A0A077ZLP0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLP0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 81 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
1M63.5Low85.8Confident115 Ų115111.4 Ų111.457%0.56755%0.547SS*.  0129.50-76.5-162-161.600106.2L3 R14 L15 I18M1-L3 HydrophobicContact CB-CD2 3.99Å; M1-L3 PolarHBondContact O-N 2.63Å; M1-R14 HydrophobicContact SD-CG 4Å; M1-R14 VanDerWaalsContact SD-CZ 3.57Å; M1-L15 HydrophobicContact CE-CD2 4.41Å; M1-I18 HydrophobicContact CE-CB 4.29Å; M1-I18 HydrophobicContact CE-CD1 3.26Å; M1-I18 HydrophobicContact CE-CG1 4.33Å; M1-I18 HydrophobicContact CE-CG2 4.24Å; M1-I18 HydrophobicContact SD-CD1 4.22Å
2D78.4Confident86.3Confident133 Ų133110.6 Ų110.671%0.71154%0.541SS*.  trans-63.6123.9164.6-81.1-38.1000108.8R14D2-R14 PolarHBondContact O-NH1 3.34Å; D2-R14 VanDerWaalsContact O-NH1 3.15Å
3L82.9Confident86.7Confident80 Ų80108.1 Ų108.142%0.41953%0.532SS..  trans-112.83-179.6-58.2-179.5000111.6M1 N5 Y6 V11M1-L3 HydrophobicContact CB-CD2 3.99Å; M1-L3 PolarHBondContact O-N 2.63Å; L3-N5 PolarHBondContact O-N 2.96Å; L3-Y6 PolarHBondContact O-N 3.19Å; L3-V11 HydrophobicContact CB-CG2 4.38Å; L3-V11 HydrophobicContact CD1-CG1 4.1Å; L3-V11 HydrophobicContact CD2-CB 4.39Å; L3-V11 HydrophobicContact CD2-CG1 3.8Å; L3-V11 HydrophobicContact CD2-CG2 3.87Å; L3-V11 HydrophobicContact CG-CG2 4.49Å
4D82.5Confident86.9Confident129 Ų129105.6 Ų105.669%0.6951%0.514SS*.THydrogen-bonded Turntrans-64.1133.8-179.7-69-21.9000110.8Y6D4-Y6 WeakPolarHBondContact O-CD2 3.35Å; D4-Y6 PolarHBondContact O-N 3.32Å
5N87.4Confident87.2Confident171 Ų171103.6 Ų103.691%0.91451%0.506SS*.THydrogen-bonded Turntrans659.5-173.9-57.8-64.9000116.8L3L3-N5 PolarHBondContact O-N 2.96Å
6Y87.1Confident87.5Confident117 Ų117101 Ų10146%0.45950%0.501SS..  trans-88.7140.2171.8-72.3-79000111.5L3 D4 D10L3-Y6 PolarHBondContact O-N 3.19Å; D4-Y6 WeakPolarHBondContact O-CD2 3.35Å; D4-Y6 PolarHBondContact O-N 3.32Å; Y6-D10 HydrophobicContact CD1-CB 3.62Å; Y6-D10 HydrophobicContact CG-CB 4.34Å
7T92.7Very high87.5Confident80 Ų80106.4 Ų106.449%0.49151%0.514SS..  trans-74.1161.3169.371.40000110.2Q9 D10 V11T7-Q9 PolarHBondContact O-N 3.18Å; T7-Q9 VanDerWaalsContact O-N 3.1Å; T7-D10 WeakPolarHBondContact CB-OD2 3.49Å; T7-D10 PolarHBondContact N-OD2 3.45Å; T7-D10 PolarHBondContact O-N 3.1Å; T7-D10 PolarHBondContact OG1-N 3.07Å; T7-D10 PolarHBondContact OG1-OD2 3.04Å; T7-V11 WeakPolarHBondContact O-CG2 3.44Å; T7-V11 PolarHBondContact O-N 3.08Å; T7-V11 VanDerWaalsContact O-N 3.07Å
8R91.8Very high87.7Confident208 Ų208105.4 Ų105.479%0.78551%0.511SS*.Hα-helixtrans-49.6-39.4174.4-168.9-169.391.1106.82.3112.2H12R8-H12 WeakPolarHBondContact O-CB 3.46Å; R8-H12 PolarHBondContact O-N 3.31Å; R8-H12 VanDerWaalsContact O-N 3.08Å
9Q93Very high88Confident91 Ų91107.1 Ų107.143%0.42552%0.522SS..Hα-helixtrans-69.7-41.8-178.4-167.258.83900111.4T7 V11 H12 D13T7-Q9 PolarHBondContact O-N 3.18Å; T7-Q9 VanDerWaalsContact O-N 3.1Å; Q9-V11 VanDerWaalsContact C-N 3.33Å; Q9-V11 PolarHBondContact O-N 2.88Å; Q9-H12 WeakPolarHBondContact O-CB 3.28Å; Q9-H12 PolarHBondContact O-N 3.15Å; Q9-D13 PolarHBondContact NE2-OD1 3.44Å; Q9-D13 PolarHBondContact NE2-OD2 2.97Å; Q9-D13 WeakPolarHBondContact O-CB 3.2Å; Q9-D13 VanDerWaalsContact O-CG 3.31Å; Q9-D13 PolarHBondContact O-N 2.99Å
10D91.5Very high88.2Confident72 Ų72103.4 Ų103.439%0.38551%0.513SS..Hα-helixtrans-63.9-41.1178.2-56.1-48.3000111.9Y6 T7 H12 D13 R14Y6-D10 HydrophobicContact CD1-CB 3.62Å; Y6-D10 HydrophobicContact CG-CB 4.34Å; T7-D10 WeakPolarHBondContact CB-OD2 3.49Å; T7-D10 PolarHBondContact N-OD2 3.45Å; T7-D10 PolarHBondContact O-N 3.1Å; T7-D10 PolarHBondContact OG1-N 3.07Å; T7-D10 PolarHBondContact OG1-OD2 3.04Å; D10-H12 VanDerWaalsContact C-N 3.35Å; D10-D13 PolarHBondContact O-N 2.95Å; D10-R14 WeakPolarHBondContact O-CB 3.49Å; D10-R14 PolarHBondContact O-N 3.48Å
