G4LYN8_SCHMA Loading...

Pentatricopeptide repeat-containing protein

AlphaFold DB , UniProt , Accession G4LYN8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 138 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
1M39.2Very low71.6Confident241 Ų24196.5 Ų96.5100%1.18753%0.533SS*.  0112.90-70.4-167.9-103.100107.4V3M1-V3 PolarHBondContact O-N 3.45Å
2T46.3Very low73.1Confident141 Ų14197.3 Ų97.387%0.86554%0.535SS*.PPolyproline II helixtrans-74.4116.5174.843.60000108.4
3V47.8Very low74.3Confident85 Ų8591 Ų9152%0.51550%0.504SS..PPolyproline II helixtrans-64.3132.5173.3179.20000107.7M1 N5 V7 A8M1-V3 PolarHBondContact O-N 3.45Å; V3-N5 PolarHBondContact O-N 3.3Å; V3-V7 HydrophobicContact CG1-CB 3.82Å; V3-V7 HydrophobicContact CG1-CG1 3.97Å; V3-A8 HydrophobicContact CG1-CB 4.48Å
4P65.8Low75.3Confident77 Ų7790.1 Ų90.150%0.550%0.497SS..PPolyproline II helixtrans-49.4129.1171.6-29.137.5000110.5D6 V7 A8P4-D6 WeakPolarHBondContact CB-OD1 3.45Å; P4-D6 PolarHBondContact O-N 3.19Å; P4-V7 HydrophobicContact CB-CG2 4.22Å; P4-V7 PolarHBondContact O-N 3.19Å; P4-A8 PolarHBondContact O-N 3.18Å
5N75.7Confident76.3Confident131 Ų13194.9 Ų94.970%0.70151%0.511SS*.Hα-helixtrans-56.2-27.3-172.8-83.7-14.4000113V3 L9V3-N5 PolarHBondContact O-N 3.3Å; N5-L9 VanDerWaalsContact O-CB 3.23Å; N5-L9 WeakPolarHBondContact O-CB 3.49Å; N5-L9 PolarHBondContact O-N 3.45Å; N5-L9 VanDerWaalsContact O-N 3.09Å
6D78.2Confident77.3Confident55 Ų5593.9 Ų93.929%0.29452%0.519SS..Hα-helixtrans-68.2-38.4176.465.8-38.4000112.6P4 L9 Y10 F25 Y29P4-D6 WeakPolarHBondContact CB-OD1 3.45Å; P4-D6 PolarHBondContact O-N 3.19Å; D6-L9 PolarHBondContact O-N 3.24Å; D6-Y10 WeakPolarHBondContact O-CB 3.31Å; D6-Y10 PolarHBondContact O-N 3.24Å; D6-F25 HydrophobicContact CB-CE1 4.42Å; D6-F25 VanDerWaalsContact O-CE1 3.27Å; D6-F25 WeakPolarHBondContact O-CE1 3.4Å; D6-F25 WeakPolarHBondContact O-CZ 3.11Å; D6-Y29 HydrophobicContact CB-CD1 4.14Å; D6-Y29 HydrophobicContact CB-CE1 3.89Å
7V82.9Confident77.8Confident58 Ų5891.7 Ų91.735%0.35252%0.523SS..Hα-helixtrans-67.4-47.2177.7177.70000110.7V3 P4 L9 Y10 E11V3-V7 HydrophobicContact CG1-CB 3.82Å; V3-V7 HydrophobicContact CG1-CG1 3.97Å; P4-V7 HydrophobicContact CB-CG2 4.22Å; P4-V7 PolarHBondContact O-N 3.19Å; V7-L9 VanDerWaalsContact C-N 3.29Å; V7-L9 PolarHBondContact O-N 3.14Å; V7-Y10 PolarHBondContact O-N 3.4Å; V7-E11 WeakPolarHBondContact O-CG 3.36Å; V7-E11 PolarHBondContact O-N 3.5Å
8A86.4Confident78.2Confident48 Ų4890.1 Ų90.140%0.39752%0.515SS..Hα-helixtrans-61.6-39.7177.600000111.7V3 P4 L12V3-A8 HydrophobicContact CG1-CB 4.48Å; P4-A8 PolarHBondContact O-N 3.18Å; A8-L12 WeakPolarHBondContact O-CB 3.43Å; A8-L12 PolarHBondContact O-N 3.43Å
9L88.1Confident78.4Confident75 Ų7591.8 Ų91.839%0.39353%0.53SS..Hα-helixtrans-71-35.5177.6-172.467.9000112.1N5 D6 V7 L12 A13 F25 Y29N5-L9 VanDerWaalsContact O-CB 3.23Å; N5-L9 WeakPolarHBondContact O-CB 3.49Å; N5-L9 PolarHBondContact O-N 3.45Å; N5-L9 VanDerWaalsContact O-N 3.09Å; D6-L9 PolarHBondContact O-N 3.24Å; V7-L9 VanDerWaalsContact C-N 3.29Å; V7-L9 PolarHBondContact O-N 3.14Å; L9-L12 HydrophobicContact CD1-CD2 4.43Å; L9-L12 PolarHBondContact O-N 3.23Å; L9-A13 WeakPolarHBondContact O-CB 3.11Å; L9-A13 PolarHBondContact O-N 3.37Å; L9-F25 HydrophobicContact CB-CE2 4.49Å; L9-F25 HydrophobicContact CB-CZ 3.89Å; L9-F25 HydrophobicContact CD2-CE2 4.38Å; L9-F25 HydrophobicContact CD2-CZ 4.01Å; L9-F25 HydrophobicContact CG-CE2 4.09Å; L9-F25 HydrophobicContact CG-CZ 3.87Å; L9-Y29 HydrophobicContact CD2-CD2 3.69Å; L9-Y29 HydrophobicContact CD2-CE2 3.83Å
10Y88.9Confident78.7Confident52 Ų5289.5 Ų89.520%0.20451%0.514CS..Hα-helixtrans-63.6-48.7173.2-178.3-121000111D6 V7 L12 A13 I14 N22 F25D6-Y10 WeakPolarHBondContact O-CB 3.31Å; D6-Y10 PolarHBondContact O-N 3.24Å; V7-Y10 PolarHBondContact O-N 3.4Å; Y10-L12 VanDerWaalsContact C-N 3.28Å; Y10-L12 PolarHBondContact O-N 3.4Å; Y10-A13 WeakPolarHBondContact O-CB 3.39Å; Y10-A13 PolarHBondContact O-N 3.44Å; Y10-A13 VanDerWaalsContact O-N 3.14Å; Y10-I14 HydrophobicContact CD2-CG1 4.41Å; Y10-I14 HydrophobicContact CE1-CG1 4.28Å; Y10-I14 HydrophobicContact CE2-CD1 3.94Å; Y10-I14 HydrophobicContact CE2-CG1 4.04Å; Y10-I14 WeakPolarHBondContact O-CG1 3.2Å; Y10-I14 PolarHBondContact O-N 3.05Å; Y10-N22 WeakPolarHBondContact CD1-ND2 3.45Å; Y10-N22 HydrophobicContact CE1-CB 4.14Å; Y10-N22 VanDerWaalsContact CE1-ND2 3.29Å; Y10-N22 WeakPolarHBondContact CE1-ND2 3.34Å; Y10-N22 HydrophobicContact CE2-CB 4.26Å; Y10-N22 PolarHBondContact OH-N 2.95Å; Y10-F25 HydrophobicContact CD2-CB 3.56Å; Y10-F25 AromaticContact CD2-CD1 3.75Å; Y10-F25 HydrophobicContact CD2-CD1 3.75Å; Y10-F25 AromaticContact CD2-CD2 3.71Å; Y10-F25 HydrophobicContact CD2-CD2 3.71Å; Y10-F25 HydrophobicContact CD2-CE1 4.4Å; Y10-F25 HydrophobicContact CD2-CE2 4.35Å; Y10-F25 AromaticContact CD2-CG 3.36Å; Y10-F25 HydrophobicContact CD2-CG 3.36Å; Y10-F25 HydrophobicContact CE2-CB 3.82Å; Y10-F25 HydrophobicContact CE2-CG 4.15Å; Y10-F25 HydrophobicContact CG-CD1 4.09Å; Y10-F25 HydrophobicContact CG-CE1 4.42Å; Y10-F25 HydrophobicContact CG-CG 4.15Å; Y10-F25 VanDerWaalsContact N-CZ 3.29Å
11E88.5Confident79.1Confident98 Ų9888.4 Ų88.446%0.45851%0.507SS..Hα-helixtrans-59.7-39.5176-73.4-174.2-168.400112.2V7 I14 K15V7-E11 WeakPolarHBondContact O-CG 3.36Å; V7-E11 PolarHBondContact O-N 3.5Å; E11-I14 PolarHBondContact O-N 3.13Å; E11-K15 WeakPolarHBondContact O-CB 3.29Å; E11-K15 VanDerWaalsContact O-CG 3.29Å; E11-K15 WeakPolarHBondContact O-CG 3.42Å; E11-K15 PolarHBondContact O-N 3.42Å; E11-K15 IonicContact OE2-NZ 2.71Å
