X6RHB9_HUMAN Loading...

PITH domain containing 1

AlphaFold DB , UniProt , Accession X6RHB9, Species HUMAN (Homo sapiens, Human), Gene PITHD1, Length 70 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
1M46.8Very low65.2Low239 Ų23998.5 Ų98.5100%1.17755%0.552SS**  0106.30-61.3-67.7-176.700104.3E3M1-E3 PolarHBondContact O-N 3.49Å
2G48.6Very low67.3Low75 Ų7593.4 Ų93.477%0.77352%0.522SS*.  trans-57135.7-174.300000109.9
3E48.5Very low69.2Low173 Ų17391.4 Ų91.481%0.80850%0.501SS*.  trans-51.9147.1-174.2-76.3159.483.900112M1 D5M1-E3 PolarHBondContact O-N 3.49Å; E3-D5 PolarHBondContact O-N 3.3Å
4D55.8Low70.8Confident149 Ų14985.2 Ų85.280%0.79747%0.467SS*.SBendtrans-57.627.1176.7-144.5-108.9000113.7
5D60.5Low72.1Confident102 Ų10279.7 Ų79.755%0.54544%0.437SS..  trans-81.2122.4179.7-159.7-91.6000106.5E3 S7 H8E3-D5 PolarHBondContact O-N 3.3Å; D5-S7 PolarHBondContact O-N 2.91Å; D5-S7 WeakPolarHBondContact OD1-CB 3.47Å; D5-S7 PolarHBondContact OD1-OG 3.07Å; D5-H8 PolarHBondContact O-CD2 3.06Å
6D63.5Low73.3Confident70 Ų7077.7 Ų77.737%0.37442%0.422SS..THydrogen-bonded Turntrans-57.26.8-178.3-60.9-85.3000114.4H8 R38 F67 G68D6-H8 PolarHBondContact O-N 3.43Å; D6-R38 IonicContact OD1-CZ 3.36Å; D6-R38 IonicContact OD1-NH1 3.22Å; D6-R38 PolarHBondContact OD1-NH1 3.46Å; D6-R38 IonicContact OD1-NH2 2.67Å; D6-R38 PolarHBondContact OD1-NH2 2.68Å; D6-F67 CarbonylContact O-C 3.35Å; D6-F67 WeakPolarHBondContact O-CA 3.22Å; D6-F67 PolarHBondContact O-N 2.71Å; D6-F67 VanDerWaalsContact O-N 3.16Å; D6-G68 WeakPolarHBondContact O-CA 3.47Å; D6-G68 PolarHBondContact O-N 3.47Å
7S66.4Low74.3Confident76 Ų7676.9 Ų76.953%0.53142%0.418SS..THydrogen-bonded Turntrans-52.2-6.3163.5-72.30000116.6D5D5-S7 PolarHBondContact O-N 2.91Å; D5-S7 WeakPolarHBondContact OD1-CB 3.47Å; D5-S7 PolarHBondContact OD1-OG 3.07Å
8H74Confident75.1Confident86 Ų8674.2 Ų74.240%0.39840%0.403SS..SBendtrans-60.8134.9174.5-69.5-84.6000111.6D5 D6 S10 N66 F67D5-H8 PolarHBondContact O-CD2 3.06Å; D6-H8 PolarHBondContact O-N 3.43Å; H8-S10 PolarHBondContact O-N 3.25Å; H8-N66 CarbonylContact O-C 3.38Å; H8-N66 WeakPolarHBondContact O-CA 3.05Å; H8-N66 WeakPolarHBondContact O-CB 3.35Å; H8-F67 HydrophobicContact CB-CD2 3.83Å; H8-F67 WeakPolarHBondContact O-CD2 3.41Å; H8-F67 PolarHBondContact O-N 3.15Å
9P78.7Confident75.7Confident51 Ų5174.5 Ų74.533%0.33141%0.409SS..EExtended strand (participates in β ladder)trans-65.413117828.6-35.3000110.6L36 I63 F67P9-L36 HydrophobicContact CB-CD1 3.62Å; P9-L36 HydrophobicContact CG-CD1 3.84Å; P9-L36 WeakPolarHBondContact O-CB 3.44Å; P9-I63 HydrophobicContact CB-CD1 4.46Å; P9-I63 HydrophobicContact CB-CG2 3.62Å; P9-F67 WeakPolarHBondContact O-CE2 3.32Å
10S85.4Confident76.2Confident22 Ų2280.4 Ų80.415%0.15443%0.433CS..EExtended strand (participates in β ladder)trans-106.4-27.7-179.862.40000112.1H8 L36 K65 N66H8-S10 PolarHBondContact O-N 3.25Å; S10-L36 PolarHBondContact O-N 3.47Å; S10-K65 PolarHBondContact N-O 2.93Å; S10-K65 VanDerWaalsContact OG-C 3.22Å; S10-K65 VanDerWaalsContact OG-CB 3.24Å; S10-K65 WeakPolarHBondContact OG-CB 3.35Å; S10-K65 PolarHBondContact OG-O 3.41Å; S10-N66 WeakPolarHBondContact OG-CA 3.44Å; S10-N66 PolarHBondContact OG-N 3.38Å; S10-N66 PolarHBondContact OG-O 3.09Å
11E89.1Confident76.7Confident40 Ų4078.4 Ų78.419%0.18742%0.422CS..EExtended strand (participates in β ladder)trans-136.2131.1176.2-168.7-176.293.600110.6R13 T33 F34 S64 K65E11-R13 IonicContact OE1-CZ 3.24Å; E11-R13 VanDerWaalsContact OE1-CZ 3.24Å; E11-R13 IonicContact OE1-NE 2.91Å; E11-R13 PolarHBondContact OE1-NE 3.11Å; E11-R13 IonicContact OE1-NH2 2.74Å; E11-R13 PolarHBondContact OE1-NH2 3.27Å; E11-T33 HydrophobicContact CG-CG2 3.83Å; E11-F34 WeakPolarHBondContact CA-O 3.47Å; E11-S64 WeakPolarHBondContact CB-OG 3.44Å; E11-S64 VanDerWaalsContact CG-OG 3.31Å; E11-S64 WeakPolarHBondContact CG-OG 3.48Å; E11-S64 PolarHBondContact O-N 2.66Å; E11-S64 VanDerWaalsContact O-N 3.11Å; E11-S64 PolarHBondContact O-OG 3.03Å; E11-S64 PolarHBondContact OE1-OG 3.39Å; E11-K65 HydrophobicContact CB-CB 4Å; E11-K65 HydrophobicContact CB-CG 4.45Å; E11-K65 PolarHBondContact N-O 2.73Å
