9177.1177-177.50111.2I926 R929 S931 P932 D933 E937 L938 F939 L995I926-K935 HydrophobicContact CB-CG 4.3Å; I926-K935 HydrophobicContact CD1-CB 4.36Å; I926-K935 HydrophobicContact CD1-CG 3.6Å; I926-K935 HydrophobicContact CG1-CG 4.16Å; I926-K935 WeakPolarHBondContact O-CE 3.46Å; I926-K935 PolarHBondContact O-NZ 3.23Å; R929-K935 WeakPolarHBondContact O-CE 3.18Å; R929-K935 PolarHBondContact O-NZ 3.19Å; S931-K935 VanDerWaalsContact O-CB 3.27Å; S931-K935 WeakPolarHBondContact O-CB 3.49Å; S931-K935 WeakPolarHBondContact O-CG 3.43Å; S931-K935 PolarHBondContact O-N 3.45Å; P932-K935 PolarHBondContact O-N 2.89Å; D933-K935 PolarHBondContact O-N 3Å; K935-E937 VanDerWaalsContact C-N 3.31Å; K935-E937 PolarHBondContact O-N 3.43Å; K935-L938 PolarHBondContact O-N 3.35Å; K935-F939 VanDerWaalsContact O-CD2 3.27Å; K935-F939 WeakPolarHBondContact O-CD2 3.15Å; K935-F939 PolarHBondContact O-N 3.46Å; K935-L995 HydrophobicContact CB-CD1 4.25Å; K935-L995 HydrophobicContact CB-CD2 3.96Å; K935-L995 HydrophobicContact CD-CD2 3.84Å; K935-L995 HydrophobicContact CG-CD2 4.43Å
936A93.8Very high90.8Very high24 Ų2435.1 Ų35.120%0.19818%0.181CC..Hα-helixtrans-56.1-46.5-179.500000111.3P932 D933 E940 Q998P932-A936 WeakPolarHBondContact O-CB 3.19Å; P932-A936 PolarHBondContact O-N 3.39Å; D933-A936 PolarHBondContact O-N 2.84Å; A936-E940 WeakPolarHBondContact O-CB 3.44Å; A936-E940 PolarHBondContact O-N 3.16Å; A936-Q998 PolarHBondContact O-NE2 3.24Å; A936-Q998 VanDerWaalsContact O-NE2 3.08Å
937E95.4Very high90.9Very high26 Ų2637.3 Ų37.312%0.12119%0.192CC..Hα-helixtrans-71.2-33.8179.7-63-60.1163.200113.4E890 L893 K894 Q897 D933 K935 L941E890-E937 HydrophobicContact CB-CG 4.25Å; E890-E937 HydrophobicContact CG-CG 4.18Å; L893-E937 HydrophobicContact CB-CB 4.22Å; L893-E937 HydrophobicContact CD1-CB 4.15Å; K894-E937 WeakPolarHBondContact CE-OE1 3.3Å; K894-E937 WeakPolarHBondContact CE-OE2 3.35Å; K894-E937 VanDerWaalsContact CG-OE2 3.29Å; K894-E937 WeakPolarHBondContact CG-OE2 3.45Å; K894-E937 IonicContact NZ-OE1 3.7Å; K894-E937 PolarHBondContact NZ-OE1 3.32Å; Q897-E937 PolarHBondContact NE2-O 3.28Å; Q897-E937 PolarHBondContact NE2-OE2 2.72Å; D933-E937 WeakPolarHBondContact O-CG 3.09Å; D933-E937 PolarHBondContact O-N 3.01Å; K935-E937 VanDerWaalsContact C-N 3.31Å; K935-E937 PolarHBondContact O-N 3.43Å; E937-L941 WeakPolarHBondContact O-CB 3.46Å; E937-L941 PolarHBondContact O-N 2.96Å
938L96.3Very high91.2Very high0 Ų040.2 Ų40.20%020%0.201CC..Hα-helixtrans-65.5-50174.3-179.171.7000110.8L893 C918 V922 Y923 I926 V934 K935 E940 L941 L942L893-L938 HydrophobicContact CD1-CB 4.13Å; L893-L938 HydrophobicContact CD2-CD1 4.29Å; C918-L938 HydrophobicContact CB-CD1 3.73Å; V922-L938 HydrophobicContact CB-CD1 4.23Å; V922-L938 HydrophobicContact CG1-CD1 4.05Å; V922-L938 HydrophobicContact CG1-CD2 4.2Å; Y923-L938 HydrophobicContact CD2-CD2 4.04Å; I926-L938 HydrophobicContact CD1-CB 4.31Å; I926-L938 HydrophobicContact CD1-CD2 3.49Å; I926-L938 VanDerWaalsContact CD1-CD2 3.49Å; I926-L938 HydrophobicContact CG1-CD2 4.33Å; V934-L938 WeakPolarHBondContact O-CB 3.41Å; V934-L938 PolarHBondContact O-N 3.22Å; K935-L938 PolarHBondContact O-N 3.35Å; L938-E940 VanDerWaalsContact C-N 3.3Å; L938-E940 PolarHBondContact O-N 3.3Å; L938-L941 WeakPolarHBondContact O-CB 3.48Å; L938-L941 PolarHBondContact O-N 3.31Å; L938-L941 VanDerWaalsContact O-N 3.14Å; L938-L942 HydrophobicContact CG-CD1 4.49Å; L938-L942 WeakPolarHBondContact O-CG 3.17Å; L938-L942 PolarHBondContact O-N 2.93Å
939F97Very high91.7Very high2 Ų231.4 Ų31.41%0.00916%0.16CC..Hα-helixtrans-65.3-35.7179.5-83.6-74000111.8Y923 K935 L942 F943 A983 F984 L995 N999Y923-F939 HydrophobicContact CE2-CZ 4.19Å; K935-F939 VanDerWaalsContact O-CD2 3.27Å; K935-F939 WeakPolarHBondContact O-CD2 3.15Å; K935-F939 PolarHBondContact O-N 3.46Å; F939-L942 PolarHBondContact O-N 3.46Å; F939-F943 WeakPolarHBondContact O-CB 3.47Å; F939-F943 PolarHBondContact O-N 3.45Å; F939-A983 HydrophobicContact CE1-CB 4.08Å; F939-A983 HydrophobicContact CZ-CB 4.29Å; F939-A983 WeakPolarHBondContact CZ-O 3.39Å; F939-F984 AromaticContact CD1-CD1 4Å; F939-F984 HydrophobicContact CD1-CD1 4Å; F939-F984 HydrophobicContact CD1-CD2 4.46Å; F939-F984 AromaticContact CD1-CE1 3.81Å; F939-F984 HydrophobicContact CD1-CE1 3.81Å; F939-F984 HydrophobicContact CD1-CE2 4.29Å; F939-F984 HydrophobicContact CD1-CG 4.31Å; F939-F984 AromaticContact CD1-CZ 3.95Å; F939-F984 HydrophobicContact CD1-CZ 3.95Å; F939-F984 HydrophobicContact CE1-CD1 4.26Å; F939-F984 HydrophobicContact CE1-CG 4.26Å; F939-L995 HydrophobicContact CD2-CD1 3.78Å; F939-L995 HydrophobicContact CD2-CD2 4.49Å; F939-L995 HydrophobicContact CE2-CD1 4.39Å; F939-L995 HydrophobicContact CE2-CD2 4.32Å; F939-L995 HydrophobicContact CG-CD1 4.44Å; F939-N999 VanDerWaalsContact CB-OD1 3.24Å; F939-N999 WeakPolarHBondContact CB-OD1 3.37Å; F939-N999 WeakPolarHBondContact CD1-ND2 3.21Å; F939-N999 WeakPolarHBondContact CG-ND2 3.36Å; F939-N999 WeakPolarHBondContact CG-OD1 3.49Å
940E97.3Very high92Very high39 Ų3927.3 Ų27.318%0.18214%0.144CC..Hα-helixtrans-62.1-41.9170.9-179.5157.3-165.900112.2A936 L938 F943 R944 Y1002A936-E940 WeakPolarHBondContact O-CB 3.44Å; A936-E940 PolarHBondContact O-N 3.16Å; L938-E940 VanDerWaalsContact C-N 3.3Å; L938-E940 PolarHBondContact O-N 3.3Å; E940-F943 PolarHBondContact O-N 2.81Å; E940-R944 HydrophobicContact CG-CG 4.26Å; E940-R944 WeakPolarHBondContact O-CB 3.33Å; E940-R944 VanDerWaalsContact O-CG 3.29Å; E940-R944 WeakPolarHBondContact O-CG 3.26Å; E940-R944 PolarHBondContact O-N 2.96Å; E940-R944 IonicContact OE1-CZ 3.25Å; E940-R944 IonicContact OE1-NE 3.77Å; E940-R944 PolarHBondContact OE1-NE 3.02Å; E940-R944 IonicContact OE1-NH2 2.9Å; E940-R944 PolarHBondContact OE1-NH2 3.36Å; E940-Y1002 HydrophobicContact CB-CE2 4.21Å; E940-Y1002 WeakPolarHBondContact CB-OH 3.29Å; E940-Y1002 WeakPolarHBondContact CG-OH 3.42Å
941L97.1Very high92.6Very high0 Ų031.8 Ų31.80%015%0.15CC..Hα-helixtrans-62.5-44.3174.9177.456.9000112.3L893 L896 Q897 V900 I914 C918 E937 L938 R944 T945L893-L941 HydrophobicContact CD2-CD2 3.79Å; L896-L941 HydrophobicContact CB-CD1 4Å; L896-L941 HydrophobicContact CB-CD2 3.85Å; L896-L941 HydrophobicContact CD1-CD2 4.2Å; Q897-L941 HydrophobicContact CB-CD1 4.33Å; Q897-L941 HydrophobicContact CG-CB 3.78Å; Q897-L941 HydrophobicContact CG-CD1 3.87Å; Q897-L941 HydrophobicContact CG-CG 4.39Å; V900-L941 HydrophobicContact CG1-CD1 4.17Å; V900-L941 HydrophobicContact CG2-CD1 3.8Å; I914-L941 HydrophobicContact CG2-CD1 4.38Å; I914-L941 HydrophobicContact CG2-CD2 4.2Å; C918-L941 WeakPolarHBondContact SG-CD2 3.23Å; E937-L941 WeakPolarHBondContact O-CB 3.46Å; E937-L941 PolarHBondContact O-N 2.96Å; L938-L941 WeakPolarHBondContact O-CB 3.48Å; L938-L941 PolarHBondContact O-N 3.31Å; L938-L941 VanDerWaalsContact O-N 3.14Å; L941-R944 PolarHBondContact O-N 3.35Å; L941-T945 WeakPolarHBondContact O-CB 3.26Å; L941-T945 PolarHBondContact O-N 2.95Å; L941-T945 PolarHBondContact O-OG1 3.06Å
942L97Very high92.9Very high1 Ų133.7 Ų33.71%0.00516%0.156CC..Hα-helixtrans-62-44.8175.7-67.1179.9000111.2C918 M919 L938 F939 T945 L946 I980 F984C918-L942 HydrophobicContact CB-CD2 3.8Å; M919-L942 HydrophobicContact SD-CD1 3.97Å; M919-L942 HydrophobicContact SD-CD2 4.13Å; L938-L942 HydrophobicContact CG-CD1 4.49Å; L938-L942 WeakPolarHBondContact O-CG 3.17Å; L938-L942 PolarHBondContact O-N 2.93Å; F939-L942 PolarHBondContact O-N 3.46Å; L942-T945 WeakPolarHBondContact O-CB 3.25Å; L942-T945 PolarHBondContact O-N 3.31Å; L942-L946 WeakPolarHBondContact O-CG 3.33Å; L942-L946 PolarHBondContact O-N 3.26Å; L942-I980 HydrophobicContact CB-CG2 4.05Å; L942-I980 HydrophobicContact CD1-CG2 4.24Å; L942-I980 HydrophobicContact CD2-CD1 4.11Å; L942-I980 HydrophobicContact CD2-CG1 3.96Å; L942-I980 HydrophobicContact CD2-CG2 4.49Å; L942-I980 HydrophobicContact CG-CG2 4.49Å; L942-F984 HydrophobicContact CB-CE2 4.26Å
943F97.3Very high93.2Very high21 Ų2131.1 Ų31.19%0.09214%0.14CC..Hα-helixtrans-60.3-50.6175165.5-105.4000112F939 E940 T945 L946 H947 F984 Y1002 T1005 L1006F939-F943 WeakPolarHBondContact O-CB 3.47Å; F939-F943 PolarHBondContact O-N 3.45Å; E940-F943 PolarHBondContact O-N 2.81Å; F943-T945 VanDerWaalsContact C-N 3.27Å; F943-T945 PolarHBondContact O-N 3.4Å; F943-L946 PolarHBondContact O-N 3.08Å; F943-H947 HydrophobicContact CE2-CB 4.19Å; F943-H947 HydrophobicContact CZ-CB 4.15Å; F943-H947 VanDerWaalsContact O-CB 3.26Å; F943-H947 WeakPolarHBondContact O-CB 3.34Å; F943-H947 PolarHBondContact O-N 3.08Å; F943-F984 HydrophobicContact CB-CZ 4.28Å; F943-Y1002 HydrophobicContact CB-CD1 4.31Å; F943-Y1002 HydrophobicContact CB-CD2 3.64Å; F943-Y1002 HydrophobicContact CB-CE2 4.04Å; F943-Y1002 HydrophobicContact CB-CG 3.78Å; F943-Y1002 AromaticContact CD1-CD1 3.63Å; F943-Y1002 HydrophobicContact CD1-CD1 3.63Å; F943-Y1002 HydrophobicContact CD1-CD2 4.4Å; F943-Y1002 AromaticContact CD1-CE1 3.73Å; F943-Y1002 HydrophobicContact CD1-CE1 3.73Å; F943-Y1002 HydrophobicContact CD1-CE2 4.47Å; F943-Y1002 AromaticContact CD1-CG 4Å; F943-Y1002 HydrophobicContact CD1-CG 4Å; F943-Y1002 AromaticContact CD2-CD1 3.9Å; F943-Y1002 HydrophobicContact CD2-CD1 3.9Å; F943-Y1002 HydrophobicContact CD2-CD2 4.45Å; F943-Y1002 AromaticContact CD2-CG 3.72Å; F943-Y1002 HydrophobicContact CD2-CG 3.72Å; F943-Y1002 AromaticContact CE1-CD1 3.85Å; F943-Y1002 HydrophobicContact CE1-CD1 3.85Å; F943-Y1002 HydrophobicContact CE1-CE1 4.01Å; F943-Y1002 HydrophobicContact CE2-CD1 4.09Å; F943-Y1002 HydrophobicContact CE2-CG 4.29Å; F943-Y1002 AromaticContact CG-CD1 3.66Å; F943-Y1002 HydrophobicContact CG-CD1 3.66Å; F943-Y1002 AromaticContact CG-CD2 3.92Å; F943-Y1002 HydrophobicContact CG-CD2 3.92Å; F943-Y1002 HydrophobicContact CG-CE1 4.15Å; F943-Y1002 HydrophobicContact CG-CE2 4.36Å; F943-Y1002 AromaticContact CG-CG 3.54Å; F943-Y1002 HydrophobicContact CG-CG 3.54Å; F943-Y1002 HydrophobicContact CZ-CD1 4.07Å; F943-T1005 HydrophobicContact CE2-CG2 4.11Å; F943-T1005 HydrophobicContact CZ-CG2 3.82Å; F943-L1006 HydrophobicContact CD2-CD1 4.12Å; F943-L1006 HydrophobicContact CD2-CD2 4.13Å; F943-L1006 HydrophobicContact CD2-CG 3.87Å; F943-L1006 HydrophobicContact CE2-CD2 3.98Å; F943-L1006 HydrophobicContact CE2-CG 3.81Å
944R95.4Very high93.2Very high51 Ų5127.5 Ų27.519%0.19212%0.12CC..Hα-helixtrans-60.9-38.1179-72.9175.9178.7-143.59.7111.3V900 Q901 E940 L941 H947 H948V900-R944 HydrophobicContact CG2-CB 3.99Å; Q901-R944 HydrophobicContact CG-CB 4.17Å; Q901-R944 HydrophobicContact CG-CG 4.26Å; E940-R944 HydrophobicContact CG-CG 4.26Å; E940-R944 WeakPolarHBondContact O-CB 3.33Å; E940-R944 VanDerWaalsContact O-CG 3.29Å; E940-R944 WeakPolarHBondContact O-CG 3.26Å; E940-R944 PolarHBondContact O-N 2.96Å; E940-R944 IonicContact OE1-CZ 3.25Å; E940-R944 IonicContact OE1-NE 3.77Å; E940-R944 PolarHBondContact OE1-NE 3.02Å; E940-R944 IonicContact OE1-NH2 2.9Å; E940-R944 PolarHBondContact OE1-NH2 3.36Å; L941-R944 PolarHBondContact O-N 3.35Å; R944-H947 PolarHBondContact O-N 3.37Å; R944-H948 WeakPolarHBondContact O-CB 3.38Å; R944-H948 PolarHBondContact O-CD2 2.84Å; R944-H948 VanDerWaalsContact O-CD2 3.31Å; R944-H948 PolarHBondContact O-N 3.34Å
945T94.1Very high92.6Very high2 Ų232.2 Ų32.21%0.01214%0.14CC..Hα-helixtrans-59.8-50.3174.6-600000111L911 I915 L941 L942 F943 N949L911-T945 HydrophobicContact CD2-CG2 4.3Å; I915-T945 HydrophobicContact CD1-CG2 4.21Å; I915-T945 HydrophobicContact CG1-CG2 4.19Å; L941-T945 WeakPolarHBondContact O-CB 3.26Å; L941-T945 PolarHBondContact O-N 2.95Å; L941-T945 PolarHBondContact O-OG1 3.06Å; L942-T945 WeakPolarHBondContact O-CB 3.25Å; L942-T945 PolarHBondContact O-N 3.31Å; F943-T945 VanDerWaalsContact C-N 3.27Å; F943-T945 PolarHBondContact O-N 3.4Å; T945-N949 WeakPolarHBondContact O-CA 3.46Å; T945-N949 VanDerWaalsContact O-CB 3.28Å; T945-N949 WeakPolarHBondContact O-CB 3.32Å; T945-N949 PolarHBondContact O-N 2.87Å
946L93.6Very high91.3Very high0 Ų035.2 Ų35.20%016%0.163CC..Hα-helixtrans-63.3-49176.8-69170.1000111.9L942 F943 H948 W950 F953 F977 I980 M981 F984 L1006L942-L946 WeakPolarHBondContact O-CG 3.33Å; L942-L946 PolarHBondContact O-N 3.26Å; F943-L946 PolarHBondContact O-N 3.08Å; L946-H948 PolarHBondContact O-N 3.5Å; L946-W950 WeakPolarHBondContact O-CA 3.39Å; L946-W950 PolarHBondContact O-N 3.48Å; L946-F953 HydrophobicContact CD2-CD2 3.95Å; L946-F953 HydrophobicContact CD2-CE2 3.64Å; L946-F953 HydrophobicContact CD2-CZ 4.04Å; L946-F977 HydrophobicContact CD2-CD2 3.75Å; L946-F977 HydrophobicContact CD2-CE2 3.91Å; L946-I980 HydrophobicContact CD1-CG2 3.76Å; L946-I980 HydrophobicContact CG-CG2 4.46Å; L946-M981 HydrophobicContact CD1-CE 3.36Å; L946-F984 HydrophobicContact CD1-CE2 4.37Å; L946-L1006 HydrophobicContact CB-CD1 4.27Å; L946-L1006 HydrophobicContact CB-CD2 4.08Å; L946-L1006 HydrophobicContact CD1-CD1 3.91Å
947H93.3Very high89.4Confident46 Ų4637.6 Ų37.621%0.21318%0.175CC..Hα-helixtrans-63.6-44.2-173.1-177.6-101.9000112.6F943 R944 L1006F943-H947 HydrophobicContact CE2-CB 4.19Å; F943-H947 HydrophobicContact CZ-CB 4.15Å; F943-H947 VanDerWaalsContact O-CB 3.26Å; F943-H947 WeakPolarHBondContact O-CB 3.34Å; F943-H947 PolarHBondContact O-N 3.08Å; R944-H947 PolarHBondContact O-N 3.37Å; H947-L1006 HydrophobicContact CB-CD2 4Å
948H91.3Very high87.4Confident86 Ų8641.7 Ų41.740%0.39820%0.202SC..Hα-helixtrans-92.1-28.7-176-67.3-88.9000113.6R944 L946R944-H948 WeakPolarHBondContact O-CB 3.38Å; R944-H948 PolarHBondContact O-CD2 2.84Å; R944-H948 VanDerWaalsContact O-CD2 3.31Å; R944-H948 PolarHBondContact O-N 3.34Å; L946-H948 PolarHBondContact O-N 3.5Å
949N90.8Very high85Confident10 Ų1048.1 Ų48.15%0.05324%0.235CC..  trans-109.833.6-177.9-59.5-79000112.9V900 L911 T945 R951 Y952V900-N949 PolarHBondContact O-ND2 2.88Å; L911-N949 HydrophobicContact CD1-CB 3.91Å; L911-N949 HydrophobicContact CD2-CB 4.46Å; T945-N949 WeakPolarHBondContact O-CA 3.46Å; T945-N949 VanDerWaalsContact O-CB 3.28Å; T945-N949 WeakPolarHBondContact O-CB 3.32Å; T945-N949 PolarHBondContact O-N 2.87Å; N949-R951 PolarHBondContact O-N 2.92Å; N949-Y952 WeakPolarHBondContact O-CB 3.43Å; N949-Y952 PolarHBondContact O-N 3.35Å
950W90.3Very high82.7Confident19 Ų1949.2 Ų49.27%0.07225%0.245CC..Hα-helixtrans-49.4-36.7-178.7-166.8-101.3000113.9L946 Y952 F953 F954 F977 Q1010 L1012 K1015L946-W950 WeakPolarHBondContact O-CA 3.39Å; L946-W950 PolarHBondContact O-N 3.48Å; W950-Y952 PolarHBondContact O-N 3.22Å; W950-F953 PolarHBondContact O-N 3.43Å; W950-F954 AromaticContact CD2-CD2 3.89Å; W950-F954 HydrophobicContact CD2-CD2 3.89Å; W950-F954 HydrophobicContact CD2-CE2 4.39Å; W950-F954 AromaticContact CE2-CD2 3.27Å; W950-F954 AromaticContact CE2-CE2 3.75Å; W950-F954 HydrophobicContact CE3-CD2 4.46Å; W950-F954 HydrophobicContact CG-CD2 4.4Å; W950-F954 HydrophobicContact CH2-CD2 4.02Å; W950-F954 AromaticContact CH2-CE2 3.58Å; W950-F954 HydrophobicContact CH2-CE2 3.58Å; W950-F954 HydrophobicContact CH2-CZ 4.41Å; W950-F954 AromaticContact CZ2-CD2 3.35Å; W950-F954 HydrophobicContact CZ2-CD2 3.35Å; W950-F954 AromaticContact CZ2-CE2 3.3Å; W950-F954 HydrophobicContact CZ2-CE2 3.3Å; W950-F954 HydrophobicContact CZ2-CG 4.18Å; W950-F954 HydrophobicContact CZ2-CZ 4.1Å; W950-F954 HydrophobicContact CZ3-CE2 4.23Å; W950-F954 AromaticContact NE1-CD2 3.45Å; W950-F954 AromaticContact NE1-CG 3.75Å; W950-F954 PolarHBondContact O-N 3.13Å; W950-F977 HydrophobicContact CH2-CE2 4.36Å; W950-F977 HydrophobicContact CZ3-CE2 4.45Å; W950-Q1010 HydrophobicContact CD2-CB 3.94Å; W950-Q1010 HydrophobicContact CD2-CG 3.78Å; W950-Q1010 HydrophobicContact CE3-CB 4.11Å; W950-Q1010 HydrophobicContact CE3-CG 3.89Å; W950-Q1010 HydrophobicContact CG-CG 4.12Å; W950-Q1010 HydrophobicContact CH2-CB 4.06Å; W950-Q1010 HydrophobicContact CZ2-CB 3.87Å; W950-Q1010 HydrophobicContact CZ3-CB 4.17Å; W950-Q1010 HydrophobicContact CZ3-CG 4.37Å; W950-L1012 HydrophobicContact CH2-CD1 3.96Å; W950-K1015 HydrophobicContact CZ2-CD 4.41Å; W950-K1015 HydrophobicContact CZ2-CG 4.12Å
951R88.1Confident80.4Confident181 Ų18152.1 Ų52.168%0.68327%0.269SS*.Hα-helixtrans-65-17.1178.6-68.3-173.5-178.6179.51.6115.2N949 F953 F954N949-R951 PolarHBondContact O-N 2.92Å; R951-F953 VanDerWaalsContact C-N 3.29Å; R951-F954 WeakPolarHBondContact CA-O 3.02Å
952Y89Confident78.2Confident47 Ų4757.6 Ų57.618%0.18430%0.302CS..Hα-helixtrans-71.2-28173.5177.1-94.1000111.8L911 P912 I915 N949 W950 N973 Q976L911-Y952 HydrophobicContact CB-CE2 4.42Å; L911-Y952 HydrophobicContact CD1-CD2 4.14Å; L911-Y952 HydrophobicContact CD1-CG 4.33Å; P912-Y952 HydrophobicContact CG-CE2 4.33Å; I915-Y952 HydrophobicContact CD1-CD1 4.43Å; I915-Y952 HydrophobicContact CD1-CE1 3.81Å; N949-Y952 WeakPolarHBondContact O-CB 3.43Å; N949-Y952 PolarHBondContact O-N 3.35Å; W950-Y952 PolarHBondContact O-N 3.22Å; Y952-N973 HydrophobicContact CE1-CB 3.91Å; Y952-N973 WeakPolarHBondContact CE1-ND2 3.49Å; Y952-N973 VanDerWaalsContact CZ-ND2 3.32Å; Y952-N973 PolarHBondContact O-ND2 3.31Å; Y952-Q976 VanDerWaalsContact CE1-OE1 3.28Å; Y952-Q976 PolarHBondContact OH-OE1 2.79Å
953F89.9Confident75.8Confident1 Ų164.8 Ų64.80%0.00434%0.336CS..Hα-helixtrans-101.8-33.9178.1-57.9-78.2000112.5I915 L946 W950 R951 M971 E972 N973 Q976 F977 I980I915-F953 HydrophobicContact CD1-CE1 4.47Å; I915-F953 HydrophobicContact CD1-CZ 3.88Å; L946-F953 HydrophobicContact CD2-CD2 3.95Å; L946-F953 HydrophobicContact CD2-CE2 3.64Å; L946-F953 HydrophobicContact CD2-CZ 4.04Å; W950-F953 PolarHBondContact O-N 3.43Å; R951-F953 VanDerWaalsContact C-N 3.29Å; F953-M971 CarbonylContact O-C 3.59Å; F953-M971 VanDerWaalsContact O-CA 3.29Å; F953-M971 WeakPolarHBondContact O-CA 3.38Å; F953-M971 WeakPolarHBondContact O-CG 3.35Å; F953-E972 WeakPolarHBondContact CA-O 3.42Å; F953-E972 PolarHBondContact O-N 2.76Å; F953-N973 HydrophobicContact CD1-CB 4.37Å; F953-Q976 HydrophobicContact CE1-CB 4.26Å; F953-F977 HydrophobicContact CB-CD2 4.4Å; F953-F977 HydrophobicContact CD1-CB 3.77Å; F953-F977 HydrophobicContact CD1-CD2 4.17Å; F953-F977 HydrophobicContact CD1-CG 4.46Å; F953-F977 HydrophobicContact CE1-CB 4.09Å; F953-F977 HydrophobicContact CG-CD2 4.19Å; F953-I980 HydrophobicContact CZ-CD1 4.3Å