12L89.8Confident81.3Confident106 Ų10679.5 Ų79.556%0.55546%0.464SS*.Hα-helixtrans-63.3-42.7175.3-176.164.4000111.6A8 L9 Y10 I14 K15 A16A8-L12 WeakPolarHBondContact O-CB 3.43Å; A8-L12 PolarHBondContact O-N 3.43Å; L9-L12 HydrophobicContact CD1-CD2 4.43Å; L9-L12 PolarHBondContact O-N 3.23Å; Y10-L12 VanDerWaalsContact C-N 3.28Å; Y10-L12 PolarHBondContact O-N 3.4Å; L12-I14 VanDerWaalsContact C-N 3.34Å; L12-I14 PolarHBondContact O-N 3.02Å; L12-K15 PolarHBondContact O-N 2.74Å; L12-A16 VanDerWaalsContact O-CB 3.3Å; L12-A16 WeakPolarHBondContact O-CB 3.41Å; L12-A16 PolarHBondContact O-N 3.46Å
13A88.3Confident83.3Confident16 Ų1679.4 Ų79.413%0.13245%0.452CS..Hα-helixtrans-62.4-41.3177.300000112L9 Y10 A16 G17 V18 M20 F25L9-A13 WeakPolarHBondContact O-CB 3.11Å; L9-A13 PolarHBondContact O-N 3.37Å; Y10-A13 WeakPolarHBondContact O-CB 3.39Å; Y10-A13 PolarHBondContact O-N 3.44Å; Y10-A13 VanDerWaalsContact O-N 3.14Å; A13-A16 PolarHBondContact O-N 3.38Å; A13-G17 PolarHBondContact O-N 3.2Å; A13-V18 WeakPolarHBondContact O-CB 3.35Å; A13-V18 PolarHBondContact O-N 3.3Å; A13-M20 HydrophobicContact CB-CE 4.45Å; A13-F25 HydrophobicContact CB-CD2 4.49Å; A13-F25 HydrophobicContact CB-CE2 4.41Å
14I88.6Confident85.3Confident79 Ų7978 Ų7841%0.40544%0.443SS..Hα-helixtrans-65.7-45.1175.1-61.6-57.7000110.9Y10 E11 L12 A16 G17Y10-I14 HydrophobicContact CD2-CG1 4.41Å; Y10-I14 HydrophobicContact CE1-CG1 4.28Å; Y10-I14 HydrophobicContact CE2-CD1 3.94Å; Y10-I14 HydrophobicContact CE2-CG1 4.04Å; Y10-I14 WeakPolarHBondContact O-CG1 3.2Å; Y10-I14 PolarHBondContact O-N 3.05Å; E11-I14 PolarHBondContact O-N 3.13Å; L12-I14 VanDerWaalsContact C-N 3.34Å; L12-I14 PolarHBondContact O-N 3.02Å; I14-A16 VanDerWaalsContact C-N 3.27Å; I14-A16 PolarHBondContact O-N 3.48Å; I14-G17 WeakPolarHBondContact O-CA 3.42Å; I14-G17 PolarHBondContact O-N 2.96Å
15K90.4Very high86.5Confident162 Ų16274.9 Ų74.970%0.70442%0.422SS*.Hα-helixtrans-62.4-33.1176.1-75.2169.7-179.1163.20112.7E11 L12 G17E11-K15 WeakPolarHBondContact O-CB 3.29Å; E11-K15 VanDerWaalsContact O-CG 3.29Å; E11-K15 WeakPolarHBondContact O-CG 3.42Å; E11-K15 PolarHBondContact O-N 3.42Å; E11-K15 IonicContact OE2-NZ 2.71Å; L12-K15 PolarHBondContact O-N 2.74Å; K15-G17 PolarHBondContact O-N 2.91Å
16A91.2Very high87.2Confident78 Ų7875.9 Ų75.965%0.64542%0.416SS*.THydrogen-bonded Turntrans-74.8-1.8173.600000113.4L12 A13 I14 V18L12-A16 VanDerWaalsContact O-CB 3.3Å; L12-A16 WeakPolarHBondContact O-CB 3.41Å; L12-A16 PolarHBondContact O-N 3.46Å; A13-A16 PolarHBondContact O-N 3.38Å; I14-A16 VanDerWaalsContact C-N 3.27Å; I14-A16 PolarHBondContact O-N 3.48Å; A16-V18 HydrophobicContact CB-CG2 4.43Å
17G86.9Confident87.7Confident57 Ų5779 Ų7959%0.58842%0.424SS*.THydrogen-bonded Turntrans78.523.4177.200000114A13 I14 K15 P19A13-G17 PolarHBondContact O-N 3.2Å; I14-G17 WeakPolarHBondContact O-CA 3.42Å; I14-G17 PolarHBondContact O-N 2.96Å; K15-G17 PolarHBondContact O-N 2.91Å; G17-P19 VanDerWaalsContact O-CD 3.27Å; G17-P19 WeakPolarHBondContact O-CD 3.38Å
18V84.7Confident88.1Confident62 Ų6277.5 Ų77.538%0.37642%0.415SS..  trans-83.2112.2175.9-168.90000109.4A13 A16 M20A13-V18 WeakPolarHBondContact O-CB 3.35Å; A13-V18 PolarHBondContact O-N 3.3Å; A16-V18 HydrophobicContact CB-CG2 4.43Å; V18-M20 VanDerWaalsContact C-N 3.34Å; V18-M20 HydrophobicContact CB-CE 3.97Å; V18-M20 HydrophobicContact CG1-CE 3.23Å; V18-M20 PolarHBondContact O-N 3.46Å
19P81.7Confident88.3Confident123 Ų12378.3 Ų78.380%0.79941%0.408SS*.  trans-80.184.3-175.833.3-33.8000109.5G17G17-P19 VanDerWaalsContact O-CD 3.27Å; G17-P19 WeakPolarHBondContact O-CD 3.38Å
20M84.2Confident88.4Confident45 Ų4575 Ų7522%0.22239%0.391CS..  trans-129.9138.1174.770.2174.68400111.7A13 V18 V24 F25A13-M20 HydrophobicContact CB-CE 4.45Å; V18-M20 VanDerWaalsContact C-N 3.34Å; V18-M20 HydrophobicContact CB-CE 3.97Å; V18-M20 HydrophobicContact CG1-CE 3.23Å; V18-M20 PolarHBondContact O-N 3.46Å; M20-V24 HydrophobicContact CB-CB 4.5Å; M20-V24 HydrophobicContact CB-CG1 4.3Å; M20-F25 HydrophobicContact CG-CB 4.22Å; M20-F25 HydrophobicContact SD-CB 3.6Å; M20-F25 HydrophobicContact SD-CD2 3.61Å; M20-F25 HydrophobicContact SD-CG 4.1Å
21D88.2Confident88.5Confident67 Ų6774.9 Ų74.936%0.35839%0.394SS..  trans-70.4157.7171.172.152.7000110.6K23 V24 F25D21-K23 PolarHBondContact O-N 3.47Å; D21-K23 VanDerWaalsContact O-N 3.17Å; D21-K23 WeakPolarHBondContact OD1-CA 3.34Å; D21-K23 VanDerWaalsContact OD1-CB 3.31Å; D21-K23 WeakPolarHBondContact OD1-CB 3.37Å; D21-K23 PolarHBondContact OD1-N 3.39Å; D21-V24 PolarHBondContact O-N 3.46Å; D21-V24 WeakPolarHBondContact OD1-CG2 3.39Å; D21-V24 PolarHBondContact OD1-N 3.27Å; D21-F25 PolarHBondContact O-N 2.93Å
22N85Confident88.5Confident54 Ų5474 Ų7429%0.28939%0.392SS..Hα-helixtrans-60.9-26.8-177.2-173.2-86.7000112.7Y10 R26Y10-N22 WeakPolarHBondContact CD1-ND2 3.45Å; Y10-N22 HydrophobicContact CE1-CB 4.14Å; Y10-N22 VanDerWaalsContact CE1-ND2 3.29Å; Y10-N22 WeakPolarHBondContact CE1-ND2 3.34Å; Y10-N22 HydrophobicContact CE2-CB 4.26Å; Y10-N22 PolarHBondContact OH-N 2.95Å; N22-R26 WeakPolarHBondContact O-CG 3.43Å; N22-R26 PolarHBondContact O-N 3.09Å; N22-R26 PolarHBondContact OD1-NE 3.4Å; N22-R26 PolarHBondContact OD1-NH2 3.43Å
23K88.4Confident88.5Confident140 Ų14070.5 Ų70.561%0.60938%0.378SS*.Hα-helixtrans-75-43178.7-63.6-175.5176.3-175.30111.4D21 F25 R26 R27D21-K23 PolarHBondContact O-N 3.47Å; D21-K23 VanDerWaalsContact O-N 3.17Å; D21-K23 WeakPolarHBondContact OD1-CA 3.34Å; D21-K23 VanDerWaalsContact OD1-CB 3.31Å; D21-K23 WeakPolarHBondContact OD1-CB 3.37Å; D21-K23 PolarHBondContact OD1-N 3.39Å; K23-F25 VanDerWaalsContact C-N 3.32Å; K23-R26 PolarHBondContact O-N 3.13Å; K23-R27 WeakPolarHBondContact O-CG 3.33Å; K23-R27 PolarHBondContact O-N 3.37Å; K23-R27 VanDerWaalsContact O-N 3.09Å
