A0A087WSM7_MOUSE Loading...

Nicotinamide nucleotide adenylyltransferase 3

AlphaFold DB , UniProt , Accession A0A087WSM7, Species MOUSE (Mus musculus, Mouse), Gene Nmnat3, Length 56 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
1M51.9Low89Confident234 Ų234102.8 Ų102.8100%1.15353%0.526SS*.  0122.10-63.5179.8-74.800107.5N3M1-N3 PolarHBondContact O-N 2.85Å; M1-N3 VanDerWaalsContact O-N 3.14Å
2K62.5Low89.7Confident186 Ų186102 Ų10281%0.80953%0.534SS*.  trans-69.1111.1179-76.1-175.3177.9-179.80108R4K2-R4 PolarHBondContact O-N 3.03Å
3N84.3Confident90.1Very high168 Ų16896 Ų9690%0.89851%0.512SS*.  trans-74.693.4179.1-153.437.6000108.4M1M1-N3 PolarHBondContact O-N 2.85Å; M1-N3 VanDerWaalsContact O-N 3.14Å
4R93.9Very high90.4Very high103 Ų10390.9 Ų90.939%0.38949%0.488SS..PPolyproline II helixtrans-83.4140.5175.8-67.3179.5179.5166-1.3109K2 P6 R38 Q40K2-R4 PolarHBondContact O-N 3.03Å; R4-P6 WeakPolarHBondContact O-CD 3.33Å; R4-R38 CarbonylContact C-O 3.46Å; R4-R38 WeakPolarHBondContact CA-O 3.4Å; R4-Q40 HydrophobicContact CB-CB 3.82Å
5I97.5Very high90.7Very high95 Ų9587.1 Ų87.149%0.48747%0.466SS..EExtended strand (participates in β ladder)trans-71.8120.9177.2-61.6167.8000108V7 R38 Y39 Q40I5-V7 HydrophobicContact CG2-CG2 4.39Å; I5-R38 PolarHBondContact N-O 3.14Å; I5-Y39 HydrophobicContact CB-CD1 3.78Å; I5-Y39 HydrophobicContact CB-CE1 4.14Å; I5-Y39 HydrophobicContact CD1-CD1 4.32Å; I5-Y39 HydrophobicContact CD1-CE1 3.85Å; I5-Y39 HydrophobicContact CG2-CD1 4.12Å; I5-Y39 HydrophobicContact CG2-CE1 4.31Å; I5-Y39 CarbonylContact O-C 3.56Å; I5-Y39 WeakPolarHBondContact O-CA 3.32Å; I5-Q40 PolarHBondContact O-N 2.91Å
6P97.7Very high90.8Very high88 Ų8890.6 Ų90.657%0.57148%0.484SS*.EExtended strand (participates in β ladder)trans-69.2136.317528.8-33000110.2R4 Q40 I42R4-P6 WeakPolarHBondContact O-CD 3.33Å; P6-Q40 CarbonylContact C-O 3.49Å; P6-Q40 VanDerWaalsContact CA-O 3.32Å; P6-Q40 WeakPolarHBondContact CA-O 3.38Å; P6-I42 HydrophobicContact CB-CD1 4.2Å; P6-I42 HydrophobicContact CB-CG2 4.23Å
7V98.1Very high91.1Very high33 Ų3391.1 Ų91.120%0.249%0.493CS..EExtended strand (participates in β ladder)trans-133.5138.5-177.5179.40000110.4I5 L9 L33 Y39 Q40 V41 I42I5-V7 HydrophobicContact CG2-CG2 4.39Å; V7-L9 HydrophobicContact CG1-CD2 4.33Å; V7-L33 HydrophobicContact CG1-CD1 4.31Å; V7-Y39 HydrophobicContact CG2-CD1 3.67Å; V7-Y39 HydrophobicContact CG2-CG 4.23Å; V7-Q40 PolarHBondContact N-O 2.84Å; V7-V41 CarbonylContact O-C 3.58Å; V7-V41 VanDerWaalsContact O-CA 3.27Å; V7-V41 WeakPolarHBondContact O-CA 3.35Å; V7-I42 WeakPolarHBondContact O-CG1 3.34Å; V7-I42 PolarHBondContact O-N 3.26Å
8V98.4Very high91.4Very high66 Ų6690.7 Ų90.740%0.449%0.49SS..EExtended strand (participates in β ladder)trans-106.6132.9166.9-179.70000108.6I42 E43 I45V8-I42 HydrophobicContact CG2-CD1 4.08Å; V8-I42 HydrophobicContact CG2-CG1 3.91Å; V8-E43 WeakPolarHBondContact CA-O 3.43Å; V8-E43 HydrophobicContact CG1-CB 4.07Å; V8-E43 HydrophobicContact CG1-CG 4.4Å; V8-E43 HydrophobicContact CG2-CB 4.18Å; V8-I45 HydrophobicContact CG1-CD1 3.83Å; V8-I45 HydrophobicContact CG1-CG1 4.09Å