11V92.7Very high88.5Confident29 Ų29104 Ų10418%0.17651%0.512CS..Hα-helixtrans-62-46.3175.7178.30000110.3L3 T7 Q9 R14 L15L3-V11 HydrophobicContact CB-CG2 4.38Å; L3-V11 HydrophobicContact CD1-CG1 4.1Å; L3-V11 HydrophobicContact CD2-CB 4.39Å; L3-V11 HydrophobicContact CD2-CG1 3.8Å; L3-V11 HydrophobicContact CD2-CG2 3.87Å; L3-V11 HydrophobicContact CG-CG2 4.49Å; T7-V11 WeakPolarHBondContact O-CG2 3.44Å; T7-V11 PolarHBondContact O-N 3.08Å; T7-V11 VanDerWaalsContact O-N 3.07Å; Q9-V11 VanDerWaalsContact C-N 3.33Å; Q9-V11 PolarHBondContact O-N 2.88Å; V11-R14 PolarHBondContact O-N 3.44Å; V11-L15 HydrophobicContact CG1-CD1 3.89Å; V11-L15 HydrophobicContact CG1-CG 4.48Å; V11-L15 WeakPolarHBondContact O-CB 3.47Å; V11-L15 VanDerWaalsContact O-CG 3.28Å; V11-L15 WeakPolarHBondContact O-CG 3.41Å; V11-L15 PolarHBondContact O-N 3.5Å
12H92.4Very high89.9Confident102 Ų102102.3 Ų102.347%0.47251%0.509SS..Hα-helixtrans-59.7-49.6177.9176.4-86.3000111.9R8 Q9 D10 R14 L15 S16R8-H12 WeakPolarHBondContact O-CB 3.46Å; R8-H12 PolarHBondContact O-N 3.31Å; R8-H12 VanDerWaalsContact O-N 3.08Å; Q9-H12 WeakPolarHBondContact O-CB 3.28Å; Q9-H12 PolarHBondContact O-N 3.15Å; D10-H12 VanDerWaalsContact C-N 3.35Å; H12-R14 VanDerWaalsContact C-N 3.33Å; H12-R14 PolarHBondContact O-N 3.5Å; H12-L15 PolarHBondContact O-N 2.85Å; H12-S16 WeakPolarHBondContact O-CB 3.42Å; H12-S16 PolarHBondContact O-N 3.23Å
13D91.6Very high90.6Very high78 Ų78104.9 Ų104.942%0.41751%0.514SS..Hα-helixtrans-70-34.4-175.1-66.7-15.1000111.4Q9 D10 S16 R17Q9-D13 PolarHBondContact NE2-OD1 3.44Å; Q9-D13 PolarHBondContact NE2-OD2 2.97Å; Q9-D13 WeakPolarHBondContact O-CB 3.2Å; Q9-D13 VanDerWaalsContact O-CG 3.31Å; Q9-D13 PolarHBondContact O-N 2.99Å; D10-D13 PolarHBondContact O-N 2.95Å; D13-S16 PolarHBondContact O-N 3.35Å; D13-R17 VanDerWaalsContact O-CB 3.28Å; D13-R17 WeakPolarHBondContact O-CB 3.28Å; D13-R17 PolarHBondContact O-N 3.26Å
14R89.3Confident91.2Very high74 Ų74109.6 Ų109.628%0.27953%0.531SS..Hα-helixtrans-65.2-44.2172.5-173.4173.2-178.4-153.63.1111.9M1 D2 D10 V11 H12 R17 I18M1-R14 HydrophobicContact SD-CG 4Å; M1-R14 VanDerWaalsContact SD-CZ 3.57Å; D2-R14 PolarHBondContact O-NH1 3.34Å; D2-R14 VanDerWaalsContact O-NH1 3.15Å; D10-R14 WeakPolarHBondContact O-CB 3.49Å; D10-R14 PolarHBondContact O-N 3.48Å; V11-R14 PolarHBondContact O-N 3.44Å; H12-R14 VanDerWaalsContact C-N 3.33Å; H12-R14 PolarHBondContact O-N 3.5Å; R14-R17 PolarHBondContact O-N 2.82Å; R14-I18 HydrophobicContact CG-CD1 3.94Å; R14-I18 WeakPolarHBondContact O-CG1 3.41Å; R14-I18 PolarHBondContact O-N 2.92Å; R14-I18 VanDerWaalsContact O-N 3.11Å
15L91.2Very high91.7Very high75 Ų75107.2 Ų107.239%0.39352%0.517SS..Hα-helixtrans-63-47.5175-75.3168.7000111.1M1 V11 H12 R17 I18 L19M1-L15 HydrophobicContact CE-CD2 4.41Å; V11-L15 HydrophobicContact CG1-CD1 3.89Å; V11-L15 HydrophobicContact CG1-CG 4.48Å; V11-L15 WeakPolarHBondContact O-CB 3.47Å; V11-L15 VanDerWaalsContact O-CG 3.28Å; V11-L15 WeakPolarHBondContact O-CG 3.41Å; V11-L15 PolarHBondContact O-N 3.5Å; H12-L15 PolarHBondContact O-N 2.85Å; L15-R17 PolarHBondContact O-N 3.2Å; L15-I18 PolarHBondContact O-N 3.27Å; L15-L19 HydrophobicContact CD2-CD1 4.24Å; L15-L19 PolarHBondContact O-N 3.11Å
16S91.5Very high92.1Very high62 Ų62103.4 Ų103.443%0.43450%0.496SS..Hα-helixtrans-61.7-30.9177.7-173.60000112.4H12 D13 G20H12-S16 WeakPolarHBondContact O-CB 3.42Å; H12-S16 PolarHBondContact O-N 3.23Å; D13-S16 PolarHBondContact O-N 3.35Å; S16-G20 WeakPolarHBondContact O-CA 3.08Å; S16-G20 PolarHBondContact O-N 3.02Å
17R88.6Confident92.5Very high193 Ų193102 Ų10273%0.72849%0.494SS*.Hα-helixtrans-75-36.4176.7-175.417364.3100.7-2.9113D13 R14 L15D13-R17 VanDerWaalsContact O-CB 3.28Å; D13-R17 WeakPolarHBondContact O-CB 3.28Å; D13-R17 PolarHBondContact O-N 3.26Å; R14-R17 PolarHBondContact O-N 2.82Å; L15-R17 PolarHBondContact O-N 3.2Å
18I90.6Very high92.6Very high88 Ų88104.1 Ų104.145%0.45150%0.498SS..Hα-helixtrans-87.2-40.4-174.5-68.1170.2000111.3M1 R14 L15M1-I18 HydrophobicContact CE-CB 4.29Å; M1-I18 HydrophobicContact CE-CD1 3.26Å; M1-I18 HydrophobicContact CE-CG1 4.33Å; M1-I18 HydrophobicContact CE-CG2 4.24Å; M1-I18 HydrophobicContact SD-CD1 4.22Å; R14-I18 HydrophobicContact CG-CD1 3.94Å; R14-I18 WeakPolarHBondContact O-CG1 3.41Å; R14-I18 PolarHBondContact O-N 2.92Å; R14-I18 VanDerWaalsContact O-N 3.11Å; L15-I18 PolarHBondContact O-N 3.27Å
19L93Very high92.7Very high137 Ų13797.8 Ų97.872%0.71748%0.477SS*.THydrogen-bonded Turntrans-113.8-21.1-173.7-60.6174.9000113.2L15L15-L19 HydrophobicContact CD2-CD1 4.24Å; L15-L19 PolarHBondContact O-N 3.11Å
20G93.1Very high92.7Very high33 Ų33100.6 Ų100.634%0.3448%0.484SS..SBendtrans-72.6148.6-177.400000112.6S16S16-G20 WeakPolarHBondContact O-CA 3.08Å; S16-G20 PolarHBondContact O-N 3.02Å