12M90.3Very high78.7Confident38 Ų3869.7 Ų69.719%0.18738%0.384CS..EExtended strand (participates in β ladder)trans-127.5137.7176.6172.3174.1158.700110.2L14 T33 F34 L36 I61M12-L14 HydrophobicContact CE-CD2 3.67Å; M12-L14 HydrophobicContact CE-CG 4.23Å; M12-T33 CarbonylContact O-C 3.57Å; M12-T33 WeakPolarHBondContact O-CA 3.4Å; M12-F34 PolarHBondContact N-O 2.61Å; M12-F34 PolarHBondContact O-N 2.81Å; M12-L36 HydrophobicContact CB-CD1 3.66Å; M12-L36 HydrophobicContact CB-CG 4.24Å; M12-I61 HydrophobicContact CE-CB 4.04Å; M12-I61 HydrophobicContact CE-CD1 3.9Å; M12-I61 HydrophobicContact CE-CG1 3.64Å; M12-I61 HydrophobicContact CE-CG2 3.27Å; M12-I61 HydrophobicContact CG-CG2 3.89Å; M12-I61 HydrophobicContact SD-CG2 3.69Å
13R91.9Very high80.6Confident67 Ų6774.1 Ų74.125%0.25338%0.382SS..EExtended strand (participates in β ladder)trans-121.7135.4-179.7-61.7177.2-171.8177.83.8109.6E11 Y15 P30 T33 H62 S64E11-R13 IonicContact OE1-CZ 3.24Å; E11-R13 VanDerWaalsContact OE1-CZ 3.24Å; E11-R13 IonicContact OE1-NE 2.91Å; E11-R13 PolarHBondContact OE1-NE 3.11Å; E11-R13 IonicContact OE1-NH2 2.74Å; E11-R13 PolarHBondContact OE1-NH2 3.27Å; R13-Y15 HydrophobicContact CB-CD2 4.41Å; R13-Y15 HydrophobicContact CB-CE2 3.55Å; R13-P30 HydrophobicContact CB-CB 3.95Å; R13-P30 HydrophobicContact CB-CG 4.47Å; R13-P30 HydrophobicContact CG-CB 4.35Å; R13-P30 HydrophobicContact CG-CG 4.32Å; R13-T33 HydrophobicContact CG-CG2 4.07Å; R13-H62 HydrophobicContact CB-CB 4.45Å; R13-H62 PolarHBondContact N-O 2.77Å; R13-H62 PolarHBondContact O-N 2.67Å; R13-S64 PolarHBondContact NE-OG 2.87Å
14L91.6Very high82.5Confident5 Ų571.4 Ų71.43%0.02637%0.374CS..EExtended strand (participates in β ladder)trans-106.3136.7175.1-72.2179.2000110.3M12 D31 Q32 F34 T48 F53 L59 I61M12-L14 HydrophobicContact CE-CD2 3.67Å; M12-L14 HydrophobicContact CE-CG 4.23Å; L14-D31 PolarHBondContact O-N 2.77Å; L14-Q32 HydrophobicContact CB-CB 4.43Å; L14-Q32 HydrophobicContact CD1-CB 4.49Å; L14-Q32 PolarHBondContact N-O 3.37Å; L14-Q32 PolarHBondContact O-N 3.06Å; L14-F34 HydrophobicContact CD1-CD2 4.39Å; L14-F34 HydrophobicContact CD1-CE2 3.47Å; L14-F34 VanDerWaalsContact CD1-CE2 3.47Å; L14-F34 HydrophobicContact CD1-CZ 4.25Å; L14-F34 HydrophobicContact CG-CD2 4.5Å; L14-F34 HydrophobicContact CG-CE2 4.02Å; L14-T48 HydrophobicContact CD1-CG2 3.53Å; L14-F53 HydrophobicContact CB-CE1 4.02Å; L14-F53 HydrophobicContact CB-CZ 3.66Å; L14-F53 HydrophobicContact CD1-CE1 3.97Å; L14-F53 HydrophobicContact CD1-CE2 4.13Å; L14-F53 HydrophobicContact CD1-CZ 3.48Å; L14-F53 VanDerWaalsContact CD1-CZ 3.48Å; L14-F53 HydrophobicContact CG-CZ 4.24Å; L14-L59 HydrophobicContact CD2-CD1 4.16Å; L14-L59 HydrophobicContact CD2-CG 4.45Å; L14-I61 HydrophobicContact CD2-CB 4.45Å; L14-I61 HydrophobicContact CD2-CG1 3.53Å
15Y91.1Very high83.9Confident2 Ų266 Ų661%0.00834%0.344CS..EExtended strand (participates in β ladder)trans-129.5131.2175.6-59.8-99.2000108.7R13 I18 M21 T26 P30 S60 H62R13-Y15 HydrophobicContact CB-CD2 4.41Å; R13-Y15 HydrophobicContact CB-CE2 3.55Å; Y15-I18 HydrophobicContact CD1-CD1 4.11Å; Y15-I18 HydrophobicContact CG-CD1 4.46Å; Y15-M21 HydrophobicContact CD1-CE 3.68Å; Y15-M21 HydrophobicContact CD2-CE 3.29Å; Y15-M21 HydrophobicContact CD2-SD 3.79Å; Y15-M21 HydrophobicContact CE1-CE 3.87Å; Y15-M21 HydrophobicContact CE2-CE 3.52Å; Y15-M21 HydrophobicContact CG-CE 3.38Å; Y15-M21 HydrophobicContact CG-SD 3.8Å; Y15-T26 PolarHBondContact OH-O 2.91Å; Y15-P30 HydrophobicContact CD1-CB 4.38Å; Y15-P30 HydrophobicContact CE1-CB 3.86Å; Y15-P30 HydrophobicContact CE2-CB 4.16Å; Y15-S60 PolarHBondContact N-O 3.22Å; Y15-S60 PolarHBondContact O-N 3.48Å; Y15-H62 HydrophobicContact CD2-CB 4.32Å; Y15-H62 HydrophobicContact CE2-CB 3.85Å