24V89.4Confident88.5Confident54 Ų5472.8 Ų72.833%0.32739%0.388SS..Hα-helixtrans-61.6-45173.6173.80000109.4M20 D21 R26 R27 V28M20-V24 HydrophobicContact CB-CB 4.5Å; M20-V24 HydrophobicContact CB-CG1 4.3Å; D21-V24 PolarHBondContact O-N 3.46Å; D21-V24 WeakPolarHBondContact OD1-CG2 3.39Å; D21-V24 PolarHBondContact OD1-N 3.27Å; V24-R26 PolarHBondContact O-N 2.98Å; V24-R27 PolarHBondContact O-N 2.91Å; V24-V28 HydrophobicContact CG1-CG2 4.35Å; V24-V28 WeakPolarHBondContact O-CG2 3.5Å; V24-V28 PolarHBondContact O-N 3.3Å
25F90.6Very high88.5Confident13 Ų1371 Ų716%0.05739%0.389CS..Hα-helixtrans-56.1-51.7175177.8-94000112D6 L9 Y10 A13 M20 D21 K23 R27 V28 Y29D6-F25 HydrophobicContact CB-CE1 4.42Å; D6-F25 VanDerWaalsContact O-CE1 3.27Å; D6-F25 WeakPolarHBondContact O-CE1 3.4Å; D6-F25 WeakPolarHBondContact O-CZ 3.11Å; L9-F25 HydrophobicContact CB-CE2 4.49Å; L9-F25 HydrophobicContact CB-CZ 3.89Å; L9-F25 HydrophobicContact CD2-CE2 4.38Å; L9-F25 HydrophobicContact CD2-CZ 4.01Å; L9-F25 HydrophobicContact CG-CE2 4.09Å; L9-F25 HydrophobicContact CG-CZ 3.87Å; Y10-F25 HydrophobicContact CD2-CB 3.56Å; Y10-F25 AromaticContact CD2-CD1 3.75Å; Y10-F25 HydrophobicContact CD2-CD1 3.75Å; Y10-F25 AromaticContact CD2-CD2 3.71Å; Y10-F25 HydrophobicContact CD2-CD2 3.71Å; Y10-F25 HydrophobicContact CD2-CE1 4.4Å; Y10-F25 HydrophobicContact CD2-CE2 4.35Å; Y10-F25 AromaticContact CD2-CG 3.36Å; Y10-F25 HydrophobicContact CD2-CG 3.36Å; Y10-F25 HydrophobicContact CE2-CB 3.82Å; Y10-F25 HydrophobicContact CE2-CG 4.15Å; Y10-F25 HydrophobicContact CG-CD1 4.09Å; Y10-F25 HydrophobicContact CG-CE1 4.42Å; Y10-F25 HydrophobicContact CG-CG 4.15Å; Y10-F25 VanDerWaalsContact N-CZ 3.29Å; A13-F25 HydrophobicContact CB-CD2 4.49Å; A13-F25 HydrophobicContact CB-CE2 4.41Å; M20-F25 HydrophobicContact CG-CB 4.22Å; M20-F25 HydrophobicContact SD-CB 3.6Å; M20-F25 HydrophobicContact SD-CD2 3.61Å; M20-F25 HydrophobicContact SD-CG 4.1Å; D21-F25 PolarHBondContact O-N 2.93Å; K23-F25 VanDerWaalsContact C-N 3.32Å; F25-R27 VanDerWaalsContact C-N 3.25Å; F25-R27 PolarHBondContact O-N 3.39Å; F25-V28 PolarHBondContact O-N 2.89Å; F25-Y29 HydrophobicContact CE1-CG 4.46Å; F25-Y29 VanDerWaalsContact O-CB 3.31Å; F25-Y29 WeakPolarHBondContact O-CB 3.48Å; F25-Y29 PolarHBondContact O-N 2.77Å
26R90Very high88.4Confident152 Ų15265.8 Ų65.857%0.57437%0.372SS*.Hα-helixtrans-59-37179.7-76.3-172.5-134.6-175.6-2.4112.6N22 K23 V24 G30N22-R26 WeakPolarHBondContact O-CG 3.43Å; N22-R26 PolarHBondContact O-N 3.09Å; N22-R26 PolarHBondContact OD1-NE 3.4Å; N22-R26 PolarHBondContact OD1-NH2 3.43Å; K23-R26 PolarHBondContact O-N 3.13Å; V24-R26 PolarHBondContact O-N 2.98Å; R26-G30 PolarHBondContact O-N 3.03Å
27R90.7Very high88.5Confident120 Ų12064.5 Ų64.545%0.45336%0.358SS..Hα-helixtrans-67.4-46.6176.2-71.3172.5178.9-168.8-4.9111.9K23 V24 F25 G30 L31K23-R27 WeakPolarHBondContact O-CG 3.33Å; K23-R27 PolarHBondContact O-N 3.37Å; K23-R27 VanDerWaalsContact O-N 3.09Å; V24-R27 PolarHBondContact O-N 2.91Å; F25-R27 VanDerWaalsContact C-N 3.25Å; F25-R27 PolarHBondContact O-N 3.39Å; R27-G30 PolarHBondContact O-N 3.39Å; R27-L31 WeakPolarHBondContact O-CG 3.49Å; R27-L31 PolarHBondContact O-N 3.42Å
28V91.3Very high88.7Confident27 Ų2765.9 Ų65.916%0.16436%0.357CS..Hα-helixtrans-62.8-45.8177.1171.40000110.7V24 F25 G30 L31 I32 I41 L45V24-V28 HydrophobicContact CG1-CG2 4.35Å; V24-V28 WeakPolarHBondContact O-CG2 3.5Å; V24-V28 PolarHBondContact O-N 3.3Å; F25-V28 PolarHBondContact O-N 2.89Å; V28-G30 VanDerWaalsContact C-N 3.33Å; V28-G30 PolarHBondContact O-N 3.46Å; V28-L31 PolarHBondContact O-N 3.09Å; V28-I32 HydrophobicContact CG1-CD1 3.95Å; V28-I32 WeakPolarHBondContact O-CG1 3.4Å; V28-I32 PolarHBondContact O-N 2.77Å; V28-I41 HydrophobicContact CG1-CG2 4.25Å; V28-I41 HydrophobicContact CG2-CG2 4.38Å; V28-L45 HydrophobicContact CG2-CD1 4.08Å
29Y90.3Very high89.1Confident64 Ų6468.6 Ų68.625%0.25137%0.369SS..Hα-helixtrans-60.4-43175.7-178.1-103.7000111.8D6 L9 F25 L31 I32 A33D6-Y29 HydrophobicContact CB-CD1 4.14Å; D6-Y29 HydrophobicContact CB-CE1 3.89Å; L9-Y29 HydrophobicContact CD2-CD2 3.69Å; L9-Y29 HydrophobicContact CD2-CE2 3.83Å; F25-Y29 HydrophobicContact CE1-CG 4.46Å; F25-Y29 VanDerWaalsContact O-CB 3.31Å; F25-Y29 WeakPolarHBondContact O-CB 3.48Å; F25-Y29 PolarHBondContact O-N 2.77Å; Y29-L31 PolarHBondContact O-N 3.27Å; Y29-I32 PolarHBondContact O-N 2.75Å; Y29-A33 WeakPolarHBondContact O-CB 3.31Å; Y29-A33 PolarHBondContact O-N 3.4Å
30G89.6Confident89.5Confident5 Ų567.2 Ų67.25%0.05236%0.359CS..Hα-helixtrans-55.1-50.9172.500000111.8R26 R27 V28 I32 A33 L34R26-G30 PolarHBondContact O-N 3.03Å; R27-G30 PolarHBondContact O-N 3.39Å; V28-G30 VanDerWaalsContact C-N 3.33Å; V28-G30 PolarHBondContact O-N 3.46Å; G30-I32 VanDerWaalsContact C-N 3.34Å; G30-I32 PolarHBondContact O-N 3.17Å; G30-A33 WeakPolarHBondContact O-CB 3.27Å; G30-A33 PolarHBondContact O-N 2.97Å; G30-A33 VanDerWaalsContact O-N 3.15Å; G30-L34 VanDerWaalsContact O-CG 3.27Å; G30-L34 WeakPolarHBondContact O-CG 3.44Å; G30-L34 PolarHBondContact O-N 3.23Å