21K94.2Very high92.6Very high117 Ų11799.4 Ų99.451%0.50948%0.479SS..PPolyproline II helixtrans-60.1139.5172.8-65.5-174-174.6-171.60109.7I25 L26 E29K21-I25 HydrophobicContact CB-CG2 4.44Å; K21-I25 HydrophobicContact CD-CG2 4.12Å; K21-L26 HydrophobicContact CB-CD1 4.47Å; K21-L26 HydrophobicContact CB-CD2 3.99Å; K21-L26 HydrophobicContact CB-CG 3.93Å; K21-L26 HydrophobicContact CD-CD2 3.89Å; K21-E29 IonicContact NZ-OE1 2.75Å; K21-E29 PolarHBondContact NZ-OE1 2.71Å; K21-E29 IonicContact NZ-OE2 2.65Å; K21-E29 PolarHBondContact NZ-OE2 3.12Å
22T92.9Very high92.5Very high80 Ų80101.3 Ų101.349%0.49149%0.491SS..PPolyproline II helixtrans-65.9149.917362.40000110.2K24 I25 L26T22-K24 PolarHBondContact O-N 3.38Å; T22-K24 VanDerWaalsContact O-N 3.09Å; T22-I25 PolarHBondContact O-N 2.87Å; T22-I25 WeakPolarHBondContact OG1-CD1 3.47Å; T22-I25 WeakPolarHBondContact OG1-CG1 3.39Å; T22-I25 PolarHBondContact OG1-N 3.42Å; T22-L26 PolarHBondContact O-N 3.06Å
23K92.9Very high92.2Very high187 Ų187101 Ų10181%0.81350%0.496SS*.Hα-helixtrans-53.1-33.2175.6-66.2-175.3178.5-178.80112.5L26 E27K23-L26 PolarHBondContact O-N 3.45Å; K23-E27 WeakPolarHBondContact O-CB 3.35Å; K23-E27 PolarHBondContact O-N 2.96Å
24K94.7Very high91.8Very high179 Ų179100.2 Ų100.278%0.77850%0.5SS*.Hα-helixtrans-64.4-42.9176.3-173179.1179-178.40112.4T22 H28T22-K24 PolarHBondContact O-N 3.38Å; T22-K24 VanDerWaalsContact O-N 3.09Å; K24-H28 VanDerWaalsContact O-CB 3.32Å; K24-H28 WeakPolarHBondContact O-CB 3.28Å; K24-H28 PolarHBondContact O-N 3.42Å
25I94.4Very high91.3Very high79 Ų79104.4 Ų104.441%0.40552%0.521SS..Hα-helixtrans-67.2-44.7176.9-67.3167.9000109.9K21 T22 E27 H28 E29K21-I25 HydrophobicContact CB-CG2 4.44Å; K21-I25 HydrophobicContact CD-CG2 4.12Å; T22-I25 PolarHBondContact O-N 2.87Å; T22-I25 WeakPolarHBondContact OG1-CD1 3.47Å; T22-I25 WeakPolarHBondContact OG1-CG1 3.39Å; T22-I25 PolarHBondContact OG1-N 3.42Å; I25-E27 VanDerWaalsContact C-N 3.33Å; I25-E27 PolarHBondContact O-N 3.09Å; I25-H28 PolarHBondContact O-N 2.93Å; I25-E29 HydrophobicContact CG2-CG 4.34Å; I25-E29 WeakPolarHBondContact O-CG 3.48Å; I25-E29 PolarHBondContact O-N 2.75Å
26L95.2Very high90.5Very high90 Ų90104.4 Ų104.447%0.47153%0.532SS..Hα-helixtrans-59.6-44.2178.1-69171.2000111.9K21 T22 K23 E29 R30K21-L26 HydrophobicContact CB-CD1 4.47Å; K21-L26 HydrophobicContact CB-CD2 3.99Å; K21-L26 HydrophobicContact CB-CG 3.93Å; K21-L26 HydrophobicContact CD-CD2 3.89Å; T22-L26 PolarHBondContact O-N 3.06Å; K23-L26 PolarHBondContact O-N 3.45Å; L26-E29 PolarHBondContact O-N 2.68Å; L26-R30 WeakPolarHBondContact O-CB 3.38Å; L26-R30 PolarHBondContact O-N 2.92Å
27E95.8Very high90Very high88 Ų88108.1 Ų108.141%0.41154%0.542SS..Hα-helixtrans-67.3-39.4176.7-17757.2-16300111.9K23 I25 R30 V31K23-E27 WeakPolarHBondContact O-CB 3.35Å; K23-E27 PolarHBondContact O-N 2.96Å; I25-E27 VanDerWaalsContact C-N 3.33Å; I25-E27 PolarHBondContact O-N 3.09Å; E27-R30 PolarHBondContact O-N 3.36Å; E27-R30 IonicContact OE1-CZ 3.46Å; E27-R30 IonicContact OE1-NE 3.38Å; E27-R30 PolarHBondContact OE1-NE 3.36Å; E27-R30 IonicContact OE1-NH2 2.71Å; E27-R30 PolarHBondContact OE1-NH2 3.44Å; E27-R30 IonicContact OE2-CZ 3.68Å; E27-R30 IonicContact OE2-NE 2.87Å; E27-R30 PolarHBondContact OE2-NE 2.97Å; E27-R30 IonicContact OE2-NH2 3.63Å; E27-V31 HydrophobicContact CG-CG2 4.49Å; E27-V31 WeakPolarHBondContact O-CB 3.42Å; E27-V31 VanDerWaalsContact O-CG2 3.28Å; E27-V31 WeakPolarHBondContact O-CG2 3.41Å; E27-V31 PolarHBondContact O-N 2.85Å
28H94.3Very high89.8Confident125 Ų125102.3 Ų102.358%0.57953%0.525SS*.Hα-helixtrans-62-45175179.2-84000112K24 I25 V31 T32K24-H28 VanDerWaalsContact O-CB 3.32Å; K24-H28 WeakPolarHBondContact O-CB 3.28Å; K24-H28 PolarHBondContact O-N 3.42Å; I25-H28 PolarHBondContact O-N 2.93Å; H28-V31 PolarHBondContact O-N 3.2Å; H28-T32 PolarHBondContact CE1-OG1 3.49Å; H28-T32 VanDerWaalsContact CE1-OG1 3.23Å; H28-T32 PolarHBondContact ND1-OG1 3.47Å; H28-T32 WeakPolarHBondContact O-CB 3.38Å; H28-T32 PolarHBondContact O-N 3.08Å; H28-T32 PolarHBondContact O-OG1 2.93Å