9L98.6Very high91.8Very high31 Ų3189.1 Ų89.116%0.16248%0.484CS..EExtended strand (participates in β ladder)trans-93.1127.4174.8-63.5-179.8000109.6V7 F26 A29 L33 V41 E43 G44 I45V7-L9 HydrophobicContact CG1-CD2 4.33Å; L9-F26 HydrophobicContact CB-CD1 3.91Å; L9-F26 HydrophobicContact CB-CE1 3.82Å; L9-F26 HydrophobicContact CD1-CD1 4.19Å; L9-A29 HydrophobicContact CD1-CB 3.85Å; L9-L33 HydrophobicContact CD2-CD1 3.77Å; L9-V41 HydrophobicContact CD1-CG1 3.96Å; L9-V41 HydrophobicContact CD1-CG2 4.23Å; L9-V41 HydrophobicContact CG-CG1 3.93Å; L9-V41 HydrophobicContact CG-CG2 4.29Å; L9-E43 PolarHBondContact N-O 3.07Å; L9-G44 CarbonylContact O-C 3.56Å; L9-G44 WeakPolarHBondContact O-CA 3.4Å; L9-I45 PolarHBondContact O-N 3Å
10L98.4Very high92.1Very high111 Ų11191.5 Ų91.558%0.58150%0.496SS*.EExtended strand (participates in β ladder)trans-117.4121.1174.717564.5000109.4I45L10-I45 WeakPolarHBondContact CA-O 3.11Å; L10-I45 HydrophobicContact CD1-CB 3.9Å; L10-I45 HydrophobicContact CD1-CG2 3.75Å
11A98.3Very high92.4Very high16 Ų1693.8 Ų93.813%0.13251%0.505CS..EExtended strand (participates in β ladder)trans-110108.717100000109.6F15 F26 I45 S47A11-F15 HydrophobicContact CB-CZ 4.03Å; A11-F15 WeakPolarHBondContact O-CE2 3.45Å; A11-F15 WeakPolarHBondContact O-CZ 3.27Å; A11-F26 HydrophobicContact CB-CE1 4.43Å; A11-F26 HydrophobicContact CB-CE2 3.59Å; A11-F26 HydrophobicContact CB-CZ 3.38Å; A11-I45 PolarHBondContact N-O 2.99Å; A11-S47 PolarHBondContact O-N 3.14Å
12C96.8Very high94.6Very high93 Ų9385.4 Ų85.463%0.62846%0.463SS*.EExtended strand (participates in β ladder)trans-90.8134.3171.3-62.20000109.8S47C12-S47 WeakPolarHBondContact CA-O 3.35Å
13G95.1Very high96.3Very high24 Ų2480.8 Ų80.825%0.24745%0.447CS..EExtended strand (participates in β ladder)trans178.6172.4-178.800000110.1F15 S47 P48 V49G13-F15 VanDerWaalsContact N-CE2 3.31Å; G13-F15 WeakPolarHBondContact O-CD2 3.41Å; G13-F15 WeakPolarHBondContact O-CE2 3.32Å; G13-S47 PolarHBondContact N-O 3Å; G13-P48 CarbonylContact O-C 3.05Å; G13-P48 VanDerWaalsContact O-CA 3.22Å; G13-P48 WeakPolarHBondContact O-CA 3.43Å; G13-V49 PolarHBondContact O-N 3.37Å
14S94.4Very high96.9Very high25 Ų2579 Ų7918%0.17543%0.427CS..  trans-85.1-19.7-179-32.60000114.1N16 V49 K55S14-N16 PolarHBondContact O-N 2.95Å; S14-V49 VanDerWaalsContact OG-CG1 3.3Å; S14-V49 WeakPolarHBondContact OG-CG1 3.29Å; S14-K55 WeakPolarHBondContact OG-CD 3.39Å; S14-K55 WeakPolarHBondContact OG-CE 3.4Å; S14-K55 PolarHBondContact OG-NZ 3.14Å
15F94.8Very high97.1Very high34 Ų3479.2 Ų79.215%0.14944%0.436CS..  trans4348.4176.5-52.7-70.4000113.2A11 G13 P17 I18 H22 I46 P48A11-F15 HydrophobicContact CB-CZ 4.03Å; A11-F15 WeakPolarHBondContact O-CE2 3.45Å; A11-F15 WeakPolarHBondContact O-CZ 3.27Å; G13-F15 VanDerWaalsContact N-CE2 3.31Å; G13-F15 WeakPolarHBondContact O-CD2 3.41Å; G13-F15 WeakPolarHBondContact O-CE2 3.32Å; F15-P17 CarbonylContact C-O 3.41Å; F15-P17 CarbonylContact O-C 3.55Å; F15-P17 VanDerWaalsContact O-CA 3.29Å; F15-P17 WeakPolarHBondContact O-CA 3.46Å; F15-I18 HydrophobicContact CB-CB 4.36Å; F15-I18 PolarHBondContact O-N 2.92Å; F15-H22 HydrophobicContact CD1-CB 4.16Å; F15-H22 AromaticContact CD1-CD2 3.92Å; F15-H22 AromaticContact CD1-CG 3.75Å; F15-H22 AromaticContact CD1-ND1 3.86Å; F15-H22 HydrophobicContact CE1-CB 4.17Å; F15-H22 AromaticContact CE1-CD2 3.94Å; F15-H22 AromaticContact CE1-CG 4Å; F15-I46 HydrophobicContact CD1-CG2 4.25Å; F15-I46 HydrophobicContact CD2-CG2 3.46Å; F15-I46 VanDerWaalsContact CD2-CG2 3.46Å; F15-I46 HydrophobicContact CE1-CG2 4.18Å; F15-I46 HydrophobicContact CE2-CG2 3.39Å; F15-I46 HydrophobicContact CG-CG2 3.91Å; F15-I46 HydrophobicContact CZ-CG2 3.77Å; F15-P48 HydrophobicContact CD2-CG 4.5Å
