A0A096M439_POEFO Loading...

Clusterin associated protein 1

AlphaFold DB , UniProt , Accession A0A096M439, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 424 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
1M62.9Low84.7Confident80 Ų8071.7 Ų71.739%0.39434%0.336SS..  0142.30-176.5-164.9-167.900109D5 L6 G91 V94M1-D5 HydrophobicContact CE-CB 4.22Å; M1-L6 HydrophobicContact CE-CB 3.24Å; M1-L6 HydrophobicContact CE-CD1 3.77Å; M1-L6 HydrophobicContact CE-CD2 4.25Å; M1-L6 HydrophobicContact CE-CG 3.89Å; M1-L6 HydrophobicContact SD-CB 3.88Å; M1-L6 HydrophobicContact SD-CD1 4.49Å; M1-L6 HydrophobicContact SD-CD2 4.06Å; M1-L6 HydrophobicContact SD-CG 4.35Å; M1-G91 WeakPolarHBondContact CG-O 3.32Å; M1-G91 WeakPolarHBondContact SD-CA 3.23Å; M1-V94 HydrophobicContact CE-CB 3.48Å; M1-V94 VanDerWaalsContact CE-CB 3.48Å; M1-V94 HydrophobicContact CE-CG1 3.34Å; M1-V94 HydrophobicContact CE-CG2 4Å
2S75.8Confident85.4Confident59 Ų5968.7 Ų68.741%0.41332%0.323SS..  trans-82.4133.5171.6-178.80000109.6R4 D5 L6S2-R4 PolarHBondContact O-N 2.82Å; S2-R4 PolarHBondContact OG-N 3.39Å; S2-D5 WeakPolarHBondContact O-CB 3.28Å; S2-D5 PolarHBondContact O-N 3.44Å; S2-L6 PolarHBondContact O-N 3.49Å
3F79.1Confident86Confident156 Ų15663.5 Ų63.568%0.68430%0.298SS*.Hα-helixtrans-49.3-33.7173.9176.6-97.2000112.3L6 K7 M24F3-L6 PolarHBondContact O-N 2.85Å; F3-K7 PolarHBondContact O-N 2.84Å; F3-K7 VanDerWaalsContact O-N 3.15Å; F3-M24 HydrophobicContact CD2-CE 3.61Å; F3-M24 HydrophobicContact CE2-CE 3.45Å; F3-M24 VanDerWaalsContact CE2-CE 3.45Å; F3-M24 HydrophobicContact CG-CE 4.3Å; F3-M24 HydrophobicContact CZ-CE 4.03Å
4R85Confident86.4Confident177 Ų17770.4 Ų70.467%0.66832%0.32SS*.Hα-helixtrans-62.5-40175.9-172.9173.6-177.3159.3-0.6113.1S2 N8S2-R4 PolarHBondContact O-N 2.82Å; S2-R4 PolarHBondContact OG-N 3.39Å; R4-N8 WeakPolarHBondContact O-CB 3.38Å; R4-N8 PolarHBondContact O-N 3.43Å; R4-N8 PolarHBondContact O-ND2 3.25Å; R4-N8 PolarHBondContact O-OD1 3.06Å
5D86.6Confident86.6Confident40 Ų4068.5 Ų68.521%0.21432%0.322CS..Hα-helixtrans-67.5-39-178.1-60.8-24.7000110.8M1 S2 F9 K95 L98M1-D5 HydrophobicContact CE-CB 4.22Å; S2-D5 WeakPolarHBondContact O-CB 3.28Å; S2-D5 PolarHBondContact O-N 3.44Å; D5-F9 VanDerWaalsContact O-CB 3.27Å; D5-F9 WeakPolarHBondContact O-CB 3.46Å; D5-F9 PolarHBondContact O-N 3.17Å; D5-K95 WeakPolarHBondContact OD2-CE 3.38Å; D5-L98 HydrophobicContact CB-CD2 4.33Å
6L87.2Confident86.9Confident10 Ų1064.8 Ų64.85%0.05231%0.305CS..Hα-helixtrans-69.6-45.5179.8-16846.2000110.8M1 S2 F3 N8 F9 T10 M24 F27 V94M1-L6 HydrophobicContact CE-CB 3.24Å; M1-L6 HydrophobicContact CE-CD1 3.77Å; M1-L6 HydrophobicContact CE-CD2 4.25Å; M1-L6 HydrophobicContact CE-CG 3.89Å; M1-L6 HydrophobicContact SD-CB 3.88Å; M1-L6 HydrophobicContact SD-CD1 4.49Å; M1-L6 HydrophobicContact SD-CD2 4.06Å; M1-L6 HydrophobicContact SD-CG 4.35Å; S2-L6 PolarHBondContact O-N 3.49Å; F3-L6 PolarHBondContact O-N 2.85Å; L6-N8 PolarHBondContact O-N 3.33Å; L6-F9 WeakPolarHBondContact O-CB 3.4Å; L6-F9 PolarHBondContact O-N 3.45Å; L6-T10 PolarHBondContact O-N 3.34Å; L6-T10 PolarHBondContact O-OG1 3.4Å; L6-M24 HydrophobicContact CB-CE 3.73Å; L6-M24 HydrophobicContact CB-SD 4.06Å; L6-M24 HydrophobicContact CD2-CB 4.17Å; L6-M24 HydrophobicContact CD2-CE 3.93Å; L6-M24 VanDerWaalsContact CD2-O 3.29Å; L6-M24 WeakPolarHBondContact CD2-O 3.48Å; L6-M24 HydrophobicContact CD2-SD 3.93Å; L6-M24 HydrophobicContact CG-CE 3.84Å; L6-M24 HydrophobicContact CG-SD 3.59Å; L6-M24 VanDerWaalsContact CG-SD 3.59Å; L6-F27 HydrophobicContact CD1-CD2 3.66Å; L6-F27 HydrophobicContact CD1-CE2 4.17Å; L6-V94 HydrophobicContact CD1-CG1 3.97Å; L6-V94 HydrophobicContact CD1-CG2 4.06Å
7K88.4Confident87.2Confident101 Ų10163.9 Ų63.944%0.43932%0.318SS..Hα-helixtrans-58.7-49.5177.1-177.6177.7174.3179.10111F3 F9 T10 E11 M24F3-K7 PolarHBondContact O-N 2.84Å; F3-K7 VanDerWaalsContact O-N 3.15Å; K7-F9 VanDerWaalsContact C-N 3.32Å; K7-F9 PolarHBondContact O-N 3.11Å; K7-T10 PolarHBondContact O-N 3Å; K7-E11 WeakPolarHBondContact CE-OE1 3.33Å; K7-E11 IonicContact NZ-OE1 3.29Å; K7-E11 WeakPolarHBondContact O-CG 3.46Å; K7-E11 PolarHBondContact O-N 3.3Å; K7-M24 HydrophobicContact CB-CE 4.28Å
8N90.4Very high87.5Confident54 Ų5461.3 Ų61.329%0.28930%0.304SS..Hα-helixtrans-58.8-44.8177.7-71.6-10.9000111.7R4 L6 E11 M12R4-N8 WeakPolarHBondContact O-CB 3.38Å; R4-N8 PolarHBondContact O-N 3.43Å; R4-N8 PolarHBondContact O-ND2 3.25Å; R4-N8 PolarHBondContact O-OD1 3.06Å; L6-N8 PolarHBondContact O-N 3.33Å; N8-E11 PolarHBondContact O-N 2.89Å; N8-M12 WeakPolarHBondContact O-CB 3.38Å; N8-M12 VanDerWaalsContact O-CG 3.26Å; N8-M12 WeakPolarHBondContact O-CG 3.42Å; N8-M12 PolarHBondContact O-N 2.77Å
9F93.4Very high87.5Confident0 Ų063.7 Ų63.70%032%0.324CS..Hα-helixtrans-59.4-49.8178178.2-109.5000112.1D5 L6 K7 E11 M12 M13 I22 F27 I38 V94 M97 L98 T101D5-F9 VanDerWaalsContact O-CB 3.27Å; D5-F9 WeakPolarHBondContact O-CB 3.46Å; D5-F9 PolarHBondContact O-N 3.17Å; L6-F9 WeakPolarHBondContact O-CB 3.4Å; L6-F9 PolarHBondContact O-N 3.45Å; K7-F9 VanDerWaalsContact C-N 3.32Å; K7-F9 PolarHBondContact O-N 3.11Å; F9-E11 PolarHBondContact O-N 3.42Å; F9-M12 PolarHBondContact O-N 3.44Å; F9-M13 HydrophobicContact CD1-CG 4.32Å; F9-M13 HydrophobicContact CD2-CG 4.06Å; F9-M13 HydrophobicContact CE1-CG 4.04Å; F9-M13 HydrophobicContact CE2-CG 3.75Å; F9-M13 HydrophobicContact CE2-SD 4.03Å; F9-M13 HydrophobicContact CG-CG 4.35Å; F9-M13 HydrophobicContact CZ-CG 3.75Å; F9-M13 HydrophobicContact CZ-SD 4.15Å; F9-M13 WeakPolarHBondContact O-CB 3.47Å; F9-M13 VanDerWaalsContact O-CG 3.22Å; F9-M13 WeakPolarHBondContact O-CG 3.41Å; F9-M13 PolarHBondContact O-N 2.96Å; F9-I22 HydrophobicContact CE1-CD1 3.94Å; F9-F27 HydrophobicContact CE1-CE2 4.41Å; F9-I38 HydrophobicContact CE1-CD1 4.33Å; F9-I38 HydrophobicContact CZ-CD1 4.4Å; F9-I38 HydrophobicContact CZ-CG2 4.07Å; F9-V94 HydrophobicContact CB-CG1 3.72Å; F9-V94 HydrophobicContact CD1-CG1 3.62Å; F9-V94 HydrophobicContact CD2-CG1 4.26Å; F9-V94 HydrophobicContact CE1-CG1 4.24Å; F9-V94 HydrophobicContact CG-CG1 3.61Å; F9-M97 HydrophobicContact CE1-CE 4.18Å; F9-M97 HydrophobicContact CE2-CB 3.58Å; F9-M97 HydrophobicContact CZ-CB 3.81Å; F9-M97 HydrophobicContact CZ-CE 3.86Å; F9-M97 HydrophobicContact CZ-SD 4.22Å; F9-L98 HydrophobicContact CB-CD1 3.95Å; F9-L98 HydrophobicContact CD2-CB 4.1Å; F9-L98 HydrophobicContact CD2-CD1 4.05Å; F9-T101 HydrophobicContact CD2-CG2 4.4Å; F9-T101 WeakPolarHBondContact CE2-OG1 3.35Å
10T91.1Very high87.6Confident16 Ų1666 Ų6610%0.09833%0.329CS..Hα-helixtrans-61.6-42.4180-54.50000112.1L6 K7 R14 I22L6-T10 PolarHBondContact O-N 3.34Å; L6-T10 PolarHBondContact O-OG1 3.4Å; K7-T10 PolarHBondContact O-N 3Å; T10-R14 WeakPolarHBondContact O-CB 3.46Å; T10-R14 PolarHBondContact O-N 3.3Å; T10-I22 HydrophobicContact CG2-CB 4.28Å; T10-I22 WeakPolarHBondContact CG2-O 3.37Å
11E91.3Very high87.5Confident96 Ų9669.5 Ų69.545%0.44935%0.348SS..Hα-helixtrans-64.1-46176.8-73.7176.4-178.700111.8K7 N8 F9 R14 A15K7-E11 WeakPolarHBondContact CE-OE1 3.33Å; K7-E11 IonicContact NZ-OE1 3.29Å; K7-E11 WeakPolarHBondContact O-CG 3.46Å; K7-E11 PolarHBondContact O-N 3.3Å; N8-E11 PolarHBondContact O-N 2.89Å; F9-E11 PolarHBondContact O-N 3.42Å; E11-R14 PolarHBondContact O-N 2.92Å; E11-A15 PolarHBondContact O-N 3.45Å
12M93.1Very high88.8Confident35 Ų3566.2 Ų66.217%0.17233%0.332CS..Hα-helixtrans-67.2-39.9178.7-68.7179.5177.200112.4N8 F9 R14 A15 L16 L98 T101 Y105N8-M12 WeakPolarHBondContact O-CB 3.38Å; N8-M12 VanDerWaalsContact O-CG 3.26Å; N8-M12 WeakPolarHBondContact O-CG 3.42Å; N8-M12 PolarHBondContact O-N 2.77Å; F9-M12 PolarHBondContact O-N 3.44Å; M12-R14 VanDerWaalsContact C-N 3.33Å; M12-R14 PolarHBondContact O-N 3.49Å; M12-A15 PolarHBondContact O-N 3.41Å; M12-L16 WeakPolarHBondContact O-CB 3.44Å; M12-L16 VanDerWaalsContact O-CG 3.29Å; M12-L16 WeakPolarHBondContact O-CG 3.35Å; M12-L16 PolarHBondContact O-N 3.22Å; M12-L98 HydrophobicContact SD-CD1 3.94Å; M12-T101 HydrophobicContact CB-CG2 3.52Å; M12-T101 HydrophobicContact SD-CG2 4.47Å; M12-Y105 HydrophobicContact CB-CD2 4.09Å; M12-Y105 HydrophobicContact CB-CG 4.08Å; M12-Y105 HydrophobicContact CE-CD1 3.87Å; M12-Y105 HydrophobicContact CE-CE1 4.21Å; M12-Y105 HydrophobicContact CG-CD1 3.84Å; M12-Y105 HydrophobicContact CG-CD2 4.04Å; M12-Y105 HydrophobicContact CG-CE1 4.18Å; M12-Y105 HydrophobicContact CG-CE2 4.4Å; M12-Y105 HydrophobicContact CG-CG 3.74Å; M12-Y105 HydrophobicContact SD-CD1 4.09Å; M12-Y105 HydrophobicContact SD-CG 4.22Å
13M93.6Very high89.3Confident1 Ų166 Ų661%0.00533%0.331CS..Hα-helixtrans-62.4-41175.9-74-63.4-71.100111.5F9 L16 G17 Y18 I22 I38 W41 L42 T101F9-M13 HydrophobicContact CD1-CG 4.32Å; F9-M13 HydrophobicContact CD2-CG 4.06Å; F9-M13 HydrophobicContact CE1-CG 4.04Å; F9-M13 HydrophobicContact CE2-CG 3.75Å; F9-M13 HydrophobicContact CE2-SD 4.03Å; F9-M13 HydrophobicContact CG-CG 4.35Å; F9-M13 HydrophobicContact CZ-CG 3.75Å; F9-M13 HydrophobicContact CZ-SD 4.15Å; F9-M13 WeakPolarHBondContact O-CB 3.47Å; F9-M13 VanDerWaalsContact O-CG 3.22Å; F9-M13 WeakPolarHBondContact O-CG 3.41Å; F9-M13 PolarHBondContact O-N 2.96Å; M13-L16 PolarHBondContact O-N 3.26Å; M13-G17 PolarHBondContact O-N 3.46Å; M13-Y18 HydrophobicContact CE-CD1 3.96Å; M13-Y18 HydrophobicContact CE-CD2 3.71Å; M13-Y18 HydrophobicContact CE-CE2 4.35Å; M13-Y18 HydrophobicContact CE-CG 3.52Å; M13-Y18 VanDerWaalsContact O-CB 3.29Å; M13-Y18 WeakPolarHBondContact O-CB 3.29Å; M13-Y18 PolarHBondContact O-N 3.47Å; M13-I22 HydrophobicContact CB-CD1 3.96Å; M13-I22 HydrophobicContact CE-CD1 4.25Å; M13-I22 HydrophobicContact CG-CD1 3.99Å; M13-I38 HydrophobicContact CE-CG1 4.43Å; M13-I38 HydrophobicContact CE-CG2 3.65Å; M13-W41 HydrophobicContact CE-CE3 3.88Å; M13-W41 HydrophobicContact CE-CZ3 3.9Å; M13-W41 HydrophobicContact SD-CZ3 4.2Å; M13-L42 HydrophobicContact CE-CD2 4.4Å; M13-L42 HydrophobicContact CE-CG 4.41Å; M13-L42 HydrophobicContact SD-CD1 4.46Å; M13-L42 HydrophobicContact SD-CD2 3.88Å; M13-L42 HydrophobicContact SD-CG 4.38Å; M13-T101 HydrophobicContact CG-CG2 4.03Å; M13-T101 HydrophobicContact SD-CG2 3.76Å; M13-T101 PolarHBondContact SD-OG1 3.31Å
14R91.6Very high89.2Confident160 Ų16061.4 Ų61.460%0.60431%0.312SS*.Hα-helixtrans-62.6-46.2174-174.8-176.8-64154.41.6111.4T10 E11 M12 L16 G17T10-R14 WeakPolarHBondContact O-CB 3.46Å; T10-R14 PolarHBondContact O-N 3.3Å; E11-R14 PolarHBondContact O-N 2.92Å; M12-R14 VanDerWaalsContact C-N 3.33Å; M12-R14 PolarHBondContact O-N 3.49Å; R14-L16 VanDerWaalsContact C-N 3.31Å; R14-L16 PolarHBondContact O-N 2.85Å; R14-G17 PolarHBondContact O-N 2.99Å
15A90.3Very high89.1Confident43 Ų4360.2 Ų60.236%0.35531%0.314SS..Hα-helixtrans-64.4-35.3179.800000112.8E11 M12 G17 Y105 M108E11-A15 PolarHBondContact O-N 3.45Å; M12-A15 PolarHBondContact O-N 3.41Å; A15-G17 PolarHBondContact O-N 3.35Å; A15-Y105 HydrophobicContact CB-CD2 3.95Å; A15-Y105 HydrophobicContact CB-CE2 3.47Å; A15-Y105 VanDerWaalsContact CB-CE2 3.47Å; A15-M108 WeakPolarHBondContact O-CE 3.32Å
16L91.3Very high89.1Confident8 Ų860.4 Ų60.44%0.04232%0.315CS..THydrogen-bonded Turntrans-72.8-8.3174.3-69.8171.4000113.6M12 M13 R14 W41 T101 L104 Y105 M108M12-L16 WeakPolarHBondContact O-CB 3.44Å; M12-L16 VanDerWaalsContact O-CG 3.29Å; M12-L16 WeakPolarHBondContact O-CG 3.35Å; M12-L16 PolarHBondContact O-N 3.22Å; M13-L16 PolarHBondContact O-N 3.26Å; R14-L16 VanDerWaalsContact C-N 3.31Å; R14-L16 PolarHBondContact O-N 2.85Å; L16-W41 HydrophobicContact CB-CH2 3.73Å; L16-W41 HydrophobicContact CB-CZ3 4.33Å; L16-T101 HydrophobicContact CD1-CG2 3.74Å; L16-L104 HydrophobicContact CD1-CB 3.84Å; L16-L104 HydrophobicContact CD2-CB 3.97Å; L16-Y105 HydrophobicContact CG-CD2 4.49Å; L16-M108 HydrophobicContact CD2-CB 4.25Å; L16-M108 HydrophobicContact CD2-SD 3.98Å
17G91Very high89.2Confident51 Ų5160.3 Ų60.353%0.52631%0.314SS..THydrogen-bonded Turntrans87.428.5176.600000114.6M13 R14 A15M13-G17 PolarHBondContact O-N 3.46Å; R14-G17 PolarHBondContact O-N 2.99Å; A15-G17 PolarHBondContact O-N 3.35Å
18Y93.3Very high89.1Confident17 Ų1761 Ų617%0.06733%0.327CS..  trans-62.7126.6172.8-178.3-113.8000110.2M13 R20 I22 E37 I38 W41M13-Y18 HydrophobicContact CE-CD1 3.96Å; M13-Y18 HydrophobicContact CE-CD2 3.71Å; M13-Y18 HydrophobicContact CE-CE2 4.35Å; M13-Y18 HydrophobicContact CE-CG 3.52Å; M13-Y18 VanDerWaalsContact O-CB 3.29Å; M13-Y18 WeakPolarHBondContact O-CB 3.29Å; M13-Y18 PolarHBondContact O-N 3.47Å; Y18-R20 HydrophobicContact CD1-CB 4.41Å; Y18-R20 WeakPolarHBondContact CD1-O 3.42Å; Y18-R20 HydrophobicContact CE1-CB 3.68Å; Y18-R20 HydrophobicContact CE1-CG 4.49Å; Y18-R20 VanDerWaalsContact CE1-O 3.22Å; Y18-R20 WeakPolarHBondContact CE1-O 3.42Å; Y18-R20 PolarHBondContact O-N 2.93Å; Y18-I22 HydrophobicContact CD1-CD1 3.68Å; Y18-I22 HydrophobicContact CD1-CG1 3.86Å; Y18-I22 HydrophobicContact CE1-CD1 3.67Å; Y18-I22 HydrophobicContact CE1-CG1 3.61Å; Y18-E37 VanDerWaalsContact OH-CD 3.23Å; Y18-E37 PolarHBondContact OH-OE1 3.35Å; Y18-I38 HydrophobicContact CE1-CG1 4.06Å; Y18-I38 HydrophobicContact CE2-CG1 4.15Å; Y18-I38 WeakPolarHBondContact OH-CG1 3.25Å; Y18-W41 HydrophobicContact CD2-CB 4.16Å; Y18-W41 AromaticContact CD2-CD2 3.59Å; Y18-W41 HydrophobicContact CD2-CD2 3.59Å; Y18-W41 AromaticContact CD2-CE2 3.96Å; Y18-W41 AromaticContact CD2-CE3 3.9Å; Y18-W41 HydrophobicContact CD2-CE3 3.9Å; Y18-W41 AromaticContact CD2-CG 3.68Å; Y18-W41 HydrophobicContact CD2-CG 3.68Å; Y18-W41 HydrophobicContact CD2-CZ3 4.49Å; Y18-W41 HydrophobicContact CE2-CB 4.05Å; Y18-W41 HydrophobicContact CE2-CD2 4.37Å; Y18-W41 HydrophobicContact CE2-CG 4.02Å
19P87Confident89Confident107 Ų10763 Ų6370%0.69534%0.341SS*.SBendtrans-75.2-24.8-165.527.5-35.9000114.3
20R89.6Confident88.9Confident108 Ų10867.5 Ų67.541%0.40837%0.37SS..SBendtrans-96.2137.9-178.1-179.8177.9179174.51.9110.6Y18 I22 E37Y18-R20 HydrophobicContact CD1-CB 4.41Å; Y18-R20 WeakPolarHBondContact CD1-O 3.42Å; Y18-R20 HydrophobicContact CE1-CB 3.68Å; Y18-R20 HydrophobicContact CE1-CG 4.49Å; Y18-R20 VanDerWaalsContact CE1-O 3.22Å; Y18-R20 WeakPolarHBondContact CE1-O 3.42Å; Y18-R20 PolarHBondContact O-N 2.93Å; R20-I22 PolarHBondContact O-N 3.1Å; R20-E37 WeakPolarHBondContact CD-OE1 3.45Å; R20-E37 IonicContact CZ-OE2 3.64Å; R20-E37 IonicContact NH1-OE2 3.24Å; R20-E37 PolarHBondContact NH1-OE2 3.35Å
21L86Confident89Confident140 Ų14068.7 Ų68.773%0.73338%0.376SS*.PPolyproline II helixtrans-72124.4173.9-68.3170.6000109.9
22I89.3Confident89.1Confident12 Ų1265.5 Ų65.56%0.06236%0.36CS..PPolyproline II helixtrans-97.1117173.9-53.8171.9000107.2F9 T10 M13 Y18 R20 F27 I38F9-I22 HydrophobicContact CE1-CD1 3.94Å; T10-I22 HydrophobicContact CG2-CB 4.28Å; T10-I22 WeakPolarHBondContact CG2-O 3.37Å; M13-I22 HydrophobicContact CB-CD1 3.96Å; M13-I22 HydrophobicContact CE-CD1 4.25Å; M13-I22 HydrophobicContact CG-CD1 3.99Å; Y18-I22 HydrophobicContact CD1-CD1 3.68Å; Y18-I22 HydrophobicContact CD1-CG1 3.86Å; Y18-I22 HydrophobicContact CE1-CD1 3.67Å; Y18-I22 HydrophobicContact CE1-CG1 3.61Å; R20-I22 PolarHBondContact O-N 3.1Å; I22-F27 HydrophobicContact CG2-CD2 4.46Å; I22-F27 HydrophobicContact CG2-CE2 3.6Å; I22-F27 HydrophobicContact CG2-CZ 4.41Å; I22-I38 HydrophobicContact CD1-CD1 3.77Å; I22-I38 HydrophobicContact CD1-CG1 4.34Å; I22-I38 HydrophobicContact CG1-CD1 4.36Å
23S86.3Confident89.1Confident55 Ų5568.6 Ų68.639%0.38538%0.382SS..PPolyproline II helixtrans-89.4158.3174.3-176.90000111.1E25 N26S23-E25 PolarHBondContact O-N 3.46Å; S23-E25 PolarHBondContact OG-N 2.84Å; S23-N26 WeakPolarHBondContact CA-OD1 3.29Å; S23-N26 VanDerWaalsContact CB-OD1 3.24Å; S23-N26 WeakPolarHBondContact CB-OD1 3.38Å; S23-N26 PolarHBondContact N-OD1 3.3Å; S23-N26 PolarHBondContact O-N 2.85Å; S23-N26 PolarHBondContact O-OD1 2.98Å
24M77.1Confident89.1Confident59 Ų5968.6 Ų68.629%0.29138%0.381SS..G310 helixtrans-64.3-25.5174.3-58.7-65.2-75.100112.1F3 L6 K7F3-M24 HydrophobicContact CD2-CE 3.61Å; F3-M24 HydrophobicContact CE2-CE 3.45Å; F3-M24 VanDerWaalsContact CE2-CE 3.45Å; F3-M24 HydrophobicContact CG-CE 4.3Å; F3-M24 HydrophobicContact CZ-CE 4.03Å; L6-M24 HydrophobicContact CB-CE 3.73Å; L6-M24 HydrophobicContact CB-SD 4.06Å; L6-M24 HydrophobicContact CD2-CB 4.17Å; L6-M24 HydrophobicContact CD2-CE 3.93Å; L6-M24 VanDerWaalsContact CD2-O 3.29Å; L6-M24 WeakPolarHBondContact CD2-O 3.48Å; L6-M24 HydrophobicContact CD2-SD 3.93Å; L6-M24 HydrophobicContact CG-CE 3.84Å; L6-M24 HydrophobicContact CG-SD 3.59Å; L6-M24 VanDerWaalsContact CG-SD 3.59Å; K7-M24 HydrophobicContact CB-CE 4.28Å
25E84.3Confident89.2Confident152 Ų15261 Ų6171%0.7135%0.353SS*.G310 helixtrans-79-18.8-179.7-67.4176.3-176.600113.1S23 F27 V28S23-E25 PolarHBondContact O-N 3.46Å; S23-E25 PolarHBondContact OG-N 2.84Å; E25-F27 PolarHBondContact O-N 3.32Å; E25-F27 VanDerWaalsContact O-N 3.09Å; E25-V28 PolarHBondContact O-N 3.46Å
26N86.5Confident89.4Confident43 Ų4359.3 Ų59.323%0.2334%0.338CS..G310 helixtrans-67.7-14.5-172-71.1126.9000114.9S23 N31 L34S23-N26 WeakPolarHBondContact CA-OD1 3.29Å; S23-N26 VanDerWaalsContact CB-OD1 3.24Å; S23-N26 WeakPolarHBondContact CB-OD1 3.38Å; S23-N26 PolarHBondContact N-OD1 3.3Å; S23-N26 PolarHBondContact O-N 2.85Å; S23-N26 PolarHBondContact O-OD1 2.98Å; N26-N31 VanDerWaalsContact O-CB 3.3Å; N26-N31 WeakPolarHBondContact O-CB 3.45Å; N26-L34 HydrophobicContact CB-CD2 3.58Å
27F88.7Confident89.5Confident8 Ų862.1 Ų62.14%0.03535%0.351CS..G310 helixtrans-121.111.7179.1-59.6-77000113.1L6 F9 I22 E25 T29 L34 V35 I38 G91 V94 M97L6-F27 HydrophobicContact CD1-CD2 3.66Å; L6-F27 HydrophobicContact CD1-CE2 4.17Å; F9-F27 HydrophobicContact CE1-CE2 4.41Å; I22-F27 HydrophobicContact CG2-CD2 4.46Å; I22-F27 HydrophobicContact CG2-CE2 3.6Å; I22-F27 HydrophobicContact CG2-CZ 4.41Å; E25-F27 PolarHBondContact O-N 3.32Å; E25-F27 VanDerWaalsContact O-N 3.09Å; F27-T29 VanDerWaalsContact C-N 3.31Å; F27-L34 HydrophobicContact CE1-CD2 4.26Å; F27-L34 HydrophobicContact CE2-CD2 4.17Å; F27-L34 HydrophobicContact CZ-CD2 3.77Å; F27-L34 HydrophobicContact CZ-CG 4.22Å; F27-V35 HydrophobicContact CD1-CG2 4.5Å; F27-V35 HydrophobicContact CE1-CG2 3.76Å; F27-I38 HydrophobicContact CZ-CD1 3.95Å; F27-G91 PolarHBondContact O-N 2.86Å; F27-V94 HydrophobicContact CB-CG2 4.03Å; F27-V94 HydrophobicContact CD1-CG2 3.6Å; F27-V94 HydrophobicContact CD2-CG2 3.48Å; F27-V94 VanDerWaalsContact CD2-CG2 3.48Å; F27-V94 HydrophobicContact CE1-CG2 3.82Å; F27-V94 HydrophobicContact CE2-CG2 3.67Å; F27-V94 HydrophobicContact CG-CG2 3.41Å; F27-V94 VanDerWaalsContact CG-CG2 3.41Å; F27-V94 HydrophobicContact CZ-CG2 3.85Å; F27-M97 HydrophobicContact CE1-CE 3.93Å; F27-M97 HydrophobicContact CZ-CE 3.89Å
28V86.7Confident89.6Confident116 Ų11659.7 Ų59.770%0.70333%0.326SS*.THydrogen-bonded Turntrans-68.9-36.9169.5174.90000109.7E25E25-V28 PolarHBondContact O-N 3.46Å
29T87.5Confident89.7Confident95 Ų9558.9 Ų58.958%0.58332%0.323SS*.SBendtrans-113.7152.8168.852.80000110.2F27 N31F27-T29 VanDerWaalsContact C-N 3.31Å; T29-N31 PolarHBondContact O-N 3.17Å
30P91.7Very high90Very high96 Ų9655 Ų5562%0.62330%0.296SS*.  trans-55122.6176.8-30.138000112.9Q88 A89P30-Q88 WeakPolarHBondContact CB-O 3.42Å; P30-A89 WeakPolarHBondContact CA-O 3.44Å
