A0A077ZBZ6_TRITR Loading...

EGF domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZBZ6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 101 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
1M58.7Low83.5Confident154 Ų154104.3 Ų104.376%0.75960%0.602SS**  0118.20-163.8134.7150.100107.3D3 G4 Y25 E27M1-D3 PolarHBondContact O-N 2.74Å; M1-G4 PolarHBondContact O-N 3.41Å; M1-Y25 HydrophobicContact CE-CG 4.47Å; M1-E27 HydrophobicContact CE-CB 3.78Å
2N71.3Confident83.9Confident80 Ų8098.6 Ų98.643%0.42858%0.583SS.*THydrogen-bonded Turntrans40.632.2178.7-60.2-21.8000117.9G4 F21 C26N2-G4 PolarHBondContact O-N 3.06Å; N2-G4 VanDerWaalsContact O-N 3.15Å; N2-F21 HydrophobicContact CB-CD1 4.36Å; N2-F21 HydrophobicContact CB-CE1 4.29Å; N2-C26 PolarHBondContact ND2-O 3.4Å
3D78.5Confident84.2Confident121 Ų12198.1 Ų98.165%0.64757%0.569SS**THydrogen-bonded Turntrans54.429.9177.4-146.527.5000115M1 K18M1-D3 PolarHBondContact O-N 2.74Å; D3-K18 HydrophobicContact CB-CD 4.18Å; D3-K18 VanDerWaalsContact O-CE 3.32Å; D3-K18 WeakPolarHBondContact O-CE 3.37Å; D3-K18 VanDerWaalsContact OD2-CE 3.26Å; D3-K18 WeakPolarHBondContact OD2-CE 3.36Å; D3-K18 IonicContact OD2-NZ 2.56Å; D3-K18 PolarHBondContact OD2-NZ 3.14Å
4G82.3Confident84.7Confident23 Ų23102.9 Ų102.924%0.23757%0.573CS.*PPolyproline II helixtrans-89.4155.7169.200000112.4M1 N2 I16M1-G4 PolarHBondContact O-N 3.41Å; N2-G4 PolarHBondContact O-N 3.06Å; N2-G4 VanDerWaalsContact O-N 3.15Å; G4-I16 CarbonylContact C-O 3.55Å; G4-I16 WeakPolarHBondContact CA-O 3.43Å
5T90.3Very high85.2Confident86 Ų8696.9 Ų96.953%0.52854%0.54SS..EExtended strand (participates in β ladder)trans-103.1117.6179.4-56.40000110.1L7 C15 I16T5-L7 HydrophobicContact CG2-CD2 4.06Å; T5-C15 WeakPolarHBondContact O-CA 3.24Å; T5-I16 PolarHBondContact N-O 3.33Å; T5-I16 PolarHBondContact O-N 2.96Å
6C91.8Very high85.6Confident76 Ų7696.4 Ų96.451%0.51454%0.535SS..EExtended strand (participates in β ladder)trans-97.8123.8176.5-56.70000111.1C15C6-C15 HydrophobicContact CB-CB 4.15Å; C6-C15 WeakPolarHBondContact CB-SG 3.36Å; C6-C15 WeakPolarHBondContact SG-CB 3.31Å; C6-C15 CovalentContact SG-SG 2.05Å; C6-C15 PolarHBondContact SG-SG 2.97Å
7L91Very high85.9Confident91 Ų9193 Ų9348%0.47652%0.519SS..EExtended strand (participates in β ladder)trans-107139.2-179.8-58.6175.4000109.6T5 V9 F13 R14 I16T5-L7 HydrophobicContact CG2-CD2 4.06Å; L7-V9 PolarHBondContact O-N 2.96Å; L7-F13 WeakPolarHBondContact O-CA 3.41Å; L7-R14 PolarHBondContact N-O 3.37Å; L7-R14 PolarHBondContact O-N 2.75Å; L7-I16 HydrophobicContact CD1-CD1 3.91Å
8N90.5Very high86.1Confident151 Ų15193.2 Ų93.281%0.80751%0.513SS*.EExtended strand (participates in β ladder)trans-80.2117.3170.3-156.85.4000108.1G12N8-G12 PolarHBondContact OD1-O 3.22Å
9V89.9Confident86.1Confident67 Ų6793.6 Ų93.641%0.40652%0.521SS..EExtended strand (participates in β ladder)trans-108.2163.2178.3-67.50000109L7 D11 G12 R14L7-V9 PolarHBondContact O-N 2.96Å; V9-D11 PolarHBondContact O-N 3.33Å; V9-G12 CarbonylContact C-O 3.42Å; V9-G12 VanDerWaalsContact CG2-O 3.28Å; V9-G12 WeakPolarHBondContact CG2-O 3.34Å; V9-G12 PolarHBondContact N-O 3.38Å; V9-G12 PolarHBondContact O-N 2.99Å; V9-G12 VanDerWaalsContact O-N 3.1Å; V9-R14 HydrophobicContact CG1-CB 4.27Å; V9-R14 HydrophobicContact CG2-CB 4.29Å
10S88.3Confident86.2Confident139 Ų13996 Ų9697%0.97252%0.523SS*.THydrogen-bonded Turntrans-56.7-22-174.151.80000114.8
11D85.5Confident86.4Confident159 Ų15994.4 Ų94.485%0.8551%0.511SS*.THydrogen-bonded Turntrans-118.228.9-177.5-163.833.1000112.6V9V9-D11 PolarHBondContact O-N 3.33Å
12G88.5Confident87.9Confident36 Ų3691.1 Ų91.137%0.37149%0.492SS..EExtended strand (participates in β ladder)trans127.1-141.2176.800000113.3N8 V9N8-G12 PolarHBondContact OD1-O 3.22Å; V9-G12 CarbonylContact C-O 3.42Å; V9-G12 VanDerWaalsContact CG2-O 3.28Å; V9-G12 WeakPolarHBondContact CG2-O 3.34Å; V9-G12 PolarHBondContact N-O 3.38Å; V9-G12 PolarHBondContact O-N 2.99Å; V9-G12 VanDerWaalsContact O-N 3.1Å
13F88.6Confident88.8Confident92 Ų9288.9 Ų88.940%0.40449%0.488SS..EExtended strand (participates in β ladder)trans-120.2146.8178.272-82.9000110.9L7 I24 Y25L7-F13 WeakPolarHBondContact O-CA 3.41Å; F13-I24 HydrophobicContact CE2-CG2 3.5Å; F13-I24 VanDerWaalsContact CE2-CG2 3.5Å; F13-I24 HydrophobicContact CZ-CG2 3.39Å; F13-Y25 HydrophobicContact CD2-CE1 4.31Å; F13-Y25 HydrophobicContact CE1-CE1 4.25Å; F13-Y25 AromaticContact CE2-CD1 3.7Å; F13-Y25 HydrophobicContact CE2-CD1 3.7Å; F13-Y25 AromaticContact CE2-CE1 3.27Å; F13-Y25 HydrophobicContact CE2-CE1 3.27Å; F13-Y25 AromaticContact CE2-CZ 3.83Å; F13-Y25 HydrophobicContact CZ-CD1 4.09Å; F13-Y25 AromaticContact CZ-CE1 3.25Å; F13-Y25 HydrophobicContact CZ-CE1 3.25Å; F13-Y25 HydrophobicContact CZ-CE2 4.17Å; F13-Y25 AromaticContact CZ-CZ 3.31Å; F13-Y25 VanDerWaalsContact CZ-OH 3.25Å; F13-Y25 WeakPolarHBondContact CZ-OH 3.39Å
14R90.3Very high89.3Confident166 Ų16688.5 Ų88.563%0.62649%0.485SS*.EExtended strand (participates in β ladder)trans-131124173.8-170.4174.7-171.3-81.5-1.3110L7 V9L7-R14 PolarHBondContact N-O 3.37Å; L7-R14 PolarHBondContact O-N 2.75Å; V9-R14 HydrophobicContact CG1-CB 4.27Å; V9-R14 HydrophobicContact CG2-CB 4.29Å