16K91.4Very high85.2Confident48 Ų4862.1 Ų62.121%0.20933%0.325CS..EExtended strand (participates in β ladder)trans-111.2149.8179.386.6-176.7-161.5156.10111.5I18 D31 R52 F53 S54 V56 H58K16-I18 PolarHBondContact O-N 3.3Å; K16-D31 WeakPolarHBondContact CD-OD1 3.24Å; K16-D31 WeakPolarHBondContact CG-OD1 3.15Å; K16-D31 WeakPolarHBondContact CG-OD2 3.31Å; K16-D31 PolarHBondContact N-OD2 3.43Å; K16-R52 WeakPolarHBondContact CD-O 3.36Å; K16-R52 VanDerWaalsContact CE-O 3.24Å; K16-R52 WeakPolarHBondContact CE-O 3.31Å; K16-R52 PolarHBondContact NZ-O 3.46Å; K16-F53 HydrophobicContact CB-CD1 4.37Å; K16-F53 HydrophobicContact CB-CE1 4.32Å; K16-S54 PolarHBondContact NZ-O 2.74Å; K16-V56 HydrophobicContact CB-CG2 4.27Å; K16-V56 HydrophobicContact CD-CG2 4.31Å; K16-H58 CarbonylContact C-O 3.5Å; K16-H58 WeakPolarHBondContact CA-O 3.42Å
17N89.7Confident86.2Confident64 Ų6466.6 Ų66.634%0.34234%0.344SS..SBendtrans58.729.5171.5-59.6-27.2000114.5P19 N55 Y57 H58N17-P19 WeakPolarHBondContact O-CD 3.35Å; N17-N55 PolarHBondContact ND2-O 3.22Å; N17-N55 VanDerWaalsContact ND2-O 3.08Å; N17-N55 PolarHBondContact OD1-O 2.61Å; N17-Y57 PolarHBondContact OD1-N 2.77Å; N17-H58 PolarHBondContact N-O 2.95Å
18I89Confident87.1Confident29 Ų2970.7 Ų70.715%0.14935%0.347CS..  trans-105.695.8169.7-51.3-177.9000107.8Y15 K16 Q20 M21 D25Y15-I18 HydrophobicContact CD1-CD1 4.11Å; Y15-I18 HydrophobicContact CG-CD1 4.46Å; K16-I18 PolarHBondContact O-N 3.3Å; I18-Q20 PolarHBondContact O-N 2.82Å; I18-M21 HydrophobicContact CB-CB 4.29Å; I18-M21 HydrophobicContact CB-CG 4.48Å; I18-M21 HydrophobicContact CG2-CB 3.95Å; I18-M21 HydrophobicContact CG2-CG 4.12Å; I18-D25 HydrophobicContact CD1-CB 4.45Å; I18-D25 HydrophobicContact CG2-CB 4.41Å
19P87Confident87.9Confident80 Ų8075.4 Ų75.452%0.51937%0.369SS..THydrogen-bonded Turntrans-65135.2174.927.8-32.9000109.5N17 M21N17-P19 WeakPolarHBondContact O-CD 3.35Å; P19-M21 VanDerWaalsContact C-N 3.32Å; P19-M21 PolarHBondContact O-N 2.96Å
20Q85.1Confident88.4Confident191 Ų19174 Ų7489%0.89336%0.361SS*.THydrogen-bonded Turntrans55.941.8179-52.4-178.7-92.700114I18 S22I18-Q20 PolarHBondContact O-N 2.82Å; Q20-S22 PolarHBondContact O-N 3.08Å
21M85.6Confident88.7Confident40 Ų4075.1 Ų75.120%0.19737%0.365CS..  trans-47.1127.6179.6-171-172.8178.200112.2Y15 I18 P19 D25 T26 S60Y15-M21 HydrophobicContact CD1-CE 3.68Å; Y15-M21 HydrophobicContact CD2-CE 3.29Å; Y15-M21 HydrophobicContact CD2-SD 3.79Å; Y15-M21 HydrophobicContact CE1-CE 3.87Å; Y15-M21 HydrophobicContact CE2-CE 3.52Å; Y15-M21 HydrophobicContact CG-CE 3.38Å; Y15-M21 HydrophobicContact CG-SD 3.8Å; I18-M21 HydrophobicContact CB-CB 4.29Å; I18-M21 HydrophobicContact CB-CG 4.48Å; I18-M21 HydrophobicContact CG2-CB 3.95Å; I18-M21 HydrophobicContact CG2-CG 4.12Å; P19-M21 VanDerWaalsContact C-N 3.32Å; P19-M21 PolarHBondContact O-N 2.96Å; M21-D25 HydrophobicContact CE-CB 4.08Å; M21-D25 HydrophobicContact CG-CB 3.77Å; M21-T26 HydrophobicContact CE-CG2 3.56Å; M21-S60 WeakPolarHBondContact CB-OG 3.49Å; M21-S60 WeakPolarHBondContact SD-CB 3.42Å
22S89.4Confident88.8Confident55 Ų5574.1 Ų74.139%0.38536%0.36SS..  trans-103.7173.9176.672.70000111.5Q20 D24 D25Q20-S22 PolarHBondContact O-N 3.08Å; S22-D24 VanDerWaalsContact C-N 3.26Å; S22-D24 PolarHBondContact O-N 3.49Å; S22-D24 PolarHBondContact OG-N 2.86Å; S22-D25 WeakPolarHBondContact CB-OD2 3.32Å; S22-D25 PolarHBondContact N-OD2 3.4Å; S22-D25 WeakPolarHBondContact O-CB 3.26Å; S22-D25 PolarHBondContact O-N 2.97Å; S22-D25 PolarHBondContact OG-OD2 2.62Å
23F87.9Confident88.8Confident168 Ų16875.4 Ų75.474%0.73737%0.37SS*.SBendtrans-66.7-27.7174.8-68.5-74.6000112.9D25 T26F23-D25 VanDerWaalsContact C-N 3.32Å; F23-D25 PolarHBondContact O-N 3.11Å; F23-T26 WeakPolarHBondContact O-CB 3.47Å; F23-T26 WeakPolarHBondContact O-CG2 3.35Å; F23-T26 PolarHBondContact O-N 3.37Å; F23-T26 VanDerWaalsContact O-N 3.11Å; F23-T26 PolarHBondContact O-OG1 2.78Å