31N93.1Very high90.3Very high40 Ų4052.4 Ų52.421%0.21429%0.286CS..  trans-129.977.6-179.3-168.9-20.8000111.4N26 T29 T33 L34 V35 A89N26-N31 VanDerWaalsContact O-CB 3.3Å; N26-N31 WeakPolarHBondContact O-CB 3.45Å; T29-N31 PolarHBondContact O-N 3.17Å; N31-T33 VanDerWaalsContact C-N 3.32Å; N31-T33 PolarHBondContact O-N 3.5Å; N31-L34 HydrophobicContact CB-CB 4.3Å; N31-L34 PolarHBondContact O-N 3.35Å; N31-L34 WeakPolarHBondContact OD1-CB 3.42Å; N31-L34 PolarHBondContact OD1-N 3.5Å; N31-L34 VanDerWaalsContact OD1-N 3.1Å; N31-V35 WeakPolarHBondContact O-CG2 3.4Å; N31-V35 PolarHBondContact O-N 3.35Å; N31-V35 VanDerWaalsContact O-N 3.14Å; N31-A89 PolarHBondContact N-O 3.07Å
32F94.2Very high90.6Very high29 Ų2945.8 Ų45.813%0.12725%0.251CS..Hα-helixtrans-65.2-34.3-174.8-168-90.3000113L34 V35 T36 V56 R62 F65 I66 Y87 A89F32-L34 PolarHBondContact O-N 2.91Å; F32-V35 PolarHBondContact O-N 3.36Å; F32-T36 WeakPolarHBondContact CD1-OG1 3.34Å; F32-T36 WeakPolarHBondContact CE1-OG1 3.35Å; F32-T36 WeakPolarHBondContact O-CB 3.48Å; F32-T36 PolarHBondContact O-N 2.87Å; F32-T36 PolarHBondContact O-OG1 3.26Å; F32-V56 HydrophobicContact CE1-CB 4.03Å; F32-V56 HydrophobicContact CE1-CG1 4.08Å; F32-R62 HydrophobicContact CD1-CG 3.95Å; F32-R62 HydrophobicContact CE1-CB 3.77Å; F32-R62 HydrophobicContact CE1-CG 3.42Å; F32-R62 VanDerWaalsContact CE1-CG 3.42Å; F32-R62 HydrophobicContact CE2-CB 4.35Å; F32-R62 HydrophobicContact CZ-CB 3.61Å; F32-R62 HydrophobicContact CZ-CG 3.83Å; F32-F65 HydrophobicContact CZ-CD1 4.14Å; F32-I66 HydrophobicContact CE2-CD1 4.03Å; F32-I66 HydrophobicContact CE2-CG1 3.99Å; F32-I66 HydrophobicContact CZ-CD1 4.13Å; F32-I66 HydrophobicContact CZ-CG1 4.02Å; F32-Y87 HydrophobicContact CD2-CD2 4.47Å; F32-Y87 AromaticContact CE2-CD2 3.8Å; F32-Y87 HydrophobicContact CE2-CD2 3.8Å; F32-Y87 HydrophobicContact CE2-CE2 4.27Å; F32-Y87 HydrophobicContact CZ-CD2 4.46Å; F32-A89 VanDerWaalsContact CA-CB 3.49Å; F32-A89 HydrophobicContact CB-CB 3.93Å; F32-A89 HydrophobicContact CD2-CB 4.02Å; F32-A89 HydrophobicContact CG-CB 4.46Å
33T92.4Very high90.8Very high101 Ų10145.2 Ų45.262%0.6225%0.249SC*.Hα-helixtrans-60.6-45.7177.1-49.30000111.2N31 T36 E37N31-T33 VanDerWaalsContact C-N 3.32Å; N31-T33 PolarHBondContact O-N 3.5Å; T33-T36 PolarHBondContact O-N 3.39Å; T33-E37 PolarHBondContact O-N 2.91Å
34L92.6Very high91.1Very high0 Ų048.8 Ų48.80%025%0.254CS..Hα-helixtrans-67.3-41.6177.7-178.761.6000111.9N26 F27 N31 F32 T36 E37 I38N26-L34 HydrophobicContact CB-CD2 3.58Å; F27-L34 HydrophobicContact CE1-CD2 4.26Å; F27-L34 HydrophobicContact CE2-CD2 4.17Å; F27-L34 HydrophobicContact CZ-CD2 3.77Å; F27-L34 HydrophobicContact CZ-CG 4.22Å; N31-L34 HydrophobicContact CB-CB 4.3Å; N31-L34 PolarHBondContact O-N 3.35Å; N31-L34 WeakPolarHBondContact OD1-CB 3.42Å; N31-L34 PolarHBondContact OD1-N 3.5Å; N31-L34 VanDerWaalsContact OD1-N 3.1Å; F32-L34 PolarHBondContact O-N 2.91Å; L34-T36 VanDerWaalsContact C-N 3.3Å; L34-T36 PolarHBondContact O-N 3.27Å; L34-E37 PolarHBondContact O-N 2.92Å; L34-I38 HydrophobicContact CD1-CD1 3.9Å; L34-I38 HydrophobicContact CD1-CG1 4.17Å; L34-I38 HydrophobicContact CD2-CD1 4.44Å; L34-I38 HydrophobicContact CG-CD1 3.74Å; L34-I38 HydrophobicContact CG-CG1 4.42Å; L34-I38 WeakPolarHBondContact O-CB 3.4Å; L34-I38 VanDerWaalsContact O-CG1 3.25Å; L34-I38 WeakPolarHBondContact O-CG1 3.33Å; L34-I38 PolarHBondContact O-N 2.91Å
35V94.3Very high91.6Very high0 Ų052.8 Ų52.80%027%0.266CS..Hα-helixtrans-60-42.8175.4171.50000111.2F27 N31 F32 I38 L39 A89 A93 M97F27-V35 HydrophobicContact CD1-CG2 4.5Å; F27-V35 HydrophobicContact CE1-CG2 3.76Å; N31-V35 WeakPolarHBondContact O-CG2 3.4Å; N31-V35 PolarHBondContact O-N 3.35Å; N31-V35 VanDerWaalsContact O-N 3.14Å; F32-V35 PolarHBondContact O-N 3.36Å; V35-I38 PolarHBondContact O-N 2.95Å; V35-L39 HydrophobicContact CG1-CD1 3.66Å; V35-L39 HydrophobicContact CG1-CG 4.16Å; V35-L39 VanDerWaalsContact O-CB 3.32Å; V35-L39 WeakPolarHBondContact O-CB 3.23Å; V35-L39 VanDerWaalsContact O-CG 3.23Å; V35-L39 WeakPolarHBondContact O-CG 3.43Å; V35-L39 PolarHBondContact O-N 2.83Å; V35-A89 HydrophobicContact CB-CB 4.37Å; V35-A89 HydrophobicContact CG2-CB 3.86Å; V35-A93 HydrophobicContact CG2-CB 3.99Å; V35-M97 HydrophobicContact CG1-SD 4.19Å; V35-M97 HydrophobicContact CG2-CE 4.07Å
36T94.1Very high91.8Very high8 Ų848.8 Ų48.85%0.04924%0.244CC..Hα-helixtrans-60.5-50.3177.3-590000111.2F32 T33 L34 I38 L39 I40 V56 F65F32-T36 WeakPolarHBondContact CD1-OG1 3.34Å; F32-T36 WeakPolarHBondContact CE1-OG1 3.35Å; F32-T36 WeakPolarHBondContact O-CB 3.48Å; F32-T36 PolarHBondContact O-N 2.87Å; F32-T36 PolarHBondContact O-OG1 3.26Å; T33-T36 PolarHBondContact O-N 3.39Å; L34-T36 VanDerWaalsContact C-N 3.3Å; L34-T36 PolarHBondContact O-N 3.27Å; T36-I38 VanDerWaalsContact C-N 3.34Å; T36-I38 PolarHBondContact O-N 3.43Å; T36-L39 PolarHBondContact O-N 2.82Å; T36-I40 HydrophobicContact CG2-CD1 3.82Å; T36-I40 VanDerWaalsContact O-CG1 3.28Å; T36-I40 WeakPolarHBondContact O-CG1 3.32Å; T36-I40 PolarHBondContact O-N 3.32Å; T36-V56 HydrophobicContact CG2-CG1 3.77Å; T36-V56 HydrophobicContact CG2-CG2 4.06Å; T36-F65 HydrophobicContact CG2-CD1 4.31Å; T36-F65 HydrophobicContact CG2-CE1 3.79Å; T36-F65 HydrophobicContact CG2-CE2 4Å; T36-F65 HydrophobicContact CG2-CZ 3.61Å
37E93.4Very high91.8Very high68 Ų6850.3 Ų50.332%0.31825%0.25SS..Hα-helixtrans-58-46.4178.7-168.3-165.7134.700111.6Y18 R20 T33 L34 W41Y18-E37 VanDerWaalsContact OH-CD 3.23Å; Y18-E37 PolarHBondContact OH-OE1 3.35Å; R20-E37 WeakPolarHBondContact CD-OE1 3.45Å; R20-E37 IonicContact CZ-OE2 3.64Å; R20-E37 IonicContact NH1-OE2 3.24Å; R20-E37 PolarHBondContact NH1-OE2 3.35Å; T33-E37 PolarHBondContact O-N 2.91Å; L34-E37 PolarHBondContact O-N 2.92Å; E37-W41 WeakPolarHBondContact O-CB 3.42Å; E37-W41 PolarHBondContact O-N 3.31Å
38I94.7Very high91.7Very high0 Ų054.6 Ų54.60%028%0.279CS..Hα-helixtrans-65-45.8179.3-69.7167.4000111.3F9 M13 Y18 I22 F27 L34 V35 T36 W41 L42 M97F9-I38 HydrophobicContact CE1-CD1 4.33Å; F9-I38 HydrophobicContact CZ-CD1 4.4Å; F9-I38 HydrophobicContact CZ-CG2 4.07Å; M13-I38 HydrophobicContact CE-CG1 4.43Å; M13-I38 HydrophobicContact CE-CG2 3.65Å; Y18-I38 HydrophobicContact CE1-CG1 4.06Å; Y18-I38 HydrophobicContact CE2-CG1 4.15Å; Y18-I38 WeakPolarHBondContact OH-CG1 3.25Å; I22-I38 HydrophobicContact CD1-CD1 3.77Å; I22-I38 HydrophobicContact CD1-CG1 4.34Å; I22-I38 HydrophobicContact CG1-CD1 4.36Å; F27-I38 HydrophobicContact CZ-CD1 3.95Å; L34-I38 HydrophobicContact CD1-CD1 3.9Å; L34-I38 HydrophobicContact CD1-CG1 4.17Å; L34-I38 HydrophobicContact CD2-CD1 4.44Å; L34-I38 HydrophobicContact CG-CD1 3.74Å; L34-I38 HydrophobicContact CG-CG1 4.42Å; L34-I38 WeakPolarHBondContact O-CB 3.4Å; L34-I38 VanDerWaalsContact O-CG1 3.25Å; L34-I38 WeakPolarHBondContact O-CG1 3.33Å; L34-I38 PolarHBondContact O-N 2.91Å; V35-I38 PolarHBondContact O-N 2.95Å; T36-I38 VanDerWaalsContact C-N 3.34Å; T36-I38 PolarHBondContact O-N 3.43Å; I38-W41 PolarHBondContact O-N 3.03Å; I38-L42 HydrophobicContact CG2-CD1 3.68Å; I38-L42 HydrophobicContact CG2-CG 4.17Å; I38-L42 WeakPolarHBondContact O-CB 3.4Å; I38-L42 WeakPolarHBondContact O-CG 3.33Å; I38-L42 PolarHBondContact O-N 2.94Å; I38-M97 HydrophobicContact CB-SD 3.94Å; I38-M97 HydrophobicContact CD1-CE 4.34Å; I38-M97 HydrophobicContact CD1-SD 4.43Å; I38-M97 HydrophobicContact CG2-SD 3.5Å; I38-M97 VanDerWaalsContact CG2-SD 3.5Å
39L94.8Very high91.5Very high0 Ų057.6 Ų57.60%029%0.285CS..Hα-helixtrans-64-42.9-179.3-75.3175.1000111.5V35 T36 W41 L42 V43 F65 I66 V69 L86 M97 I100V35-L39 HydrophobicContact CG1-CD1 3.66Å; V35-L39 HydrophobicContact CG1-CG 4.16Å; V35-L39 VanDerWaalsContact O-CB 3.32Å; V35-L39 WeakPolarHBondContact O-CB 3.23Å; V35-L39 VanDerWaalsContact O-CG 3.23Å; V35-L39 WeakPolarHBondContact O-CG 3.43Å; V35-L39 PolarHBondContact O-N 2.83Å; T36-L39 PolarHBondContact O-N 2.82Å; L39-W41 VanDerWaalsContact C-N 3.29Å; L39-W41 PolarHBondContact O-N 3.5Å; L39-L42 PolarHBondContact O-N 2.9Å; L39-V43 WeakPolarHBondContact O-CB 3.42Å; L39-V43 WeakPolarHBondContact O-CG2 3.47Å; L39-V43 PolarHBondContact O-N 3.2Å; L39-F65 HydrophobicContact CB-CE1 4.41Å; L39-F65 HydrophobicContact CB-CZ 4Å; L39-F65 HydrophobicContact CD1-CE1 4.01Å; L39-F65 HydrophobicContact CD1-CZ 4.42Å; L39-I66 HydrophobicContact CD1-CD1 4.1Å; L39-V69 HydrophobicContact CB-CG1 4.37Å; L39-V69 HydrophobicContact CD1-CG1 4.29Å; L39-V69 HydrophobicContact CD2-CG1 4.09Å; L39-V69 HydrophobicContact CG-CG1 4.49Å; L39-L86 HydrophobicContact CD1-CD2 4.27Å; L39-L86 HydrophobicContact CD2-CD2 4.33Å; L39-M97 HydrophobicContact CD2-CG 3.77Å; L39-M97 HydrophobicContact CD2-SD 4.25Å; L39-M97 HydrophobicContact CG-CG 4.33Å; L39-M97 HydrophobicContact CG-SD 4.2Å; L39-I100 HydrophobicContact CD2-CD1 4.1Å
40I93.3Very high91.4Very high24 Ų2454.2 Ų54.212%0.12326%0.264CS..Hα-helixtrans-58.1-46174.2-69.7167.7000110.1T36 V43 R44 T54 F65T36-I40 HydrophobicContact CG2-CD1 3.82Å; T36-I40 VanDerWaalsContact O-CG1 3.28Å; T36-I40 WeakPolarHBondContact O-CG1 3.32Å; T36-I40 PolarHBondContact O-N 3.32Å; I40-V43 PolarHBondContact O-N 2.96Å; I40-R44 WeakPolarHBondContact O-CB 3.49Å; I40-R44 WeakPolarHBondContact O-CG 3.31Å; I40-R44 PolarHBondContact O-N 3.44Å; I40-T54 HydrophobicContact CD1-CG2 4.37Å; I40-F65 HydrophobicContact CD1-CE2 4.08Å; I40-F65 HydrophobicContact CD1-CZ 4.44Å; I40-F65 HydrophobicContact CG1-CE2 3.68Å; I40-F65 HydrophobicContact CG1-CZ 3.95Å
41W94.9Very high91Very high55 Ų5557.3 Ų57.321%0.20828%0.275CS..Hα-helixtrans-63.2-46.1179.8-176.191.2000112.3M13 L16 Y18 E37 I38 L39 V43 R44 R45M13-W41 HydrophobicContact CE-CE3 3.88Å; M13-W41 HydrophobicContact CE-CZ3 3.9Å; M13-W41 HydrophobicContact SD-CZ3 4.2Å; L16-W41 HydrophobicContact CB-CH2 3.73Å; L16-W41 HydrophobicContact CB-CZ3 4.33Å; Y18-W41 HydrophobicContact CD2-CB 4.16Å; Y18-W41 AromaticContact CD2-CD2 3.59Å; Y18-W41 HydrophobicContact CD2-CD2 3.59Å; Y18-W41 AromaticContact CD2-CE2 3.96Å; Y18-W41 AromaticContact CD2-CE3 3.9Å; Y18-W41 HydrophobicContact CD2-CE3 3.9Å; Y18-W41 AromaticContact CD2-CG 3.68Å; Y18-W41 HydrophobicContact CD2-CG 3.68Å; Y18-W41 HydrophobicContact CD2-CZ3 4.49Å; Y18-W41 HydrophobicContact CE2-CB 4.05Å; Y18-W41 HydrophobicContact CE2-CD2 4.37Å; Y18-W41 HydrophobicContact CE2-CG 4.02Å; E37-W41 WeakPolarHBondContact O-CB 3.42Å; E37-W41 PolarHBondContact O-N 3.31Å; I38-W41 PolarHBondContact O-N 3.03Å; L39-W41 VanDerWaalsContact C-N 3.29Å; L39-W41 PolarHBondContact O-N 3.5Å; W41-V43 PolarHBondContact O-N 3.48Å; W41-R44 PolarHBondContact O-N 2.83Å; W41-R45 WeakPolarHBondContact O-CB 3.36Å; W41-R45 PolarHBondContact O-N 3.38Å
42L93.6Very high90.6Very high0 Ų055.9 Ų55.90%027%0.267CS..Hα-helixtrans-62.9-43.1178.9-76.3171.5000111.8M13 I38 L39 R45 Y46 M97 I100 L104M13-L42 HydrophobicContact CE-CD2 4.4Å; M13-L42 HydrophobicContact CE-CG 4.41Å; M13-L42 HydrophobicContact SD-CD1 4.46Å; M13-L42 HydrophobicContact SD-CD2 3.88Å; M13-L42 HydrophobicContact SD-CG 4.38Å; I38-L42 HydrophobicContact CG2-CD1 3.68Å; I38-L42 HydrophobicContact CG2-CG 4.17Å; I38-L42 WeakPolarHBondContact O-CB 3.4Å; I38-L42 WeakPolarHBondContact O-CG 3.33Å; I38-L42 PolarHBondContact O-N 2.94Å; L39-L42 PolarHBondContact O-N 2.9Å; L42-R45 WeakPolarHBondContact O-CB 3.49Å; L42-R45 PolarHBondContact O-N 2.99Å; L42-Y46 PolarHBondContact O-N 3.04Å; L42-M97 HydrophobicContact CD1-CB 4.37Å; L42-I100 HydrophobicContact CB-CG2 4.08Å; L42-I100 HydrophobicContact CD1-CB 4.28Å; L42-I100 HydrophobicContact CD1-CD1 4.48Å; L42-I100 HydrophobicContact CD1-CG2 4.3Å; L42-I100 HydrophobicContact CD2-CG2 4.31Å; L42-I100 HydrophobicContact CG-CG2 4.48Å; L42-L104 HydrophobicContact CD2-CD1 3.85Å
43V93Very high90.1Very high0 Ų056.2 Ų56.20%027%0.273CS..Hα-helixtrans-68.6-41.1-179.8177.70000111.1L39 I40 W41 R45 Y46 E47 V50 I52 V69 F72 M73L39-V43 WeakPolarHBondContact O-CB 3.42Å; L39-V43 WeakPolarHBondContact O-CG2 3.47Å; L39-V43 PolarHBondContact O-N 3.2Å; I40-V43 PolarHBondContact O-N 2.96Å; W41-V43 PolarHBondContact O-N 3.48Å; V43-R45 PolarHBondContact O-N 2.85Å; V43-Y46 WeakPolarHBondContact O-CB 3.49Å; V43-Y46 PolarHBondContact O-N 3.43Å; V43-E47 PolarHBondContact O-N 3.21Å; V43-V50 HydrophobicContact CG1-CB 4.41Å; V43-V50 HydrophobicContact CG1-CG1 3.67Å; V43-V50 HydrophobicContact CG1-CG2 4.11Å; V43-I52 HydrophobicContact CB-CD1 3.44Å; V43-I52 VanDerWaalsContact CB-CD1 3.44Å; V43-I52 HydrophobicContact CG1-CD1 3.25Å; V43-I52 HydrophobicContact CG1-CG1 4.2Å; V43-I52 HydrophobicContact CG2-CD1 4.02Å; V43-V69 HydrophobicContact CG2-CG1 4.04Å; V43-F72 HydrophobicContact CB-CD1 4.49Å; V43-F72 HydrophobicContact CG1-CD1 3.44Å; V43-F72 VanDerWaalsContact CG1-CD1 3.44Å; V43-F72 HydrophobicContact CG1-CD2 4.42Å; V43-F72 HydrophobicContact CG1-CE1 3.45Å; V43-F72 VanDerWaalsContact CG1-CE1 3.45Å; V43-F72 HydrophobicContact CG1-CE2 4.39Å; V43-F72 HydrophobicContact CG1-CG 3.98Å; V43-F72 HydrophobicContact CG1-CZ 3.94Å; V43-F72 HydrophobicContact CG2-CD1 4.31Å; V43-M73 HydrophobicContact CG2-CG 4.4Å; V43-M73 HydrophobicContact CG2-SD 4.02Å
44R91.3Very high89.6Confident130 Ų13056.1 Ų56.149%0.49127%0.272SS..Hα-helixtrans-64.3-24.8172.6-74-179.8176.8172.81.8113.3I40 W41 Y46 E47 P48 V50I40-R44 WeakPolarHBondContact O-CB 3.49Å; I40-R44 WeakPolarHBondContact O-CG 3.31Å; I40-R44 PolarHBondContact O-N 3.44Å; W41-R44 PolarHBondContact O-N 2.83Å; R44-Y46 VanDerWaalsContact C-N 3.35Å; R44-E47 CarbonylContact O-C 3.4Å; R44-P48 WeakPolarHBondContact O-CA 3.41Å; R44-V50 HydrophobicContact CG-CG1 4.19Å
45R89.2Confident89.2Confident144 Ų14460.2 Ų60.254%0.54329%0.294SS..Hα-helixtrans-73.2-28.7173.6-16560.8165.2177.4-4.6112.3W41 L42 V43 L104W41-R45 WeakPolarHBondContact O-CB 3.36Å; W41-R45 PolarHBondContact O-N 3.38Å; L42-R45 WeakPolarHBondContact O-CB 3.49Å; L42-R45 PolarHBondContact O-N 2.99Å; V43-R45 PolarHBondContact O-N 2.85Å; R45-L104 HydrophobicContact CB-CD1 4.17Å; R45-L104 HydrophobicContact CG-CD1 4.06Å; R45-L104 HydrophobicContact CG-CD2 4.42Å
46Y87Confident88.9Confident67 Ų6761.1 Ų61.126%0.26330%0.3SS..Hα-helixtrans-77.2-47.7171.1-93.4-89000112.1L42 V43 R44 M73 A77 I100 V103 L104L42-Y46 PolarHBondContact O-N 3.04Å; V43-Y46 WeakPolarHBondContact O-CB 3.49Å; V43-Y46 PolarHBondContact O-N 3.43Å; R44-Y46 VanDerWaalsContact C-N 3.35Å; Y46-M73 HydrophobicContact CD2-CE 4.19Å; Y46-M73 HydrophobicContact CE2-CE 3.98Å; Y46-A77 HydrophobicContact CD1-CB 4.11Å; Y46-A77 HydrophobicContact CE1-CB 3.8Å; Y46-I100 HydrophobicContact CD2-CG2 4.1Å; Y46-I100 HydrophobicContact CE2-CG2 3.51Å; Y46-V103 VanDerWaalsContact OH-CB 3.29Å; Y46-V103 WeakPolarHBondContact OH-CB 3.4Å; Y46-V103 WeakPolarHBondContact OH-CG1 3.38Å; Y46-L104 HydrophobicContact CD2-CD1 3.84Å; Y46-L104 HydrophobicContact CD2-CD2 3.77Å; Y46-L104 HydrophobicContact CD2-CG 3.98Å; Y46-L104 HydrophobicContact CE1-CD2 4.3Å; Y46-L104 HydrophobicContact CE2-CD1 3.55Å; Y46-L104 HydrophobicContact CE2-CD2 3.44Å; Y46-L104 VanDerWaalsContact CE2-CD2 3.44Å; Y46-L104 HydrophobicContact CE2-CG 3.33Å; Y46-L104 HydrophobicContact CG-CD2 4.32Å
47E87.7Confident88.7Confident75 Ų7567 Ų6735%0.3533%0.33SS..  trans-139.9107-178.3-167.3164.7179.500110.3V43 R44 H49 V50 F72V43-E47 PolarHBondContact O-N 3.21Å; R44-E47 CarbonylContact O-C 3.4Å; E47-H49 PolarHBondContact O-N 3.47Å; E47-H49 VanDerWaalsContact O-N 3.13Å; E47-V50 HydrophobicContact CB-CB 4.35Å; E47-V50 WeakPolarHBondContact O-CG1 3.32Å; E47-V50 PolarHBondContact O-N 3.05Å; E47-F72 HydrophobicContact CB-CE2 4.22Å; E47-F72 HydrophobicContact CB-CZ 3.76Å; E47-F72 WeakPolarHBondContact OE2-CE2 3.44Å
48P86.3Confident88.7Confident98 Ų9867 Ų6764%0.63634%0.335SS*.THydrogen-bonded Turntrans-61.8-24.2-172.4-27.735.7000115.6R44R44-P48 WeakPolarHBondContact O-CA 3.41Å
49H82.6Confident88.6Confident180 Ų18072.8 Ų72.883%0.83336%0.362SS*.THydrogen-bonded Turntrans-102.810.9-174.5-60.5-62.8000113.8E47 D51E47-H49 PolarHBondContact O-N 3.47Å; E47-H49 VanDerWaalsContact O-N 3.13Å; H49-D51 PolarHBondContact O-N 3.42Å
50V86.1Confident88.5Confident24 Ų2477 Ų7715%0.14539%0.392CS..  trans-69126.9178.165.60000111.2V43 R44 E47 I52 F72V43-V50 HydrophobicContact CG1-CB 4.41Å; V43-V50 HydrophobicContact CG1-CG1 3.67Å; V43-V50 HydrophobicContact CG1-CG2 4.11Å; R44-V50 HydrophobicContact CG-CG1 4.19Å; E47-V50 HydrophobicContact CB-CB 4.35Å; E47-V50 WeakPolarHBondContact O-CG1 3.32Å; E47-V50 PolarHBondContact O-N 3.05Å; V50-I52 HydrophobicContact CG1-CD1 4.16Å; V50-I52 HydrophobicContact CG1-CG1 4.18Å; V50-I52 HydrophobicContact CG2-CD1 4.45Å; V50-I52 HydrophobicContact CG2-CG1 3.88Å; V50-F72 HydrophobicContact CB-CE2 4.08Å; V50-F72 HydrophobicContact CG2-CD2 3.57Å; V50-F72 HydrophobicContact CG2-CE2 3.5Å; V50-F72 VanDerWaalsContact CG2-CE2 3.5Å; V50-F72 HydrophobicContact CG2-CG 4.37Å; V50-F72 HydrophobicContact CG2-CZ 4.28Å
51D82.4Confident88.5Confident160 Ų16078.4 Ų78.486%0.85640%0.399SS*.  trans-92.5106.9174.2-166.916.4000109.2H49H49-D51 PolarHBondContact O-N 3.42Å
52I84.9Confident88.5Confident10 Ų1079.8 Ų79.85%0.05141%0.405CS..  trans-114.6137.1178.2-51.8172.8000107.1V43 V50 T54 F65 V69V43-I52 HydrophobicContact CB-CD1 3.44Å; V43-I52 VanDerWaalsContact CB-CD1 3.44Å; V43-I52 HydrophobicContact CG1-CD1 3.25Å; V43-I52 HydrophobicContact CG1-CG1 4.2Å; V43-I52 HydrophobicContact CG2-CD1 4.02Å; V50-I52 HydrophobicContact CG1-CD1 4.16Å; V50-I52 HydrophobicContact CG1-CG1 4.18Å; V50-I52 HydrophobicContact CG2-CD1 4.45Å; V50-I52 HydrophobicContact CG2-CG1 3.88Å; I52-T54 PolarHBondContact O-N 3.45Å; I52-F65 HydrophobicContact CG2-CD2 3.78Å; I52-F65 HydrophobicContact CG2-CE2 3.63Å; I52-V69 HydrophobicContact CG2-CG2 4.01Å
53P84.1Confident88.5Confident37 Ų3782.9 Ų82.924%0.2442%0.421CS..  trans-51.3126.9173.2-25.334.5000110.9F64 F65 A68P53-F64 HydrophobicContact CB-CD1 4.06Å; P53-F64 HydrophobicContact CB-CE1 4.18Å; P53-F64 HydrophobicContact CG-CD1 3.54Å; P53-F64 HydrophobicContact CG-CE1 3.3Å; P53-F64 HydrophobicContact CG-CZ 4.39Å; P53-F65 WeakPolarHBondContact O-CD2 3.38Å; P53-A68 HydrophobicContact CG-CB 4.43Å
54T81.3Confident88.6Confident98 Ų9889 Ų8960%0.60145%0.447SS*.  trans-99.5-15.2177.750.30000113.1I40 I52I40-T54 HydrophobicContact CD1-CG2 4.37Å; I52-T54 PolarHBondContact O-N 3.45Å
55D84.6Confident88.8Confident86 Ų8682.8 Ų82.846%0.4642%0.424SS..  trans-81126.1176.1-163.3-14.3000109.7D57 D61D55-D57 PolarHBondContact OD1-N 3.46Å; D55-D57 VanDerWaalsContact OD1-N 3.15Å; D55-D61 WeakPolarHBondContact O-CB 3.36Å
56V88.6Confident89.2Confident20 Ų2076.1 Ų76.112%0.12140%0.399CS..  trans-139.521.1-177.9-68.80000111.3F32 T36 R62 F65F32-V56 HydrophobicContact CE1-CB 4.03Å; F32-V56 HydrophobicContact CE1-CG1 4.08Å; T36-V56 HydrophobicContact CG2-CG1 3.77Å; T36-V56 HydrophobicContact CG2-CG2 4.06Å; V56-R62 HydrophobicContact CB-CG 4Å; V56-R62 WeakPolarHBondContact O-CG 3.49Å; V56-R62 PolarHBondContact O-NE 2.9Å; V56-F65 HydrophobicContact CG1-CB 3.92Å; V56-F65 HydrophobicContact CG1-CD1 4.21Å; V56-F65 HydrophobicContact CG1-CD2 4.37Å; V56-F65 HydrophobicContact CG1-CG 3.9Å
57D89.1Confident89.5Confident130 Ų13079.3 Ų79.370%0.69541%0.414SS*.SBendtrans-72.2-39-174.5-72.9-19.7000111.3D55 R62D55-D57 PolarHBondContact OD1-N 3.46Å; D55-D57 VanDerWaalsContact OD1-N 3.15Å; D57-R62 PolarHBondContact O-NH2 2.95Å
58T93.1Very high89.8Confident68 Ų6877.2 Ų77.242%0.41741%0.41SS..SBendtrans-94154.9176.183.50000112.8S60 D61 R62T58-S60 PolarHBondContact O-N 3.25Å; T58-S60 PolarHBondContact OG1-N 3.41Å; T58-D61 WeakPolarHBondContact CB-OD2 3.45Å; T58-D61 WeakPolarHBondContact CG2-OD2 3.21Å; T58-D61 PolarHBondContact O-N 2.99Å; T58-D61 PolarHBondContact OG1-N 2.97Å; T58-D61 VanDerWaalsContact OG1-N 3.17Å; T58-D61 PolarHBondContact OG1-OD2 3.01Å; T58-R62 WeakPolarHBondContact O-CG 3.38Å; T58-R62 PolarHBondContact O-N 3.32Å