15C92.5Very high89.6Confident12 Ų1293 Ų938%0.08150%0.496CS..EExtended strand (participates in β ladder)trans-92.5134.8174.8-58.10000111.5T5 C6 I24T5-C15 WeakPolarHBondContact O-CA 3.24Å; C6-C15 HydrophobicContact CB-CB 4.15Å; C6-C15 WeakPolarHBondContact CB-SG 3.36Å; C6-C15 WeakPolarHBondContact SG-CB 3.31Å; C6-C15 CovalentContact SG-SG 2.05Å; C6-C15 PolarHBondContact SG-SG 2.97Å; C15-I24 WeakPolarHBondContact CB-O 3.44Å; C15-I24 PolarHBondContact SG-O 2.99Å
16I91.2Very high89.7Confident90 Ų9089 Ų8946%0.46247%0.471SS..EExtended strand (participates in β ladder)trans-93.1113.7169-57.8175.5000106.9G4 T5 L7G4-I16 CarbonylContact C-O 3.55Å; G4-I16 WeakPolarHBondContact CA-O 3.43Å; T5-I16 PolarHBondContact N-O 3.33Å; T5-I16 PolarHBondContact O-N 2.96Å; L7-I16 HydrophobicContact CD1-CD1 3.91Å
17C91.6Very high89.6Confident38 Ų3889.3 Ų89.326%0.25747%0.465SS..PPolyproline II helixtrans-89.3147.9-178.9-52.60000111.5F21 C26C17-F21 HydrophobicContact CB-CB 4.12Å; C17-F21 VanDerWaalsContact CB-O 3.27Å; C17-F21 WeakPolarHBondContact CB-O 3.47Å; C17-C26 WeakPolarHBondContact CA-SG 3.42Å; C17-C26 HydrophobicContact CB-CB 3.68Å; C17-C26 WeakPolarHBondContact CB-SG 3.43Å; C17-C26 WeakPolarHBondContact SG-CA 3.34Å; C17-C26 WeakPolarHBondContact SG-CB 3.5Å; C17-C26 CovalentContact SG-SG 2.03Å; C17-C26 PolarHBondContact SG-SG 3.34Å
18K88.7Confident89.6Confident96 Ų9689.7 Ų89.742%0.41746%0.464SS..PPolyproline II helixtrans-64.2159.9167.6-76-169.6174.7-175.20110.8D3 Y20 F21D3-K18 HydrophobicContact CB-CD 4.18Å; D3-K18 VanDerWaalsContact O-CE 3.32Å; D3-K18 WeakPolarHBondContact O-CE 3.37Å; D3-K18 VanDerWaalsContact OD2-CE 3.26Å; D3-K18 WeakPolarHBondContact OD2-CE 3.36Å; D3-K18 IonicContact OD2-NZ 2.56Å; D3-K18 PolarHBondContact OD2-NZ 3.14Å; K18-Y20 PolarHBondContact O-N 3.34Å; K18-F21 HydrophobicContact CB-CD2 4.28Å; K18-F21 PolarHBondContact O-N 3.39Å; K18-F21 VanDerWaalsContact O-N 3.13Å
19P86.8Confident89.5Confident101 Ų10188.3 Ų88.366%0.65646%0.455SS*.THydrogen-bonded Turntrans-48.1144.7169.5-25.834.3000111F21P19-F21 VanDerWaalsContact C-N 3.27Å; P19-F21 WeakPolarHBondContact O-CD2 3.44Å; P19-F21 PolarHBondContact O-N 3.11Å
20Y87.6Confident89.3Confident142 Ų14288.8 Ų88.856%0.55745%0.453SS*.THydrogen-bonded Turntrans70.48.4-176.4-39.9-75.3000116.2K18 I29 E30 V32K18-Y20 PolarHBondContact O-N 3.34Å; Y20-I29 CarbonylContact O-C 3.57Å; Y20-I29 WeakPolarHBondContact O-CA 3.23Å; Y20-E30 VanDerWaalsContact CA-O 3.28Å; Y20-E30 WeakPolarHBondContact CA-O 3.28Å; Y20-E30 WeakPolarHBondContact CB-O 3.35Å; Y20-E30 PolarHBondContact O-N 2.98Å; Y20-V32 HydrophobicContact CD1-CB 4.1Å; Y20-V32 HydrophobicContact CD1-CG2 4.19Å; Y20-V32 HydrophobicContact CE1-CB 4.12Å
21F90.1Very high89.1Confident62 Ų6289.2 Ų89.227%0.27244%0.443SS..EExtended strand (participates in β ladder)trans-125.4143.2173.3-66.6-88.8000111.4N2 C17 K18 P19 C26 Q28 I29N2-F21 HydrophobicContact CB-CD1 4.36Å; N2-F21 HydrophobicContact CB-CE1 4.29Å; C17-F21 HydrophobicContact CB-CB 4.12Å; C17-F21 VanDerWaalsContact CB-O 3.27Å; C17-F21 WeakPolarHBondContact CB-O 3.47Å; K18-F21 HydrophobicContact CB-CD2 4.28Å; K18-F21 PolarHBondContact O-N 3.39Å; K18-F21 VanDerWaalsContact O-N 3.13Å; P19-F21 VanDerWaalsContact C-N 3.27Å; P19-F21 WeakPolarHBondContact O-CD2 3.44Å; P19-F21 PolarHBondContact O-N 3.11Å; F21-C26 HydrophobicContact CB-CB 4.31Å; F21-Q28 CarbonylContact C-O 3.53Å; F21-Q28 VanDerWaalsContact CA-O 3.26Å; F21-Q28 WeakPolarHBondContact CA-O 3.29Å; F21-I29 HydrophobicContact CD1-CG1 4.04Å; F21-I29 HydrophobicContact CE1-CD1 4.43Å; F21-I29 HydrophobicContact CE1-CG1 3.63Å; F21-I29 HydrophobicContact CZ-CG1 4.41Å
22K90.4Very high88.8Confident86 Ų8685.4 Ų85.437%0.37443%0.425SS..EExtended strand (participates in β ladder)trans-143.3174.7176.168.2180171-1690111.2C26 E27 Q28 E30K22-C26 CarbonylContact O-C 3.51Å; K22-C26 WeakPolarHBondContact O-CA 3.3Å; K22-E27 PolarHBondContact O-N 3.09Å; K22-Q28 HydrophobicContact CG-CB 3.82Å; K22-Q28 PolarHBondContact N-O 2.92Å; K22-Q28 WeakPolarHBondContact O-CA 3.39Å; K22-Q28 VanDerWaalsContact O-CB 3.31Å; K22-Q28 WeakPolarHBondContact O-CB 3.49Å; K22-Q28 PolarHBondContact O-N 3.38Å; K22-E30 HydrophobicContact CD-CB 4.04Å; K22-E30 HydrophobicContact CD-CG 4.37Å; K22-E30 HydrophobicContact CG-CB 4.18Å; K22-E30 IonicContact NZ-OE1 2.81Å; K22-E30 PolarHBondContact NZ-OE1 3.1Å
23G90.3Very high88.2Confident32 Ų3293.6 Ų93.633%0.3345%0.445SS..SBendtrans109170.2-175.500000112.4Y25 C26G23-Y25 VanDerWaalsContact C-N 3.25Å; G23-Y25 PolarHBondContact O-N 2.69Å; G23-C26 PolarHBondContact O-N 3.27Å
24I89.1Confident87.2Confident114 Ų11494.8 Ų94.859%0.58546%0.462SS*.THydrogen-bonded Turntrans-65.3-34.5-176.8-66.7173.9000110.6F13 C15 E27F13-I24 HydrophobicContact CE2-CG2 3.5Å; F13-I24 VanDerWaalsContact CE2-CG2 3.5Å; F13-I24 HydrophobicContact CZ-CG2 3.39Å; C15-I24 WeakPolarHBondContact CB-O 3.44Å; C15-I24 PolarHBondContact SG-O 2.99Å; I24-E27 PolarHBondContact N-OE2 3.48Å