24D88.8Confident88.6Confident117 Ų11773.2 Ų73.263%0.62636%0.362SS*.G310 helixtrans-63.6-39.5174.4-167-89.5000110.9S22 T26 E27S22-D24 VanDerWaalsContact C-N 3.26Å; S22-D24 PolarHBondContact O-N 3.49Å; S22-D24 PolarHBondContact OG-N 2.86Å; D24-T26 PolarHBondContact O-N 2.75Å; D24-E27 WeakPolarHBondContact O-CB 3.43Å; D24-E27 PolarHBondContact O-N 2.71Å; D24-E27 VanDerWaalsContact O-N 3.07Å
25D86.5Confident88.3Confident34 Ų3476.8 Ų76.818%0.18239%0.388CS..G310 helixtrans-63-17.9175.3-63.1-79.2000113.3I18 M21 S22 F23 E27 R28I18-D25 HydrophobicContact CD1-CB 4.45Å; I18-D25 HydrophobicContact CG2-CB 4.41Å; M21-D25 HydrophobicContact CE-CB 4.08Å; M21-D25 HydrophobicContact CG-CB 3.77Å; S22-D25 WeakPolarHBondContact CB-OD2 3.32Å; S22-D25 PolarHBondContact N-OD2 3.4Å; S22-D25 WeakPolarHBondContact O-CB 3.26Å; S22-D25 PolarHBondContact O-N 2.97Å; S22-D25 PolarHBondContact OG-OD2 2.62Å; F23-D25 VanDerWaalsContact C-N 3.32Å; F23-D25 PolarHBondContact O-N 3.11Å; D25-E27 PolarHBondContact O-N 2.86Å; D25-R28 VanDerWaalsContact O-CB 3.31Å; D25-R28 WeakPolarHBondContact O-CB 3.47Å; D25-R28 WeakPolarHBondContact O-CG 3.24Å; D25-R28 PolarHBondContact O-N 2.8Å
26T86.3Confident87.9Confident22 Ų2278.2 Ų78.214%0.13540%0.396CS..G310 helixtrans-73.3-15.5177.476.20000113.2Y15 M21 F23 D24 R28 H62Y15-T26 PolarHBondContact OH-O 2.91Å; M21-T26 HydrophobicContact CE-CG2 3.56Å; F23-T26 WeakPolarHBondContact O-CB 3.47Å; F23-T26 WeakPolarHBondContact O-CG2 3.35Å; F23-T26 PolarHBondContact O-N 3.37Å; F23-T26 VanDerWaalsContact O-N 3.11Å; F23-T26 PolarHBondContact O-OG1 2.78Å; D24-T26 PolarHBondContact O-N 2.75Å; T26-R28 PolarHBondContact O-N 2.98Å; T26-H62 HydrophobicContact CG2-CB 4.41Å; T26-H62 WeakPolarHBondContact CG2-ND1 3.17Å
27E85.1Confident87.3Confident164 Ų16480.7 Ų80.777%0.76641%0.411SS*.G310 helixtrans-73.3-16.6172.6-61.1-167.589.200112.4D24 D25D24-E27 WeakPolarHBondContact O-CB 3.43Å; D24-E27 PolarHBondContact O-N 2.71Å; D24-E27 VanDerWaalsContact O-N 3.07Å; D25-E27 PolarHBondContact O-N 2.86Å
28R86.2Confident86.5Confident162 Ų16283.8 Ų83.861%0.61142%0.418SS*.SBendtrans-73.7159.9176.6-53.8173.969.5113.63.4110.7D25 T26 P30D25-R28 VanDerWaalsContact O-CB 3.31Å; D25-R28 WeakPolarHBondContact O-CB 3.47Å; D25-R28 WeakPolarHBondContact O-CG 3.24Å; D25-R28 PolarHBondContact O-N 2.8Å; T26-R28 PolarHBondContact O-N 2.98Å; R28-P30 WeakPolarHBondContact O-CD 3.49Å
29E88.9Confident85.7Confident184 Ų18485.2 Ų85.286%0.8643%0.426SS*.PPolyproline II helixtrans-62.9121174.7-171.7173.696.100110.1
30P90.4Very high84.7Confident23 Ų2389.8 Ų89.815%0.14945%0.445CS..PPolyproline II helixtrans-70.3145176.828.7-34.2000111.1R13 Y15 R28 Q32 T33R13-P30 HydrophobicContact CB-CB 3.95Å; R13-P30 HydrophobicContact CB-CG 4.47Å; R13-P30 HydrophobicContact CG-CB 4.35Å; R13-P30 HydrophobicContact CG-CG 4.32Å; Y15-P30 HydrophobicContact CD1-CB 4.38Å; Y15-P30 HydrophobicContact CE1-CB 3.86Å; Y15-P30 HydrophobicContact CE2-CB 4.16Å; R28-P30 WeakPolarHBondContact O-CD 3.49Å; P30-Q32 PolarHBondContact O-N 2.88Å; P30-T33 WeakPolarHBondContact CG-OG1 3.14Å
31D91Very high84.2Confident45 Ų4585.1 Ų85.124%0.24143%0.429CS..SBendtrans-60.3-36.7175-73.4-89000111.4L14 K16 R52 F53L14-D31 PolarHBondContact O-N 2.77Å; K16-D31 WeakPolarHBondContact CD-OD1 3.24Å; K16-D31 WeakPolarHBondContact CG-OD1 3.15Å; K16-D31 WeakPolarHBondContact CG-OD2 3.31Å; K16-D31 PolarHBondContact N-OD2 3.43Å; D31-R52 WeakPolarHBondContact O-CD 3.5Å; D31-R52 PolarHBondContact O-NH1 3.27Å; D31-F53 HydrophobicContact CB-CE1 4.37Å; D31-F53 HydrophobicContact CB-CZ 3.99Å
32Q90.8Very high83.4Confident18 Ų1886.5 Ų86.58%0.08445%0.454CS..EExtended strand (participates in β ladder)trans-153.6132.1175.2-173.7159.1-20.800111.1L14 P30 F34 A47 F53L14-Q32 HydrophobicContact CB-CB 4.43Å; L14-Q32 HydrophobicContact CD1-CB 4.49Å; L14-Q32 PolarHBondContact N-O 3.37Å; L14-Q32 PolarHBondContact O-N 3.06Å; P30-Q32 PolarHBondContact O-N 2.88Å; Q32-F34 HydrophobicContact CG-CD2 4.49Å; Q32-F34 HydrophobicContact CG-CE1 4.12Å; Q32-F34 HydrophobicContact CG-CE2 4.01Å; Q32-F34 HydrophobicContact CG-CZ 3.83Å; Q32-A47 PolarHBondContact NE2-O 3.15Å; Q32-F53 HydrophobicContact CB-CE2 3.78Å; Q32-F53 HydrophobicContact CB-CZ 3.88Å