16N92.9Very high97.2Very high142 Ų14276 Ų7676%0.75942%0.418SS*.THydrogen-bonded Turntrans-115.686.2-174.6-174.924.3000111.7S14S14-N16 PolarHBondContact O-N 2.95Å
17P94.8Very high97.2Very high99 Ų9975.4 Ų75.464%0.64341%0.408SS*.THydrogen-bonded Turncis-82.9171.3-935-34.4000112.1F15F15-P17 CarbonylContact C-O 3.41Å; F15-P17 CarbonylContact O-C 3.55Å; F15-P17 VanDerWaalsContact O-CA 3.29Å; F15-P17 WeakPolarHBondContact O-CA 3.46Å
18I97.6Very high97.2Very high85 Ų8577.4 Ų77.444%0.43642%0.42SS..  trans-64.5152.2165.5-165.3168.3000109.5F15 H22 L23 I46F15-I18 HydrophobicContact CB-CB 4.36Å; F15-I18 PolarHBondContact O-N 2.92Å; I18-H22 HydrophobicContact CG1-CB 3.99Å; I18-L23 HydrophobicContact CD1-CD2 4.03Å; I18-I46 HydrophobicContact CD1-CD1 3.61Å
19T98Very high97.2Very high60 Ų6075.9 Ų75.937%0.36842%0.415SS..  trans-136.4160.1-175.970.80000108.7M21 H22 L23T19-M21 PolarHBondContact O-N 2.89Å; T19-M21 VanDerWaalsContact O-N 3.12Å; T19-M21 PolarHBondContact OG1-N 3.14Å; T19-H22 PolarHBondContact N-ND1 3.46Å; T19-H22 WeakPolarHBondContact O-CB 3.37Å; T19-H22 PolarHBondContact O-N 3.28Å; T19-H22 PolarHBondContact OG1-N 3.43Å; T19-H22 PolarHBondContact OG1-ND1 2.94Å; T19-H22 VanDerWaalsContact OG1-ND1 3.14Å; T19-L23 PolarHBondContact O-N 3.36Å
20N98.3Very high97.2Very high137 Ų13778.2 Ų78.273%0.73342%0.421SS*.Hα-helixtrans-57.3-27.6174.5-68.5-14.6000112.2L23 R24N20-L23 PolarHBondContact O-N 3.41Å; N20-R24 WeakPolarHBondContact O-CB 3.38Å; N20-R24 PolarHBondContact O-N 2.92Å
21M98.1Very high97.2Very high140 Ų14075.5 Ų75.569%0.6941%0.407SS*.Hα-helixtrans-70.5-34.2176.6-66-56.1-63.200112.6T19 L23 R24 L25T19-M21 PolarHBondContact O-N 2.89Å; T19-M21 VanDerWaalsContact O-N 3.12Å; T19-M21 PolarHBondContact OG1-N 3.14Å; M21-L23 VanDerWaalsContact C-N 3.29Å; M21-L23 PolarHBondContact O-N 2.69Å; M21-R24 PolarHBondContact O-N 2.88Å; M21-L25 PolarHBondContact O-N 2.86Å
22H97.9Very high97.2Very high58 Ų5880.3 Ų80.327%0.26943%0.427SS..Hα-helixtrans-63.2-38.2172.7-60.6132.2000111.5F15 I18 T19 L25 F26F15-H22 HydrophobicContact CD1-CB 4.16Å; F15-H22 AromaticContact CD1-CD2 3.92Å; F15-H22 AromaticContact CD1-CG 3.75Å; F15-H22 AromaticContact CD1-ND1 3.86Å; F15-H22 HydrophobicContact CE1-CB 4.17Å; F15-H22 AromaticContact CE1-CD2 3.94Å; F15-H22 AromaticContact CE1-CG 4Å; I18-H22 HydrophobicContact CG1-CB 3.99Å; T19-H22 PolarHBondContact N-ND1 3.46Å; T19-H22 WeakPolarHBondContact O-CB 3.37Å; T19-H22 PolarHBondContact O-N 3.28Å; T19-H22 PolarHBondContact OG1-N 3.43Å; T19-H22 PolarHBondContact OG1-ND1 2.94Å; T19-H22 VanDerWaalsContact OG1-ND1 3.14Å; H22-L25 WeakPolarHBondContact O-CB 3.31Å; H22-F26 WeakPolarHBondContact O-CD2 3.3Å