59E92.3Very high90.3Very high123 Ų12372.6 Ų72.658%0.57538%0.38SS*.Hα-helixtrans-56.6-38.4173.8173.3167.3-162.100112.5D61 R62 I63E59-D61 VanDerWaalsContact C-N 3.34Å; E59-D61 PolarHBondContact O-N 3Å; E59-R62 PolarHBondContact O-N 3.29Å; E59-I63 HydrophobicContact CG-CD1 3.95Å; E59-I63 WeakPolarHBondContact O-CG1 3.48Å; E59-I63 PolarHBondContact O-N 3.42Å
60S92.6Very high90.9Very high89 Ų8965 Ų6562%0.62235%0.346SS*.Hα-helixtrans-64.2-41.3178.6-670000111.5T58 I63 F64T58-S60 PolarHBondContact O-N 3.25Å; T58-S60 PolarHBondContact OG1-N 3.41Å; S60-I63 PolarHBondContact O-N 3.36Å; S60-F64 WeakPolarHBondContact O-CB 3.32Å; S60-F64 PolarHBondContact O-N 3.24Å
61D93.1Very high91.3Very high52 Ų5269.9 Ų69.928%0.27837%0.367SS..Hα-helixtrans-68.8-37.8178.7-59-38.8000111.6D55 T58 E59 I63 F64 F65D55-D61 WeakPolarHBondContact O-CB 3.36Å; T58-D61 WeakPolarHBondContact CB-OD2 3.45Å; T58-D61 WeakPolarHBondContact CG2-OD2 3.21Å; T58-D61 PolarHBondContact O-N 2.99Å; T58-D61 PolarHBondContact OG1-N 2.97Å; T58-D61 VanDerWaalsContact OG1-N 3.17Å; T58-D61 PolarHBondContact OG1-OD2 3.01Å; E59-D61 VanDerWaalsContact C-N 3.34Å; E59-D61 PolarHBondContact O-N 3Å; D61-I63 PolarHBondContact O-N 3.48Å; D61-F64 PolarHBondContact O-N 2.85Å; D61-F65 WeakPolarHBondContact O-CB 3.46Å; D61-F65 PolarHBondContact O-N 2.99Å
62R94.6Very high91.8Very high85 Ų8563.4 Ų63.432%0.32133%0.332SS..Hα-helixtrans-61.9-43.9173.6-65.1177.7-166.6155.68.9112.2F32 V56 D57 T58 E59 F64 F65 I66 Y87F32-R62 HydrophobicContact CD1-CG 3.95Å; F32-R62 HydrophobicContact CE1-CB 3.77Å; F32-R62 HydrophobicContact CE1-CG 3.42Å; F32-R62 VanDerWaalsContact CE1-CG 3.42Å; F32-R62 HydrophobicContact CE2-CB 4.35Å; F32-R62 HydrophobicContact CZ-CB 3.61Å; F32-R62 HydrophobicContact CZ-CG 3.83Å; V56-R62 HydrophobicContact CB-CG 4Å; V56-R62 WeakPolarHBondContact O-CG 3.49Å; V56-R62 PolarHBondContact O-NE 2.9Å; D57-R62 PolarHBondContact O-NH2 2.95Å; T58-R62 WeakPolarHBondContact O-CG 3.38Å; T58-R62 PolarHBondContact O-N 3.32Å; E59-R62 PolarHBondContact O-N 3.29Å; R62-F64 VanDerWaalsContact C-N 3.33Å; R62-F65 PolarHBondContact O-N 3.38Å; R62-I66 WeakPolarHBondContact O-CG1 3.35Å; R62-I66 PolarHBondContact O-N 3.01Å; R62-Y87 HydrophobicContact CB-CD2 4.42Å; R62-Y87 HydrophobicContact CB-CE2 3.69Å
63I94.4Very high92.3Very high65 Ų6563 Ų6333%0.33333%0.329SS..Hα-helixtrans-63.9-42.9177-68.3164.6000110.1E59 S60 D61 K67 Y87E59-I63 HydrophobicContact CG-CD1 3.95Å; E59-I63 WeakPolarHBondContact O-CG1 3.48Å; E59-I63 PolarHBondContact O-N 3.42Å; S60-I63 PolarHBondContact O-N 3.36Å; D61-I63 PolarHBondContact O-N 3.48Å; I63-K67 HydrophobicContact CG2-CD 4.19Å; I63-K67 WeakPolarHBondContact O-CG 3.4Å; I63-K67 PolarHBondContact O-N 3.29Å; I63-Y87 HydrophobicContact CG1-CE2 4.17Å
64F94.8Very high92.7Very high127 Ų12762.9 Ų62.956%0.55733%0.332SS*.Hα-helixtrans-62.5-45.9177.1-175.4-111.8000111.8P53 S60 D61 R62 I66 K67 A68P53-F64 HydrophobicContact CB-CD1 4.06Å; P53-F64 HydrophobicContact CB-CE1 4.18Å; P53-F64 HydrophobicContact CG-CD1 3.54Å; P53-F64 HydrophobicContact CG-CE1 3.3Å; P53-F64 HydrophobicContact CG-CZ 4.39Å; S60-F64 WeakPolarHBondContact O-CB 3.32Å; S60-F64 PolarHBondContact O-N 3.24Å; D61-F64 PolarHBondContact O-N 2.85Å; R62-F64 VanDerWaalsContact C-N 3.33Å; F64-I66 PolarHBondContact O-N 2.91Å; F64-K67 PolarHBondContact O-N 3.1Å; F64-A68 WeakPolarHBondContact O-CB 3.24Å; F64-A68 PolarHBondContact O-N 3.39Å
65F96.3Very high93.3Very high0 Ų061.7 Ų61.70%033%0.325CS..Hα-helixtrans-55.1-52.4174.9171.3-103.6000112.3F32 T36 L39 I40 I52 P53 V56 D61 R62 K67 A68 V69F32-F65 HydrophobicContact CZ-CD1 4.14Å; T36-F65 HydrophobicContact CG2-CD1 4.31Å; T36-F65 HydrophobicContact CG2-CE1 3.79Å; T36-F65 HydrophobicContact CG2-CE2 4Å; T36-F65 HydrophobicContact CG2-CZ 3.61Å; L39-F65 HydrophobicContact CB-CE1 4.41Å; L39-F65 HydrophobicContact CB-CZ 4Å; L39-F65 HydrophobicContact CD1-CE1 4.01Å; L39-F65 HydrophobicContact CD1-CZ 4.42Å; I40-F65 HydrophobicContact CD1-CE2 4.08Å; I40-F65 HydrophobicContact CD1-CZ 4.44Å; I40-F65 HydrophobicContact CG1-CE2 3.68Å; I40-F65 HydrophobicContact CG1-CZ 3.95Å; I52-F65 HydrophobicContact CG2-CD2 3.78Å; I52-F65 HydrophobicContact CG2-CE2 3.63Å; P53-F65 WeakPolarHBondContact O-CD2 3.38Å; V56-F65 HydrophobicContact CG1-CB 3.92Å; V56-F65 HydrophobicContact CG1-CD1 4.21Å; V56-F65 HydrophobicContact CG1-CD2 4.37Å; V56-F65 HydrophobicContact CG1-CG 3.9Å; D61-F65 WeakPolarHBondContact O-CB 3.46Å; D61-F65 PolarHBondContact O-N 2.99Å; R62-F65 PolarHBondContact O-N 3.38Å; F65-K67 VanDerWaalsContact C-N 3.33Å; F65-K67 PolarHBondContact O-N 3.24Å; F65-A68 PolarHBondContact O-N 2.84Å; F65-V69 HydrophobicContact CD2-CG2 4.25Å; F65-V69 HydrophobicContact CE1-CG2 4.22Å; F65-V69 HydrophobicContact CE2-CG2 3.79Å; F65-V69 HydrophobicContact CZ-CG2 3.76Å; F65-V69 WeakPolarHBondContact O-CG2 3.37Å; F65-V69 PolarHBondContact O-N 3.08Å
66I96.5Very high93.5Very high5 Ų563.9 Ų63.93%0.02633%0.33CS..Hα-helixtrans-61-43179.7-68.1-58.1000111F32 L39 R62 F64 A68 V69 V70 T83 L86 Y87F32-I66 HydrophobicContact CE2-CD1 4.03Å; F32-I66 HydrophobicContact CE2-CG1 3.99Å; F32-I66 HydrophobicContact CZ-CD1 4.13Å; F32-I66 HydrophobicContact CZ-CG1 4.02Å; L39-I66 HydrophobicContact CD1-CD1 4.1Å; R62-I66 WeakPolarHBondContact O-CG1 3.35Å; R62-I66 PolarHBondContact O-N 3.01Å; F64-I66 PolarHBondContact O-N 2.91Å; I66-A68 VanDerWaalsContact C-N 3.35Å; I66-A68 PolarHBondContact O-N 3.27Å; I66-V69 PolarHBondContact O-N 2.96Å; I66-V70 HydrophobicContact CG2-CG2 4.31Å; I66-V70 WeakPolarHBondContact O-CB 3.47Å; I66-V70 VanDerWaalsContact O-CG2 3.3Å; I66-V70 WeakPolarHBondContact O-CG2 3.38Å; I66-V70 PolarHBondContact O-N 3.46Å; I66-T83 HydrophobicContact CG2-CG2 4.03Å; I66-L86 HydrophobicContact CD1-CB 3.9Å; I66-L86 HydrophobicContact CG2-CB 4.37Å; I66-Y87 HydrophobicContact CG1-CD2 4.32Å
67K94.9Very high93.5Very high133 Ų13364 Ų6458%0.57833%0.333SS*.Hα-helixtrans-61.1-43.3176.3-75.2177.7179.7178.30111.7I63 F64 F65 V70 Q71I63-K67 HydrophobicContact CG2-CD 4.19Å; I63-K67 WeakPolarHBondContact O-CG 3.4Å; I63-K67 PolarHBondContact O-N 3.29Å; F64-K67 PolarHBondContact O-N 3.1Å; F65-K67 VanDerWaalsContact C-N 3.33Å; F65-K67 PolarHBondContact O-N 3.24Å; K67-V70 PolarHBondContact O-N 2.93Å; K67-Q71 WeakPolarHBondContact O-CB 3.22Å; K67-Q71 PolarHBondContact O-N 3.2Å
68A94.2Very high93.6Very high32 Ų3265.3 Ų65.326%0.26434%0.335SS..Hα-helixtrans-62-47.2178.700000111.8P53 F64 F65 I66 Q71 F72P53-A68 HydrophobicContact CG-CB 4.43Å; F64-A68 WeakPolarHBondContact O-CB 3.24Å; F64-A68 PolarHBondContact O-N 3.39Å; F65-A68 PolarHBondContact O-N 2.84Å; I66-A68 VanDerWaalsContact C-N 3.35Å; I66-A68 PolarHBondContact O-N 3.27Å; A68-Q71 PolarHBondContact O-N 2.9Å; A68-F72 WeakPolarHBondContact O-CB 3.1Å; A68-F72 PolarHBondContact O-N 3.08Å
69V95Very high93.7Very high0 Ų063 Ų630%032%0.32CS..Hα-helixtrans-62.6-46.9177.8171.80000111.5L39 V43 I52 F65 I66 F72 M73L39-V69 HydrophobicContact CB-CG1 4.37Å; L39-V69 HydrophobicContact CD1-CG1 4.29Å; L39-V69 HydrophobicContact CD2-CG1 4.09Å; L39-V69 HydrophobicContact CG-CG1 4.49Å; V43-V69 HydrophobicContact CG2-CG1 4.04Å; I52-V69 HydrophobicContact CG2-CG2 4.01Å; F65-V69 HydrophobicContact CD2-CG2 4.25Å; F65-V69 HydrophobicContact CE1-CG2 4.22Å; F65-V69 HydrophobicContact CE2-CG2 3.79Å; F65-V69 HydrophobicContact CZ-CG2 3.76Å; F65-V69 WeakPolarHBondContact O-CG2 3.37Å; F65-V69 PolarHBondContact O-N 3.08Å; I66-V69 PolarHBondContact O-N 2.96Å; V69-F72 PolarHBondContact O-N 2.87Å; V69-M73 HydrophobicContact CG1-CG 4.39Å; V69-M73 VanDerWaalsContact O-CG 3.32Å; V69-M73 WeakPolarHBondContact O-CG 3.48Å; V69-M73 PolarHBondContact O-N 2.73Å
70V95.9Very high93.8Very high22 Ų2265.9 Ų65.913%0.13333%0.33CS..Hα-helixtrans-65.5-41.5-179.5173.30000111.4I66 K67 M73 A74 L81 T83 L86I66-V70 HydrophobicContact CG2-CG2 4.31Å; I66-V70 WeakPolarHBondContact O-CB 3.47Å; I66-V70 VanDerWaalsContact O-CG2 3.3Å; I66-V70 WeakPolarHBondContact O-CG2 3.38Å; I66-V70 PolarHBondContact O-N 3.46Å; K67-V70 PolarHBondContact O-N 2.93Å; V70-M73 PolarHBondContact O-N 3.3Å; V70-A74 VanDerWaalsContact O-CB 3.28Å; V70-A74 WeakPolarHBondContact O-CB 3.33Å; V70-A74 PolarHBondContact O-N 2.81Å; V70-L81 HydrophobicContact CG1-CB 4.33Å; V70-L81 HydrophobicContact CG2-CB 3.93Å; V70-L81 HydrophobicContact CG2-CD1 4.46Å; V70-T83 HydrophobicContact CB-CG2 4.06Å; V70-T83 HydrophobicContact CG1-CG2 4.06Å; V70-T83 HydrophobicContact CG2-CG2 3.75Å; V70-L86 HydrophobicContact CG2-CD1 3.73Å
71Q94Very high94Very high125 Ų12562.5 Ų62.558%0.58431%0.305SS*.Hα-helixtrans-62-43.9175.8-176.465.611.100111.5K67 A68 T75K67-Q71 WeakPolarHBondContact O-CB 3.22Å; K67-Q71 PolarHBondContact O-N 3.2Å; A68-Q71 PolarHBondContact O-N 2.9Å; Q71-T75 WeakPolarHBondContact O-CB 3.16Å; Q71-T75 WeakPolarHBondContact O-CG2 3.22Å; Q71-T75 PolarHBondContact O-N 3.22Å; Q71-T75 VanDerWaalsContact O-N 3.08Å; Q71-T75 PolarHBondContact O-OG1 3.39Å
72F94.1Very high94.1Very high25 Ų2563 Ų6311%0.1131%0.308CS..Hα-helixtrans-59.9-52.5176176.2-87.1000111.2V43 E47 V50 A68 V69 A74 T75 K76V43-F72 HydrophobicContact CB-CD1 4.49Å; V43-F72 HydrophobicContact CG1-CD1 3.44Å; V43-F72 VanDerWaalsContact CG1-CD1 3.44Å; V43-F72 HydrophobicContact CG1-CD2 4.42Å; V43-F72 HydrophobicContact CG1-CE1 3.45Å; V43-F72 VanDerWaalsContact CG1-CE1 3.45Å; V43-F72 HydrophobicContact CG1-CE2 4.39Å; V43-F72 HydrophobicContact CG1-CG 3.98Å; V43-F72 HydrophobicContact CG1-CZ 3.94Å; V43-F72 HydrophobicContact CG2-CD1 4.31Å; E47-F72 HydrophobicContact CB-CE2 4.22Å; E47-F72 HydrophobicContact CB-CZ 3.76Å; E47-F72 WeakPolarHBondContact OE2-CE2 3.44Å; V50-F72 HydrophobicContact CB-CE2 4.08Å; V50-F72 HydrophobicContact CG2-CD2 3.57Å; V50-F72 HydrophobicContact CG2-CE2 3.5Å; V50-F72 VanDerWaalsContact CG2-CE2 3.5Å; V50-F72 HydrophobicContact CG2-CG 4.37Å; V50-F72 HydrophobicContact CG2-CZ 4.28Å; A68-F72 WeakPolarHBondContact O-CB 3.1Å; A68-F72 PolarHBondContact O-N 3.08Å; V69-F72 PolarHBondContact O-N 2.87Å; F72-A74 VanDerWaalsContact C-N 3.31Å; F72-A74 PolarHBondContact O-N 3.09Å; F72-T75 PolarHBondContact O-N 3.41Å; F72-T75 PolarHBondContact O-OG1 2.96Å; F72-K76 HydrophobicContact CD2-CG 3.94Å; F72-K76 HydrophobicContact CE1-CB 4.25Å; F72-K76 HydrophobicContact CE2-CB 4.17Å; F72-K76 HydrophobicContact CE2-CG 3.74Å; F72-K76 HydrophobicContact CZ-CB 4.02Å; F72-K76 HydrophobicContact CZ-CG 4.11Å; F72-K76 WeakPolarHBondContact O-CB 3.32Å; F72-K76 PolarHBondContact O-N 3.36Å
73M93.9Very high94.2Very high0 Ų062.1 Ų62.10%031%0.312CS..Hα-helixtrans-64.9-35.1-176.5-68.1-54.7-59.400112.6V43 Y46 V69 V70 A77 H78 I79 L81 I100V43-M73 HydrophobicContact CG2-CG 4.4Å; V43-M73 HydrophobicContact CG2-SD 4.02Å; Y46-M73 HydrophobicContact CD2-CE 4.19Å; Y46-M73 HydrophobicContact CE2-CE 3.98Å; V69-M73 HydrophobicContact CG1-CG 4.39Å; V69-M73 VanDerWaalsContact O-CG 3.32Å; V69-M73 WeakPolarHBondContact O-CG 3.48Å; V69-M73 PolarHBondContact O-N 2.73Å; V70-M73 PolarHBondContact O-N 3.3Å; M73-A77 HydrophobicContact CE-CB 3.53Å; M73-A77 CarbonylContact O-C 3.39Å; M73-A77 WeakPolarHBondContact O-CA 3.43Å; M73-A77 WeakPolarHBondContact O-CB 3.49Å; M73-A77 PolarHBondContact O-N 2.91Å; M73-A77 HydrophobicContact SD-CB 4.34Å; M73-H78 PolarHBondContact O-N 3.33Å; M73-I79 CarbonylContact C-O 3.47Å; M73-I79 HydrophobicContact CE-CB 4.31Å; M73-I79 HydrophobicContact CE-CD1 3.8Å; M73-I79 HydrophobicContact CE-CG1 4.4Å; M73-I79 PolarHBondContact O-N 3.5Å; M73-L81 HydrophobicContact CB-CD1 3.74Å; M73-L81 HydrophobicContact CB-CG 4.45Å; M73-L81 HydrophobicContact CG-CD1 3.8Å; M73-I100 HydrophobicContact CE-CB 4.22Å; M73-I100 HydrophobicContact CE-CD1 4.04Å; M73-I100 HydrophobicContact CE-CG1 3.87Å; M73-I100 HydrophobicContact CE-CG2 3.56Å; M73-I100 HydrophobicContact CG-CD1 4.14Å; M73-I100 HydrophobicContact SD-CD1 4.38Å; M73-I100 HydrophobicContact SD-CG2 4.47Å
74A94.3Very high94.3Very high36 Ų3665.7 Ų65.730%0.29833%0.325SS..Hα-helixtrans-69.9-38.4176.600000112.8V70 F72 H78 I79V70-A74 VanDerWaalsContact O-CB 3.28Å; V70-A74 WeakPolarHBondContact O-CB 3.33Å; V70-A74 PolarHBondContact O-N 2.81Å; F72-A74 VanDerWaalsContact C-N 3.31Å; F72-A74 PolarHBondContact O-N 3.09Å; A74-H78 WeakPolarHBondContact O-CA 3.43Å; A74-I79 WeakPolarHBondContact CA-O 3.38Å; A74-I79 PolarHBondContact N-O 3.13Å
75T92.3Very high94.3Very high73 Ų7362 Ų6245%0.44831%0.31SS..Hα-helixtrans-87.1-36.4-174.654.30000113.5Q71 F72Q71-T75 WeakPolarHBondContact O-CB 3.16Å; Q71-T75 WeakPolarHBondContact O-CG2 3.22Å; Q71-T75 PolarHBondContact O-N 3.22Å; Q71-T75 VanDerWaalsContact O-N 3.08Å; Q71-T75 PolarHBondContact O-OG1 3.39Å; F72-T75 PolarHBondContact O-N 3.41Å; F72-T75 PolarHBondContact O-OG1 2.96Å
76K89.8Confident94.2Very high131 Ų13162 Ų6257%0.5731%0.31SS*.Hα-helixtrans-99.3-39.7-174.3-62.1-65.6-170.6163.50113.5F72F72-K76 HydrophobicContact CD2-CG 3.94Å; F72-K76 HydrophobicContact CE1-CB 4.25Å; F72-K76 HydrophobicContact CE2-CB 4.17Å; F72-K76 HydrophobicContact CE2-CG 3.74Å; F72-K76 HydrophobicContact CZ-CB 4.02Å; F72-K76 HydrophobicContact CZ-CG 4.11Å; F72-K76 WeakPolarHBondContact O-CB 3.32Å; F72-K76 PolarHBondContact O-N 3.36Å
77A88.3Confident94.2Very high23 Ų2365.4 Ų65.419%0.1932%0.323CS..SBendtrans-102.5-6.6-178.700000113Y46 M73 I79Y46-A77 HydrophobicContact CD1-CB 4.11Å; Y46-A77 HydrophobicContact CE1-CB 3.8Å; M73-A77 HydrophobicContact CE-CB 3.53Å; M73-A77 CarbonylContact O-C 3.39Å; M73-A77 WeakPolarHBondContact O-CA 3.43Å; M73-A77 WeakPolarHBondContact O-CB 3.49Å; M73-A77 PolarHBondContact O-N 2.91Å; M73-A77 HydrophobicContact SD-CB 4.34Å; A77-I79 HydrophobicContact CB-CD1 4.15Å; A77-I79 HydrophobicContact CB-CG1 4.03Å; A77-I79 WeakPolarHBondContact O-CG1 3.28Å; A77-I79 PolarHBondContact O-N 3.07Å
78H91.9Very high94.1Very high157 Ų15762.3 Ų62.373%0.72731%0.311SS*.  trans5529-173.2-58.5-67.3000114M73 A74M73-H78 PolarHBondContact O-N 3.33Å; A74-H78 WeakPolarHBondContact O-CA 3.43Å
79I93.9Very high94.1Very high20 Ų2060.9 Ų60.910%0.10330%0.298CS..  trans-101.3116.4178.1-57.8-179.5000108.9M73 A74 A77 L81 K99 V103M73-I79 CarbonylContact C-O 3.47Å; M73-I79 HydrophobicContact CE-CB 4.31Å; M73-I79 HydrophobicContact CE-CD1 3.8Å; M73-I79 HydrophobicContact CE-CG1 4.4Å; M73-I79 PolarHBondContact O-N 3.5Å; A74-I79 WeakPolarHBondContact CA-O 3.38Å; A74-I79 PolarHBondContact N-O 3.13Å; A77-I79 HydrophobicContact CB-CD1 4.15Å; A77-I79 HydrophobicContact CB-CG1 4.03Å; A77-I79 WeakPolarHBondContact O-CG1 3.28Å; A77-I79 PolarHBondContact O-N 3.07Å; I79-L81 HydrophobicContact CG2-CD2 3.8Å; I79-L81 HydrophobicContact CG2-CG 4.2Å; I79-K99 HydrophobicContact CG2-CB 4.01Å; I79-V103 HydrophobicContact CD1-CB 4.42Å; I79-V103 HydrophobicContact CD1-CG2 4.03Å
80K95.6Very high93.9Very high183 Ų18362.6 Ų62.680%0.79631%0.308SS*.  trans-83.5121.4175-64.4-179.1-178.5178.90110.2
81L95.6Very high93.6Very high18 Ų1861.9 Ų61.99%0.09431%0.305CS..  trans-116147.7-179.3-60173.8000110.8V70 M73 I79 L86 E96 K99 I100V70-L81 HydrophobicContact CG1-CB 4.33Å; V70-L81 HydrophobicContact CG2-CB 3.93Å; V70-L81 HydrophobicContact CG2-CD1 4.46Å; M73-L81 HydrophobicContact CB-CD1 3.74Å; M73-L81 HydrophobicContact CB-CG 4.45Å; M73-L81 HydrophobicContact CG-CD1 3.8Å; I79-L81 HydrophobicContact CG2-CD2 3.8Å; I79-L81 HydrophobicContact CG2-CG 4.2Å; L81-L86 HydrophobicContact CB-CD1 4.07Å; L81-L86 HydrophobicContact CD1-CD1 4.2Å; L81-E96 WeakPolarHBondContact CA-OE2 3.39Å; L81-E96 HydrophobicContact CD2-CB 4.32Å; L81-E96 WeakPolarHBondContact CD2-O 3.1Å; L81-K99 HydrophobicContact CD2-CB 4.41Å; L81-K99 HydrophobicContact CD2-CD 4.14Å; L81-I100 HydrophobicContact CD1-CD1 3.74Å; L81-I100 HydrophobicContact CD1-CG1 4.28Å; L81-I100 HydrophobicContact CD2-CD1 4.35Å; L81-I100 HydrophobicContact CD2-CG1 4.11Å
82N96.4Very high93.5Very high62 Ų6261 Ų6133%0.33230%0.297SS..  trans-89.1115174.9-172.5-46.9000110.7K84 H85 L86 E96N82-K84 PolarHBondContact O-N 3.34Å; N82-K84 WeakPolarHBondContact OD1-CA 3.26Å; N82-K84 WeakPolarHBondContact OD1-CB 3.35Å; N82-K84 PolarHBondContact OD1-N 3.45Å; N82-H85 HydrophobicContact CB-CB 4.14Å; N82-H85 PolarHBondContact O-N 2.87Å; N82-H85 PolarHBondContact OD1-N 2.89Å; N82-H85 VanDerWaalsContact OD1-N 3.16Å; N82-L86 WeakPolarHBondContact O-CG 3.48Å; N82-L86 PolarHBondContact O-N 3.23Å; N82-L86 VanDerWaalsContact O-N 3.14Å; N82-E96 HydrophobicContact CB-CG 4.25Å; N82-E96 PolarHBondContact N-OE2 3.39Å
83T96Very high93.5Very high68 Ų6859.9 Ų59.942%0.41729%0.292SS..Hα-helixtrans-62.5-38-179.149.90000113I66 V70 Y87I66-T83 HydrophobicContact CG2-CG2 4.03Å; V70-T83 HydrophobicContact CB-CG2 4.06Å; V70-T83 HydrophobicContact CG1-CG2 4.06Å; V70-T83 HydrophobicContact CG2-CG2 3.75Å; T83-Y87 WeakPolarHBondContact O-CB 3.36Å; T83-Y87 PolarHBondContact O-N 3.28Å
84K95.7Very high93.5Very high139 Ų13959.9 Ų59.960%0.60429%0.292SS*.Hα-helixtrans-65.4-46179.2-175.6-179.6179.11790111N82 Y87 Q88N82-K84 PolarHBondContact O-N 3.34Å; N82-K84 WeakPolarHBondContact OD1-CA 3.26Å; N82-K84 WeakPolarHBondContact OD1-CB 3.35Å; N82-K84 PolarHBondContact OD1-N 3.45Å; K84-Y87 PolarHBondContact O-N 2.91Å; K84-Q88 VanDerWaalsContact O-CG 3.3Å; K84-Q88 WeakPolarHBondContact O-CG 3.4Å; K84-Q88 PolarHBondContact O-N 3.02Å
85H95.2Very high93.4Very high51 Ų5162 Ų6224%0.23629%0.294CS..Hα-helixtrans-66.6-37.8179.6-66.9160.3000112.4N82 Q88 A93 E96N82-H85 HydrophobicContact CB-CB 4.14Å; N82-H85 PolarHBondContact O-N 2.87Å; N82-H85 PolarHBondContact OD1-N 2.89Å; N82-H85 VanDerWaalsContact OD1-N 3.16Å; H85-Q88 PolarHBondContact CD2-OE1 3.15Å; H85-A93 VanDerWaalsContact O-CA 3.31Å; H85-A93 WeakPolarHBondContact O-CA 3.25Å; H85-A93 VanDerWaalsContact O-CB 3.31Å; H85-A93 WeakPolarHBondContact O-CB 3.44Å; H85-A93 PolarHBondContact O-N 2.69Å; H85-E96 HydrophobicContact CB-CG 3.76Å; H85-E96 IonicContact ND1-OE1 2.9Å
86L95.2Very high93.6Very high0 Ų059.1 Ų59.10%028%0.276CS..Hα-helixtrans-66.1-39.6174.2-69.9174.8000111.9L39 I66 V70 L81 N82 A89 E96 M97L39-L86 HydrophobicContact CD1-CD2 4.27Å; L39-L86 HydrophobicContact CD2-CD2 4.33Å; I66-L86 HydrophobicContact CD1-CB 3.9Å; I66-L86 HydrophobicContact CG2-CB 4.37Å; V70-L86 HydrophobicContact CG2-CD1 3.73Å; L81-L86 HydrophobicContact CB-CD1 4.07Å; L81-L86 HydrophobicContact CD1-CD1 4.2Å; N82-L86 WeakPolarHBondContact O-CG 3.48Å; N82-L86 PolarHBondContact O-N 3.23Å; N82-L86 VanDerWaalsContact O-N 3.14Å; L86-A89 PolarHBondContact O-N 3.42Å; L86-E96 HydrophobicContact CD2-CB 3.54Å; L86-E96 HydrophobicContact CD2-CG 4.42Å; L86-E96 HydrophobicContact CG-CB 3.93Å; L86-E96 HydrophobicContact CG-CG 4.38Å; L86-M97 HydrophobicContact CD2-CG 4.08Å
87Y96.1Very high93.8Very high76 Ų7652.9 Ų52.930%0.29825%0.249SC..Hα-helixtrans-69.8-34.5178.8-170.7-99.8000113.4F32 R62 I63 I66 T83 K84 A89F32-Y87 HydrophobicContact CD2-CD2 4.47Å; F32-Y87 AromaticContact CE2-CD2 3.8Å; F32-Y87 HydrophobicContact CE2-CD2 3.8Å; F32-Y87 HydrophobicContact CE2-CE2 4.27Å; F32-Y87 HydrophobicContact CZ-CD2 4.46Å; R62-Y87 HydrophobicContact CB-CD2 4.42Å; R62-Y87 HydrophobicContact CB-CE2 3.69Å; I63-Y87 HydrophobicContact CG1-CE2 4.17Å; I66-Y87 HydrophobicContact CG1-CD2 4.32Å; T83-Y87 WeakPolarHBondContact O-CB 3.36Å; T83-Y87 PolarHBondContact O-N 3.28Å; K84-Y87 PolarHBondContact O-N 2.91Å; Y87-A89 PolarHBondContact O-N 2.79Å
88Q93.7Very high94.1Very high68 Ų6852.9 Ų52.932%0.31825%0.245SC..Hα-helixtrans-59.2-24.7173.3-78.4173.5-26.400112.9P30 K84 H85 D90P30-Q88 WeakPolarHBondContact CB-O 3.42Å; K84-Q88 VanDerWaalsContact O-CG 3.3Å; K84-Q88 WeakPolarHBondContact O-CG 3.4Å; K84-Q88 PolarHBondContact O-N 3.02Å; H85-Q88 PolarHBondContact CD2-OE1 3.15Å; Q88-D90 PolarHBondContact O-N 2.73Å