33T90.2Very high82.9Confident65 Ų6590.8 Ų90.840%0.39947%0.468SS..EExtended strand (participates in β ladder)trans-107.4139.7171.5-54.40000109.4E11 M12 R13 P30E11-T33 HydrophobicContact CG-CG2 3.83Å; M12-T33 CarbonylContact O-C 3.57Å; M12-T33 WeakPolarHBondContact O-CA 3.4Å; R13-T33 HydrophobicContact CG-CG2 4.07Å; P30-T33 WeakPolarHBondContact CG-OG1 3.14Å
34F87.6Confident82.5Confident21 Ų2186.4 Ų86.49%0.09245%0.452CS..EExtended strand (participates in β ladder)trans-120.6129.5173.5-61.8-74.8000109.9E11 M12 L14 Q32 L36 Y46 T48E11-F34 WeakPolarHBondContact CA-O 3.47Å; M12-F34 PolarHBondContact N-O 2.61Å; M12-F34 PolarHBondContact O-N 2.81Å; L14-F34 HydrophobicContact CD1-CD2 4.39Å; L14-F34 HydrophobicContact CD1-CE2 3.47Å; L14-F34 VanDerWaalsContact CD1-CE2 3.47Å; L14-F34 HydrophobicContact CD1-CZ 4.25Å; L14-F34 HydrophobicContact CG-CD2 4.5Å; L14-F34 HydrophobicContact CG-CE2 4.02Å; Q32-F34 HydrophobicContact CG-CD2 4.49Å; Q32-F34 HydrophobicContact CG-CE1 4.12Å; Q32-F34 HydrophobicContact CG-CE2 4.01Å; Q32-F34 HydrophobicContact CG-CZ 3.83Å; F34-L36 PolarHBondContact O-N 3.17Å; F34-Y46 HydrophobicContact CB-CD1 4.23Å; F34-Y46 AromaticContact CD1-CD1 3.9Å; F34-Y46 HydrophobicContact CD1-CD1 3.9Å; F34-Y46 HydrophobicContact CD1-CG 4.14Å; F34-Y46 HydrophobicContact CG-CD1 4.39Å; F34-Y46 HydrophobicContact CG-CG 4.48Å; F34-T48 HydrophobicContact CE2-CG2 4.31Å; F34-T48 HydrophobicContact CZ-CG2 3.95Å
35S86.2Confident82.2Confident81 Ų8189.5 Ų89.557%0.56646%0.463SS*.EExtended strand (participates in β ladder)trans-85.6104.8163.8-560000107.4N37 Y46S35-N37 PolarHBondContact O-ND2 3.04Å; S35-Y46 VanDerWaalsContact O-CE1 3.24Å; S35-Y46 WeakPolarHBondContact O-CE1 3.37Å
36L83.4Confident82Confident32 Ų3291.2 Ų91.217%0.16847%0.467CS..  trans-73.8134.9176.4-68.9162.5000107.9P9 S10 M12 F34 Y46 F67P9-L36 HydrophobicContact CB-CD1 3.62Å; P9-L36 HydrophobicContact CG-CD1 3.84Å; P9-L36 WeakPolarHBondContact O-CB 3.44Å; S10-L36 PolarHBondContact O-N 3.47Å; M12-L36 HydrophobicContact CB-CD1 3.66Å; M12-L36 HydrophobicContact CB-CG 4.24Å; F34-L36 PolarHBondContact O-N 3.17Å; L36-Y46 HydrophobicContact CD2-CD2 3.84Å; L36-Y46 HydrophobicContact CD2-CE2 3.58Å; L36-F67 WeakPolarHBondContact O-CE2 3.47Å; L36-F67 WeakPolarHBondContact O-CZ 3.03Å
37N78.6Confident81.8Confident99 Ų9994.2 Ų94.253%0.52949%0.494SS..  trans-107147.2175-72.6-89.6000109.1S35 D39 L44 Y46S35-N37 PolarHBondContact O-ND2 3.04Å; N37-D39 PolarHBondContact O-N 3.31Å; N37-L44 HydrophobicContact CB-CD1 3.67Å; N37-Y46 PolarHBondContact N-OH 3.41Å
38R72.6Confident81.8Confident130 Ų13089.5 Ų89.549%0.49148%0.477SS..  trans-64.8101.4175.1-62.4-172.8-168.8-166.75.4108.4D6 F67D6-R38 IonicContact OD1-CZ 3.36Å; D6-R38 IonicContact OD1-NH1 3.22Å; D6-R38 PolarHBondContact OD1-NH1 3.46Å; D6-R38 IonicContact OD1-NH2 2.67Å; D6-R38 PolarHBondContact OD1-NH2 2.68Å; R38-F67 HydrophobicContact CG-CD1 4.17Å; R38-F67 HydrophobicContact CG-CD2 3.79Å; R38-F67 HydrophobicContact CG-CE1 4.03Å; R38-F67 HydrophobicContact CG-CE2 3.64Å; R38-F67 HydrophobicContact CG-CG 4.05Å; R38-F67 HydrophobicContact CG-CZ 3.75Å
39D72.6Confident81.7Confident59 Ų5988 Ų8832%0.31647%0.474SS..  trans-107.1105.7-179.5-162.5-119000109.4N37 T41 G42 E43 L44N37-D39 PolarHBondContact O-N 3.31Å; D39-T41 VanDerWaalsContact C-N 3.27Å; D39-G42 WeakPolarHBondContact OD1-CA 3.48Å; D39-G42 PolarHBondContact OD1-N 3.13Å; D39-E43 PolarHBondContact OD1-N 3.16Å; D39-L44 HydrophobicContact CB-CB 3.87Å; D39-L44 HydrophobicContact CB-CD1 3.55Å; D39-L44 HydrophobicContact CB-CG 4.11Å; D39-L44 PolarHBondContact OD1-N 2.78Å; D39-L44 VanDerWaalsContact OD1-N 3.09Å; D39-L44 VanDerWaalsContact OD2-CD1 3.32Å; D39-L44 WeakPolarHBondContact OD2-CD1 3.15Å; D39-L44 WeakPolarHBondContact OD2-CG 3.46Å
40L64.6Low81.3Confident176 Ų17686.2 Ų86.292%0.92147%0.469SS*.SBendtrans-78.1-16.3-177.4-65.8170.5000112.2