23L97.9Very high97.3Very high89 Ų8977.6 Ų77.647%0.46641%0.406SS..Hα-helixtrans-70.9-41.7175.3-58.4178.6000111.3I18 T19 N20 M21 L25 F26 E27 I46I18-L23 HydrophobicContact CD1-CD2 4.03Å; T19-L23 PolarHBondContact O-N 3.36Å; N20-L23 PolarHBondContact O-N 3.41Å; M21-L23 VanDerWaalsContact C-N 3.29Å; M21-L23 PolarHBondContact O-N 2.69Å; L23-L25 PolarHBondContact O-N 3.32Å; L23-F26 PolarHBondContact O-N 2.75Å; L23-F26 VanDerWaalsContact O-N 3.14Å; L23-E27 PolarHBondContact O-N 3.27Å; L23-I46 HydrophobicContact CD2-CD1 4.16Å
24R98.2Very high97.3Very high130 Ų13079.3 Ų79.349%0.49141%0.407SS..Hα-helixtrans-60.5-30.6177.9-174.656.5178.5159.82.7112.6N20 M21 F26 E27 V28N20-R24 WeakPolarHBondContact O-CB 3.38Å; N20-R24 PolarHBondContact O-N 2.92Å; M21-R24 PolarHBondContact O-N 2.88Å; R24-F26 VanDerWaalsContact C-N 3.31Å; R24-F26 PolarHBondContact O-N 2.98Å; R24-E27 PolarHBondContact O-N 3.41Å; R24-V28 HydrophobicContact CG-CG2 4.19Å; R24-V28 WeakPolarHBondContact O-CG2 3.16Å; R24-V28 PolarHBondContact O-N 3.03Å
25L98.2Very high97.5Very high108 Ų10885.5 Ų85.557%0.56543%0.433SS*.Hα-helixtrans-55.4-45.5175.2-176.969.5000111.9M21 H22 L23 A29M21-L25 PolarHBondContact O-N 2.86Å; H22-L25 WeakPolarHBondContact O-CB 3.31Å; L23-L25 PolarHBondContact O-N 3.32Å; L25-A29 VanDerWaalsContact O-CB 3.31Å; L25-A29 WeakPolarHBondContact O-CB 3.16Å; L25-A29 PolarHBondContact O-N 3.34Å
26F98.4Very high97.5Very high27 Ų2786.2 Ų86.212%0.11844%0.44CS..Hα-helixtrans-66.2-42.9179-78-92.8000112.2L9 A11 H22 L23 R24 A29 R30 I45 I46L9-F26 HydrophobicContact CB-CD1 3.91Å; L9-F26 HydrophobicContact CB-CE1 3.82Å; L9-F26 HydrophobicContact CD1-CD1 4.19Å; A11-F26 HydrophobicContact CB-CE1 4.43Å; A11-F26 HydrophobicContact CB-CE2 3.59Å; A11-F26 HydrophobicContact CB-CZ 3.38Å; H22-F26 WeakPolarHBondContact O-CD2 3.3Å; L23-F26 PolarHBondContact O-N 2.75Å; L23-F26 VanDerWaalsContact O-N 3.14Å; R24-F26 VanDerWaalsContact C-N 3.31Å; R24-F26 PolarHBondContact O-N 2.98Å; F26-A29 PolarHBondContact O-N 3.24Å; F26-R30 VanDerWaalsContact O-CB 3.3Å; F26-R30 WeakPolarHBondContact O-CB 3.04Å; F26-R30 PolarHBondContact O-N 3.03Å; F26-I45 WeakPolarHBondContact CZ-O 3.5Å; F26-I46 HydrophobicContact CE2-CD1 4.11Å; F26-I46 HydrophobicContact CE2-CG1 3.58Å; F26-I46 HydrophobicContact CZ-CG1 3.78Å
27E98.4Very high97.6Very high75 Ų7581.1 Ų81.135%0.3542%0.422SS..Hα-helixtrans-62.1-46.8-179.8-65.5-64.6106.100111.4L23 R24 A29 R30 D31L23-E27 PolarHBondContact O-N 3.27Å; R24-E27 PolarHBondContact O-N 3.41Å; E27-A29 PolarHBondContact O-N 2.84Å; E27-R30 VanDerWaalsContact CD-NH1 3.26Å; E27-R30 PolarHBondContact O-N 2.85Å; E27-R30 IonicContact OE1-CZ 3.19Å; E27-R30 IonicContact OE1-NH1 2.83Å; E27-R30 PolarHBondContact OE1-NH1 2.89Å; E27-R30 IonicContact OE1-NH2 3.52Å; E27-R30 IonicContact OE2-CZ 3.8Å; E27-R30 IonicContact OE2-NH1 2.98Å; E27-R30 PolarHBondContact OE2-NH1 3.25Å; E27-R30 IonicContact OE2-NH2 2.7Å; E27-R30 PolarHBondContact OE2-NH2 3.41Å; E27-D31 WeakPolarHBondContact O-CB 3.38Å; E27-D31 PolarHBondContact O-N 2.83Å
28V98.4Very high97.7Very high76 Ų7683.7 Ų83.746%0.46142%0.419SS..Hα-helixtrans-64.7-41.5178.4176.30000111.1R24 H32R24-V28 HydrophobicContact CG-CG2 4.19Å; R24-V28 WeakPolarHBondContact O-CG2 3.16Å; R24-V28 PolarHBondContact O-N 3.03Å; V28-H32 WeakPolarHBondContact O-CB 3.22Å; V28-H32 PolarHBondContact O-N 3.48Å