89A93Very high94.3Very high1 Ų149.5 Ų49.51%0.00823%0.228CC..  trans53.125.8172.800000116.1P30 N31 F32 V35 L86 Y87P30-A89 WeakPolarHBondContact CA-O 3.44Å; N31-A89 PolarHBondContact N-O 3.07Å; F32-A89 VanDerWaalsContact CA-CB 3.49Å; F32-A89 HydrophobicContact CB-CB 3.93Å; F32-A89 HydrophobicContact CD2-CB 4.02Å; F32-A89 HydrophobicContact CG-CB 4.46Å; V35-A89 HydrophobicContact CB-CB 4.37Å; V35-A89 HydrophobicContact CG2-CB 3.86Å; L86-A89 PolarHBondContact O-N 3.42Å; Y87-A89 PolarHBondContact O-N 2.79Å
90D90.6Very high94.3Very high37 Ų3748.5 Ų48.520%0.19822%0.224CC..SBendtrans-109.5-159.2178.565.56.6000110.1Q88 Y92 A93 V94Q88-D90 PolarHBondContact O-N 2.73Å; D90-Y92 PolarHBondContact O-N 2.9Å; D90-Y92 WeakPolarHBondContact OD1-CB 3.37Å; D90-Y92 WeakPolarHBondContact OD1-CD2 3.45Å; D90-Y92 PolarHBondContact OD1-N 3.09Å; D90-A93 WeakPolarHBondContact O-CB 3.49Å; D90-A93 PolarHBondContact O-N 2.81Å; D90-V94 PolarHBondContact O-N 3.16Å
91G89.8Confident94.2Very high7 Ų739.8 Ų39.87%0.07219%0.186CC..Hα-helixtrans-58.4-17.217700000115.7M1 F27M1-G91 WeakPolarHBondContact CG-O 3.32Å; M1-G91 WeakPolarHBondContact SD-CA 3.23Å; F27-G91 PolarHBondContact O-N 2.86Å
92Y92.4Very high94.1Very high107 Ų10740.5 Ų40.542%0.4219%0.192SC..Hα-helixtrans-76.8-34172-66.9-87.6000111.9D90 V94 K95 E96D90-Y92 PolarHBondContact O-N 2.9Å; D90-Y92 WeakPolarHBondContact OD1-CB 3.37Å; D90-Y92 WeakPolarHBondContact OD1-CD2 3.45Å; D90-Y92 PolarHBondContact OD1-N 3.09Å; Y92-V94 PolarHBondContact O-N 2.96Å; Y92-K95 WeakPolarHBondContact O-CB 3.3Å; Y92-K95 PolarHBondContact O-N 3.34Å; Y92-E96 PolarHBondContact O-N 3.12Å
93A94.3Very high93.9Very high0 Ų041 Ų410%020%0.197CC..Hα-helixtrans-60.7-38.1173.500000111.2V35 H85 D90 K95 E96 M97V35-A93 HydrophobicContact CG2-CB 3.99Å; H85-A93 VanDerWaalsContact O-CA 3.31Å; H85-A93 WeakPolarHBondContact O-CA 3.25Å; H85-A93 VanDerWaalsContact O-CB 3.31Å; H85-A93 WeakPolarHBondContact O-CB 3.44Å; H85-A93 PolarHBondContact O-N 2.69Å; D90-A93 WeakPolarHBondContact O-CB 3.49Å; D90-A93 PolarHBondContact O-N 2.81Å; A93-K95 VanDerWaalsContact C-N 3.32Å; A93-K95 PolarHBondContact O-N 2.86Å; A93-E96 PolarHBondContact O-N 3.33Å; A93-E96 VanDerWaalsContact O-N 3.12Å; A93-M97 WeakPolarHBondContact O-CG 3.29Å; A93-M97 PolarHBondContact O-N 2.69Å
94V93.5Very high93.7Very high0 Ų039 Ų390%018%0.184CC..Hα-helixtrans-61.9-39177.5178.90000112M1 L6 F9 F27 D90 Y92 E96 M97 L98M1-V94 HydrophobicContact CE-CB 3.48Å; M1-V94 VanDerWaalsContact CE-CB 3.48Å; M1-V94 HydrophobicContact CE-CG1 3.34Å; M1-V94 HydrophobicContact CE-CG2 4Å; L6-V94 HydrophobicContact CD1-CG1 3.97Å; L6-V94 HydrophobicContact CD1-CG2 4.06Å; F9-V94 HydrophobicContact CB-CG1 3.72Å; F9-V94 HydrophobicContact CD1-CG1 3.62Å; F9-V94 HydrophobicContact CD2-CG1 4.26Å; F9-V94 HydrophobicContact CE1-CG1 4.24Å; F9-V94 HydrophobicContact CG-CG1 3.61Å; F27-V94 HydrophobicContact CB-CG2 4.03Å; F27-V94 HydrophobicContact CD1-CG2 3.6Å; F27-V94 HydrophobicContact CD2-CG2 3.48Å; F27-V94 VanDerWaalsContact CD2-CG2 3.48Å; F27-V94 HydrophobicContact CE1-CG2 3.82Å; F27-V94 HydrophobicContact CE2-CG2 3.67Å; F27-V94 HydrophobicContact CG-CG2 3.41Å; F27-V94 VanDerWaalsContact CG-CG2 3.41Å; F27-V94 HydrophobicContact CZ-CG2 3.85Å; D90-V94 PolarHBondContact O-N 3.16Å; Y92-V94 PolarHBondContact O-N 2.96Å; V94-E96 VanDerWaalsContact C-N 3.26Å; V94-E96 PolarHBondContact O-N 2.95Å; V94-M97 HydrophobicContact CG2-CE 4.16Å; V94-M97 PolarHBondContact O-N 3.32Å; V94-L98 WeakPolarHBondContact O-CB 3.45Å; V94-L98 PolarHBondContact O-N 3.04Å
95K92.9Very high93.5Very high80 Ų8035.6 Ų35.635%0.34817%0.168SC..Hα-helixtrans-61.7-37.3175.6-71.4-174.8170.2-171.40112.1D5 Y92 A93D5-K95 WeakPolarHBondContact OD2-CE 3.38Å; Y92-K95 WeakPolarHBondContact O-CB 3.3Å; Y92-K95 PolarHBondContact O-N 3.34Å; A93-K95 VanDerWaalsContact C-N 3.32Å; A93-K95 PolarHBondContact O-N 2.86Å
96E95.3Very high93.3Very high14 Ų1437.4 Ų37.47%0.06518%0.179CC..Hα-helixtrans-72.8-45177.7-62.1-57.7132.400111.3L81 N82 H85 L86 Y92 A93 V94 L98 K99L81-E96 WeakPolarHBondContact CA-OE2 3.39Å; L81-E96 HydrophobicContact CD2-CB 4.32Å; L81-E96 WeakPolarHBondContact CD2-O 3.1Å; N82-E96 HydrophobicContact CB-CG 4.25Å; N82-E96 PolarHBondContact N-OE2 3.39Å; H85-E96 HydrophobicContact CB-CG 3.76Å; H85-E96 IonicContact ND1-OE1 2.9Å; L86-E96 HydrophobicContact CD2-CB 3.54Å; L86-E96 HydrophobicContact CD2-CG 4.42Å; L86-E96 HydrophobicContact CG-CB 3.93Å; L86-E96 HydrophobicContact CG-CG 4.38Å; Y92-E96 PolarHBondContact O-N 3.12Å; A93-E96 PolarHBondContact O-N 3.33Å; A93-E96 VanDerWaalsContact O-N 3.12Å; V94-E96 VanDerWaalsContact C-N 3.26Å; V94-E96 PolarHBondContact O-N 2.95Å; E96-L98 VanDerWaalsContact C-N 3.3Å; E96-L98 PolarHBondContact O-N 3.39Å; E96-K99 WeakPolarHBondContact O-CB 3.05Å; E96-K99 PolarHBondContact O-N 3.25Å; E96-K99 IonicContact OE1-NZ 3.09Å; E96-K99 PolarHBondContact OE1-NZ 3.45Å; E96-K99 IonicContact OE2-NZ 2.79Å; E96-K99 PolarHBondContact OE2-NZ 2.75Å
97M95Very high92.9Very high0 Ų040.3 Ų40.30%020%0.203CC..Hα-helixtrans-62.5-36.3175-66.4-172.4-67.400112.1F9 F27 V35 I38 L39 L42 L86 A93 V94 K99 I100 T101F9-M97 HydrophobicContact CE1-CE 4.18Å; F9-M97 HydrophobicContact CE2-CB 3.58Å; F9-M97 HydrophobicContact CZ-CB 3.81Å; F9-M97 HydrophobicContact CZ-CE 3.86Å; F9-M97 HydrophobicContact CZ-SD 4.22Å; F27-M97 HydrophobicContact CE1-CE 3.93Å; F27-M97 HydrophobicContact CZ-CE 3.89Å; V35-M97 HydrophobicContact CG1-SD 4.19Å; V35-M97 HydrophobicContact CG2-CE 4.07Å; I38-M97 HydrophobicContact CB-SD 3.94Å; I38-M97 HydrophobicContact CD1-CE 4.34Å; I38-M97 HydrophobicContact CD1-SD 4.43Å; I38-M97 HydrophobicContact CG2-SD 3.5Å; I38-M97 VanDerWaalsContact CG2-SD 3.5Å; L39-M97 HydrophobicContact CD2-CG 3.77Å; L39-M97 HydrophobicContact CD2-SD 4.25Å; L39-M97 HydrophobicContact CG-CG 4.33Å; L39-M97 HydrophobicContact CG-SD 4.2Å; L42-M97 HydrophobicContact CD1-CB 4.37Å; L86-M97 HydrophobicContact CD2-CG 4.08Å; A93-M97 WeakPolarHBondContact O-CG 3.29Å; A93-M97 PolarHBondContact O-N 2.69Å; V94-M97 HydrophobicContact CG2-CE 4.16Å; V94-M97 PolarHBondContact O-N 3.32Å; M97-K99 PolarHBondContact O-N 2.83Å; M97-I100 WeakPolarHBondContact O-CB 3.29Å; M97-I100 PolarHBondContact O-N 2.79Å; M97-T101 PolarHBondContact O-N 3.39Å; M97-T101 PolarHBondContact O-OG1 3.1Å; M97-T101 VanDerWaalsContact O-OG1 3.1Å
98L94.4Very high92.5Very high22 Ų2240.2 Ų40.212%0.11521%0.206CC..Hα-helixtrans-61-29.2178.3-175.962.2000112.9D5 F9 M12 V94 E96 I100 T101 S102D5-L98 HydrophobicContact CB-CD2 4.33Å; F9-L98 HydrophobicContact CB-CD1 3.95Å; F9-L98 HydrophobicContact CD2-CB 4.1Å; F9-L98 HydrophobicContact CD2-CD1 4.05Å; M12-L98 HydrophobicContact SD-CD1 3.94Å; V94-L98 WeakPolarHBondContact O-CB 3.45Å; V94-L98 PolarHBondContact O-N 3.04Å; E96-L98 VanDerWaalsContact C-N 3.3Å; E96-L98 PolarHBondContact O-N 3.39Å; L98-I100 VanDerWaalsContact C-N 3.29Å; L98-I100 PolarHBondContact O-N 3.49Å; L98-T101 PolarHBondContact O-N 3.45Å; L98-S102 VanDerWaalsContact O-CB 3.24Å; L98-S102 WeakPolarHBondContact O-CB 3.44Å; L98-S102 PolarHBondContact O-N 3.29Å; L98-S102 PolarHBondContact O-OG 3.45Å
99K94.8Very high92.1Very high86 Ų8641.7 Ų41.737%0.37421%0.212SC..Hα-helixtrans-60.4-42.5173.1-63171.3-174.5171.40111I79 L81 E96 M97 V103I79-K99 HydrophobicContact CG2-CB 4.01Å; L81-K99 HydrophobicContact CD2-CB 4.41Å; L81-K99 HydrophobicContact CD2-CD 4.14Å; E96-K99 WeakPolarHBondContact O-CB 3.05Å; E96-K99 PolarHBondContact O-N 3.25Å; E96-K99 IonicContact OE1-NZ 3.09Å; E96-K99 PolarHBondContact OE1-NZ 3.45Å; E96-K99 IonicContact OE2-NZ 2.79Å; E96-K99 PolarHBondContact OE2-NZ 2.75Å; M97-K99 PolarHBondContact O-N 2.83Å; K99-V103 WeakPolarHBondContact O-CG2 3.37Å
100I94.4Very high91.5Very high0 Ų046.3 Ų46.30%024%0.24CC..Hα-helixtrans-69.3-50.8179-48.1-179.6000110L39 L42 Y46 M73 L81 M97 L98 S102 V103 L104L39-I100 HydrophobicContact CD2-CD1 4.1Å; L42-I100 HydrophobicContact CB-CG2 4.08Å; L42-I100 HydrophobicContact CD1-CB 4.28Å; L42-I100 HydrophobicContact CD1-CD1 4.48Å; L42-I100 HydrophobicContact CD1-CG2 4.3Å; L42-I100 HydrophobicContact CD2-CG2 4.31Å; L42-I100 HydrophobicContact CG-CG2 4.48Å; Y46-I100 HydrophobicContact CD2-CG2 4.1Å; Y46-I100 HydrophobicContact CE2-CG2 3.51Å; M73-I100 HydrophobicContact CE-CB 4.22Å; M73-I100 HydrophobicContact CE-CD1 4.04Å; M73-I100 HydrophobicContact CE-CG1 3.87Å; M73-I100 HydrophobicContact CE-CG2 3.56Å; M73-I100 HydrophobicContact CG-CD1 4.14Å; M73-I100 HydrophobicContact SD-CD1 4.38Å; M73-I100 HydrophobicContact SD-CG2 4.47Å; L81-I100 HydrophobicContact CD1-CD1 3.74Å; L81-I100 HydrophobicContact CD1-CG1 4.28Å; L81-I100 HydrophobicContact CD2-CD1 4.35Å; L81-I100 HydrophobicContact CD2-CG1 4.11Å; M97-I100 WeakPolarHBondContact O-CB 3.29Å; M97-I100 PolarHBondContact O-N 2.79Å; L98-I100 VanDerWaalsContact C-N 3.29Å; L98-I100 PolarHBondContact O-N 3.49Å; I100-S102 VanDerWaalsContact C-N 3.35Å; I100-S102 PolarHBondContact O-N 3.29Å; I100-V103 PolarHBondContact O-N 3.19Å; I100-L104 HydrophobicContact CG2-CD1 4.45Å; I100-L104 PolarHBondContact O-N 3.09Å
101T94.7Very high90.8Very high0 Ų052 Ų520%026%0.262CS..Hα-helixtrans-60.8-41.7-177.8-55.50000111.9F9 M12 M13 L16 M97 L98 V103 L104 Y105F9-T101 HydrophobicContact CD2-CG2 4.4Å; F9-T101 WeakPolarHBondContact CE2-OG1 3.35Å; M12-T101 HydrophobicContact CB-CG2 3.52Å; M12-T101 HydrophobicContact SD-CG2 4.47Å; M13-T101 HydrophobicContact CG-CG2 4.03Å; M13-T101 HydrophobicContact SD-CG2 3.76Å; M13-T101 PolarHBondContact SD-OG1 3.31Å; L16-T101 HydrophobicContact CD1-CG2 3.74Å; M97-T101 PolarHBondContact O-N 3.39Å; M97-T101 PolarHBondContact O-OG1 3.1Å; M97-T101 VanDerWaalsContact O-OG1 3.1Å; L98-T101 PolarHBondContact O-N 3.45Å; T101-V103 VanDerWaalsContact C-N 3.34Å; T101-V103 PolarHBondContact O-N 3.18Å; T101-L104 PolarHBondContact O-N 3.47Å; T101-Y105 WeakPolarHBondContact O-CB 3.41Å; T101-Y105 PolarHBondContact O-N 3.17Å
102S92.9Very high90Very high32 Ų3256.1 Ų56.122%0.22428%0.28CS..Hα-helixtrans-62.3-40.6-179.1-61.30000112.1L98 I100 Y105 N106L98-S102 VanDerWaalsContact O-CB 3.24Å; L98-S102 WeakPolarHBondContact O-CB 3.44Å; L98-S102 PolarHBondContact O-N 3.29Å; L98-S102 PolarHBondContact O-OG 3.45Å; I100-S102 VanDerWaalsContact C-N 3.35Å; I100-S102 PolarHBondContact O-N 3.29Å; S102-Y105 PolarHBondContact O-N 3Å; S102-N106 WeakPolarHBondContact O-CB 2.94Å; S102-N106 PolarHBondContact O-N 2.57Å; S102-N106 PolarHBondContact O-ND2 3.17Å; S102-N106 VanDerWaalsContact O-ND2 3.14Å
103V93.1Very high88.8Confident73 Ų7356.2 Ų56.244%0.44229%0.286SS..Hα-helixtrans-65.9-46.2178.4175.80000110.7Y46 I79 K99 I100 T101 Y105 N106 A107Y46-V103 VanDerWaalsContact OH-CB 3.29Å; Y46-V103 WeakPolarHBondContact OH-CB 3.4Å; Y46-V103 WeakPolarHBondContact OH-CG1 3.38Å; I79-V103 HydrophobicContact CD1-CB 4.42Å; I79-V103 HydrophobicContact CD1-CG2 4.03Å; K99-V103 WeakPolarHBondContact O-CG2 3.37Å; I100-V103 PolarHBondContact O-N 3.19Å; T101-V103 VanDerWaalsContact C-N 3.34Å; T101-V103 PolarHBondContact O-N 3.18Å; V103-Y105 PolarHBondContact O-N 3.3Å; V103-N106 PolarHBondContact O-N 3.03Å; V103-A107 WeakPolarHBondContact O-CB 3.47Å; V103-A107 PolarHBondContact O-N 3.5Å
104L89.9Confident87.2Confident25 Ų2559.5 Ų59.513%0.13131%0.313CS..Hα-helixtrans-62.7-43176.8-71173.6000112.1L16 L42 R45 Y46 I100 T101 A107 M108L16-L104 HydrophobicContact CD1-CB 3.84Å; L16-L104 HydrophobicContact CD2-CB 3.97Å; L42-L104 HydrophobicContact CD2-CD1 3.85Å; R45-L104 HydrophobicContact CB-CD1 4.17Å; R45-L104 HydrophobicContact CG-CD1 4.06Å; R45-L104 HydrophobicContact CG-CD2 4.42Å; Y46-L104 HydrophobicContact CD2-CD1 3.84Å; Y46-L104 HydrophobicContact CD2-CD2 3.77Å; Y46-L104 HydrophobicContact CD2-CG 3.98Å; Y46-L104 HydrophobicContact CE1-CD2 4.3Å; Y46-L104 HydrophobicContact CE2-CD1 3.55Å; Y46-L104 HydrophobicContact CE2-CD2 3.44Å; Y46-L104 VanDerWaalsContact CE2-CD2 3.44Å; Y46-L104 HydrophobicContact CE2-CG 3.33Å; Y46-L104 HydrophobicContact CG-CD2 4.32Å; I100-L104 HydrophobicContact CG2-CD1 4.45Å; I100-L104 PolarHBondContact O-N 3.09Å; T101-L104 PolarHBondContact O-N 3.47Å; L104-A107 PolarHBondContact O-N 3.23Å; L104-M108 PolarHBondContact O-N 2.86Å
105Y92.1Very high85.5Confident69 Ų6965.1 Ų65.127%0.27134%0.342SS..Hα-helixtrans-65.2-43.4-179.4-179.1-103.2000111.7M12 A15 L16 T101 S102 V103 M108 K109M12-Y105 HydrophobicContact CB-CD2 4.09Å; M12-Y105 HydrophobicContact CB-CG 4.08Å; M12-Y105 HydrophobicContact CE-CD1 3.87Å; M12-Y105 HydrophobicContact CE-CE1 4.21Å; M12-Y105 HydrophobicContact CG-CD1 3.84Å; M12-Y105 HydrophobicContact CG-CD2 4.04Å; M12-Y105 HydrophobicContact CG-CE1 4.18Å; M12-Y105 HydrophobicContact CG-CE2 4.4Å; M12-Y105 HydrophobicContact CG-CG 3.74Å; M12-Y105 HydrophobicContact SD-CD1 4.09Å; M12-Y105 HydrophobicContact SD-CG 4.22Å; A15-Y105 HydrophobicContact CB-CD2 3.95Å; A15-Y105 HydrophobicContact CB-CE2 3.47Å; A15-Y105 VanDerWaalsContact CB-CE2 3.47Å; L16-Y105 HydrophobicContact CG-CD2 4.49Å; T101-Y105 WeakPolarHBondContact O-CB 3.41Å; T101-Y105 PolarHBondContact O-N 3.17Å; S102-Y105 PolarHBondContact O-N 3Å; V103-Y105 PolarHBondContact O-N 3.3Å; Y105-M108 PolarHBondContact O-N 3.41Å; Y105-K109 WeakPolarHBondContact O-CB 3.35Å; Y105-K109 PolarHBondContact O-N 2.8Å
106N90.6Very high83.6Confident89 Ų8965.9 Ų65.948%0.47635%0.347SS..Hα-helixtrans-63-43.6175.8-70.7-23.2000111.5S102 V103 M108 K109 T110S102-N106 WeakPolarHBondContact O-CB 2.94Å; S102-N106 PolarHBondContact O-N 2.57Å; S102-N106 PolarHBondContact O-ND2 3.17Å; S102-N106 VanDerWaalsContact O-ND2 3.14Å; V103-N106 PolarHBondContact O-N 3.03Å; N106-M108 VanDerWaalsContact C-N 3.34Å; N106-M108 PolarHBondContact O-N 3.33Å; N106-K109 PolarHBondContact O-N 3.39Å; N106-T110 PolarHBondContact O-N 3.33Å; N106-T110 PolarHBondContact O-OG1 3.28Å; N106-T110 VanDerWaalsContact O-OG1 3.05Å
107A87.3Confident81.5Confident61 Ų6171.5 Ų71.550%0.50438%0.378SS..Hα-helixtrans-61.2-41.7176.500000112.4V103 L104 K111V103-A107 WeakPolarHBondContact O-CB 3.47Å; V103-A107 PolarHBondContact O-N 3.5Å; L104-A107 PolarHBondContact O-N 3.23Å; A107-K111 PolarHBondContact O-N 3.47Å
108M87Confident79.4Confident74 Ų7475.4 Ų75.437%0.36541%0.41SS..Hα-helixtrans-62.2-46174.3178.2178.2167.600111.6A15 L16 L104 Y105 N106 T110 K111 Q112A15-M108 WeakPolarHBondContact O-CE 3.32Å; L16-M108 HydrophobicContact CD2-CB 4.25Å; L16-M108 HydrophobicContact CD2-SD 3.98Å; L104-M108 PolarHBondContact O-N 2.86Å; Y105-M108 PolarHBondContact O-N 3.41Å; N106-M108 VanDerWaalsContact C-N 3.34Å; N106-M108 PolarHBondContact O-N 3.33Å; M108-T110 PolarHBondContact O-N 2.95Å; M108-K111 PolarHBondContact O-N 2.87Å; M108-Q112 PolarHBondContact O-N 2.93Å
109K85.4Confident77.3Confident99 Ų9979.8 Ų79.843%0.4344%0.437SS..Hα-helixtrans-64.2-40.5-179.5-171177.5178.4-178.30112.3Y105 N106 K111 Q112 M113Y105-K109 WeakPolarHBondContact O-CB 3.35Å; Y105-K109 PolarHBondContact O-N 2.8Å; N106-K109 PolarHBondContact O-N 3.39Å; K109-K111 VanDerWaalsContact C-N 3.32Å; K109-K111 PolarHBondContact O-N 3Å; K109-Q112 PolarHBondContact O-N 3.43Å; K109-M113 HydrophobicContact CG-SD 4.23Å; K109-M113 WeakPolarHBondContact O-CG 3.32Å; K109-M113 PolarHBondContact O-N 3.48Å
110T81.1Confident75Confident97 Ų9782.6 Ų82.660%0.59545%0.451SS*.Hα-helixtrans-61.3-41.1174.6-58.40000111.6N106 M108 Q112 A114N106-T110 PolarHBondContact O-N 3.33Å; N106-T110 PolarHBondContact O-OG1 3.28Å; N106-T110 VanDerWaalsContact O-OG1 3.05Å; M108-T110 PolarHBondContact O-N 2.95Å; T110-Q112 VanDerWaalsContact C-N 3.34Å; T110-A114 WeakPolarHBondContact O-CB 3.35Å; T110-A114 PolarHBondContact O-N 2.98Å; T110-A114 VanDerWaalsContact O-N 3.09Å
111K76.1Confident72.8Confident156 Ų15691.7 Ų91.768%0.67849%0.494SS*.Hα-helixtrans-65.4-37.1175.2-174.6179.1177.8-178.80112.3A107 M108 K109 L115A107-K111 PolarHBondContact O-N 3.47Å; M108-K111 PolarHBondContact O-N 2.87Å; K109-K111 VanDerWaalsContact C-N 3.32Å; K109-K111 PolarHBondContact O-N 3Å; K111-L115 PolarHBondContact O-N 2.95Å
112Q72.7Confident70.4Confident95 Ų9599.4 Ų99.444%0.44454%0.535SS..Hα-helixtrans-69.9-43.4178.5-173.1171.5-5.800112M108 K109 T110 A114 L115 E116M108-Q112 PolarHBondContact O-N 2.93Å; K109-Q112 PolarHBondContact O-N 3.43Å; T110-Q112 VanDerWaalsContact C-N 3.34Å; Q112-A114 VanDerWaalsContact C-N 3.31Å; Q112-A114 PolarHBondContact O-N 3.5Å; Q112-L115 WeakPolarHBondContact O-CB 3.45Å; Q112-L115 PolarHBondContact O-N 3.23Å; Q112-E116 WeakPolarHBondContact CG-OE1 3.43Å; Q112-E116 PolarHBondContact NE2-OE1 3.41Å; Q112-E116 PolarHBondContact O-N 3.07Å
113M66.4Low68Low109 Ų109101.7 Ų101.754%0.53755%0.551SS.*Hα-helixtrans-62.2-37.6175-72.3175.4138.400112.2K109 L115 E116 D117K109-M113 HydrophobicContact CG-SD 4.23Å; K109-M113 WeakPolarHBondContact O-CG 3.32Å; K109-M113 PolarHBondContact O-N 3.48Å; M113-L115 PolarHBondContact O-N 2.85Å; M113-E116 PolarHBondContact O-N 3.41Å; M113-D117 PolarHBondContact O-N 3.31Å; M113-D117 VanDerWaalsContact O-N 3.15Å
114A62.3Low65.5Low69 Ų69105.1 Ų105.157%0.5757%0.567SS**Hα-helixtrans-69-19.717400000113.9T110 Q112T110-A114 WeakPolarHBondContact O-CB 3.35Å; T110-A114 PolarHBondContact O-N 2.98Å; T110-A114 VanDerWaalsContact O-N 3.09Å; Q112-A114 VanDerWaalsContact C-N 3.31Å; Q112-A114 PolarHBondContact O-N 3.5Å
115L57.4Low63.6Low118 Ų118112.9 Ų112.962%0.61860%0.6SS**Hα-helixtrans-89.9-33.7176.3-129.992.7000111.9K111 Q112 M113 A118K111-L115 PolarHBondContact O-N 2.95Å; Q112-L115 WeakPolarHBondContact O-CB 3.45Å; Q112-L115 PolarHBondContact O-N 3.23Å; M113-L115 PolarHBondContact O-N 2.85Å; L115-A118 PolarHBondContact O-N 3.41Å
116E53.4Low61.6Low95 Ų95118.8 Ų118.844%0.44463%0.627SS.*Hα-helixtrans-72.2-36.9177.9-76.6168.7-174.800111.7Q112 M113 A118 V119 E120Q112-E116 WeakPolarHBondContact CG-OE1 3.43Å; Q112-E116 PolarHBondContact NE2-OE1 3.41Å; Q112-E116 PolarHBondContact O-N 3.07Å; M113-E116 PolarHBondContact O-N 3.41Å; E116-A118 PolarHBondContact O-N 2.96Å; E116-V119 PolarHBondContact O-N 3.44Å; E116-V119 VanDerWaalsContact O-N 3.1Å; E116-E120 PolarHBondContact O-N 3.36Å
117D50.9Low59.5Low133 Ų133123.8 Ų123.871%0.71165%0.645SS**THydrogen-bonded Turntrans-60.6-24.5173.4-108.40.2000113.3M113M113-D117 PolarHBondContact O-N 3.31Å; M113-D117 VanDerWaalsContact O-N 3.15Å
118A51.3Low58Low82 Ų82128.4 Ų128.468%0.67865%0.654SS**THydrogen-bonded Turntrans-86.4-12.4179.200000113.8L115 E116L115-A118 PolarHBondContact O-N 3.41Å; E116-A118 PolarHBondContact O-N 2.96Å
119V49.6Very low56.6Low113 Ų113129.6 Ų129.669%0.68566%0.662SS**THydrogen-bonded Turntrans-108.8-17.3-177.1-1760000111.7E116E116-V119 PolarHBondContact O-N 3.44Å; E116-V119 VanDerWaalsContact O-N 3.1Å
120E46.1Very low55.3Low145 Ų145130 Ų13068%0.67867%0.668SS**G310 helixtrans-90.90.8-178.1-70.2-154.8164.700116.1E116 D122E116-E120 PolarHBondContact O-N 3.36Å; E120-D122 VanDerWaalsContact C-N 3.31Å; E120-D122 PolarHBondContact O-N 2.87Å
121E47.8Very low54.5Low191 Ų191127.7 Ų127.789%0.89366%0.663SS**G310 helixtrans-72.5-16.8177.6-87-164.6157.300114.5
122D44.3Very low53.9Low162 Ų162122.8 Ų122.887%0.86665%0.649SS**G310 helixtrans-111.70.4-173.1-155.625.7000115.5E120E120-D122 VanDerWaalsContact C-N 3.31Å; E120-D122 PolarHBondContact O-N 2.87Å
123S42.9Very low53.7Low80 Ų80125.2 Ų125.256%0.55965%0.654SS**SBendtrans-1309.3-166.2102.40000119.5
124N41Very low54.2Low145 Ų145123.9 Ų123.978%0.77565%0.648SS**  trans-146.988.8170.7-89-41.4000115.8