41T76.5Confident81Confident92 Ų9290.5 Ų90.556%0.56450%0.5SS*.SBendtrans-101.9-18.5-175.656.10000113.7D39 E43D39-T41 VanDerWaalsContact C-N 3.27Å; T41-E43 WeakPolarHBondContact CB-OE2 3.24Å; T41-E43 WeakPolarHBondContact OG1-CG 3.44Å; T41-E43 PolarHBondContact OG1-OE2 2.77Å
42G68.6Low80.5Confident69 Ų6994.2 Ų94.271%0.71151%0.511SS*.SBendtrans77.220.9-178.100000114.2D39D39-G42 WeakPolarHBondContact OD1-CA 3.48Å; D39-G42 PolarHBondContact OD1-N 3.13Å
43E77.7Confident80.2Confident146 Ų14694.8 Ų94.868%0.68251%0.513SS*.  trans-91.9-14-178.2-62.617898.400113.3D39 T41 E45D39-E43 PolarHBondContact OD1-N 3.16Å; T41-E43 WeakPolarHBondContact CB-OE2 3.24Å; T41-E43 WeakPolarHBondContact OG1-CG 3.44Å; T41-E43 PolarHBondContact OG1-OE2 2.77Å; E43-E45 PolarHBondContact O-N 3.18Å; E43-E45 VanDerWaalsContact O-N 3.15Å
44L80.3Confident79.9Confident76 Ų7694.8 Ų94.840%0.39852%0.515SS..  trans-74.4104.5-178.8-93.5165.7000112.4N37 D39 Y46N37-L44 HydrophobicContact CB-CD1 3.67Å; D39-L44 HydrophobicContact CB-CB 3.87Å; D39-L44 HydrophobicContact CB-CD1 3.55Å; D39-L44 HydrophobicContact CB-CG 4.11Å; D39-L44 PolarHBondContact OD1-N 2.78Å; D39-L44 VanDerWaalsContact OD1-N 3.09Å; D39-L44 VanDerWaalsContact OD2-CD1 3.32Å; D39-L44 WeakPolarHBondContact OD2-CD1 3.15Å; D39-L44 WeakPolarHBondContact OD2-CG 3.46Å; L44-Y46 HydrophobicContact CB-CE2 4.02Å
45E81.1Confident79.9Confident182 Ų18299.5 Ų99.585%0.8554%0.542SS*.  trans-96.1128.5174.2-66.5-174.989.500112.4E43E43-E45 PolarHBondContact O-N 3.18Å; E43-E45 VanDerWaalsContact O-N 3.15Å
46Y82.8Confident80Confident69 Ų6998.3 Ų98.327%0.27153%0.531SS..  trans-106.990.1178.4-64.4-83.1000110.7F34 S35 L36 N37 L44 T48F34-Y46 HydrophobicContact CB-CD1 4.23Å; F34-Y46 AromaticContact CD1-CD1 3.9Å; F34-Y46 HydrophobicContact CD1-CD1 3.9Å; F34-Y46 HydrophobicContact CD1-CG 4.14Å; F34-Y46 HydrophobicContact CG-CD1 4.39Å; F34-Y46 HydrophobicContact CG-CG 4.48Å; S35-Y46 VanDerWaalsContact O-CE1 3.24Å; S35-Y46 WeakPolarHBondContact O-CE1 3.37Å; L36-Y46 HydrophobicContact CD2-CD2 3.84Å; L36-Y46 HydrophobicContact CD2-CE2 3.58Å; N37-Y46 PolarHBondContact N-OH 3.41Å; L44-Y46 HydrophobicContact CB-CE2 4.02Å; Y46-T48 PolarHBondContact O-N 2.77Å
47A82.8Confident80.3Confident86 Ų86105.5 Ų105.571%0.71156%0.557SS**  trans-68.5127.1-177.200000112.5Q32Q32-A47 PolarHBondContact NE2-O 3.15Å
48T84.9Confident80.8Confident65 Ų65105.3 Ų105.340%0.39955%0.553SS.*  trans-74.3139.6169.556.40000110.9L14 F34 Y46 I50 F53L14-T48 HydrophobicContact CD1-CG2 3.53Å; F34-T48 HydrophobicContact CE2-CG2 4.31Å; F34-T48 HydrophobicContact CZ-CG2 3.95Å; Y46-T48 PolarHBondContact O-N 2.77Å; T48-I50 PolarHBondContact O-N 2.92Å; T48-I50 VanDerWaalsContact O-N 3.13Å; T48-F53 HydrophobicContact CG2-CD2 4.31Å; T48-F53 HydrophobicContact CG2-CE2 4.17Å
49K84Confident81.6Confident129 Ų129103.5 Ų103.556%0.56155%0.553SS**  trans-72108.1174.7-71.5-175.3177.6179.10110S51 R52 F53K49-S51 PolarHBondContact O-N 3.25Å; K49-R52 HydrophobicContact CB-CB 4.33Å; K49-R52 HydrophobicContact CB-CG 4.16Å; K49-R52 WeakPolarHBondContact O-CA 3.21Å; K49-R52 WeakPolarHBondContact O-CB 3.11Å; K49-R52 PolarHBondContact O-N 3.22Å; K49-F53 WeakPolarHBondContact O-CD2 3.49Å; K49-F53 PolarHBondContact O-N 2.87Å; K49-F53 VanDerWaalsContact O-N 3.15Å
50I80.8Confident82.5Confident147 Ų147102.1 Ų102.175%0.75455%0.547SS*.THydrogen-bonded Turntrans-50.6-38.4-178.9-63158.9000112.1T48 R52 F53 S54T48-I50 PolarHBondContact O-N 2.92Å; T48-I50 VanDerWaalsContact O-N 3.13Å; I50-R52 VanDerWaalsContact C-N 3.27Å; I50-R52 PolarHBondContact O-N 2.85Å; I50-F53 CarbonylContact O-C 3.38Å; I50-F53 PolarHBondContact O-N 3.39Å; I50-F53 VanDerWaalsContact O-N 3.17Å; I50-S54 PolarHBondContact O-N 3.01Å
51S83.1Confident83.7Confident114 Ų11498.7 Ų98.780%0.79753%0.529SS*.THydrogen-bonded Turntrans-59.5-34.9176.2172.50000113.4K49K49-S51 PolarHBondContact O-N 3.25Å