25Y88.7Confident86.1Confident118 Ų11895.7 Ų95.746%0.46347%0.471SS..THydrogen-bonded Turntrans-114.315.9178.8-58.6-77000112.6M1 F13 G23 E27M1-Y25 HydrophobicContact CE-CG 4.47Å; F13-Y25 HydrophobicContact CD2-CE1 4.31Å; F13-Y25 HydrophobicContact CE1-CE1 4.25Å; F13-Y25 AromaticContact CE2-CD1 3.7Å; F13-Y25 HydrophobicContact CE2-CD1 3.7Å; F13-Y25 AromaticContact CE2-CE1 3.27Å; F13-Y25 HydrophobicContact CE2-CE1 3.27Å; F13-Y25 AromaticContact CE2-CZ 3.83Å; F13-Y25 HydrophobicContact CZ-CD1 4.09Å; F13-Y25 AromaticContact CZ-CE1 3.25Å; F13-Y25 HydrophobicContact CZ-CE1 3.25Å; F13-Y25 HydrophobicContact CZ-CE2 4.17Å; F13-Y25 AromaticContact CZ-CZ 3.31Å; F13-Y25 VanDerWaalsContact CZ-OH 3.25Å; F13-Y25 WeakPolarHBondContact CZ-OH 3.39Å; G23-Y25 VanDerWaalsContact C-N 3.25Å; G23-Y25 PolarHBondContact O-N 2.69Å; Y25-E27 VanDerWaalsContact C-OE2 3.31Å; Y25-E27 VanDerWaalsContact CA-OE2 3.31Å; Y25-E27 WeakPolarHBondContact CA-OE2 3.36Å; Y25-E27 WeakPolarHBondContact CB-OE2 3.45Å; Y25-E27 PolarHBondContact N-OE2 3.18Å; Y25-E27 PolarHBondContact O-N 3.01Å
26C91.7Very high84.7Confident2 Ų2104 Ų1041%0.01451%0.508CS..SBendtrans5933-173.7-45.40000113.3N2 C17 F21 K22 G23N2-C26 PolarHBondContact ND2-O 3.4Å; C17-C26 WeakPolarHBondContact CA-SG 3.42Å; C17-C26 HydrophobicContact CB-CB 3.68Å; C17-C26 WeakPolarHBondContact CB-SG 3.43Å; C17-C26 WeakPolarHBondContact SG-CA 3.34Å; C17-C26 WeakPolarHBondContact SG-CB 3.5Å; C17-C26 CovalentContact SG-SG 2.03Å; C17-C26 PolarHBondContact SG-SG 3.34Å; F21-C26 HydrophobicContact CB-CB 4.31Å; K22-C26 CarbonylContact O-C 3.51Å; K22-C26 WeakPolarHBondContact O-CA 3.3Å; G23-C26 PolarHBondContact O-N 3.27Å
27E89.4Confident83Confident82 Ų82107.7 Ų107.738%0.38352%0.523SS..  trans-80.7-17.5-176.871.7-74.5175.700113.8M1 K22 I24 Y25M1-E27 HydrophobicContact CE-CB 3.78Å; K22-E27 PolarHBondContact O-N 3.09Å; I24-E27 PolarHBondContact N-OE2 3.48Å; Y25-E27 VanDerWaalsContact C-OE2 3.31Å; Y25-E27 VanDerWaalsContact CA-OE2 3.31Å; Y25-E27 WeakPolarHBondContact CA-OE2 3.36Å; Y25-E27 WeakPolarHBondContact CB-OE2 3.45Å; Y25-E27 PolarHBondContact N-OE2 3.18Å; Y25-E27 PolarHBondContact O-N 3.01Å
28Q91Very high81.3Confident99 Ų99110.3 Ų110.346%0.46354%0.542SS..EExtended strand (participates in β ladder)trans-101.4133.7-176.7-52.8-179.2-17.600110.4F21 K22F21-Q28 CarbonylContact C-O 3.53Å; F21-Q28 VanDerWaalsContact CA-O 3.26Å; F21-Q28 WeakPolarHBondContact CA-O 3.29Å; K22-Q28 HydrophobicContact CG-CB 3.82Å; K22-Q28 PolarHBondContact N-O 2.92Å; K22-Q28 WeakPolarHBondContact O-CA 3.39Å; K22-Q28 VanDerWaalsContact O-CB 3.31Å; K22-Q28 WeakPolarHBondContact O-CB 3.49Å; K22-Q28 PolarHBondContact O-N 3.38Å
29I89.6Confident79.6Confident121 Ų121115.3 Ų115.362%0.62157%0.567SS**EExtended strand (participates in β ladder)trans-83.5126.1170.2-60.9170000108.5Y20 F21 I31Y20-I29 CarbonylContact O-C 3.57Å; Y20-I29 WeakPolarHBondContact O-CA 3.23Å; F21-I29 HydrophobicContact CD1-CG1 4.04Å; F21-I29 HydrophobicContact CE1-CD1 4.43Å; F21-I29 HydrophobicContact CE1-CG1 3.63Å; F21-I29 HydrophobicContact CZ-CG1 4.41Å; I29-I31 HydrophobicContact CG2-CG1 4.37Å
30E86.3Confident78.3Confident78 Ų78120.1 Ų120.136%0.36457%0.573SS.*  trans-101.9105.4169.2-177.1155.7-119.300110Y20 K22 V32Y20-E30 VanDerWaalsContact CA-O 3.28Å; Y20-E30 WeakPolarHBondContact CA-O 3.28Å; Y20-E30 WeakPolarHBondContact CB-O 3.35Å; Y20-E30 PolarHBondContact O-N 2.98Å; K22-E30 HydrophobicContact CD-CB 4.04Å; K22-E30 HydrophobicContact CD-CG 4.37Å; K22-E30 HydrophobicContact CG-CB 4.18Å; K22-E30 IonicContact NZ-OE1 2.81Å; K22-E30 PolarHBondContact NZ-OE1 3.1Å; E30-V32 VanDerWaalsContact C-N 3.32Å; E30-V32 HydrophobicContact CG-CG2 4.05Å; E30-V32 PolarHBondContact O-N 3.35Å
31I83.4Confident76.4Confident147 Ų147118.1 Ų118.175%0.75457%0.567SS**  trans-73.491.5171.9-53.2175.2000107.7I29 R33I29-I31 HydrophobicContact CG2-CG1 4.37Å; I31-R33 PolarHBondContact O-N 2.91Å
32V78.6Confident74.5Confident79 Ų79121 Ų12148%0.47959%0.593SS.*  trans-72.7100.2169-1760000107.1Y20 E30Y20-V32 HydrophobicContact CD1-CB 4.1Å; Y20-V32 HydrophobicContact CD1-CG2 4.19Å; Y20-V32 HydrophobicContact CE1-CB 4.12Å; E30-V32 VanDerWaalsContact C-N 3.32Å; E30-V32 HydrophobicContact CG-CG2 4.05Å; E30-V32 PolarHBondContact O-N 3.35Å
33R77.1Confident72.9Confident208 Ų208120.5 Ų120.579%0.78561%0.605SS**  trans-63.1135.6161.5-65.1-153-67.8-1223.7107.4I31 K35I31-R33 PolarHBondContact O-N 2.91Å; R33-K35 PolarHBondContact O-N 3.31Å; R33-K35 VanDerWaalsContact O-N 3.1Å
34P67.7Low71.2Confident118 Ų118126.6 Ų126.677%0.76663%0.625SS**  trans-50.4124.2173.5-21.730.4000108.6E36P34-E36 PolarHBondContact O-N 3.32Å
35K66.2Low69.7Low185 Ų185127.3 Ų127.380%0.80463%0.63SS**  trans-72.286.2162.3-70.6-174.7-179.7177.40105.3R33 H37R33-K35 PolarHBondContact O-N 3.31Å; R33-K35 VanDerWaalsContact O-N 3.1Å; K35-H37 PolarHBondContact O-N 3.11Å
36E62.5Low68.2Low185 Ų185124.4 Ų124.486%0.86463%0.63SS**  trans-57.7104172.8-159.7173.7-173.800107P34 S38P34-E36 PolarHBondContact O-N 3.32Å; E36-S38 PolarHBondContact O-N 3.49Å
37H55.7Low66.8Low169 Ų169133 Ų13378%0.78267%0.667SS**  trans29.174.9175.9-73.2-163000116.2K35 E39K35-H37 PolarHBondContact O-N 3.11Å; H37-E39 VanDerWaalsContact C-N 3.31Å; H37-E39 PolarHBondContact O-N 2.87Å
38S56.5Low65.4Low92 Ų92133 Ų13364%0.64367%0.674SS**THydrogen-bonded Turntrans-86.714.2175.9179.10000114.5E36E36-S38 PolarHBondContact O-N 3.49Å
39E53.4Low64.4Low202 Ų202131.9 Ų131.994%0.94467%0.674SS**THydrogen-bonded Turntrans-102.8-0.8169.5-114.5171.2159.300112.9H37H37-E39 VanDerWaalsContact C-N 3.31Å; H37-E39 PolarHBondContact O-N 2.87Å