31L90.2Very high90Very high51 Ų5165.5 Ų65.527%0.26735%0.35SS..Hα-helixtrans-59.1-42.6177.3-68.1171000112.7R27 V28 Y29 A33 L34 G35 C36 I41 M44R27-L31 WeakPolarHBondContact O-CG 3.49Å; R27-L31 PolarHBondContact O-N 3.42Å; V28-L31 PolarHBondContact O-N 3.09Å; Y29-L31 PolarHBondContact O-N 3.27Å; L31-A33 VanDerWaalsContact C-N 3.34Å; L31-A33 PolarHBondContact O-N 3.5Å; L31-L34 PolarHBondContact O-N 3.12Å; L31-G35 PolarHBondContact O-N 3.22Å; L31-C36 HydrophobicContact CB-CB 4.17Å; L31-C36 VanDerWaalsContact O-CB 3.23Å; L31-C36 WeakPolarHBondContact O-CB 3.27Å; L31-C36 PolarHBondContact O-N 2.93Å; L31-I41 HydrophobicContact CB-CD1 3.62Å; L31-I41 HydrophobicContact CB-CG1 4.08Å; L31-I41 HydrophobicContact CD1-CG1 4.23Å; L31-I41 HydrophobicContact CD1-CG2 4.24Å; L31-M44 HydrophobicContact CD1-CE 3.89Å
32I89.7Confident90.1Very high80 Ų8069 Ų6941%0.4136%0.363SS..Hα-helixtrans-62.5-43.5176.3-65.9167.1000110.5V28 Y29 G30 L34 G35 I41V28-I32 HydrophobicContact CG1-CD1 3.95Å; V28-I32 WeakPolarHBondContact O-CG1 3.4Å; V28-I32 PolarHBondContact O-N 2.77Å; Y29-I32 PolarHBondContact O-N 2.75Å; G30-I32 VanDerWaalsContact C-N 3.34Å; G30-I32 PolarHBondContact O-N 3.17Å; I32-L34 VanDerWaalsContact C-N 3.28Å; I32-L34 PolarHBondContact O-N 2.89Å; I32-G35 PolarHBondContact O-N 3.18Å; I32-I41 HydrophobicContact CG1-CD1 3.66Å
33A88.4Confident90.4Very high31 Ų3169.8 Ų69.826%0.25637%0.372SS..Hα-helixtrans-64.1-30.9177.300000113.2Y29 G30 L31 G35 Y115Y29-A33 WeakPolarHBondContact O-CB 3.31Å; Y29-A33 PolarHBondContact O-N 3.4Å; G30-A33 WeakPolarHBondContact O-CB 3.27Å; G30-A33 PolarHBondContact O-N 2.97Å; G30-A33 VanDerWaalsContact O-N 3.15Å; L31-A33 VanDerWaalsContact C-N 3.34Å; L31-A33 PolarHBondContact O-N 3.5Å; A33-G35 PolarHBondContact O-N 3.48Å; A33-Y115 HydrophobicContact CB-CD2 4.16Å; A33-Y115 HydrophobicContact CB-CE2 3.88Å
34L89.2Confident90.6Very high65 Ų6567.3 Ų67.334%0.3436%0.364SS..THydrogen-bonded Turntrans-74.7-4.7172.7-61.1173.7000113G30 L31 I32 C118G30-L34 VanDerWaalsContact O-CG 3.27Å; G30-L34 WeakPolarHBondContact O-CG 3.44Å; G30-L34 PolarHBondContact O-N 3.23Å; L31-L34 PolarHBondContact O-N 3.12Å; I32-L34 VanDerWaalsContact C-N 3.28Å; I32-L34 PolarHBondContact O-N 2.89Å; L34-C118 HydrophobicContact CD2-CB 4.17Å; L34-C118 WeakPolarHBondContact CD2-SG 3.44Å
35G88Confident90.6Very high42 Ų4267.9 Ų67.943%0.43337%0.365SS..THydrogen-bonded Turntrans87.912.6-179.200000114.4L31 I32 A33 S37L31-G35 PolarHBondContact O-N 3.22Å; I32-G35 PolarHBondContact O-N 3.18Å; A33-G35 PolarHBondContact O-N 3.48Å; G35-S37 PolarHBondContact O-N 3.31Å
36C89.6Confident90.5Very high52 Ų5273.4 Ų73.435%0.35139%0.389SS..  trans-66134.6173.4-60.80000110.5L31 I41L31-C36 HydrophobicContact CB-CB 4.17Å; L31-C36 VanDerWaalsContact O-CB 3.23Å; L31-C36 WeakPolarHBondContact O-CB 3.27Å; L31-C36 PolarHBondContact O-N 2.93Å; C36-I41 HydrophobicContact CB-CD1 3.94Å; C36-I41 HydrophobicContact CB-CG1 4.02Å
37S91.7Very high90.4Very high50 Ų5073.8 Ų73.835%0.3539%0.391SS..  trans-61.2130.9177.7168.90000111G35 D39 V40 I41G35-S37 PolarHBondContact O-N 3.31Å; S37-D39 PolarHBondContact O-N 3.26Å; S37-D39 PolarHBondContact OG-N 2.96Å; S37-V40 WeakPolarHBondContact O-CB 3.27Å; S37-V40 PolarHBondContact O-N 3.44Å; S37-I41 WeakPolarHBondContact O-CG1 3.4Å; S37-I41 PolarHBondContact O-N 3.45Å
38P91.4Very high90.2Very high86 Ų8672.6 Ų72.656%0.55839%0.394SS*.Hα-helixtrans-53.3-36.6175-27.635.5000113.5V40 I41 F42P38-V40 VanDerWaalsContact C-N 3.33Å; P38-V40 PolarHBondContact O-N 3.49Å; P38-I41 PolarHBondContact O-N 2.87Å; P38-F42 WeakPolarHBondContact O-CB 3.45Å; P38-F42 PolarHBondContact O-N 2.95Å
39D93.1Very high89.8Confident119 Ų11976 Ų7664%0.63641%0.414SS*.Hα-helixtrans-65.7-37.4178.7-61.9-54.3000112.2S37 S43S37-D39 PolarHBondContact O-N 3.26Å; S37-D39 PolarHBondContact OG-N 2.96Å; D39-S43 WeakPolarHBondContact O-CB 3.35Å; D39-S43 PolarHBondContact O-N 3.48Å; D39-S43 PolarHBondContact O-OG 3.36Å
40V91.4Very high89.3Confident95 Ų9575.8 Ų75.858%0.57642%0.423SS*.Hα-helixtrans-70.3-44.3177.5176.30000110S37 P38 F42 S43 M44S37-V40 WeakPolarHBondContact O-CB 3.27Å; S37-V40 PolarHBondContact O-N 3.44Å; P38-V40 VanDerWaalsContact C-N 3.33Å; P38-V40 PolarHBondContact O-N 3.49Å; V40-F42 VanDerWaalsContact C-N 3.32Å; V40-F42 PolarHBondContact O-N 3.36Å; V40-S43 PolarHBondContact O-N 3.14Å; V40-M44 WeakPolarHBondContact O-CB 3.15Å; V40-M44 PolarHBondContact O-N 2.99Å
41I92.8Very high88.3Confident9 Ų977.9 Ų77.95%0.04643%0.434CS..Hα-helixtrans-59.7-46.4175.6-60.3167000109.9V28 L31 I32 C36 S37 P38 S43 M44 L45V28-I41 HydrophobicContact CG1-CG2 4.25Å; V28-I41 HydrophobicContact CG2-CG2 4.38Å; L31-I41 HydrophobicContact CB-CD1 3.62Å; L31-I41 HydrophobicContact CB-CG1 4.08Å; L31-I41 HydrophobicContact CD1-CG1 4.23Å; L31-I41 HydrophobicContact CD1-CG2 4.24Å; I32-I41 HydrophobicContact CG1-CD1 3.66Å; C36-I41 HydrophobicContact CB-CD1 3.94Å; C36-I41 HydrophobicContact CB-CG1 4.02Å; S37-I41 WeakPolarHBondContact O-CG1 3.4Å; S37-I41 PolarHBondContact O-N 3.45Å; P38-I41 PolarHBondContact O-N 2.87Å; I41-S43 PolarHBondContact O-N 2.87Å; I41-M44 PolarHBondContact O-N 2.9Å; I41-L45 HydrophobicContact CG2-CD1 4.09Å; I41-L45 HydrophobicContact CG2-CG 4.41Å; I41-L45 WeakPolarHBondContact O-CG 3.49Å; I41-L45 PolarHBondContact O-N 2.86Å
42F91.3Very high86.8Confident140 Ų14082.8 Ų82.861%0.61446%0.455SS*.Hα-helixtrans-61-44.9177.3178.4-105.1000112.1P38 V40 M44 L45 K46P38-F42 WeakPolarHBondContact O-CB 3.45Å; P38-F42 PolarHBondContact O-N 2.95Å; V40-F42 VanDerWaalsContact C-N 3.32Å; V40-F42 PolarHBondContact O-N 3.36Å; F42-M44 VanDerWaalsContact C-N 3.33Å; F42-M44 PolarHBondContact O-N 3Å; F42-L45 PolarHBondContact O-N 3.32Å; F42-K46 WeakPolarHBondContact O-CB 3.34Å; F42-K46 PolarHBondContact O-N 3.46Å