29E93.6Very high89.5Confident74 Ų74104 Ų10435%0.34654%0.535SS..Hα-helixtrans-59.2-48.8175.4-73.9175.2-179.500110.4K21 I25 L26 V31 T32 T33K21-E29 IonicContact NZ-OE1 2.75Å; K21-E29 PolarHBondContact NZ-OE1 2.71Å; K21-E29 IonicContact NZ-OE2 2.65Å; K21-E29 PolarHBondContact NZ-OE2 3.12Å; I25-E29 HydrophobicContact CG2-CG 4.34Å; I25-E29 WeakPolarHBondContact O-CG 3.48Å; I25-E29 PolarHBondContact O-N 2.75Å; L26-E29 PolarHBondContact O-N 2.68Å; E29-V31 VanDerWaalsContact C-N 3.34Å; E29-V31 PolarHBondContact O-N 2.95Å; E29-T32 PolarHBondContact O-N 3.4Å; E29-T32 VanDerWaalsContact O-N 3.13Å; E29-T33 PolarHBondContact O-N 3.23Å; E29-T33 PolarHBondContact O-OG1 2.9Å; E29-T33 VanDerWaalsContact O-OG1 3.08Å
30R92.5Very high89.3Confident151 Ų151100.4 Ų100.457%0.5753%0.525SS*.Hα-helixtrans-55.4-47.7177.1-167.5-171.474.781.51.6112.2L26 E27 A34L26-R30 WeakPolarHBondContact O-CB 3.38Å; L26-R30 PolarHBondContact O-N 2.92Å; E27-R30 PolarHBondContact O-N 3.36Å; E27-R30 IonicContact OE1-CZ 3.46Å; E27-R30 IonicContact OE1-NE 3.38Å; E27-R30 PolarHBondContact OE1-NE 3.36Å; E27-R30 IonicContact OE1-NH2 2.71Å; E27-R30 PolarHBondContact OE1-NH2 3.44Å; E27-R30 IonicContact OE2-CZ 3.68Å; E27-R30 IonicContact OE2-NE 2.87Å; E27-R30 PolarHBondContact OE2-NE 2.97Å; E27-R30 IonicContact OE2-NH2 3.63Å; R30-A34 WeakPolarHBondContact O-CB 3.32Å; R30-A34 PolarHBondContact O-N 3.38Å; R30-A34 VanDerWaalsContact O-N 3.12Å
31V90.9Very high89.3Confident47 Ų47104.3 Ų104.329%0.28553%0.53SS..Hα-helixtrans-68.3-36.71791730000111.5E27 H28 E29 A34 K35E27-V31 HydrophobicContact CG-CG2 4.49Å; E27-V31 WeakPolarHBondContact O-CB 3.42Å; E27-V31 VanDerWaalsContact O-CG2 3.28Å; E27-V31 WeakPolarHBondContact O-CG2 3.41Å; E27-V31 PolarHBondContact O-N 2.85Å; H28-V31 PolarHBondContact O-N 3.2Å; E29-V31 VanDerWaalsContact C-N 3.34Å; E29-V31 PolarHBondContact O-N 2.95Å; V31-A34 PolarHBondContact O-N 2.69Å; V31-K35 HydrophobicContact CG1-CD 3.96Å; V31-K35 HydrophobicContact CG1-CG 4.37Å; V31-K35 WeakPolarHBondContact O-CB 3.43Å; V31-K35 VanDerWaalsContact O-CG 3.27Å; V31-K35 WeakPolarHBondContact O-CG 3.27Å; V31-K35 PolarHBondContact O-N 3.44Å
32T90.5Very high89.3Confident68 Ų68102.6 Ų102.642%0.41752%0.523SS..Hα-helixtrans-68.7-45.1-179.7-55.90000111.1H28 E29 A34 K35 A36H28-T32 PolarHBondContact CE1-OG1 3.49Å; H28-T32 VanDerWaalsContact CE1-OG1 3.23Å; H28-T32 PolarHBondContact ND1-OG1 3.47Å; H28-T32 WeakPolarHBondContact O-CB 3.38Å; H28-T32 PolarHBondContact O-N 3.08Å; H28-T32 PolarHBondContact O-OG1 2.93Å; E29-T32 PolarHBondContact O-N 3.4Å; E29-T32 VanDerWaalsContact O-N 3.13Å; T32-A34 VanDerWaalsContact C-N 3.33Å; T32-A34 PolarHBondContact O-N 3.23Å; T32-K35 PolarHBondContact O-N 3.13Å; T32-A36 PolarHBondContact O-N 3.19Å
33T86.6Confident89.4Confident96 Ų9699.8 Ų99.859%0.58951%0.51SS*.Hα-helixtrans-61.1-44175.6-54.70000110.8E29 K35 A36E29-T33 PolarHBondContact O-N 3.23Å; E29-T33 PolarHBondContact O-OG1 2.9Å; E29-T33 VanDerWaalsContact O-OG1 3.08Å; T33-K35 VanDerWaalsContact C-N 3.32Å; T33-K35 PolarHBondContact O-N 2.84Å; T33-A36 WeakPolarHBondContact O-CB 3.32Å; T33-A36 PolarHBondContact O-N 2.95Å
34A83.2Confident89.4Confident61 Ų6199.7 Ų99.750%0.50451%0.512SS..Hα-helixtrans-63.5-35.217600000113.1R30 V31 T32R30-A34 WeakPolarHBondContact O-CB 3.32Å; R30-A34 PolarHBondContact O-N 3.38Å; R30-A34 VanDerWaalsContact O-N 3.12Å; V31-A34 PolarHBondContact O-N 2.69Å; T32-A34 VanDerWaalsContact C-N 3.33Å; T32-A34 PolarHBondContact O-N 3.23Å
35K78.4Confident89.2Confident162 Ų16296.7 Ų96.770%0.70451%0.513SS*.Hα-helixtrans-75.2-24176.7-77.6177.2178.4-179.60113.7V31 T32 T33 E37V31-K35 HydrophobicContact CG1-CD 3.96Å; V31-K35 HydrophobicContact CG1-CG 4.37Å; V31-K35 WeakPolarHBondContact O-CB 3.43Å; V31-K35 VanDerWaalsContact O-CG 3.27Å; V31-K35 WeakPolarHBondContact O-CG 3.27Å; V31-K35 PolarHBondContact O-N 3.44Å; T32-K35 PolarHBondContact O-N 3.13Å; T33-K35 VanDerWaalsContact C-N 3.32Å; T33-K35 PolarHBondContact O-N 2.84Å; K35-E37 PolarHBondContact O-N 3.02Å
36A74.7Confident89.1Confident75 Ų7597.6 Ų97.662%0.6251%0.512SS*.Hα-helixtrans-64.3-29.2178.500000111.6T32 T33 N38T32-A36 PolarHBondContact O-N 3.19Å; T33-A36 WeakPolarHBondContact O-CB 3.32Å; T33-A36 PolarHBondContact O-N 2.95Å; A36-N38 PolarHBondContact O-N 3.45Å; A36-N38 VanDerWaalsContact O-N 3.07Å
37E80.9Confident88.8Confident141 Ų14198.3 Ų98.366%0.65952%0.523SS*.SBendtrans-77.488.6172.4-65.2-176.5174.200110.4K35 L39K35-E37 PolarHBondContact O-N 3.02Å; E37-L39 PolarHBondContact O-N 3.18Å