40Y58.2Low63.8Low201 Ų201132 Ų13279%0.78867%0.673SS**SBendtrans-114.559.2168.9-168-103.2000110.7
41F48.1Very low63.8Low100 Ų100135.6 Ų135.644%0.43969%0.688SS.*  trans-157.8117.5167.5-150.3-126.9000112.4A43 Q44 A46F41-A43 VanDerWaalsContact CZ-C 3.47Å; F41-Q44 WeakPolarHBondContact CE2-O 3.47Å; F41-Q44 WeakPolarHBondContact CZ-O 3.41Å; F41-A46 HydrophobicContact CE2-CB 4.42Å
42P51.5Low63.9Low123 Ų123131.4 Ų131.480%0.79968%0.676SS**SBend-78.6126.712732.4-22.4000107.9
43A56.5Low64.3Low76 Ų76130.9 Ų130.963%0.62867%0.672SS**SBendtrans-0.6138.2167.100000120.5F41F41-A43 VanDerWaalsContact CZ-C 3.47Å
44Q54.4Low65Low160 Ų160124.4 Ų124.475%0.74866%0.656SS**SBendtrans87.1127.2168.6-53.6170.112.300119F41F41-Q44 WeakPolarHBondContact CE2-O 3.47Å; F41-Q44 WeakPolarHBondContact CZ-O 3.41Å
45D56.3Low66.2Low129 Ų129123.9 Ų123.969%0.6965%0.645SS**  trans-49.2125.6-151.8-53-80.6000117.6K47 P48D45-K47 PolarHBondContact O-N 3.01Å; D45-P48 WeakPolarHBondContact O-CD 3.35Å
46A57.7Low67.5Low57 Ų57117.4 Ų117.447%0.47163%0.626SS.*Hα-helixtrans-82.111.1-170.500000117F41F41-A46 HydrophobicContact CE2-CB 4.42Å
47K62.5Low69Low183 Ų183112.7 Ų112.780%0.79661%0.611SS**Hα-helixtrans-83.1-46.1176.4-68.1179.1-176.3170.90113.8D45 F51D45-K47 PolarHBondContact O-N 3.01Å; K47-F51 WeakPolarHBondContact O-CD2 3.28Å
48P60.4Low71Confident82 Ų82108.8 Ų108.853%0.53260%0.595SS.*Hα-helixtrans-75.5-2317527.7-36.2000114.2D45 M50 F51 A52D45-P48 WeakPolarHBondContact O-CD 3.35Å; P48-M50 VanDerWaalsContact C-N 3.32Å; P48-M50 PolarHBondContact O-N 3.49Å; P48-F51 PolarHBondContact O-N 3.23Å; P48-A52 PolarHBondContact O-N 3.32Å
49V70.3Confident72.9Confident75 Ų75107.1 Ų107.146%0.45558%0.583SS.*Hα-helixtrans-63.1-37.8-176.4-178.90000111.7F51 A52 T53V49-F51 PolarHBondContact O-N 3.47Å; V49-A52 PolarHBondContact O-N 3.4Å; V49-T53 HydrophobicContact CG1-CG2 4.23Å; V49-T53 WeakPolarHBondContact O-CG2 3.2Å; V49-T53 PolarHBondContact O-N 2.88Å; V49-T53 PolarHBondContact O-OG1 3.47Å
50M75.9Confident75Confident124 Ų124103.1 Ų103.161%0.61157%0.567SS**Hα-helixtrans-63.4-40.8177-64.3-57.3-6600112.5P48 T53 V54P48-M50 VanDerWaalsContact C-N 3.32Å; P48-M50 PolarHBondContact O-N 3.49Å; M50-T53 PolarHBondContact O-OG1 2.85Å; M50-V54 WeakPolarHBondContact O-CB 3.34Å; M50-V54 WeakPolarHBondContact O-CG2 3.4Å; M50-V54 PolarHBondContact O-N 3.45Å; M50-V54 VanDerWaalsContact O-N 3.14Å
51F86.4Confident76.8Confident152 Ų152100.9 Ų100.967%0.66756%0.562SS**Hα-helixtrans-68.6-41.6176.4-66.4-73.9000111.3K47 P48 V49 T53 V54 I55K47-F51 WeakPolarHBondContact O-CD2 3.28Å; P48-F51 PolarHBondContact O-N 3.23Å; V49-F51 PolarHBondContact O-N 3.47Å; F51-T53 PolarHBondContact O-N 2.93Å; F51-V54 PolarHBondContact O-N 3.02Å; F51-I55 WeakPolarHBondContact O-CB 3.22Å; F51-I55 WeakPolarHBondContact O-CD1 3.39Å; F51-I55 WeakPolarHBondContact O-CG1 3.43Å; F51-I55 PolarHBondContact O-N 3.03Å
52A86.9Confident79.2Confident60 Ų60100.6 Ų100.650%0.49656%0.564SS.*Hα-helixtrans-62.1-43.9178.700000112.1P48 V49 I55 A56P48-A52 PolarHBondContact O-N 3.32Å; V49-A52 PolarHBondContact O-N 3.4Å; A52-I55 PolarHBondContact O-N 3.41Å; A52-A56 WeakPolarHBondContact O-CB 3.29Å; A52-A56 PolarHBondContact O-N 3.43Å
53T86.2Confident81.4Confident67 Ų6799 Ų9941%0.41156%0.555SS.*Hα-helixtrans-66.4-41.2177.955.90000111.8V49 M50 F51 A56 T57V49-T53 HydrophobicContact CG1-CG2 4.23Å; V49-T53 WeakPolarHBondContact O-CG2 3.2Å; V49-T53 PolarHBondContact O-N 2.88Å; V49-T53 PolarHBondContact O-OG1 3.47Å; M50-T53 PolarHBondContact O-OG1 2.85Å; F51-T53 PolarHBondContact O-N 2.93Å; T53-A56 PolarHBondContact O-N 3Å; T53-T57 WeakPolarHBondContact O-CG2 3.42Å; T53-T57 PolarHBondContact O-N 3.49Å; T53-T57 PolarHBondContact O-OG1 2.92Å
54V91.4Very high83.4Confident73 Ų7399.2 Ų99.244%0.44255%0.551SS.*Hα-helixtrans-65.1-43.2176.8171.80000111.9M50 F51 A56 T57 I58M50-V54 WeakPolarHBondContact O-CB 3.34Å; M50-V54 WeakPolarHBondContact O-CG2 3.4Å; M50-V54 PolarHBondContact O-N 3.45Å; M50-V54 VanDerWaalsContact O-N 3.14Å; F51-V54 PolarHBondContact O-N 3.02Å; V54-A56 VanDerWaalsContact C-N 3.31Å; V54-A56 PolarHBondContact O-N 3.43Å; V54-T57 PolarHBondContact O-N 2.85Å; V54-T57 PolarHBondContact O-OG1 2.94Å; V54-I58 HydrophobicContact CG1-CD1 3.77Å; V54-I58 VanDerWaalsContact O-CG1 3.26Å; V54-I58 WeakPolarHBondContact O-CG1 3.29Å; V54-I58 PolarHBondContact O-N 3.2Å
55I93.4Very high85.5Confident106 Ų10697.1 Ų97.154%0.54454%0.539SS..Hα-helixtrans-63.5-40.9176.5-68.5164.6000110.5F51 A52 I58 S59F51-I55 WeakPolarHBondContact O-CB 3.22Å; F51-I55 WeakPolarHBondContact O-CD1 3.39Å; F51-I55 WeakPolarHBondContact O-CG1 3.43Å; F51-I55 PolarHBondContact O-N 3.03Å; A52-I55 PolarHBondContact O-N 3.41Å; I55-I58 PolarHBondContact O-N 3.26Å; I55-S59 VanDerWaalsContact O-CB 3.29Å; I55-S59 WeakPolarHBondContact O-CB 3.22Å; I55-S59 PolarHBondContact O-N 2.93Å; I55-S59 PolarHBondContact O-OG 2.93Å
56A94.2Very high87.5Confident49 Ų4994.5 Ų94.541%0.40553%0.528SS..Hα-helixtrans-63.3-43.8178.500000112.1A52 T53 V54 S59 L60A52-A56 WeakPolarHBondContact O-CB 3.29Å; A52-A56 PolarHBondContact O-N 3.43Å; T53-A56 PolarHBondContact O-N 3Å; V54-A56 VanDerWaalsContact C-N 3.31Å; V54-A56 PolarHBondContact O-N 3.43Å; A56-S59 PolarHBondContact O-N 3Å; A56-L60 WeakPolarHBondContact O-CG 3.46Å; A56-L60 PolarHBondContact O-N 3.44Å