43S91.3Very high85.2Confident71 Ų7184.9 Ų84.950%0.49747%0.467SS..Hα-helixtrans-61.2-41.5176.8-61.20000112D39 V40 I41 K46 Y47D39-S43 WeakPolarHBondContact O-CB 3.35Å; D39-S43 PolarHBondContact O-N 3.48Å; D39-S43 PolarHBondContact O-OG 3.36Å; V40-S43 PolarHBondContact O-N 3.14Å; I41-S43 PolarHBondContact O-N 2.87Å; S43-K46 PolarHBondContact O-N 2.79Å; S43-Y47 WeakPolarHBondContact O-CB 3.34Å; S43-Y47 PolarHBondContact O-N 2.85Å
44M91.7Very high83.5Confident88 Ų8888.2 Ų88.243%0.43348%0.48SS..Hα-helixtrans-64.2-47.2175.4-177.7-177.469.800111.7L31 V40 I41 F42 K46 Y47 L48L31-M44 HydrophobicContact CD1-CE 3.89Å; V40-M44 WeakPolarHBondContact O-CB 3.15Å; V40-M44 PolarHBondContact O-N 2.99Å; I41-M44 PolarHBondContact O-N 2.9Å; F42-M44 VanDerWaalsContact C-N 3.33Å; F42-M44 PolarHBondContact O-N 3Å; M44-K46 VanDerWaalsContact C-N 3.32Å; M44-K46 PolarHBondContact O-N 3.18Å; M44-Y47 PolarHBondContact O-N 2.87Å; M44-L48 HydrophobicContact CG-CD1 4.25Å; M44-L48 WeakPolarHBondContact O-CG 3.29Å; M44-L48 PolarHBondContact O-N 2.94Å
45L89.9Confident81.6Confident65 Ų6590.7 Ų90.734%0.3449%0.494SS..Hα-helixtrans-60.2-43.8176.9-72174.1000111.2V28 I41 F42 Y47 L48 T49V28-L45 HydrophobicContact CG2-CD1 4.08Å; I41-L45 HydrophobicContact CG2-CD1 4.09Å; I41-L45 HydrophobicContact CG2-CG 4.41Å; I41-L45 WeakPolarHBondContact O-CG 3.49Å; I41-L45 PolarHBondContact O-N 2.86Å; F42-L45 PolarHBondContact O-N 3.32Å; L45-Y47 PolarHBondContact O-N 2.98Å; L45-L48 PolarHBondContact O-N 3.15Å; L45-T49 WeakPolarHBondContact O-CG2 3.4Å; L45-T49 PolarHBondContact O-N 2.87Å; L45-T49 PolarHBondContact O-OG1 3.49Å
46K88.2Confident79.7Confident130 Ų13093.8 Ų93.857%0.56551%0.509SS*.Hα-helixtrans-58-49175.3-174.3-180178.1-178.70111.1F42 S43 M44 L48 T49 S50F42-K46 WeakPolarHBondContact O-CB 3.34Å; F42-K46 PolarHBondContact O-N 3.46Å; S43-K46 PolarHBondContact O-N 2.79Å; M44-K46 VanDerWaalsContact C-N 3.32Å; M44-K46 PolarHBondContact O-N 3.18Å; K46-L48 PolarHBondContact O-N 3.38Å; K46-T49 WeakPolarHBondContact CA-OG1 3.37Å; K46-T49 PolarHBondContact O-N 3.46Å; K46-T49 PolarHBondContact O-OG1 3.38Å; K46-S50 PolarHBondContact O-N 3.05Å; K46-S50 PolarHBondContact O-OG 2.9Å; K46-S50 VanDerWaalsContact O-OG 3.13Å
47Y88Confident77.7Confident159 Ų15996.6 Ų96.662%0.62453%0.525SS*.Hα-helixtrans-58-47.4176.9178-99.9000112S43 M44 L45 T49 S50 V51S43-Y47 WeakPolarHBondContact O-CB 3.34Å; S43-Y47 PolarHBondContact O-N 2.85Å; M44-Y47 PolarHBondContact O-N 2.87Å; L45-Y47 PolarHBondContact O-N 2.98Å; Y47-T49 VanDerWaalsContact C-N 3.33Å; Y47-T49 PolarHBondContact O-N 3.3Å; Y47-S50 PolarHBondContact O-N 3.49Å; Y47-S50 VanDerWaalsContact O-N 3.09Å; Y47-V51 HydrophobicContact CD1-CG2 4.08Å; Y47-V51 HydrophobicContact CD2-CG2 4.16Å; Y47-V51 HydrophobicContact CE1-CG2 3.62Å; Y47-V51 HydrophobicContact CE2-CG2 3.71Å; Y47-V51 HydrophobicContact CG-CG2 4.34Å; Y47-V51 VanDerWaalsContact CZ-CG2 3.42Å; Y47-V51 WeakPolarHBondContact O-CG2 3.49Å; Y47-V51 PolarHBondContact O-N 3.22Å
48L85.9Confident75.3Confident96 Ų96101.4 Ų101.450%0.50354%0.541SS..Hα-helixtrans-60.7-41.4178.5-70.4172.5000112.1M44 L45 K46 S50 H52M44-L48 HydrophobicContact CG-CD1 4.25Å; M44-L48 WeakPolarHBondContact O-CG 3.29Å; M44-L48 PolarHBondContact O-N 2.94Å; L45-L48 PolarHBondContact O-N 3.15Å; K46-L48 PolarHBondContact O-N 3.38Å; L48-S50 VanDerWaalsContact C-N 3.31Å; L48-S50 PolarHBondContact O-N 2.98Å; L48-H52 WeakPolarHBondContact O-CB 3.3Å; L48-H52 PolarHBondContact O-N 3.44Å; L48-H52 VanDerWaalsContact O-N 3.13Å
49T83.1Confident72.9Confident98 Ų98105.4 Ų105.460%0.60156%0.557SS**Hα-helixtrans-68-30176550000113L45 K46 Y47L45-T49 WeakPolarHBondContact O-CG2 3.4Å; L45-T49 PolarHBondContact O-N 2.87Å; L45-T49 PolarHBondContact O-OG1 3.49Å; K46-T49 WeakPolarHBondContact CA-OG1 3.37Å; K46-T49 PolarHBondContact O-N 3.46Å; K46-T49 PolarHBondContact O-OG1 3.38Å; Y47-T49 VanDerWaalsContact C-N 3.33Å; Y47-T49 PolarHBondContact O-N 3.3Å
50S80.9Confident70.3Confident60 Ų60105 Ų10542%0.4256%0.559SS.*Hα-helixtrans-76.2-43.8176.3-62.40000112.3K46 Y47 L48 H52 L53 N54K46-S50 PolarHBondContact O-N 3.05Å; K46-S50 PolarHBondContact O-OG 2.9Å; K46-S50 VanDerWaalsContact O-OG 3.13Å; Y47-S50 PolarHBondContact O-N 3.49Å; Y47-S50 VanDerWaalsContact O-N 3.09Å; L48-S50 VanDerWaalsContact C-N 3.31Å; L48-S50 PolarHBondContact O-N 2.98Å; S50-H52 VanDerWaalsContact C-N 3.3Å; S50-H52 PolarHBondContact O-N 2.77Å; S50-L53 WeakPolarHBondContact O-CB 3.48Å; S50-L53 PolarHBondContact O-N 3.41Å; S50-L53 VanDerWaalsContact O-N 3.14Å; S50-N54 PolarHBondContact O-N 3.32Å; S50-N54 PolarHBondContact O-OD1 3.3Å
51V69.1Low67.8Low49 Ų49106.8 Ų106.830%0.29757%0.565SS.*Hα-helixtrans-64.5-37.5178.5174.40000111.3Y47 L53 N54 N55Y47-V51 HydrophobicContact CD1-CG2 4.08Å; Y47-V51 HydrophobicContact CD2-CG2 4.16Å; Y47-V51 HydrophobicContact CE1-CG2 3.62Å; Y47-V51 HydrophobicContact CE2-CG2 3.71Å; Y47-V51 HydrophobicContact CG-CG2 4.34Å; Y47-V51 VanDerWaalsContact CZ-CG2 3.42Å; Y47-V51 WeakPolarHBondContact O-CG2 3.49Å; Y47-V51 PolarHBondContact O-N 3.22Å; V51-L53 PolarHBondContact O-N 2.9Å; V51-N54 PolarHBondContact O-N 3.28Å; V51-N55 PolarHBondContact O-N 2.96Å
52H58.6Low65.2Low153 Ų153114.2 Ų114.271%0.70860%0.6SS**Hα-helixtrans-64.6-24.5177.7-141.771.6000112.9L48 S50L48-H52 WeakPolarHBondContact O-CB 3.3Å; L48-H52 PolarHBondContact O-N 3.44Å; L48-H52 VanDerWaalsContact O-N 3.13Å; S50-H52 VanDerWaalsContact C-N 3.3Å; S50-H52 PolarHBondContact O-N 2.77Å