29A98.4Very high97.7Very high34 Ų3482.6 Ų82.628%0.28141%0.409SS..Hα-helixtrans-65.3-43178.100000112.3L9 L25 F26 E27 H32 L33L9-A29 HydrophobicContact CD1-CB 3.85Å; L25-A29 VanDerWaalsContact O-CB 3.31Å; L25-A29 WeakPolarHBondContact O-CB 3.16Å; L25-A29 PolarHBondContact O-N 3.34Å; F26-A29 PolarHBondContact O-N 3.24Å; E27-A29 PolarHBondContact O-N 2.84Å; A29-H32 PolarHBondContact O-N 3.06Å; A29-L33 WeakPolarHBondContact O-CG 3.35Å; A29-L33 PolarHBondContact O-N 3Å
30R98.2Very high97.7Very high79 Ų7984.1 Ų84.130%0.29841%0.412SS..Hα-helixtrans-58.2-52.5175.1-178.1-166.970.7-147.5-9.8111F26 E27 H32 L33 H34 V41F26-R30 VanDerWaalsContact O-CB 3.3Å; F26-R30 WeakPolarHBondContact O-CB 3.04Å; F26-R30 PolarHBondContact O-N 3.03Å; E27-R30 VanDerWaalsContact CD-NH1 3.26Å; E27-R30 PolarHBondContact O-N 2.85Å; E27-R30 IonicContact OE1-CZ 3.19Å; E27-R30 IonicContact OE1-NH1 2.83Å; E27-R30 PolarHBondContact OE1-NH1 2.89Å; E27-R30 IonicContact OE1-NH2 3.52Å; E27-R30 IonicContact OE2-CZ 3.8Å; E27-R30 IonicContact OE2-NH1 2.98Å; E27-R30 PolarHBondContact OE2-NH1 3.25Å; E27-R30 IonicContact OE2-NH2 2.7Å; E27-R30 PolarHBondContact OE2-NH2 3.41Å; R30-H32 VanDerWaalsContact C-N 3.31Å; R30-H32 PolarHBondContact O-N 3.16Å; R30-L33 PolarHBondContact O-N 2.98Å; R30-H34 PolarHBondContact O-N 3.22Å; R30-V41 HydrophobicContact CB-CG2 4.46Å; R30-V41 HydrophobicContact CG-CB 4.02Å; R30-V41 HydrophobicContact CG-CG1 4.39Å; R30-V41 HydrophobicContact CG-CG2 4.29Å
31D98.3Very high97.6Very high55 Ų5578.6 Ų78.629%0.29438%0.384SS..Hα-helixtrans-62.1-42.2-176.6-67.6-5000110.6E27 H34 Q35E27-D31 WeakPolarHBondContact O-CB 3.38Å; E27-D31 PolarHBondContact O-N 2.83Å; D31-H34 PolarHBondContact O-N 2.79Å; D31-Q35 WeakPolarHBondContact O-CB 3.42Å; D31-Q35 WeakPolarHBondContact O-CG 3.3Å; D31-Q35 PolarHBondContact O-N 3.23Å
32H98.3Very high97.6Very high117 Ų11777 Ų7754%0.54238%0.377SS..Hα-helixtrans-60.2-48.3175.6-179.474000112.2V28 A29 R30 H34 Q35 T36V28-H32 WeakPolarHBondContact O-CB 3.22Å; V28-H32 PolarHBondContact O-N 3.48Å; A29-H32 PolarHBondContact O-N 3.06Å; R30-H32 VanDerWaalsContact C-N 3.31Å; R30-H32 PolarHBondContact O-N 3.16Å; H32-H34 PolarHBondContact O-N 3.14Å; H32-Q35 PolarHBondContact O-N 3.48Å; H32-T36 WeakPolarHBondContact O-CG2 2.81Å; H32-T36 PolarHBondContact O-N 2.7Å
33L97.7Very high97.6Very high35 Ų3579.4 Ų79.418%0.18339%0.388CS..Hα-helixtrans-64-40.5-179.7-75174.1000112.2V7 L9 A29 R30 T36 Y39 V41V7-L33 HydrophobicContact CG1-CD1 4.31Å; L9-L33 HydrophobicContact CD2-CD1 3.77Å; A29-L33 WeakPolarHBondContact O-CG 3.35Å; A29-L33 PolarHBondContact O-N 3Å; R30-L33 PolarHBondContact O-N 2.98Å; L33-T36 PolarHBondContact O-N 2.98Å; L33-T36 PolarHBondContact O-OG1 3.01Å; L33-Y39 HydrophobicContact CD2-CD2 3.78Å; L33-Y39 HydrophobicContact CD2-CE2 4.33Å; L33-Y39 HydrophobicContact CD2-CG 4.18Å; L33-V41 HydrophobicContact CB-CG2 4.01Å; L33-V41 HydrophobicContact CD1-CG2 3.57Å; L33-V41 HydrophobicContact CG-CG2 4.45Å