57T94Very high89.4Confident87 Ų8793.2 Ų93.253%0.53452%0.52SS..Hα-helixtrans-67.3-40.2177.955.80000112.3T53 V54 L60 F61T53-T57 WeakPolarHBondContact O-CG2 3.42Å; T53-T57 PolarHBondContact O-N 3.49Å; T53-T57 PolarHBondContact O-OG1 2.92Å; V54-T57 PolarHBondContact O-N 2.85Å; V54-T57 PolarHBondContact O-OG1 2.94Å; T57-L60 PolarHBondContact O-N 3.45Å; T57-F61 WeakPolarHBondContact O-CB 3.47Å; T57-F61 PolarHBondContact O-N 2.91Å
58I96.2Very high91.1Very high87 Ų8789.5 Ų89.545%0.44651%0.507SS..Hα-helixtrans-63.2-43.5174.9-68.8168.8000110.6V54 I55 L60 F61 I62V54-I58 HydrophobicContact CG1-CD1 3.77Å; V54-I58 VanDerWaalsContact O-CG1 3.26Å; V54-I58 WeakPolarHBondContact O-CG1 3.29Å; V54-I58 PolarHBondContact O-N 3.2Å; I55-I58 PolarHBondContact O-N 3.26Å; I58-L60 PolarHBondContact O-N 2.9Å; I58-F61 PolarHBondContact O-N 3.45Å; I58-I62 HydrophobicContact CG2-CD1 3.59Å; I58-I62 HydrophobicContact CG2-CG1 4.23Å; I58-I62 VanDerWaalsContact O-CG1 3.29Å; I58-I62 WeakPolarHBondContact O-CG1 3.34Å; I58-I62 PolarHBondContact O-N 3.2Å
59S96.8Very high92.8Very high57 Ų5789.6 Ų89.640%0.39950%0.501SS..Hα-helixtrans-62.2-45179.7-620000111.4I55 A56 F61 I62 C63I55-S59 VanDerWaalsContact O-CB 3.29Å; I55-S59 WeakPolarHBondContact O-CB 3.22Å; I55-S59 PolarHBondContact O-N 2.93Å; I55-S59 PolarHBondContact O-OG 2.93Å; A56-S59 PolarHBondContact O-N 3Å; S59-F61 VanDerWaalsContact C-N 3.35Å; S59-F61 PolarHBondContact O-N 3.15Å; S59-I62 PolarHBondContact O-N 3.24Å; S59-C63 WeakPolarHBondContact O-CB 3.45Å; S59-C63 PolarHBondContact O-N 2.94Å; S59-C63 PolarHBondContact O-SG 3.22Å
60L97Very high94.1Very high118 Ų11890.9 Ų90.962%0.61850%0.504SS*.Hα-helixtrans-60.5-43.9173.5-71.9172.9000111.9A56 T57 I58 C63 C64A56-L60 WeakPolarHBondContact O-CG 3.46Å; A56-L60 PolarHBondContact O-N 3.44Å; T57-L60 PolarHBondContact O-N 3.45Å; I58-L60 PolarHBondContact O-N 2.9Å; L60-C63 PolarHBondContact O-N 2.91Å; L60-C64 WeakPolarHBondContact O-CB 3.26Å; L60-C64 PolarHBondContact O-N 3.3Å; L60-C64 PolarHBondContact O-SG 2.84Å
61F97.7Very high95Very high154 Ų15489.5 Ų89.568%0.67550%0.498SS*.Hα-helixtrans-63.2-44179.3-169.1-98.2000112.2T57 I58 S59 C64 F65T57-F61 WeakPolarHBondContact O-CB 3.47Å; T57-F61 PolarHBondContact O-N 2.91Å; I58-F61 PolarHBondContact O-N 3.45Å; S59-F61 VanDerWaalsContact C-N 3.35Å; S59-F61 PolarHBondContact O-N 3.15Å; F61-C64 PolarHBondContact O-N 2.91Å; F61-F65 WeakPolarHBondContact O-CB 3.35Å; F61-F65 PolarHBondContact O-N 2.73Å
62I97.9Very high95.4Very high93 Ų9387.3 Ų87.348%0.47749%0.49SS..Hα-helixtrans-64.5-46.2176.3-67.2170.6000110.5I58 S59 C64 F65 V66I58-I62 HydrophobicContact CG2-CD1 3.59Å; I58-I62 HydrophobicContact CG2-CG1 4.23Å; I58-I62 VanDerWaalsContact O-CG1 3.29Å; I58-I62 WeakPolarHBondContact O-CG1 3.34Å; I58-I62 PolarHBondContact O-N 3.2Å; S59-I62 PolarHBondContact O-N 3.24Å; I62-C64 VanDerWaalsContact C-N 3.33Å; I62-C64 PolarHBondContact O-N 3.45Å; I62-F65 PolarHBondContact O-N 3.4Å; I62-V66 HydrophobicContact CG2-CG2 4.28Å; I62-V66 WeakPolarHBondContact O-CB 3.39Å; I62-V66 WeakPolarHBondContact O-CG2 3.43Å; I62-V66 PolarHBondContact O-N 3.36Å
63C97.9Very high95.8Very high89 Ų8990.8 Ų90.860%0.60150%0.496SS*.Hα-helixtrans-59.2-43.5176.5-73.10000111.8S59 L60 G67S59-C63 WeakPolarHBondContact O-CB 3.45Å; S59-C63 PolarHBondContact O-N 2.94Å; S59-C63 PolarHBondContact O-SG 3.22Å; L60-C63 PolarHBondContact O-N 2.91Å; C63-G67 PolarHBondContact O-N 3.49Å
64C97.9Very high96.2Very high81 Ų8191.1 Ų91.155%0.54750%0.498SS..Hα-helixtrans-63-45175.1-72.70000111.6L60 F61 I62 G67 M68L60-C64 WeakPolarHBondContact O-CB 3.26Å; L60-C64 PolarHBondContact O-N 3.3Å; L60-C64 PolarHBondContact O-SG 2.84Å; F61-C64 PolarHBondContact O-N 2.91Å; I62-C64 VanDerWaalsContact C-N 3.33Å; I62-C64 PolarHBondContact O-N 3.45Å; C64-G67 PolarHBondContact O-N 2.88Å; C64-M68 WeakPolarHBondContact O-CB 3.33Å; C64-M68 VanDerWaalsContact O-CG 3.22Å; C64-M68 WeakPolarHBondContact O-CG 3.32Å; C64-M68 PolarHBondContact O-N 3.48Å
65F98.1Very high96.4Very high117 Ų11793 Ų9351%0.51350%0.502SS..Hα-helixtrans-64.4-46.3-179.8-172.7-99000112F61 I62 M68 M69F61-F65 WeakPolarHBondContact O-CB 3.35Å; F61-F65 PolarHBondContact O-N 2.73Å; I62-F65 PolarHBondContact O-N 3.4Å; F65-M68 PolarHBondContact O-N 2.88Å; F65-M69 HydrophobicContact CD1-CG 4.01Å; F65-M69 HydrophobicContact CE1-CG 3.71Å; F65-M69 HydrophobicContact CE1-SD 4.21Å; F65-M69 HydrophobicContact CZ-CE 4.36Å; F65-M69 HydrophobicContact CZ-CG 4.03Å; F65-M69 HydrophobicContact CZ-SD 4.07Å; F65-M69 WeakPolarHBondContact O-CB 3.12Å; F65-M69 WeakPolarHBondContact O-CG 3.42Å; F65-M69 PolarHBondContact O-N 3.46Å
66V98.4Very high96.4Very high74 Ų7495.8 Ų95.845%0.44851%0.507SS..Hα-helixtrans-63.8-42.4176.3173.50000111I62 M69 I70I62-V66 HydrophobicContact CG2-CG2 4.28Å; I62-V66 WeakPolarHBondContact O-CB 3.39Å; I62-V66 WeakPolarHBondContact O-CG2 3.43Å; I62-V66 PolarHBondContact O-N 3.36Å; V66-M69 PolarHBondContact O-N 2.96Å; V66-I70 HydrophobicContact CG1-CD1 3.81Å; V66-I70 HydrophobicContact CG1-CG1 4.41Å; V66-I70 VanDerWaalsContact O-CG1 3.29Å; V66-I70 WeakPolarHBondContact O-CG1 3.45Å; V66-I70 PolarHBondContact O-N 3.34Å