38N84.2Confident88.7Confident70 Ų7098 Ų9837%0.37452%0.518SS..  trans-71.9113.4174.6-173.2-13.2000110.3A36 A40 Y41A36-N38 PolarHBondContact O-N 3.45Å; A36-N38 VanDerWaalsContact O-N 3.07Å; N38-A40 PolarHBondContact O-N 3.16Å; N38-A40 VanDerWaalsContact OD1-CB 3.26Å; N38-A40 WeakPolarHBondContact OD1-CB 3.43Å; N38-A40 PolarHBondContact OD1-N 3.23Å; N38-Y41 HydrophobicContact CB-CD1 4.16Å; N38-Y41 HydrophobicContact CB-CD2 3.69Å; N38-Y41 HydrophobicContact CB-CE1 4.02Å; N38-Y41 HydrophobicContact CB-CE2 3.54Å; N38-Y41 HydrophobicContact CB-CG 4Å; N38-Y41 WeakPolarHBondContact O-CB 3.45Å; N38-Y41 PolarHBondContact O-N 3.08Å
39L83.9Confident88.7Confident125 Ų12598.7 Ų98.765%0.65452%0.521SS*.THydrogen-bonded Turntrans-62.5-12.6179.2-59.6177.1000114.4E37 Y41 R48E37-L39 PolarHBondContact O-N 3.18Å; L39-Y41 VanDerWaalsContact C-N 3.34Å; L39-R48 PolarHBondContact O-NH2 3.44Å; L39-R48 VanDerWaalsContact O-NH2 3.08Å
40A89Confident88.9Confident60 Ų6097.9 Ų97.950%0.49652%0.523SS..THydrogen-bonded Turntrans-83.2-9.9174.200000113.1N38 F42N38-A40 PolarHBondContact O-N 3.16Å; N38-A40 VanDerWaalsContact OD1-CB 3.26Å; N38-A40 WeakPolarHBondContact OD1-CB 3.43Å; N38-A40 PolarHBondContact OD1-N 3.23Å; A40-F42 WeakPolarHBondContact O-CD2 3.31Å; A40-F42 WeakPolarHBondContact O-CE2 3.47Å
41Y92.7Very high89Confident115 Ų11594.9 Ų94.945%0.45152%0.518SS..  trans-75.5146.1175.3-63.7-19.5000111.4N38 L39 Y46N38-Y41 HydrophobicContact CB-CD1 4.16Å; N38-Y41 HydrophobicContact CB-CD2 3.69Å; N38-Y41 HydrophobicContact CB-CE1 4.02Å; N38-Y41 HydrophobicContact CB-CE2 3.54Å; N38-Y41 HydrophobicContact CB-CG 4Å; N38-Y41 WeakPolarHBondContact O-CB 3.45Å; N38-Y41 PolarHBondContact O-N 3.08Å; L39-Y41 VanDerWaalsContact C-N 3.34Å; Y41-Y46 HydrophobicContact CD2-CD1 4.48Å; Y41-Y46 AromaticContact CD2-CE1 3.65Å; Y41-Y46 HydrophobicContact CD2-CE1 3.65Å; Y41-Y46 AromaticContact CD2-CZ 3.71Å; Y41-Y46 HydrophobicContact CG-CE1 4.15Å
42F95.1Very high89.3Confident82 Ų8294.4 Ų94.436%0.3652%0.516SS..  trans-119148176.4-62.4-88000109.4A40 R48 I51 M54A40-F42 WeakPolarHBondContact O-CD2 3.31Å; A40-F42 WeakPolarHBondContact O-CE2 3.47Å; F42-R48 CarbonylContact C-O 3.56Å; F42-R48 VanDerWaalsContact CA-O 3.23Å; F42-R48 WeakPolarHBondContact CA-O 3.34Å; F42-R48 HydrophobicContact CD1-CB 3.67Å; F42-R48 HydrophobicContact CE1-CB 3.9Å; F42-I51 HydrophobicContact CE1-CB 4.31Å; F42-I51 HydrophobicContact CE1-CG1 4.37Å; F42-I51 HydrophobicContact CZ-CB 4.33Å; F42-I51 HydrophobicContact CZ-CD1 4.5Å; F42-I51 HydrophobicContact CZ-CG1 4.01Å; F42-M54 HydrophobicContact CE1-CG 4.31Å; F42-M54 HydrophobicContact CZ-CG 4.42Å
43G93.5Very high89.4Confident21 Ų2196 Ų9622%0.21652%0.518CS..SBendtrans146.4-177.9176.300000112.5S45 Y46 R48 Q49G43-S45 PolarHBondContact O-N 3.06Å; G43-Y46 PolarHBondContact O-N 3.07Å; G43-Y46 VanDerWaalsContact O-N 3.16Å; G43-R48 PolarHBondContact N-O 2.97Å; G43-Q49 PolarHBondContact N-O 3.43Å
44E93.7Very high89.8Confident184 Ų18494.7 Ų94.786%0.8651%0.507SS*.THydrogen-bonded Turntrans-62.3-40.1-174.9-175.6175.4-167.800113.5Y46E44-Y46 VanDerWaalsContact C-N 3.27Å; E44-Y46 PolarHBondContact O-N 3.37Å
45S91.1Very high90.3Very high116 Ų116101 Ų10181%0.81153%0.526SS*.THydrogen-bonded Turntrans-84.22.1178.1-49.30000114G43G43-S45 PolarHBondContact O-N 3.06Å
46Y90.6Very high91.1Very high98 Ų9897.3 Ų97.338%0.38453%0.533SS..SBendtrans-111.3159.4-176-64.3-71.9000111Y41 G43 E44 R48Y41-Y46 HydrophobicContact CD2-CD1 4.48Å; Y41-Y46 AromaticContact CD2-CE1 3.65Å; Y41-Y46 HydrophobicContact CD2-CE1 3.65Å; Y41-Y46 AromaticContact CD2-CZ 3.71Å; Y41-Y46 HydrophobicContact CG-CE1 4.15Å; G43-Y46 PolarHBondContact O-N 3.07Å; G43-Y46 VanDerWaalsContact O-N 3.16Å; E44-Y46 VanDerWaalsContact C-N 3.27Å; E44-Y46 PolarHBondContact O-N 3.37Å; Y46-R48 PolarHBondContact O-N 3.26Å
47P90.6Very high92.1Very high106 Ų10698.7 Ų98.769%0.68853%0.527SS*.SBendtrans-58.7-22.8-176.6-26.735.3000115