954F87.4Confident73.3Confident8 Ų874.5 Ų74.54%0.03537%0.372CS..BIsolated β-bridgetrans-129.8104.7-176.7-59.6-84.6000110.4W950 R951 S956 M971 F977 K1015 I1017W950-F954 AromaticContact CD2-CD2 3.89Å; W950-F954 HydrophobicContact CD2-CD2 3.89Å; W950-F954 HydrophobicContact CD2-CE2 4.39Å; W950-F954 AromaticContact CE2-CD2 3.27Å; W950-F954 AromaticContact CE2-CE2 3.75Å; W950-F954 HydrophobicContact CE3-CD2 4.46Å; W950-F954 HydrophobicContact CG-CD2 4.4Å; W950-F954 HydrophobicContact CH2-CD2 4.02Å; W950-F954 AromaticContact CH2-CE2 3.58Å; W950-F954 HydrophobicContact CH2-CE2 3.58Å; W950-F954 HydrophobicContact CH2-CZ 4.41Å; W950-F954 AromaticContact CZ2-CD2 3.35Å; W950-F954 HydrophobicContact CZ2-CD2 3.35Å; W950-F954 AromaticContact CZ2-CE2 3.3Å; W950-F954 HydrophobicContact CZ2-CE2 3.3Å; W950-F954 HydrophobicContact CZ2-CG 4.18Å; W950-F954 HydrophobicContact CZ2-CZ 4.1Å; W950-F954 HydrophobicContact CZ3-CE2 4.23Å; W950-F954 AromaticContact NE1-CD2 3.45Å; W950-F954 AromaticContact NE1-CG 3.75Å; W950-F954 PolarHBondContact O-N 3.13Å; R951-F954 WeakPolarHBondContact CA-O 3.02Å; F954-S956 PolarHBondContact O-N 3.2Å; F954-M971 HydrophobicContact CD1-CB 4.38Å; F954-M971 HydrophobicContact CD1-CG 4.26Å; F954-M971 HydrophobicContact CE1-CB 4.3Å; F954-M971 HydrophobicContact CE1-CE 4.46Å; F954-M971 HydrophobicContact CE1-CG 3.91Å; F954-M971 HydrophobicContact CE1-SD 4.12Å; F954-M971 HydrophobicContact CZ-CE 4.11Å; F954-M971 HydrophobicContact CZ-CG 4.4Å; F954-M971 HydrophobicContact CZ-SD 4.34Å; F954-F977 HydrophobicContact CE2-CD2 4.15Å; F954-F977 AromaticContact CE2-CE2 3.8Å; F954-F977 HydrophobicContact CE2-CE2 3.8Å; F954-F977 HydrophobicContact CE2-CZ 4.25Å; F954-F977 HydrophobicContact CZ-CD2 4.47Å; F954-F977 HydrophobicContact CZ-CE2 4.1Å; F954-F977 HydrophobicContact CZ-CZ 4.13Å; F954-K1015 HydrophobicContact CD1-CD 4.4Å; F954-K1015 HydrophobicContact CE1-CB 4.35Å; F954-K1015 HydrophobicContact CE1-CD 4.27Å; F954-K1015 HydrophobicContact CE1-CG 4.31Å; F954-K1015 HydrophobicContact CZ-CB 4.44Å; F954-K1015 HydrophobicContact CZ-CG 4.33Å; F954-I1017 HydrophobicContact CE1-CG2 4.38Å; F954-I1017 HydrophobicContact CZ-CG2 4.19Å
955K78.6Confident71Confident100 Ų10075.7 Ų75.744%0.43540%0.4SS..  trans-75.5127.4177.2-80.4-172.2174156.30110.4Q970 E972K955-Q970 PolarHBondContact N-O 3.03Å; K955-E972 HydrophobicContact CD-CG 4.5Å; K955-E972 VanDerWaalsContact CD-OE1 3.28Å; K955-E972 WeakPolarHBondContact CD-OE1 3.49Å; K955-E972 VanDerWaalsContact CE-OE1 3.23Å; K955-E972 WeakPolarHBondContact CE-OE1 3.42Å; K955-E972 WeakPolarHBondContact CE-OE2 3.4Å; K955-E972 IonicContact NZ-OE1 3Å; K955-E972 PolarHBondContact NZ-OE1 2.74Å; K955-E972 IonicContact NZ-OE2 3.38Å; K955-E972 PolarHBondContact NZ-OE2 3.34Å
956S63.6Low68.8Low75 Ų7583.6 Ų83.652%0.52444%0.44SS..  trans-90.2105.5169.7-175.90000109.3F954 V958F954-S956 PolarHBondContact O-N 3.2Å; S956-V958 PolarHBondContact O-N 3.31Å
957T55.4Low66.6Low75 Ų7586.5 Ų86.546%0.4646%0.461SS..  trans-86.7103170.415.50000109.3L959 A960T957-L959 PolarHBondContact O-N 3.18Å; T957-L959 VanDerWaalsContact O-N 3.13Å; T957-A960 WeakPolarHBondContact O-CB 3.28Å; T957-A960 PolarHBondContact O-N 3.37Å; T957-A960 WeakPolarHBondContact OG1-CB 3.3Å
958V51.9Low64.9Low112 Ų11290 Ų9068%0.67948%0.477SS*.THydrogen-bonded Turntrans-59.2-22.7175-175.90000112.2S956 S961S956-V958 PolarHBondContact O-N 3.31Å; V958-S961 PolarHBondContact O-OG 3.43Å
959L46.2Very low63.7Low135 Ų13590 Ų9071%0.70748%0.478SS*.THydrogen-bonded Turntrans-77.5-25.6173.7-82.9157.7000113.7T957 V962 Q963T957-L959 PolarHBondContact O-N 3.18Å; T957-L959 VanDerWaalsContact O-N 3.13Å; L959-V962 PolarHBondContact O-N 2.83Å; L959-Q963 PolarHBondContact O-N 2.99Å
960A48.2Very low62.8Low25 Ų2596.4 Ų96.421%0.20751%0.507CS..THydrogen-bonded Turntrans-77.7-27.6-178.300000112T957 V962 S967T957-A960 WeakPolarHBondContact O-CB 3.28Å; T957-A960 PolarHBondContact O-N 3.37Å; T957-A960 WeakPolarHBondContact OG1-CB 3.3Å; A960-V962 VanDerWaalsContact C-N 3.28Å; A960-V962 PolarHBondContact O-N 3.08Å; A960-S967 WeakPolarHBondContact CB-OG 3.39Å; A960-S967 PolarHBondContact O-OG 2.65Å
961S49.2Very low62.4Low99 Ų9997.7 Ų97.769%0.69252%0.515SS*.THydrogen-bonded Turntrans-72.3-17.717358.10000114.1V958V958-S961 PolarHBondContact O-OG 3.43Å
962V51.5Low62.2Low116 Ų11692.5 Ų92.570%0.70350%0.498SS*.THydrogen-bonded Turntrans-99.7-23.8-178.4-179.10000112.4L959 A960L959-V962 PolarHBondContact O-N 2.83Å; A960-V962 VanDerWaalsContact C-N 3.28Å; A960-V962 PolarHBondContact O-N 3.08Å
963Q47.7Very low62.2Low151 Ų15193.1 Ų93.171%0.70651%0.505SS*.SBendtrans-119.193.6178.2-71.5-177.8-13.400111L959L959-Q963 PolarHBondContact O-N 2.99Å
964R44.3Very low62.1Low225 Ų22597.9 Ų97.985%0.84953%0.527SS*.SBendtrans86.1124.8177.2-56.2-178.3-175.7179.71.8115
965G46.3Very low62.2Low76 Ų76102.3 Ų102.378%0.78456%0.557SS**THydrogen-bonded Turntrans-56.1138.9171.100000111.7
966I49.1Very low62.9Low168 Ų168100 Ų10086%0.86255%0.547SS*.THydrogen-bonded Turntrans5855.5173-36.6174.5000113.5
967S46.1Very low64.3Low62 Ų6296.4 Ų96.443%0.43452%0.522SS..  trans-81.9108.3152.651.60000108.3A960A960-S967 WeakPolarHBondContact CB-OG 3.39Å; A960-S967 PolarHBondContact O-OG 2.65Å
968E58.5Low66.1Low118 Ų11893.9 Ų93.955%0.55151%0.507SS*.PPolyproline II helixtrans-48.6137172.8-65.9174.6156.900110.7Q970 K1016E968-Q970 PolarHBondContact O-N 3.34Å; E968-K1016 WeakPolarHBondContact OE1-CD 3.24Å; E968-K1016 IonicContact OE1-NZ 2.9Å; E968-K1016 PolarHBondContact OE1-NZ 3.16Å; E968-K1016 WeakPolarHBondContact OE2-CD 3.28Å; E968-K1016 IonicContact OE2-NZ 3.17Å; E968-K1016 PolarHBondContact OE2-NZ 2.87Å
969E65.5Low68.1Low88 Ų8890 Ų9041%0.41149%0.487SS..PPolyproline II helixtrans-57.5123.8174.2-78.7177.1-171.100109.8M971 K1015E969-M971 PolarHBondContact O-N 3.3Å; E969-K1015 IonicContact OE1-NZ 3.9Å; E969-K1015 PolarHBondContact OE1-NZ 2.95Å; E969-K1015 IonicContact OE2-NZ 3.83Å; E969-K1015 PolarHBondContact OE2-NZ 2.86Å
970Q71.5Confident70.5Confident143 Ų14383.5 Ų83.567%0.66845%0.453SS*.PPolyproline II helixtrans-68.1122.5175-80.1-178.7-27.200109.7K955 E968K955-Q970 PolarHBondContact N-O 3.03Å; E968-Q970 PolarHBondContact O-N 3.34Å
971M82.9Confident72.7Confident47 Ų4782.3 Ų82.323%0.23244%0.443CS..BIsolated β-bridgetrans-85.9136.9177.1-168.8-179.8-17700110.3F953 F954 E969 E974 F977 I1017F953-M971 CarbonylContact O-C 3.59Å; F953-M971 VanDerWaalsContact O-CA 3.29Å; F953-M971 WeakPolarHBondContact O-CA 3.38Å; F953-M971 WeakPolarHBondContact O-CG 3.35Å; F954-M971 HydrophobicContact CD1-CB 4.38Å; F954-M971 HydrophobicContact CD1-CG 4.26Å; F954-M971 HydrophobicContact CE1-CB 4.3Å; F954-M971 HydrophobicContact CE1-CE 4.46Å; F954-M971 HydrophobicContact CE1-CG 3.91Å; F954-M971 HydrophobicContact CE1-SD 4.12Å; F954-M971 HydrophobicContact CZ-CE 4.11Å; F954-M971 HydrophobicContact CZ-CG 4.4Å; F954-M971 HydrophobicContact CZ-SD 4.34Å; E969-M971 PolarHBondContact O-N 3.3Å; M971-E974 HydrophobicContact CE-CB 4.17Å; M971-E974 HydrophobicContact CE-CG 4.1Å; M971-E974 HydrophobicContact SD-CB 4.12Å; M971-E974 HydrophobicContact SD-CG 3.95Å; M971-F977 HydrophobicContact CE-CB 3.38Å; M971-F977 HydrophobicContact CE-CD1 3.37Å; M971-F977 HydrophobicContact CE-CD2 4.25Å; M971-F977 HydrophobicContact CE-CE1 4.19Å; M971-F977 HydrophobicContact CE-CG 3.4Å; M971-F977 VanDerWaalsContact CE-CG 3.4Å; M971-I1017 HydrophobicContact CE-CG1 4.37Å; M971-I1017 HydrophobicContact CE-CG2 4.08Å; M971-I1017 HydrophobicContact SD-CB 3.95Å; M971-I1017 HydrophobicContact SD-CG1 4.15Å; M971-I1017 HydrophobicContact SD-CG2 3.81Å
972E82.7Confident74.8Confident72 Ų7283.5 Ų83.534%0.33644%0.438SS..  trans-119.6153.7171.5-64.7-169.6165.300109.3F953 K955 E974F953-E972 WeakPolarHBondContact CA-O 3.42Å; F953-E972 PolarHBondContact O-N 2.76Å; K955-E972 HydrophobicContact CD-CG 4.5Å; K955-E972 VanDerWaalsContact CD-OE1 3.28Å; K955-E972 WeakPolarHBondContact CD-OE1 3.49Å; K955-E972 VanDerWaalsContact CE-OE1 3.23Å; K955-E972 WeakPolarHBondContact CE-OE1 3.42Å; K955-E972 WeakPolarHBondContact CE-OE2 3.4Å; K955-E972 IonicContact NZ-OE1 3Å; K955-E972 PolarHBondContact NZ-OE1 2.74Å; K955-E972 IonicContact NZ-OE2 3.38Å; K955-E972 PolarHBondContact NZ-OE2 3.34Å; E972-E974 VanDerWaalsContact C-N 3.26Å; E972-E974 PolarHBondContact O-N 2.99Å
973N89Confident76.9Confident60 Ų6078 Ų7832%0.32141%0.405SS..  trans56.936.4179.6-52-57.5000114.2Y952 F953 P975 Q976 F977Y952-N973 HydrophobicContact CE1-CB 3.91Å; Y952-N973 WeakPolarHBondContact CE1-ND2 3.49Å; Y952-N973 VanDerWaalsContact CZ-ND2 3.32Å; Y952-N973 PolarHBondContact O-ND2 3.31Å; F953-N973 HydrophobicContact CD1-CB 4.37Å; N973-P975 VanDerWaalsContact C-CD 3.41Å; N973-Q976 HydrophobicContact CB-CB 4.47Å; N973-Q976 WeakPolarHBondContact O-CB 3.43Å; N973-Q976 PolarHBondContact O-N 2.65Å; N973-Q976 VanDerWaalsContact O-N 3.09Å; N973-F977 PolarHBondContact O-N 3.25Å
974E88.8Confident79.1Confident101 Ų10170.8 Ų70.847%0.47237%0.371SS..Hα-helixtrans-45.1-46.8175.8-171.5-179.6157.700115.3M971 E972 Q976 F977 S978 I1017M971-E974 HydrophobicContact CE-CB 4.17Å; M971-E974 HydrophobicContact CE-CG 4.1Å; M971-E974 HydrophobicContact SD-CB 4.12Å; M971-E974 HydrophobicContact SD-CG 3.95Å; E972-E974 VanDerWaalsContact C-N 3.26Å; E972-E974 PolarHBondContact O-N 2.99Å; E974-Q976 VanDerWaalsContact C-N 3.29Å; E974-Q976 PolarHBondContact O-N 2.84Å; E974-F977 PolarHBondContact O-N 3.26Å; E974-S978 WeakPolarHBondContact O-CB 3.4Å; E974-S978 PolarHBondContact O-N 3.37Å; E974-S978 PolarHBondContact O-OG 2.8Å; E974-I1017 HydrophobicContact CG-CD1 4.2Å; E974-I1017 WeakPolarHBondContact OE1-CD1 2.76Å
975P90.1Very high81.4Confident101 Ų10160.7 Ų60.766%0.65634%0.337SS*.Hα-helixtrans-62.4-35.8-178.723.5-34.6000112.9N973 A979N973-P975 VanDerWaalsContact C-CD 3.41Å; P975-A979 WeakPolarHBondContact O-CB 3.47Å; P975-A979 PolarHBondContact O-N 3Å
976Q92.4Very high83.6Confident50 Ų5062 Ų6223%0.23432%0.323CS..Hα-helixtrans-68.6-45.3177.9-69.3177.8-8.500111I915 Y952 F953 N973 E974 A979 I980I915-Q976 HydrophobicContact CG2-CB 4.13Å; I915-Q976 HydrophobicContact CG2-CG 4.13Å; Y952-Q976 VanDerWaalsContact CE1-OE1 3.28Å; Y952-Q976 PolarHBondContact OH-OE1 2.79Å; F953-Q976 HydrophobicContact CE1-CB 4.26Å; N973-Q976 HydrophobicContact CB-CB 4.47Å; N973-Q976 WeakPolarHBondContact O-CB 3.43Å; N973-Q976 PolarHBondContact O-N 2.65Å; N973-Q976 VanDerWaalsContact O-N 3.09Å; E974-Q976 VanDerWaalsContact C-N 3.29Å; E974-Q976 PolarHBondContact O-N 2.84Å; Q976-A979 PolarHBondContact O-N 2.85Å; Q976-I980 VanDerWaalsContact O-CG1 3.31Å; Q976-I980 WeakPolarHBondContact O-CG1 3.15Å; Q976-I980 PolarHBondContact O-N 3.12Å; Q976-I980 VanDerWaalsContact O-N 3.14Å
977F93.6Very high85.7Confident0 Ų054 Ų540%028%0.282CS..Hα-helixtrans-61.7-45.5176.9-179.3-91.5000111.9L946 W950 F953 F954 M971 N973 E974 A979 I980 M981 L1012 I1017 M1022L946-F977 HydrophobicContact CD2-CD2 3.75Å; L946-F977 HydrophobicContact CD2-CE2 3.91Å; W950-F977 HydrophobicContact CH2-CE2 4.36Å; W950-F977 HydrophobicContact CZ3-CE2 4.45Å; F953-F977 HydrophobicContact CB-CD2 4.4Å; F953-F977 HydrophobicContact CD1-CB 3.77Å; F953-F977 HydrophobicContact CD1-CD2 4.17Å; F953-F977 HydrophobicContact CD1-CG 4.46Å; F953-F977 HydrophobicContact CE1-CB 4.09Å; F953-F977 HydrophobicContact CG-CD2 4.19Å; F954-F977 HydrophobicContact CE2-CD2 4.15Å; F954-F977 AromaticContact CE2-CE2 3.8Å; F954-F977 HydrophobicContact CE2-CE2 3.8Å; F954-F977 HydrophobicContact CE2-CZ 4.25Å; F954-F977 HydrophobicContact CZ-CD2 4.47Å; F954-F977 HydrophobicContact CZ-CE2 4.1Å; F954-F977 HydrophobicContact CZ-CZ 4.13Å; M971-F977 HydrophobicContact CE-CB 3.38Å; M971-F977 HydrophobicContact CE-CD1 3.37Å; M971-F977 HydrophobicContact CE-CD2 4.25Å; M971-F977 HydrophobicContact CE-CE1 4.19Å; M971-F977 HydrophobicContact CE-CG 3.4Å; M971-F977 VanDerWaalsContact CE-CG 3.4Å; N973-F977 PolarHBondContact O-N 3.25Å; E974-F977 PolarHBondContact O-N 3.26Å; F977-A979 PolarHBondContact O-N 3.41Å; F977-I980 PolarHBondContact O-N 3.46Å; F977-M981 HydrophobicContact CD1-CG 4.02Å; F977-M981 HydrophobicContact CE1-CG 3.56Å; F977-M981 HydrophobicContact CE2-CE 4.11Å; F977-M981 HydrophobicContact CE2-CG 4.41Å; F977-M981 HydrophobicContact CZ-CE 4.08Å; F977-M981 HydrophobicContact CZ-CG 3.79Å; F977-M981 HydrophobicContact CZ-SD 4.21Å; F977-M981 WeakPolarHBondContact O-CG 3.47Å; F977-M981 PolarHBondContact O-N 3.21Å; F977-L1012 HydrophobicContact CE2-CD1 4.42Å; F977-L1012 HydrophobicContact CZ-CD1 3.77Å; F977-I1017 HydrophobicContact CD1-CG2 4.3Å; F977-I1017 HydrophobicContact CE1-CG2 3.83Å; F977-M1022 HydrophobicContact CD1-CE 4.42Å; F977-M1022 HydrophobicContact CE1-CE 4.4Å; F977-M1022 HydrophobicContact CE1-SD 4.46Å
978S92.8Very high87.9Confident22 Ų2251.1 Ų51.115%0.15426%0.262CS..Hα-helixtrans-63.6-40.5179.7-68.40000112.2E974 I980 M981 Q982E974-S978 WeakPolarHBondContact O-CB 3.4Å; E974-S978 PolarHBondContact O-N 3.37Å; E974-S978 PolarHBondContact O-OG 2.8Å; S978-I980 PolarHBondContact O-N 2.8Å; S978-M981 PolarHBondContact O-N 2.88Å; S978-Q982 WeakPolarHBondContact O-CB 3.37Å; S978-Q982 VanDerWaalsContact O-CG 3.23Å; S978-Q982 WeakPolarHBondContact O-CG 3.38Å; S978-Q982 PolarHBondContact O-N 2.93Å
979A94Very high89.4Confident30 Ų3050.8 Ų50.825%0.24826%0.263CS..Hα-helixtrans-62.2-42.1175.300000112.1M919 P975 Q976 F977 Q982 A983M919-A979 HydrophobicContact CE-CB 3.93Å; M919-A979 WeakPolarHBondContact CE-O 3.42Å; P975-A979 WeakPolarHBondContact O-CB 3.47Å; P975-A979 PolarHBondContact O-N 3Å; Q976-A979 PolarHBondContact O-N 2.85Å; F977-A979 PolarHBondContact O-N 3.41Å; A979-Q982 PolarHBondContact O-N 3.19Å; A979-A983 PolarHBondContact O-N 3.05Å
980I95.6Very high90.6Very high0 Ų048.1 Ų48.10%025%0.25CS..Hα-helixtrans-63.4-47.9176.4-65.4168.6000110.7I915 M919 L942 L946 F953 Q976 F977 S978 Q982 A983 F984I915-I980 HydrophobicContact CG2-CD1 4.44Å; M919-I980 HydrophobicContact CG-CG1 4.27Å; M919-I980 HydrophobicContact SD-CG1 3.98Å; L942-I980 HydrophobicContact CB-CG2 4.05Å; L942-I980 HydrophobicContact CD1-CG2 4.24Å; L942-I980 HydrophobicContact CD2-CD1 4.11Å; L942-I980 HydrophobicContact CD2-CG1 3.96Å; L942-I980 HydrophobicContact CD2-CG2 4.49Å; L942-I980 HydrophobicContact CG-CG2 4.49Å; L946-I980 HydrophobicContact CD1-CG2 3.76Å; L946-I980 HydrophobicContact CG-CG2 4.46Å; F953-I980 HydrophobicContact CZ-CD1 4.3Å; Q976-I980 VanDerWaalsContact O-CG1 3.31Å; Q976-I980 WeakPolarHBondContact O-CG1 3.15Å; Q976-I980 PolarHBondContact O-N 3.12Å; Q976-I980 VanDerWaalsContact O-N 3.14Å; F977-I980 PolarHBondContact O-N 3.46Å; S978-I980 PolarHBondContact O-N 2.8Å; I980-Q982 VanDerWaalsContact C-N 3.31Å; I980-Q982 PolarHBondContact O-N 3.16Å; I980-A983 WeakPolarHBondContact O-CB 3.46Å; I980-A983 PolarHBondContact O-N 2.71Å; I980-A983 VanDerWaalsContact O-N 3.16Å; I980-F984 HydrophobicContact CG2-CD2 3.9Å; I980-F984 HydrophobicContact CG2-CE2 3.76Å; I980-F984 WeakPolarHBondContact O-CD2 3.35Å; I980-F984 PolarHBondContact O-N 2.76Å
981M95.2Very high91.4Very high0 Ų047.2 Ų47.20%026%0.257CS..Hα-helixtrans-63.3-37.6178.7-71.7-66.6127.300112.1L946 F977 S978 A983 F984 G985 L1003 L1006 L1012 F1018 M1022 F1026L946-M981 HydrophobicContact CD1-CE 3.36Å; F977-M981 HydrophobicContact CD1-CG 4.02Å; F977-M981 HydrophobicContact CE1-CG 3.56Å; F977-M981 HydrophobicContact CE2-CE 4.11Å; F977-M981 HydrophobicContact CE2-CG 4.41Å; F977-M981 HydrophobicContact CZ-CE 4.08Å; F977-M981 HydrophobicContact CZ-CG 3.79Å; F977-M981 HydrophobicContact CZ-SD 4.21Å; F977-M981 WeakPolarHBondContact O-CG 3.47Å; F977-M981 PolarHBondContact O-N 3.21Å; S978-M981 PolarHBondContact O-N 2.88Å; M981-A983 VanDerWaalsContact C-N 3.34Å; M981-A983 PolarHBondContact O-N 3.12Å; M981-F984 HydrophobicContact CE-CD2 4.42Å; M981-F984 WeakPolarHBondContact O-CB 3.14Å; M981-F984 PolarHBondContact O-N 3.26Å; M981-G985 PolarHBondContact O-N 3.3Å; M981-L1003 HydrophobicContact SD-CD2 4.27Å; M981-L1006 HydrophobicContact CE-CD1 4.44Å; M981-L1012 HydrophobicContact CE-CD1 4.48Å; M981-L1012 HydrophobicContact SD-CD1 4.4Å; M981-L1012 HydrophobicContact SD-CD2 4.37Å; M981-F1018 HydrophobicContact SD-CD2 4.34Å; M981-F1018 HydrophobicContact SD-CE2 4.15Å; M981-M1022 HydrophobicContact CB-CE 3.81Å; M981-M1022 HydrophobicContact CB-SD 3.5Å; M981-M1022 VanDerWaalsContact CB-SD 3.5Å; M981-M1022 HydrophobicContact CG-CE 4.22Å; M981-M1022 HydrophobicContact CG-SD 3.78Å; M981-F1026 WeakPolarHBondContact O-CZ 3.29Å
982Q93.6Very high91.7Very high123 Ų12347 Ų4758%0.57526%0.257SS*.Hα-helixtrans-61.7-41.9173.4-75.6171.52.100111.6S978 A979 I980 F984 G985 Q986S978-Q982 WeakPolarHBondContact O-CB 3.37Å; S978-Q982 VanDerWaalsContact O-CG 3.23Å; S978-Q982 WeakPolarHBondContact O-CG 3.38Å; S978-Q982 PolarHBondContact O-N 2.93Å; A979-Q982 PolarHBondContact O-N 3.19Å; I980-Q982 VanDerWaalsContact C-N 3.31Å; I980-Q982 PolarHBondContact O-N 3.16Å; Q982-F984 VanDerWaalsContact C-N 3.35Å; Q982-F984 PolarHBondContact O-N 2.93Å; Q982-G985 PolarHBondContact O-N 3.48Å; Q982-Q986 VanDerWaalsContact O-CG 3.3Å; Q982-Q986 WeakPolarHBondContact O-CG 3.39Å; Q982-Q986 PolarHBondContact O-N 3.11Å
983A94.5Very high92.1Very high1 Ų146 Ų461%0.00825%0.253CS..Hα-helixtrans-60.3-42.9174.400000112.2M919 Y923 F939 A979 I980 M981 G985 Q986 S987M919-A983 HydrophobicContact CE-CB 4.14Å; Y923-A983 HydrophobicContact CD2-CB 4.16Å; Y923-A983 HydrophobicContact CE1-CB 4.15Å; Y923-A983 HydrophobicContact CE2-CB 3.59Å; F939-A983 HydrophobicContact CE1-CB 4.08Å; F939-A983 HydrophobicContact CZ-CB 4.29Å; F939-A983 WeakPolarHBondContact CZ-O 3.39Å; A979-A983 PolarHBondContact O-N 3.05Å; I980-A983 WeakPolarHBondContact O-CB 3.46Å; I980-A983 PolarHBondContact O-N 2.71Å; I980-A983 VanDerWaalsContact O-N 3.16Å; M981-A983 VanDerWaalsContact C-N 3.34Å; M981-A983 PolarHBondContact O-N 3.12Å; A983-G985 PolarHBondContact O-N 3.16Å; A983-Q986 PolarHBondContact O-N 3.35Å; A983-S987 PolarHBondContact O-N 3.4Å