67G98.1Very high96.5Very high29 Ų2997.9 Ų97.930%0.29951%0.511SS..Hα-helixtrans-59.3-47.7175.200000112.3C63 C64 M69 I70 I71C63-G67 PolarHBondContact O-N 3.49Å; C64-G67 PolarHBondContact O-N 2.88Å; G67-M69 PolarHBondContact O-N 2.88Å; G67-I70 PolarHBondContact O-N 3.41Å; G67-I71 WeakPolarHBondContact O-CD1 3.17Å; G67-I71 VanDerWaalsContact O-CG1 3.23Å; G67-I71 WeakPolarHBondContact O-CG1 3.28Å; G67-I71 PolarHBondContact O-N 3.22Å
68M97.5Very high96.6Very high106 Ų10699.1 Ų99.152%0.52251%0.509SS..Hα-helixtrans-62.4-42175.9-69.9-61.1-66.200112.1C64 F65 I71 Q72C64-M68 WeakPolarHBondContact O-CB 3.33Å; C64-M68 VanDerWaalsContact O-CG 3.22Å; C64-M68 WeakPolarHBondContact O-CG 3.32Å; C64-M68 PolarHBondContact O-N 3.48Å; F65-M68 PolarHBondContact O-N 2.88Å; M68-I71 PolarHBondContact O-N 2.86Å; M68-Q72 WeakPolarHBondContact O-CB 3.44Å; M68-Q72 VanDerWaalsContact O-CG 3.28Å; M68-Q72 WeakPolarHBondContact O-CG 3.12Å; M68-Q72 PolarHBondContact O-N 3.43Å
69M97Very high96.6Very high84 Ų8499.4 Ų99.441%0.41451%0.509SS..Hα-helixtrans-60.9-44.4176-73.8-73.597.800112.2F65 V66 G67 Q72 H73F65-M69 HydrophobicContact CD1-CG 4.01Å; F65-M69 HydrophobicContact CE1-CG 3.71Å; F65-M69 HydrophobicContact CE1-SD 4.21Å; F65-M69 HydrophobicContact CZ-CE 4.36Å; F65-M69 HydrophobicContact CZ-CG 4.03Å; F65-M69 HydrophobicContact CZ-SD 4.07Å; F65-M69 WeakPolarHBondContact O-CB 3.12Å; F65-M69 WeakPolarHBondContact O-CG 3.42Å; F65-M69 PolarHBondContact O-N 3.46Å; V66-M69 PolarHBondContact O-N 2.96Å; G67-M69 PolarHBondContact O-N 2.88Å; M69-Q72 PolarHBondContact O-N 3.4Å; M69-H73 WeakPolarHBondContact O-CB 3.47Å; M69-H73 PolarHBondContact O-N 3.36Å
70I97.2Very high96.6Very high102 Ų10299.9 Ų99.952%0.52351%0.507SS..Hα-helixtrans-62.9-48.1176.6-68.2166.6000110.1V66 G67 Q72 H73 T74V66-I70 HydrophobicContact CG1-CD1 3.81Å; V66-I70 HydrophobicContact CG1-CG1 4.41Å; V66-I70 VanDerWaalsContact O-CG1 3.29Å; V66-I70 WeakPolarHBondContact O-CG1 3.45Å; V66-I70 PolarHBondContact O-N 3.34Å; G67-I70 PolarHBondContact O-N 3.41Å; I70-Q72 PolarHBondContact O-N 2.88Å; I70-H73 PolarHBondContact O-N 2.75Å; I70-T74 WeakPolarHBondContact O-CG2 3.26Å; I70-T74 PolarHBondContact O-N 3.23Å; I70-T74 PolarHBondContact O-OG1 3.22Å
71I96Very high96.6Very high94 Ų9497.9 Ų97.948%0.48250%0.499SS..Hα-helixtrans-59.3-47.4178.8-67.9164.3000110.6G67 M68 H73 T74 E75G67-I71 WeakPolarHBondContact O-CD1 3.17Å; G67-I71 VanDerWaalsContact O-CG1 3.23Å; G67-I71 WeakPolarHBondContact O-CG1 3.28Å; G67-I71 PolarHBondContact O-N 3.22Å; M68-I71 PolarHBondContact O-N 2.86Å; I71-H73 VanDerWaalsContact C-N 3.34Å; I71-H73 PolarHBondContact O-N 3.39Å; I71-T74 WeakPolarHBondContact CA-OG1 3.4Å; I71-T74 PolarHBondContact O-N 2.87Å; I71-T74 PolarHBondContact O-OG1 3.46Å; I71-E75 WeakPolarHBondContact O-CG 3.27Å; I71-E75 PolarHBondContact O-N 3.36Å
72Q94.5Very high96.6Very high107 Ų10794.6 Ų94.650%0.549%0.486SS..Hα-helixtrans-62.8-40.1178.8-75-177.4-43.300112.3M68 M69 I70 E75 Y76M68-Q72 WeakPolarHBondContact O-CB 3.44Å; M68-Q72 VanDerWaalsContact O-CG 3.28Å; M68-Q72 WeakPolarHBondContact O-CG 3.12Å; M68-Q72 PolarHBondContact O-N 3.43Å; M69-Q72 PolarHBondContact O-N 3.4Å; I70-Q72 PolarHBondContact O-N 2.88Å; Q72-E75 PolarHBondContact O-N 3Å; Q72-Y76 VanDerWaalsContact O-CB 3.28Å; Q72-Y76 WeakPolarHBondContact O-CB 3.31Å; Q72-Y76 PolarHBondContact O-N 2.89Å
73H95.1Very high96.6Very high132 Ų13293.5 Ų93.561%0.61148%0.482SS*.Hα-helixtrans-65.8-38.4176.5-169-65.5000111.9M69 I70 I71 Y76 D77M69-H73 WeakPolarHBondContact O-CB 3.47Å; M69-H73 PolarHBondContact O-N 3.36Å; I70-H73 PolarHBondContact O-N 2.75Å; I71-H73 VanDerWaalsContact C-N 3.34Å; I71-H73 PolarHBondContact O-N 3.39Å; H73-Y76 PolarHBondContact O-N 3.46Å; H73-D77 WeakPolarHBondContact O-CB 3.48Å; H73-D77 PolarHBondContact O-N 2.9Å
74T94.3Very high96.6Very high75 Ų7592.9 Ų92.946%0.4647%0.472SS..Hα-helixtrans-67.2-40176.850.40000112.5I70 I71 K78I70-T74 WeakPolarHBondContact O-CG2 3.26Å; I70-T74 PolarHBondContact O-N 3.23Å; I70-T74 PolarHBondContact O-OG1 3.22Å; I71-T74 WeakPolarHBondContact CA-OG1 3.4Å; I71-T74 PolarHBondContact O-N 2.87Å; I71-T74 PolarHBondContact O-OG1 3.46Å; T74-K78 WeakPolarHBondContact O-CB 3.46Å; T74-K78 PolarHBondContact O-N 2.88Å; T74-K78 VanDerWaalsContact O-N 3.15Å
75E94.9Very high96.5Very high113 Ų11394.8 Ų94.853%0.52847%0.473SS..Hα-helixtrans-69-36.7175.4-65.5-61.9149.600111.4I71 Q72 K78 Q79I71-E75 WeakPolarHBondContact O-CG 3.27Å; I71-E75 PolarHBondContact O-N 3.36Å; Q72-E75 PolarHBondContact O-N 3Å; E75-K78 PolarHBondContact O-N 3.49Å; E75-Q79 WeakPolarHBondContact O-CB 3.42Å; E75-Q79 PolarHBondContact O-N 3.42Å
76Y94.8Very high96.5Very high163 Ų16394.5 Ų94.564%0.63947%0.473SS*.Hα-helixtrans-63.2-47.2176.1-179.6-98.4000112.4Q72 H73 K78 Q79 D80Q72-Y76 VanDerWaalsContact O-CB 3.28Å; Q72-Y76 WeakPolarHBondContact O-CB 3.31Å; Q72-Y76 PolarHBondContact O-N 2.89Å; H73-Y76 PolarHBondContact O-N 3.46Å; Y76-K78 VanDerWaalsContact C-N 3.3Å; Y76-K78 PolarHBondContact O-N 2.92Å; Y76-Q79 PolarHBondContact O-N 3.04Å; Y76-D80 PolarHBondContact O-N 3.38Å