53L55.5Low62.5Low125 Ų125115.1 Ų115.165%0.65461%0.611SS**Hα-helixtrans-77.9-35.8177.1-160.370000111.9S50 V51 T57S50-L53 WeakPolarHBondContact O-CB 3.48Å; S50-L53 PolarHBondContact O-N 3.41Å; S50-L53 VanDerWaalsContact O-N 3.14Å; V51-L53 PolarHBondContact O-N 2.9Å; L53-T57 PolarHBondContact O-OG1 2.93Å
54N51.6Low59.9Low100 Ų100116.8 Ų116.854%0.53562%0.623SS.*Hα-helixtrans-72.7-39.3-179-71.923.9000112S50 V51 S56 T57S50-N54 PolarHBondContact O-N 3.32Å; S50-N54 PolarHBondContact O-OD1 3.3Å; V51-N54 PolarHBondContact O-N 3.28Å; N54-S56 PolarHBondContact O-N 3.04Å; N54-T57 PolarHBondContact O-N 3.41Å
55N50.8Low57.3Low117 Ų117120.8 Ų120.863%0.62664%0.644SS**THydrogen-bonded Turntrans-71.1-12.9-178.5-66.88000114V51V51-N55 PolarHBondContact O-N 2.96Å
56S48.6Very low55.1Low108 Ų108121.9 Ų121.976%0.75566%0.657SS**THydrogen-bonded Turntrans-92.5-7.8176.8-131.50000113.4N54N54-S56 PolarHBondContact O-N 3.04Å
57T46.7Very low52.8Low111 Ų111122.6 Ų122.668%0.68167%0.667SS**THydrogen-bonded Turntrans-109.6-8.6-177.9-37.80000112.5L53 N54L53-T57 PolarHBondContact O-OG1 2.93Å; N54-T57 PolarHBondContact O-N 3.41Å
58E41.3Very low50.5Low150 Ų150122.3 Ų122.370%0.70168%0.681SS**  trans-107.667.3178.7-68.3-177.6171.500111
59L41.5Very low48.1Very low170 Ų170122.6 Ų122.689%0.8969%0.692SS**SBendtrans-107.423.2157.4-122.2169.7000110.7
60V37.8Very low45.9Very low111 Ų111123.9 Ų123.967%0.67370%0.699SS**SBendtrans-136.6117.6177.6-175.50000108
61D39Very low44Very low133 Ų133127.4 Ų127.471%0.71172%0.719SS**  trans75.197.8162.8-69.1-26.1000120.9
62H37.9Very low42.3Very low165 Ų165131.1 Ų131.176%0.76474%0.742SS**  58.8113.9122.5-80.7-80.9000120
63N35.2Very low41.2Very low158 Ų158129.6 Ų129.685%0.84575%0.748SS**  trans50.988.6137.7-88.111.9000117.4
64S37.5Very low40.1Very low107 Ų107135.3 Ų135.375%0.74876%0.761SS**  trans-166.9102.7135.8-163.80000112
65I36.5Very low39.5Very low172 Ų172136.3 Ų136.388%0.88278%0.775SS**  trans-82.1109.6159.3-66.4162.8000105.8
66S43.4Very low39Very low87 Ų87136.8 Ų136.861%0.60878%0.783SS**  trans-146.6104.2161.375.60000112.9
67N39.8Very low38.3Very low145 Ų145135 Ų13578%0.77578%0.781SS**  trans34.192.9138.5-48-16000117.1S69N67-S69 PolarHBondContact O-N 3.23Å
68V39.6Very low38Very low153 Ų153138.3 Ų138.393%0.92779%0.789SS**  trans-72.795.6163.6175.70000108.9
69S36.8Very low37.7Very low103 Ų103140.4 Ų140.472%0.7280%0.798SS**  trans-106.2126.8160.7-74.80000109.1N67N67-S69 PolarHBondContact O-N 3.23Å
70T35Very low37.8Very low124 Ų124140.3 Ų140.376%0.76179%0.793SS**  trans-12.6129.3161.942.40000117.3
71T41.4Very low37.6Very low135 Ų135144.2 Ų144.283%0.82880%0.804SS**  173.5138.6109.7380000112.2
72T33.3Very low37.9Very low127 Ų127143.6 Ų143.678%0.77981%0.805SS**  trans-30.4135.7166.236.30000117.2
73S35.9Very low37.8Very low120 Ų120141.5 Ų141.584%0.83980%0.799SS**  177.2146.9113.5-77.40000114.1
74R32.7Very low38.2Very low246 Ų246144.6 Ų144.693%0.92880%0.799SS**  trans-40.2133-177.5-65.9153.771.1168.92.4115.5
75S38.2Very low38.4Very low120 Ų120143.5 Ų143.584%0.83979%0.791SS**  trans-134.4129.5150.1-1710000110.9
76T40.6Very low38.7Very low128 Ų128143.5 Ų143.579%0.78579%0.787SS**  trans-80.9143.2-177.837.70000112.2
77G35.2Very low38.5Very low69 Ų69148.2 Ų148.271%0.71180%0.797SS**  trans89.4108.4150.100000116
78Q40.5Very low38.3Very low182 Ų182147.5 Ų147.585%0.8580%0.798SS**  176.5125.698.2-89.6179.7-9.400109.2H80Q78-H80 PolarHBondContact O-N 2.84Å
79H34Very low38Very low194 Ų194144.6 Ų144.690%0.89879%0.79SS**  trans-58.1121.7174.3-116.2-117.2000109.9
80H44Very low37.9Very low168 Ų168145.4 Ų145.478%0.77880%0.796SS**  trans-125.2122.1157-91.547.3000109.1Q78 V82Q78-H80 PolarHBondContact O-N 2.84Å; H80-V82 PolarHBondContact O-N 3.39Å
81Q33.9Very low38.2Very low192 Ų192150.2 Ų150.290%0.89780%0.8SS**  trans-66.4115.4-178.2-177.9-169.257.800109.4
82V44.3Very low38.1Very low121 Ų121150.2 Ų150.273%0.73380%0.795SS**  trans-94.1113.3174.8-1730000108.8H80 R84H80-V82 PolarHBondContact O-N 3.39Å; V82-R84 PolarHBondContact O-N 3.47Å
83N35.6Very low38.7Very low121 Ų121149.5 Ų149.565%0.64779%0.786SS**  trans-66.9120.7174.1-168.9-8.9000109.7S85N83-S85 VanDerWaalsContact C-N 3.29Å; N83-S85 PolarHBondContact ND2-OG 2.93Å; N83-S85 PolarHBondContact O-N 3.09Å; N83-S85 PolarHBondContact OD1-N 2.97Å; N83-S85 PolarHBondContact OD1-OG 2.84Å
84R44.2Very low38.8Very low223 Ų223152 Ų15284%0.84278%0.784SS**G310 helixtrans-843.4-171.2-120.9177.6174.4151.2-3.1113.7V82V82-R84 PolarHBondContact O-N 3.47Å
85S42.4Very low39.3Very low83 Ų83145.1 Ų145.158%0.5877%0.773SS**G310 helixtrans-85.6-6.5-166.3580000116.6N83N83-S85 VanDerWaalsContact C-N 3.29Å; N83-S85 PolarHBondContact ND2-OG 2.93Å; N83-S85 PolarHBondContact O-N 3.09Å; N83-S85 PolarHBondContact OD1-N 2.97Å; N83-S85 PolarHBondContact OD1-OG 2.84Å
86E41.8Very low39.4Very low173 Ų173144.9 Ų144.981%0.80875%0.754SS**G310 helixtrans-112.86.5-170.5-72.4-175160.600115.7V88E86-V88 PolarHBondContact O-N 3.4Å
87F39.4Very low39.5Very low185 Ų185147.3 Ų147.381%0.81176%0.757SS**  trans-80.222.7-177.4-85.8-84.4000115.3
88V35.8Very low39.7Very low131 Ų131148.4 Ų148.479%0.79475%0.753SS**SBendtrans-121.5122.5178.7-1710000109.3E86E86-V88 PolarHBondContact O-N 3.4Å
89A32.9Very low39.9Very low91 Ų91146.1 Ų146.175%0.75274%0.741SS**SBendtrans7892.1169.600000117.3
90S34.2Very low40Very low121 Ų121145.1 Ų145.185%0.84673%0.729SS**  trans167.777.2132.3-76.20000110.9
91R42Very low39.6Very low225 Ų225141.1 Ų141.185%0.84972%0.72SS**  trans-10289.8162.2-92.4-168-82.2161.5-4108.9
92N38.9Very low39.9Very low134 Ų134136.5 Ų136.572%0.71771%0.705SS**  trans-61.1139.1165.4-165.7-32.9000109.1E94N92-E94 PolarHBondContact O-N 3.35Å