984F95Very high92.3Very high0 Ų050.3 Ų50.30%027%0.271CS..Hα-helixtrans-58.8-46.9172.7-85.2-78.3000111.6F939 L942 F943 L946 I980 M981 Q982 Q986 S987 N999 Y1002 L1003 F1026F939-F984 AromaticContact CD1-CD1 4Å; F939-F984 HydrophobicContact CD1-CD1 4Å; F939-F984 HydrophobicContact CD1-CD2 4.46Å; F939-F984 AromaticContact CD1-CE1 3.81Å; F939-F984 HydrophobicContact CD1-CE1 3.81Å; F939-F984 HydrophobicContact CD1-CE2 4.29Å; F939-F984 HydrophobicContact CD1-CG 4.31Å; F939-F984 AromaticContact CD1-CZ 3.95Å; F939-F984 HydrophobicContact CD1-CZ 3.95Å; F939-F984 HydrophobicContact CE1-CD1 4.26Å; F939-F984 HydrophobicContact CE1-CG 4.26Å; L942-F984 HydrophobicContact CB-CE2 4.26Å; F943-F984 HydrophobicContact CB-CZ 4.28Å; L946-F984 HydrophobicContact CD1-CE2 4.37Å; I980-F984 HydrophobicContact CG2-CD2 3.9Å; I980-F984 HydrophobicContact CG2-CE2 3.76Å; I980-F984 WeakPolarHBondContact O-CD2 3.35Å; I980-F984 PolarHBondContact O-N 2.76Å; M981-F984 HydrophobicContact CE-CD2 4.42Å; M981-F984 WeakPolarHBondContact O-CB 3.14Å; M981-F984 PolarHBondContact O-N 3.26Å; Q982-F984 VanDerWaalsContact C-N 3.35Å; Q982-F984 PolarHBondContact O-N 2.93Å; F984-Q986 PolarHBondContact O-N 2.96Å; F984-S987 WeakPolarHBondContact O-CB 3.36Å; F984-S987 PolarHBondContact O-N 2.76Å; F984-S987 PolarHBondContact O-OG 3.44Å; F984-N999 HydrophobicContact CD1-CB 3.89Å; F984-N999 HydrophobicContact CE1-CB 4.09Å; F984-Y1002 HydrophobicContact CE1-CD2 4.15Å; F984-Y1002 HydrophobicContact CZ-CD2 4.44Å; F984-L1003 HydrophobicContact CB-CD2 4.47Å; F984-L1003 HydrophobicContact CD1-CD2 4.4Å; F984-L1003 HydrophobicContact CD1-CG 4.43Å; F984-L1003 HydrophobicContact CG-CD2 4.33Å; F984-F1026 HydrophobicContact CB-CE1 4.47Å; F984-F1026 HydrophobicContact CB-CZ 4.4Å
985G93.1Very high92.5Very high13 Ų1345.6 Ų45.613%0.13425%0.249CC..Hα-helixtrans-61.4-42.6178.100000113.2M981 Q982 A983 S987 F988M981-G985 PolarHBondContact O-N 3.3Å; Q982-G985 PolarHBondContact O-N 3.48Å; A983-G985 PolarHBondContact O-N 3.16Å; G985-S987 VanDerWaalsContact C-N 3.29Å; G985-S987 PolarHBondContact O-N 3.47Å; G985-F988 PolarHBondContact O-N 3.21Å
986Q91.4Very high92.7Very high103 Ų10340.8 Ų40.848%0.48122%0.218SC..Hα-helixtrans-65.6-31.9177.1-69.8-61.3-36.100112.5Q982 A983 F984 F988 L989Q982-Q986 VanDerWaalsContact O-CG 3.3Å; Q982-Q986 WeakPolarHBondContact O-CG 3.39Å; Q982-Q986 PolarHBondContact O-N 3.11Å; A983-Q986 PolarHBondContact O-N 3.35Å; F984-Q986 PolarHBondContact O-N 2.96Å; Q986-F988 PolarHBondContact O-N 3.28Å; Q986-L989 WeakPolarHBondContact O-CB 3.29Å; Q986-L989 PolarHBondContact O-N 2.54Å
987S93Very high92.9Very high1 Ų143.9 Ų43.91%0.00723%0.231CC..Hα-helixtrans-61-29.7177.378.20000113A983 F984 G985 L989 Q990 N999A983-S987 PolarHBondContact O-N 3.4Å; F984-S987 WeakPolarHBondContact O-CB 3.36Å; F984-S987 PolarHBondContact O-N 2.76Å; F984-S987 PolarHBondContact O-OG 3.44Å; G985-S987 VanDerWaalsContact C-N 3.29Å; G985-S987 PolarHBondContact O-N 3.47Å; S987-L989 PolarHBondContact O-N 3.31Å; S987-Q990 WeakPolarHBondContact O-CB 3.44Å; S987-Q990 PolarHBondContact O-N 3.28Å; S987-Q990 VanDerWaalsContact O-N 3.15Å; S987-N999 VanDerWaalsContact CB-ND2 3.28Å; S987-N999 WeakPolarHBondContact CB-ND2 3.5Å; S987-N999 PolarHBondContact OG-ND2 3.42Å
988F93.3Very high93Very high1 Ų145.7 Ų45.70%0.00424%0.239CC..THydrogen-bonded Turntrans-74.6-7.8177.7-61.2-44.9000114.3G985 Q986 F996 N999 L1000 L1003 F1026 V1029 L1030G985-F988 PolarHBondContact O-N 3.21Å; Q986-F988 PolarHBondContact O-N 3.28Å; F988-F996 HydrophobicContact CB-CD2 4.18Å; F988-F996 HydrophobicContact CB-CE2 3.68Å; F988-F996 HydrophobicContact CB-CZ 4.34Å; F988-F996 HydrophobicContact CD1-CD1 4.14Å; F988-F996 AromaticContact CD1-CD2 3.66Å; F988-F996 HydrophobicContact CD1-CD2 3.66Å; F988-F996 HydrophobicContact CD1-CE1 4.07Å; F988-F996 AromaticContact CD1-CE2 3.57Å; F988-F996 HydrophobicContact CD1-CE2 3.57Å; F988-F996 AromaticContact CD1-CG 3.94Å; F988-F996 HydrophobicContact CD1-CG 3.94Å; F988-F996 AromaticContact CD1-CZ 3.78Å; F988-F996 HydrophobicContact CD1-CZ 3.78Å; F988-F996 HydrophobicContact CE1-CD1 4.37Å; F988-F996 HydrophobicContact CE1-CE1 4.37Å; F988-F996 HydrophobicContact CE1-CG 4.48Å; F988-F996 HydrophobicContact CE1-CZ 4.47Å; F988-F996 HydrophobicContact CG-CD2 4.39Å; F988-F996 HydrophobicContact CG-CE2 4Å; F988-F996 HydrophobicContact CG-CZ 4.3Å; F988-F996 WeakPolarHBondContact O-CE2 3.23Å; F988-N999 HydrophobicContact CE1-CB 4Å; F988-N999 HydrophobicContact CZ-CB 4.29Å; F988-L1000 HydrophobicContact CE1-CB 4.01Å; F988-L1000 HydrophobicContact CE1-CD1 4.33Å; F988-L1000 HydrophobicContact CZ-CB 4.24Å; F988-L1000 HydrophobicContact CZ-CD1 4.04Å; F988-L1003 HydrophobicContact CE2-CD1 3.52Å; F988-L1003 HydrophobicContact CZ-CD1 3.62Å; F988-F1026 HydrophobicContact CD2-CD1 4.19Å; F988-F1026 HydrophobicContact CD2-CE1 4.16Å; F988-F1026 AromaticContact CE2-CD1 3.89Å; F988-F1026 HydrophobicContact CE2-CD1 3.89Å; F988-F1026 AromaticContact CE2-CE1 3.76Å; F988-F1026 HydrophobicContact CE2-CE1 3.76Å; F988-V1029 HydrophobicContact CB-CG1 3.73Å; F988-L1030 HydrophobicContact CD2-CD2 4.47Å; F988-L1030 HydrophobicContact CG-CD2 4.48Å
989L90.4Very high93.2Very high110 Ų11044.7 Ų44.758%0.57623%0.232SC*.THydrogen-bonded Turntrans-92-7.2172.3-58.9177000112.3Q986 S987 V1029Q986-L989 WeakPolarHBondContact O-CB 3.29Å; Q986-L989 PolarHBondContact O-N 2.54Å; S987-L989 PolarHBondContact O-N 3.31Å; L989-V1029 HydrophobicContact CD2-CG1 3.77Å; L989-V1029 HydrophobicContact CD2-CG2 4.16Å; L989-V1029 HydrophobicContact CG-CG1 4.41Å
990Q89.1Confident93.3Very high33 Ų3343.6 Ų43.615%0.15422%0.222CC..SBendtrans-87.3153.8-179.1-57.1-1703.400111.1A927 S987 D992 H1039A927-Q990 PolarHBondContact O-NE2 3.42Å; S987-Q990 WeakPolarHBondContact O-CB 3.44Å; S987-Q990 PolarHBondContact O-N 3.28Å; S987-Q990 VanDerWaalsContact O-N 3.15Å; Q990-D992 VanDerWaalsContact C-N 3.31Å; Q990-D992 PolarHBondContact O-N 3.46Å; Q990-H1039 PolarHBondContact O-CE1 3.43Å; Q990-H1039 PolarHBondContact O-NE2 3.38Å
991P88.4Confident93.4Very high123 Ų12349.8 Ų49.880%0.79925%0.249SC*.SBendtrans-79.1-5.6-176.931.7-36.7000114.9I993P991-I993 PolarHBondContact O-N 3.48Å
992D90Very high93.5Very high44 Ų4450.7 Ų50.724%0.23525%0.253CS..  trans-77.6105.3-176.2-175.4-19.7000111.6Q990 H994 L995 F996Q990-D992 VanDerWaalsContact C-N 3.31Å; Q990-D992 PolarHBondContact O-N 3.46Å; D992-H994 VanDerWaalsContact C-N 3.33Å; D992-H994 PolarHBondContact O-N 3.38Å; D992-H994 PolarHBondContact OD1-N 3.34Å; D992-L995 HydrophobicContact CB-CB 4.04Å; D992-L995 PolarHBondContact O-N 3.41Å; D992-L995 PolarHBondContact OD1-N 2.95Å; D992-L995 VanDerWaalsContact OD1-N 3.16Å; D992-F996 WeakPolarHBondContact O-CB 3.45Å; D992-F996 PolarHBondContact O-N 3.15Å
993I91.9Very high93.6Very high50 Ų5044.9 Ų44.926%0.25623%0.225SC..Hα-helixtrans-63.8-32.7-179.5-169.4172.8000113.8P991 K997 L1041 L1042P991-I993 PolarHBondContact O-N 3.48Å; I993-K997 WeakPolarHBondContact O-CB 3.34Å; I993-K997 PolarHBondContact O-N 3Å; I993-L1041 HydrophobicContact CD1-CB 3.71Å; I993-L1041 HydrophobicContact CD1-CD1 3.74Å; I993-L1041 HydrophobicContact CD1-CG 4.3Å; I993-L1042 HydrophobicContact CD1-CD1 4.48Å; I993-L1042 HydrophobicContact CD1-CG 4.2Å; I993-L1042 HydrophobicContact CG1-CD1 3.77Å; I993-L1042 HydrophobicContact CG1-CG 4.03Å
994H91.9Very high93.8Very high150 Ų15046.1 Ų46.169%0.69423%0.231SC*.Hα-helixtrans-72.5-46.5-177.4-68.658.5000109.4D992 K997 Q998D992-H994 VanDerWaalsContact C-N 3.33Å; D992-H994 PolarHBondContact O-N 3.38Å; D992-H994 PolarHBondContact OD1-N 3.34Å; H994-K997 PolarHBondContact O-N 3.32Å; H994-Q998 WeakPolarHBondContact O-CB 3.46Å; H994-Q998 PolarHBondContact O-N 2.95Å
995L92.9Very high93.8Very high3 Ų347.5 Ų47.52%0.01624%0.239CC..Hα-helixtrans-63.1-41.9175.1-174.864.1000111.7K935 F939 D992 K997 Q998 N999K935-L995 HydrophobicContact CB-CD1 4.25Å; K935-L995 HydrophobicContact CB-CD2 3.96Å; K935-L995 HydrophobicContact CD-CD2 3.84Å; K935-L995 HydrophobicContact CG-CD2 4.43Å; F939-L995 HydrophobicContact CD2-CD1 3.78Å; F939-L995 HydrophobicContact CD2-CD2 4.49Å; F939-L995 HydrophobicContact CE2-CD1 4.39Å; F939-L995 HydrophobicContact CE2-CD2 4.32Å; F939-L995 HydrophobicContact CG-CD1 4.44Å; D992-L995 HydrophobicContact CB-CB 4.04Å; D992-L995 PolarHBondContact O-N 3.41Å; D992-L995 PolarHBondContact OD1-N 2.95Å; D992-L995 VanDerWaalsContact OD1-N 3.16Å; L995-K997 PolarHBondContact O-N 3.46Å; L995-Q998 PolarHBondContact O-N 3.19Å; L995-N999 WeakPolarHBondContact O-CB 3.49Å; L995-N999 PolarHBondContact O-N 3.36Å
996F95.1Very high93.9Very high0 Ų046.9 Ų46.90%023%0.233CC..Hα-helixtrans-56.6-51.4174.9-169.9-69.8000110.8F988 D992 Q998 N999 L1000 L1030 V1033 H1039 L1042 I1046F988-F996 HydrophobicContact CB-CD2 4.18Å; F988-F996 HydrophobicContact CB-CE2 3.68Å; F988-F996 HydrophobicContact CB-CZ 4.34Å; F988-F996 HydrophobicContact CD1-CD1 4.14Å; F988-F996 AromaticContact CD1-CD2 3.66Å; F988-F996 HydrophobicContact CD1-CD2 3.66Å; F988-F996 HydrophobicContact CD1-CE1 4.07Å; F988-F996 AromaticContact CD1-CE2 3.57Å; F988-F996 HydrophobicContact CD1-CE2 3.57Å; F988-F996 AromaticContact CD1-CG 3.94Å; F988-F996 HydrophobicContact CD1-CG 3.94Å; F988-F996 AromaticContact CD1-CZ 3.78Å; F988-F996 HydrophobicContact CD1-CZ 3.78Å; F988-F996 HydrophobicContact CE1-CD1 4.37Å; F988-F996 HydrophobicContact CE1-CE1 4.37Å; F988-F996 HydrophobicContact CE1-CG 4.48Å; F988-F996 HydrophobicContact CE1-CZ 4.47Å; F988-F996 HydrophobicContact CG-CD2 4.39Å; F988-F996 HydrophobicContact CG-CE2 4Å; F988-F996 HydrophobicContact CG-CZ 4.3Å; F988-F996 WeakPolarHBondContact O-CE2 3.23Å; D992-F996 WeakPolarHBondContact O-CB 3.45Å; D992-F996 PolarHBondContact O-N 3.15Å; F996-Q998 PolarHBondContact O-N 3.13Å; F996-N999 PolarHBondContact O-N 3.28Å; F996-L1000 HydrophobicContact CE1-CD2 4.2Å; F996-L1000 WeakPolarHBondContact O-CB 3.44Å; F996-L1000 PolarHBondContact O-N 2.9Å; F996-L1030 HydrophobicContact CE1-CD2 4.46Å; F996-L1030 HydrophobicContact CZ-CD2 3.83Å; F996-V1033 HydrophobicContact CE2-CG1 4.23Å; F996-V1033 HydrophobicContact CE2-CG2 4.09Å; F996-V1033 HydrophobicContact CZ-CG1 4.15Å; F996-V1033 HydrophobicContact CZ-CG2 4.46Å; F996-H1039 AromaticContact CD2-CE1 3.69Å; F996-H1039 AromaticContact CD2-ND1 3.83Å; F996-H1039 AromaticContact CD2-NE2 3.81Å; F996-H1039 AromaticContact CE2-ND1 3.93Å; F996-L1042 HydrophobicContact CB-CD1 4.33Å; F996-L1042 HydrophobicContact CD1-CD1 3.5Å; F996-L1042 HydrophobicContact CE1-CD1 4.19Å; F996-L1042 HydrophobicContact CG-CD1 4.2Å; F996-I1046 HydrophobicContact CE1-CD1 3.8Å; F996-I1046 HydrophobicContact CE1-CG1 3.71Å; F996-I1046 HydrophobicContact CZ-CD1 3.86Å; F996-I1046 HydrophobicContact CZ-CG1 4.02Å
997K95.9Very high94.1Very high115 Ų11542.6 Ų42.650%0.521%0.213SC..Hα-helixtrans-60.8-45.6180-173.6175.5-174.4163.60111.8I993 H994 L995 F1001 L1042I993-K997 WeakPolarHBondContact O-CB 3.34Å; I993-K997 PolarHBondContact O-N 3Å; H994-K997 PolarHBondContact O-N 3.32Å; L995-K997 PolarHBondContact O-N 3.46Å; K997-F1001 WeakPolarHBondContact O-CB 3.45Å; K997-F1001 PolarHBondContact O-N 3.23Å; K997-L1042 HydrophobicContact CB-CD1 3.93Å; K997-L1042 HydrophobicContact CB-CD2 4.19Å; K997-L1042 HydrophobicContact CD-CD2 3.93Å; K997-L1042 HydrophobicContact CG-CD2 4.09Å
998Q96.2Very high94.1Very high38 Ų3847.1 Ų47.118%0.17824%0.241CC..Hα-helixtrans-58.6-50.3178-178.6-171.7800111.5A936 H994 L995 F996 F1001 Y1002A936-Q998 PolarHBondContact O-NE2 3.24Å; A936-Q998 VanDerWaalsContact O-NE2 3.08Å; H994-Q998 WeakPolarHBondContact O-CB 3.46Å; H994-Q998 PolarHBondContact O-N 2.95Å; L995-Q998 PolarHBondContact O-N 3.19Å; F996-Q998 PolarHBondContact O-N 3.13Å; Q998-F1001 WeakPolarHBondContact O-CB 3.5Å; Q998-F1001 PolarHBondContact O-N 2.92Å; Q998-Y1002 HydrophobicContact CG-CD2 4.14Å; Q998-Y1002 HydrophobicContact CG-CE1 4.31Å; Q998-Y1002 HydrophobicContact CG-CE2 3.46Å; Q998-Y1002 VanDerWaalsContact CG-CE2 3.46Å; Q998-Y1002 PolarHBondContact NE2-OH 3.49Å; Q998-Y1002 PolarHBondContact O-N 2.91Å
999N96.3Very high94.1Very high0 Ų053.9 Ų53.90%027%0.27CS..Hα-helixtrans-69.8-35.4-176.8-77.5-9.3000113F939 F984 S987 F988 L995 F996 Y1002 L1003F939-N999 VanDerWaalsContact CB-OD1 3.24Å; F939-N999 WeakPolarHBondContact CB-OD1 3.37Å; F939-N999 WeakPolarHBondContact CD1-ND2 3.21Å; F939-N999 WeakPolarHBondContact CG-ND2 3.36Å; F939-N999 WeakPolarHBondContact CG-OD1 3.49Å; F984-N999 HydrophobicContact CD1-CB 3.89Å; F984-N999 HydrophobicContact CE1-CB 4.09Å; S987-N999 VanDerWaalsContact CB-ND2 3.28Å; S987-N999 WeakPolarHBondContact CB-ND2 3.5Å; S987-N999 PolarHBondContact OG-ND2 3.42Å; F988-N999 HydrophobicContact CE1-CB 4Å; F988-N999 HydrophobicContact CZ-CB 4.29Å; L995-N999 WeakPolarHBondContact O-CB 3.49Å; L995-N999 PolarHBondContact O-N 3.36Å; F996-N999 PolarHBondContact O-N 3.28Å; N999-Y1002 PolarHBondContact O-N 3.39Å; N999-L1003 PolarHBondContact O-N 3.1Å; N999-L1003 VanDerWaalsContact O-N 3.09Å
1000L96.7Very high94.1Very high7 Ų751.4 Ų51.44%0.03726%0.256CS..Hα-helixtrans-63-45.9172.7-168.765.4000110.8F988 F996 Y1002 L1003 E1004 L1030 E1045 I1046 A1049F988-L1000 HydrophobicContact CE1-CB 4.01Å; F988-L1000 HydrophobicContact CE1-CD1 4.33Å; F988-L1000 HydrophobicContact CZ-CB 4.24Å; F988-L1000 HydrophobicContact CZ-CD1 4.04Å; F996-L1000 HydrophobicContact CE1-CD2 4.2Å; F996-L1000 WeakPolarHBondContact O-CB 3.44Å; F996-L1000 PolarHBondContact O-N 2.9Å; L1000-Y1002 VanDerWaalsContact C-N 3.3Å; L1000-Y1002 PolarHBondContact O-N 2.77Å; L1000-L1003 PolarHBondContact O-N 2.89Å; L1000-E1004 PolarHBondContact O-N 2.82Å; L1000-L1030 HydrophobicContact CD1-CD1 4.32Å; L1000-L1030 HydrophobicContact CD1-CD2 4.27Å; L1000-E1045 HydrophobicContact CD2-CB 3.99Å; L1000-I1046 HydrophobicContact CD2-CG1 4.17Å; L1000-A1049 HydrophobicContact CD1-CB 3.64Å; L1000-A1049 HydrophobicContact CD2-CB 4.4Å; L1000-A1049 HydrophobicContact CG-CB 4.27Å
1001F97.5Very high94.2Very high131 Ų13155.4 Ų55.458%0.57527%0.273SS*.Hα-helixtrans-59.4-39.3175.6174.8-98.7000112.7K997 Q998 E1004 T1005K997-F1001 WeakPolarHBondContact O-CB 3.45Å; K997-F1001 PolarHBondContact O-N 3.23Å; Q998-F1001 WeakPolarHBondContact O-CB 3.5Å; Q998-F1001 PolarHBondContact O-N 2.92Å; F1001-E1004 PolarHBondContact O-N 3Å; F1001-T1005 WeakPolarHBondContact O-CB 3.47Å; F1001-T1005 PolarHBondContact O-N 3.16Å; F1001-T1005 PolarHBondContact O-OG1 3.36Å
1002Y97.4Very high94.5Very high19 Ų1949.5 Ų49.58%0.07524%0.235CC..Hα-helixtrans-63.9-44175.5-69.9-19000112.9E940 F943 F984 Q998 N999 L1000 E1004 T1005 L1006E940-Y1002 HydrophobicContact CB-CE2 4.21Å; E940-Y1002 WeakPolarHBondContact CB-OH 3.29Å; E940-Y1002 WeakPolarHBondContact CG-OH 3.42Å; F943-Y1002 HydrophobicContact CB-CD1 4.31Å; F943-Y1002 HydrophobicContact CB-CD2 3.64Å; F943-Y1002 HydrophobicContact CB-CE2 4.04Å; F943-Y1002 HydrophobicContact CB-CG 3.78Å; F943-Y1002 AromaticContact CD1-CD1 3.63Å; F943-Y1002 HydrophobicContact CD1-CD1 3.63Å; F943-Y1002 HydrophobicContact CD1-CD2 4.4Å; F943-Y1002 AromaticContact CD1-CE1 3.73Å; F943-Y1002 HydrophobicContact CD1-CE1 3.73Å; F943-Y1002 HydrophobicContact CD1-CE2 4.47Å; F943-Y1002 AromaticContact CD1-CG 4Å; F943-Y1002 HydrophobicContact CD1-CG 4Å; F943-Y1002 AromaticContact CD2-CD1 3.9Å; F943-Y1002 HydrophobicContact CD2-CD1 3.9Å; F943-Y1002 HydrophobicContact CD2-CD2 4.45Å; F943-Y1002 AromaticContact CD2-CG 3.72Å; F943-Y1002 HydrophobicContact CD2-CG 3.72Å; F943-Y1002 AromaticContact CE1-CD1 3.85Å; F943-Y1002 HydrophobicContact CE1-CD1 3.85Å; F943-Y1002 HydrophobicContact CE1-CE1 4.01Å; F943-Y1002 HydrophobicContact CE2-CD1 4.09Å; F943-Y1002 HydrophobicContact CE2-CG 4.29Å; F943-Y1002 AromaticContact CG-CD1 3.66Å; F943-Y1002 HydrophobicContact CG-CD1 3.66Å; F943-Y1002 AromaticContact CG-CD2 3.92Å; F943-Y1002 HydrophobicContact CG-CD2 3.92Å; F943-Y1002 HydrophobicContact CG-CE1 4.15Å; F943-Y1002 HydrophobicContact CG-CE2 4.36Å; F943-Y1002 AromaticContact CG-CG 3.54Å; F943-Y1002 HydrophobicContact CG-CG 3.54Å; F943-Y1002 HydrophobicContact CZ-CD1 4.07Å; F984-Y1002 HydrophobicContact CE1-CD2 4.15Å; F984-Y1002 HydrophobicContact CZ-CD2 4.44Å; Q998-Y1002 HydrophobicContact CG-CD2 4.14Å; Q998-Y1002 HydrophobicContact CG-CE1 4.31Å; Q998-Y1002 HydrophobicContact CG-CE2 3.46Å; Q998-Y1002 VanDerWaalsContact CG-CE2 3.46Å; Q998-Y1002 PolarHBondContact NE2-OH 3.49Å; Q998-Y1002 PolarHBondContact O-N 2.91Å; N999-Y1002 PolarHBondContact O-N 3.39Å; L1000-Y1002 VanDerWaalsContact C-N 3.3Å; L1000-Y1002 PolarHBondContact O-N 2.77Å; Y1002-E1004 PolarHBondContact O-N 2.97Å; Y1002-T1005 PolarHBondContact O-N 3.28Å; Y1002-L1006 WeakPolarHBondContact O-CG 3.47Å; Y1002-L1006 PolarHBondContact O-N 3.09Å
1003L96.6Very high94.7Very high0 Ų047.4 Ų47.40%022%0.224CC..Hα-helixtrans-62.1-43.3175.5-68.9179.6000111.8M981 F984 F988 N999 L1000 T1005 L1006 N1007 L1012 F1026M981-L1003 HydrophobicContact SD-CD2 4.27Å; F984-L1003 HydrophobicContact CB-CD2 4.47Å; F984-L1003 HydrophobicContact CD1-CD2 4.4Å; F984-L1003 HydrophobicContact CD1-CG 4.43Å; F984-L1003 HydrophobicContact CG-CD2 4.33Å; F988-L1003 HydrophobicContact CE2-CD1 3.52Å; F988-L1003 HydrophobicContact CZ-CD1 3.62Å; N999-L1003 PolarHBondContact O-N 3.1Å; N999-L1003 VanDerWaalsContact O-N 3.09Å; L1000-L1003 PolarHBondContact O-N 2.89Å; L1003-T1005 VanDerWaalsContact C-N 3.33Å; L1003-T1005 PolarHBondContact O-N 3.48Å; L1003-L1006 PolarHBondContact O-N 3.48Å; L1003-N1007 WeakPolarHBondContact O-CB 3.48Å; L1003-N1007 PolarHBondContact O-N 3.02Å; L1003-L1012 HydrophobicContact CD2-CD2 3.9Å; L1003-F1026 HydrophobicContact CD1-CD1 4.01Å; L1003-F1026 HydrophobicContact CD1-CE1 3.64Å
1004E96.8Very high94.7Very high28 Ų2849.4 Ų49.413%0.13123%0.231CC..Hα-helixtrans-65.7-36.7177.9-72.3-55.9144.500112.4L1000 F1001 Y1002 N1007 T1008 Y1013 A1049 N1052L1000-E1004 PolarHBondContact O-N 2.82Å; F1001-E1004 PolarHBondContact O-N 3Å; Y1002-E1004 PolarHBondContact O-N 2.97Å; E1004-N1007 PolarHBondContact O-N 3.32Å; E1004-T1008 WeakPolarHBondContact O-CB 3.49Å; E1004-T1008 PolarHBondContact O-N 3.23Å; E1004-T1008 PolarHBondContact O-OG1 3.23Å; E1004-Y1013 PolarHBondContact OE1-OH 3.34Å; E1004-A1049 VanDerWaalsContact OE1-CA 3.24Å; E1004-A1049 WeakPolarHBondContact OE1-CA 3.25Å; E1004-A1049 VanDerWaalsContact OE1-CB 3.32Å; E1004-A1049 WeakPolarHBondContact OE1-CB 3.31Å; E1004-N1052 PolarHBondContact OE2-ND2 3.15Å