125K49.6Very low55.1Low189 Ų189124.6 Ų124.682%0.82265%0.649SS**  trans-41.1130.3145.5-82170.9176.5171.20111.8
126F49.4Very low56.3Low193 Ų193124.9 Ų124.985%0.84665%0.647SS**  trans52.478.7150.7-74.6-90.5000117.3
127K47.9Very low57.9Low194 Ų194124.5 Ų124.584%0.84365%0.648SS**  trans-123.2113.5140.2-74.2-176.6-179173.40108.3D129K127-D129 PolarHBondContact O-N 3.14Å
128F55.7Low59.6Low157 Ų157124.9 Ų124.969%0.68964%0.643SS**  trans-7382.7175.6-136.8-88.8000107.7L130F128-L130 HydrophobicContact CD1-CD1 4.24Å; F128-L130 HydrophobicContact CE1-CD1 4.21Å; F128-L130 PolarHBondContact O-N 3.31Å; F128-L130 VanDerWaalsContact O-N 3.09Å
129D56.4Low61.3Low100 Ų100123.3 Ų123.354%0.53563%0.63SS.*  trans-81.288.2177.3-161.7-2.5000109.1K127 G131 S132K127-D129 PolarHBondContact O-N 3.14Å; D129-G131 PolarHBondContact O-N 2.86Å; D129-G131 PolarHBondContact OD1-N 3.25Å; D129-S132 PolarHBondContact O-OG 3.31Å
130L58.3Low63.3Low106 Ų106120.7 Ų120.756%0.55562%0.62SS**Hα-helixtrans-66.5-24.5179.9-155.175000111.1F128 I134F128-L130 HydrophobicContact CD1-CD1 4.24Å; F128-L130 HydrophobicContact CE1-CD1 4.21Å; F128-L130 PolarHBondContact O-N 3.31Å; F128-L130 VanDerWaalsContact O-N 3.09Å; L130-I134 HydrophobicContact CD2-CD1 4.43Å; L130-I134 HydrophobicContact CG-CD1 4.21Å; L130-I134 WeakPolarHBondContact O-CB 3.39Å; L130-I134 VanDerWaalsContact O-CD1 3.27Å; L130-I134 WeakPolarHBondContact O-CD1 3.47Å; L130-I134 WeakPolarHBondContact O-CG1 3.06Å; L130-I134 PolarHBondContact O-N 3.48Å
131G65.8Low65.5Low49 Ų49121.7 Ų121.751%0.50562%0.618SS.*Hα-helixtrans-67.8-43.5-179.400000113.2D129 I134 S135D129-G131 PolarHBondContact O-N 2.86Å; D129-G131 PolarHBondContact OD1-N 3.25Å; G131-I134 PolarHBondContact O-N 2.98Å; G131-S135 PolarHBondContact O-N 3.38Å
132S63.2Low67.6Low54 Ų54117.7 Ų117.738%0.37860%0.599SS.*Hα-helixtrans-66.9-43.7176.560.80000111.6D129 I134 S135 E136D129-S132 PolarHBondContact O-OG 3.31Å; S132-I134 VanDerWaalsContact C-N 3.33Å; S132-I134 PolarHBondContact O-N 3.29Å; S132-S135 WeakPolarHBondContact O-CB 3.47Å; S132-S135 PolarHBondContact O-N 3.04Å; S132-E136 PolarHBondContact O-N 3.05Å
133R68.9Low70Confident146 Ų146114.7 Ų114.755%0.55158%0.582SS**Hα-helixtrans-66.3-28.7177.2-70.1-170176.4-166.8-0.7114.1S135 E136 L137R133-S135 VanDerWaalsContact C-N 3.34Å; R133-E136 PolarHBondContact O-N 3.43Å; R133-L137 WeakPolarHBondContact O-CB 3.32Å; R133-L137 PolarHBondContact O-N 3.43Å
134I76.2Confident72.5Confident81 Ų81113.3 Ų113.342%0.41558%0.576SS.*Hα-helixtrans-67.3-37.1174.7-74.8161.8000110.9L130 G131 S132 L137 K138L130-I134 HydrophobicContact CD2-CD1 4.43Å; L130-I134 HydrophobicContact CG-CD1 4.21Å; L130-I134 WeakPolarHBondContact O-CB 3.39Å; L130-I134 VanDerWaalsContact O-CD1 3.27Å; L130-I134 WeakPolarHBondContact O-CD1 3.47Å; L130-I134 WeakPolarHBondContact O-CG1 3.06Å; L130-I134 PolarHBondContact O-N 3.48Å; G131-I134 PolarHBondContact O-N 2.98Å; S132-I134 VanDerWaalsContact C-N 3.33Å; S132-I134 PolarHBondContact O-N 3.29Å; I134-L137 PolarHBondContact O-N 2.92Å; I134-K138 WeakPolarHBondContact O-CG 3.21Å; I134-K138 PolarHBondContact O-N 2.99Å
135S80.3Confident75Confident83 Ų83109.8 Ų109.858%0.5856%0.563SS**Hα-helixtrans-66.2-46174.9-170.90000111.1G131 S132 R133 L137 K138 A139G131-S135 PolarHBondContact O-N 3.38Å; S132-S135 WeakPolarHBondContact O-CB 3.47Å; S132-S135 PolarHBondContact O-N 3.04Å; R133-S135 VanDerWaalsContact C-N 3.34Å; S135-L137 VanDerWaalsContact C-N 3.32Å; S135-L137 PolarHBondContact O-N 3.28Å; S135-K138 PolarHBondContact O-N 3.44Å; S135-A139 PolarHBondContact O-N 3Å
136E83.6Confident77.2Confident125 Ų125104.9 Ų104.958%0.58454%0.543SS*.Hα-helixtrans-59.9-41.1174.7-68.5170.3-17200112.1S132 R133 A139 A140S132-E136 PolarHBondContact O-N 3.05Å; R133-E136 PolarHBondContact O-N 3.43Å; E136-A139 PolarHBondContact O-N 3.46Å; E136-A140 WeakPolarHBondContact O-CB 3.42Å; E136-A140 PolarHBondContact O-N 2.91Å
137L86.1Confident79.4Confident87 Ų87101.5 Ų101.546%0.45553%0.532SS..Hα-helixtrans-67-36.7177.6-168.6106.4000112.2R133 I134 S135 R141R133-L137 WeakPolarHBondContact O-CB 3.32Å; R133-L137 PolarHBondContact O-N 3.43Å; I134-L137 PolarHBondContact O-N 2.92Å; S135-L137 VanDerWaalsContact C-N 3.32Å; S135-L137 PolarHBondContact O-N 3.28Å; L137-R141 VanDerWaalsContact CD2-CZ 3.47Å; L137-R141 WeakPolarHBondContact O-CG 3.36Å; L137-R141 PolarHBondContact O-N 3.37Å
138K86.5Confident81.7Confident140 Ų14097.2 Ų97.261%0.60952%0.523SS*.Hα-helixtrans-66-44.6172.2-77.2178179.4-179.30111.1I134 S135 A140 R141 Q142I134-K138 WeakPolarHBondContact O-CG 3.21Å; I134-K138 PolarHBondContact O-N 2.99Å; S135-K138 PolarHBondContact O-N 3.44Å; K138-A140 VanDerWaalsContact C-N 3.34Å; K138-A140 PolarHBondContact O-N 3.27Å; K138-R141 PolarHBondContact O-N 3.04Å; K138-Q142 WeakPolarHBondContact O-CB 3.31Å; K138-Q142 PolarHBondContact O-N 3.36Å
139A88.5Confident83.6Confident50 Ų5093.4 Ų93.441%0.41352%0.515SS..Hα-helixtrans-61.1-42.8175.500000111.5S135 E136 R141 Q142 L143S135-A139 PolarHBondContact O-N 3Å; E136-A139 PolarHBondContact O-N 3.46Å; A139-R141 PolarHBondContact O-N 3.07Å; A139-Q142 PolarHBondContact O-N 2.97Å; A139-L143 WeakPolarHBondContact O-CB 3.34Å; A139-L143 VanDerWaalsContact O-CG 3.32Å; A139-L143 WeakPolarHBondContact O-CG 3.42Å; A139-L143 PolarHBondContact O-N 3.2Å
140A91.3Very high85.5Confident57 Ų5797.5 Ų97.547%0.47152%0.523SS..Hα-helixtrans-62.6-40.8176.600000112.5E136 K138 A144E136-A140 WeakPolarHBondContact O-CB 3.42Å; E136-A140 PolarHBondContact O-N 2.91Å; K138-A140 VanDerWaalsContact C-N 3.34Å; K138-A140 PolarHBondContact O-N 3.27Å; A140-A144 WeakPolarHBondContact O-CB 3.41Å; A140-A144 PolarHBondContact O-N 3.48Å
141R91.6Very high87.3Confident166 Ų16694.3 Ų94.363%0.62652%0.516SS*.Hα-helixtrans-66.5-40.7174.3-76.2-178.6-171.6144.1-1.5112.5L137 K138 A139 A144 S145L137-R141 VanDerWaalsContact CD2-CZ 3.47Å; L137-R141 WeakPolarHBondContact O-CG 3.36Å; L137-R141 PolarHBondContact O-N 3.37Å; K138-R141 PolarHBondContact O-N 3.04Å; A139-R141 PolarHBondContact O-N 3.07Å; R141-A144 PolarHBondContact O-N 3.39Å; R141-S145 PolarHBondContact O-N 3.17Å
142Q92.9Very high88.8Confident107 Ų10794.5 Ų94.550%0.551%0.513SS..Hα-helixtrans-61.9-48176.2-178.559.529.700110.6K138 A139 A144 S145 E146K138-Q142 WeakPolarHBondContact O-CB 3.31Å; K138-Q142 PolarHBondContact O-N 3.36Å; A139-Q142 PolarHBondContact O-N 2.97Å; Q142-A144 VanDerWaalsContact C-N 3.34Å; Q142-A144 PolarHBondContact O-N 2.7Å; Q142-S145 WeakPolarHBondContact O-CB 3.33Å; Q142-S145 PolarHBondContact O-N 3.48Å; Q142-S145 VanDerWaalsContact O-N 3.15Å; Q142-E146 PolarHBondContact NE2-OE1 3.42Å; Q142-E146 WeakPolarHBondContact O-CG 3.35Å; Q142-E146 PolarHBondContact O-N 2.94Å
143L93.7Very high90.3Very high99 Ų9994.5 Ų94.552%0.51851%0.513SS..Hα-helixtrans-60.4-40.9175.5-72.7170000112.2A139 S145 E146 I147A139-L143 WeakPolarHBondContact O-CB 3.34Å; A139-L143 VanDerWaalsContact O-CG 3.32Å; A139-L143 WeakPolarHBondContact O-CG 3.42Å; A139-L143 PolarHBondContact O-N 3.2Å; L143-S145 VanDerWaalsContact C-N 3.32Å; L143-S145 PolarHBondContact O-N 2.95Å; L143-E146 PolarHBondContact O-N 3.24Å; L143-I147 WeakPolarHBondContact O-CB 3.44Å; L143-I147 VanDerWaalsContact O-CG1 3.25Å; L143-I147 WeakPolarHBondContact O-CG1 3.46Å; L143-I147 PolarHBondContact O-N 3.42Å
144A95.4Very high91.6Very high51 Ų5192.2 Ų92.242%0.42151%0.511SS..Hα-helixtrans-63.4-37.9175.800000112.5A140 R141 Q142 T148A140-A144 WeakPolarHBondContact O-CB 3.41Å; A140-A144 PolarHBondContact O-N 3.48Å; R141-A144 PolarHBondContact O-N 3.39Å; Q142-A144 VanDerWaalsContact C-N 3.34Å; Q142-A144 PolarHBondContact O-N 2.7Å; A144-T148 PolarHBondContact O-N 3.34Å; A144-T148 VanDerWaalsContact O-N 3.13Å; A144-T148 PolarHBondContact O-OG1 2.82Å
145S94.3Very high92.5Very high71 Ų7196.6 Ų96.650%0.49752%0.524SS..Hα-helixtrans-66.4-43.2173.9-174.20000111.4R141 Q142 L143 T148 S149R141-S145 PolarHBondContact O-N 3.17Å; Q142-S145 WeakPolarHBondContact O-CB 3.33Å; Q142-S145 PolarHBondContact O-N 3.48Å; Q142-S145 VanDerWaalsContact O-N 3.15Å; L143-S145 VanDerWaalsContact C-N 3.32Å; L143-S145 PolarHBondContact O-N 2.95Å; S145-T148 PolarHBondContact O-N 3.47Å; S145-S149 WeakPolarHBondContact O-CB 3.29Å; S145-S149 PolarHBondContact O-N 3.49Å
146E95.4Very high93.2Very high86 Ų8697.3 Ų97.340%0.40252%0.521SS..Hα-helixtrans-63.8-42175.6-74.4176.3-156.300112.3Q142 L143 T148 S149 R150Q142-E146 PolarHBondContact NE2-OE1 3.42Å; Q142-E146 WeakPolarHBondContact O-CG 3.35Å; Q142-E146 PolarHBondContact O-N 2.94Å; L143-E146 PolarHBondContact O-N 3.24Å; E146-T148 VanDerWaalsContact C-N 3.27Å; E146-T148 PolarHBondContact O-N 3.43Å; E146-S149 PolarHBondContact O-N 3.01Å; E146-R150 VanDerWaalsContact O-CB 3.27Å; E146-R150 WeakPolarHBondContact O-CB 3.46Å; E146-R150 WeakPolarHBondContact O-CG 3.22Å; E146-R150 PolarHBondContact O-N 3.18Å
147I96.3Very high93.6Very high123 Ų12396 Ų9663%0.63152%0.517SS*.Hα-helixtrans-58.2-44.3175.1-72.9165.9000110.2L143 G151L143-I147 WeakPolarHBondContact O-CB 3.44Å; L143-I147 VanDerWaalsContact O-CG1 3.25Å; L143-I147 WeakPolarHBondContact O-CG1 3.46Å; L143-I147 PolarHBondContact O-N 3.42Å; I147-G151 PolarHBondContact O-N 3.38Å
148T95.8Very high94Very high104 Ų10497 Ų9764%0.63852%0.523SS*.Hα-helixtrans-64.9-45178.1-52.60000111.4A144 S145 E146 G151 A152A144-T148 PolarHBondContact O-N 3.34Å; A144-T148 VanDerWaalsContact O-N 3.13Å; A144-T148 PolarHBondContact O-OG1 2.82Å; S145-T148 PolarHBondContact O-N 3.47Å; E146-T148 VanDerWaalsContact C-N 3.27Å; E146-T148 PolarHBondContact O-N 3.43Å; T148-G151 PolarHBondContact O-N 2.98Å; T148-A152 PolarHBondContact O-N 2.81Å
149S95.9Very high94.4Very high76 Ų7693.4 Ų93.453%0.53153%0.525SS..Hα-helixtrans-64.4-45.1178.4176.30000112.5S145 E146 G151 A152 S153S145-S149 WeakPolarHBondContact O-CB 3.29Å; S145-S149 PolarHBondContact O-N 3.49Å; E146-S149 PolarHBondContact O-N 3.01Å; S149-G151 VanDerWaalsContact C-N 3.34Å; S149-A152 PolarHBondContact O-N 3.43Å; S149-S153 WeakPolarHBondContact O-CB 3.26Å; S149-S153 PolarHBondContact O-N 3.48Å
150R95.9Very high94.7Very high186 Ų18696.7 Ų96.770%0.70253%0.53SS*.Hα-helixtrans-65.9-38.2175.9-67.5-66.2-175.5-167.6-0.2111.3E146 S153 L154E146-R150 VanDerWaalsContact O-CB 3.27Å; E146-R150 WeakPolarHBondContact O-CB 3.46Å; E146-R150 WeakPolarHBondContact O-CG 3.22Å; E146-R150 PolarHBondContact O-N 3.18Å; R150-S153 PolarHBondContact O-N 3.39Å; R150-L154 VanDerWaalsContact O-CB 3.23Å; R150-L154 WeakPolarHBondContact O-CB 3.45Å; R150-L154 PolarHBondContact O-N 3.3Å
151G96.8Very high94.8Very high40 Ų4096.2 Ų96.241%0.41252%0.518SS..Hα-helixtrans-61.4-45.1174.400000112.2I147 T148 S149 L154 Y155I147-G151 PolarHBondContact O-N 3.38Å; T148-G151 PolarHBondContact O-N 2.98Å; S149-G151 VanDerWaalsContact C-N 3.34Å; G151-L154 PolarHBondContact O-N 3.13Å; G151-Y155 WeakPolarHBondContact O-CB 3.27Å; G151-Y155 PolarHBondContact O-N 2.95Å
152A95.9Very high94.8Very high53 Ų5391.7 Ų91.744%0.43852%0.516SS..Hα-helixtrans-63.3-47.7174.600000111.8T148 S149 L154 Y155 D156T148-A152 PolarHBondContact O-N 2.81Å; S149-A152 PolarHBondContact O-N 3.43Å; A152-L154 VanDerWaalsContact C-N 3.3Å; A152-L154 PolarHBondContact O-N 3.27Å; A152-Y155 WeakPolarHBondContact O-CB 3.5Å; A152-Y155 PolarHBondContact O-N 3.06Å; A152-D156 PolarHBondContact O-N 3.2Å
153S95.2Very high94.8Very high54 Ų5492.2 Ų92.238%0.37852%0.519SS..Hα-helixtrans-60.6-39.8176.8-179.80000112.3S149 R150 D156 L157S149-S153 WeakPolarHBondContact O-CB 3.26Å; S149-S153 PolarHBondContact O-N 3.48Å; R150-S153 PolarHBondContact O-N 3.39Å; S153-D156 PolarHBondContact O-N 2.92Å; S153-L157 WeakPolarHBondContact O-CB 3.4Å; S153-L157 WeakPolarHBondContact O-CG 3.49Å; S153-L157 PolarHBondContact O-N 3.34Å
154L95.3Very high94.8Very high97 Ų9790.7 Ų90.751%0.50851%0.511SS..Hα-helixtrans-66.1-42176.2179.762.5000111.4R150 G151 A152 D156 L157 L158R150-L154 VanDerWaalsContact O-CB 3.23Å; R150-L154 WeakPolarHBondContact O-CB 3.45Å; R150-L154 PolarHBondContact O-N 3.3Å; G151-L154 PolarHBondContact O-N 3.13Å; A152-L154 VanDerWaalsContact C-N 3.3Å; A152-L154 PolarHBondContact O-N 3.27Å; L154-D156 VanDerWaalsContact C-N 3.34Å; L154-D156 PolarHBondContact O-N 2.94Å; L154-L157 PolarHBondContact O-N 3.18Å; L154-L158 HydrophobicContact CD1-CD1 3.94Å; L154-L158 HydrophobicContact CD1-CG 3.94Å; L154-L158 HydrophobicContact CD2-CD1 4.42Å; L154-L158 HydrophobicContact CG-CD1 3.78Å; L154-L158 HydrophobicContact CG-CG 4.22Å; L154-L158 VanDerWaalsContact O-CB 3.3Å; L154-L158 WeakPolarHBondContact O-CB 3.5Å; L154-L158 VanDerWaalsContact O-CG 3.24Å; L154-L158 WeakPolarHBondContact O-CG 3.2Å; L154-L158 PolarHBondContact O-N 3.47Å
155Y95.6Very high94.7Very high174 Ų17494.1 Ų94.168%0.68251%0.513SS*.Hα-helixtrans-57.8-47.2174.9175.7-92.6000111.4G151 A152 L157 L158 G159G151-Y155 WeakPolarHBondContact O-CB 3.27Å; G151-Y155 PolarHBondContact O-N 2.95Å; A152-Y155 WeakPolarHBondContact O-CB 3.5Å; A152-Y155 PolarHBondContact O-N 3.06Å; Y155-L157 PolarHBondContact O-N 3.23Å; Y155-L158 PolarHBondContact O-N 3.05Å; Y155-G159 PolarHBondContact O-N 3.28Å
156D94.9Very high94.6Very high97 Ų9797.8 Ų97.852%0.51952%0.522SS..Hα-helixtrans-64.3-41.8178.8-67.5-23.4000112.1A152 S153 L154 G159 K160A152-D156 PolarHBondContact O-N 3.2Å; S153-D156 PolarHBondContact O-N 2.92Å; L154-D156 VanDerWaalsContact C-N 3.34Å; L154-D156 PolarHBondContact O-N 2.94Å; D156-G159 PolarHBondContact O-N 3.49Å; D156-K160 WeakPolarHBondContact O-CG 3.35Å; D156-K160 PolarHBondContact O-N 2.87Å
157L93Very high94.4Very high97 Ų9798.3 Ų98.351%0.50853%0.526SS..Hα-helixtrans-66.9-42.3177.5-70.8172.8000111.9S153 L154 Y155 G159 K160 E161S153-L157 WeakPolarHBondContact O-CB 3.4Å; S153-L157 WeakPolarHBondContact O-CG 3.49Å; S153-L157 PolarHBondContact O-N 3.34Å; L154-L157 PolarHBondContact O-N 3.18Å; Y155-L157 PolarHBondContact O-N 3.23Å; L157-G159 VanDerWaalsContact C-N 3.31Å; L157-G159 PolarHBondContact O-N 2.86Å; L157-K160 PolarHBondContact O-N 3.02Å; L157-E161 PolarHBondContact O-N 3.37Å
158L94.4Very high94.2Very high109 Ų10997.9 Ų97.957%0.57152%0.516SS*.Hα-helixtrans-66-34.8175.5-73.1173.5000111.7L154 Y155 K160 E161L154-L158 HydrophobicContact CD1-CD1 3.94Å; L154-L158 HydrophobicContact CD1-CG 3.94Å; L154-L158 HydrophobicContact CD2-CD1 4.42Å; L154-L158 HydrophobicContact CG-CD1 3.78Å; L154-L158 HydrophobicContact CG-CG 4.22Å; L154-L158 VanDerWaalsContact O-CB 3.3Å; L154-L158 WeakPolarHBondContact O-CB 3.5Å; L154-L158 VanDerWaalsContact O-CG 3.24Å; L154-L158 WeakPolarHBondContact O-CG 3.2Å; L154-L158 PolarHBondContact O-N 3.47Å; Y155-L158 PolarHBondContact O-N 3.05Å; L158-K160 PolarHBondContact O-N 3.32Å; L158-E161 VanDerWaalsContact O-CB 3.3Å; L158-E161 WeakPolarHBondContact O-CB 3.49Å; L158-E161 PolarHBondContact O-N 3.33Å; L158-E161 VanDerWaalsContact O-N 3.09Å
159G93.8Very high94Very high64 Ų6496.8 Ų96.866%0.6651%0.509SS*.Hα-helixtrans-59.8-32.817300000112.8Y155 D156 L157Y155-G159 PolarHBondContact O-N 3.28Å; D156-G159 PolarHBondContact O-N 3.49Å; L157-G159 VanDerWaalsContact C-N 3.31Å; L157-G159 PolarHBondContact O-N 2.86Å
160K95.2Very high93.6Very high120 Ų12096.2 Ų96.252%0.52251%0.509SS..THydrogen-bonded Turntrans-85-7.5176.2-64.5178.5-175.2-176.80114.1D156 L157 L158 A162 E163 L164D156-K160 WeakPolarHBondContact O-CG 3.35Å; D156-K160 PolarHBondContact O-N 2.87Å; L157-K160 PolarHBondContact O-N 3.02Å; L158-K160 PolarHBondContact O-N 3.32Å; K160-A162 PolarHBondContact O-N 3.5Å; K160-E163 PolarHBondContact O-N 3.44Å; K160-L164 HydrophobicContact CB-CD1 3.84Å; K160-L164 HydrophobicContact CB-CG 4.13Å; K160-L164 WeakPolarHBondContact O-CB 3.35Å; K160-L164 VanDerWaalsContact O-CG 3.3Å; K160-L164 WeakPolarHBondContact O-CG 3.41Å; K160-L164 PolarHBondContact O-N 3.47Å
161E93.7Very high93.1Very high47 Ų4790.7 Ų90.722%0.2250%0.503CS..Hα-helixtrans-62.6-29.6-171.8172.657.1-164.800113L157 L158 R165 R168L157-E161 PolarHBondContact O-N 3.37Å; L158-E161 VanDerWaalsContact O-CB 3.3Å; L158-E161 WeakPolarHBondContact O-CB 3.49Å; L158-E161 PolarHBondContact O-N 3.33Å; L158-E161 VanDerWaalsContact O-N 3.09Å; E161-R165 WeakPolarHBondContact O-CB 3.38Å; E161-R165 PolarHBondContact O-N 2.94Å; E161-R165 IonicContact OE1-CZ 2.7Å; E161-R165 VanDerWaalsContact OE1-CZ 3.24Å; E161-R165 IonicContact OE1-NE 3.72Å; E161-R165 PolarHBondContact OE1-NE 3.42Å; E161-R165 IonicContact OE1-NH2 3.24Å; E161-R165 PolarHBondContact OE1-NH2 2.97Å; E161-R168 IonicContact OE1-CZ 3.81Å; E161-R168 IonicContact OE1-NH1 2.64Å; E161-R168 IonicContact OE1-NH2 2.75Å; E161-R168 PolarHBondContact OE1-NH2 3.02Å; E161-R168 IonicContact OE2-NH1 4Å
162A91.6Very high92.6Very high70 Ų7095 Ų9558%0.57952%0.516SS*.Hα-helixtrans-62.3-49.6176.100000111.7K160 E166K160-A162 PolarHBondContact O-N 3.5Å; A162-E166 PolarHBondContact O-N 3.28Å; A162-E166 VanDerWaalsContact O-N 3.16Å
163E93.1Very high92.1Very high119 Ų11996 Ų9656%0.55652%0.524SS*.Hα-helixtrans-67.6-46.1177.2-171.5-169.8170.900111.3K160 R165 E166 M167K160-E163 PolarHBondContact O-N 3.44Å; E163-R165 VanDerWaalsContact C-N 3.28Å; E163-R165 PolarHBondContact O-N 2.96Å; E163-E166 PolarHBondContact O-N 3.48Å; E163-E166 VanDerWaalsContact O-N 3.16Å; E163-M167 HydrophobicContact CG-CE 4.15Å; E163-M167 WeakPolarHBondContact O-CG 3.47Å; E163-M167 PolarHBondContact O-N 2.99Å
164L92.6Very high91.5Very high67 Ų67100.5 Ų100.535%0.35153%0.532SS..Hα-helixtrans-61.6-36.9178-69171.9000111.8K160 M167 R168K160-L164 HydrophobicContact CB-CD1 3.84Å; K160-L164 HydrophobicContact CB-CG 4.13Å; K160-L164 WeakPolarHBondContact O-CB 3.35Å; K160-L164 VanDerWaalsContact O-CG 3.3Å; K160-L164 WeakPolarHBondContact O-CG 3.41Å; K160-L164 PolarHBondContact O-N 3.47Å; L164-M167 HydrophobicContact CD2-CE 3.74Å; L164-R168 WeakPolarHBondContact O-CB 3.39Å; L164-R168 PolarHBondContact O-N 3.15Å
165R93.1Very high90.6Very high123 Ų123100.3 Ų100.346%0.46454%0.537SS..Hα-helixtrans-66.3-42.4175.4-179.7179.6-62.8122.83.6111.4E161 E163 T169E161-R165 WeakPolarHBondContact O-CB 3.38Å; E161-R165 PolarHBondContact O-N 2.94Å; E161-R165 IonicContact OE1-CZ 2.7Å; E161-R165 VanDerWaalsContact OE1-CZ 3.24Å; E161-R165 IonicContact OE1-NE 3.72Å; E161-R165 PolarHBondContact OE1-NE 3.42Å; E161-R165 IonicContact OE1-NH2 3.24Å; E161-R165 PolarHBondContact OE1-NH2 2.97Å; E163-R165 VanDerWaalsContact C-N 3.28Å; E163-R165 PolarHBondContact O-N 2.96Å; R165-T169 VanDerWaalsContact O-CB 3.31Å; R165-T169 WeakPolarHBondContact O-CB 3.47Å; R165-T169 PolarHBondContact O-N 3.1Å; R165-T169 PolarHBondContact O-OG1 3.22Å
166E92.8Very high89.5Confident147 Ų14799.3 Ų99.369%0.68754%0.543SS*.Hα-helixtrans-63-51176.3-173.9174.1-176.600110.8A162 E163 R168 T169 A170A162-E166 PolarHBondContact O-N 3.28Å; A162-E166 VanDerWaalsContact O-N 3.16Å; E163-E166 PolarHBondContact O-N 3.48Å; E163-E166 VanDerWaalsContact O-N 3.16Å; E166-R168 VanDerWaalsContact C-N 3.34Å; E166-R168 PolarHBondContact O-N 3.41Å; E166-T169 PolarHBondContact O-N 3.17Å; E166-T169 VanDerWaalsContact O-N 3.16Å; E166-A170 WeakPolarHBondContact O-CB 3.35Å; E166-A170 PolarHBondContact O-N 3.45Å
167M91.3Very high88.9Confident98 Ų9898.8 Ų98.848%0.48354%0.537SS..Hα-helixtrans-59-43.6176.4-71.3-165.6-68.500112.4E163 L164 A170 A171E163-M167 HydrophobicContact CG-CE 4.15Å; E163-M167 WeakPolarHBondContact O-CG 3.47Å; E163-M167 PolarHBondContact O-N 2.99Å; L164-M167 HydrophobicContact CD2-CE 3.74Å; M167-A170 PolarHBondContact O-N 3.48Å; M167-A171 VanDerWaalsContact O-CB 3.29Å; M167-A171 WeakPolarHBondContact O-CB 3.21Å; M167-A171 PolarHBondContact O-N 3.38Å