48R92.8Very high92.8Very high80 Ų8097.7 Ų97.730%0.30252%0.522SS..  trans-126.4130.3176.6-69.6-176.7-76.8-116.3-5109.3L39 F42 G43 Y46 E53 M54L39-R48 PolarHBondContact O-NH2 3.44Å; L39-R48 VanDerWaalsContact O-NH2 3.08Å; F42-R48 CarbonylContact C-O 3.56Å; F42-R48 VanDerWaalsContact CA-O 3.23Å; F42-R48 WeakPolarHBondContact CA-O 3.34Å; F42-R48 HydrophobicContact CD1-CB 3.67Å; F42-R48 HydrophobicContact CE1-CB 3.9Å; G43-R48 PolarHBondContact N-O 2.97Å; Y46-R48 PolarHBondContact O-N 3.26Å; R48-E53 VanDerWaalsContact CA-OE2 3.31Å; R48-E53 WeakPolarHBondContact CA-OE2 3.4Å; R48-E53 WeakPolarHBondContact CB-OE2 3.32Å; R48-E53 WeakPolarHBondContact CG-OE2 3.38Å; R48-M54 VanDerWaalsContact CD-SD 3.56Å; R48-M54 PolarHBondContact NH1-SD 3.11Å
49Q95.2Very high93.3Very high140 Ų14096.8 Ų96.865%0.65452%0.52SS*.SBendtrans-83.4-44-179.3-173.5-179.8-0.600111G43 E53G43-Q49 PolarHBondContact N-O 3.43Å; Q49-E53 PolarHBondContact N-OE1 3.18Å; Q49-E53 VanDerWaalsContact N-OE1 3.11Å
50C95.9Very high94Very high58 Ų5893.1 Ų93.139%0.39251%0.505SS..SBendtrans-134150.9-177.3-174.30000111.2C52 E53C50-C52 PolarHBondContact O-N 2.95Å; C50-C52 VanDerWaalsContact O-N 3.13Å; C50-E53 PolarHBondContact N-OE1 3.13Å; C50-E53 WeakPolarHBondContact O-CB 3.4Å; C50-E53 PolarHBondContact O-N 2.98Å
51I96.4Very high94.3Very high88 Ų8893.8 Ų93.845%0.45150%0.504SS..G310 helixtrans-64.4-18.2179.2-159.5169.8000113.2F42 E53 M54 Q57F42-I51 HydrophobicContact CE1-CB 4.31Å; F42-I51 HydrophobicContact CE1-CG1 4.37Å; F42-I51 HydrophobicContact CZ-CB 4.33Å; F42-I51 HydrophobicContact CZ-CD1 4.5Å; F42-I51 HydrophobicContact CZ-CG1 4.01Å; I51-E53 PolarHBondContact O-N 3.12Å; I51-E53 VanDerWaalsContact O-N 3.12Å; I51-M54 HydrophobicContact CG1-CG 4.4Å; I51-M54 WeakPolarHBondContact O-CB 3.23Å; I51-M54 PolarHBondContact O-N 3.46Å; I51-Q57 HydrophobicContact CG1-CG 4.19Å
52C95.9Very high94.4Very high36 Ų3693.8 Ų93.824%0.24352%0.52CS..G310 helixtrans-63.7-13.5175.464.80000113.8C50 M54 Q58 C60C50-C52 PolarHBondContact O-N 2.95Å; C50-C52 VanDerWaalsContact O-N 3.13Å; C52-M54 VanDerWaalsContact C-N 3.26Å; C52-Q58 WeakPolarHBondContact CB-O 3.3Å; C52-C60 HydrophobicContact CB-CB 4.25Å
53E94Very high94.5Very high101 Ų10195.4 Ų95.447%0.47254%0.537SS..G310 helixtrans-76.7-13.8172.8-64.8166.6-146.300112.6R48 Q49 C50 I51R48-E53 VanDerWaalsContact CA-OE2 3.31Å; R48-E53 WeakPolarHBondContact CA-OE2 3.4Å; R48-E53 WeakPolarHBondContact CB-OE2 3.32Å; R48-E53 WeakPolarHBondContact CG-OE2 3.38Å; Q49-E53 PolarHBondContact N-OE1 3.18Å; Q49-E53 VanDerWaalsContact N-OE1 3.11Å; C50-E53 PolarHBondContact N-OE1 3.13Å; C50-E53 WeakPolarHBondContact O-CB 3.4Å; C50-E53 PolarHBondContact O-N 2.98Å; I51-E53 PolarHBondContact O-N 3.12Å; I51-E53 VanDerWaalsContact O-N 3.12Å
54M93.5Very high94.5Very high69 Ų6997.9 Ų97.934%0.3455%0.548SS..SBendtrans-83.6128.5178.7-67.1-65.9-73.800111F42 R48 I51 C52 Q57F42-M54 HydrophobicContact CE1-CG 4.31Å; F42-M54 HydrophobicContact CZ-CG 4.42Å; R48-M54 VanDerWaalsContact CD-SD 3.56Å; R48-M54 PolarHBondContact NH1-SD 3.11Å; I51-M54 HydrophobicContact CG1-CG 4.4Å; I51-M54 WeakPolarHBondContact O-CB 3.23Å; I51-M54 PolarHBondContact O-N 3.46Å; C52-M54 VanDerWaalsContact C-N 3.26Å; M54-Q57 HydrophobicContact CB-CB 4.49Å; M54-Q57 HydrophobicContact CB-CG 3.77Å; M54-Q57 VanDerWaalsContact O-CB 3.32Å; M54-Q57 WeakPolarHBondContact O-CB 3.26Å; M54-Q57 PolarHBondContact O-N 3.14Å; M54-Q57 VanDerWaalsContact O-N 3.14Å
55Q94Very high94.6Very high195 Ų19593.9 Ų93.991%0.91154%0.538SS*.THydrogen-bonded Turntrans-60.6141.3176.1-63.9-171.514.900111.4Q57Q55-Q57 PolarHBondContact O-N 2.97Å
56G95.6Very high94.8Very high83 Ų8390.3 Ų90.386%0.85651%0.509SS*.THydrogen-bonded Turntrans84.1-10.3-174.900000114.4
57Q95.6Very high95Very high104 Ų10488.1 Ų88.149%0.48651%0.507SS..SBendtrans-87.4165.1172.8-56.6-59.8-2200111.7I51 M54 Q55I51-Q57 HydrophobicContact CG1-CG 4.19Å; M54-Q57 HydrophobicContact CB-CB 4.49Å; M54-Q57 HydrophobicContact CB-CG 3.77Å; M54-Q57 VanDerWaalsContact O-CB 3.32Å; M54-Q57 WeakPolarHBondContact O-CB 3.26Å; M54-Q57 PolarHBondContact O-N 3.14Å; M54-Q57 VanDerWaalsContact O-N 3.14Å; Q55-Q57 PolarHBondContact O-N 2.97Å
58Q94.6Very high95.1Very high120 Ų12086.5 Ų86.556%0.56149%0.493SS*.PPolyproline II helixtrans-64.8126.5175-71.7-65.4-59.600110.1C52C52-Q58 WeakPolarHBondContact CB-O 3.3Å
59P96.3Very high95Very high52 Ų5290.6 Ų90.634%0.33851%0.509SS..PPolyproline II helixtrans-67.1157.8178.228.9-35.3000111.1V64P59-V64 HydrophobicContact CB-CB 4.07Å; P59-V64 HydrophobicContact CB-CG2 4.02Å; P59-V64 HydrophobicContact CG-CB 3.75Å; P59-V64 HydrophobicContact CG-CG1 4.16Å; P59-V64 HydrophobicContact CG-CG2 4.04Å