93L46.7Very low39.8Very low113 Ų113134.9 Ų134.959%0.59269%0.688SS**SBendtrans-96.312.2-148-156.974.8000113.6
94E37Very low40Very low173 Ų173132.8 Ų132.881%0.80868%0.683SS**THydrogen-bonded Turntrans-97.3-8-159.6-123.4130.8124.200116.5N92N92-E94 PolarHBondContact O-N 3.35Å
95S43.1Very low39.9Very low100 Ų100127 Ų12770%0.69967%0.669SS**THydrogen-bonded Turntrans-92.611174.560.10000114.4Q97S95-Q97 PolarHBondContact O-N 3.38Å
96R41.6Very low39.9Very low116 Ų116126.1 Ų126.144%0.43866%0.662SS.*THydrogen-bonded Turntrans-80.42.5-166.6-71.7-171.172.2-169.50.6117.1
97Q41.5Very low40.2Very low179 Ų179123.8 Ų123.884%0.83666%0.655SS**THydrogen-bonded Turntrans-90.1-28.8-175.5-65.6-170.47.300114S95 F99S95-Q97 PolarHBondContact O-N 3.38Å; Q97-F99 PolarHBondContact O-N 3.39Å
98S39.4Very low40.8Very low92 Ų92122 Ų12264%0.64365%0.649SS**SBendtrans-79.4-14.8-176.8-172.90000115.2
99F44.5Very low41.2Very low133 Ų133123.5 Ų123.558%0.58364%0.642SS**SBendtrans-106.3-10-178.8-69-76.9000113.4Q97 S101 T102 F103Q97-F99 PolarHBondContact O-N 3.39Å; F99-S101 VanDerWaalsContact C-N 3.32Å; F99-S101 PolarHBondContact O-N 3.26Å; F99-T102 PolarHBondContact O-N 3.36Å; F99-F103 HydrophobicContact CB-CD2 4.1Å; F99-F103 HydrophobicContact CB-CE2 3.98Å; F99-F103 HydrophobicContact CD1-CE2 4.23Å; F99-F103 HydrophobicContact CG-CE2 4.48Å; F99-F103 WeakPolarHBondContact O-CD2 3.46Å; F99-F103 PolarHBondContact O-N 3.5Å
100R37.4Very low42Very low173 Ų173123.7 Ų123.765%0.65363%0.63SS**Hα-helixtrans-68.8-30.1-175.9-100.3-178.8165.1-96.77.4112.9S104R100-S104 WeakPolarHBondContact O-CB 2.96Å; R100-S104 PolarHBondContact O-N 2.99Å
101S35.1Very low42.7Very low85 Ų85122.9 Ų122.959%0.59462%0.616SS**Hα-helixtrans-73.2-40.6177.546.10000112.3F99 F103F99-S101 VanDerWaalsContact C-N 3.32Å; F99-S101 PolarHBondContact O-N 3.26Å; S101-F103 PolarHBondContact O-N 2.87Å
102T40.9Very low43.2Very low94 Ų94114.5 Ų114.558%0.57760%0.599SS**Hα-helixtrans-72.3-28-177.2-28.70000113.4F99F99-T102 PolarHBondContact O-N 3.36Å
103F40.6Very low43.9Very low87 Ų87115.4 Ų115.438%0.38260%0.599SS.*Hα-helixtrans-91.9-14.9179.5-69.8-63.6000114.2F99 S101 D105 C106F99-F103 HydrophobicContact CB-CD2 4.1Å; F99-F103 HydrophobicContact CB-CE2 3.98Å; F99-F103 HydrophobicContact CD1-CE2 4.23Å; F99-F103 HydrophobicContact CG-CE2 4.48Å; F99-F103 WeakPolarHBondContact O-CD2 3.46Å; F99-F103 PolarHBondContact O-N 3.5Å; S101-F103 PolarHBondContact O-N 2.87Å; F103-D105 VanDerWaalsContact C-N 3.32Å; F103-C106 PolarHBondContact O-N 3.26Å
104S39.9Very low44.2Very low77 Ų77112.3 Ų112.354%0.53858%0.583SS.*Hα-helixtrans-71.5-27.8179.5-162.80000112.4R100R100-S104 WeakPolarHBondContact O-CB 2.96Å; R100-S104 PolarHBondContact O-N 2.99Å
105D42.7Very low44.9Very low102 Ų102109.1 Ų109.155%0.54557%0.565SS.*THydrogen-bonded Turntrans-73.1-29.8176.6-82.4-22.3000112.4F103 D107 Q108 Y109F103-D105 VanDerWaalsContact C-N 3.32Å; D105-D107 VanDerWaalsContact C-N 3.27Å; D105-D107 PolarHBondContact O-N 3Å; D105-Q108 PolarHBondContact O-N 3.34Å; D105-Y109 WeakPolarHBondContact O-CD2 3.23Å
106C42.2Very low45.6Very low64 Ų64108.7 Ų108.743%0.43255%0.551SS.*Hα-helixtrans-66.2-27.8-179.1-61.30000113.4F103 Q108 Y109 L110F103-C106 PolarHBondContact O-N 3.26Å; C106-Q108 PolarHBondContact O-N 3.21Å; C106-Y109 PolarHBondContact O-N 3.39Å; C106-Y109 VanDerWaalsContact O-N 3.12Å; C106-L110 PolarHBondContact O-N 3.47Å
107D48.7Very low46.3Very low124 Ų124108.3 Ų108.366%0.66356%0.557SS**Hα-helixtrans-68.1-25.2178.4-76.3-21.7000111.8D105D105-D107 VanDerWaalsContact C-N 3.27Å; D105-D107 PolarHBondContact O-N 3Å
108Q50.8Low46.8Very low148 Ų148100.9 Ų100.969%0.69253%0.525SS*.Hα-helixtrans-72.4-28.7171.6-74.4-171.33.900112.7D105 C106 L110D105-Q108 PolarHBondContact O-N 3.34Å; C106-Q108 PolarHBondContact O-N 3.21Å; Q108-L110 VanDerWaalsContact C-N 3.32Å; Q108-L110 PolarHBondContact O-N 3.31Å
109Y46Very low47.6Very low163 Ų163102.1 Ų102.164%0.63952%0.519SS*.Hα-helixtrans-78.3-14.8-179.8-70.9-82.7000113.5D105 C106 N114D105-Y109 WeakPolarHBondContact O-CD2 3.23Å; C106-Y109 PolarHBondContact O-N 3.39Å; C106-Y109 VanDerWaalsContact O-N 3.12Å; Y109-N114 WeakPolarHBondContact CA-ND2 3.23Å; Y109-N114 WeakPolarHBondContact O-CB 3.37Å; Y109-N114 PolarHBondContact O-ND2 3.38Å
110L49.9Very low48.2Very low95 Ų95103.2 Ų103.250%0.49753%0.528SS..THydrogen-bonded Turntrans-9822177.3-73.6168.9000113.5C106 Q108C106-L110 PolarHBondContact O-N 3.47Å; Q108-L110 VanDerWaalsContact C-N 3.32Å; Q108-L110 PolarHBondContact O-N 3.31Å
111N48.7Very low49Very low104 Ų10499.9 Ų99.956%0.55652%0.522SS*.SBendtrans-74146.3169.9-163.14.4000110.2Q113 N114N111-Q113 PolarHBondContact O-N 3.39Å; N111-N114 PolarHBondContact O-N 3.35Å
112G52.3Low49.5Very low48 Ų48101.1 Ų101.150%0.49553%0.528SS..Hα-helixtrans-54.1-19.5-169.100000115.9
113Q53.1Low49.9Very low154 Ų154102.9 Ų102.972%0.7253%0.534SS*.Hα-helixtrans-68.3-36.3172.6-72.9179.2-22.800113.8N111 E116 L117N111-Q113 PolarHBondContact O-N 3.39Å; Q113-E116 PolarHBondContact O-N 3.34Å; Q113-L117 PolarHBondContact O-N 3.41Å
114N53.1Low50.1Low47 Ų47107.7 Ų107.725%0.25156%0.555SS.*Hα-helixtrans-75.6-27.5178.9-76.4-27.9000112.3Y109 N111 E116 L117 C118Y109-N114 WeakPolarHBondContact CA-ND2 3.23Å; Y109-N114 WeakPolarHBondContact O-CB 3.37Å; Y109-N114 PolarHBondContact O-ND2 3.38Å; N111-N114 PolarHBondContact O-N 3.35Å; N114-E116 VanDerWaalsContact C-N 3.28Å; N114-E116 PolarHBondContact O-N 3.44Å; N114-L117 PolarHBondContact O-N 3.28Å; N114-C118 PolarHBondContact O-N 3.25Å; N114-C118 VanDerWaalsContact O-N 3.12Å