168R92.6Very high88.4Confident113 Ų11399.7 Ų99.743%0.42654%0.541SS..Hα-helixtrans-62.3-44176.3179.717664.8-120.14.4111.3E161 L164 E166 A171 I172E161-R168 IonicContact OE1-CZ 3.81Å; E161-R168 IonicContact OE1-NH1 2.64Å; E161-R168 IonicContact OE1-NH2 2.75Å; E161-R168 PolarHBondContact OE1-NH2 3.02Å; E161-R168 IonicContact OE2-NH1 4Å; L164-R168 WeakPolarHBondContact O-CB 3.39Å; L164-R168 PolarHBondContact O-N 3.15Å; E166-R168 VanDerWaalsContact C-N 3.34Å; E166-R168 PolarHBondContact O-N 3.41Å; R168-A171 PolarHBondContact O-N 3.03Å; R168-I172 HydrophobicContact CG-CD1 3.72Å; R168-I172 HydrophobicContact CG-CG1 4.48Å; R168-I172 WeakPolarHBondContact O-CB 3.34Å; R168-I172 WeakPolarHBondContact O-CD1 3.3Å; R168-I172 WeakPolarHBondContact O-CG1 3.32Å; R168-I172 PolarHBondContact O-N 2.95Å
169T91.3Very high88.2Confident82 Ų82100.3 Ų100.350%0.50355%0.545SS..Hα-helixtrans-66.1-41.6178.7-53.70000110.7R165 E166 I172 A173R165-T169 VanDerWaalsContact O-CB 3.31Å; R165-T169 WeakPolarHBondContact O-CB 3.47Å; R165-T169 PolarHBondContact O-N 3.1Å; R165-T169 PolarHBondContact O-OG1 3.22Å; E166-T169 PolarHBondContact O-N 3.17Å; E166-T169 VanDerWaalsContact O-N 3.16Å; T169-I172 PolarHBondContact O-N 2.64Å; T169-A173 WeakPolarHBondContact O-CB 3.46Å; T169-A173 PolarHBondContact O-N 3.26Å
170A88.1Confident87.9Confident63 Ų63102.5 Ų102.552%0.52154%0.538SS..Hα-helixtrans-63.8-42.9175.200000112.3E166 M167 A173 R174E166-A170 WeakPolarHBondContact O-CB 3.35Å; E166-A170 PolarHBondContact O-N 3.45Å; M167-A170 PolarHBondContact O-N 3.48Å; A170-A173 PolarHBondContact O-N 3.47Å; A170-R174 PolarHBondContact O-N 3.35Å
171A85.7Confident87.5Confident70 Ų70100.6 Ų100.658%0.57954%0.537SS*.Hα-helixtrans-66.6-38.8177.100000112.7M167 R168 R174M167-A171 VanDerWaalsContact O-CB 3.29Å; M167-A171 WeakPolarHBondContact O-CB 3.21Å; M167-A171 PolarHBondContact O-N 3.38Å; R168-A171 PolarHBondContact O-N 3.03Å; A171-R174 WeakPolarHBondContact O-CB 3.3Å; A171-R174 PolarHBondContact O-N 3.49Å
172I86Confident87.5Confident132 Ų132102 Ų10268%0.67754%0.543SS*.Hα-helixtrans-71.4-36.3175.5-68168.1000111.2R168 T169 R174R168-I172 HydrophobicContact CG-CD1 3.72Å; R168-I172 HydrophobicContact CG-CG1 4.48Å; R168-I172 WeakPolarHBondContact O-CB 3.34Å; R168-I172 WeakPolarHBondContact O-CD1 3.3Å; R168-I172 WeakPolarHBondContact O-CG1 3.32Å; R168-I172 PolarHBondContact O-N 2.95Å; T169-I172 PolarHBondContact O-N 2.64Å; I172-R174 PolarHBondContact O-N 2.95Å
173A85.6Confident87.6Confident73 Ų73106.4 Ų106.460%0.60355%0.549SS*.Hα-helixtrans-73.8-16.8177.500000112.7T169 A170 P175T169-A173 WeakPolarHBondContact O-CB 3.46Å; T169-A173 PolarHBondContact O-N 3.26Å; A170-A173 PolarHBondContact O-N 3.47Å; A173-P175 VanDerWaalsContact O-CD 3.25Å; A173-P175 WeakPolarHBondContact O-CD 3.37Å
174R81.1Confident87.7Confident148 Ų148103.7 Ų103.756%0.55855%0.547SS*.SBendtrans-64.7118.1174-172.3177.2175.3177.4-3.8108.7A170 A171 I172 L176 E180A170-R174 PolarHBondContact O-N 3.35Å; A171-R174 WeakPolarHBondContact O-CB 3.3Å; A171-R174 PolarHBondContact O-N 3.49Å; I172-R174 PolarHBondContact O-N 2.95Å; R174-L176 PolarHBondContact O-N 2.98Å; R174-E180 IonicContact NH2-OE2 3.38Å; R174-E180 PolarHBondContact NH2-OE2 2.94Å
175P77.4Confident87.8Confident94 Ų94105.8 Ų105.861%0.6156%0.558SS**  trans-56.6138.6170.9-21.433.7000109.5A173 E177A173-P175 VanDerWaalsContact O-CD 3.25Å; A173-P175 WeakPolarHBondContact O-CD 3.37Å; P175-E177 PolarHBondContact O-N 3.44Å
176L72.6Confident88Confident153 Ų153107.7 Ų107.780%0.80157%0.566SS**  trans-60.7108.7173-83.1153000108.5R174 I178R174-L176 PolarHBondContact O-N 2.98Å; L176-I178 PolarHBondContact O-N 2.94Å
177E81.5Confident88.2Confident85 Ų85103.4 Ų103.440%0.39756%0.555SS.*  trans-73.677.1173.5-68.3-63.8159.500108.7P175 N179 E180 T181P175-E177 PolarHBondContact O-N 3.44Å; E177-N179 PolarHBondContact O-N 3.29Å; E177-N179 VanDerWaalsContact O-N 3.11Å; E177-E180 HydrophobicContact CB-CB 3.95Å; E177-E180 HydrophobicContact CB-CG 3.89Å; E177-E180 PolarHBondContact O-N 2.82Å; E177-T181 PolarHBondContact O-N 3.46Å
178I83.9Confident88.4Confident117 Ų117100.7 Ų100.760%0.655%0.549SS*.Hα-helixtrans-51.9-39.2-175.8-64.9168.7000110.4L176 E180 T181 E182L176-I178 PolarHBondContact O-N 2.94Å; I178-E180 PolarHBondContact O-N 2.87Å; I178-T181 WeakPolarHBondContact CA-OG1 3.31Å; I178-T181 PolarHBondContact O-N 2.91Å; I178-T181 PolarHBondContact O-OG1 3.47Å; I178-E182 VanDerWaalsContact O-CB 3.29Å; I178-E182 WeakPolarHBondContact O-CB 3.48Å; I178-E182 PolarHBondContact O-N 3.48Å
179N88.5Confident88.7Confident121 Ų12199.6 Ų99.665%0.64755%0.55SS*.Hα-helixtrans-64.5-40.3178.7-64.7-38.9000113.3E177 K183E177-N179 PolarHBondContact O-N 3.29Å; E177-N179 VanDerWaalsContact O-N 3.11Å; N179-K183 WeakPolarHBondContact O-CB 3.1Å; N179-K183 PolarHBondContact O-N 3.05Å
180E87.5Confident89Confident110 Ų110101.9 Ų101.951%0.51455%0.553SS.*Hα-helixtrans-68-43.3176.5-67.8-177.6166.800110.4R174 E177 I178 E182 K183 A184R174-E180 IonicContact NH2-OE2 3.38Å; R174-E180 PolarHBondContact NH2-OE2 2.94Å; E177-E180 HydrophobicContact CB-CB 3.95Å; E177-E180 HydrophobicContact CB-CG 3.89Å; E177-E180 PolarHBondContact O-N 2.82Å; I178-E180 PolarHBondContact O-N 2.87Å; E180-E182 VanDerWaalsContact C-N 3.35Å; E180-E182 PolarHBondContact O-N 2.91Å; E180-K183 PolarHBondContact O-N 2.94Å; E180-A184 WeakPolarHBondContact O-CB 3.5Å; E180-A184 PolarHBondContact O-N 3.34Å
181T88.4Confident89.5Confident80 Ų80104.5 Ų104.549%0.49156%0.555SS.*Hα-helixtrans-64.6-39.3177.361.90000112.1E177 I178 A184 L185E177-T181 PolarHBondContact O-N 3.46Å; I178-T181 WeakPolarHBondContact CA-OG1 3.31Å; I178-T181 PolarHBondContact O-N 2.91Å; I178-T181 PolarHBondContact O-OG1 3.47Å; T181-A184 PolarHBondContact O-N 3.43Å; T181-L185 VanDerWaalsContact O-CB 3.29Å; T181-L185 WeakPolarHBondContact O-CB 3.29Å; T181-L185 PolarHBondContact O-N 2.96Å
182E92.4Very high90.1Very high77 Ų77105.1 Ų105.136%0.3655%0.551SS.*Hα-helixtrans-66.4-42.7175.8-173.3-174.8161.400111I178 E180 L185 R186I178-E182 VanDerWaalsContact O-CB 3.29Å; I178-E182 WeakPolarHBondContact O-CB 3.48Å; I178-E182 PolarHBondContact O-N 3.48Å; E180-E182 VanDerWaalsContact C-N 3.35Å; E180-E182 PolarHBondContact O-N 2.91Å; E182-L185 PolarHBondContact O-N 3.01Å; E182-R186 HydrophobicContact CG-CG 4.48Å; E182-R186 WeakPolarHBondContact O-CB 3.34Å; E182-R186 VanDerWaalsContact O-CG 3.27Å; E182-R186 WeakPolarHBondContact O-CG 3.48Å; E182-R186 PolarHBondContact O-N 3.16Å; E182-R186 IonicContact OE1-CZ 2.96Å; E182-R186 IonicContact OE1-NE 3.8Å; E182-R186 PolarHBondContact OE1-NE 3.28Å; E182-R186 IonicContact OE1-NH2 2.69Å; E182-R186 PolarHBondContact OE1-NH2 3.44Å
183K95.1Very high90.6Very high162 Ų162104 Ų10470%0.70455%0.546SS*.Hα-helixtrans-61.7-45.6176.2-174.8-177.9177.9-173.90111.4N179 E180 L185 R186 A187N179-K183 WeakPolarHBondContact O-CB 3.1Å; N179-K183 PolarHBondContact O-N 3.05Å; E180-K183 PolarHBondContact O-N 2.94Å; K183-L185 VanDerWaalsContact C-N 3.35Å; K183-R186 PolarHBondContact O-N 3.41Å; K183-A187 WeakPolarHBondContact O-CB 3.2Å; K183-A187 PolarHBondContact O-N 3.14Å
184A93.6Very high91.2Very high63 Ų63105.8 Ų105.852%0.52154%0.542SS..Hα-helixtrans-62.3-42.9176.300000111.5E180 T181 A187 A188E180-A184 WeakPolarHBondContact O-CB 3.5Å; E180-A184 PolarHBondContact O-N 3.34Å; T181-A184 PolarHBondContact O-N 3.43Å; A184-A187 PolarHBondContact O-N 3.29Å; A184-A188 PolarHBondContact O-N 2.97Å
185L95.1Very high92Very high111 Ų111102.8 Ų102.858%0.58154%0.536SS*.Hα-helixtrans-63.6-43.2176.9-175.263.1000111.8T181 E182 K183 A187 A188 I189T181-L185 VanDerWaalsContact O-CB 3.29Å; T181-L185 WeakPolarHBondContact O-CB 3.29Å; T181-L185 PolarHBondContact O-N 2.96Å; E182-L185 PolarHBondContact O-N 3.01Å; K183-L185 VanDerWaalsContact C-N 3.35Å; L185-A187 VanDerWaalsContact C-N 3.33Å; L185-A187 PolarHBondContact O-N 3.28Å; L185-A188 PolarHBondContact O-N 3.44Å; L185-I189 HydrophobicContact CG-CD1 4.1Å; L185-I189 VanDerWaalsContact O-CG1 3.26Å; L185-I189 WeakPolarHBondContact O-CG1 3.42Å; L185-I189 PolarHBondContact O-N 3.48Å
186R96.8Very high93Very high163 Ų163101.3 Ų101.362%0.61553%0.525SS*.Hα-helixtrans-62.9-39.5175.8-74.4174.2-179.4-87.42.1112E182 K183 I189 K190E182-R186 HydrophobicContact CG-CG 4.48Å; E182-R186 WeakPolarHBondContact O-CB 3.34Å; E182-R186 VanDerWaalsContact O-CG 3.27Å; E182-R186 WeakPolarHBondContact O-CG 3.48Å; E182-R186 PolarHBondContact O-N 3.16Å; E182-R186 IonicContact OE1-CZ 2.96Å; E182-R186 IonicContact OE1-NE 3.8Å; E182-R186 PolarHBondContact OE1-NE 3.28Å; E182-R186 IonicContact OE1-NH2 2.69Å; E182-R186 PolarHBondContact OE1-NH2 3.44Å; K183-R186 PolarHBondContact O-N 3.41Å; R186-I189 PolarHBondContact O-N 2.94Å; R186-K190 WeakPolarHBondContact O-CB 3.39Å; R186-K190 PolarHBondContact O-N 3.33Å
187A96.9Very high94.2Very high56 Ų5698.5 Ų98.546%0.46351%0.508SS..Hα-helixtrans-64-47.2175.400000111.4K183 A184 L185 I189 K190 E191K183-A187 WeakPolarHBondContact O-CB 3.2Å; K183-A187 PolarHBondContact O-N 3.14Å; A184-A187 PolarHBondContact O-N 3.29Å; L185-A187 VanDerWaalsContact C-N 3.33Å; L185-A187 PolarHBondContact O-N 3.28Å; A187-I189 VanDerWaalsContact C-N 3.33Å; A187-I189 PolarHBondContact O-N 3Å; A187-K190 WeakPolarHBondContact O-CB 3.49Å; A187-K190 PolarHBondContact O-N 3.42Å; A187-K190 VanDerWaalsContact O-N 3.13Å; A187-E191 PolarHBondContact O-N 3.23Å
188A97.4Very high95Very high42 Ų42101 Ų10135%0.34752%0.518SS..Hα-helixtrans-61.9-38.5177.400000112.7A184 L185 T192A184-A188 PolarHBondContact O-N 2.97Å; L185-A188 PolarHBondContact O-N 3.44Å; A188-T192 WeakPolarHBondContact O-CB 3.24Å; A188-T192 PolarHBondContact O-N 3.24Å; A188-T192 PolarHBondContact O-OG1 2.82Å
189I97.6Very high95.7Very high89 Ų89100.3 Ų100.346%0.45651%0.514SS..Hα-helixtrans-62.4-46173.6-70.4165.2000110.4L185 R186 A187 T192 L193L185-I189 HydrophobicContact CG-CD1 4.1Å; L185-I189 VanDerWaalsContact O-CG1 3.26Å; L185-I189 WeakPolarHBondContact O-CG1 3.42Å; L185-I189 PolarHBondContact O-N 3.48Å; R186-I189 PolarHBondContact O-N 2.94Å; A187-I189 VanDerWaalsContact C-N 3.33Å; A187-I189 PolarHBondContact O-N 3Å; I189-T192 PolarHBondContact O-N 3.27Å; I189-L193 HydrophobicContact CG2-CD1 3.97Å; I189-L193 HydrophobicContact CG2-CG 4.42Å; I189-L193 VanDerWaalsContact O-CG 3.31Å; I189-L193 WeakPolarHBondContact O-CG 3.44Å; I189-L193 PolarHBondContact O-N 3.1Å
190K98.1Very high96.1Very high130 Ų13099.8 Ų99.857%0.56551%0.506SS*.Hα-helixtrans-60.8-48.9179.3-178.7-177.9167.1-1730111.4R186 A187 T192 L193 E194R186-K190 WeakPolarHBondContact O-CB 3.39Å; R186-K190 PolarHBondContact O-N 3.33Å; A187-K190 WeakPolarHBondContact O-CB 3.49Å; A187-K190 PolarHBondContact O-N 3.42Å; A187-K190 VanDerWaalsContact O-N 3.13Å; K190-T192 VanDerWaalsContact C-N 3.32Å; K190-T192 PolarHBondContact O-N 3Å; K190-L193 WeakPolarHBondContact O-CB 3.22Å; K190-L193 PolarHBondContact O-N 3.37Å; K190-L193 VanDerWaalsContact O-N 3.15Å; K190-E194 WeakPolarHBondContact CE-OE1 3.21Å; K190-E194 IonicContact NZ-OE1 2.81Å; K190-E194 WeakPolarHBondContact O-CG 3.33Å; K190-E194 PolarHBondContact O-N 3.45Å
191E98.1Very high96.6Very high119 Ų119100.3 Ų100.356%0.55651%0.508SS*.Hα-helixtrans-58.9-44177.2-173.8-174.2175.400111.4A187 L193 E194 I195A187-E191 PolarHBondContact O-N 3.23Å; E191-L193 VanDerWaalsContact C-N 3.32Å; E191-L193 PolarHBondContact O-N 2.89Å; E191-E194 PolarHBondContact O-N 3.37Å; E191-I195 HydrophobicContact CG-CD1 4.34Å; E191-I195 WeakPolarHBondContact O-CG1 3.45Å; E191-I195 PolarHBondContact O-N 3.38Å
192T97.8Very high97.1Very high82 Ų82101.9 Ų101.950%0.50351%0.511SS..Hα-helixtrans-62.3-40176.7-55.60000111.7A188 I189 K190 I195 V196A188-T192 WeakPolarHBondContact O-CB 3.24Å; A188-T192 PolarHBondContact O-N 3.24Å; A188-T192 PolarHBondContact O-OG1 2.82Å; I189-T192 PolarHBondContact O-N 3.27Å; K190-T192 VanDerWaalsContact C-N 3.32Å; K190-T192 PolarHBondContact O-N 3Å; T192-I195 PolarHBondContact O-N 3.39Å; T192-V196 VanDerWaalsContact O-CG2 3.29Å; T192-V196 WeakPolarHBondContact O-CG2 3.34Å; T192-V196 PolarHBondContact O-N 3.4Å
193L98.1Very high97.3Very high110 Ų110103.4 Ų103.458%0.57652%0.522SS*.Hα-helixtrans-66.1-38.9176.8-72.8171.5000112.1I189 K190 E191 V196 E197I189-L193 HydrophobicContact CG2-CD1 3.97Å; I189-L193 HydrophobicContact CG2-CG 4.42Å; I189-L193 VanDerWaalsContact O-CG 3.31Å; I189-L193 WeakPolarHBondContact O-CG 3.44Å; I189-L193 PolarHBondContact O-N 3.1Å; K190-L193 WeakPolarHBondContact O-CB 3.22Å; K190-L193 PolarHBondContact O-N 3.37Å; K190-L193 VanDerWaalsContact O-N 3.15Å; E191-L193 VanDerWaalsContact C-N 3.32Å; E191-L193 PolarHBondContact O-N 2.89Å; L193-V196 PolarHBondContact O-N 3.2Å; L193-E197 PolarHBondContact O-N 3.47Å
194E98.1Very high97.5Very high109 Ų10999.4 Ų99.451%0.50951%0.514SS..Hα-helixtrans-64-42174.8-71.8171.7-179.900111.4K190 E191 V196 E197 K198K190-E194 WeakPolarHBondContact CE-OE1 3.21Å; K190-E194 IonicContact NZ-OE1 2.81Å; K190-E194 WeakPolarHBondContact O-CG 3.33Å; K190-E194 PolarHBondContact O-N 3.45Å; E191-E194 PolarHBondContact O-N 3.37Å; E194-V196 VanDerWaalsContact C-N 3.34Å; E194-V196 PolarHBondContact O-N 2.98Å; E194-E197 PolarHBondContact O-N 3.49Å; E194-K198 PolarHBondContact O-N 3.12Å
195I97.9Very high97.7Very high86 Ų86101.2 Ų101.244%0.44152%0.515SS..Hα-helixtrans-61.6-43.8173.4-66.6167.5000111E191 T192 E197 K198 I199E191-I195 HydrophobicContact CG-CD1 4.34Å; E191-I195 WeakPolarHBondContact O-CG1 3.45Å; E191-I195 PolarHBondContact O-N 3.38Å; T192-I195 PolarHBondContact O-N 3.39Å; I195-E197 VanDerWaalsContact C-N 3.3Å; I195-E197 PolarHBondContact O-N 3.48Å; I195-K198 PolarHBondContact O-N 2.83Å; I195-I199 HydrophobicContact CG2-CD1 3.75Å; I195-I199 HydrophobicContact CG2-CG1 4.36Å; I195-I199 VanDerWaalsContact O-CG1 3.29Å; I195-I199 WeakPolarHBondContact O-CG1 3.43Å; I195-I199 PolarHBondContact O-N 3.32Å
196V98.1Very high97.8Very high62 Ų62100 Ų10038%0.37651%0.512SS..Hα-helixtrans-59.4-43.5177.3165.30000110.8T192 L193 E194 I199 K200T192-V196 VanDerWaalsContact O-CG2 3.29Å; T192-V196 WeakPolarHBondContact O-CG2 3.34Å; T192-V196 PolarHBondContact O-N 3.4Å; L193-V196 PolarHBondContact O-N 3.2Å; E194-V196 VanDerWaalsContact C-N 3.34Å; E194-V196 PolarHBondContact O-N 2.98Å; V196-I199 PolarHBondContact O-N 3.38Å; V196-K200 WeakPolarHBondContact O-CG 3.29Å; V196-K200 PolarHBondContact O-N 3.06Å
197E98.3Very high97.9Very high95 Ų9595.6 Ų95.644%0.44450%0.503SS..Hα-helixtrans-67.2-42.6179.8-156.359.5-155.700111.8L193 E194 I195 I199 K200 E201L193-E197 PolarHBondContact O-N 3.47Å; E194-E197 PolarHBondContact O-N 3.49Å; I195-E197 VanDerWaalsContact C-N 3.3Å; I195-E197 PolarHBondContact O-N 3.48Å; E197-I199 VanDerWaalsContact C-N 3.31Å; E197-I199 PolarHBondContact O-N 3.4Å; E197-K200 WeakPolarHBondContact O-CB 3.5Å; E197-K200 PolarHBondContact O-N 2.86Å; E197-K200 VanDerWaalsContact O-N 3.08Å; E197-K200 IonicContact OE2-NZ 3.17Å; E197-K200 PolarHBondContact OE2-NZ 3.17Å; E197-E201 PolarHBondContact O-N 3.46Å
198K98.1Very high97.9Very high138 Ų13896.2 Ų96.260%0.650%0.504SS*.Hα-helixtrans-58.5-41.9173.5-173.6175.1-178.7175.10112.3E194 I195 K200 E201 M202E194-K198 PolarHBondContact O-N 3.12Å; I195-K198 PolarHBondContact O-N 2.83Å; K198-K200 VanDerWaalsContact C-N 3.33Å; K198-K200 PolarHBondContact O-N 2.7Å; K198-E201 PolarHBondContact O-N 2.99Å; K198-M202 WeakPolarHBondContact O-CG 3.45Å; K198-M202 PolarHBondContact O-N 3.49Å
199I97.6Very high97.9Very high102 Ų10298.8 Ų98.852%0.52351%0.511SS..Hα-helixtrans-65.3-37.5176.8-69.6169.2000111I195 V196 E197 M202 L203I195-I199 HydrophobicContact CG2-CD1 3.75Å; I195-I199 HydrophobicContact CG2-CG1 4.36Å; I195-I199 VanDerWaalsContact O-CG1 3.29Å; I195-I199 WeakPolarHBondContact O-CG1 3.43Å; I195-I199 PolarHBondContact O-N 3.32Å; V196-I199 PolarHBondContact O-N 3.38Å; E197-I199 VanDerWaalsContact C-N 3.31Å; E197-I199 PolarHBondContact O-N 3.4Å; I199-M202 PolarHBondContact O-N 3.14Å; I199-L203 WeakPolarHBondContact O-CB 3.25Å; I199-L203 PolarHBondContact O-N 2.94Å
200K98.1Very high97.9Very high109 Ų10999.8 Ų99.847%0.47451%0.514SS..Hα-helixtrans-65.5-41.9175.5-71.3177-164.7157.90112.3V196 E197 K198 L203 S204V196-K200 WeakPolarHBondContact O-CG 3.29Å; V196-K200 PolarHBondContact O-N 3.06Å; E197-K200 WeakPolarHBondContact O-CB 3.5Å; E197-K200 PolarHBondContact O-N 2.86Å; E197-K200 VanDerWaalsContact O-N 3.08Å; E197-K200 IonicContact OE2-NZ 3.17Å; E197-K200 PolarHBondContact OE2-NZ 3.17Å; K198-K200 VanDerWaalsContact C-N 3.33Å; K198-K200 PolarHBondContact O-N 2.7Å; K200-L203 WeakPolarHBondContact O-CB 3.38Å; K200-L203 PolarHBondContact O-N 3.23Å; K200-S204 PolarHBondContact O-N 2.92Å
201E98Very high97.9Very high121 Ų12197.6 Ų97.657%0.56551%0.512SS*.Hα-helixtrans-62-46.7175.4-74-178.7166.900111E197 K198 L203 S204 N205E197-E201 PolarHBondContact O-N 3.46Å; K198-E201 PolarHBondContact O-N 2.99Å; E201-L203 VanDerWaalsContact C-N 3.29Å; E201-L203 PolarHBondContact O-N 2.93Å; E201-S204 WeakPolarHBondContact O-CB 3.33Å; E201-S204 PolarHBondContact O-N 3.44Å; E201-S204 VanDerWaalsContact O-N 3.14Å; E201-N205 PolarHBondContact O-N 3.42Å
202M97.4Very high97.9Very high113 Ų11394.6 Ų94.656%0.55750%0.504SS*.Hα-helixtrans-58.1-42.1174.4-71179.567.300111.9K198 I199 N205 V206K198-M202 WeakPolarHBondContact O-CG 3.45Å; K198-M202 PolarHBondContact O-N 3.49Å; I199-M202 PolarHBondContact O-N 3.14Å; M202-N205 PolarHBondContact O-N 3.32Å; M202-V206 WeakPolarHBondContact O-CG2 3.46Å; M202-V206 PolarHBondContact O-N 2.88Å
203L97.9Very high97.9Very high110 Ų11095.3 Ų95.358%0.57650%0.504SS*.Hα-helixtrans-63.1-42.3176.2-177.965000111.6I199 K200 E201 N205 V206 V207I199-L203 WeakPolarHBondContact O-CB 3.25Å; I199-L203 PolarHBondContact O-N 2.94Å; K200-L203 WeakPolarHBondContact O-CB 3.38Å; K200-L203 PolarHBondContact O-N 3.23Å; E201-L203 VanDerWaalsContact C-N 3.29Å; E201-L203 PolarHBondContact O-N 2.93Å; L203-N205 VanDerWaalsContact C-N 3.31Å; L203-N205 PolarHBondContact O-N 3.24Å; L203-V206 PolarHBondContact O-N 3.48Å; L203-V207 VanDerWaalsContact O-CG2 3.32Å; L203-V207 WeakPolarHBondContact O-CG2 3.43Å; L203-V207 PolarHBondContact O-N 3.05Å
204S98.1Very high97.9Very high77 Ų7794.4 Ų94.454%0.53850%0.5SS..Hα-helixtrans-60.6-41.6176.3-172.30000111.8K200 E201 V207 S208K200-S204 PolarHBondContact O-N 2.92Å; E201-S204 WeakPolarHBondContact O-CB 3.33Å; E201-S204 PolarHBondContact O-N 3.44Å; E201-S204 VanDerWaalsContact O-N 3.14Å; S204-V207 PolarHBondContact O-N 3.33Å; S204-S208 PolarHBondContact O-N 3.05Å
205N97.4Very high97.9Very high101 Ų10192.2 Ų92.254%0.5450%0.5SS..Hα-helixtrans-64.8-45.4176.7-66.2-14.7000111.3E201 M202 L203 V207 S208 D209E201-N205 PolarHBondContact O-N 3.42Å; M202-N205 PolarHBondContact O-N 3.32Å; L203-N205 VanDerWaalsContact C-N 3.31Å; L203-N205 PolarHBondContact O-N 3.24Å; N205-V207 VanDerWaalsContact C-N 3.31Å; N205-V207 PolarHBondContact O-N 3.36Å; N205-S208 WeakPolarHBondContact O-CB 3.28Å; N205-S208 PolarHBondContact O-N 3.09Å; N205-S208 VanDerWaalsContact O-N 3.15Å; N205-D209 PolarHBondContact O-N 3.21Å
206V98.1Very high97.9Very high86 Ų8694.2 Ų94.252%0.52151%0.506SS..Hα-helixtrans-60.1-40.9176.61710000111.6M202 L203 D209 E210M202-V206 WeakPolarHBondContact O-CG2 3.46Å; M202-V206 PolarHBondContact O-N 2.88Å; L203-V206 PolarHBondContact O-N 3.48Å; V206-D209 PolarHBondContact O-N 3.15Å; V206-E210 WeakPolarHBondContact O-CB 3.49Å; V206-E210 PolarHBondContact O-N 2.89Å