52R80.6Confident84.4Confident123 Ų12396 Ų9646%0.46451%0.51SS..THydrogen-bonded Turntrans-79.3-32.2176.2-65.3-165.5175.7-169.2-5.6112K16 D31 K49 I50K16-R52 WeakPolarHBondContact CD-O 3.36Å; K16-R52 VanDerWaalsContact CE-O 3.24Å; K16-R52 WeakPolarHBondContact CE-O 3.31Å; K16-R52 PolarHBondContact NZ-O 3.46Å; D31-R52 WeakPolarHBondContact O-CD 3.5Å; D31-R52 PolarHBondContact O-NH1 3.27Å; K49-R52 HydrophobicContact CB-CB 4.33Å; K49-R52 HydrophobicContact CB-CG 4.16Å; K49-R52 WeakPolarHBondContact O-CA 3.21Å; K49-R52 WeakPolarHBondContact O-CB 3.11Å; K49-R52 PolarHBondContact O-N 3.22Å; I50-R52 VanDerWaalsContact C-N 3.27Å; I50-R52 PolarHBondContact O-N 2.85Å
53F84.9Confident85.3Confident30 Ų3097.5 Ų97.513%0.13250%0.501CS..THydrogen-bonded Turntrans-100.126.3-178.8-66.1-86.4000113.8L14 K16 D31 Q32 T48 K49 I50 V56 L59L14-F53 HydrophobicContact CB-CE1 4.02Å; L14-F53 HydrophobicContact CB-CZ 3.66Å; L14-F53 HydrophobicContact CD1-CE1 3.97Å; L14-F53 HydrophobicContact CD1-CE2 4.13Å; L14-F53 HydrophobicContact CD1-CZ 3.48Å; L14-F53 VanDerWaalsContact CD1-CZ 3.48Å; L14-F53 HydrophobicContact CG-CZ 4.24Å; K16-F53 HydrophobicContact CB-CD1 4.37Å; K16-F53 HydrophobicContact CB-CE1 4.32Å; D31-F53 HydrophobicContact CB-CE1 4.37Å; D31-F53 HydrophobicContact CB-CZ 3.99Å; Q32-F53 HydrophobicContact CB-CE2 3.78Å; Q32-F53 HydrophobicContact CB-CZ 3.88Å; T48-F53 HydrophobicContact CG2-CD2 4.31Å; T48-F53 HydrophobicContact CG2-CE2 4.17Å; K49-F53 WeakPolarHBondContact O-CD2 3.49Å; K49-F53 PolarHBondContact O-N 2.87Å; K49-F53 VanDerWaalsContact O-N 3.15Å; I50-F53 CarbonylContact O-C 3.38Å; I50-F53 PolarHBondContact O-N 3.39Å; I50-F53 VanDerWaalsContact O-N 3.17Å; F53-V56 HydrophobicContact CB-CG2 3.92Å; F53-V56 HydrophobicContact CD1-CG2 3.97Å; F53-V56 HydrophobicContact CG-CG2 4.45Å; F53-V56 VanDerWaalsContact O-CG2 3.24Å; F53-V56 WeakPolarHBondContact O-CG2 3.24Å; F53-L59 HydrophobicContact CD1-CD1 3.95Å; F53-L59 HydrophobicContact CE1-CD1 3.6Å
54S84.3Confident85.7Confident64 Ų6492.3 Ų92.345%0.44848%0.48SS..SBendtrans-70.2137.9167.5-167.40000110.1K16 I50K16-S54 PolarHBondContact NZ-O 2.74Å; I50-S54 PolarHBondContact O-N 3.01Å
55N86.6Confident85.9Confident121 Ų12194.1 Ų94.165%0.64749%0.485SS*.SBendtrans51.264.2-179.6-62.7-29.2000114N17 Y57N17-N55 PolarHBondContact ND2-O 3.22Å; N17-N55 VanDerWaalsContact ND2-O 3.08Å; N17-N55 PolarHBondContact OD1-O 2.61Å; N55-Y57 HydrophobicContact CB-CE2 4.35Å
56V89.5Confident86Confident55 Ų5588 Ų8833%0.33346%0.458SS..  trans-92122.2176.2177.30000109.6K16 F53 L59K16-V56 HydrophobicContact CB-CG2 4.27Å; K16-V56 HydrophobicContact CD-CG2 4.31Å; F53-V56 HydrophobicContact CB-CG2 3.92Å; F53-V56 HydrophobicContact CD1-CG2 3.97Å; F53-V56 HydrophobicContact CG-CG2 4.45Å; F53-V56 VanDerWaalsContact O-CG2 3.24Å; F53-V56 WeakPolarHBondContact O-CG2 3.24Å; V56-L59 HydrophobicContact CG1-CB 3.91Å
57Y89.6Confident85.6Confident183 Ų18388 Ų8872%0.71846%0.459SS*.SBendtrans-104.7-33.6174-63.5-84.4000112.1N17 N55N17-Y57 PolarHBondContact OD1-N 2.77Å; N55-Y57 HydrophobicContact CB-CE2 4.35Å
58H88.7Confident84.9Confident96 Ų9686.1 Ų86.144%0.44445%0.449SS..  trans-132.4129.6174.3-66.9-86.3000108.4K16 N17K16-H58 CarbonylContact C-O 3.5Å; K16-H58 WeakPolarHBondContact CA-O 3.42Å; N17-H58 PolarHBondContact N-O 2.95Å
59L90.3Very high83.7Confident92 Ų9286 Ų8648%0.48246%0.455SS..EExtended strand (participates in β ladder)trans-122.1121.6174.6-175.366.2000108.6L14 F53 V56L14-L59 HydrophobicContact CD2-CD1 4.16Å; L14-L59 HydrophobicContact CD2-CG 4.45Å; F53-L59 HydrophobicContact CD1-CD1 3.95Å; F53-L59 HydrophobicContact CE1-CD1 3.6Å; V56-L59 HydrophobicContact CG1-CB 3.91Å
60S90.3Very high82.2Confident30 Ų3090.8 Ų90.821%0.2149%0.486CS..EExtended strand (participates in β ladder)trans-113.3134.7176.7-61.10000109.7Y15 M21Y15-S60 PolarHBondContact N-O 3.22Å; Y15-S60 PolarHBondContact O-N 3.48Å; M21-S60 WeakPolarHBondContact CB-OG 3.49Å; M21-S60 WeakPolarHBondContact SD-CB 3.42Å