1005T96.8Very high94.6Very high29 Ų2943.9 Ų43.918%0.17821%0.206CC..Hα-helixtrans-66.2-45.6174.6-60.20000111.3F943 F1001 Y1002 L1003 N1007 T1008 K1009F943-T1005 HydrophobicContact CE2-CG2 4.11Å; F943-T1005 HydrophobicContact CZ-CG2 3.82Å; F1001-T1005 WeakPolarHBondContact O-CB 3.47Å; F1001-T1005 PolarHBondContact O-N 3.16Å; F1001-T1005 PolarHBondContact O-OG1 3.36Å; Y1002-T1005 PolarHBondContact O-N 3.28Å; L1003-T1005 VanDerWaalsContact C-N 3.33Å; L1003-T1005 PolarHBondContact O-N 3.48Å; T1005-N1007 VanDerWaalsContact C-N 3.31Å; T1005-N1007 PolarHBondContact O-N 2.94Å; T1005-T1008 PolarHBondContact O-N 3.11Å; T1005-K1009 HydrophobicContact CG2-CG 4.49Å; T1005-K1009 WeakPolarHBondContact O-CB 3.39Å; T1005-K1009 WeakPolarHBondContact O-CG 3.42Å; T1005-K1009 PolarHBondContact O-N 2.92Å
1006L95Very high94.3Very high0 Ų049.2 Ų49.20%023%0.228CC..Hα-helixtrans-61.3-39.6174.5-71.6174.3000111.5F943 L946 H947 M981 Y1002 L1003 Q1010 K1011 L1012F943-L1006 HydrophobicContact CD2-CD1 4.12Å; F943-L1006 HydrophobicContact CD2-CD2 4.13Å; F943-L1006 HydrophobicContact CD2-CG 3.87Å; F943-L1006 HydrophobicContact CE2-CD2 3.98Å; F943-L1006 HydrophobicContact CE2-CG 3.81Å; L946-L1006 HydrophobicContact CB-CD1 4.27Å; L946-L1006 HydrophobicContact CB-CD2 4.08Å; L946-L1006 HydrophobicContact CD1-CD1 3.91Å; H947-L1006 HydrophobicContact CB-CD2 4Å; M981-L1006 HydrophobicContact CE-CD1 4.44Å; Y1002-L1006 WeakPolarHBondContact O-CG 3.47Å; Y1002-L1006 PolarHBondContact O-N 3.09Å; L1003-L1006 PolarHBondContact O-N 3.48Å; L1006-Q1010 WeakPolarHBondContact O-CA 3.27Å; L1006-Q1010 WeakPolarHBondContact O-CB 3.4Å; L1006-Q1010 PolarHBondContact O-N 3.03Å; L1006-K1011 PolarHBondContact O-N 3.18Å; L1006-L1012 HydrophobicContact CB-CB 4.21Å; L1006-L1012 HydrophobicContact CB-CD2 3.91Å; L1006-L1012 HydrophobicContact CD1-CD2 4.25Å
1007N94.7Very high94.1Very high12 Ų1250.1 Ų50.16%0.06423%0.233CC..Hα-helixtrans-66.3-44.9175.5-175.648.4000112.1L1003 E1004 T1005 K1009 K1011 L1012 Y1013L1003-N1007 WeakPolarHBondContact O-CB 3.48Å; L1003-N1007 PolarHBondContact O-N 3.02Å; E1004-N1007 PolarHBondContact O-N 3.32Å; T1005-N1007 VanDerWaalsContact C-N 3.31Å; T1005-N1007 PolarHBondContact O-N 2.94Å; N1007-K1009 PolarHBondContact O-N 3.31Å; N1007-K1011 WeakPolarHBondContact O-CA 3.39Å; N1007-K1011 PolarHBondContact O-N 3.04Å; N1007-L1012 HydrophobicContact CB-CB 4.3Å; N1007-Y1013 HydrophobicContact CB-CD1 4.32Å; N1007-Y1013 HydrophobicContact CB-CD2 3.84Å; N1007-Y1013 HydrophobicContact CB-CE1 4.21Å; N1007-Y1013 HydrophobicContact CB-CE2 3.7Å; N1007-Y1013 HydrophobicContact CB-CG 4.13Å; N1007-Y1013 WeakPolarHBondContact ND2-CD2 3.33Å; N1007-Y1013 WeakPolarHBondContact ND2-CE2 3.3Å; N1007-Y1013 WeakPolarHBondContact OD1-CD2 3.45Å; N1007-Y1013 PolarHBondContact OD1-N 3.18Å
1008T93.9Very high93.9Very high96 Ų9644.7 Ų44.759%0.58921%0.209SC*.Hα-helixtrans-61.7-42.7179.3-60.40000111.8E1004 T1005E1004-T1008 WeakPolarHBondContact O-CB 3.49Å; E1004-T1008 PolarHBondContact O-N 3.23Å; E1004-T1008 PolarHBondContact O-OG1 3.23Å; T1005-T1008 PolarHBondContact O-N 3.11Å
1009K92.3Very high93.6Very high143 Ų14349 Ų4962%0.62222%0.224SC*.Hα-helixtrans-86.7-40.8-176.2-65.6-67.5-174.8-179.40114.2T1005 N1007T1005-K1009 HydrophobicContact CG2-CG 4.49Å; T1005-K1009 WeakPolarHBondContact O-CB 3.39Å; T1005-K1009 WeakPolarHBondContact O-CG 3.42Å; T1005-K1009 PolarHBondContact O-N 2.92Å; N1007-K1009 PolarHBondContact O-N 3.31Å
1010Q89.9Confident93.1Very high59 Ų5953.1 Ų53.128%0.27625%0.25SC..Hα-helixtrans-117.62.4-170.2-58.3-64.4-10.600113.9W950 L1006 L1012 K1015W950-Q1010 HydrophobicContact CD2-CB 3.94Å; W950-Q1010 HydrophobicContact CD2-CG 3.78Å; W950-Q1010 HydrophobicContact CE3-CB 4.11Å; W950-Q1010 HydrophobicContact CE3-CG 3.89Å; W950-Q1010 HydrophobicContact CG-CG 4.12Å; W950-Q1010 HydrophobicContact CH2-CB 4.06Å; W950-Q1010 HydrophobicContact CZ2-CB 3.87Å; W950-Q1010 HydrophobicContact CZ3-CB 4.17Å; W950-Q1010 HydrophobicContact CZ3-CG 4.37Å; L1006-Q1010 WeakPolarHBondContact O-CA 3.27Å; L1006-Q1010 WeakPolarHBondContact O-CB 3.4Å; L1006-Q1010 PolarHBondContact O-N 3.03Å; Q1010-L1012 PolarHBondContact O-N 3.47Å; Q1010-K1015 WeakPolarHBondContact O-CE 3.42Å
1011K92.1Very high92.7Very high116 Ų11656.5 Ų56.550%0.50427%0.27SS..  trans52.942.6-175.7-59.8-64.8-176.2-177.70112.1L1006 N1007 Y1013 H1014 K1015L1006-K1011 PolarHBondContact O-N 3.18Å; N1007-K1011 WeakPolarHBondContact O-CA 3.39Å; N1007-K1011 PolarHBondContact O-N 3.04Å; K1011-Y1013 VanDerWaalsContact C-N 3.26Å; K1011-Y1013 PolarHBondContact O-N 3.29Å; K1011-Y1013 VanDerWaalsContact O-N 3.17Å; K1011-H1014 HydrophobicContact CB-CB 4.18Å; K1011-H1014 WeakPolarHBondContact O-CB 3.47Å; K1011-H1014 PolarHBondContact O-N 3.26Å; K1011-K1015 PolarHBondContact O-N 3.48Å
1012L93.9Very high92.5Very high0 Ų050.8 Ų50.80%025%0.246CC..G310 helixtrans-41.9-51.3-180174.263.1000112.5W950 F977 M981 L1003 L1006 N1007 Q1010 H1014 K1015 F1018W950-L1012 HydrophobicContact CH2-CD1 3.96Å; F977-L1012 HydrophobicContact CE2-CD1 4.42Å; F977-L1012 HydrophobicContact CZ-CD1 3.77Å; M981-L1012 HydrophobicContact CE-CD1 4.48Å; M981-L1012 HydrophobicContact SD-CD1 4.4Å; M981-L1012 HydrophobicContact SD-CD2 4.37Å; L1003-L1012 HydrophobicContact CD2-CD2 3.9Å; L1006-L1012 HydrophobicContact CB-CB 4.21Å; L1006-L1012 HydrophobicContact CB-CD2 3.91Å; L1006-L1012 HydrophobicContact CD1-CD2 4.25Å; N1007-L1012 HydrophobicContact CB-CB 4.3Å; Q1010-L1012 PolarHBondContact O-N 3.47Å; L1012-H1014 PolarHBondContact O-N 2.93Å; L1012-K1015 WeakPolarHBondContact O-CB 3.37Å; L1012-K1015 PolarHBondContact O-N 3.3Å; L1012-F1018 HydrophobicContact CD1-CD2 4.02Å; L1012-F1018 HydrophobicContact CD2-CD2 4.46Å; L1012-F1018 HydrophobicContact CD2-CE2 4.28Å; L1012-F1018 HydrophobicContact CG-CD2 4.03Å; L1012-F1018 HydrophobicContact CG-CE2 4.3Å; L1012-F1018 HydrophobicContact CG-CG 4.47Å; L1012-F1018 WeakPolarHBondContact O-CB 3.3Å
1013Y94.4Very high92.3Very high0 Ų051 Ų510%025%0.248CC..G310 helixtrans-67.5-21.4-174.6-53-26.6000113.3E1004 N1007 K1011 F1018 N1052 M1053 V1056E1004-Y1013 PolarHBondContact OE1-OH 3.34Å; N1007-Y1013 HydrophobicContact CB-CD1 4.32Å; N1007-Y1013 HydrophobicContact CB-CD2 3.84Å; N1007-Y1013 HydrophobicContact CB-CE1 4.21Å; N1007-Y1013 HydrophobicContact CB-CE2 3.7Å; N1007-Y1013 HydrophobicContact CB-CG 4.13Å; N1007-Y1013 WeakPolarHBondContact ND2-CD2 3.33Å; N1007-Y1013 WeakPolarHBondContact ND2-CE2 3.3Å; N1007-Y1013 WeakPolarHBondContact OD1-CD2 3.45Å; N1007-Y1013 PolarHBondContact OD1-N 3.18Å; K1011-Y1013 VanDerWaalsContact C-N 3.26Å; K1011-Y1013 PolarHBondContact O-N 3.29Å; K1011-Y1013 VanDerWaalsContact O-N 3.17Å; Y1013-F1018 AromaticContact CD1-CD1 3.83Å; Y1013-F1018 HydrophobicContact CD1-CD1 3.83Å; Y1013-F1018 AromaticContact CD1-CE1 3.36Å; Y1013-F1018 HydrophobicContact CD1-CE1 3.36Å; Y1013-F1018 HydrophobicContact CD1-CE2 4.27Å; Y1013-F1018 HydrophobicContact CD1-CG 4.45Å; Y1013-F1018 AromaticContact CD1-CZ 3.62Å; Y1013-F1018 HydrophobicContact CD1-CZ 3.62Å; Y1013-F1018 AromaticContact CE1-CE1 3.94Å; Y1013-F1018 HydrophobicContact CE1-CE1 3.94Å; Y1013-F1018 HydrophobicContact CE1-CE2 4.41Å; Y1013-F1018 AromaticContact CE1-CZ 3.75Å; Y1013-F1018 HydrophobicContact CE1-CZ 3.75Å; Y1013-F1018 HydrophobicContact CG-CD1 4.45Å; Y1013-F1018 HydrophobicContact CG-CE1 4.15Å; Y1013-N1052 HydrophobicContact CD2-CB 4.39Å; Y1013-N1052 HydrophobicContact CE2-CB 4.04Å; Y1013-M1053 HydrophobicContact CD1-CG 4.34Å; Y1013-M1053 HydrophobicContact CD2-CB 4.45Å; Y1013-M1053 HydrophobicContact CD2-CG 3.75Å; Y1013-M1053 HydrophobicContact CE1-CE 3.83Å; Y1013-M1053 HydrophobicContact CE1-CG 4.2Å; Y1013-M1053 HydrophobicContact CE2-CE 4.29Å; Y1013-M1053 HydrophobicContact CE2-CG 3.59Å; Y1013-M1053 HydrophobicContact CG-CG 4.15Å; Y1013-M1053 WeakPolarHBondContact OH-CE 3.45Å; Y1013-V1056 VanDerWaalsContact CB-CG2 3.46Å; Y1013-V1056 WeakPolarHBondContact O-CG1 3.49Å
1014H91.4Very high92.1Very high91 Ų9154.5 Ų54.542%0.42126%0.263SS..G310 helixtrans-84.1-11.5177.9-6165.6000112.9K1011 L1012K1011-H1014 HydrophobicContact CB-CB 4.18Å; K1011-H1014 WeakPolarHBondContact O-CB 3.47Å; K1011-H1014 PolarHBondContact O-N 3.26Å; L1012-H1014 PolarHBondContact O-N 2.93Å
1015K89.9Confident91.9Very high35 Ų3558.7 Ų58.715%0.15228%0.283CS..SBendtrans-69.6137.1178.7-61-63.3175.3-177.30109.6W950 F954 E969 Q1010 K1011 L1012 I1017 F1018 R1019W950-K1015 HydrophobicContact CZ2-CD 4.41Å; W950-K1015 HydrophobicContact CZ2-CG 4.12Å; F954-K1015 HydrophobicContact CD1-CD 4.4Å; F954-K1015 HydrophobicContact CE1-CB 4.35Å; F954-K1015 HydrophobicContact CE1-CD 4.27Å; F954-K1015 HydrophobicContact CE1-CG 4.31Å; F954-K1015 HydrophobicContact CZ-CB 4.44Å; F954-K1015 HydrophobicContact CZ-CG 4.33Å; E969-K1015 IonicContact OE1-NZ 3.9Å; E969-K1015 PolarHBondContact OE1-NZ 2.95Å; E969-K1015 IonicContact OE2-NZ 3.83Å; E969-K1015 PolarHBondContact OE2-NZ 2.86Å; Q1010-K1015 WeakPolarHBondContact O-CE 3.42Å; K1011-K1015 PolarHBondContact O-N 3.48Å; L1012-K1015 WeakPolarHBondContact O-CB 3.37Å; L1012-K1015 PolarHBondContact O-N 3.3Å; K1015-I1017 VanDerWaalsContact C-N 3.34Å; K1015-I1017 HydrophobicContact CB-CG2 4.46Å; K1015-I1017 PolarHBondContact O-N 2.94Å; K1015-F1018 PolarHBondContact O-N 2.93Å; K1015-R1019 PolarHBondContact O-N 2.9Å
1016K88.4Confident91.8Very high114 Ų11457.6 Ų57.650%0.49628%0.276SS..Hα-helixtrans-49.5-52-175.1-176.3176.9-172.8154.50112.4E968 F1018 R1019 T1020E968-K1016 WeakPolarHBondContact OE1-CD 3.24Å; E968-K1016 IonicContact OE1-NZ 2.9Å; E968-K1016 PolarHBondContact OE1-NZ 3.16Å; E968-K1016 WeakPolarHBondContact OE2-CD 3.28Å; E968-K1016 IonicContact OE2-NZ 3.17Å; E968-K1016 PolarHBondContact OE2-NZ 2.87Å; K1016-F1018 VanDerWaalsContact C-N 3.29Å; K1016-F1018 PolarHBondContact O-N 2.57Å; K1016-R1019 PolarHBondContact O-N 3.42Å; K1016-T1020 HydrophobicContact CG-CG2 4.17Å; K1016-T1020 PolarHBondContact O-N 3.42Å; K1016-T1020 PolarHBondContact O-OG1 2.99Å
1017I89.8Confident91.8Very high20 Ų2057.8 Ų57.810%0.10328%0.277CS..Hα-helixtrans-56.6-39178.6-172.368000112.9F954 M971 E974 F977 K1015 T1021 M1022F954-I1017 HydrophobicContact CE1-CG2 4.38Å; F954-I1017 HydrophobicContact CZ-CG2 4.19Å; M971-I1017 HydrophobicContact CE-CG1 4.37Å; M971-I1017 HydrophobicContact CE-CG2 4.08Å; M971-I1017 HydrophobicContact SD-CB 3.95Å; M971-I1017 HydrophobicContact SD-CG1 4.15Å; M971-I1017 HydrophobicContact SD-CG2 3.81Å; E974-I1017 HydrophobicContact CG-CD1 4.2Å; E974-I1017 WeakPolarHBondContact OE1-CD1 2.76Å; F977-I1017 HydrophobicContact CD1-CG2 4.3Å; F977-I1017 HydrophobicContact CE1-CG2 3.83Å; K1015-I1017 VanDerWaalsContact C-N 3.34Å; K1015-I1017 HydrophobicContact CB-CG2 4.46Å; K1015-I1017 PolarHBondContact O-N 2.94Å; I1017-T1021 WeakPolarHBondContact CD1-OG1 3.27Å; I1017-T1021 WeakPolarHBondContact O-CB 3.18Å; I1017-T1021 PolarHBondContact O-N 3.12Å; I1017-T1021 PolarHBondContact O-OG1 3.17Å; I1017-M1022 HydrophobicContact CG1-CE 4.22Å
1018F91.4Very high91.8Very high0 Ų059.1 Ų59.10%028%0.284CS..Iπ-helixtrans-72.3-49.9177.4-162.2-83.3000109.7M981 L1012 Y1013 K1015 K1016 T1020 M1022 L1023 F1026M981-F1018 HydrophobicContact SD-CD2 4.34Å; M981-F1018 HydrophobicContact SD-CE2 4.15Å; L1012-F1018 HydrophobicContact CD1-CD2 4.02Å; L1012-F1018 HydrophobicContact CD2-CD2 4.46Å; L1012-F1018 HydrophobicContact CD2-CE2 4.28Å; L1012-F1018 HydrophobicContact CG-CD2 4.03Å; L1012-F1018 HydrophobicContact CG-CE2 4.3Å; L1012-F1018 HydrophobicContact CG-CG 4.47Å; L1012-F1018 WeakPolarHBondContact O-CB 3.3Å; Y1013-F1018 AromaticContact CD1-CD1 3.83Å; Y1013-F1018 HydrophobicContact CD1-CD1 3.83Å; Y1013-F1018 AromaticContact CD1-CE1 3.36Å; Y1013-F1018 HydrophobicContact CD1-CE1 3.36Å; Y1013-F1018 HydrophobicContact CD1-CE2 4.27Å; Y1013-F1018 HydrophobicContact CD1-CG 4.45Å; Y1013-F1018 AromaticContact CD1-CZ 3.62Å; Y1013-F1018 HydrophobicContact CD1-CZ 3.62Å; Y1013-F1018 AromaticContact CE1-CE1 3.94Å; Y1013-F1018 HydrophobicContact CE1-CE1 3.94Å; Y1013-F1018 HydrophobicContact CE1-CE2 4.41Å; Y1013-F1018 AromaticContact CE1-CZ 3.75Å; Y1013-F1018 HydrophobicContact CE1-CZ 3.75Å; Y1013-F1018 HydrophobicContact CG-CD1 4.45Å; Y1013-F1018 HydrophobicContact CG-CE1 4.15Å; K1015-F1018 PolarHBondContact O-N 2.93Å; K1016-F1018 VanDerWaalsContact C-N 3.29Å; K1016-F1018 PolarHBondContact O-N 2.57Å; F1018-T1020 PolarHBondContact O-N 2.9Å; F1018-M1022 HydrophobicContact CD2-CB 4.15Å; F1018-M1022 HydrophobicContact CD2-SD 4.02Å; F1018-M1022 HydrophobicContact CE2-CB 4.3Å; F1018-M1022 HydrophobicContact CG-CB 4.35Å; F1018-M1022 CarbonylContact O-C 3.52Å; F1018-M1022 PolarHBondContact O-N 3.4Å; F1018-L1023 HydrophobicContact CD1-CB 4.29Å; F1018-L1023 HydrophobicContact CD1-CD1 4.03Å; F1018-L1023 HydrophobicContact CE1-CB 4.39Å; F1018-L1023 HydrophobicContact CE1-CD1 3.77Å; F1018-L1023 WeakPolarHBondContact O-CB 3.5Å; F1018-L1023 PolarHBondContact O-N 3.39Å; F1018-F1026 HydrophobicContact CE2-CD2 4.26Å; F1018-F1026 HydrophobicContact CE2-CE2 4.15Å; F1018-F1026 AromaticContact CZ-CD2 3.97Å; F1018-F1026 HydrophobicContact CZ-CD2 3.97Å; F1018-F1026 HydrophobicContact CZ-CE2 4.31Å; F1018-F1026 HydrophobicContact CZ-CG 4.13Å
1019R90Very high91.8Very high128 Ų12855.7 Ų55.748%0.48326%0.263SS..Iπ-helixtrans-58.5-44.4-177.9-164.3-176.382.8-173.96.4113.3K1015 K1016 L1023 V1056K1015-R1019 PolarHBondContact O-N 2.9Å; K1016-R1019 PolarHBondContact O-N 3.42Å; R1019-L1023 HydrophobicContact CG-CD2 4.29Å; R1019-V1056 HydrophobicContact CG-CG1 4.3Å
1020T87Confident92Very high88 Ų8848.9 Ų48.954%0.5423%0.233SC..Iπ-helixtrans-86.2-27.7-17356.40000113.9K1016 F1018K1016-T1020 HydrophobicContact CG-CG2 4.17Å; K1016-T1020 PolarHBondContact O-N 3.42Å; K1016-T1020 PolarHBondContact O-OG1 2.99Å; F1018-T1020 PolarHBondContact O-N 2.9Å
1021T88.3Confident92.2Very high77 Ų7746.2 Ų46.247%0.47222%0.221SC..Iπ-helixtrans-121.9-24.7-16530000113.8I1017I1017-T1021 WeakPolarHBondContact CD1-OG1 3.27Å; I1017-T1021 WeakPolarHBondContact O-CB 3.18Å; I1017-T1021 PolarHBondContact O-N 3.12Å; I1017-T1021 PolarHBondContact O-OG1 3.17Å
1022M92.3Very high92.2Very high12 Ų1242.6 Ų42.66%0.05921%0.206CC..Iπ-helixtrans-120.7-33.7-171.4-60.9172.8-176.900113.2F977 M981 I1017 F1018 F1024 Q1025 F1026F977-M1022 HydrophobicContact CD1-CE 4.42Å; F977-M1022 HydrophobicContact CE1-CE 4.4Å; F977-M1022 HydrophobicContact CE1-SD 4.46Å; M981-M1022 HydrophobicContact CB-CE 3.81Å; M981-M1022 HydrophobicContact CB-SD 3.5Å; M981-M1022 VanDerWaalsContact CB-SD 3.5Å; M981-M1022 HydrophobicContact CG-CE 4.22Å; M981-M1022 HydrophobicContact CG-SD 3.78Å; I1017-M1022 HydrophobicContact CG1-CE 4.22Å; F1018-M1022 HydrophobicContact CD2-CB 4.15Å; F1018-M1022 HydrophobicContact CD2-SD 4.02Å; F1018-M1022 HydrophobicContact CE2-CB 4.3Å; F1018-M1022 HydrophobicContact CG-CB 4.35Å; F1018-M1022 CarbonylContact O-C 3.52Å; F1018-M1022 PolarHBondContact O-N 3.4Å; M1022-F1024 VanDerWaalsContact C-N 3.31Å; M1022-F1024 PolarHBondContact O-N 3.14Å; M1022-Q1025 PolarHBondContact O-N 3.18Å; M1022-F1026 HydrophobicContact CB-CD2 4.06Å; M1022-F1026 HydrophobicContact CB-CE2 4.1Å; M1022-F1026 WeakPolarHBondContact O-CD2 3.39Å; M1022-F1026 PolarHBondContact O-N 3.08Å; M1022-F1026 VanDerWaalsContact O-N 3.08Å
1023L92.5Very high92.1Very high23 Ų2343 Ų4312%0.1221%0.208CC..Hα-helixtrans-51.2-48.3-172.4-172.170.6000112.3F1018 R1019 Q1025 F1026 V1027 M1053F1018-L1023 HydrophobicContact CD1-CB 4.29Å; F1018-L1023 HydrophobicContact CD1-CD1 4.03Å; F1018-L1023 HydrophobicContact CE1-CB 4.39Å; F1018-L1023 HydrophobicContact CE1-CD1 3.77Å; F1018-L1023 WeakPolarHBondContact O-CB 3.5Å; F1018-L1023 PolarHBondContact O-N 3.39Å; R1019-L1023 HydrophobicContact CG-CD2 4.29Å; L1023-Q1025 VanDerWaalsContact C-N 3.34Å; L1023-Q1025 PolarHBondContact O-N 2.95Å; L1023-F1026 PolarHBondContact O-N 3.49Å; L1023-V1027 HydrophobicContact CD1-CG2 4.48Å; L1023-V1027 VanDerWaalsContact O-CG2 3.27Å; L1023-V1027 WeakPolarHBondContact O-CG2 3Å; L1023-V1027 PolarHBondContact O-N 3.44Å; L1023-M1053 HydrophobicContact CD1-CB 3.72Å; L1023-M1053 HydrophobicContact CD1-CG 4.09Å
1024F92.3Very high92Very high73 Ų7343.2 Ų43.232%0.3221%0.209SC..Hα-helixtrans-55.9-47.3177.5-176.1-80.8000112.1M1022 N1028 F1065 E1068M1022-F1024 VanDerWaalsContact C-N 3.31Å; M1022-F1024 PolarHBondContact O-N 3.14Å; F1024-N1028 HydrophobicContact CE1-CB 4.47Å; F1024-N1028 WeakPolarHBondContact O-CB 3.44Å; F1024-N1028 PolarHBondContact O-N 3.49Å; F1024-F1065 AromaticContact CD2-CD2 3.41Å; F1024-F1065 HydrophobicContact CD2-CD2 3.41Å; F1024-F1065 VanDerWaalsContact CD2-CD2 3.41Å; F1024-F1065 AromaticContact CD2-CE2 3.99Å; F1024-F1065 HydrophobicContact CD2-CE2 3.99Å; F1024-F1065 HydrophobicContact CD2-CG 4.44Å; F1024-F1065 AromaticContact CE2-CD2 3.57Å; F1024-F1065 HydrophobicContact CE2-CD2 3.57Å; F1024-F1065 HydrophobicContact CE2-CE2 4.02Å; F1024-F1065 HydrophobicContact CE2-CG 4.44Å; F1024-F1065 HydrophobicContact CG-CD2 4.05Å; F1024-F1065 HydrophobicContact CG-CE2 4.27Å; F1024-F1065 HydrophobicContact CZ-CD2 4.35Å; F1024-F1065 HydrophobicContact CZ-CE2 4.36Å; F1024-E1068 HydrophobicContact CE2-CB 4.17Å; F1024-E1068 VanDerWaalsContact CE2-CD 3.4Å; F1024-E1068 HydrophobicContact CE2-CG 4Å; F1024-E1068 VanDerWaalsContact CE2-OE2 3.27Å; F1024-E1068 WeakPolarHBondContact CE2-OE2 3.36Å; F1024-E1068 HydrophobicContact CZ-CB 4.41Å; F1024-E1068 VanDerWaalsContact CZ-CD 3.47Å; F1024-E1068 HydrophobicContact CZ-CG 3.88Å; F1024-E1068 WeakPolarHBondContact CZ-OE1 3.41Å
1025Q92.8Very high92Very high116 Ų11639.2 Ų39.254%0.54219%0.191SC..Hα-helixtrans-67-43.2-176-64176.5-5.800111.6M1022 L1023 N1028 V1029M1022-Q1025 PolarHBondContact O-N 3.18Å; L1023-Q1025 VanDerWaalsContact C-N 3.34Å; L1023-Q1025 PolarHBondContact O-N 2.95Å; Q1025-N1028 PolarHBondContact O-N 3.03Å; Q1025-V1029 WeakPolarHBondContact O-CG2 3.5Å; Q1025-V1029 PolarHBondContact O-N 2.68Å