60C96.8Very high94.9Very high48 Ų4887 Ų8732%0.32449%0.493SS..PPolyproline II helixtrans-61.4133.3177.4-177.70000110.4C52 S62 V63 V64C52-C60 HydrophobicContact CB-CB 4.25Å; C60-S62 PolarHBondContact O-N 2.9Å; C60-V63 HydrophobicContact CB-CG2 4.31Å; C60-V63 PolarHBondContact O-N 3.05Å; C60-V64 PolarHBondContact O-N 3.33Å
61P96.6Very high94.7Very high73 Ų7388.2 Ų88.247%0.47449%0.49SS..THydrogen-bonded Turntrans-58.2-22.7178.6-24.333.6000114.4V63 V64 L66P61-V63 VanDerWaalsContact C-N 3.32Å; P61-V64 VanDerWaalsContact CA-O 3.3Å; P61-V64 WeakPolarHBondContact CA-O 3.37Å; P61-L66 HydrophobicContact CB-CD1 4.17Å; P61-L66 HydrophobicContact CB-CG 4.04Å; P61-L66 HydrophobicContact CG-CD1 3.62Å; P61-L66 HydrophobicContact CG-CD2 4.44Å; P61-L66 HydrophobicContact CG-CG 3.77Å
62S95.4Very high94.4Very high115 Ų11585.9 Ų85.980%0.80449%0.487SS*.THydrogen-bonded Turntrans-69.7-29.4175.4-168.60000112.5C60C60-S62 PolarHBondContact O-N 2.9Å
63V95.3Very high94.1Very high117 Ų11789.9 Ų89.971%0.70950%0.5SS*.THydrogen-bonded Turntrans-95.6-46.8-179.7-176.50000110.5C60 P61C60-V63 HydrophobicContact CB-CG2 4.31Å; C60-V63 PolarHBondContact O-N 3.05Å; P61-V63 VanDerWaalsContact C-N 3.32Å
64V95.1Very high93.9Very high73 Ų7390.1 Ų90.144%0.44250%0.497SS..SBendtrans-126.8112.6179-177.50000108.2P59 C60 P61 L66P59-V64 HydrophobicContact CB-CB 4.07Å; P59-V64 HydrophobicContact CB-CG2 4.02Å; P59-V64 HydrophobicContact CG-CB 3.75Å; P59-V64 HydrophobicContact CG-CG1 4.16Å; P59-V64 HydrophobicContact CG-CG2 4.04Å; C60-V64 PolarHBondContact O-N 3.33Å; P61-V64 VanDerWaalsContact CA-O 3.3Å; P61-V64 WeakPolarHBondContact CA-O 3.37Å; V64-L66 PolarHBondContact O-N 2.96Å
65P95.3Very high93.6Very high100 Ų10093.6 Ų93.665%0.64951%0.506SS*.PPolyproline II helixtrans-56.1131.8179.5-25.233.5000111.7
66L95Very high93.2Very high40 Ų4093 Ų9321%0.20950%0.496CS..PPolyproline II helixtrans-64.2144.9174.6-71.9172.6000110.7P61 V64 M70 R71P61-L66 HydrophobicContact CB-CD1 4.17Å; P61-L66 HydrophobicContact CB-CG 4.04Å; P61-L66 HydrophobicContact CG-CD1 3.62Å; P61-L66 HydrophobicContact CG-CD2 4.44Å; P61-L66 HydrophobicContact CG-CG 3.77Å; V64-L66 PolarHBondContact O-N 2.96Å; L66-M70 HydrophobicContact CB-CB 4.43Å; L66-M70 HydrophobicContact CD2-CE 4.42Å; L66-R71 HydrophobicContact CB-CG 3.95Å; L66-R71 WeakPolarHBondContact O-CD 3.47Å; L66-R71 PolarHBondContact O-NH1 2.66Å
67P94.3Very high92.6Very high52 Ų5293.2 Ų93.234%0.33848%0.477SS..PPolyproline II helixtrans-54.1148.3172.4-25.633.8000113Y69 M70 R71P67-Y69 VanDerWaalsContact C-N 3.32Å; P67-Y69 HydrophobicContact CB-CD1 3.66Å; P67-Y69 HydrophobicContact CB-CE1 3.23Å; P67-Y69 HydrophobicContact CG-CE1 3.99Å; P67-Y69 PolarHBondContact O-N 2.98Å; P67-M70 HydrophobicContact CB-CG 4.48Å; P67-M70 HydrophobicContact CG-SD 4.17Å; P67-M70 WeakPolarHBondContact O-CA 3.34Å; P67-M70 WeakPolarHBondContact O-CB 3.41Å; P67-M70 PolarHBondContact O-N 3.28Å; P67-R71 PolarHBondContact O-N 3.24Å
68D92.5Very high91.3Very high73 Ų7397.2 Ų97.239%0.3949%0.493SS..G310 helixtrans-54.5-46.3-172.6-71.924.4000112.3M70 R71 W74D68-M70 PolarHBondContact O-N 3.33Å; D68-M70 VanDerWaalsContact O-N 3.08Å; D68-R71 PolarHBondContact O-N 2.65Å; D68-R71 IonicContact OD1-CZ 2.68Å; D68-R71 IonicContact OD1-NH1 2.96Å; D68-R71 PolarHBondContact OD1-NH1 2.89Å; D68-R71 IonicContact OD1-NH2 3.33Å; D68-R71 PolarHBondContact OD1-NH2 2.9Å; D68-R71 IonicContact OD2-NH2 2.74Å; D68-R71 PolarHBondContact OD2-NH2 2.74Å; D68-W74 VanDerWaalsContact CA-CD1 3.49Å; D68-W74 HydrophobicContact CB-CD2 4.38Å; D68-W74 HydrophobicContact CB-CG 3.98Å; D68-W74 WeakPolarHBondContact O-CB 3.49Å; D68-W74 WeakPolarHBondContact OD2-CZ2 2.98Å; D68-W74 PolarHBondContact OD2-NE1 3.08Å
69Y91.5Very high90.2Very high166 Ų16698.3 Ų98.365%0.65150%0.503SS*.G310 helixtrans-61.1-21.5178.568.3-92.4000114P67 R75P67-Y69 VanDerWaalsContact C-N 3.32Å; P67-Y69 HydrophobicContact CB-CD1 3.66Å; P67-Y69 HydrophobicContact CB-CE1 3.23Å; P67-Y69 HydrophobicContact CG-CE1 3.99Å; P67-Y69 PolarHBondContact O-N 2.98Å; Y69-R75 PolarHBondContact O-NE 3.22Å