61I91.1Very high82.3Confident104 Ų10488 Ų8853%0.53347%0.473SS..EExtended strand (participates in β ladder)trans-109.4120.7176.3-65.3164.6000107.2M12 L14M12-I61 HydrophobicContact CE-CB 4.04Å; M12-I61 HydrophobicContact CE-CD1 3.9Å; M12-I61 HydrophobicContact CE-CG1 3.64Å; M12-I61 HydrophobicContact CE-CG2 3.27Å; M12-I61 HydrophobicContact CG-CG2 3.89Å; M12-I61 HydrophobicContact SD-CG2 3.69Å; L14-I61 HydrophobicContact CD2-CB 4.45Å; L14-I61 HydrophobicContact CD2-CG1 3.53Å
62H90.3Very high82.3Confident36 Ų3686.6 Ų86.617%0.16746%0.456CS..EExtended strand (participates in β ladder)trans-115.1122.6175.4179.5-136.2000109.7R13 Y15 T26R13-H62 HydrophobicContact CB-CB 4.45Å; R13-H62 PolarHBondContact N-O 2.77Å; R13-H62 PolarHBondContact O-N 2.67Å; Y15-H62 HydrophobicContact CD2-CB 4.32Å; Y15-H62 HydrophobicContact CE2-CB 3.85Å; T26-H62 HydrophobicContact CG2-CB 4.41Å; T26-H62 WeakPolarHBondContact CG2-ND1 3.17Å
63I88.4Confident82.3Confident100 Ų10084.6 Ų84.651%0.51346%0.455SS..EExtended strand (participates in β ladder)trans-92.8105.3173.9-60.1170.4000106.7P9P9-I63 HydrophobicContact CB-CD1 4.46Å; P9-I63 HydrophobicContact CB-CG2 3.62Å
64S85.6Confident82.2Confident36 Ų3687.8 Ų87.825%0.25247%0.474SS..EExtended strand (participates in β ladder)trans-86.4-30.2-173.645.50000112.9E11 R13E11-S64 WeakPolarHBondContact CB-OG 3.44Å; E11-S64 VanDerWaalsContact CG-OG 3.31Å; E11-S64 WeakPolarHBondContact CG-OG 3.48Å; E11-S64 PolarHBondContact O-N 2.66Å; E11-S64 VanDerWaalsContact O-N 3.11Å; E11-S64 PolarHBondContact O-OG 3.03Å; E11-S64 PolarHBondContact OE1-OG 3.39Å; R13-S64 PolarHBondContact NE-OG 2.87Å
65K84.1Confident82.1Confident114 Ų11489.3 Ų89.350%0.49648%0.476SS..EExtended strand (participates in β ladder)trans-143.9151.3-178.5-62.6-170.1175.5-166.10111.4S10 E11S10-K65 PolarHBondContact N-O 2.93Å; S10-K65 VanDerWaalsContact OG-C 3.22Å; S10-K65 VanDerWaalsContact OG-CB 3.24Å; S10-K65 WeakPolarHBondContact OG-CB 3.35Å; S10-K65 PolarHBondContact OG-O 3.41Å; E11-K65 HydrophobicContact CB-CB 4Å; E11-K65 HydrophobicContact CB-CG 4.45Å; E11-K65 PolarHBondContact N-O 2.73Å
66N82.9Confident81.8Confident55 Ų5587.1 Ų87.129%0.29447%0.465SS..EExtended strand (participates in β ladder)trans-112175.8166.165.727.5000109.5H8 S10 G68 A69H8-N66 CarbonylContact O-C 3.38Å; H8-N66 WeakPolarHBondContact O-CA 3.05Å; H8-N66 WeakPolarHBondContact O-CB 3.35Å; S10-N66 WeakPolarHBondContact OG-CA 3.44Å; S10-N66 PolarHBondContact OG-N 3.38Å; S10-N66 PolarHBondContact OG-O 3.09Å; N66-G68 VanDerWaalsContact C-N 3.3Å; N66-G68 PolarHBondContact OD1-N 2.65Å; N66-A69 WeakPolarHBondContact OD1-CB 3.15Å; N66-A69 PolarHBondContact OD1-N 2.7Å
67F74Confident81.2Confident67 Ų6789.4 Ų89.429%0.29447%0.474SS..SBendtrans-80-11.5-177.6-88.1-74.3000113.7D6 H8 P9 L36 R38D6-F67 CarbonylContact O-C 3.35Å; D6-F67 WeakPolarHBondContact O-CA 3.22Å; D6-F67 PolarHBondContact O-N 2.71Å; D6-F67 VanDerWaalsContact O-N 3.16Å; H8-F67 HydrophobicContact CB-CD2 3.83Å; H8-F67 WeakPolarHBondContact O-CD2 3.41Å; H8-F67 PolarHBondContact O-N 3.15Å; P9-F67 WeakPolarHBondContact O-CE2 3.32Å; L36-F67 WeakPolarHBondContact O-CE2 3.47Å; L36-F67 WeakPolarHBondContact O-CZ 3.03Å; R38-F67 HydrophobicContact CG-CD1 4.17Å; R38-F67 HydrophobicContact CG-CD2 3.79Å; R38-F67 HydrophobicContact CG-CE1 4.03Å; R38-F67 HydrophobicContact CG-CE2 3.64Å; R38-F67 HydrophobicContact CG-CG 4.05Å; R38-F67 HydrophobicContact CG-CZ 3.75Å
68G68.1Low80.6Confident47 Ų4782.2 Ų82.249%0.48546%0.455SS..SBendtrans-109-9.9-172.300000115.5D6 N66D6-G68 WeakPolarHBondContact O-CA 3.47Å; D6-G68 PolarHBondContact O-N 3.47Å; N66-G68 VanDerWaalsContact C-N 3.3Å; N66-G68 PolarHBondContact OD1-N 2.65Å
69A60.6Low79.9Confident64 Ų6481.1 Ų81.153%0.52946%0.456SS..  trans-97.595.3169.900000107.9N66N66-A69 WeakPolarHBondContact OD1-CB 3.15Å; N66-A69 PolarHBondContact OD1-N 2.7Å
70D52.8Low78.9Confident228 Ų22880.1 Ų80.1100%1.21945%0.454SS*.  trans-63.50161.2-172.1-114.6000110.3

Retrieved 70 of 70 residues in 15.3 ms (Link to these results)

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