77D95.6Very high96.4Very high93 Ų9393.8 Ų93.850%0.49747%0.467SS..Hα-helixtrans-63-38.7177.9-172.352000112H73 D80 T81H73-D77 WeakPolarHBondContact O-CB 3.48Å; H73-D77 PolarHBondContact O-N 2.9Å; D77-D80 PolarHBondContact O-N 3.49Å; D77-T81 WeakPolarHBondContact O-CB 2.99Å; D77-T81 PolarHBondContact O-N 3.49Å; D77-T81 PolarHBondContact O-OG1 2.99Å
78K95.6Very high96.4Very high114 Ų11495.5 Ų95.550%0.49647%0.471SS..Hα-helixtrans-62.8-46.3173.8-173.4-175.7171.9-163.70111.5T74 E75 Y76 T81 E82T74-K78 WeakPolarHBondContact O-CB 3.46Å; T74-K78 PolarHBondContact O-N 2.88Å; T74-K78 VanDerWaalsContact O-N 3.15Å; E75-K78 PolarHBondContact O-N 3.49Å; Y76-K78 VanDerWaalsContact C-N 3.3Å; Y76-K78 PolarHBondContact O-N 2.92Å; K78-T81 PolarHBondContact O-N 3.47Å; K78-E82 WeakPolarHBondContact CE-OE1 3.31Å; K78-E82 WeakPolarHBondContact O-CG 3.24Å; K78-E82 PolarHBondContact O-N 3.31Å
79Q96.4Very high96.4Very high93 Ų9394.7 Ų94.744%0.43547%0.469SS..Hα-helixtrans-63-43.9178.2-173.96548.300111.7E75 Y76 T81 E82 D83E75-Q79 WeakPolarHBondContact O-CB 3.42Å; E75-Q79 PolarHBondContact O-N 3.42Å; Y76-Q79 PolarHBondContact O-N 3.04Å; Q79-T81 VanDerWaalsContact C-N 3.29Å; Q79-T81 PolarHBondContact O-N 3.02Å; Q79-E82 PolarHBondContact O-N 3.01Å; Q79-D83 PolarHBondContact NE2-OD1 3.37Å; Q79-D83 WeakPolarHBondContact O-CB 3.32Å; Q79-D83 VanDerWaalsContact O-CG 3.23Å; Q79-D83 PolarHBondContact O-N 3.16Å
80D96.8Very high96.4Very high67 Ų6796.3 Ų96.336%0.35848%0.477SS..Hα-helixtrans-62.6-37.8177.6-17568.2000111.8Y76 D77 D83 N84Y76-D80 PolarHBondContact O-N 3.38Å; D77-D80 PolarHBondContact O-N 3.49Å; D80-D83 PolarHBondContact O-N 2.93Å; D80-N84 VanDerWaalsContact O-CB 3.24Å; D80-N84 WeakPolarHBondContact O-CB 3.26Å; D80-N84 VanDerWaalsContact O-CG 3.27Å; D80-N84 PolarHBondContact O-N 3.23Å; D80-N84 PolarHBondContact O-ND2 3.32Å; D80-N84 PolarHBondContact OD2-ND2 3.02Å
81T96.9Very high96.4Very high75 Ų7598.8 Ų98.846%0.4648%0.48SS..Hα-helixtrans-63.8-44.8174.5-57.50000111.5D77 K78 Q79 N84 Q85D77-T81 WeakPolarHBondContact O-CB 2.99Å; D77-T81 PolarHBondContact O-N 3.49Å; D77-T81 PolarHBondContact O-OG1 2.99Å; K78-T81 PolarHBondContact O-N 3.47Å; Q79-T81 VanDerWaalsContact C-N 3.29Å; Q79-T81 PolarHBondContact O-N 3.02Å; T81-N84 PolarHBondContact O-N 3.38Å; T81-Q85 WeakPolarHBondContact O-CB 3.12Å; T81-Q85 PolarHBondContact O-N 3.2Å
82E97.4Very high96.4Very high85 Ų8599.6 Ų99.640%0.39749%0.485SS..Hα-helixtrans-63.2-43.4176.6-71.2177178.100111.5K78 Q79 Q85 Q86K78-E82 WeakPolarHBondContact CE-OE1 3.31Å; K78-E82 WeakPolarHBondContact O-CG 3.24Å; K78-E82 PolarHBondContact O-N 3.31Å; Q79-E82 PolarHBondContact O-N 3.01Å; E82-Q85 PolarHBondContact O-N 3.23Å; E82-Q86 VanDerWaalsContact O-CG 3.3Å; E82-Q86 WeakPolarHBondContact O-CG 2.99Å; E82-Q86 PolarHBondContact O-N 3.47Å
83D97.7Very high96.5Very high71 Ų7197.9 Ų97.938%0.3849%0.489SS..Hα-helixtrans-65.8-42177.8-69.1-14.4000111.6Q79 D80 Q86 L87Q79-D83 PolarHBondContact NE2-OD1 3.37Å; Q79-D83 WeakPolarHBondContact O-CB 3.32Å; Q79-D83 VanDerWaalsContact O-CG 3.23Å; Q79-D83 PolarHBondContact O-N 3.16Å; D80-D83 PolarHBondContact O-N 2.93Å; D83-Q86 PolarHBondContact O-N 3.42Å; D83-L87 VanDerWaalsContact O-CB 3.31Å; D83-L87 WeakPolarHBondContact O-CB 3.49Å; D83-L87 PolarHBondContact O-N 3.1Å
84N97.5Very high96.5Very high75 Ų7596.7 Ų96.740%0.40148%0.484SS..Hα-helixtrans-64.5-40.5175.3-80.4-45.8000111.7D80 T81 L87 T88D80-N84 VanDerWaalsContact O-CB 3.24Å; D80-N84 WeakPolarHBondContact O-CB 3.26Å; D80-N84 VanDerWaalsContact O-CG 3.27Å; D80-N84 PolarHBondContact O-N 3.23Å; D80-N84 PolarHBondContact O-ND2 3.32Å; D80-N84 PolarHBondContact OD2-ND2 3.02Å; T81-N84 PolarHBondContact O-N 3.38Å; N84-L87 PolarHBondContact O-N 3.14Å; N84-T88 WeakPolarHBondContact O-CG2 3.21Å; N84-T88 PolarHBondContact O-N 3Å; N84-T88 PolarHBondContact O-OG1 2.93Å
85Q96.9Very high96.6Very high121 Ų12196.2 Ų96.257%0.56548%0.483SS*.Hα-helixtrans-64.1-46176.2-172.9171.8-35.200111T81 E82 L87 T88 D89T81-Q85 WeakPolarHBondContact O-CB 3.12Å; T81-Q85 PolarHBondContact O-N 3.2Å; E82-Q85 PolarHBondContact O-N 3.23Å; Q85-L87 VanDerWaalsContact C-N 3.3Å; Q85-L87 PolarHBondContact O-N 3.28Å; Q85-T88 WeakPolarHBondContact CA-OG1 3.36Å; Q85-T88 PolarHBondContact O-N 2.92Å; Q85-T88 PolarHBondContact O-OG1 2.91Å; Q85-D89 PolarHBondContact O-N 2.92Å
86Q97.3Very high96.6Very high111 Ų11192.6 Ų92.652%0.51948%0.476SS..Hα-helixtrans-59.3-41.5173.8-72.1176.610.600111.9E82 D83 T88 D89 M90E82-Q86 VanDerWaalsContact O-CG 3.3Å; E82-Q86 WeakPolarHBondContact O-CG 2.99Å; E82-Q86 PolarHBondContact O-N 3.47Å; D83-Q86 PolarHBondContact O-N 3.42Å; Q86-T88 PolarHBondContact O-N 2.73Å; Q86-D89 PolarHBondContact O-N 2.82Å; Q86-M90 WeakPolarHBondContact O-CG 3.14Å; Q86-M90 PolarHBondContact O-N 3.06Å
87L97.2Very high96.5Very high60 Ų6091.7 Ų91.731%0.31447%0.473SS..Hα-helixtrans-64.2-38.9177-177.261.2000112.4D83 N84 Q85 M90 R91D83-L87 VanDerWaalsContact O-CB 3.31Å; D83-L87 WeakPolarHBondContact O-CB 3.49Å; D83-L87 PolarHBondContact O-N 3.1Å; N84-L87 PolarHBondContact O-N 3.14Å; Q85-L87 VanDerWaalsContact C-N 3.3Å; Q85-L87 PolarHBondContact O-N 3.28Å; L87-M90 HydrophobicContact CB-CE 4.45Å; L87-M90 HydrophobicContact CD1-CE 4.24Å; L87-R91 VanDerWaalsContact CD2-NH2 3.31Å; L87-R91 WeakPolarHBondContact O-CG 3.25Å; L87-R91 PolarHBondContact O-N 2.81Å; L87-R91 VanDerWaalsContact O-N 3.11Å