1026F95.6Very high92Very high7 Ų743.3 Ų43.33%0.03121%0.211CC..Hα-helixtrans-65.6-47.1178.4-84.6-94.1000112M981 F984 F988 L1003 F1018 M1022 L1023 N1028 V1029 L1030 M1053M981-F1026 WeakPolarHBondContact O-CZ 3.29Å; F984-F1026 HydrophobicContact CB-CE1 4.47Å; F984-F1026 HydrophobicContact CB-CZ 4.4Å; F988-F1026 HydrophobicContact CD2-CD1 4.19Å; F988-F1026 HydrophobicContact CD2-CE1 4.16Å; F988-F1026 AromaticContact CE2-CD1 3.89Å; F988-F1026 HydrophobicContact CE2-CD1 3.89Å; F988-F1026 AromaticContact CE2-CE1 3.76Å; F988-F1026 HydrophobicContact CE2-CE1 3.76Å; L1003-F1026 HydrophobicContact CD1-CD1 4.01Å; L1003-F1026 HydrophobicContact CD1-CE1 3.64Å; F1018-F1026 HydrophobicContact CE2-CD2 4.26Å; F1018-F1026 HydrophobicContact CE2-CE2 4.15Å; F1018-F1026 AromaticContact CZ-CD2 3.97Å; F1018-F1026 HydrophobicContact CZ-CD2 3.97Å; F1018-F1026 HydrophobicContact CZ-CE2 4.31Å; F1018-F1026 HydrophobicContact CZ-CG 4.13Å; M1022-F1026 HydrophobicContact CB-CD2 4.06Å; M1022-F1026 HydrophobicContact CB-CE2 4.1Å; M1022-F1026 WeakPolarHBondContact O-CD2 3.39Å; M1022-F1026 PolarHBondContact O-N 3.08Å; M1022-F1026 VanDerWaalsContact O-N 3.08Å; L1023-F1026 PolarHBondContact O-N 3.49Å; F1026-N1028 VanDerWaalsContact C-N 3.29Å; F1026-N1028 PolarHBondContact O-N 3.47Å; F1026-V1029 PolarHBondContact O-N 3.28Å; F1026-L1030 WeakPolarHBondContact O-CB 3.37Å; F1026-L1030 WeakPolarHBondContact O-CG 3.31Å; F1026-L1030 PolarHBondContact O-N 2.99Å; F1026-M1053 HydrophobicContact CB-CE 4.04Å; F1026-M1053 HydrophobicContact CB-SD 3.79Å; F1026-M1053 HydrophobicContact CD1-CE 4.33Å; F1026-M1053 HydrophobicContact CG-CE 4.49Å
1027V95.2Very high91.9Very high3 Ų341.7 Ų41.72%0.01820%0.204CC..Hα-helixtrans-61.6-41.3177.1178.90000110.5L1023 L1031 I1050 M1053 F1061 F1065L1023-V1027 HydrophobicContact CD1-CG2 4.48Å; L1023-V1027 VanDerWaalsContact O-CG2 3.27Å; L1023-V1027 WeakPolarHBondContact O-CG2 3Å; L1023-V1027 PolarHBondContact O-N 3.44Å; V1027-L1031 HydrophobicContact CG1-CD1 4.08Å; V1027-L1031 WeakPolarHBondContact O-CB 3.29Å; V1027-L1031 WeakPolarHBondContact O-CG 3.43Å; V1027-L1031 PolarHBondContact O-N 3.04Å; V1027-I1050 HydrophobicContact CG1-CG2 4.28Å; V1027-M1053 HydrophobicContact CG2-CB 3.63Å; V1027-M1053 HydrophobicContact CG2-CG 4.35Å; V1027-M1053 HydrophobicContact CG2-SD 3.81Å; V1027-F1061 HydrophobicContact CG1-CD2 4.47Å; V1027-F1061 HydrophobicContact CG1-CE2 3.92Å; V1027-F1065 HydrophobicContact CB-CE2 3.88Å; V1027-F1065 HydrophobicContact CB-CZ 3.91Å; V1027-F1065 HydrophobicContact CG1-CD1 4.2Å; V1027-F1065 HydrophobicContact CG1-CD2 4.4Å; V1027-F1065 HydrophobicContact CG1-CE1 3.55Å; V1027-F1065 HydrophobicContact CG1-CE2 3.78Å; V1027-F1065 HydrophobicContact CG1-CZ 3.33Å
1028N94.2Very high91.7Very high40 Ų4044.2 Ų44.221%0.21422%0.223CC..Hα-helixtrans-61.7-49.3175.7-17853.1000112F1024 Q1025 F1026 L1030 L1031 Q1032 F1065 F1069F1024-N1028 HydrophobicContact CE1-CB 4.47Å; F1024-N1028 WeakPolarHBondContact O-CB 3.44Å; F1024-N1028 PolarHBondContact O-N 3.49Å; Q1025-N1028 PolarHBondContact O-N 3.03Å; F1026-N1028 VanDerWaalsContact C-N 3.29Å; F1026-N1028 PolarHBondContact O-N 3.47Å; N1028-L1030 PolarHBondContact O-N 3.24Å; N1028-L1031 PolarHBondContact O-N 2.95Å; N1028-Q1032 WeakPolarHBondContact O-CB 3.42Å; N1028-Q1032 VanDerWaalsContact O-CG 3.24Å; N1028-Q1032 WeakPolarHBondContact O-CG 3.42Å; N1028-Q1032 PolarHBondContact O-N 2.91Å; N1028-F1065 HydrophobicContact CB-CE2 4.22Å; N1028-F1065 HydrophobicContact CB-CZ 4.41Å; N1028-F1069 WeakPolarHBondContact OD1-CD2 3.31Å
1029V94.6Very high91.7Very high25 Ų2544.7 Ų44.715%0.15223%0.225CC..Hα-helixtrans-59.4-46.3179168.80000111.1F988 L989 Q1025 F1026 L1031 Q1032 V1033F988-V1029 HydrophobicContact CB-CG1 3.73Å; L989-V1029 HydrophobicContact CD2-CG1 3.77Å; L989-V1029 HydrophobicContact CD2-CG2 4.16Å; L989-V1029 HydrophobicContact CG-CG1 4.41Å; Q1025-V1029 WeakPolarHBondContact O-CG2 3.5Å; Q1025-V1029 PolarHBondContact O-N 2.68Å; F1026-V1029 PolarHBondContact O-N 3.28Å; V1029-L1031 PolarHBondContact O-N 3.37Å; V1029-Q1032 PolarHBondContact O-N 3.5Å; V1029-V1033 HydrophobicContact CG1-CG2 4.46Å; V1029-V1033 VanDerWaalsContact O-CG2 3.3Å; V1029-V1033 WeakPolarHBondContact O-CG2 3.18Å; V1029-V1033 PolarHBondContact O-N 3.24Å
1030L95.6Very high91.5Very high0 Ų041.7 Ų41.70%022%0.219CC..Hα-helixtrans-63.9-41.4179.1-69-179.7000112.4F988 F996 L1000 F1026 N1028 V1033 L1034 I1046 A1049 I1050 M1053F988-L1030 HydrophobicContact CD2-CD2 4.47Å; F988-L1030 HydrophobicContact CG-CD2 4.48Å; F996-L1030 HydrophobicContact CE1-CD2 4.46Å; F996-L1030 HydrophobicContact CZ-CD2 3.83Å; L1000-L1030 HydrophobicContact CD1-CD1 4.32Å; L1000-L1030 HydrophobicContact CD1-CD2 4.27Å; F1026-L1030 WeakPolarHBondContact O-CB 3.37Å; F1026-L1030 WeakPolarHBondContact O-CG 3.31Å; F1026-L1030 PolarHBondContact O-N 2.99Å; N1028-L1030 PolarHBondContact O-N 3.24Å; L1030-V1033 PolarHBondContact O-N 3.44Å; L1030-L1034 WeakPolarHBondContact O-CG 3.28Å; L1030-L1034 PolarHBondContact O-N 3.36Å; L1030-I1046 HydrophobicContact CB-CG2 3.88Å; L1030-I1046 HydrophobicContact CD2-CG2 4.14Å; L1030-I1046 HydrophobicContact CG-CG2 4.45Å; L1030-A1049 HydrophobicContact CD1-CB 4.07Å; L1030-I1050 HydrophobicContact CB-CD1 3.98Å; L1030-I1050 HydrophobicContact CB-CG1 3.76Å; L1030-I1050 HydrophobicContact CD1-CG1 4.18Å; L1030-M1053 HydrophobicContact CD1-CE 4.04Å; L1030-M1053 HydrophobicContact CD1-SD 4.26Å
1031L94.2Very high91.8Very high2 Ų244.6 Ų44.61%0.0123%0.23CC..Hα-helixtrans-65.5-39.9173.1-80.4172.5000112V1027 N1028 V1029 V1033 L1034 V1035 I1050 F1065 F1069 V1101V1027-L1031 HydrophobicContact CG1-CD1 4.08Å; V1027-L1031 WeakPolarHBondContact O-CB 3.29Å; V1027-L1031 WeakPolarHBondContact O-CG 3.43Å; V1027-L1031 PolarHBondContact O-N 3.04Å; N1028-L1031 PolarHBondContact O-N 2.95Å; V1029-L1031 PolarHBondContact O-N 3.37Å; L1031-V1033 VanDerWaalsContact C-N 3.35Å; L1031-V1033 PolarHBondContact O-N 3.13Å; L1031-L1034 CarbonylContact O-C 3.56Å; L1031-L1034 WeakPolarHBondContact O-CB 3.14Å; L1031-L1034 PolarHBondContact O-N 2.89Å; L1031-V1035 VanDerWaalsContact O-CG2 3.25Å; L1031-V1035 WeakPolarHBondContact O-CG2 3.23Å; L1031-V1035 PolarHBondContact O-N 3.06Å; L1031-I1050 HydrophobicContact CD2-CD1 3.81Å; L1031-I1050 HydrophobicContact CG-CD1 3.92Å; L1031-F1065 HydrophobicContact CD1-CE1 3.49Å; L1031-F1065 VanDerWaalsContact CD1-CE1 3.49Å; L1031-F1065 HydrophobicContact CD1-CZ 3.74Å; L1031-F1069 HydrophobicContact CB-CE2 3.83Å; L1031-F1069 HydrophobicContact CB-CZ 3.89Å; L1031-F1069 HydrophobicContact CD1-CD2 4.38Å; L1031-F1069 HydrophobicContact CD1-CE1 4.49Å; L1031-F1069 HydrophobicContact CD1-CE2 4.26Å; L1031-F1069 HydrophobicContact CD1-CZ 4.32Å; L1031-V1101 HydrophobicContact CD2-CG1 3.7Å
1032Q92.3Very high91.9Very high40 Ų4041.2 Ų41.219%0.18721%0.209CC..Hα-helixtrans-64.9-38.8176-69.2-62.9-14.700111.6N1028 V1029 L1034 V1035 H1036 F1069N1028-Q1032 WeakPolarHBondContact O-CB 3.42Å; N1028-Q1032 VanDerWaalsContact O-CG 3.24Å; N1028-Q1032 WeakPolarHBondContact O-CG 3.42Å; N1028-Q1032 PolarHBondContact O-N 2.91Å; V1029-Q1032 PolarHBondContact O-N 3.5Å; Q1032-L1034 VanDerWaalsContact C-N 3.33Å; Q1032-L1034 PolarHBondContact O-N 3.48Å; Q1032-V1035 CarbonylContact O-C 3.55Å; Q1032-V1035 PolarHBondContact O-N 3.02Å; Q1032-V1035 VanDerWaalsContact O-N 3.11Å; Q1032-H1036 PolarHBondContact O-N 3.32Å; Q1032-H1036 PolarHBondContact O-ND1 3.32Å; Q1032-H1036 PolarHBondContact OE1-CE1 2.92Å; Q1032-F1069 HydrophobicContact CG-CE2 4.45Å
1033V93.1Very high92Very high8 Ų843.4 Ų43.45%0.04822%0.219CC..Hα-helixtrans-58.3-47.8171.7167.50000110F996 V1029 L1030 L1031 V1035 H1036 K1037 H1039 I1046F996-V1033 HydrophobicContact CE2-CG1 4.23Å; F996-V1033 HydrophobicContact CE2-CG2 4.09Å; F996-V1033 HydrophobicContact CZ-CG1 4.15Å; F996-V1033 HydrophobicContact CZ-CG2 4.46Å; V1029-V1033 HydrophobicContact CG1-CG2 4.46Å; V1029-V1033 VanDerWaalsContact O-CG2 3.3Å; V1029-V1033 WeakPolarHBondContact O-CG2 3.18Å; V1029-V1033 PolarHBondContact O-N 3.24Å; L1030-V1033 PolarHBondContact O-N 3.44Å; L1031-V1033 VanDerWaalsContact C-N 3.35Å; L1031-V1033 PolarHBondContact O-N 3.13Å; V1033-V1035 VanDerWaalsContact C-N 3.26Å; V1033-V1035 PolarHBondContact O-N 3.28Å; V1033-H1036 PolarHBondContact O-N 3.2Å; V1033-K1037 PolarHBondContact O-N 3.31Å; V1033-K1037 VanDerWaalsContact O-N 3.1Å; V1033-H1039 HydrophobicContact CG1-CB 3.98Å; V1033-I1046 HydrophobicContact CG1-CD1 3.75Å
1034L92.3Very high92Very high5 Ų549.4 Ų49.43%0.02625%0.247CC..Hα-helixtrans-61.9-30.6175-72.1-174.9000113L1030 L1031 Q1032 Q1043 I1046 I1050 V1101 V1105 R1109L1030-L1034 WeakPolarHBondContact O-CG 3.28Å; L1030-L1034 PolarHBondContact O-N 3.36Å; L1031-L1034 CarbonylContact O-C 3.56Å; L1031-L1034 WeakPolarHBondContact O-CB 3.14Å; L1031-L1034 PolarHBondContact O-N 2.89Å; Q1032-L1034 VanDerWaalsContact C-N 3.33Å; Q1032-L1034 PolarHBondContact O-N 3.48Å; L1034-Q1043 HydrophobicContact CD2-CB 4.38Å; L1034-Q1043 HydrophobicContact CD2-CG 3.54Å; L1034-I1046 HydrophobicContact CD1-CG2 3.93Å; L1034-I1046 HydrophobicContact CD2-CB 4.03Å; L1034-I1046 HydrophobicContact CD2-CD1 4.22Å; L1034-I1046 HydrophobicContact CD2-CG2 3.85Å; L1034-I1046 HydrophobicContact CG-CB 4.36Å; L1034-I1046 HydrophobicContact CG-CG2 3.62Å; L1034-I1050 HydrophobicContact CD1-CD1 3.57Å; L1034-I1050 HydrophobicContact CG-CD1 4.42Å; L1034-V1101 HydrophobicContact CD1-CG1 3.78Å; L1034-V1105 HydrophobicContact CB-CG1 4.46Å; L1034-V1105 HydrophobicContact CB-CG2 3.95Å; L1034-V1105 WeakPolarHBondContact O-CG1 3.45Å; L1034-R1109 VanDerWaalsContact O-CZ 3.3Å; L1034-R1109 PolarHBondContact O-NH2 3.28Å
1035V90.4Very high92.1Very high7 Ų749.3 Ų49.34%0.04225%0.247CC..Hα-helixtrans-80.9-31178171.60000112.7L1031 Q1032 V1033 F1069 V1105 L1108 R1109L1031-V1035 VanDerWaalsContact O-CG2 3.25Å; L1031-V1035 WeakPolarHBondContact O-CG2 3.23Å; L1031-V1035 PolarHBondContact O-N 3.06Å; Q1032-V1035 CarbonylContact O-C 3.55Å; Q1032-V1035 PolarHBondContact O-N 3.02Å; Q1032-V1035 VanDerWaalsContact O-N 3.11Å; V1033-V1035 VanDerWaalsContact C-N 3.26Å; V1033-V1035 PolarHBondContact O-N 3.28Å; V1035-F1069 HydrophobicContact CG2-CZ 4.49Å; V1035-V1105 HydrophobicContact CG2-CG1 4.34Å; V1035-V1105 HydrophobicContact CG2-CG2 4.04Å; V1035-L1108 HydrophobicContact CG1-CD2 4.06Å; V1035-L1108 HydrophobicContact CG2-CD2 3.83Å; V1035-R1109 VanDerWaalsContact O-CZ 3.25Å; V1035-R1109 PolarHBondContact O-NE 3.37Å; V1035-R1109 PolarHBondContact O-NH2 3.36Å
1036H89.3Confident92.3Very high121 Ų12143.8 Ų43.856%0.5622%0.222SC*.Hα-helixtrans-92.2-7.6-179.8-66.991.5000114.9Q1032 V1033 S1038Q1032-H1036 PolarHBondContact O-N 3.32Å; Q1032-H1036 PolarHBondContact O-ND1 3.32Å; Q1032-H1036 PolarHBondContact OE1-CE1 2.92Å; V1033-H1036 PolarHBondContact O-N 3.2Å; H1036-S1038 PolarHBondContact O-N 3.22Å
1037K87.4Confident92.3Very high81 Ų8143.5 Ų43.535%0.35222%0.22SC..THydrogen-bonded Turntrans61.123.7-174.4-68.3-153.1166.4-136.60114.2E162 V1033 H1039 D1040E162-K1037 WeakPolarHBondContact OE1-CE 3.49Å; E162-K1037 IonicContact OE1-NZ 2.7Å; E162-K1037 PolarHBondContact OE1-NZ 2.85Å; E162-K1037 WeakPolarHBondContact OE2-CE 3.26Å; E162-K1037 IonicContact OE2-NZ 2.86Å; V1033-K1037 PolarHBondContact O-N 3.31Å; V1033-K1037 VanDerWaalsContact O-N 3.1Å; K1037-H1039 PolarHBondContact O-N 2.98Å; K1037-D1040 IonicContact NZ-OD1 2.79Å; K1037-D1040 IonicContact NZ-OD2 2.74Å; K1037-D1040 PolarHBondContact NZ-OD2 3.45Å
1038S85.9Confident92.3Very high72 Ų7246.6 Ų46.650%0.50324%0.236SC..THydrogen-bonded Turntrans-64.7-29.4-178.654.30000113H1036H1036-S1038 PolarHBondContact O-N 3.22Å
1039H89.9Confident92.4Very high10 Ų1044.7 Ų44.75%0.04623%0.226CC..THydrogen-bonded Turntrans-135.352.8-178.7-6186.6000112.2Q990 F996 V1033 K1037 L1041 L1042 I1046Q990-H1039 PolarHBondContact O-CE1 3.43Å; Q990-H1039 PolarHBondContact O-NE2 3.38Å; F996-H1039 AromaticContact CD2-CE1 3.69Å; F996-H1039 AromaticContact CD2-ND1 3.83Å; F996-H1039 AromaticContact CD2-NE2 3.81Å; F996-H1039 AromaticContact CE2-ND1 3.93Å; V1033-H1039 HydrophobicContact CG1-CB 3.98Å; K1037-H1039 PolarHBondContact O-N 2.98Å; H1039-L1041 PolarHBondContact O-N 2.93Å; H1039-L1041 VanDerWaalsContact O-N 3.12Å; H1039-L1042 PolarHBondContact O-N 3.34Å; H1039-I1046 HydrophobicContact CB-CD1 4.39Å
1040D87.4Confident92.6Very high65 Ų6543.5 Ų43.535%0.34822%0.219SC..G310 helixtrans-59.1-26.1-174.1-14437.2000113.3K1037 L1042 Q1043K1037-D1040 IonicContact NZ-OD1 2.79Å; K1037-D1040 IonicContact NZ-OD2 2.74Å; K1037-D1040 PolarHBondContact NZ-OD2 3.45Å; D1040-L1042 PolarHBondContact O-N 3.25Å; D1040-Q1043 WeakPolarHBondContact O-CB 3.43Å; D1040-Q1043 PolarHBondContact O-N 3.41Å
1041L91.4Very high92.6Very high150 Ų15045.6 Ų45.679%0.78523%0.227SC*.G310 helixtrans-67.4-16.1175.5-68.5175.8000114.1I993 H1039I993-L1041 HydrophobicContact CD1-CB 3.71Å; I993-L1041 HydrophobicContact CD1-CD1 3.74Å; I993-L1041 HydrophobicContact CD1-CG 4.3Å; H1039-L1041 PolarHBondContact O-N 2.93Å; H1039-L1041 VanDerWaalsContact O-N 3.12Å
1042L92.3Very high92.7Very high6 Ų647.2 Ų47.23%0.03124%0.236CC..G310 helixtrans-110.420180-58.1179.1000112.3I993 F996 K997 H1039 D1040 E1044 E1045 I1046I993-L1042 HydrophobicContact CD1-CD1 4.48Å; I993-L1042 HydrophobicContact CD1-CG 4.2Å; I993-L1042 HydrophobicContact CG1-CD1 3.77Å; I993-L1042 HydrophobicContact CG1-CG 4.03Å; F996-L1042 HydrophobicContact CB-CD1 4.33Å; F996-L1042 HydrophobicContact CD1-CD1 3.5Å; F996-L1042 HydrophobicContact CE1-CD1 4.19Å; F996-L1042 HydrophobicContact CG-CD1 4.2Å; K997-L1042 HydrophobicContact CB-CD1 3.93Å; K997-L1042 HydrophobicContact CB-CD2 4.19Å; K997-L1042 HydrophobicContact CD-CD2 3.93Å; K997-L1042 HydrophobicContact CG-CD2 4.09Å; H1039-L1042 PolarHBondContact O-N 3.34Å; D1040-L1042 PolarHBondContact O-N 3.25Å; L1042-E1044 VanDerWaalsContact C-N 3.26Å; L1042-E1044 PolarHBondContact O-N 3.09Å; L1042-E1045 WeakPolarHBondContact CA-OE2 3.37Å; L1042-E1045 PolarHBondContact O-N 3.16Å; L1042-I1046 HydrophobicContact CB-CD1 4.04Å; L1042-I1046 HydrophobicContact CB-CG1 4.29Å; L1042-I1046 WeakPolarHBondContact O-CB 3.46Å; L1042-I1046 WeakPolarHBondContact O-CD1 3.48Å; L1042-I1046 WeakPolarHBondContact O-CG1 3.28Å; L1042-I1046 PolarHBondContact O-N 2.96Å
1043Q92.6Very high92.9Very high58 Ų5845.3 Ų45.327%0.27123%0.227SC..Hα-helixtrans-57.7-39.2-172-148-165.3-300112.6L1034 D1040 G1047 H1102L1034-Q1043 HydrophobicContact CD2-CB 4.38Å; L1034-Q1043 HydrophobicContact CD2-CG 3.54Å; D1040-Q1043 WeakPolarHBondContact O-CB 3.43Å; D1040-Q1043 PolarHBondContact O-N 3.41Å; Q1043-G1047 PolarHBondContact O-N 3.19Å; Q1043-H1102 PolarHBondContact NE2-ND1 3.01Å
1044E93Very high93Very high148 Ų14845.1 Ų45.169%0.69223%0.226SC*.Hα-helixtrans-70.3-48.7179.9-67-171.1174.700111.4L1042 I1046 G1047 I1048L1042-E1044 VanDerWaalsContact C-N 3.26Å; L1042-E1044 PolarHBondContact O-N 3.09Å; E1044-I1046 VanDerWaalsContact C-N 3.31Å; E1044-I1046 PolarHBondContact O-N 3.47Å; E1044-G1047 PolarHBondContact O-N 3.34Å; E1044-G1047 VanDerWaalsContact O-N 3.17Å; E1044-I1048 WeakPolarHBondContact O-CG1 3.27Å; E1044-I1048 PolarHBondContact O-N 2.93Å
1045E95.1Very high93.1Very high72 Ų7247 Ų4734%0.33624%0.239SC..Hα-helixtrans-61.7-40.4178.4-64.893.3149.600111.7L1000 L1042 I1048 A1049L1000-E1045 HydrophobicContact CD2-CB 3.99Å; L1042-E1045 WeakPolarHBondContact CA-OE2 3.37Å; L1042-E1045 PolarHBondContact O-N 3.16Å; E1045-I1048 PolarHBondContact O-N 3.36Å; E1045-A1049 PolarHBondContact O-N 3.33Å
1046I96.5Very high93.2Very high0 Ų047.9 Ų47.90%025%0.245CC..Hα-helixtrans-64.6-43.5175.3-65.1164.6000110.6F996 L1000 L1030 V1033 L1034 H1039 L1042 E1044 I1048 A1049 I1050F996-I1046 HydrophobicContact CE1-CD1 3.8Å; F996-I1046 HydrophobicContact CE1-CG1 3.71Å; F996-I1046 HydrophobicContact CZ-CD1 3.86Å; F996-I1046 HydrophobicContact CZ-CG1 4.02Å; L1000-I1046 HydrophobicContact CD2-CG1 4.17Å; L1030-I1046 HydrophobicContact CB-CG2 3.88Å; L1030-I1046 HydrophobicContact CD2-CG2 4.14Å; L1030-I1046 HydrophobicContact CG-CG2 4.45Å; V1033-I1046 HydrophobicContact CG1-CD1 3.75Å; L1034-I1046 HydrophobicContact CD1-CG2 3.93Å; L1034-I1046 HydrophobicContact CD2-CB 4.03Å; L1034-I1046 HydrophobicContact CD2-CD1 4.22Å; L1034-I1046 HydrophobicContact CD2-CG2 3.85Å; L1034-I1046 HydrophobicContact CG-CB 4.36Å; L1034-I1046 HydrophobicContact CG-CG2 3.62Å; H1039-I1046 HydrophobicContact CB-CD1 4.39Å; L1042-I1046 HydrophobicContact CB-CD1 4.04Å; L1042-I1046 HydrophobicContact CB-CG1 4.29Å; L1042-I1046 WeakPolarHBondContact O-CB 3.46Å; L1042-I1046 WeakPolarHBondContact O-CD1 3.48Å; L1042-I1046 WeakPolarHBondContact O-CG1 3.28Å; L1042-I1046 PolarHBondContact O-N 2.96Å; E1044-I1046 VanDerWaalsContact C-N 3.31Å; E1044-I1046 PolarHBondContact O-N 3.47Å; I1046-I1048 VanDerWaalsContact C-N 3.34Å; I1046-I1048 PolarHBondContact O-N 2.91Å; I1046-A1049 PolarHBondContact O-N 3.49Å; I1046-I1050 HydrophobicContact CG2-CD1 3.83Å; I1046-I1050 HydrophobicContact CG2-CG1 4.39Å; I1046-I1050 VanDerWaalsContact O-CG1 3.31Å; I1046-I1050 WeakPolarHBondContact O-CG1 3.43Å; I1046-I1050 PolarHBondContact O-N 3.02Å
1047G95.5Very high93.2Very high0 Ų045.1 Ų45.10%023%0.234CC..Hα-helixtrans-58.8-43.9176.400000112.6Q1043 E1044 I1050 Y1051Q1043-G1047 PolarHBondContact O-N 3.19Å; E1044-G1047 PolarHBondContact O-N 3.34Å; E1044-G1047 VanDerWaalsContact O-N 3.17Å; G1047-I1050 PolarHBondContact O-N 2.93Å; G1047-Y1051 PolarHBondContact O-N 3.35Å
1048I96.2Very high93.5Very high69 Ų6942.6 Ų42.635%0.35422%0.223SC..Hα-helixtrans-63.5-42.7176.3-66.6165.2000111E1044 E1045 I1046 Y1051 N1052 L1094E1044-I1048 WeakPolarHBondContact O-CG1 3.27Å; E1044-I1048 PolarHBondContact O-N 2.93Å; E1045-I1048 PolarHBondContact O-N 3.36Å; I1046-I1048 VanDerWaalsContact C-N 3.34Å; I1046-I1048 PolarHBondContact O-N 2.91Å; I1048-Y1051 WeakPolarHBondContact O-CB 3.38Å; I1048-Y1051 PolarHBondContact O-N 3.35Å; I1048-N1052 PolarHBondContact O-N 2.74Å; I1048-L1094 HydrophobicContact CG1-CD1 4.18Å
1049A96.6Very high93.7Very high0 Ų044.1 Ų44.10%023%0.226CC..Hα-helixtrans-64.7-42.4178.500000112.5L1000 E1004 L1030 E1045 I1046 Y1051 N1052 M1053L1000-A1049 HydrophobicContact CD1-CB 3.64Å; L1000-A1049 HydrophobicContact CD2-CB 4.4Å; L1000-A1049 HydrophobicContact CG-CB 4.27Å; E1004-A1049 VanDerWaalsContact OE1-CA 3.24Å; E1004-A1049 WeakPolarHBondContact OE1-CA 3.25Å; E1004-A1049 VanDerWaalsContact OE1-CB 3.32Å; E1004-A1049 WeakPolarHBondContact OE1-CB 3.31Å; L1030-A1049 HydrophobicContact CD1-CB 4.07Å; E1045-A1049 PolarHBondContact O-N 3.33Å; I1046-A1049 PolarHBondContact O-N 3.49Å; A1049-Y1051 VanDerWaalsContact C-N 3.31Å; A1049-Y1051 PolarHBondContact O-N 2.76Å; A1049-N1052 PolarHBondContact O-N 3.21Å; A1049-M1053 WeakPolarHBondContact O-CB 3.45Å; A1049-M1053 WeakPolarHBondContact O-CG 3.47Å; A1049-M1053 PolarHBondContact O-N 3.29Å