207V98Very high97.9Very high71 Ų7195.2 Ų95.243%0.4351%0.509SS..Hα-helixtrans-64.6-42176.2170.60000111.1L203 S204 N205 E210 T211L203-V207 VanDerWaalsContact O-CG2 3.32Å; L203-V207 WeakPolarHBondContact O-CG2 3.43Å; L203-V207 PolarHBondContact O-N 3.05Å; S204-V207 PolarHBondContact O-N 3.33Å; N205-V207 VanDerWaalsContact C-N 3.31Å; N205-V207 PolarHBondContact O-N 3.36Å; V207-E210 PolarHBondContact O-N 3.25Å; V207-T211 WeakPolarHBondContact O-CG2 3.35Å; V207-T211 PolarHBondContact O-N 3.02Å; V207-T211 PolarHBondContact O-OG1 3.23Å
208S97.7Very high97.9Very high68 Ų6895 Ų9548%0.47651%0.508SS..Hα-helixtrans-59.1-47.1173.6172.10000111.4S204 N205 E210 T211 S212S204-S208 PolarHBondContact O-N 3.05Å; N205-S208 WeakPolarHBondContact O-CB 3.28Å; N205-S208 PolarHBondContact O-N 3.09Å; N205-S208 VanDerWaalsContact O-N 3.15Å; S208-E210 PolarHBondContact O-N 2.93Å; S208-T211 PolarHBondContact O-N 3.41Å; S208-T211 PolarHBondContact O-OG1 3.46Å; S208-S212 PolarHBondContact O-N 2.91Å
209D97.8Very high97.9Very high96 Ų9695.3 Ų95.351%0.51351%0.509SS..Hα-helixtrans-64.1-41.5179.1-68.5-19000112N205 V206 S212 L213N205-D209 PolarHBondContact O-N 3.21Å; V206-D209 PolarHBondContact O-N 3.15Å; D209-S212 PolarHBondContact O-N 3.47Å; D209-L213 WeakPolarHBondContact O-CB 3.47Å; D209-L213 VanDerWaalsContact O-CG 3.29Å; D209-L213 WeakPolarHBondContact O-CG 3.38Å; D209-L213 PolarHBondContact O-N 3.3Å
210E97.6Very high98Very high111 Ų11197.5 Ų97.552%0.51952%0.515SS..Hα-helixtrans-57.3-50.5174.7-175.8177.4-167.700110.8V206 V207 S208 S212 L213 D214V206-E210 WeakPolarHBondContact O-CB 3.49Å; V206-E210 PolarHBondContact O-N 2.89Å; V207-E210 PolarHBondContact O-N 3.25Å; S208-E210 PolarHBondContact O-N 2.93Å; E210-S212 VanDerWaalsContact C-N 3.32Å; E210-S212 PolarHBondContact O-N 2.84Å; E210-L213 PolarHBondContact O-N 3.41Å; E210-D214 WeakPolarHBondContact O-CB 3.47Å; E210-D214 PolarHBondContact O-N 2.92Å
211T97.9Very high98Very high84 Ų8498.1 Ų98.152%0.51552%0.517SS..Hα-helixtrans-63.3-36.417961.50000113.1V207 S208 A215V207-T211 WeakPolarHBondContact O-CG2 3.35Å; V207-T211 PolarHBondContact O-N 3.02Å; V207-T211 PolarHBondContact O-OG1 3.23Å; S208-T211 PolarHBondContact O-N 3.41Å; S208-T211 PolarHBondContact O-OG1 3.46Å; T211-A215 PolarHBondContact O-N 2.74Å; T211-A215 VanDerWaalsContact O-N 3.1Å
212S98Very high98Very high56 Ų5696.5 Ų96.539%0.39251%0.51SS..Hα-helixtrans-66.9-43.1175.7-1790000111.8S208 D209 E210 A215 K216S208-S212 PolarHBondContact O-N 2.91Å; D209-S212 PolarHBondContact O-N 3.47Å; E210-S212 VanDerWaalsContact C-N 3.32Å; E210-S212 PolarHBondContact O-N 2.84Å; S212-A215 PolarHBondContact O-N 3.24Å; S212-K216 WeakPolarHBondContact O-CG 3.43Å; S212-K216 PolarHBondContact O-N 3.08Å; S212-K216 VanDerWaalsContact O-N 3.07Å
213L98.1Very high98Very high96 Ų9693.8 Ų93.850%0.50350%0.497SS..Hα-helixtrans-66.7-41.2176.9-72.3174.5000111.8D209 E210 A215 K216 I217D209-L213 WeakPolarHBondContact O-CB 3.47Å; D209-L213 VanDerWaalsContact O-CG 3.29Å; D209-L213 WeakPolarHBondContact O-CG 3.38Å; D209-L213 PolarHBondContact O-N 3.3Å; E210-L213 PolarHBondContact O-N 3.41Å; L213-A215 VanDerWaalsContact C-N 3.32Å; L213-A215 PolarHBondContact O-N 3.34Å; L213-K216 WeakPolarHBondContact O-CB 3.33Å; L213-K216 PolarHBondContact O-N 2.96Å; L213-K216 VanDerWaalsContact O-N 3.15Å; L213-I217 WeakPolarHBondContact O-CB 3.39Å; L213-I217 VanDerWaalsContact O-CG1 3.28Å; L213-I217 WeakPolarHBondContact O-CG1 3.43Å; L213-I217 PolarHBondContact O-N 3.35Å
214D97.8Very high98Very high91 Ų9193.2 Ų93.249%0.48749%0.494SS..Hα-helixtrans-60.5-42.4175.2-82.1-21.3000111.8E210 K216 I217 E218E210-D214 WeakPolarHBondContact O-CB 3.47Å; E210-D214 PolarHBondContact O-N 2.92Å; D214-K216 VanDerWaalsContact C-N 3.34Å; D214-K216 PolarHBondContact O-N 3.06Å; D214-I217 PolarHBondContact O-N 2.87Å; D214-E218 WeakPolarHBondContact O-CB 3.38Å; D214-E218 PolarHBondContact O-N 3.25Å
215A98.2Very high98Very high63 Ų6394 Ų9452%0.52149%0.489SS..Hα-helixtrans-61.7-40.7174.500000112.2T211 S212 L213 K219T211-A215 PolarHBondContact O-N 2.74Å; T211-A215 VanDerWaalsContact O-N 3.1Å; S212-A215 PolarHBondContact O-N 3.24Å; L213-A215 VanDerWaalsContact C-N 3.32Å; L213-A215 PolarHBondContact O-N 3.34Å; A215-K219 PolarHBondContact O-N 2.96Å
216K98.4Very high98Very high129 Ų12997.4 Ų97.456%0.56150%0.495SS*.Hα-helixtrans-65.9-42.5175.3-71.6177.5-174179.90112S212 L213 D214 E218 K219 K220S212-K216 WeakPolarHBondContact O-CG 3.43Å; S212-K216 PolarHBondContact O-N 3.08Å; S212-K216 VanDerWaalsContact O-N 3.07Å; L213-K216 WeakPolarHBondContact O-CB 3.33Å; L213-K216 PolarHBondContact O-N 2.96Å; L213-K216 VanDerWaalsContact O-N 3.15Å; D214-K216 VanDerWaalsContact C-N 3.34Å; D214-K216 PolarHBondContact O-N 3.06Å; K216-E218 VanDerWaalsContact C-N 3.34Å; K216-K219 PolarHBondContact O-N 3.22Å; K216-K220 WeakPolarHBondContact O-CG 3.45Å; K216-K220 PolarHBondContact O-N 2.7Å
217I98.1Very high98Very high83 Ų8399.2 Ų99.243%0.42650%0.497SS..Hα-helixtrans-61.3-46177.3-72.1165.8000109.8L213 D214 K220 K221L213-I217 WeakPolarHBondContact O-CB 3.39Å; L213-I217 VanDerWaalsContact O-CG1 3.28Å; L213-I217 WeakPolarHBondContact O-CG1 3.43Å; L213-I217 PolarHBondContact O-N 3.35Å; D214-I217 PolarHBondContact O-N 2.87Å; I217-K220 PolarHBondContact O-N 3.38Å; I217-K221 HydrophobicContact CG2-CD 4.18Å; I217-K221 HydrophobicContact CG2-CG 4.43Å; I217-K221 WeakPolarHBondContact O-CG 3.4Å; I217-K221 PolarHBondContact O-N 2.93Å
218E98.3Very high97.9Very high91 Ų91101.3 Ų101.343%0.42550%0.502SS..Hα-helixtrans-64.8-42-179.4-169.853.8-148.100111.8D214 K216 K220 K221 Q222D214-E218 WeakPolarHBondContact O-CB 3.38Å; D214-E218 PolarHBondContact O-N 3.25Å; K216-E218 VanDerWaalsContact C-N 3.34Å; E218-K220 PolarHBondContact O-N 3.42Å; E218-K221 PolarHBondContact O-N 3.01Å; E218-Q222 WeakPolarHBondContact O-CG 3.2Å; E218-Q222 PolarHBondContact O-N 3.2Å; E218-Q222 PolarHBondContact OE1-NE2 3.43Å
219K98.3Very high97.9Very high144 Ų144103.3 Ų103.363%0.62650%0.503SS*.Hα-helixtrans-58-47.2172.2-174.4177.4178.7-179.70111.7A215 K216 K221 Q222 D223A215-K219 PolarHBondContact O-N 2.96Å; K216-K219 PolarHBondContact O-N 3.22Å; K219-K221 PolarHBondContact O-N 2.89Å; K219-Q222 PolarHBondContact O-N 3.09Å; K219-D223 PolarHBondContact O-N 3.29Å
220K98.2Very high97.8Very high148 Ų148107 Ų10764%0.64351%0.509SS*.Hα-helixtrans-65.3-35.6178.7-72.4-65-174.4-176.80113K216 I217 E218 D223 L224K216-K220 WeakPolarHBondContact O-CG 3.45Å; K216-K220 PolarHBondContact O-N 2.7Å; I217-K220 PolarHBondContact O-N 3.38Å; E218-K220 PolarHBondContact O-N 3.42Å; K220-D223 PolarHBondContact O-N 3.45Å; K220-L224 VanDerWaalsContact O-CB 3.25Å; K220-L224 WeakPolarHBondContact O-CB 3.27Å; K220-L224 PolarHBondContact O-N 2.99Å
221K98.2Very high97.7Very high121 Ų121106.2 Ų106.253%0.52651%0.508SS..Hα-helixtrans-62.2-45173.3-76.8175.8-179.9171.40111.5I217 E218 K219 L224 E225I217-K221 HydrophobicContact CG2-CD 4.18Å; I217-K221 HydrophobicContact CG2-CG 4.43Å; I217-K221 WeakPolarHBondContact O-CG 3.4Å; I217-K221 PolarHBondContact O-N 2.93Å; E218-K221 PolarHBondContact O-N 3.01Å; K219-K221 PolarHBondContact O-N 2.89Å; K221-L224 PolarHBondContact O-N 3.02Å; K221-E225 WeakPolarHBondContact O-CB 3.12Å; K221-E225 PolarHBondContact O-N 3.46Å
222Q98.3Very high97.5Very high88 Ų88108.6 Ų108.641%0.41151%0.513SS..Hα-helixtrans-64.7-41.8178-68.9175.720.200112E218 K219 E225 R226E218-Q222 WeakPolarHBondContact O-CG 3.2Å; E218-Q222 PolarHBondContact O-N 3.2Å; E218-Q222 PolarHBondContact OE1-NE2 3.43Å; K219-Q222 PolarHBondContact O-N 3.09Å; Q222-E225 PolarHBondContact O-N 3.43Å; Q222-R226 VanDerWaalsContact O-CG 3.29Å; Q222-R226 WeakPolarHBondContact O-CG 3.45Å; Q222-R226 PolarHBondContact O-N 3.36Å
223D98Very high97.3Very high55 Ų55110 Ų11029%0.29452%0.52SS..Hα-helixtrans-62.6-44.6175.3-69.6-20.2000111.2K219 K220 E225 R226 H227K219-D223 PolarHBondContact O-N 3.29Å; K220-D223 PolarHBondContact O-N 3.45Å; D223-E225 PolarHBondContact O-N 2.86Å; D223-R226 WeakPolarHBondContact O-CB 3.48Å; D223-R226 PolarHBondContact O-N 2.97Å; D223-H227 PolarHBondContact O-CD2 3.04Å; D223-H227 PolarHBondContact O-N 3.36Å
224L97.9Very high96.9Very high98 Ų98110.8 Ų110.851%0.51352%0.524SS..Hα-helixtrans-61.2-43.7177.2-176.9147.6000111.6K220 K221 R226 H227 Q228K220-L224 VanDerWaalsContact O-CB 3.25Å; K220-L224 WeakPolarHBondContact O-CB 3.27Å; K220-L224 PolarHBondContact O-N 2.99Å; K221-L224 PolarHBondContact O-N 3.02Å; L224-R226 VanDerWaalsContact C-N 3.34Å; L224-R226 PolarHBondContact O-N 3.18Å; L224-H227 PolarHBondContact O-N 3.47Å; L224-Q228 VanDerWaalsContact CD2-CD 3.41Å; L224-Q228 HydrophobicContact CD2-CG 4.11Å; L224-Q228 WeakPolarHBondContact O-CB 3.5Å; L224-Q228 WeakPolarHBondContact O-CG 3.28Å; L224-Q228 PolarHBondContact O-N 3.26Å
225E98.1Very high96.5Very high93 Ų93113.5 Ų113.544%0.43553%0.534SS..Hα-helixtrans-62.5-40.8176.2-168.7-170.7168.400111.5K221 Q222 D223 Q228 K229K221-E225 WeakPolarHBondContact O-CB 3.12Å; K221-E225 PolarHBondContact O-N 3.46Å; Q222-E225 PolarHBondContact O-N 3.43Å; D223-E225 PolarHBondContact O-N 2.86Å; E225-Q228 PolarHBondContact O-N 3.23Å; E225-K229 HydrophobicContact CG-CD 4.49Å; E225-K229 WeakPolarHBondContact O-CB 3.5Å; E225-K229 WeakPolarHBondContact O-CG 3.49Å; E225-K229 PolarHBondContact O-N 2.92Å; E225-K229 WeakPolarHBondContact OE1-CE 3.38Å; E225-K229 IonicContact OE1-NZ 3.34Å; E225-K229 PolarHBondContact OE1-NZ 3.1Å
226R97.8Very high96.1Very high173 Ų173114.8 Ų114.865%0.65354%0.539SS*.Hα-helixtrans-62.1-45.6175-71.9170.9-175.9-125.23.7111.6Q222 D223 L224 K229 R230Q222-R226 VanDerWaalsContact O-CG 3.29Å; Q222-R226 WeakPolarHBondContact O-CG 3.45Å; Q222-R226 PolarHBondContact O-N 3.36Å; D223-R226 WeakPolarHBondContact O-CB 3.48Å; D223-R226 PolarHBondContact O-N 2.97Å; L224-R226 VanDerWaalsContact C-N 3.34Å; L224-R226 PolarHBondContact O-N 3.18Å; R226-K229 PolarHBondContact O-N 3.48Å; R226-R230 PolarHBondContact O-N 3.43Å
227H97.4Very high95.7Very high124 Ų124113 Ų11357%0.57454%0.539SS*.Hα-helixtrans-66.3-40.3177.9-71.3-54.8000112.3D223 L224 R230 L231D223-H227 PolarHBondContact O-CD2 3.04Å; D223-H227 PolarHBondContact O-N 3.36Å; L224-H227 PolarHBondContact O-N 3.47Å; H227-R230 PolarHBondContact O-N 3.29Å; H227-L231 WeakPolarHBondContact O-CB 3.38Å; H227-L231 PolarHBondContact O-N 3.44Å
228Q97.2Very high95.1Very high115 Ų115115.3 Ų115.354%0.53754%0.542SS..Hα-helixtrans-61-45.2174-78.8179.9-25.100111.7L224 E225 R230 L231 Q232L224-Q228 VanDerWaalsContact CD2-CD 3.41Å; L224-Q228 HydrophobicContact CD2-CG 4.11Å; L224-Q228 WeakPolarHBondContact O-CB 3.5Å; L224-Q228 WeakPolarHBondContact O-CG 3.28Å; L224-Q228 PolarHBondContact O-N 3.26Å; E225-Q228 PolarHBondContact O-N 3.23Å; Q228-R230 VanDerWaalsContact C-N 3.35Å; Q228-R230 PolarHBondContact O-N 2.9Å; Q228-L231 PolarHBondContact O-N 3.18Å; Q228-Q232 WeakPolarHBondContact O-CB 3.33Å; Q228-Q232 PolarHBondContact O-N 3.5Å
229K96.8Very high94.7Very high111 Ų111113.8 Ų113.848%0.48354%0.54SS..Hα-helixtrans-60.7-43.7174.6-74.1174.6-175.4168.40111.5E225 R226 L231 Q232 T233E225-K229 HydrophobicContact CG-CD 4.49Å; E225-K229 WeakPolarHBondContact O-CB 3.5Å; E225-K229 WeakPolarHBondContact O-CG 3.49Å; E225-K229 PolarHBondContact O-N 2.92Å; E225-K229 WeakPolarHBondContact OE1-CE 3.38Å; E225-K229 IonicContact OE1-NZ 3.34Å; E225-K229 PolarHBondContact OE1-NZ 3.1Å; R226-K229 PolarHBondContact O-N 3.48Å; K229-L231 PolarHBondContact O-N 3.48Å; K229-Q232 PolarHBondContact O-N 3.03Å; K229-T233 PolarHBondContact O-N 3.41Å; K229-T233 PolarHBondContact O-OG1 3.15Å; K229-T233 VanDerWaalsContact O-OG1 3.07Å
230R95.8Very high94.1Very high172 Ų172111.2 Ų111.265%0.64955%0.546SS*.Hα-helixtrans-61.6-43.6176.2-176176.9179.4175.5-1111.9R226 H227 Q228 T233 L234R226-R230 PolarHBondContact O-N 3.43Å; H227-R230 PolarHBondContact O-N 3.29Å; Q228-R230 VanDerWaalsContact C-N 3.35Å; Q228-R230 PolarHBondContact O-N 2.9Å; R230-T233 PolarHBondContact O-N 3.05Å; R230-L234 HydrophobicContact CG-CD1 4.23Å; R230-L234 WeakPolarHBondContact O-CG 3.34Å; R230-L234 PolarHBondContact O-N 2.87Å
231L94.7Very high93.7Very high95 Ų95110.5 Ų110.550%0.49754%0.543SS..Hα-helixtrans-62.4-45.7176.8178.463.6000111H227 Q228 K229 T233 L234 Q235H227-L231 WeakPolarHBondContact O-CB 3.38Å; H227-L231 PolarHBondContact O-N 3.44Å; Q228-L231 PolarHBondContact O-N 3.18Å; K229-L231 PolarHBondContact O-N 3.48Å; L231-T233 VanDerWaalsContact C-N 3.32Å; L231-T233 PolarHBondContact O-N 3.43Å; L231-L234 PolarHBondContact O-N 2.83Å; L231-Q235 HydrophobicContact CD1-CG 4.2Å; L231-Q235 HydrophobicContact CG-CG 4.39Å; L231-Q235 WeakPolarHBondContact O-CB 3.35Å; L231-Q235 WeakPolarHBondContact O-CG 3.42Å; L231-Q235 PolarHBondContact O-N 3.3Å
232Q94.6Very high93.5Very high134 Ų134107.5 Ų107.563%0.62653%0.532SS*.Hα-helixtrans-60.1-43177.3-172.9177.417.100111.5Q228 K229 Q235 S236Q228-Q232 WeakPolarHBondContact O-CB 3.33Å; Q228-Q232 PolarHBondContact O-N 3.5Å; K229-Q232 PolarHBondContact O-N 3.03Å; Q232-Q235 PolarHBondContact O-N 2.91Å; Q232-S236 WeakPolarHBondContact O-CB 3.29Å; Q232-S236 PolarHBondContact O-N 2.99Å; Q232-S236 PolarHBondContact O-OG 2.87Å
233T93Very high93.1Very high87 Ų87107.9 Ų107.953%0.53454%0.537SS..Hα-helixtrans-61.3-47.3174.1-56.80000111.1K229 R230 L231 Q235 S236 V237K229-T233 PolarHBondContact O-N 3.41Å; K229-T233 PolarHBondContact O-OG1 3.15Å; K229-T233 VanDerWaalsContact O-OG1 3.07Å; R230-T233 PolarHBondContact O-N 3.05Å; L231-T233 VanDerWaalsContact C-N 3.32Å; L231-T233 PolarHBondContact O-N 3.43Å; T233-Q235 VanDerWaalsContact C-N 3.34Å; T233-Q235 PolarHBondContact O-N 3.21Å; T233-S236 PolarHBondContact O-N 3.41Å; T233-S236 PolarHBondContact O-OG 3.48Å; T233-V237 WeakPolarHBondContact O-CG2 3.42Å; T233-V237 PolarHBondContact O-N 3.07Å
234L90.2Very high92.9Very high112 Ų112111.7 Ų111.759%0.58655%0.552SS**Hα-helixtrans-60.4-41.5177.6-80.9167.6000112.6R230 L231 S236 V237R230-L234 HydrophobicContact CG-CD1 4.23Å; R230-L234 WeakPolarHBondContact O-CG 3.34Å; R230-L234 PolarHBondContact O-N 2.87Å; L231-L234 PolarHBondContact O-N 2.83Å; L234-S236 VanDerWaalsContact C-N 3.33Å; L234-V237 PolarHBondContact O-N 2.81Å
235Q89.1Confident92.8Very high147 Ų147113.6 Ų113.669%0.68755%0.554SS**Hα-helixtrans-68.4-32177.1-74.4177.8-2900112.8L231 Q232 T233 V237L231-Q235 HydrophobicContact CD1-CG 4.2Å; L231-Q235 HydrophobicContact CG-CG 4.39Å; L231-Q235 WeakPolarHBondContact O-CB 3.35Å; L231-Q235 WeakPolarHBondContact O-CG 3.42Å; L231-Q235 PolarHBondContact O-N 3.3Å; Q232-Q235 PolarHBondContact O-N 2.91Å; T233-Q235 VanDerWaalsContact C-N 3.34Å; T233-Q235 PolarHBondContact O-N 3.21Å; Q235-V237 VanDerWaalsContact C-N 3.25Å; Q235-V237 PolarHBondContact O-N 3.39Å
236S89.9Confident92.6Very high91 Ų91112.8 Ų112.864%0.63655%0.55SS*.Hα-helixtrans-72.5-21.5177.472.60000113.1Q232 T233 L234Q232-S236 WeakPolarHBondContact O-CB 3.29Å; Q232-S236 PolarHBondContact O-N 2.99Å; Q232-S236 PolarHBondContact O-OG 2.87Å; T233-S236 PolarHBondContact O-N 3.41Å; T233-S236 PolarHBondContact O-OG 3.48Å; L234-S236 VanDerWaalsContact C-N 3.33Å
237V89.6Confident92.6Very high92 Ų92112 Ų11256%0.55855%0.551SS**SBendtrans-91.6116.5-178.8177.90000108.9T233 L234 Q235T233-V237 WeakPolarHBondContact O-CG2 3.42Å; T233-V237 PolarHBondContact O-N 3.07Å; L234-V237 PolarHBondContact O-N 2.81Å; Q235-V237 VanDerWaalsContact C-N 3.25Å; Q235-V237 PolarHBondContact O-N 3.39Å
238R85.8Confident92.5Very high130 Ų130111.7 Ų111.749%0.49155%0.553SS.*PPolyproline II helixtrans-64.1126.4169.4-178.9172165.8123.1-8.5109A240 M242 D243 E246R238-A240 PolarHBondContact O-N 2.79Å; R238-M242 HydrophobicContact CG-CB 4.19Å; R238-D243 IonicContact CZ-OD1 3.77Å; R238-D243 IonicContact NE-OD1 3.9Å; R238-D243 PolarHBondContact NE-OD1 3.02Å; R238-D243 IonicContact NH2-OD1 2.73Å; R238-D243 PolarHBondContact NH2-OD1 3.33Å; R238-E246 IonicContact CZ-OE1 3.82Å; R238-E246 IonicContact CZ-OE2 3.2Å; R238-E246 IonicContact NH1-OE1 3.57Å; R238-E246 PolarHBondContact NH1-OE1 2.93Å; R238-E246 VanDerWaalsContact NH1-OE1 3.09Å; R238-E246 IonicContact NH1-OE2 3.8Å; R238-E246 IonicContact NH2-OE1 2.99Å; R238-E246 PolarHBondContact NH2-OE1 3.48Å; R238-E246 IonicContact NH2-OE2 2.85Å; R238-E246 PolarHBondContact NH2-OE2 3.41Å
239P90.1Very high92.5Very high59 Ų59111.2 Ų111.238%0.38355%0.551SS.*PPolyproline II helixtrans-60.9138.2178.1-20.429.2000111.7F241 M242P239-F241 HydrophobicContact CB-CD1 3.89Å; P239-F241 HydrophobicContact CB-CE1 3.4Å; P239-F241 VanDerWaalsContact CB-CE1 3.4Å; P239-F241 HydrophobicContact CB-CE2 4.08Å; P239-F241 HydrophobicContact CB-CG 4.42Å; P239-F241 HydrophobicContact CB-CZ 3.5Å; P239-F241 HydrophobicContact CG-CE1 4.37Å; P239-F241 HydrophobicContact CG-CZ 4.09Å; P239-F241 PolarHBondContact O-N 3.41Å; P239-M242 HydrophobicContact CB-CG 3.99Å; P239-M242 HydrophobicContact CG-CG 4.02Å; P239-M242 WeakPolarHBondContact O-CB 3.44Å; P239-M242 PolarHBondContact O-N 3.29Å
240A86.3Confident92.5Very high90 Ų90111.3 Ų111.374%0.74455%0.552SS**THydrogen-bonded Turntrans-60.6-29.4-174.300000113.8R238 M242R238-A240 PolarHBondContact O-N 2.79Å; A240-M242 VanDerWaalsContact C-N 3.3Å; A240-M242 PolarHBondContact O-N 3.03Å
241F89.5Confident92.6Very high134 Ų134107.2 Ų107.259%0.58854%0.541SS*.THydrogen-bonded Turntrans-77.6-11.4178.360.8-100.3000113.6P239 D243 E244 Y245P239-F241 HydrophobicContact CB-CD1 3.89Å; P239-F241 HydrophobicContact CB-CE1 3.4Å; P239-F241 VanDerWaalsContact CB-CE1 3.4Å; P239-F241 HydrophobicContact CB-CE2 4.08Å; P239-F241 HydrophobicContact CB-CG 4.42Å; P239-F241 HydrophobicContact CB-CZ 3.5Å; P239-F241 HydrophobicContact CG-CE1 4.37Å; P239-F241 HydrophobicContact CG-CZ 4.09Å; P239-F241 PolarHBondContact O-N 3.41Å; F241-D243 VanDerWaalsContact C-N 3.29Å; F241-D243 PolarHBondContact O-N 2.87Å; F241-E244 PolarHBondContact O-N 2.87Å; F241-Y245 WeakPolarHBondContact O-CB 3.32Å; F241-Y245 PolarHBondContact O-N 3.35Å
242M93.2Very high92.7Very high58 Ų58108.3 Ų108.329%0.28655%0.547SS..Hα-helixtrans-64.3-36-178.9-76-59-60.200112R238 P239 A240 E244 Y245 E246R238-M242 HydrophobicContact CG-CB 4.19Å; P239-M242 HydrophobicContact CB-CG 3.99Å; P239-M242 HydrophobicContact CG-CG 4.02Å; P239-M242 WeakPolarHBondContact O-CB 3.44Å; P239-M242 PolarHBondContact O-N 3.29Å; A240-M242 VanDerWaalsContact C-N 3.3Å; A240-M242 PolarHBondContact O-N 3.03Å; M242-E244 VanDerWaalsContact C-N 3.33Å; M242-Y245 PolarHBondContact O-N 3.22Å; M242-E246 WeakPolarHBondContact O-CG 3.48Å; M242-E246 PolarHBondContact O-N 2.84Å
243D90.6Very high92.8Very high96 Ų96107.8 Ų107.851%0.51354%0.544SS..Hα-helixtrans-67.9-36.7178.7-62.6-9.1000111.2R238 F241 K247R238-D243 IonicContact CZ-OD1 3.77Å; R238-D243 IonicContact NE-OD1 3.9Å; R238-D243 PolarHBondContact NE-OD1 3.02Å; R238-D243 IonicContact NH2-OD1 2.73Å; R238-D243 PolarHBondContact NH2-OD1 3.33Å; F241-D243 VanDerWaalsContact C-N 3.29Å; F241-D243 PolarHBondContact O-N 2.87Å; D243-K247 WeakPolarHBondContact O-CB 3.38Å; D243-K247 PolarHBondContact O-N 3.4Å; D243-K247 VanDerWaalsContact O-N 3.16Å
244E93.4Very high93Very high134 Ų134108.6 Ų108.663%0.62654%0.54SS*.Hα-helixtrans-69.7-40.2174.2-65.6-176.8176.300111.5F241 M242 K247 I248F241-E244 PolarHBondContact O-N 2.87Å; M242-E244 VanDerWaalsContact C-N 3.33Å; E244-K247 PolarHBondContact O-N 3.01Å; E244-I248 VanDerWaalsContact O-CG1 3.26Å; E244-I248 WeakPolarHBondContact O-CG1 3.32Å; E244-I248 PolarHBondContact O-N 3.49Å