70M93Very high88.6Confident63 Ų6399.2 Ų99.231%0.3150%0.504SS..G310 helixtrans-85.4-25.9175.8-63.3-176.27000112.5L66 P67 D68 R75L66-M70 HydrophobicContact CB-CB 4.43Å; L66-M70 HydrophobicContact CD2-CE 4.42Å; P67-M70 HydrophobicContact CB-CG 4.48Å; P67-M70 HydrophobicContact CG-SD 4.17Å; P67-M70 WeakPolarHBondContact O-CA 3.34Å; P67-M70 WeakPolarHBondContact O-CB 3.41Å; P67-M70 PolarHBondContact O-N 3.28Å; D68-M70 PolarHBondContact O-N 3.33Å; D68-M70 VanDerWaalsContact O-N 3.08Å; M70-R75 PolarHBondContact O-NH2 3.35Å
71R92.7Very high86.6Confident85 Ų85105.9 Ų105.932%0.32155%0.549SS..SBendtrans-79137.1-176.5-54.3-167.7-62-106.86.5111.1L66 P67 D68 K73 W74 R75L66-R71 HydrophobicContact CB-CG 3.95Å; L66-R71 WeakPolarHBondContact O-CD 3.47Å; L66-R71 PolarHBondContact O-NH1 2.66Å; P67-R71 PolarHBondContact O-N 3.24Å; D68-R71 PolarHBondContact O-N 2.65Å; D68-R71 IonicContact OD1-CZ 2.68Å; D68-R71 IonicContact OD1-NH1 2.96Å; D68-R71 PolarHBondContact OD1-NH1 2.89Å; D68-R71 IonicContact OD1-NH2 3.33Å; D68-R71 PolarHBondContact OD1-NH2 2.9Å; D68-R71 IonicContact OD2-NH2 2.74Å; D68-R71 PolarHBondContact OD2-NH2 2.74Å; R71-K73 PolarHBondContact O-N 3.37Å; R71-K73 VanDerWaalsContact O-N 3.15Å; R71-W74 PolarHBondContact O-N 3.32Å; R71-W74 VanDerWaalsContact O-N 3.11Å; R71-R75 PolarHBondContact O-N 3.15Å
72G90.1Very high86.1Confident38 Ų38107.5 Ų107.539%0.39255%0.553SS.*Hα-helixtrans-60.1-31-175.900000114.2W74 R75 W76G72-W74 VanDerWaalsContact C-N 3.3Å; G72-W74 PolarHBondContact O-N 3.11Å; G72-R75 PolarHBondContact O-N 3.1Å; G72-W76 PolarHBondContact O-N 3.43Å; G72-W76 VanDerWaalsContact O-N 3.1Å
73K89.4Confident85.6Confident121 Ų121107.1 Ų107.153%0.52654%0.54SS..Hα-helixtrans-53.7-42.9175.1-178.6179.4177.8-174.60112.6R71 N77 L80R71-K73 PolarHBondContact O-N 3.37Å; R71-K73 VanDerWaalsContact O-N 3.15Å; K73-N77 WeakPolarHBondContact O-CB 3.48Å; K73-N77 PolarHBondContact O-N 3.24Å; K73-L80 HydrophobicContact CD-CD1 4.05Å; K73-L80 VanDerWaalsContact CE-CD1 3.41Å; K73-L80 HydrophobicContact CG-CD1 3.43Å; K73-L80 VanDerWaalsContact CG-CD1 3.43Å
74W88.8Confident85Confident106 Ų106106.6 Ų106.640%0.40253%0.53SS..Hα-helixtrans-89.1-30.2-177.5-58.6107.9000112.8D68 R71 G72 L80D68-W74 VanDerWaalsContact CA-CD1 3.49Å; D68-W74 HydrophobicContact CB-CD2 4.38Å; D68-W74 HydrophobicContact CB-CG 3.98Å; D68-W74 WeakPolarHBondContact O-CB 3.49Å; D68-W74 WeakPolarHBondContact OD2-CZ2 2.98Å; D68-W74 PolarHBondContact OD2-NE1 3.08Å; R71-W74 PolarHBondContact O-N 3.32Å; R71-W74 VanDerWaalsContact O-N 3.11Å; G72-W74 VanDerWaalsContact C-N 3.3Å; G72-W74 PolarHBondContact O-N 3.11Å; W74-L80 HydrophobicContact CE3-CB 4.5Å; W74-L80 HydrophobicContact CZ3-CB 4.28Å
75R87.2Confident84.4Confident142 Ų142108.5 Ų108.554%0.53654%0.535SS..Hα-helixtrans-76.4-33.5-175.7-148.3-167.8-58.1-168.610113.2Y69 M70 R71 G72Y69-R75 PolarHBondContact O-NE 3.22Å; M70-R75 PolarHBondContact O-NH2 3.35Å; R71-R75 PolarHBondContact O-N 3.15Å; G72-R75 PolarHBondContact O-N 3.1Å
76W86.5Confident83.7Confident183 Ų183109.1 Ų109.169%0.69353%0.528SS*.Hα-helixtrans-116.4-21.4-175-74-80.8000115.1G72 K78G72-W76 PolarHBondContact O-N 3.43Å; G72-W76 VanDerWaalsContact O-N 3.1Å; W76-K78 PolarHBondContact O-N 3.12Å
77N82.4Confident83Confident86 Ų86113.7 Ų113.746%0.4655%0.549SS..  trans-89.593.9-174.5-140.5-0.4000110K73 N79 L80K73-N77 WeakPolarHBondContact O-CB 3.48Å; K73-N77 PolarHBondContact O-N 3.24Å; N77-N79 PolarHBondContact O-N 3.19Å; N77-N79 VanDerWaalsContact O-N 3.12Å; N77-L80 HydrophobicContact CB-CD1 4.07Å
78K69.5Low82.2Confident189 Ų189118.1 Ų118.182%0.82257%0.565SS**THydrogen-bonded Turntrans-67.8-5.8-178.7-62-175-178.8-177.60114.4W76W76-K78 PolarHBondContact O-N 3.12Å
79N70.6Confident81.4Confident143 Ų143121.5 Ų121.577%0.76558%0.578SS**THydrogen-bonded Turntrans-94.714-175.6-60.2-24000113.4N77N77-N79 PolarHBondContact O-N 3.19Å; N77-N79 VanDerWaalsContact O-N 3.12Å
80L62.6Low80.6Confident70 Ų70117.8 Ų117.837%0.36657%0.572SS.*  trans-107.117.5-179.5-81.1161.8000113.4K73 W74 N77K73-L80 HydrophobicContact CD-CD1 4.05Å; K73-L80 VanDerWaalsContact CE-CD1 3.41Å; K73-L80 HydrophobicContact CG-CD1 3.43Å; K73-L80 VanDerWaalsContact CG-CD1 3.43Å; W74-L80 HydrophobicContact CE3-CB 4.5Å; W74-L80 HydrophobicContact CZ3-CB 4.28Å; N77-L80 HydrophobicContact CB-CD1 4.07Å
81C53.9Low79.4Confident188 Ų188122.8 Ų122.8100%1.2760%0.596SS**  trans-1120174-51.30000109.9

Retrieved 81 of 81 residues in 18.1 ms (Link to these results)