34H96.9Very high97.7Very high61 Ų6177.3 Ų77.328%0.28239%0.388SS..Hα-helixtrans-66.2-38.7175.5-72.8-178000112.2R30 D31 H32 T36 G37 V41R30-H34 PolarHBondContact O-N 3.22Å; D31-H34 PolarHBondContact O-N 2.79Å; H32-H34 PolarHBondContact O-N 3.14Å; H34-T36 PolarHBondContact O-N 3.42Å; H34-G37 PolarHBondContact O-N 3.48Å; H34-V41 PolarHBondContact NE2-N 3.04Å; H34-V41 VanDerWaalsContact NE2-N 3.14Å
35Q97.2Very high97.7Very high154 Ų15474.3 Ų74.372%0.7238%0.381SS*.Hα-helixtrans-61-29.6177.5-77.5167.626.300113D31 H32 G37D31-Q35 WeakPolarHBondContact O-CB 3.42Å; D31-Q35 WeakPolarHBondContact O-CG 3.3Å; D31-Q35 PolarHBondContact O-N 3.23Å; H32-Q35 PolarHBondContact O-N 3.48Å; Q35-G37 PolarHBondContact O-N 3.29Å; Q35-G37 VanDerWaalsContact O-N 3.14Å
36T95.9Very high97.7Very high49 Ų4971.9 Ų71.930%0.30137%0.368SS..THydrogen-bonded Turntrans-63.6-17.8173.774.10000113.3H32 L33 H34 R38 Y39H32-T36 WeakPolarHBondContact O-CG2 2.81Å; H32-T36 PolarHBondContact O-N 2.7Å; L33-T36 PolarHBondContact O-N 2.98Å; L33-T36 PolarHBondContact O-OG1 3.01Å; H34-T36 PolarHBondContact O-N 3.42Å; T36-R38 PolarHBondContact O-N 3.07Å; T36-R38 VanDerWaalsContact O-N 3.07Å; T36-R38 PolarHBondContact OG1-N 3.05Å; T36-Y39 WeakPolarHBondContact OG1-CD2 3.13Å
37G94.8Very high97.6Very high36 Ų3672.9 Ų72.937%0.37138%0.378SS..SBendtrans70-3.2-17600000114.9H34 Q35H34-G37 PolarHBondContact O-N 3.48Å; Q35-G37 PolarHBondContact O-N 3.29Å; Q35-G37 VanDerWaalsContact O-N 3.14Å
38R95.8Very high97.6Very high153 Ų15373.5 Ų73.558%0.57739%0.389SS*.SBendtrans-95.6-31.6-177.1-64.7-173.4-67.2174.9-2.5113.3R4 I5 T36R4-R38 CarbonylContact C-O 3.46Å; R4-R38 WeakPolarHBondContact CA-O 3.4Å; I5-R38 PolarHBondContact N-O 3.14Å; T36-R38 PolarHBondContact O-N 3.07Å; T36-R38 VanDerWaalsContact O-N 3.07Å; T36-R38 PolarHBondContact OG1-N 3.05Å
39Y97.9Very high97.4Very high61 Ų6172 Ų7224%0.23938%0.38CS..EExtended strand (participates in β ladder)trans-114.1152.2-171.5-56.5-74.6000111.9I5 V7 L33 T36I5-Y39 HydrophobicContact CB-CD1 3.78Å; I5-Y39 HydrophobicContact CB-CE1 4.14Å; I5-Y39 HydrophobicContact CD1-CD1 4.32Å; I5-Y39 HydrophobicContact CD1-CE1 3.85Å; I5-Y39 HydrophobicContact CG2-CD1 4.12Å; I5-Y39 HydrophobicContact CG2-CE1 4.31Å; I5-Y39 CarbonylContact O-C 3.56Å; I5-Y39 WeakPolarHBondContact O-CA 3.32Å; V7-Y39 HydrophobicContact CG2-CD1 3.67Å; V7-Y39 HydrophobicContact CG2-CG 4.23Å; L33-Y39 HydrophobicContact CD2-CD2 3.78Å; L33-Y39 HydrophobicContact CD2-CE2 4.33Å; L33-Y39 HydrophobicContact CD2-CG 4.18Å; T36-Y39 WeakPolarHBondContact OG1-CD2 3.13Å
40Q97.6Very high97.3Very high92 Ų9275.6 Ų75.643%0.4339%0.394SS..EExtended strand (participates in β ladder)trans-129.9102.9170.2178.6170.6-30.700108.1R4 I5 P6 V7 I42R4-Q40 HydrophobicContact CB-CB 3.82Å; I5-Q40 PolarHBondContact O-N 2.91Å; P6-Q40 CarbonylContact C-O 3.49Å; P6-Q40 VanDerWaalsContact CA-O 3.32Å; P6-Q40 WeakPolarHBondContact CA-O 3.38Å; V7-Q40 PolarHBondContact N-O 2.84Å; Q40-I42 HydrophobicContact CG-CG2 4.3Å; Q40-I42 PolarHBondContact O-N 3.05Å