1050I97Very high93.8Very high0 Ų044.8 Ų44.80%024%0.236CC..Hα-helixtrans-58.8-44.4173.6-67.8164.6000110.3V1027 L1030 L1031 L1034 I1046 G1047 M1053 A1054 F1097 V1101V1027-I1050 HydrophobicContact CG1-CG2 4.28Å; L1030-I1050 HydrophobicContact CB-CD1 3.98Å; L1030-I1050 HydrophobicContact CB-CG1 3.76Å; L1030-I1050 HydrophobicContact CD1-CG1 4.18Å; L1031-I1050 HydrophobicContact CD2-CD1 3.81Å; L1031-I1050 HydrophobicContact CG-CD1 3.92Å; L1034-I1050 HydrophobicContact CD1-CD1 3.57Å; L1034-I1050 HydrophobicContact CG-CD1 4.42Å; I1046-I1050 HydrophobicContact CG2-CD1 3.83Å; I1046-I1050 HydrophobicContact CG2-CG1 4.39Å; I1046-I1050 VanDerWaalsContact O-CG1 3.31Å; I1046-I1050 WeakPolarHBondContact O-CG1 3.43Å; I1046-I1050 PolarHBondContact O-N 3.02Å; G1047-I1050 PolarHBondContact O-N 2.93Å; I1050-M1053 PolarHBondContact O-N 3.47Å; I1050-A1054 VanDerWaalsContact O-CB 3.29Å; I1050-A1054 WeakPolarHBondContact O-CB 3.34Å; I1050-A1054 PolarHBondContact O-N 3.17Å; I1050-F1097 HydrophobicContact CG2-CE1 4Å; I1050-F1097 HydrophobicContact CG2-CZ 4.3Å; I1050-V1101 HydrophobicContact CD1-CG1 4.38Å; I1050-V1101 HydrophobicContact CG2-CG2 4.39Å
1051Y97.3Very high94.1Very high43 Ų4342.3 Ų42.317%0.16922%0.222CC..Hα-helixtrans-60.1-48.7175.1170.3-93.3000112G1047 I1048 A1049 M1053 A1054 S1055 F1058 R1092 L1094 F1097G1047-Y1051 PolarHBondContact O-N 3.35Å; I1048-Y1051 WeakPolarHBondContact O-CB 3.38Å; I1048-Y1051 PolarHBondContact O-N 3.35Å; A1049-Y1051 VanDerWaalsContact C-N 3.31Å; A1049-Y1051 PolarHBondContact O-N 2.76Å; Y1051-M1053 VanDerWaalsContact C-N 3.28Å; Y1051-M1053 PolarHBondContact O-N 3.41Å; Y1051-A1054 PolarHBondContact O-N 3.19Å; Y1051-S1055 VanDerWaalsContact O-CB 3.31Å; Y1051-S1055 WeakPolarHBondContact O-CB 3.35Å; Y1051-S1055 PolarHBondContact O-N 3.49Å; Y1051-F1058 HydrophobicContact CD2-CZ 4.36Å; Y1051-F1058 HydrophobicContact CE2-CE1 4.45Å; Y1051-F1058 AromaticContact CE2-CZ 3.82Å; Y1051-F1058 HydrophobicContact CE2-CZ 3.82Å; Y1051-R1092 WeakPolarHBondContact CE2-O 3.36Å; Y1051-R1092 PolarHBondContact OH-O 3.45Å; Y1051-R1092 VanDerWaalsContact OH-O 3.14Å; Y1051-L1094 HydrophobicContact CD1-CB 4.16Å; Y1051-L1094 HydrophobicContact CD1-CD1 3.42Å; Y1051-L1094 VanDerWaalsContact CD1-CD1 3.42Å; Y1051-L1094 HydrophobicContact CD1-CG 4.32Å; Y1051-L1094 HydrophobicContact CD2-CB 4.35Å; Y1051-L1094 HydrophobicContact CD2-CD1 4.07Å; Y1051-L1094 HydrophobicContact CE1-CB 3.94Å; Y1051-L1094 HydrophobicContact CE1-CD1 4.07Å; Y1051-L1094 HydrophobicContact CE2-CB 4.11Å; Y1051-L1094 HydrophobicContact CG-CB 4.35Å; Y1051-L1094 HydrophobicContact CG-CD1 3.41Å; Y1051-L1094 VanDerWaalsContact CG-CD1 3.41Å; Y1051-L1094 HydrophobicContact CG-CG 4.49Å; Y1051-F1097 HydrophobicContact CD2-CB 3.8Å; Y1051-F1097 AromaticContact CD2-CD1 3.7Å; Y1051-F1097 HydrophobicContact CD2-CD1 3.7Å; Y1051-F1097 HydrophobicContact CD2-CE1 4.41Å; Y1051-F1097 AromaticContact CD2-CG 3.75Å; Y1051-F1097 HydrophobicContact CD2-CG 3.75Å; Y1051-F1097 HydrophobicContact CE2-CB 4.29Å; Y1051-F1097 HydrophobicContact CG-CD1 4.21Å
1052N96.2Very high94.2Very high37 Ų3736 Ų3620%0.19819%0.188CC..Hα-helixtrans-61.8-38.1-178.6-74-21.4000111.6E1004 Y1013 I1048 A1049 S1055E1004-N1052 PolarHBondContact OE2-ND2 3.15Å; Y1013-N1052 HydrophobicContact CD2-CB 4.39Å; Y1013-N1052 HydrophobicContact CE2-CB 4.04Å; I1048-N1052 PolarHBondContact O-N 2.74Å; A1049-N1052 PolarHBondContact O-N 3.21Å; N1052-S1055 PolarHBondContact O-OG 3.1Å
1053M96Very high94.2Very high0 Ų039.6 Ų39.60%022%0.219CC..Hα-helixtrans-68.2-45.2173.3-70.9-176.7-167.700112.4Y1013 L1023 F1026 V1027 L1030 A1049 I1050 Y1051 S1055 V1056Y1013-M1053 HydrophobicContact CD1-CG 4.34Å; Y1013-M1053 HydrophobicContact CD2-CB 4.45Å; Y1013-M1053 HydrophobicContact CD2-CG 3.75Å; Y1013-M1053 HydrophobicContact CE1-CE 3.83Å; Y1013-M1053 HydrophobicContact CE1-CG 4.2Å; Y1013-M1053 HydrophobicContact CE2-CE 4.29Å; Y1013-M1053 HydrophobicContact CE2-CG 3.59Å; Y1013-M1053 HydrophobicContact CG-CG 4.15Å; Y1013-M1053 WeakPolarHBondContact OH-CE 3.45Å; L1023-M1053 HydrophobicContact CD1-CB 3.72Å; L1023-M1053 HydrophobicContact CD1-CG 4.09Å; F1026-M1053 HydrophobicContact CB-CE 4.04Å; F1026-M1053 HydrophobicContact CB-SD 3.79Å; F1026-M1053 HydrophobicContact CD1-CE 4.33Å; F1026-M1053 HydrophobicContact CG-CE 4.49Å; V1027-M1053 HydrophobicContact CG2-CB 3.63Å; V1027-M1053 HydrophobicContact CG2-CG 4.35Å; V1027-M1053 HydrophobicContact CG2-SD 3.81Å; L1030-M1053 HydrophobicContact CD1-CE 4.04Å; L1030-M1053 HydrophobicContact CD1-SD 4.26Å; A1049-M1053 WeakPolarHBondContact O-CB 3.45Å; A1049-M1053 WeakPolarHBondContact O-CG 3.47Å; A1049-M1053 PolarHBondContact O-N 3.29Å; I1050-M1053 PolarHBondContact O-N 3.47Å; Y1051-M1053 VanDerWaalsContact C-N 3.28Å; Y1051-M1053 PolarHBondContact O-N 3.41Å; M1053-S1055 VanDerWaalsContact C-N 3.3Å; M1053-S1055 PolarHBondContact O-N 2.69Å; M1053-V1056 WeakPolarHBondContact O-CB 3.46Å; M1053-V1056 WeakPolarHBondContact O-CG2 3.45Å; M1053-V1056 PolarHBondContact O-N 2.88Å
1054A94.7Very high94.1Very high3 Ų339.4 Ų39.43%0.02523%0.227CC..Hα-helixtrans-64.4-34.1177.300000112.4I1050 Y1051 V1056 D1057 F1058 F1061 F1097I1050-A1054 VanDerWaalsContact O-CB 3.29Å; I1050-A1054 WeakPolarHBondContact O-CB 3.34Å; I1050-A1054 PolarHBondContact O-N 3.17Å; Y1051-A1054 PolarHBondContact O-N 3.19Å; A1054-V1056 PolarHBondContact O-N 2.87Å; A1054-V1056 VanDerWaalsContact O-N 3.12Å; A1054-D1057 CarbonylContact O-C 3.58Å; A1054-D1057 PolarHBondContact O-N 3.25Å; A1054-D1057 VanDerWaalsContact O-N 3.09Å; A1054-F1058 HydrophobicContact CB-CD1 4.34Å; A1054-F1058 HydrophobicContact CB-CE1 4.2Å; A1054-F1058 PolarHBondContact O-N 2.93Å; A1054-F1058 VanDerWaalsContact O-N 3.09Å; A1054-F1061 HydrophobicContact CB-CB 4.25Å; A1054-F1061 HydrophobicContact CB-CD1 4.38Å; A1054-F1061 HydrophobicContact CB-CD2 3.64Å; A1054-F1061 HydrophobicContact CB-CE2 4.05Å; A1054-F1061 HydrophobicContact CB-CG 3.83Å; A1054-F1097 HydrophobicContact CB-CE1 4.46Å; A1054-F1097 HydrophobicContact CB-CE2 4.17Å; A1054-F1097 HydrophobicContact CB-CZ 3.71Å
1055S94.6Very high94.1Very high44 Ų4433 Ų3331%0.30820%0.197SC..THydrogen-bonded Turntrans-63.7-18.5-17876.70000114.4Y1051 N1052 M1053 D1057Y1051-S1055 VanDerWaalsContact O-CB 3.31Å; Y1051-S1055 WeakPolarHBondContact O-CB 3.35Å; Y1051-S1055 PolarHBondContact O-N 3.49Å; N1052-S1055 PolarHBondContact O-OG 3.1Å; M1053-S1055 VanDerWaalsContact C-N 3.3Å; M1053-S1055 PolarHBondContact O-N 2.69Å; S1055-D1057 VanDerWaalsContact C-N 3.32Å
1056V91.9Very high94Very high27 Ų2730.1 Ų30.116%0.16418%0.184CC..THydrogen-bonded Turntrans-66.5-37.2175.1-178.60000111.6Y1013 R1019 M1053 A1054Y1013-V1056 VanDerWaalsContact CB-CG2 3.46Å; Y1013-V1056 WeakPolarHBondContact O-CG1 3.49Å; R1019-V1056 HydrophobicContact CG-CG1 4.3Å; M1053-V1056 WeakPolarHBondContact O-CB 3.46Å; M1053-V1056 WeakPolarHBondContact O-CG2 3.45Å; M1053-V1056 PolarHBondContact O-N 2.88Å; A1054-V1056 PolarHBondContact O-N 2.87Å; A1054-V1056 VanDerWaalsContact O-N 3.12Å
1057D90.3Very high93.8Very high63 Ų6332.9 Ų32.934%0.33720%0.202SC..  trans-153.875.9-178.1-172.93.5000109.7A1054 S1055 D1059 G1060 F1061A1054-D1057 CarbonylContact O-C 3.58Å; A1054-D1057 PolarHBondContact O-N 3.25Å; A1054-D1057 VanDerWaalsContact O-N 3.09Å; S1055-D1057 VanDerWaalsContact C-N 3.32Å; D1057-D1059 PolarHBondContact O-N 2.81Å; D1057-G1060 PolarHBondContact O-N 2.83Å; D1057-G1060 PolarHBondContact OD1-N 3Å; D1057-F1061 PolarHBondContact O-N 3.43Å
1058F93.4Very high93.7Very high27 Ų2738 Ų3812%0.11823%0.225CC..Hα-helixtrans-58.8-37177.9-81.1-57.1000111.8Y1051 A1054 F1061 F1062 R1092 F1097Y1051-F1058 HydrophobicContact CD2-CZ 4.36Å; Y1051-F1058 HydrophobicContact CE2-CE1 4.45Å; Y1051-F1058 AromaticContact CE2-CZ 3.82Å; Y1051-F1058 HydrophobicContact CE2-CZ 3.82Å; A1054-F1058 HydrophobicContact CB-CD1 4.34Å; A1054-F1058 HydrophobicContact CB-CE1 4.2Å; A1054-F1058 PolarHBondContact O-N 2.93Å; A1054-F1058 VanDerWaalsContact O-N 3.09Å; F1058-F1061 PolarHBondContact O-N 3.39Å; F1058-F1062 HydrophobicContact CB-CD2 4.21Å; F1058-F1062 HydrophobicContact CB-CE2 3.96Å; F1058-F1062 AromaticContact CD1-CE2 3.92Å; F1058-F1062 HydrophobicContact CD1-CE2 3.92Å; F1058-F1062 HydrophobicContact CD1-CZ 4.29Å; F1058-F1062 HydrophobicContact CG-CE2 4.26Å; F1058-F1062 WeakPolarHBondContact O-CD2 3.22Å; F1058-F1062 WeakPolarHBondContact O-CG 3.47Å; F1058-F1062 PolarHBondContact O-N 3.5Å; F1058-R1092 HydrophobicContact CD2-CB 4.4Å; F1058-R1092 HydrophobicContact CD2-CG 4.01Å; F1058-R1092 HydrophobicContact CE2-CB 3.96Å; F1058-R1092 HydrophobicContact CE2-CG 4.07Å; F1058-R1092 HydrophobicContact CG-CG 4.27Å; F1058-R1092 HydrophobicContact CZ-CB 4.17Å; F1058-R1092 HydrophobicContact CZ-CG 4.41Å; F1058-F1097 HydrophobicContact CE1-CD2 4.27Å; F1058-F1097 HydrophobicContact CE1-CE2 4.28Å
1059D90.8Very high93.6Very high104 Ų10434.7 Ų34.756%0.55621%0.209SC*.Hα-helixtrans-66.8-43.5-178.2-61.1-29.6000110D1057 A1063 R1092D1057-D1059 PolarHBondContact O-N 2.81Å; D1059-A1063 WeakPolarHBondContact O-CB 3.32Å; D1059-A1063 PolarHBondContact O-N 2.95Å; D1059-R1092 IonicContact OD1-NH2 2.65Å; D1059-R1092 PolarHBondContact OD1-NH2 3.18Å
1060G90.8Very high93.4Very high25 Ų2535.1 Ų35.126%0.25821%0.211SC..Hα-helixtrans-63.4-39.2170.700000113.5D1057 A1064 F1065D1057-G1060 PolarHBondContact O-N 2.83Å; D1057-G1060 PolarHBondContact OD1-N 3Å; G1060-A1064 WeakPolarHBondContact O-CB 3.47Å; G1060-A1064 PolarHBondContact O-N 3.31Å; G1060-F1065 PolarHBondContact O-N 3.03Å
1061F93.8Very high93Very high12 Ų1239.9 Ų39.95%0.05324%0.24CC..Iπ-helixtrans-61-50176.6-179.7-91000111.6V1027 A1054 D1057 F1058 F1065 L1066 F1088 F1097V1027-F1061 HydrophobicContact CG1-CD2 4.47Å; V1027-F1061 HydrophobicContact CG1-CE2 3.92Å; A1054-F1061 HydrophobicContact CB-CB 4.25Å; A1054-F1061 HydrophobicContact CB-CD1 4.38Å; A1054-F1061 HydrophobicContact CB-CD2 3.64Å; A1054-F1061 HydrophobicContact CB-CE2 4.05Å; A1054-F1061 HydrophobicContact CB-CG 3.83Å; D1057-F1061 PolarHBondContact O-N 3.43Å; F1058-F1061 PolarHBondContact O-N 3.39Å; F1061-F1065 HydrophobicContact CD2-CB 4.37Å; F1061-F1065 AromaticContact CD2-CD1 3.67Å; F1061-F1065 HydrophobicContact CD2-CD1 3.67Å; F1061-F1065 HydrophobicContact CD2-CE1 4.38Å; F1061-F1065 HydrophobicContact CD2-CG 4.16Å; F1061-F1065 AromaticContact CE2-CD1 3.48Å; F1061-F1065 HydrophobicContact CE2-CD1 3.48Å; F1061-F1065 VanDerWaalsContact CE2-CD1 3.48Å; F1061-F1065 AromaticContact CE2-CE1 3.78Å; F1061-F1065 HydrophobicContact CE2-CE1 3.78Å; F1061-F1065 HydrophobicContact CE2-CG 4.37Å; F1061-F1065 HydrophobicContact CG-CD1 4.49Å; F1061-F1065 HydrophobicContact CZ-CD1 4.15Å; F1061-F1065 HydrophobicContact CZ-CE1 4.4Å; F1061-F1065 WeakPolarHBondContact O-CB 3.5Å; F1061-F1065 PolarHBondContact O-N 3.39Å; F1061-L1066 WeakPolarHBondContact O-CB 3.38Å; F1061-L1066 PolarHBondContact O-N 3.34Å; F1061-F1088 HydrophobicContact CE1-CE1 4.34Å; F1061-F1088 HydrophobicContact CE1-CZ 4.28Å; F1061-F1097 HydrophobicContact CD1-CE2 4.2Å; F1061-F1097 HydrophobicContact CD1-CZ 4.47Å; F1061-F1097 AromaticContact CE1-CE2 3.74Å; F1061-F1097 HydrophobicContact CE1-CE2 3.74Å; F1061-F1097 AromaticContact CE1-CZ 3.83Å; F1061-F1097 HydrophobicContact CE1-CZ 3.83Å; F1061-F1097 HydrophobicContact CE2-CZ 4.34Å; F1061-F1097 HydrophobicContact CZ-CE2 4.16Å; F1061-F1097 AromaticContact CZ-CZ 3.75Å; F1061-F1097 HydrophobicContact CZ-CZ 3.75Å
1062F93.7Very high92.7Very high17 Ų1740.9 Ų40.98%0.07525%0.253CS..Iπ-helixtrans-76.8-38.7-176.9-65.8-58.1000113.5F1058 P1067 F1088 M1090 F1097F1058-F1062 HydrophobicContact CB-CD2 4.21Å; F1058-F1062 HydrophobicContact CB-CE2 3.96Å; F1058-F1062 AromaticContact CD1-CE2 3.92Å; F1058-F1062 HydrophobicContact CD1-CE2 3.92Å; F1058-F1062 HydrophobicContact CD1-CZ 4.29Å; F1058-F1062 HydrophobicContact CG-CE2 4.26Å; F1058-F1062 WeakPolarHBondContact O-CD2 3.22Å; F1058-F1062 WeakPolarHBondContact O-CG 3.47Å; F1058-F1062 PolarHBondContact O-N 3.5Å; F1062-P1067 VanDerWaalsContact O-CD 3.31Å; F1062-P1067 WeakPolarHBondContact O-CD 3.15Å; F1062-F1088 AromaticContact CE1-CD1 3.99Å; F1062-F1088 HydrophobicContact CE1-CD1 3.99Å; F1062-F1088 AromaticContact CE1-CE1 3.75Å; F1062-F1088 HydrophobicContact CE1-CE1 3.75Å; F1062-M1090 HydrophobicContact CB-CE 3.38Å; F1062-M1090 HydrophobicContact CD1-CE 4.35Å; F1062-M1090 HydrophobicContact CD1-CG 4.18Å; F1062-M1090 HydrophobicContact CD2-CB 4.47Å; F1062-M1090 HydrophobicContact CD2-CE 4.08Å; F1062-M1090 HydrophobicContact CD2-CG 4.44Å; F1062-M1090 HydrophobicContact CE1-CB 4.36Å; F1062-M1090 HydrophobicContact CE1-CG 4.32Å; F1062-M1090 HydrophobicContact CE2-CB 4.21Å; F1062-M1090 HydrophobicContact CG-CE 3.71Å; F1062-M1090 HydrophobicContact CG-CG 4.26Å; F1062-M1090 HydrophobicContact CZ-CB 4.16Å; F1062-F1097 HydrophobicContact CZ-CE2 4.4Å
1063A91.8Very high92.2Very high82 Ų8239.1 Ų39.168%0.67824%0.244SC*.Iπ-helixtrans-86.5-27.2-173.500000113.7D1059D1059-A1063 WeakPolarHBondContact O-CB 3.32Å; D1059-A1063 PolarHBondContact O-N 2.95Å
1064A91Very high91.7Very high54 Ų5445.4 Ų45.445%0.44628%0.278SS..Iπ-helixtrans-119-59.2-176.800000112.4G1060 P1067 E1068G1060-A1064 WeakPolarHBondContact O-CB 3.47Å; G1060-A1064 PolarHBondContact O-N 3.31Å; A1064-P1067 WeakPolarHBondContact O-CD 3.31Å; A1064-E1068 VanDerWaalsContact O-CB 3.32Å; A1064-E1068 WeakPolarHBondContact O-CB 3.4Å; A1064-E1068 PolarHBondContact O-N 3.03Å; A1064-E1068 VanDerWaalsContact O-N 3.11Å
1065F93.6Very high91.2Very high13 Ų1346.1 Ų46.16%0.05729%0.285CS..Iπ-helixtrans-61.3-53.4-172.4174.9-88.3000112.7F1024 V1027 N1028 L1031 G1060 F1061 E1068 F1069F1024-F1065 AromaticContact CD2-CD2 3.41Å; F1024-F1065 HydrophobicContact CD2-CD2 3.41Å; F1024-F1065 VanDerWaalsContact CD2-CD2 3.41Å; F1024-F1065 AromaticContact CD2-CE2 3.99Å; F1024-F1065 HydrophobicContact CD2-CE2 3.99Å; F1024-F1065 HydrophobicContact CD2-CG 4.44Å; F1024-F1065 AromaticContact CE2-CD2 3.57Å; F1024-F1065 HydrophobicContact CE2-CD2 3.57Å; F1024-F1065 HydrophobicContact CE2-CE2 4.02Å; F1024-F1065 HydrophobicContact CE2-CG 4.44Å; F1024-F1065 HydrophobicContact CG-CD2 4.05Å; F1024-F1065 HydrophobicContact CG-CE2 4.27Å; F1024-F1065 HydrophobicContact CZ-CD2 4.35Å; F1024-F1065 HydrophobicContact CZ-CE2 4.36Å; V1027-F1065 HydrophobicContact CB-CE2 3.88Å; V1027-F1065 HydrophobicContact CB-CZ 3.91Å; V1027-F1065 HydrophobicContact CG1-CD1 4.2Å; V1027-F1065 HydrophobicContact CG1-CD2 4.4Å; V1027-F1065 HydrophobicContact CG1-CE1 3.55Å; V1027-F1065 HydrophobicContact CG1-CE2 3.78Å; V1027-F1065 HydrophobicContact CG1-CZ 3.33Å; N1028-F1065 HydrophobicContact CB-CE2 4.22Å; N1028-F1065 HydrophobicContact CB-CZ 4.41Å; L1031-F1065 HydrophobicContact CD1-CE1 3.49Å; L1031-F1065 VanDerWaalsContact CD1-CE1 3.49Å; L1031-F1065 HydrophobicContact CD1-CZ 3.74Å; G1060-F1065 PolarHBondContact O-N 3.03Å; F1061-F1065 HydrophobicContact CD2-CB 4.37Å; F1061-F1065 AromaticContact CD2-CD1 3.67Å; F1061-F1065 HydrophobicContact CD2-CD1 3.67Å; F1061-F1065 HydrophobicContact CD2-CE1 4.38Å; F1061-F1065 HydrophobicContact CD2-CG 4.16Å; F1061-F1065 AromaticContact CE2-CD1 3.48Å; F1061-F1065 HydrophobicContact CE2-CD1 3.48Å; F1061-F1065 VanDerWaalsContact CE2-CD1 3.48Å; F1061-F1065 AromaticContact CE2-CE1 3.78Å; F1061-F1065 HydrophobicContact CE2-CE1 3.78Å; F1061-F1065 HydrophobicContact CE2-CG 4.37Å; F1061-F1065 HydrophobicContact CG-CD1 4.49Å; F1061-F1065 HydrophobicContact CZ-CD1 4.15Å; F1061-F1065 HydrophobicContact CZ-CE1 4.4Å; F1061-F1065 WeakPolarHBondContact O-CB 3.5Å; F1061-F1065 PolarHBondContact O-N 3.39Å; F1065-E1068 PolarHBondContact O-N 3.31Å; F1065-F1069 HydrophobicContact CE1-CB 4.05Å; F1065-F1069 HydrophobicContact CE1-CG 4.35Å; F1065-F1069 HydrophobicContact CZ-CB 4.18Å; F1065-F1069 HydrophobicContact CZ-CD2 4.22Å; F1065-F1069 HydrophobicContact CZ-CG 4.39Å; F1065-F1069 VanDerWaalsContact O-CB 3.31Å; F1065-F1069 WeakPolarHBondContact O-CB 3.3Å; F1065-F1069 PolarHBondContact O-N 2.92Å
1066L93.1Very high90.9Very high12 Ų1244.1 Ų44.16%0.06327%0.271CS..Hα-helixtrans-62.2-46.5-175.1175.967.1000112.3F1061 E1068 F1069 L1070 F1088 L1104F1061-L1066 WeakPolarHBondContact O-CB 3.38Å; F1061-L1066 PolarHBondContact O-N 3.34Å; L1066-E1068 PolarHBondContact O-N 2.98Å; L1066-F1069 PolarHBondContact O-N 2.95Å; L1066-L1070 HydrophobicContact CD1-CD1 4.19Å; L1066-L1070 HydrophobicContact CD1-CG 4.25Å; L1066-L1070 HydrophobicContact CG-CD1 4.23Å; L1066-L1070 WeakPolarHBondContact O-CB 3.49Å; L1066-L1070 VanDerWaalsContact O-CG 3.3Å; L1066-L1070 WeakPolarHBondContact O-CG 3.29Å; L1066-L1070 PolarHBondContact O-N 3.09Å; L1066-F1088 HydrophobicContact CD1-CD2 4.39Å; L1066-F1088 HydrophobicContact CD2-CB 3.9Å; L1066-F1088 HydrophobicContact CD2-CD1 4.06Å; L1066-F1088 HydrophobicContact CD2-CD2 4.29Å; L1066-F1088 HydrophobicContact CD2-CG 3.8Å; L1066-L1104 HydrophobicContact CD1-CD2 3.89Å
1067P92.5Very high90.6Very high59 Ų5944.7 Ų44.738%0.38327%0.273SS..Hα-helixtrans-58.5-41.9172.3-27.235.3000114F1062 A1064 T1071F1062-P1067 VanDerWaalsContact O-CD 3.31Å; F1062-P1067 WeakPolarHBondContact O-CD 3.15Å; A1064-P1067 WeakPolarHBondContact O-CD 3.31Å; P1067-T1071 WeakPolarHBondContact O-CB 3.47Å; P1067-T1071 PolarHBondContact O-N 3.17Å; P1067-T1071 PolarHBondContact O-OG1 2.93Å
1068E93.4Very high90.5Very high106 Ų10645.6 Ų45.650%0.49529%0.289SS..Hα-helixtrans-67.4-45.1179.3-171.9175.8171.200111.4F1024 A1064 F1065 L1066 L1070 T1071 S1072F1024-E1068 HydrophobicContact CE2-CB 4.17Å; F1024-E1068 VanDerWaalsContact CE2-CD 3.4Å; F1024-E1068 HydrophobicContact CE2-CG 4Å; F1024-E1068 VanDerWaalsContact CE2-OE2 3.27Å; F1024-E1068 WeakPolarHBondContact CE2-OE2 3.36Å; F1024-E1068 HydrophobicContact CZ-CB 4.41Å; F1024-E1068 VanDerWaalsContact CZ-CD 3.47Å; F1024-E1068 HydrophobicContact CZ-CG 3.88Å; F1024-E1068 WeakPolarHBondContact CZ-OE1 3.41Å; A1064-E1068 VanDerWaalsContact O-CB 3.32Å; A1064-E1068 WeakPolarHBondContact O-CB 3.4Å; A1064-E1068 PolarHBondContact O-N 3.03Å; A1064-E1068 VanDerWaalsContact O-N 3.11Å; F1065-E1068 PolarHBondContact O-N 3.31Å; L1066-E1068 PolarHBondContact O-N 2.98Å; E1068-L1070 PolarHBondContact O-N 3.42Å; E1068-T1071 WeakPolarHBondContact O-CB 3.43Å; E1068-T1071 PolarHBondContact O-N 2.97Å; E1068-T1071 VanDerWaalsContact O-N 3.16Å; E1068-S1072 PolarHBondContact O-N 3.48Å