88T97.4Very high96.5Very high64 Ų6491.6 Ų91.639%0.39347%0.472SS..Hα-helixtrans-65.7-41174.550.50000112.2N84 Q85 Q86 M90 R91 L92N84-T88 WeakPolarHBondContact O-CG2 3.21Å; N84-T88 PolarHBondContact O-N 3Å; N84-T88 PolarHBondContact O-OG1 2.93Å; Q85-T88 WeakPolarHBondContact CA-OG1 3.36Å; Q85-T88 PolarHBondContact O-N 2.92Å; Q85-T88 PolarHBondContact O-OG1 2.91Å; Q86-T88 PolarHBondContact O-N 2.73Å; T88-M90 VanDerWaalsContact C-N 3.35Å; T88-M90 PolarHBondContact O-N 3.36Å; T88-R91 PolarHBondContact O-N 2.99Å; T88-L92 WeakPolarHBondContact O-CG 3.28Å; T88-L92 PolarHBondContact O-N 3.37Å
89D97.5Very high96.4Very high89 Ų8991 Ų9148%0.47648%0.482SS..Hα-helixtrans-64.4-40.6178.1-68.1-24.4000111.5Q85 Q86 R91 L92 A93Q85-D89 PolarHBondContact O-N 2.92Å; Q86-D89 PolarHBondContact O-N 2.82Å; D89-R91 PolarHBondContact O-N 3.4Å; D89-L92 PolarHBondContact O-N 2.82Å; D89-A93 PolarHBondContact O-N 3.3Å
90M96.7Very high96.2Very high119 Ų11996.1 Ų96.159%0.58650%0.499SS*.Hα-helixtrans-62.2-41.2174.2-72.8-172.9-75.700112.5Q86 L87 T88 A93 Q94Q86-M90 WeakPolarHBondContact O-CG 3.14Å; Q86-M90 PolarHBondContact O-N 3.06Å; L87-M90 HydrophobicContact CB-CE 4.45Å; L87-M90 HydrophobicContact CD1-CE 4.24Å; T88-M90 VanDerWaalsContact C-N 3.35Å; T88-M90 PolarHBondContact O-N 3.36Å; M90-A93 PolarHBondContact O-N 2.89Å; M90-Q94 PolarHBondContact O-N 2.56Å; M90-Q94 VanDerWaalsContact O-N 3.09Å
91R97.6Very high95.5Very high153 Ų15399.2 Ų99.258%0.57753%0.526SS*.Hα-helixtrans-67.5-39.3177.1-72.4172.8-178.1151.9-1112.3L87 T88 D89 Q94 S95L87-R91 VanDerWaalsContact CD2-NH2 3.31Å; L87-R91 WeakPolarHBondContact O-CG 3.25Å; L87-R91 PolarHBondContact O-N 2.81Å; L87-R91 VanDerWaalsContact O-N 3.11Å; T88-R91 PolarHBondContact O-N 2.99Å; D89-R91 PolarHBondContact O-N 3.4Å; R91-Q94 PolarHBondContact O-N 3.13Å; R91-S95 PolarHBondContact O-N 3.5Å
92L96.2Very high95.4Very high112 Ų112100.4 Ų100.459%0.58653%0.529SS*.Hα-helixtrans-64.3-44.1176-70.9173.3000111.2T88 D89 Q94 S95 G96T88-L92 WeakPolarHBondContact O-CG 3.28Å; T88-L92 PolarHBondContact O-N 3.37Å; D89-L92 PolarHBondContact O-N 2.82Å; L92-Q94 VanDerWaalsContact C-N 3.29Å; L92-Q94 PolarHBondContact O-N 3.35Å; L92-S95 PolarHBondContact O-N 3.4Å; L92-S95 PolarHBondContact O-OG 3.38Å; L92-G96 PolarHBondContact O-N 2.03Å
93A96.2Very high95.3Very high71 Ų71101.2 Ų101.259%0.58754%0.536SS*.Hα-helixtrans-57.8-42.4174.600000112D89 M90 G96 Y97D89-A93 PolarHBondContact O-N 3.3Å; M90-A93 PolarHBondContact O-N 2.89Å; A93-G96 PolarHBondContact O-N 3.04Å; A93-Y97 PolarHBondContact O-N 3.15Å; A93-Y97 VanDerWaalsContact O-N 3.1Å
94Q96.1Very high95.2Very high107 Ų107102.9 Ų102.950%0.555%0.545SS..Hα-helixtrans-64.1-45.2176-173.665.84.400112.2M90 R91 L92 G96 Y97 D98M90-Q94 PolarHBondContact O-N 2.56Å; M90-Q94 VanDerWaalsContact O-N 3.09Å; R91-Q94 PolarHBondContact O-N 3.13Å; L92-Q94 VanDerWaalsContact C-N 3.29Å; L92-Q94 PolarHBondContact O-N 3.35Å; Q94-G96 VanDerWaalsContact C-N 3.28Å; Q94-G96 PolarHBondContact O-N 2.78Å; Q94-Y97 WeakPolarHBondContact O-CB 3.38Å; Q94-Y97 PolarHBondContact O-N 3.31Å; Q94-Y97 VanDerWaalsContact O-N 3.11Å; Q94-D98 PolarHBondContact O-N 2.79Å
95S96.1Very high95Very high65 Ų65104.5 Ų104.546%0.45555%0.553SS.*Hα-helixtrans-62.4-35.2178.1700000113R91 L92 S99R91-S95 PolarHBondContact O-N 3.5Å; L92-S95 PolarHBondContact O-N 3.4Å; L92-S95 PolarHBondContact O-OG 3.38Å; S95-S99 PolarHBondContact O-N 2.05Å; S95-S99 VanDerWaalsContact O-N 3.14Å
96G94.1Very high94.9Very high37 Ų37103.5 Ų103.538%0.38155%0.552SS.*Hα-helixtrans-65.4-40.6173.600000112.1L92 A93 Q94 S99 Y100L92-G96 PolarHBondContact O-N 2.03Å; A93-G96 PolarHBondContact O-N 3.04Å; Q94-G96 VanDerWaalsContact C-N 3.28Å; Q94-G96 PolarHBondContact O-N 2.78Å; G96-S99 PolarHBondContact O-N 2.86Å; G96-S99 PolarHBondContact O-OG 3.1Å; G96-Y100 PolarHBondContact O-N 2.88Å
97Y93.7Very high94.8Very high143 Ų143103 Ų10356%0.56156%0.555SS**Hα-helixtrans-63.9-44.9175.2179.8-97.7000112.6A93 Q94 S99 Y100 S101A93-Y97 PolarHBondContact O-N 3.15Å; A93-Y97 VanDerWaalsContact O-N 3.1Å; Q94-Y97 WeakPolarHBondContact O-CB 3.38Å; Q94-Y97 PolarHBondContact O-N 3.31Å; Q94-Y97 VanDerWaalsContact O-N 3.11Å; Y97-S99 PolarHBondContact O-N 2.97Å; Y97-Y100 PolarHBondContact O-N 2.96Å; Y97-S101 PolarHBondContact O-N 3.5Å
98D95.6Very high94.6Very high92 Ų92106.1 Ų106.149%0.49257%0.572SS.*Hα-helixtrans-64.3-30178.8-65.4-26.7000112.2Q94 Y100Q94-D98 PolarHBondContact O-N 2.79Å; D98-Y100 VanDerWaalsContact C-N 3.3Å
99S93.6Very high94.4Very high101 Ų101109.3 Ų109.371%0.70659%0.586SS**Hα-helixtrans-75-16.2174.772.60000114.5S95 G96 Y97S95-S99 PolarHBondContact O-N 2.05Å; S95-S99 VanDerWaalsContact O-N 3.14Å; G96-S99 PolarHBondContact O-N 2.86Å; G96-S99 PolarHBondContact O-OG 3.1Å; Y97-S99 PolarHBondContact O-N 2.97Å
100Y90.9Very high94.1Very high201 Ų201111 Ų11179%0.78860%0.595SS**Hα-helixtrans-93.7-24.2-179.3-178.6-98.2000113.4G96 Y97 D98G96-Y100 PolarHBondContact O-N 2.88Å; Y97-Y100 PolarHBondContact O-N 2.96Å; D98-Y100 VanDerWaalsContact C-N 3.3Å
101S82.5Confident93.9Very high131 Ų131110.3 Ų110.392%0.91660%0.595SS**  trans-81.20177.9-63.50000112.3Y97Y97-S101 PolarHBondContact O-N 3.5Å

Retrieved 101 of 101 residues in 52.5 ms (Link to these results)