115Y52.4Low50.4Low107 Ų107109.2 Ų109.242%0.4256%0.563SS.*Hα-helixtrans-60.8-39172.5-177.9-109.9000111.8A33 C118 K119A33-Y115 HydrophobicContact CB-CD2 4.16Å; A33-Y115 HydrophobicContact CB-CE2 3.88Å; Y115-C118 PolarHBondContact O-N 3.43Å; Y115-K119 HydrophobicContact CE1-CD 4.43Å; Y115-K119 VanDerWaalsContact CE1-NZ 3.26Å; Y115-K119 PolarHBondContact O-N 3.42Å
116E57Low50.2Low90 Ų90116 Ų11642%0.42158%0.581SS.*Hα-helixtrans-72.1-36176.8-66.6-57.3129.900112.7Q113 N114 C118 K119 M120Q113-E116 PolarHBondContact O-N 3.34Å; N114-E116 VanDerWaalsContact C-N 3.28Å; N114-E116 PolarHBondContact O-N 3.44Å; E116-C118 VanDerWaalsContact C-N 3.27Å; E116-C118 PolarHBondContact O-N 3.12Å; E116-K119 PolarHBondContact O-N 3.47Å; E116-K119 IonicContact OE1-NZ 3.69Å; E116-K119 PolarHBondContact OE1-NZ 3.46Å; E116-K119 IonicContact OE2-NZ 3.77Å; E116-M120 PolarHBondContact O-N 3.04Å
117L56.7Low50.2Low108 Ų108118.5 Ų118.557%0.56559%0.594SS**Hα-helixtrans-60.8-37.4173.2-81.4165.4000112.1Q113 N114 M120Q113-L117 PolarHBondContact O-N 3.41Å; N114-L117 PolarHBondContact O-N 3.28Å; L117-M120 PolarHBondContact O-N 3.21Å
118C51.4Low50Low24 Ų24117 Ų11716%0.16259%0.593CS.*Hα-helixtrans-72.7-27178.8-72.40000114L34 N114 Y115 E116 M120 L121L34-C118 HydrophobicContact CD2-CB 4.17Å; L34-C118 WeakPolarHBondContact CD2-SG 3.44Å; N114-C118 PolarHBondContact O-N 3.25Å; N114-C118 VanDerWaalsContact O-N 3.12Å; Y115-C118 PolarHBondContact O-N 3.43Å; E116-C118 VanDerWaalsContact C-N 3.27Å; E116-C118 PolarHBondContact O-N 3.12Å; C118-M120 VanDerWaalsContact C-N 3.26Å; C118-M120 PolarHBondContact O-N 3.48Å; C118-L121 PolarHBondContact O-N 2.71Å
119K55.3Low49.6Very low118 Ų118118.3 Ų118.351%0.51360%0.599SS.*Hα-helixtrans-68.6-25.5170.2-69.8179-173.61660113Y115 E116Y115-K119 HydrophobicContact CE1-CD 4.43Å; Y115-K119 VanDerWaalsContact CE1-NZ 3.26Å; Y115-K119 PolarHBondContact O-N 3.42Å; E116-K119 PolarHBondContact O-N 3.47Å; E116-K119 IonicContact OE1-NZ 3.69Å; E116-K119 PolarHBondContact OE1-NZ 3.46Å; E116-K119 IonicContact OE2-NZ 3.77Å
120M57.8Low49.5Very low155 Ų155118.8 Ų118.876%0.76461%0.607SS**THydrogen-bonded Turntrans-84.3-7.9-179.5-66.9-166.5176.300113.8E116 L117 C118E116-M120 PolarHBondContact O-N 3.04Å; L117-M120 PolarHBondContact O-N 3.21Å; C118-M120 VanDerWaalsContact C-N 3.26Å; C118-M120 PolarHBondContact O-N 3.48Å
121L54.3Low49.1Very low104 Ų104122.3 Ų122.355%0.54562%0.621SS.*SBendtrans-73.5126.7173.9-70.5172.1000109.9C118 N123C118-L121 PolarHBondContact O-N 2.71Å; L121-N123 PolarHBondContact O-N 2.91Å
122P46.7Very low48.9Very low111 Ų111122 Ų12272%0.72163%0.625SS**  trans-68.1101.2179.325.7-31.4000109.9K124P122-K124 PolarHBondContact O-N 2.8Å
123N48.6Very low48.3Very low131 Ų131127.5 Ų127.570%0.70164%0.637SS**  trans-67.270.6162.9-76.8-38000109.5L121 P125L121-N123 PolarHBondContact O-N 2.91Å; N123-P125 VanDerWaalsContact O-CD 3.31Å; N123-P125 WeakPolarHBondContact O-CD 3.31Å
124K44.7Very low48.1Very low187 Ų187125.9 Ų125.981%0.81364%0.643SS**  trans-97.3104.4163.9-96-177.4176.9176.80108.1P122 R126P122-K124 PolarHBondContact O-N 2.8Å; K124-R126 PolarHBondContact O-N 2.8Å
125P45.6Very low48.1Very low110 Ų110131.6 Ų131.671%0.71467%0.665SS**  trans-60.7111.5159.425.2-26.8000105.7N123 V127N123-P125 VanDerWaalsContact O-CD 3.31Å; N123-P125 WeakPolarHBondContact O-CD 3.31Å; P125-V127 PolarHBondContact O-N 2.98Å
126R39.4Very low47.7Very low244 Ų244132.3 Ų132.392%0.92168%0.683SS**  trans-70.483.3170.8-144179.7-165.9167.53105.6K124 S128K124-R126 PolarHBondContact O-N 2.8Å; R126-S128 PolarHBondContact O-N 2.95Å
127V41.8Very low47.3Very low117 Ų117135 Ų13571%0.70970%0.7SS**  trans-63.396.9167.31800000105P125 Q129P125-V127 PolarHBondContact O-N 2.98Å; V127-Q129 VanDerWaalsContact C-N 3.3Å; V127-Q129 PolarHBondContact O-N 2.88Å
128S43.5Very low46.8Very low92 Ų92141.7 Ų141.764%0.64374%0.735SS**  trans-64.799167.8-168.20000106R126 H130R126-S128 PolarHBondContact O-N 2.95Å; S128-H130 VanDerWaalsContact C-N 3.27Å; S128-H130 PolarHBondContact O-N 2.89Å
129Q43.2Very low46.6Very low175 Ų175147.6 Ų147.682%0.81876%0.764SS**  trans-60.998.6164.8-81.3-175.5-24.300106.7V127 H131V127-Q129 VanDerWaalsContact C-N 3.3Å; V127-Q129 PolarHBondContact O-N 2.88Å; Q129-H131 PolarHBondContact O-N 2.98Å
130H44.2Very low46.1Very low173 Ų173149.2 Ų149.280%0.80178%0.777SS**  trans-58.4104.6162.8-85.4-91000107.2S128 P132S128-H130 VanDerWaalsContact C-N 3.27Å; S128-H130 PolarHBondContact O-N 2.89Å; H130-P132 VanDerWaalsContact O-CD 3.28Å; H130-P132 WeakPolarHBondContact O-CD 3.28Å
131H42.3Very low45.4Very low170 Ų170148.8 Ų148.879%0.78778%0.778SS**  trans-73.2114168.8-152.570.1000107.3Q129Q129-H131 PolarHBondContact O-N 2.98Å
132P42.7Very low44.9Very low98 Ų98151.5 Ų151.564%0.63679%0.792SS**  trans-81.6141.6171.433.9-27.3000108H130H130-P132 VanDerWaalsContact O-CD 3.28Å; H130-P132 WeakPolarHBondContact O-CD 3.28Å
133H39.9Very low44.8Very low162 Ų162154 Ų15475%0.7580%0.796SS**  trans64.8107.8162-80.1-71000118.7
134S50.6Low44.6Very low120 Ų120155.5 Ų155.584%0.83980%0.803SS**  -151.1118.4128.3-79.10000109.2
135K52.5Low44.6Very low168 Ų168153.3 Ų153.373%0.7380%0.802SS**  trans-66.2151.7175.1-79.3173.1171.61740110.4
136P43.7Very low44.5Very low121 Ų121156.6 Ų156.679%0.78681%0.808SS**  trans-79.3129162.333.5-27.5000108.4
137N49Very low44.9Very low148 Ų148149.3 Ų149.379%0.79180%0.799SS**  trans-160.786.5165.6-94.8-23.1000108.2
138L45.6Very low45.2Very low248 Ų248152.3 Ų152.3100%1.29881%0.807SS**  -179.10114.1-132.181.2000108.8

Retrieved 138 of 138 residues in 72 ms (Link to these results)