1069F93.2Very high90.2Very high1 Ų149.8 Ų49.80%0.00431%0.313CS..Hα-helixtrans-56.1-50.6174.3176.4-98.2000111.2N1028 L1031 Q1032 V1035 F1065 L1066 T1071 S1072 C1073 L1104 L1108N1028-F1069 WeakPolarHBondContact OD1-CD2 3.31Å; L1031-F1069 HydrophobicContact CB-CE2 3.83Å; L1031-F1069 HydrophobicContact CB-CZ 3.89Å; L1031-F1069 HydrophobicContact CD1-CD2 4.38Å; L1031-F1069 HydrophobicContact CD1-CE1 4.49Å; L1031-F1069 HydrophobicContact CD1-CE2 4.26Å; L1031-F1069 HydrophobicContact CD1-CZ 4.32Å; Q1032-F1069 HydrophobicContact CG-CE2 4.45Å; V1035-F1069 HydrophobicContact CG2-CZ 4.49Å; F1065-F1069 HydrophobicContact CE1-CB 4.05Å; F1065-F1069 HydrophobicContact CE1-CG 4.35Å; F1065-F1069 HydrophobicContact CZ-CB 4.18Å; F1065-F1069 HydrophobicContact CZ-CD2 4.22Å; F1065-F1069 HydrophobicContact CZ-CG 4.39Å; F1065-F1069 VanDerWaalsContact O-CB 3.31Å; F1065-F1069 WeakPolarHBondContact O-CB 3.3Å; F1065-F1069 PolarHBondContact O-N 2.92Å; L1066-F1069 PolarHBondContact O-N 2.95Å; F1069-T1071 VanDerWaalsContact C-N 3.29Å; F1069-T1071 PolarHBondContact O-N 3.09Å; F1069-S1072 PolarHBondContact O-N 2.88Å; F1069-S1072 PolarHBondContact O-OG 3.36Å; F1069-C1073 PolarHBondContact O-N 3.29Å; F1069-C1073 VanDerWaalsContact O-N 3.13Å; F1069-C1073 PolarHBondContact O-SG 3.34Å; F1069-L1104 HydrophobicContact CE1-CD2 4.49Å; F1069-L1108 HydrophobicContact CE1-CD2 4.49Å
1070L92.1Very high90.1Very high8 Ų845.7 Ų45.74%0.04229%0.291CS..Hα-helixtrans-61.9-36.7177.4-71.6173.4000112.6L1066 E1068 S1072 C1073 K1081 L1084 L1104L1066-L1070 HydrophobicContact CD1-CD1 4.19Å; L1066-L1070 HydrophobicContact CD1-CG 4.25Å; L1066-L1070 HydrophobicContact CG-CD1 4.23Å; L1066-L1070 WeakPolarHBondContact O-CB 3.49Å; L1066-L1070 VanDerWaalsContact O-CG 3.3Å; L1066-L1070 WeakPolarHBondContact O-CG 3.29Å; L1066-L1070 PolarHBondContact O-N 3.09Å; E1068-L1070 PolarHBondContact O-N 3.42Å; L1070-S1072 VanDerWaalsContact C-N 3.35Å; L1070-C1073 WeakPolarHBondContact O-CB 3.27Å; L1070-C1073 PolarHBondContact O-N 3.39Å; L1070-K1081 VanDerWaalsContact O-CD 3.26Å; L1070-K1081 WeakPolarHBondContact O-CD 3.33Å; L1070-K1081 WeakPolarHBondContact O-CE 3.44Å; L1070-L1084 HydrophobicContact CD2-CB 3.91Å; L1070-L1084 HydrophobicContact CD2-CD1 4.1Å; L1070-L1104 HydrophobicContact CD2-CD1 4.07Å
1071T89.9Confident90.2Very high100 Ų10046.6 Ų46.661%0.61329%0.287SS*.Hα-helixtrans-65.4-41.4176.9-56.60000110.8P1067 E1068 F1069 C1073 K1081P1067-T1071 WeakPolarHBondContact O-CB 3.47Å; P1067-T1071 PolarHBondContact O-N 3.17Å; P1067-T1071 PolarHBondContact O-OG1 2.93Å; E1068-T1071 WeakPolarHBondContact O-CB 3.43Å; E1068-T1071 PolarHBondContact O-N 2.97Å; E1068-T1071 VanDerWaalsContact O-N 3.16Å; F1069-T1071 VanDerWaalsContact C-N 3.29Å; F1069-T1071 PolarHBondContact O-N 3.09Å; T1071-C1073 VanDerWaalsContact C-N 3.26Å; T1071-C1073 PolarHBondContact O-N 2.98Å; T1071-K1081 PolarHBondContact O-NZ 3.21Å
1072S88.9Confident89.9Confident64 Ų6449.8 Ų49.845%0.44831%0.311SS..Hα-helixtrans-72.4-10.517775.60000114.9E1068 F1069 L1070 D1074E1068-S1072 PolarHBondContact O-N 3.48Å; F1069-S1072 PolarHBondContact O-N 2.88Å; F1069-S1072 PolarHBondContact O-OG 3.36Å; L1070-S1072 VanDerWaalsContact C-N 3.35Å; S1072-D1074 PolarHBondContact O-N 3.37Å
1073C87.5Confident89.8Confident1 Ų150.2 Ų50.21%0.00732%0.315CS..  trans-73.1117.8178.4-72.20000111.4F1069 L1070 T1071 V1076 K1081 L1108F1069-C1073 PolarHBondContact O-N 3.29Å; F1069-C1073 VanDerWaalsContact O-N 3.13Å; F1069-C1073 PolarHBondContact O-SG 3.34Å; L1070-C1073 WeakPolarHBondContact O-CB 3.27Å; L1070-C1073 PolarHBondContact O-N 3.39Å; T1071-C1073 VanDerWaalsContact C-N 3.26Å; T1071-C1073 PolarHBondContact O-N 2.98Å; C1073-V1076 HydrophobicContact CB-CG2 4.05Å; C1073-K1081 WeakPolarHBondContact O-CE 3.35Å; C1073-K1081 PolarHBondContact O-NZ 2.88Å; C1073-L1108 HydrophobicContact CB-CD1 4.16Å
1074D84.9Confident89.8Confident132 Ų13246.4 Ų46.471%0.70628%0.283SS*.THydrogen-bonded Turntrans-76.5158.7170.2-61.7-40.9000112.2S1072 R1112S1072-D1074 PolarHBondContact O-N 3.37Å; D1074-R1112 PolarHBondContact O-NE 3.04Å; D1074-R1112 PolarHBondContact O-NH2 2.77Å
1075G83.9Confident89.7Confident17 Ų1745.2 Ų45.218%0.17528%0.276CS..THydrogen-bonded Turntrans77.712.517500000115.4N1115G1075-N1115 PolarHBondContact O-ND2 3.02Å
1076V87.8Confident89.5Confident2 Ų253.6 Ų53.61%0.01231%0.307CS..  trans-135.6141.5176.8-67.70000112.3C1073 Q1080 K1081 L1108 R1112C1073-V1076 HydrophobicContact CB-CG2 4.05Å; V1076-Q1080 HydrophobicContact CB-CB 4.34Å; V1076-K1081 HydrophobicContact CG2-CD 4.38Å; V1076-K1081 HydrophobicContact CG2-CG 3.81Å; V1076-K1081 VanDerWaalsContact O-CE 3.32Å; V1076-K1081 WeakPolarHBondContact O-CE 3.22Å; V1076-L1108 HydrophobicContact CG1-CD1 3.88Å; V1076-L1108 HydrophobicContact CG2-CD1 4.05Å; V1076-R1112 HydrophobicContact CG1-CG 4.1Å
1077D86.6Confident89.4Confident40 Ų4055.6 Ų55.621%0.21432%0.318CS..  trans-81.8169.5-17874.942.3000113.4N1079 Q1080 K1081 V1123D1077-N1079 VanDerWaalsContact C-N 3.28Å; D1077-N1079 PolarHBondContact O-N 2.93Å; D1077-N1079 WeakPolarHBondContact OD1-CA 3.38Å; D1077-N1079 WeakPolarHBondContact OD1-CB 3.48Å; D1077-N1079 PolarHBondContact OD1-N 2.91Å; D1077-Q1080 PolarHBondContact O-N 3.12Å; D1077-Q1080 WeakPolarHBondContact OD1-CG 3.47Å; D1077-Q1080 PolarHBondContact OD1-N 3.06Å; D1077-K1081 WeakPolarHBondContact O-CG 3.18Å; D1077-K1081 PolarHBondContact O-N 3.02Å; D1077-V1123 HydrophobicContact CB-CG1 3.93Å
1078A86.8Confident89.3Confident81 Ų8153.5 Ų53.567%0.66930%0.303SS*.Hα-helixtrans-60.9-32.8-178.100000114.1S1082A1078-S1082 PolarHBondContact O-N 3.08Å; A1078-S1082 VanDerWaalsContact O-N 3.14Å
1079N87.8Confident89.2Confident115 Ų11554.3 Ų54.362%0.61531%0.305SS*.Hα-helixtrans-74.7-43178.5178.760.1000110.8D1077 S1082 V1083D1077-N1079 VanDerWaalsContact C-N 3.28Å; D1077-N1079 PolarHBondContact O-N 2.93Å; D1077-N1079 WeakPolarHBondContact OD1-CA 3.38Å; D1077-N1079 WeakPolarHBondContact OD1-CB 3.48Å; D1077-N1079 PolarHBondContact OD1-N 2.91Å; N1079-S1082 WeakPolarHBondContact O-CB 3.35Å; N1079-S1082 PolarHBondContact O-N 2.99Å; N1079-V1083 WeakPolarHBondContact O-CG2 3.43Å; N1079-V1083 PolarHBondContact O-N 3.33Å
1080Q89.7Confident89.1Confident19 Ų1960.5 Ų60.59%0.08934%0.335CS..Hα-helixtrans-60.5-44.3174.1-68.9170.3-17.300111V1076 D1077 S1082 V1083 L1084 Y1111 N1115V1076-Q1080 HydrophobicContact CB-CB 4.34Å; D1077-Q1080 PolarHBondContact O-N 3.12Å; D1077-Q1080 WeakPolarHBondContact OD1-CG 3.47Å; D1077-Q1080 PolarHBondContact OD1-N 3.06Å; Q1080-S1082 VanDerWaalsContact C-N 3.32Å; Q1080-S1082 PolarHBondContact O-N 3.18Å; Q1080-V1083 PolarHBondContact O-N 3.5Å; Q1080-L1084 WeakPolarHBondContact O-CG 3.38Å; Q1080-L1084 PolarHBondContact O-N 2.9Å; Q1080-Y1111 HydrophobicContact CB-CD2 4.16Å; Q1080-Y1111 HydrophobicContact CB-CE2 4.4Å; Q1080-Y1111 HydrophobicContact CB-CG 4.27Å; Q1080-Y1111 HydrophobicContact CG-CD1 3.93Å; Q1080-Y1111 HydrophobicContact CG-CD2 4.38Å; Q1080-Y1111 HydrophobicContact CG-CE1 4.16Å; Q1080-Y1111 HydrophobicContact CG-CG 4.06Å; Q1080-N1115 PolarHBondContact NE2-ND2 2.76Å; Q1080-N1115 PolarHBondContact NE2-OD1 3.13Å; Q1080-N1115 VanDerWaalsContact NE2-OD1 3.14Å; Q1080-N1115 PolarHBondContact OE1-ND2 3.46Å
1081K91.3Very high89Confident44 Ų4462.6 Ų62.619%0.19135%0.347CS..Hα-helixtrans-56.3-44.7172.9-71.7176.7-178.7-173.70111.7L1070 T1071 C1073 V1076 D1077 L1084 G1085L1070-K1081 VanDerWaalsContact O-CD 3.26Å; L1070-K1081 WeakPolarHBondContact O-CD 3.33Å; L1070-K1081 WeakPolarHBondContact O-CE 3.44Å; T1071-K1081 PolarHBondContact O-NZ 3.21Å; C1073-K1081 WeakPolarHBondContact O-CE 3.35Å; C1073-K1081 PolarHBondContact O-NZ 2.88Å; V1076-K1081 HydrophobicContact CG2-CD 4.38Å; V1076-K1081 HydrophobicContact CG2-CG 3.81Å; V1076-K1081 VanDerWaalsContact O-CE 3.32Å; V1076-K1081 WeakPolarHBondContact O-CE 3.22Å; D1077-K1081 WeakPolarHBondContact O-CG 3.18Å; D1077-K1081 PolarHBondContact O-N 3.02Å; K1081-L1084 PolarHBondContact O-N 2.85Å; K1081-G1085 PolarHBondContact O-N 3.41Å; K1081-G1085 VanDerWaalsContact O-N 3.09Å
1082S89.6Confident89.1Confident78 Ų7864.2 Ų64.255%0.54534%0.341SS..Hα-helixtrans-63.8-41.6176.7-175.80000112.8A1078 N1079 Q1080 G1085 R1086A1078-S1082 PolarHBondContact O-N 3.08Å; A1078-S1082 VanDerWaalsContact O-N 3.14Å; N1079-S1082 WeakPolarHBondContact O-CB 3.35Å; N1079-S1082 PolarHBondContact O-N 2.99Å; Q1080-S1082 VanDerWaalsContact C-N 3.32Å; Q1080-S1082 PolarHBondContact O-N 3.18Å; S1082-G1085 PolarHBondContact O-N 3.33Å; S1082-R1086 WeakPolarHBondContact O-CB 3.46Å; S1082-R1086 PolarHBondContact O-N 3.44Å
1083V90.1Very high89.4Confident26 Ų2664.6 Ų64.616%0.15834%0.338CS..Hα-helixtrans-65.4-44.5177.8171.50000111.5N1079 Q1080 G1085 R1086 N1087N1079-V1083 WeakPolarHBondContact O-CG2 3.43Å; N1079-V1083 PolarHBondContact O-N 3.33Å; Q1080-V1083 PolarHBondContact O-N 3.5Å; V1083-G1085 PolarHBondContact O-N 2.95Å; V1083-R1086 PolarHBondContact O-N 3.39Å; V1083-N1087 WeakPolarHBondContact O-CB 3.45Å; V1083-N1087 PolarHBondContact O-N 3.22Å
1084L91.4Very high89.6Confident3 Ų367.5 Ų67.52%0.01635%0.353CS..Hα-helixtrans-58.7-47.1176.3-71.3168.9000111.2L1070 Q1080 K1081 R1086 N1087 F1088 L1104 D1107 L1108 Y1111L1070-L1084 HydrophobicContact CD2-CB 3.91Å; L1070-L1084 HydrophobicContact CD2-CD1 4.1Å; Q1080-L1084 WeakPolarHBondContact O-CG 3.38Å; Q1080-L1084 PolarHBondContact O-N 2.9Å; K1081-L1084 PolarHBondContact O-N 2.85Å; L1084-R1086 PolarHBondContact O-N 2.94Å; L1084-N1087 PolarHBondContact O-N 2.91Å; L1084-F1088 PolarHBondContact O-N 3.28Å; L1084-L1104 HydrophobicContact CB-CD1 3.96Å; L1084-L1104 HydrophobicContact CD2-CD1 4.12Å; L1084-D1107 HydrophobicContact CD2-CB 3.58Å; L1084-L1108 HydrophobicContact CD1-CB 4.35Å; L1084-L1108 HydrophobicContact CD1-CD1 3.76Å; L1084-Y1111 HydrophobicContact CD1-CD2 4.1Å; L1084-Y1111 HydrophobicContact CD1-CE2 4.44Å; L1084-Y1111 HydrophobicContact CD2-CD2 3.99Å; L1084-Y1111 HydrophobicContact CD2-CE2 3.8Å; L1084-Y1111 HydrophobicContact CG-CD2 4.07Å; L1084-Y1111 HydrophobicContact CG-CE2 3.92Å
1085G90.2Very high89.9Confident28 Ų2865.5 Ų65.529%0.28935%0.348SS..Hα-helixtrans-62.1-42.1177.200000113.1K1081 S1082 V1083 F1088K1081-G1085 PolarHBondContact O-N 3.41Å; K1081-G1085 VanDerWaalsContact O-N 3.09Å; S1082-G1085 PolarHBondContact O-N 3.33Å; V1083-G1085 PolarHBondContact O-N 2.95Å; G1085-F1088 PolarHBondContact O-N 3.44Å
1086R89.8Confident90.4Very high189 Ų18966.4 Ų66.471%0.71335%0.351SS*.Hα-helixtrans-68-34177.9-173.7-179.666.9-166.3-2.1113.1S1082 V1083 L1084 F1088S1082-R1086 WeakPolarHBondContact O-CB 3.46Å; S1082-R1086 PolarHBondContact O-N 3.44Å; V1083-R1086 PolarHBondContact O-N 3.39Å; L1084-R1086 PolarHBondContact O-N 2.94Å; R1086-F1088 VanDerWaalsContact C-N 3.32Å
1087N89.1Confident90.7Very high54 Ų5466.3 Ų66.329%0.28935%0.351SS..Hα-helixtrans-79.2-15.7-178.2-71.6-8.5000112.9V1083 L1084 K1089V1083-N1087 WeakPolarHBondContact O-CB 3.45Å; V1083-N1087 PolarHBondContact O-N 3.22Å; L1084-N1087 PolarHBondContact O-N 2.91Å; N1087-K1089 PolarHBondContact O-N 3.31Å
1088F91.8Very high91.1Very high15 Ų1565.5 Ų65.57%0.06635%0.347CS..SBendtrans-75.1103.4172.8-158.6-71.3000109.9F1061 F1062 L1066 L1084 G1085 R1086 F1097 N1100 V1101 L1104F1061-F1088 HydrophobicContact CE1-CE1 4.34Å; F1061-F1088 HydrophobicContact CE1-CZ 4.28Å; F1062-F1088 AromaticContact CE1-CD1 3.99Å; F1062-F1088 HydrophobicContact CE1-CD1 3.99Å; F1062-F1088 AromaticContact CE1-CE1 3.75Å; F1062-F1088 HydrophobicContact CE1-CE1 3.75Å; L1066-F1088 HydrophobicContact CD1-CD2 4.39Å; L1066-F1088 HydrophobicContact CD2-CB 3.9Å; L1066-F1088 HydrophobicContact CD2-CD1 4.06Å; L1066-F1088 HydrophobicContact CD2-CD2 4.29Å; L1066-F1088 HydrophobicContact CD2-CG 3.8Å; L1084-F1088 PolarHBondContact O-N 3.28Å; G1085-F1088 PolarHBondContact O-N 3.44Å; R1086-F1088 VanDerWaalsContact C-N 3.32Å; F1088-F1097 HydrophobicContact CE1-CD2 4.49Å; F1088-F1097 HydrophobicContact CE1-CE2 4.29Å; F1088-F1097 HydrophobicContact CZ-CE2 4.24Å; F1088-N1100 HydrophobicContact CD1-CB 4.37Å; F1088-N1100 HydrophobicContact CD2-CB 4.46Å; F1088-N1100 HydrophobicContact CE1-CB 3.99Å; F1088-N1100 HydrophobicContact CE2-CB 4.13Å; F1088-N1100 HydrophobicContact CZ-CB 3.88Å; F1088-V1101 HydrophobicContact CE2-CG2 4.18Å; F1088-V1101 HydrophobicContact CZ-CG2 3.97Å; F1088-L1104 HydrophobicContact CD2-CB 3.92Å; F1088-L1104 HydrophobicContact CD2-CD1 4.49Å; F1088-L1104 HydrophobicContact CD2-CD2 3.86Å; F1088-L1104 HydrophobicContact CD2-CG 4.3Å; F1088-L1104 HydrophobicContact CE2-CB 4.13Å; F1088-L1104 HydrophobicContact CE2-CD2 3.93Å
1089K90.8Very high91.3Very high124 Ų12467.3 Ų67.354%0.53934%0.342SS..  trans-70.9143.3177.3-64.9178.7-179.9177.50110.7N1087 D1091 N1100N1087-K1089 PolarHBondContact O-N 3.31Å; K1089-D1091 WeakPolarHBondContact CB-OD2 3.32Å; K1089-D1091 PolarHBondContact O-N 3Å; K1089-N1100 PolarHBondContact O-ND2 3.01Å
1090M90.6Very high91.6Very high131 Ų13162.3 Ų62.365%0.64532%0.315SS*.  trans-8141.8-179.8-60.8179.9121.700112.5F1062F1062-M1090 HydrophobicContact CB-CE 3.38Å; F1062-M1090 HydrophobicContact CD1-CE 4.35Å; F1062-M1090 HydrophobicContact CD1-CG 4.18Å; F1062-M1090 HydrophobicContact CD2-CB 4.47Å; F1062-M1090 HydrophobicContact CD2-CE 4.08Å; F1062-M1090 HydrophobicContact CD2-CG 4.44Å; F1062-M1090 HydrophobicContact CE1-CB 4.36Å; F1062-M1090 HydrophobicContact CE1-CG 4.32Å; F1062-M1090 HydrophobicContact CE2-CB 4.21Å; F1062-M1090 HydrophobicContact CG-CE 3.71Å; F1062-M1090 HydrophobicContact CG-CG 4.26Å; F1062-M1090 HydrophobicContact CZ-CB 4.16Å
1091D90.9Very high91.8Very high52 Ų5261.4 Ų61.428%0.27831%0.311SS..  trans-73.5138.9179.5-57.7-43.4000109.8K1089 N1100K1089-D1091 WeakPolarHBondContact CB-OD2 3.32Å; K1089-D1091 PolarHBondContact O-N 3Å; D1091-N1100 PolarHBondContact OD2-ND2 2.95Å
1092R92.4Very high91.8Very high134 Ų13461.6 Ų61.651%0.50631%0.313SS..  trans-111.8-5.1-174-64.6-177.6179.6-166.8-7.7113.6Y1051 F1058 D1059Y1051-R1092 WeakPolarHBondContact CE2-O 3.36Å; Y1051-R1092 PolarHBondContact OH-O 3.45Å; Y1051-R1092 VanDerWaalsContact OH-O 3.14Å; F1058-R1092 HydrophobicContact CD2-CB 4.4Å; F1058-R1092 HydrophobicContact CD2-CG 4.01Å; F1058-R1092 HydrophobicContact CE2-CB 3.96Å; F1058-R1092 HydrophobicContact CE2-CG 4.07Å; F1058-R1092 HydrophobicContact CG-CG 4.27Å; F1058-R1092 HydrophobicContact CZ-CB 4.17Å; F1058-R1092 HydrophobicContact CZ-CG 4.41Å; D1059-R1092 IonicContact OD1-NH2 2.65Å; D1059-R1092 PolarHBondContact OD1-NH2 3.18Å
1093D94.5Very high92Very high72 Ų7260.4 Ų60.439%0.38530%0.296SS..SBendtrans-83144.7171.363.6-74.6000110.8S1096 F1097D1093-S1096 VanDerWaalsContact CG-OG 3.27Å; D1093-S1096 PolarHBondContact O-N 3.47Å; D1093-S1096 VanDerWaalsContact OD1-CB 3.32Å; D1093-S1096 WeakPolarHBondContact OD1-CB 2.98Å; D1093-S1096 PolarHBondContact OD1-OG 3.05Å; D1093-S1096 WeakPolarHBondContact OD2-CB 3.21Å; D1093-S1096 PolarHBondContact OD2-N 3.18Å; D1093-S1096 PolarHBondContact OD2-OG 3.05Å; D1093-F1097 VanDerWaalsContact O-CB 3.26Å; D1093-F1097 WeakPolarHBondContact O-CB 3.14Å; D1093-F1097 PolarHBondContact O-N 3.08Å
1094L91Very high92.1Very high61 Ų6159.6 Ų59.632%0.31929%0.291SS..Hα-helixtrans-53.9-51.1-175.3172.567.9000113I1048 Y1051 S1096 F1097 T1098I1048-L1094 HydrophobicContact CG1-CD1 4.18Å; Y1051-L1094 HydrophobicContact CD1-CB 4.16Å; Y1051-L1094 HydrophobicContact CD1-CD1 3.42Å; Y1051-L1094 VanDerWaalsContact CD1-CD1 3.42Å; Y1051-L1094 HydrophobicContact CD1-CG 4.32Å; Y1051-L1094 HydrophobicContact CD2-CB 4.35Å; Y1051-L1094 HydrophobicContact CD2-CD1 4.07Å; Y1051-L1094 HydrophobicContact CE1-CB 3.94Å; Y1051-L1094 HydrophobicContact CE1-CD1 4.07Å; Y1051-L1094 HydrophobicContact CE2-CB 4.11Å; Y1051-L1094 HydrophobicContact CG-CB 4.35Å; Y1051-L1094 HydrophobicContact CG-CD1 3.41Å; Y1051-L1094 VanDerWaalsContact CG-CD1 3.41Å; Y1051-L1094 HydrophobicContact CG-CG 4.49Å; L1094-S1096 PolarHBondContact O-N 3.32Å; L1094-F1097 PolarHBondContact O-N 3.3Å; L1094-T1098 HydrophobicContact CD1-CG2 3.75Å; L1094-T1098 WeakPolarHBondContact O-CG2 3.47Å; L1094-T1098 PolarHBondContact O-N 3.11Å; L1094-T1098 PolarHBondContact O-OG1 3.47Å; L1094-T1098 VanDerWaalsContact O-OG1 3.05Å
1095P93Very high92.2Very high90 Ų9059.6 Ų59.658%0.58429%0.291SS*.Hα-helixtrans-62.6-45-177.5-22.534.3000113.7T1098 Q1099P1095-T1098 PolarHBondContact O-OG1 2.94Å; P1095-T1098 VanDerWaalsContact O-OG1 3.12Å; P1095-Q1099 WeakPolarHBondContact O-CB 3.49Å; P1095-Q1099 PolarHBondContact O-N 3.42Å; P1095-Q1099 VanDerWaalsContact O-N 3.09Å
1096S92.8Very high92.2Very high36 Ų3659 Ų5925%0.25228%0.281SS..Hα-helixtrans-70.6-38.5-179-530000111.3D1093 L1094 Q1099 N1100D1093-S1096 VanDerWaalsContact CG-OG 3.27Å; D1093-S1096 PolarHBondContact O-N 3.47Å; D1093-S1096 VanDerWaalsContact OD1-CB 3.32Å; D1093-S1096 WeakPolarHBondContact OD1-CB 2.98Å; D1093-S1096 PolarHBondContact OD1-OG 3.05Å; D1093-S1096 WeakPolarHBondContact OD2-CB 3.21Å; D1093-S1096 PolarHBondContact OD2-N 3.18Å; D1093-S1096 PolarHBondContact OD2-OG 3.05Å; L1094-S1096 PolarHBondContact O-N 3.32Å; S1096-Q1099 PolarHBondContact O-N 3.5Å; S1096-N1100 VanDerWaalsContact O-CG 3.22Å; S1096-N1100 PolarHBondContact O-N 3.3Å; S1096-N1100 PolarHBondContact O-ND2 3.1Å; S1096-N1100 VanDerWaalsContact O-ND2 3.07Å