41V97.8Very high96.9Very high21 Ų2179.7 Ų79.713%0.12742%0.422CS..EExtended strand (participates in β ladder)trans-64.3126.8169.5-179.80000109.3V7 L9 R30 L33 H34V7-V41 CarbonylContact O-C 3.58Å; V7-V41 VanDerWaalsContact O-CA 3.27Å; V7-V41 WeakPolarHBondContact O-CA 3.35Å; L9-V41 HydrophobicContact CD1-CG1 3.96Å; L9-V41 HydrophobicContact CD1-CG2 4.23Å; L9-V41 HydrophobicContact CG-CG1 3.93Å; L9-V41 HydrophobicContact CG-CG2 4.29Å; R30-V41 HydrophobicContact CB-CG2 4.46Å; R30-V41 HydrophobicContact CG-CB 4.02Å; R30-V41 HydrophobicContact CG-CG1 4.39Å; R30-V41 HydrophobicContact CG-CG2 4.29Å; L33-V41 HydrophobicContact CB-CG2 4.01Å; L33-V41 HydrophobicContact CD1-CG2 3.57Å; L33-V41 HydrophobicContact CG-CG2 4.45Å; H34-V41 PolarHBondContact NE2-N 3.04Å; H34-V41 VanDerWaalsContact NE2-N 3.14Å
42I98Very high96.5Very high106 Ų10682.2 Ų82.254%0.54444%0.444SS..EExtended strand (participates in β ladder)trans-109.6-23.6-178.758.2169.7000112.8P6 V7 V8 Q40P6-I42 HydrophobicContact CB-CD1 4.2Å; P6-I42 HydrophobicContact CB-CG2 4.23Å; V7-I42 WeakPolarHBondContact O-CG1 3.34Å; V7-I42 PolarHBondContact O-N 3.26Å; V8-I42 HydrophobicContact CG2-CD1 4.08Å; V8-I42 HydrophobicContact CG2-CG1 3.91Å; Q40-I42 HydrophobicContact CG-CG2 4.3Å; Q40-I42 PolarHBondContact O-N 3.05Å
43E98.2Very high95.8Very high110 Ų11084.3 Ų84.351%0.51445%0.448SS..EExtended strand (participates in β ladder)trans-157153.5-177.2-173.5171.6-171.800111V8 L9 I45V8-E43 WeakPolarHBondContact CA-O 3.43Å; V8-E43 HydrophobicContact CG1-CB 4.07Å; V8-E43 HydrophobicContact CG1-CG 4.4Å; V8-E43 HydrophobicContact CG2-CB 4.18Å; L9-E43 PolarHBondContact N-O 3.07Å; E43-I45 HydrophobicContact CG-CG1 4.21Å
44G98.1Very high94.6Very high44 Ų4485.6 Ų85.645%0.45447%0.47SS..EExtended strand (participates in β ladder)trans-129.6129.2171.300000110.3L9L9-G44 CarbonylContact O-C 3.56Å; L9-G44 WeakPolarHBondContact O-CA 3.4Å
45I98.6Very high92.8Very high68 Ų6889.1 Ų89.135%0.34949%0.485SS..EExtended strand (participates in β ladder)trans-118.9124.6-176.2-57.5175000109V8 L9 L10 A11 F26 E43V8-I45 HydrophobicContact CG1-CD1 3.83Å; V8-I45 HydrophobicContact CG1-CG1 4.09Å; L9-I45 PolarHBondContact O-N 3Å; L10-I45 WeakPolarHBondContact CA-O 3.11Å; L10-I45 HydrophobicContact CD1-CB 3.9Å; L10-I45 HydrophobicContact CD1-CG2 3.75Å; A11-I45 PolarHBondContact N-O 2.99Å; F26-I45 WeakPolarHBondContact CZ-O 3.5Å; E43-I45 HydrophobicContact CG-CG1 4.21Å
46I98.2Very high90.5Very high56 Ų5694.9 Ų94.929%0.28751%0.507SS..EExtended strand (participates in β ladder)trans-94.5120.3168-65.3-177.8000107F15 I18 L23 F26 P48F15-I46 HydrophobicContact CD1-CG2 4.25Å; F15-I46 HydrophobicContact CD2-CG2 3.46Å; F15-I46 VanDerWaalsContact CD2-CG2 3.46Å; F15-I46 HydrophobicContact CE1-CG2 4.18Å; F15-I46 HydrophobicContact CE2-CG2 3.39Å; F15-I46 HydrophobicContact CG-CG2 3.91Å; F15-I46 HydrophobicContact CZ-CG2 3.77Å; I18-I46 HydrophobicContact CD1-CD1 3.61Å; L23-I46 HydrophobicContact CD2-CD1 4.16Å; F26-I46 HydrophobicContact CE2-CD1 4.11Å; F26-I46 HydrophobicContact CE2-CG1 3.58Å; F26-I46 HydrophobicContact CZ-CG1 3.78Å; I46-P48 WeakPolarHBondContact O-CD 3.42Å
47S97.9Very high90.3Very high49 Ų4997.2 Ų97.234%0.34352%0.518SS..EExtended strand (participates in β ladder)trans-113.595.6179.1-179.40000110.1A11 C12 G13A11-S47 PolarHBondContact O-N 3.14Å; C12-S47 WeakPolarHBondContact CA-O 3.35Å; G13-S47 PolarHBondContact N-O 3Å
48P96.7Very high90Very high87 Ų87100.4 Ų100.457%0.56553%0.525SS*.EExtended strand (participates in β ladder)trans-55.5138.2171.6-25.135.6000111.6G13 F15 I46G13-P48 CarbonylContact O-C 3.05Å; G13-P48 VanDerWaalsContact O-CA 3.22Å; G13-P48 WeakPolarHBondContact O-CA 3.43Å; F15-P48 HydrophobicContact CD2-CG 4.5Å; I46-P48 WeakPolarHBondContact O-CD 3.42Å
49V96Very high89.7Confident46 Ų4697.5 Ų97.528%0.27952%0.522SS..PPolyproline II helixtrans-70.3151.2176.483.20000110.8G13 S14 Y53G13-V49 PolarHBondContact O-N 3.37Å; S14-V49 VanDerWaalsContact OG-CG1 3.3Å; S14-V49 WeakPolarHBondContact OG-CG1 3.29Å; V49-Y53 HydrophobicContact CB-CD1 4.32Å; V49-Y53 HydrophobicContact CB-CG 4.3Å; V49-Y53 HydrophobicContact CG1-CD1 3.86Å; V49-Y53 HydrophobicContact CG1-CG 4.1Å; V49-Y53 HydrophobicContact CG2-CD1 3.62Å; V49-Y53 HydrophobicContact CG2-CD2 3.5Å; V49-Y53 HydrophobicContact CG2-CE1 4.16Å; V49-Y53 HydrophobicContact CG2-CE2 4.05Å; V49-Y53 HydrophobicContact CG2-CG 3.26Å
50N94.6Very high89.2Confident109 Ų10999.6 Ų99.658%0.58354%0.539SS*.PPolyproline II helixtrans-63145.6173.6-173.8-86.8000111.4S52 Y53N50-S52 PolarHBondContact O-N 2.89Å; N50-S52 VanDerWaalsContact O-N 3.16Å; N50-S52 WeakPolarHBondContact OD1-CB 3.45Å; N50-S52 PolarHBondContact OD1-N 3.32Å; N50-S52 PolarHBondContact OD1-OG 3.34Å; N50-Y53 WeakPolarHBondContact O-CB 3.41Å; N50-Y53 PolarHBondContact O-N 3.12Å
51D89.9Confident88.7Confident164 Ų164100.1 Ų100.188%0.87755%0.546SS*.G310 helixtrans-59.6-28.4179.8-62.4-40000113.2Y53D51-Y53 PolarHBondContact O-N 3.42Å
52S91.3Very high88.1Confident108 Ų108105.4 Ų105.476%0.75557%0.574SS**G310 helixtrans-74.3-2.9177.6-48.40000113.6N50 G54N50-S52 PolarHBondContact O-N 2.89Å; N50-S52 VanDerWaalsContact O-N 3.16Å; N50-S52 WeakPolarHBondContact OD1-CB 3.45Å; N50-S52 PolarHBondContact OD1-N 3.32Å; N50-S52 PolarHBondContact OD1-OG 3.34Å; S52-G54 PolarHBondContact O-N 3.46Å
53Y83.5Confident87.4Confident162 Ų162105.4 Ų105.464%0.63558%0.576SS**G310 helixtrans-64.8-5.8-178.4-176.9-108.2000114V49 N50 D51 K55V49-Y53 HydrophobicContact CB-CD1 4.32Å; V49-Y53 HydrophobicContact CB-CG 4.3Å; V49-Y53 HydrophobicContact CG1-CD1 3.86Å; V49-Y53 HydrophobicContact CG1-CG 4.1Å; V49-Y53 HydrophobicContact CG2-CD1 3.62Å; V49-Y53 HydrophobicContact CG2-CD2 3.5Å; V49-Y53 HydrophobicContact CG2-CE1 4.16Å; V49-Y53 HydrophobicContact CG2-CE2 4.05Å; V49-Y53 HydrophobicContact CG2-CG 3.26Å; N50-Y53 WeakPolarHBondContact O-CB 3.41Å; N50-Y53 PolarHBondContact O-N 3.12Å; D51-Y53 PolarHBondContact O-N 3.42Å; Y53-K55 HydrophobicContact CD1-CG 4.45Å
54G71.3Confident86.6Confident62 Ų62105 Ų10564%0.63958%0.581SS**  trans74.640.6170.800000112.6S52 K56S52-G54 PolarHBondContact O-N 3.46Å; G54-K56 PolarHBondContact O-N 3.37Å
55K58.8Low85.6Confident135 Ų135110.1 Ų110.159%0.58759%0.591SS**  trans-67.6103.6160.3-83.4-159149.7176.90108.6S14 Y53S14-K55 WeakPolarHBondContact OG-CD 3.39Å; S14-K55 WeakPolarHBondContact OG-CE 3.4Å; S14-K55 PolarHBondContact OG-NZ 3.14Å; Y53-K55 HydrophobicContact CD1-CG 4.45Å
56K50.4Low84.4Confident275 Ų275113.9 Ų113.9100%1.19661%0.613SS**  trans-63.40159-82.8-173.5175.1-178.10110.2G54G54-K56 PolarHBondContact O-N 3.37Å

Retrieved 56 of 56 residues in 58.4 ms (Link to these results)