1097F95.5Very high92.3Very high0 Ų050.1 Ų50.10%025%0.248CC..Hα-helixtrans-63.5-48.8176.9-179.3-86.3000112.2I1050 Y1051 A1054 F1058 F1061 F1062 F1088 D1093 L1094 Q1099 N1100 V1101I1050-F1097 HydrophobicContact CG2-CE1 4Å; I1050-F1097 HydrophobicContact CG2-CZ 4.3Å; Y1051-F1097 HydrophobicContact CD2-CB 3.8Å; Y1051-F1097 AromaticContact CD2-CD1 3.7Å; Y1051-F1097 HydrophobicContact CD2-CD1 3.7Å; Y1051-F1097 HydrophobicContact CD2-CE1 4.41Å; Y1051-F1097 AromaticContact CD2-CG 3.75Å; Y1051-F1097 HydrophobicContact CD2-CG 3.75Å; Y1051-F1097 HydrophobicContact CE2-CB 4.29Å; Y1051-F1097 HydrophobicContact CG-CD1 4.21Å; A1054-F1097 HydrophobicContact CB-CE1 4.46Å; A1054-F1097 HydrophobicContact CB-CE2 4.17Å; A1054-F1097 HydrophobicContact CB-CZ 3.71Å; F1058-F1097 HydrophobicContact CE1-CD2 4.27Å; F1058-F1097 HydrophobicContact CE1-CE2 4.28Å; F1061-F1097 HydrophobicContact CD1-CE2 4.2Å; F1061-F1097 HydrophobicContact CD1-CZ 4.47Å; F1061-F1097 AromaticContact CE1-CE2 3.74Å; F1061-F1097 HydrophobicContact CE1-CE2 3.74Å; F1061-F1097 AromaticContact CE1-CZ 3.83Å; F1061-F1097 HydrophobicContact CE1-CZ 3.83Å; F1061-F1097 HydrophobicContact CE2-CZ 4.34Å; F1061-F1097 HydrophobicContact CZ-CE2 4.16Å; F1061-F1097 AromaticContact CZ-CZ 3.75Å; F1061-F1097 HydrophobicContact CZ-CZ 3.75Å; F1062-F1097 HydrophobicContact CZ-CE2 4.4Å; F1088-F1097 HydrophobicContact CE1-CD2 4.49Å; F1088-F1097 HydrophobicContact CE1-CE2 4.29Å; F1088-F1097 HydrophobicContact CZ-CE2 4.24Å; D1093-F1097 VanDerWaalsContact O-CB 3.26Å; D1093-F1097 WeakPolarHBondContact O-CB 3.14Å; D1093-F1097 PolarHBondContact O-N 3.08Å; L1094-F1097 PolarHBondContact O-N 3.3Å; F1097-Q1099 VanDerWaalsContact C-N 3.31Å; F1097-Q1099 PolarHBondContact O-N 3.27Å; F1097-N1100 WeakPolarHBondContact O-CB 3.23Å; F1097-N1100 PolarHBondContact O-N 3.45Å; F1097-N1100 VanDerWaalsContact O-N 3.11Å; F1097-V1101 HydrophobicContact CD1-CG2 3.99Å; F1097-V1101 HydrophobicContact CE1-CG2 3.56Å; F1097-V1101 HydrophobicContact CZ-CG2 4.03Å; F1097-V1101 WeakPolarHBondContact O-CG2 3.5Å; F1097-V1101 PolarHBondContact O-N 3.17Å
1098T93.6Very high92.4Very high24 Ų2447.6 Ų47.615%0.14723%0.234CC..Hα-helixtrans-63.5-39.5178.7540000111L1094 P1095 N1100 V1101 H1102L1094-T1098 HydrophobicContact CD1-CG2 3.75Å; L1094-T1098 WeakPolarHBondContact O-CG2 3.47Å; L1094-T1098 PolarHBondContact O-N 3.11Å; L1094-T1098 PolarHBondContact O-OG1 3.47Å; L1094-T1098 VanDerWaalsContact O-OG1 3.05Å; P1095-T1098 PolarHBondContact O-OG1 2.94Å; P1095-T1098 VanDerWaalsContact O-OG1 3.12Å; T1098-N1100 VanDerWaalsContact C-N 3.32Å; T1098-N1100 PolarHBondContact O-N 3.42Å; T1098-V1101 WeakPolarHBondContact O-CB 3.33Å; T1098-V1101 PolarHBondContact O-N 3.12Å; T1098-V1101 VanDerWaalsContact O-N 3.14Å; T1098-H1102 PolarHBondContact O-CD2 2.91Å; T1098-H1102 PolarHBondContact O-N 2.94Å
1099Q92.1Very high92.2Very high119 Ų11948.5 Ų48.556%0.55624%0.237SC*.Hα-helixtrans-57.9-42.8172.2-172.3179.6900112.1P1095 S1096 F1097 H1102 R1103P1095-Q1099 WeakPolarHBondContact O-CB 3.49Å; P1095-Q1099 PolarHBondContact O-N 3.42Å; P1095-Q1099 VanDerWaalsContact O-N 3.09Å; S1096-Q1099 PolarHBondContact O-N 3.5Å; F1097-Q1099 VanDerWaalsContact C-N 3.31Å; F1097-Q1099 PolarHBondContact O-N 3.27Å; Q1099-H1102 PolarHBondContact O-N 3.38Å; Q1099-R1103 VanDerWaalsContact O-CB 3.31Å; Q1099-R1103 WeakPolarHBondContact O-CB 3.34Å; Q1099-R1103 PolarHBondContact O-N 3.27Å
1100N93.4Very high92.1Very high10 Ų1043.5 Ų43.55%0.05322%0.215CC..Hα-helixtrans-64.7-37.9175.8-70.5-37.1000112.2F1088 K1089 D1091 S1096 F1097 T1098 R1103 L1104F1088-N1100 HydrophobicContact CD1-CB 4.37Å; F1088-N1100 HydrophobicContact CD2-CB 4.46Å; F1088-N1100 HydrophobicContact CE1-CB 3.99Å; F1088-N1100 HydrophobicContact CE2-CB 4.13Å; F1088-N1100 HydrophobicContact CZ-CB 3.88Å; K1089-N1100 PolarHBondContact O-ND2 3.01Å; D1091-N1100 PolarHBondContact OD2-ND2 2.95Å; S1096-N1100 VanDerWaalsContact O-CG 3.22Å; S1096-N1100 PolarHBondContact O-N 3.3Å; S1096-N1100 PolarHBondContact O-ND2 3.1Å; S1096-N1100 VanDerWaalsContact O-ND2 3.07Å; F1097-N1100 WeakPolarHBondContact O-CB 3.23Å; F1097-N1100 PolarHBondContact O-N 3.45Å; F1097-N1100 VanDerWaalsContact O-N 3.11Å; T1098-N1100 VanDerWaalsContact C-N 3.32Å; T1098-N1100 PolarHBondContact O-N 3.42Å; N1100-R1103 PolarHBondContact O-N 3.49Å; N1100-L1104 WeakPolarHBondContact O-CB 3.05Å; N1100-L1104 PolarHBondContact O-N 2.83Å
1101V94.1Very high91.9Very high0 Ų039.1 Ų39.10%019%0.192CC..Hα-helixtrans-62.3-50.1173.1171.40000111.3L1031 L1034 I1050 F1088 F1097 T1098 R1103 L1104 V1105L1031-V1101 HydrophobicContact CD2-CG1 3.7Å; L1034-V1101 HydrophobicContact CD1-CG1 3.78Å; I1050-V1101 HydrophobicContact CD1-CG1 4.38Å; I1050-V1101 HydrophobicContact CG2-CG2 4.39Å; F1088-V1101 HydrophobicContact CE2-CG2 4.18Å; F1088-V1101 HydrophobicContact CZ-CG2 3.97Å; F1097-V1101 HydrophobicContact CD1-CG2 3.99Å; F1097-V1101 HydrophobicContact CE1-CG2 3.56Å; F1097-V1101 HydrophobicContact CZ-CG2 4.03Å; F1097-V1101 WeakPolarHBondContact O-CG2 3.5Å; F1097-V1101 PolarHBondContact O-N 3.17Å; T1098-V1101 WeakPolarHBondContact O-CB 3.33Å; T1098-V1101 PolarHBondContact O-N 3.12Å; T1098-V1101 VanDerWaalsContact O-N 3.14Å; V1101-R1103 VanDerWaalsContact C-N 3.28Å; V1101-R1103 PolarHBondContact O-N 3.14Å; V1101-L1104 WeakPolarHBondContact O-CB 3.34Å; V1101-L1104 PolarHBondContact O-N 3.41Å; V1101-V1105 HydrophobicContact CG1-CG2 4.49Å; V1101-V1105 VanDerWaalsContact O-CG2 3.29Å; V1101-V1105 WeakPolarHBondContact O-CG2 3.48Å; V1101-V1105 PolarHBondContact O-N 2.95Å
1102H92.1Very high91.8Very high48 Ų4838.8 Ų38.822%0.22219%0.186CC..Hα-helixtrans-63.4-36178.2-63.5-58.4000112Q1043 T1098 Q1099 V1105 N1106Q1043-H1102 PolarHBondContact NE2-ND1 3.01Å; T1098-H1102 PolarHBondContact O-CD2 2.91Å; T1098-H1102 PolarHBondContact O-N 2.94Å; Q1099-H1102 PolarHBondContact O-N 3.38Å; H1102-V1105 PolarHBondContact O-N 3.14Å; H1102-N1106 WeakPolarHBondContact O-CB 3.41Å; H1102-N1106 PolarHBondContact O-N 3.36Å
1103R92.1Very high91.5Very high52 Ų5235.1 Ų35.120%0.19618%0.177CC..Hα-helixtrans-62-48.6173.6178.8175.8-175.8150.62.8112V166 Q1099 N1100 V1101 V1105 N1106 D1107V166-R1103 HydrophobicContact CB-CG 4.01Å; V166-R1103 HydrophobicContact CG1-CG 4.32Å; V166-R1103 HydrophobicContact CG2-CB 4.27Å; V166-R1103 HydrophobicContact CG2-CG 3.93Å; Q1099-R1103 VanDerWaalsContact O-CB 3.31Å; Q1099-R1103 WeakPolarHBondContact O-CB 3.34Å; Q1099-R1103 PolarHBondContact O-N 3.27Å; N1100-R1103 PolarHBondContact O-N 3.49Å; V1101-R1103 VanDerWaalsContact C-N 3.28Å; V1101-R1103 PolarHBondContact O-N 3.14Å; R1103-V1105 VanDerWaalsContact C-N 3.31Å; R1103-V1105 PolarHBondContact O-N 3.03Å; R1103-N1106 PolarHBondContact O-N 3.13Å; R1103-D1107 WeakPolarHBondContact O-CB 3.49Å; R1103-D1107 PolarHBondContact O-N 2.9Å
1104L93.2Very high90.9Very high9 Ų932 Ų325%0.04716%0.161CC..Hα-helixtrans-56.5-47.5176.517668.6000111.2L1066 F1069 L1070 L1084 F1088 N1100 V1101 D1107 L1108L1066-L1104 HydrophobicContact CD1-CD2 3.89Å; F1069-L1104 HydrophobicContact CE1-CD2 4.49Å; L1070-L1104 HydrophobicContact CD2-CD1 4.07Å; L1084-L1104 HydrophobicContact CB-CD1 3.96Å; L1084-L1104 HydrophobicContact CD2-CD1 4.12Å; F1088-L1104 HydrophobicContact CD2-CB 3.92Å; F1088-L1104 HydrophobicContact CD2-CD1 4.49Å; F1088-L1104 HydrophobicContact CD2-CD2 3.86Å; F1088-L1104 HydrophobicContact CD2-CG 4.3Å; F1088-L1104 HydrophobicContact CE2-CB 4.13Å; F1088-L1104 HydrophobicContact CE2-CD2 3.93Å; N1100-L1104 WeakPolarHBondContact O-CB 3.05Å; N1100-L1104 PolarHBondContact O-N 2.83Å; V1101-L1104 WeakPolarHBondContact O-CB 3.34Å; V1101-L1104 PolarHBondContact O-N 3.41Å; L1104-D1107 PolarHBondContact O-N 2.89Å; L1104-L1108 WeakPolarHBondContact O-CB 3.35Å; L1104-L1108 PolarHBondContact O-N 3.39Å
1105V92.5Very high90.6Very high3 Ų330 Ų302%0.01815%0.15CC..Hα-helixtrans-61.1-47.7179.9167.50000111.6L1034 V1035 V1101 H1102 R1103 R1109L1034-V1105 HydrophobicContact CB-CG1 4.46Å; L1034-V1105 HydrophobicContact CB-CG2 3.95Å; L1034-V1105 WeakPolarHBondContact O-CG1 3.45Å; V1035-V1105 HydrophobicContact CG2-CG1 4.34Å; V1035-V1105 HydrophobicContact CG2-CG2 4.04Å; V1101-V1105 HydrophobicContact CG1-CG2 4.49Å; V1101-V1105 VanDerWaalsContact O-CG2 3.29Å; V1101-V1105 WeakPolarHBondContact O-CG2 3.48Å; V1101-V1105 PolarHBondContact O-N 2.95Å; H1102-V1105 PolarHBondContact O-N 3.14Å; R1103-V1105 VanDerWaalsContact C-N 3.31Å; R1103-V1105 PolarHBondContact O-N 3.03Å; V1105-R1109 WeakPolarHBondContact O-CG 3.39Å; V1105-R1109 PolarHBondContact O-N 3.03Å; V1105-R1109 VanDerWaalsContact O-N 3.11Å
1106N91.2Very high90Very high15 Ų1531.7 Ų31.78%0.0815%0.154CC..Hα-helixtrans-62.6-47.4177.8176.491.8000111.5L164 V166 K169 H1102 R1103 L1108 R1109 Y1110L164-N1106 PolarHBondContact O-ND2 3.1Å; V166-N1106 HydrophobicContact CG2-CB 3.85Å; V166-N1106 WeakPolarHBondContact CG2-ND2 3.44Å; V166-N1106 PolarHBondContact N-ND2 3.34Å; K169-N1106 PolarHBondContact NZ-OD1 3.35Å; H1102-N1106 WeakPolarHBondContact O-CB 3.41Å; H1102-N1106 PolarHBondContact O-N 3.36Å; R1103-N1106 PolarHBondContact O-N 3.13Å; N1106-L1108 PolarHBondContact O-N 3.27Å; N1106-R1109 PolarHBondContact O-N 3.31Å; N1106-Y1110 WeakPolarHBondContact O-CB 3.41Å; N1106-Y1110 PolarHBondContact O-N 3.46Å
1107D91.1Very high89.2Confident4 Ų431.5 Ų31.52%0.02115%0.153CC..Hα-helixtrans-68.3-36.4-177.7-70.5-8.3000111.8S165 V166 L1084 R1103 L1104 Y1110 Y1111S165-D1107 VanDerWaalsContact CA-OD1 3.24Å; S165-D1107 WeakPolarHBondContact CA-OD1 3.35Å; V166-D1107 PolarHBondContact N-OD1 2.79Å; L1084-D1107 HydrophobicContact CD2-CB 3.58Å; R1103-D1107 WeakPolarHBondContact O-CB 3.49Å; R1103-D1107 PolarHBondContact O-N 2.9Å; L1104-D1107 PolarHBondContact O-N 2.89Å; D1107-Y1110 WeakPolarHBondContact O-CB 3.47Å; D1107-Y1110 PolarHBondContact O-N 3.13Å; D1107-Y1111 WeakPolarHBondContact O-CD2 3.45Å; D1107-Y1111 PolarHBondContact O-N 3.13Å
1108L90.8Very high88.1Confident1 Ų133.5 Ų33.51%0.00516%0.163CC..Hα-helixtrans-62.1-45.4174.218065.9000111.6V1035 F1069 C1073 V1076 L1084 L1104 N1106 Y1111 R1112V1035-L1108 HydrophobicContact CG1-CD2 4.06Å; V1035-L1108 HydrophobicContact CG2-CD2 3.83Å; F1069-L1108 HydrophobicContact CE1-CD2 4.49Å; C1073-L1108 HydrophobicContact CB-CD1 4.16Å; V1076-L1108 HydrophobicContact CG1-CD1 3.88Å; V1076-L1108 HydrophobicContact CG2-CD1 4.05Å; L1084-L1108 HydrophobicContact CD1-CB 4.35Å; L1084-L1108 HydrophobicContact CD1-CD1 3.76Å; L1104-L1108 WeakPolarHBondContact O-CB 3.35Å; L1104-L1108 PolarHBondContact O-N 3.39Å; N1106-L1108 PolarHBondContact O-N 3.27Å; L1108-Y1111 PolarHBondContact O-N 3.26Å; L1108-R1112 WeakPolarHBondContact O-CG 3.32Å; L1108-R1112 PolarHBondContact O-N 2.59Å
1109R88.8Confident86.7Confident33 Ų3334.9 Ų34.913%0.12517%0.173CC..Hα-helixtrans-61.8-43.8175.1-76175.7170.8155.57.6112.5E162 L1034 V1035 V1105 N1106 Y1111 R1112 L1113E162-R1109 IonicContact OE1-NH1 2.93Å; E162-R1109 IonicContact OE2-CZ 3.75Å; E162-R1109 IonicContact OE2-NE 3.31Å; E162-R1109 IonicContact OE2-NH1 2.6Å; E162-R1109 PolarHBondContact OE2-NH1 3.22Å; L1034-R1109 VanDerWaalsContact O-CZ 3.3Å; L1034-R1109 PolarHBondContact O-NH2 3.28Å; V1035-R1109 VanDerWaalsContact O-CZ 3.25Å; V1035-R1109 PolarHBondContact O-NE 3.37Å; V1035-R1109 PolarHBondContact O-NH2 3.36Å; V1105-R1109 WeakPolarHBondContact O-CG 3.39Å; V1105-R1109 PolarHBondContact O-N 3.03Å; V1105-R1109 VanDerWaalsContact O-N 3.11Å; N1106-R1109 PolarHBondContact O-N 3.31Å; R1109-Y1111 VanDerWaalsContact C-N 3.32Å; R1109-Y1111 PolarHBondContact O-N 2.76Å; R1109-R1112 PolarHBondContact O-N 2.59Å; R1109-L1113 WeakPolarHBondContact O-CB 3.3Å; R1109-L1113 PolarHBondContact O-N 3.15Å
1110Y87.8Confident85Confident20 Ų2036 Ų368%0.07819%0.19CC..Hα-helixtrans-57-46.5177.3169-110.8000111.3D163 N1106 D1107 L1113 C1114D163-Y1110 WeakPolarHBondContact O-CD2 3.41Å; D163-Y1110 WeakPolarHBondContact O-CE2 3.46Å; N1106-Y1110 WeakPolarHBondContact O-CB 3.41Å; N1106-Y1110 PolarHBondContact O-N 3.46Å; D1107-Y1110 WeakPolarHBondContact O-CB 3.47Å; D1107-Y1110 PolarHBondContact O-N 3.13Å; Y1110-L1113 PolarHBondContact O-N 3.49Å; Y1110-C1114 VanDerWaalsContact CE2-SG 3.53Å; Y1110-C1114 PolarHBondContact O-N 3.36Å; Y1110-C1114 PolarHBondContact O-SG 2.94Å
1111Y88.1Confident83.3Confident38 Ų3839.1 Ų39.115%0.14923%0.225CC..Hα-helixtrans-65.7-42.3177.6-69.2-48.6000113Q1080 L1084 D1107 L1108 R1109 L1113 C1114 N1115Q1080-Y1111 HydrophobicContact CB-CD2 4.16Å; Q1080-Y1111 HydrophobicContact CB-CE2 4.4Å; Q1080-Y1111 HydrophobicContact CB-CG 4.27Å; Q1080-Y1111 HydrophobicContact CG-CD1 3.93Å; Q1080-Y1111 HydrophobicContact CG-CD2 4.38Å; Q1080-Y1111 HydrophobicContact CG-CE1 4.16Å; Q1080-Y1111 HydrophobicContact CG-CG 4.06Å; L1084-Y1111 HydrophobicContact CD1-CD2 4.1Å; L1084-Y1111 HydrophobicContact CD1-CE2 4.44Å; L1084-Y1111 HydrophobicContact CD2-CD2 3.99Å; L1084-Y1111 HydrophobicContact CD2-CE2 3.8Å; L1084-Y1111 HydrophobicContact CG-CD2 4.07Å; L1084-Y1111 HydrophobicContact CG-CE2 3.92Å; D1107-Y1111 WeakPolarHBondContact O-CD2 3.45Å; D1107-Y1111 PolarHBondContact O-N 3.13Å; L1108-Y1111 PolarHBondContact O-N 3.26Å; R1109-Y1111 VanDerWaalsContact C-N 3.32Å; R1109-Y1111 PolarHBondContact O-N 2.76Å; Y1111-L1113 PolarHBondContact O-N 3.17Å; Y1111-C1114 PolarHBondContact O-N 2.89Å; Y1111-N1115 WeakPolarHBondContact O-CB 3.4Å; Y1111-N1115 PolarHBondContact O-N 3.3Å; Y1111-N1115 PolarHBondContact O-ND2 2.81Å
1112R88.2Confident81.5Confident45 Ų4543 Ų4317%0.1725%0.249CC..Hα-helixtrans-56.9-48.9174.3-75.3-179171.6174.1-0.9111.5D1074 V1076 L1108 R1109 C1114 N1115 D1116D1074-R1112 PolarHBondContact O-NE 3.04Å; D1074-R1112 PolarHBondContact O-NH2 2.77Å; V1076-R1112 HydrophobicContact CG1-CG 4.1Å; L1108-R1112 WeakPolarHBondContact O-CG 3.32Å; L1108-R1112 PolarHBondContact O-N 2.59Å; R1109-R1112 PolarHBondContact O-N 2.59Å; R1112-C1114 VanDerWaalsContact C-N 3.32Å; R1112-C1114 PolarHBondContact O-N 2.68Å; R1112-N1115 PolarHBondContact O-N 3.1Å; R1112-D1116 WeakPolarHBondContact O-CB 3.49Å; R1112-D1116 PolarHBondContact O-N 2.98Å
1113L85.3Confident79.7Confident57 Ų5742 Ų4230%0.29825%0.246SC..Hα-helixtrans-57.6-43.6178.1179.868.1000112.4D163 R1109 Y1110 Y1111 S1117D163-L1113 HydrophobicContact CB-CD2 3.45Å; D163-L1113 VanDerWaalsContact CB-CD2 3.45Å; R1109-L1113 WeakPolarHBondContact O-CB 3.3Å; R1109-L1113 PolarHBondContact O-N 3.15Å; Y1110-L1113 PolarHBondContact O-N 3.49Å; Y1111-L1113 PolarHBondContact O-N 3.17Å; L1113-S1117 WeakPolarHBondContact O-CB 3.33Å; L1113-S1117 PolarHBondContact O-N 3.02Å; L1113-S1117 PolarHBondContact O-OG 2.93Å
1114C81.7Confident77.6Confident8 Ų848.9 Ų48.95%0.05428%0.277CS..Hα-helixtrans-63.6-47.6177.3-66.90000111.1Y1110 Y1111 R1112 S1117 L1118Y1110-C1114 VanDerWaalsContact CE2-SG 3.53Å; Y1110-C1114 PolarHBondContact O-N 3.36Å; Y1110-C1114 PolarHBondContact O-SG 2.94Å; Y1111-C1114 PolarHBondContact O-N 2.89Å; R1112-C1114 VanDerWaalsContact C-N 3.32Å; R1112-C1114 PolarHBondContact O-N 2.68Å; C1114-S1117 PolarHBondContact O-N 3.35Å; C1114-L1118 WeakPolarHBondContact O-CG 3.37Å; C1114-L1118 PolarHBondContact O-N 3.09Å
1115N84.5Confident75.3Confident18 Ų1856.7 Ų56.710%0.09632%0.318CS..Hα-helixtrans-70.4-41.4-174.2-67.5-15000112.7G1075 Q1080 Y1111 R1112 S1117 L1118 V1123G1075-N1115 PolarHBondContact O-ND2 3.02Å; Q1080-N1115 PolarHBondContact NE2-ND2 2.76Å; Q1080-N1115 PolarHBondContact NE2-OD1 3.13Å; Q1080-N1115 VanDerWaalsContact NE2-OD1 3.14Å; Q1080-N1115 PolarHBondContact OE1-ND2 3.46Å; Y1111-N1115 WeakPolarHBondContact O-CB 3.4Å; Y1111-N1115 PolarHBondContact O-N 3.3Å; Y1111-N1115 PolarHBondContact O-ND2 2.81Å; R1112-N1115 PolarHBondContact O-N 3.1Å; N1115-S1117 PolarHBondContact O-N 3.09Å; N1115-S1117 VanDerWaalsContact O-N 3.16Å; N1115-L1118 PolarHBondContact O-N 3.34Å; N1115-L1118 VanDerWaalsContact O-N 3.14Å; N1115-V1123 HydrophobicContact CB-CG2 4.09Å
1116D81.9Confident74.5Confident126 Ų12659.4 Ų59.467%0.67433%0.333SS*.Hα-helixtrans-61.5-22.6176.1-69.1-18.2000112.2R1112R1112-D1116 WeakPolarHBondContact O-CB 3.49Å; R1112-D1116 PolarHBondContact O-N 2.98Å
1117S75.5Confident73.6Confident32 Ų3261.7 Ų61.722%0.22435%0.347CS..THydrogen-bonded Turntrans-93-6.9-178.6-55.50000113.6K74 M75 L1113 C1114 N1115K74-S1117 WeakPolarHBondContact CB-OG 3.43Å; M75-S1117 VanDerWaalsContact CG-O 3.29Å; M75-S1117 WeakPolarHBondContact CG-O 3.41Å; L1113-S1117 WeakPolarHBondContact O-CB 3.33Å; L1113-S1117 PolarHBondContact O-N 3.02Å; L1113-S1117 PolarHBondContact O-OG 2.93Å; C1114-S1117 PolarHBondContact O-N 3.35Å; N1115-S1117 PolarHBondContact O-N 3.09Å; N1115-S1117 VanDerWaalsContact O-N 3.16Å
1118L71.4Confident72.6Confident41 Ų4164.9 Ų64.922%0.21537%0.365CS..SBendtrans-85.3153.6177.6-69.1172.2000111.5C1114 N1115 T1122 V1123C1114-L1118 WeakPolarHBondContact O-CG 3.37Å; C1114-L1118 PolarHBondContact O-N 3.09Å; N1115-L1118 PolarHBondContact O-N 3.34Å; N1115-L1118 VanDerWaalsContact O-N 3.14Å; L1118-T1122 HydrophobicContact CB-CG2 4.37Å; L1118-T1122 HydrophobicContact CD1-CG2 4.24Å; L1118-V1123 HydrophobicContact CD1-CG2 3.78Å
1119P63.9Low71.6Confident54 Ų5468.6 Ų68.635%0.35139%0.386SS..PPolyproline II helixtrans-56.4143.5176.5-2432.9000112.4G1121 T1122P1119-G1121 PolarHBondContact O-N 3.34Å; P1119-T1122 VanDerWaalsContact O-CB 3.29Å; P1119-T1122 WeakPolarHBondContact O-CB 3.48Å; P1119-T1122 PolarHBondContact O-N 2.69Å; P1119-T1122 VanDerWaalsContact O-N 3.08Å; P1119-T1122 PolarHBondContact O-OG1 3.42Å
1120P58.1Low70.5Confident141 Ų14170.9 Ų70.992%0.91640%0.402SS*.THydrogen-bonded Turntrans-52.4127.9179-25.532.7000112.2
1121G56.8Low69.3Low76 Ų7674.3 Ų74.378%0.78442%0.424SS*.THydrogen-bonded Turntrans90.8-1.5-17900000115.9P1119P1119-G1121 PolarHBondContact O-N 3.34Å
1122T56.8Low68Low83 Ų8376.9 Ų76.951%0.50944%0.443SS..SBendtrans-73.1-36174.7-50.10000112L1118 P1119L1118-T1122 HydrophobicContact CB-CG2 4.37Å; L1118-T1122 HydrophobicContact CD1-CG2 4.24Å; P1119-T1122 VanDerWaalsContact O-CB 3.29Å; P1119-T1122 WeakPolarHBondContact O-CB 3.48Å; P1119-T1122 PolarHBondContact O-N 2.69Å; P1119-T1122 VanDerWaalsContact O-N 3.08Å; P1119-T1122 PolarHBondContact O-OG1 3.42Å
1123V53.7Low66.4Low27 Ų2779.3 Ų79.316%0.16446%0.464CS..SBendtrans-97.9120.5174.3-174.50000108D1077 N1115 L1118 L1125D1077-V1123 HydrophobicContact CB-CG1 3.93Å; N1115-V1123 HydrophobicContact CB-CG2 4.09Å; L1118-V1123 HydrophobicContact CD1-CG2 3.78Å; V1123-L1125 HydrophobicContact CG1-CD2 4.3Å; V1123-L1125 HydrophobicContact CG1-CG 4.49Å; V1123-L1125 PolarHBondContact O-N 3.34Å; V1123-L1125 VanDerWaalsContact O-N 3.14Å
1124K49.2Very low64.9Low195 Ų19581.2 Ų81.285%0.84848%0.478SS*.  trans-78.592.6167.8-71-175.2179.3-178.90107.3
1125L44.9Very low63.3Low173 Ų17387.8 Ų87.891%0.90652%0.517SS*.  trans-61.60173.8-70.9169.1000111.5V1123V1123-L1125 HydrophobicContact CG1-CD2 4.3Å; V1123-L1125 HydrophobicContact CG1-CG 4.49Å; V1123-L1125 PolarHBondContact O-N 3.34Å; V1123-L1125 VanDerWaalsContact O-N 3.14Å

Retrieved 1,125 of 1,125 residues in 459.6 ms (Link to these results)

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