245Y94.8Very high93.3Very high138 Ų138108.4 Ų108.454%0.54154%0.536SS..Hα-helixtrans-59.5-53.1175.7178.4-90.1000111.7F241 M242 K247 I248 E249F241-Y245 WeakPolarHBondContact O-CB 3.32Å; F241-Y245 PolarHBondContact O-N 3.35Å; M242-Y245 PolarHBondContact O-N 3.22Å; Y245-K247 VanDerWaalsContact C-N 3.27Å; Y245-K247 PolarHBondContact O-N 3.26Å; Y245-I248 PolarHBondContact O-N 3.46Å; Y245-I248 VanDerWaalsContact O-N 3.12Å; Y245-E249 WeakPolarHBondContact O-CB 3.44Å; Y245-E249 PolarHBondContact O-N 2.95Å
246E95.5Very high93.7Very high76 Ų76108.4 Ų108.436%0.35553%0.531SS..Hα-helixtrans-59.5-39.2179-73.2174.7-168.500111.1R238 M242 E249 E250R238-E246 IonicContact CZ-OE1 3.82Å; R238-E246 IonicContact CZ-OE2 3.2Å; R238-E246 IonicContact NH1-OE1 3.57Å; R238-E246 PolarHBondContact NH1-OE1 2.93Å; R238-E246 VanDerWaalsContact NH1-OE1 3.09Å; R238-E246 IonicContact NH1-OE2 3.8Å; R238-E246 IonicContact NH2-OE1 2.99Å; R238-E246 PolarHBondContact NH2-OE1 3.48Å; R238-E246 IonicContact NH2-OE2 2.85Å; R238-E246 PolarHBondContact NH2-OE2 3.41Å; M242-E246 WeakPolarHBondContact O-CG 3.48Å; M242-E246 PolarHBondContact O-N 2.84Å; E246-E249 PolarHBondContact O-N 3.04Å; E246-E250 PolarHBondContact O-N 3.3Å
247K96.1Very high94.1Very high157 Ų157110.1 Ų110.168%0.68353%0.529SS*.Hα-helixtrans-64.4-41.7175.8-174.3-179.4-178.8-177.20112.7D243 E244 Y245 E249 E251D243-K247 WeakPolarHBondContact O-CB 3.38Å; D243-K247 PolarHBondContact O-N 3.4Å; D243-K247 VanDerWaalsContact O-N 3.16Å; E244-K247 PolarHBondContact O-N 3.01Å; Y245-K247 VanDerWaalsContact C-N 3.27Å; Y245-K247 PolarHBondContact O-N 3.26Å; K247-E249 VanDerWaalsContact C-N 3.34Å; K247-E251 PolarHBondContact O-N 3.15Å; K247-E251 VanDerWaalsContact O-N 3.09Å
248I96.8Very high94.5Very high118 Ų118108.4 Ų108.461%0.60552%0.519SS*.Hα-helixtrans-68.2-38177.1-70167000110.3E244 Y245 E251 L252E244-I248 VanDerWaalsContact O-CG1 3.26Å; E244-I248 WeakPolarHBondContact O-CG1 3.32Å; E244-I248 PolarHBondContact O-N 3.49Å; Y245-I248 PolarHBondContact O-N 3.46Å; Y245-I248 VanDerWaalsContact O-N 3.12Å; I248-E251 PolarHBondContact O-N 3.35Å; I248-L252 WeakPolarHBondContact O-CB 3.49Å; I248-L252 PolarHBondContact O-N 3.31Å
249E96.6Very high95.1Very high105 Ų105107.8 Ų107.849%0.49152%0.52SS..Hα-helixtrans-61.9-46.5175.8-169.6-176.8-167.800111.5Y245 E246 K247 E251 L252 Q253Y245-E249 WeakPolarHBondContact O-CB 3.44Å; Y245-E249 PolarHBondContact O-N 2.95Å; E246-E249 PolarHBondContact O-N 3.04Å; K247-E249 VanDerWaalsContact C-N 3.34Å; E249-E251 VanDerWaalsContact C-N 3.32Å; E249-E251 PolarHBondContact O-N 2.95Å; E249-L252 WeakPolarHBondContact O-CB 3.36Å; E249-L252 PolarHBondContact O-N 3Å; E249-Q253 PolarHBondContact O-N 3.14Å
250E97.3Very high95.4Very high112 Ų112106.8 Ų106.852%0.52351%0.512SS..Hα-helixtrans-60.2-41.4174.3-78-171.1-177.900112.3E246 Q253 K254E246-E250 PolarHBondContact O-N 3.3Å; E250-Q253 PolarHBondContact O-N 2.88Å; E250-K254 WeakPolarHBondContact O-CG 3.39Å; E250-K254 PolarHBondContact O-N 3.37Å; E250-K254 VanDerWaalsContact O-N 3.13Å
251E96.9Very high96Very high86 Ų86108.3 Ų108.340%0.40250%0.504SS..Hα-helixtrans-66.6-42.2177.6-172.957.5-148.400111.1K247 I248 E249 Q253 K254 Q255K247-E251 PolarHBondContact O-N 3.15Å; K247-E251 VanDerWaalsContact O-N 3.09Å; I248-E251 PolarHBondContact O-N 3.35Å; E249-E251 VanDerWaalsContact C-N 3.32Å; E249-E251 PolarHBondContact O-N 2.95Å; E251-Q253 VanDerWaalsContact C-N 3.27Å; E251-Q253 PolarHBondContact O-N 3.45Å; E251-K254 PolarHBondContact O-N 3.06Å; E251-Q255 HydrophobicContact CG-CG 4.47Å; E251-Q255 WeakPolarHBondContact O-CG 3.48Å; E251-Q255 PolarHBondContact O-N 3.36Å; E251-Q255 PolarHBondContact OE1-NE2 3.37Å
252L97.1Very high96.3Very high119 Ų119108.8 Ų108.862%0.62351%0.506SS*.Hα-helixtrans-58-42.3175.1179.864.8000111.2I248 E249 Q255 Y256I248-L252 WeakPolarHBondContact O-CB 3.49Å; I248-L252 PolarHBondContact O-N 3.31Å; E249-L252 WeakPolarHBondContact O-CB 3.36Å; E249-L252 PolarHBondContact O-N 3Å; L252-Q255 PolarHBondContact O-N 2.98Å; L252-Y256 WeakPolarHBondContact O-CB 3.48Å; L252-Y256 PolarHBondContact O-N 2.82Å
253Q97.1Very high96.6Very high123 Ų123111.4 Ų111.458%0.57552%0.516SS*.Hα-helixtrans-62.1-45.1177.9-167.8171.1200111.8E249 E250 E251 Q255 Y256 E257E249-Q253 PolarHBondContact O-N 3.14Å; E250-Q253 PolarHBondContact O-N 2.88Å; E251-Q253 VanDerWaalsContact C-N 3.27Å; E251-Q253 PolarHBondContact O-N 3.45Å; Q253-Q255 PolarHBondContact O-N 3.27Å; Q253-Y256 PolarHBondContact O-N 3.32Å; Q253-E257 PolarHBondContact O-N 2.89Å; Q253-E257 VanDerWaalsContact O-N 3.07Å
254K97.6Very high96.9Very high104 Ų104115.2 Ų115.245%0.45252%0.523SS..Hα-helixtrans-61.7-44.3175.1-68168.3-167.5157.50111.9E250 E251 Y256 E257 V258E250-K254 WeakPolarHBondContact O-CG 3.39Å; E250-K254 PolarHBondContact O-N 3.37Å; E250-K254 VanDerWaalsContact O-N 3.13Å; E251-K254 PolarHBondContact O-N 3.06Å; K254-Y256 VanDerWaalsContact C-N 3.3Å; K254-Y256 PolarHBondContact O-N 3.45Å; K254-E257 PolarHBondContact O-N 3.15Å; K254-V258 WeakPolarHBondContact O-CG2 3.43Å; K254-V258 PolarHBondContact O-N 2.99Å
255Q97Very high97.1Very high107 Ų107113 Ų11350%0.552%0.516SS..Hα-helixtrans-64.6-36.7178-66.8-58.6-29.900111.8E251 L252 Q253 V258 F259E251-Q255 HydrophobicContact CG-CG 4.47Å; E251-Q255 WeakPolarHBondContact O-CG 3.48Å; E251-Q255 PolarHBondContact O-N 3.36Å; E251-Q255 PolarHBondContact OE1-NE2 3.37Å; L252-Q255 PolarHBondContact O-N 2.98Å; Q253-Q255 PolarHBondContact O-N 3.27Å; Q255-V258 PolarHBondContact O-N 2.91Å; Q255-F259 WeakPolarHBondContact O-CB 3.25Å; Q255-F259 PolarHBondContact O-N 2.89Å
256Y97.6Very high97.2Very high148 Ų148110.6 Ų110.658%0.5851%0.512SS*.Hα-helixtrans-65-41.7176.3-174.5-103.6000112.1L252 Q253 K254 V258 F259 V260L252-Y256 WeakPolarHBondContact O-CB 3.48Å; L252-Y256 PolarHBondContact O-N 2.82Å; Q253-Y256 PolarHBondContact O-N 3.32Å; K254-Y256 VanDerWaalsContact C-N 3.3Å; K254-Y256 PolarHBondContact O-N 3.45Å; Y256-V258 PolarHBondContact O-N 3.35Å; Y256-F259 HydrophobicContact CD2-CD1 4.4Å; Y256-F259 HydrophobicContact CE2-CD1 4.38Å; Y256-F259 WeakPolarHBondContact O-CB 3.42Å; Y256-F259 PolarHBondContact O-N 2.79Å; Y256-V260 HydrophobicContact CD1-CG2 4.12Å; Y256-V260 HydrophobicContact CE1-CG2 3.7Å; Y256-V260 HydrophobicContact CE2-CG2 4.26Å; Y256-V260 WeakPolarHBondContact O-CG2 3.42Å; Y256-V260 PolarHBondContact O-N 3.35Å
257E97.5Very high97.3Very high127 Ų127110 Ų11059%0.59351%0.513SS*.Hα-helixtrans-58.5-48.1174.6-74-179.7177.900111.8Q253 K254 F259 V260 E261Q253-E257 PolarHBondContact O-N 2.89Å; Q253-E257 VanDerWaalsContact O-N 3.07Å; K254-E257 PolarHBondContact O-N 3.15Å; E257-F259 VanDerWaalsContact C-N 3.31Å; E257-F259 PolarHBondContact O-N 3.02Å; E257-V260 PolarHBondContact O-N 3.41Å; E257-E261 PolarHBondContact O-N 3.27Å
258V97.5Very high97.4Very high56 Ų56109.3 Ų109.334%0.33951%0.507SS..Hα-helixtrans-62.1-40.5177175.30000111.2K254 Q255 Y256 E261 K262K254-V258 WeakPolarHBondContact O-CG2 3.43Å; K254-V258 PolarHBondContact O-N 2.99Å; Q255-V258 PolarHBondContact O-N 2.91Å; Y256-V258 PolarHBondContact O-N 3.35Å; V258-E261 PolarHBondContact O-N 3.49Å; V258-K262 HydrophobicContact CG1-CD 4.04Å; V258-K262 HydrophobicContact CG1-CG 4.44Å; V258-K262 WeakPolarHBondContact O-CB 3.34Å; V258-K262 WeakPolarHBondContact O-CG 3.18Å; V258-K262 PolarHBondContact O-N 2.93Å
259F98Very high97.4Very high117 Ų117108.8 Ų108.851%0.51351%0.505SS..Hα-helixtrans-60.3-47.7175.8168.7-97.5000111.4Q255 Y256 E257 E261 K262 F263Q255-F259 WeakPolarHBondContact O-CB 3.25Å; Q255-F259 PolarHBondContact O-N 2.89Å; Y256-F259 HydrophobicContact CD2-CD1 4.4Å; Y256-F259 HydrophobicContact CE2-CD1 4.38Å; Y256-F259 WeakPolarHBondContact O-CB 3.42Å; Y256-F259 PolarHBondContact O-N 2.79Å; E257-F259 VanDerWaalsContact C-N 3.31Å; E257-F259 PolarHBondContact O-N 3.02Å; F259-E261 VanDerWaalsContact C-N 3.33Å; F259-E261 PolarHBondContact O-N 3.08Å; F259-K262 PolarHBondContact O-N 3.33Å; F259-F263 HydrophobicContact CZ-CB 4.45Å; F259-F263 HydrophobicContact CZ-CD2 4.26Å; F259-F263 WeakPolarHBondContact O-CB 3.29Å; F259-F263 PolarHBondContact O-N 3.36Å
260V98.1Very high97.4Very high37 Ų37108.5 Ų108.522%0.22450%0.504CS..Hα-helixtrans-61.8-41.6179.9171.20000111.2Y256 E257 F263 R264Y256-V260 HydrophobicContact CD1-CG2 4.12Å; Y256-V260 HydrophobicContact CE1-CG2 3.7Å; Y256-V260 HydrophobicContact CE2-CG2 4.26Å; Y256-V260 WeakPolarHBondContact O-CG2 3.42Å; Y256-V260 PolarHBondContact O-N 3.35Å; E257-V260 PolarHBondContact O-N 3.41Å; V260-F263 PolarHBondContact O-N 3.38Å; V260-R264 WeakPolarHBondContact O-CG 3.4Å; V260-R264 PolarHBondContact O-N 2.98Å
261E97.5Very high97.3Very high123 Ų123106.2 Ų106.258%0.57550%0.5SS*.Hα-helixtrans-63.3-49.3176.7-171.8-178.5-174.300111.5E257 V258 F259 F263 R264 N265E257-E261 PolarHBondContact O-N 3.27Å; V258-E261 PolarHBondContact O-N 3.49Å; F259-E261 VanDerWaalsContact C-N 3.33Å; F259-E261 PolarHBondContact O-N 3.08Å; E261-F263 VanDerWaalsContact C-N 3.31Å; E261-F263 PolarHBondContact O-N 2.9Å; E261-R264 PolarHBondContact O-N 3.47Å; E261-N265 VanDerWaalsContact O-CG 3.31Å; E261-N265 PolarHBondContact O-N 3.35Å; E261-N265 PolarHBondContact O-ND2 3.38Å
262K97.1Very high97.3Very high144 Ų144106.7 Ų106.763%0.62650%0.503SS*.Hα-helixtrans-61.4-40.9177.2-73.7179.4-180176.80112V258 F259 N265 L266V258-K262 HydrophobicContact CG1-CD 4.04Å; V258-K262 HydrophobicContact CG1-CG 4.44Å; V258-K262 WeakPolarHBondContact O-CB 3.34Å; V258-K262 WeakPolarHBondContact O-CG 3.18Å; V258-K262 PolarHBondContact O-N 2.93Å; F259-K262 PolarHBondContact O-N 3.33Å; K262-N265 PolarHBondContact O-N 2.82Å; K262-L266 WeakPolarHBondContact O-CB 3.29Å; K262-L266 PolarHBondContact O-N 2.98Å
263F97.9Very high97.2Very high113 Ų113105.6 Ų105.650%0.49650%0.497SS..Hα-helixtrans-62-47.3177.3-177.1-96.1000111F259 V260 E261 N265 L266 T267F259-F263 HydrophobicContact CZ-CB 4.45Å; F259-F263 HydrophobicContact CZ-CD2 4.26Å; F259-F263 WeakPolarHBondContact O-CB 3.29Å; F259-F263 PolarHBondContact O-N 3.36Å; V260-F263 PolarHBondContact O-N 3.38Å; E261-F263 VanDerWaalsContact C-N 3.31Å; E261-F263 PolarHBondContact O-N 2.9Å; F263-N265 VanDerWaalsContact C-N 3.34Å; F263-N265 PolarHBondContact O-N 2.76Å; F263-L266 PolarHBondContact O-N 3Å; F263-T267 PolarHBondContact O-N 3.23Å; F263-T267 PolarHBondContact O-OG1 3.19Å
264R97.9Very high97.2Very high176 Ų176104.2 Ų104.266%0.66449%0.493SS*.Hα-helixtrans-58.1-45.8174.8-76.1175.5179.8175.62.3112.2V260 E261 T267 Y268V260-R264 WeakPolarHBondContact O-CG 3.4Å; V260-R264 PolarHBondContact O-N 2.98Å; E261-R264 PolarHBondContact O-N 3.47Å; R264-T267 PolarHBondContact O-N 3.1Å; R264-Y268 WeakPolarHBondContact O-CB 3.27Å; R264-Y268 PolarHBondContact O-N 3.49Å
265N97.1Very high97.2Very high87 Ų87104.4 Ų104.447%0.46550%0.496SS..Hα-helixtrans-63.2-42.4178.3-70.1-18.9000111.5E261 K262 F263 Y268 L269E261-N265 VanDerWaalsContact O-CG 3.31Å; E261-N265 PolarHBondContact O-N 3.35Å; E261-N265 PolarHBondContact O-ND2 3.38Å; K262-N265 PolarHBondContact O-N 2.82Å; F263-N265 VanDerWaalsContact C-N 3.34Å; F263-N265 PolarHBondContact O-N 2.76Å; N265-Y268 PolarHBondContact O-N 3.23Å; N265-L269 VanDerWaalsContact O-CG 3.32Å; N265-L269 WeakPolarHBondContact O-CG 3.38Å; N265-L269 PolarHBondContact O-N 2.91Å
266L97.3Very high97.1Very high88 Ų88105.7 Ų105.746%0.46150%0.497SS..Hα-helixtrans-61.8-52.1176.7-179.964.9000111K262 F263 Y268 L269 E270K262-L266 WeakPolarHBondContact O-CB 3.29Å; K262-L266 PolarHBondContact O-N 2.98Å; F263-L266 PolarHBondContact O-N 3Å; L266-Y268 PolarHBondContact O-N 3.13Å; L266-L269 PolarHBondContact O-N 3.29Å; L266-L269 VanDerWaalsContact O-N 3.08Å; L266-E270 HydrophobicContact CD1-CG 4.23Å; L266-E270 HydrophobicContact CG-CG 4.34Å; L266-E270 WeakPolarHBondContact O-CB 3.49Å; L266-E270 WeakPolarHBondContact O-CG 3.31Å; L266-E270 PolarHBondContact O-N 3.49Å
267T97.1Very high97Very high62 Ų62103.5 Ų103.538%0.3849%0.492SS..Hα-helixtrans-57.5-37.7178.2-55.70000111.9F263 R264 S271F263-T267 PolarHBondContact O-N 3.23Å; F263-T267 PolarHBondContact O-OG1 3.19Å; R264-T267 PolarHBondContact O-N 3.1Å; T267-S271 WeakPolarHBondContact O-CB 3.49Å; T267-S271 PolarHBondContact O-N 3.27Å
268Y97.6Very high97Very high143 Ų143104.5 Ų104.556%0.56149%0.49SS*.Hα-helixtrans-65.8-45.3175.6178.1-106.5000112.6R264 N265 L266 S271 Q272R264-Y268 WeakPolarHBondContact O-CB 3.27Å; R264-Y268 PolarHBondContact O-N 3.49Å; N265-Y268 PolarHBondContact O-N 3.23Å; L266-Y268 PolarHBondContact O-N 3.13Å; Y268-S271 PolarHBondContact O-N 3.15Å; Y268-Q272 HydrophobicContact CE1-CG 4.31Å; Y268-Q272 PolarHBondContact O-N 2.94Å; Y268-Q272 PolarHBondContact OH-NE2 3.4Å
269L97.3Very high96.9Very high108 Ų108106.8 Ų106.857%0.56550%0.5SS*.Hα-helixtrans-66.6-40.5178.2-70.8172.1000112N265 L266 S271 Q272 L273N265-L269 VanDerWaalsContact O-CG 3.32Å; N265-L269 WeakPolarHBondContact O-CG 3.38Å; N265-L269 PolarHBondContact O-N 2.91Å; L266-L269 PolarHBondContact O-N 3.29Å; L266-L269 VanDerWaalsContact O-N 3.08Å; L269-S271 VanDerWaalsContact C-N 3.34Å; L269-Q272 PolarHBondContact O-N 2.97Å; L269-L273 WeakPolarHBondContact O-CB 3.34Å; L269-L273 PolarHBondContact O-N 3.43Å
270E96.2Very high96.7Very high99 Ų99104.7 Ų104.746%0.46349%0.491SS..Hα-helixtrans-58.5-46.6172.9-72.4173.3159.900110.6L266 Q272 L273 D274L266-E270 HydrophobicContact CD1-CG 4.23Å; L266-E270 HydrophobicContact CG-CG 4.34Å; L266-E270 WeakPolarHBondContact O-CB 3.49Å; L266-E270 WeakPolarHBondContact O-CG 3.31Å; L266-E270 PolarHBondContact O-N 3.49Å; E270-Q272 PolarHBondContact O-N 3.35Å; E270-L273 WeakPolarHBondContact O-CB 3.34Å; E270-L273 PolarHBondContact O-N 3.29Å; E270-D274 PolarHBondContact O-N 2.93Å
271S96.4Very high96.4Very high64 Ų64108.3 Ų108.345%0.44851%0.506SS..Hα-helixtrans-60.6-41.1176-177.70000113T267 Y268 L269 E275T267-S271 WeakPolarHBondContact O-CB 3.49Å; T267-S271 PolarHBondContact O-N 3.27Å; Y268-S271 PolarHBondContact O-N 3.15Å; L269-S271 VanDerWaalsContact C-N 3.34Å; S271-E275 WeakPolarHBondContact O-CB 3.23Å; S271-E275 PolarHBondContact O-N 2.97Å; S271-E275 VanDerWaalsContact O-N 3.1Å
272Q96.8Very high96.2Very high96 Ų96106.1 Ų106.145%0.44950%0.498SS..Hα-helixtrans-66.9-38.8176.3-80.8-1503400112.1Y268 L269 E270 E275 Y276Y268-Q272 HydrophobicContact CE1-CG 4.31Å; Y268-Q272 PolarHBondContact O-N 2.94Å; Y268-Q272 PolarHBondContact OH-NE2 3.4Å; L269-Q272 PolarHBondContact O-N 2.97Å; E270-Q272 PolarHBondContact O-N 3.35Å; Q272-E275 PolarHBondContact O-N 2.75Å; Q272-Y276 PolarHBondContact O-N 3.4Å
273L95.6Very high96Very high96 Ų96106.7 Ų106.750%0.50350%0.496SS..Hα-helixtrans-63.6-44.3177.4-167.283000110.7L269 E270 E275 Y276 H277L269-L273 WeakPolarHBondContact O-CB 3.34Å; L269-L273 PolarHBondContact O-N 3.43Å; E270-L273 WeakPolarHBondContact O-CB 3.34Å; E270-L273 PolarHBondContact O-N 3.29Å; L273-E275 VanDerWaalsContact C-N 3.27Å; L273-E275 PolarHBondContact O-N 2.96Å; L273-Y276 PolarHBondContact O-N 3.25Å; L273-H277 PolarHBondContact O-N 3.25Å
274D96.5Very high95.6Very high93 Ų93108 Ų10850%0.49750%0.502SS..Hα-helixtrans-62.4-35176.1-74.8-15.5000112.4E270 R278E270-D274 PolarHBondContact O-N 2.93Å; D274-R278 WeakPolarHBondContact O-CB 3.26Å; D274-R278 PolarHBondContact O-N 3.43Å; D274-R278 VanDerWaalsContact O-N 3.08Å
275E96.4Very high95.3Very high108 Ų108103.7 Ų103.751%0.50549%0.49SS..Hα-helixtrans-73-39.7175.9-166155.2-153.900111.9S271 Q272 L273 R278 L279S271-E275 WeakPolarHBondContact O-CB 3.23Å; S271-E275 PolarHBondContact O-N 2.97Å; S271-E275 VanDerWaalsContact O-N 3.1Å; Q272-E275 PolarHBondContact O-N 2.75Å; L273-E275 VanDerWaalsContact C-N 3.27Å; L273-E275 PolarHBondContact O-N 2.96Å; E275-R278 WeakPolarHBondContact O-CB 3.49Å; E275-R278 PolarHBondContact O-N 3.39Å; E275-L279 WeakPolarHBondContact O-CG 3.29Å; E275-L279 PolarHBondContact O-N 3.38Å
276Y96.3Very high95.1Very high134 Ų134105.6 Ų105.653%0.52550%0.496SS..Hα-helixtrans-61.1-47.3172.4-179.8-95.2000111.8Q272 L273 R278 L279 E280Q272-Y276 PolarHBondContact O-N 3.4Å; L273-Y276 PolarHBondContact O-N 3.25Å; Y276-R278 VanDerWaalsContact C-N 3.3Å; Y276-R278 PolarHBondContact O-N 2.82Å; Y276-L279 PolarHBondContact O-N 2.96Å; Y276-E280 PolarHBondContact O-N 3.41Å; Y276-E280 PolarHBondContact OH-OE2 3.41Å
277H95.8Very high94.6Very high102 Ų102104.3 Ų104.347%0.47250%0.498SS..Hα-helixtrans-60.9-38.9176.3-69.9160.9000112.2L273 E280 Q281L273-H277 PolarHBondContact O-N 3.25Å; H277-E280 PolarHBondContact O-N 2.97Å; H277-Q281 VanDerWaalsContact O-CB 3.31Å; H277-Q281 WeakPolarHBondContact O-CB 3.47Å; H277-Q281 PolarHBondContact O-N 3.36Å
278R96.1Very high94.3Very high149 Ų149105.5 Ų105.556%0.56250%0.499SS*.Hα-helixtrans-60.6-49.5173.5-112.3-178.2-68.8178.60.2112.1D274 E275 Y276 E280 Q281 D282D274-R278 WeakPolarHBondContact O-CB 3.26Å; D274-R278 PolarHBondContact O-N 3.43Å; D274-R278 VanDerWaalsContact O-N 3.08Å; E275-R278 WeakPolarHBondContact O-CB 3.49Å; E275-R278 PolarHBondContact O-N 3.39Å; Y276-R278 VanDerWaalsContact C-N 3.3Å; Y276-R278 PolarHBondContact O-N 2.82Å; R278-E280 VanDerWaalsContact C-N 3.35Å; R278-E280 PolarHBondContact O-N 3.13Å; R278-Q281 PolarHBondContact O-N 2.94Å; R278-D282 VanDerWaalsContact O-CG 3.29Å; R278-D282 PolarHBondContact O-N 3.37Å
279L95.4Very high93.8Very high103 Ų103102.3 Ų102.354%0.53949%0.491SS..Hα-helixtrans-63.5-39.7179.6-71.9172.3000112.4E275 Y276 Q281 D282 R283E275-L279 WeakPolarHBondContact O-CG 3.29Å; E275-L279 PolarHBondContact O-N 3.38Å; Y276-L279 PolarHBondContact O-N 2.96Å; L279-Q281 VanDerWaalsContact C-N 3.32Å; L279-D282 PolarHBondContact O-N 2.94Å; L279-R283 WeakPolarHBondContact O-CB 3.46Å; L279-R283 VanDerWaalsContact O-CG 3.28Å; L279-R283 WeakPolarHBondContact O-CG 3.27Å; L279-R283 PolarHBondContact O-N 2.95Å
280E93.4Very high93.4Very high73 Ų73101.1 Ų101.134%0.34149%0.492SS..Hα-helixtrans-66.5-38.2176.6-16069.5-126.100111.1Y276 H277 R278 R283 F284Y276-E280 PolarHBondContact O-N 3.41Å; Y276-E280 PolarHBondContact OH-OE2 3.41Å; H277-E280 PolarHBondContact O-N 2.97Å; R278-E280 VanDerWaalsContact C-N 3.35Å; R278-E280 PolarHBondContact O-N 3.13Å; E280-R283 PolarHBondContact O-N 3.48Å; E280-R283 IonicContact OE1-NH1 3.39Å; E280-R283 PolarHBondContact OE1-NH1 2.92Å; E280-R283 IonicContact OE2-NH1 3.93Å; E280-F284 WeakPolarHBondContact O-CB 3.44Å; E280-F284 PolarHBondContact O-N 3.02Å
281Q93Very high92.7Very high113 Ų113102.1 Ų102.153%0.52850%0.499SS..Hα-helixtrans-65.1-46.9174.3-176.2169.3-9.700111.7H277 R278 L279 R283 F284 E285H277-Q281 VanDerWaalsContact O-CB 3.31Å; H277-Q281 WeakPolarHBondContact O-CB 3.47Å; H277-Q281 PolarHBondContact O-N 3.36Å; R278-Q281 PolarHBondContact O-N 2.94Å; L279-Q281 VanDerWaalsContact C-N 3.32Å; Q281-R283 VanDerWaalsContact C-N 3.3Å; Q281-R283 PolarHBondContact O-N 2.97Å; Q281-F284 WeakPolarHBondContact O-CB 3.22Å; Q281-F284 PolarHBondContact O-N 3.33Å; Q281-F284 VanDerWaalsContact O-N 3.1Å; Q281-E285 HydrophobicContact CG-CG 4.46Å; Q281-E285 WeakPolarHBondContact CG-OE1 3.3Å; Q281-E285 PolarHBondContact NE2-OE1 3.24Å; Q281-E285 WeakPolarHBondContact O-CG 3.24Å; Q281-E285 PolarHBondContact O-N 3.34Å
282D93.6Very high92.3Very high77 Ų77105.3 Ų105.341%0.41250%0.501SS..Hα-helixtrans-57.4-44175.9-68.9-18.7000110.9R278 L279 F284 E285 E286R278-D282 VanDerWaalsContact O-CG 3.29Å; R278-D282 PolarHBondContact O-N 3.37Å; L279-D282 PolarHBondContact O-N 2.94Å; D282-F284 VanDerWaalsContact C-N 3.35Å; D282-F284 PolarHBondContact O-N 3.32Å; D282-E285 PolarHBondContact O-N 3.39Å; D282-E286 WeakPolarHBondContact O-CB 3.44Å; D282-E286 VanDerWaalsContact O-CG 3.32Å; D282-E286 WeakPolarHBondContact O-CG 2.92Å; D282-E286 PolarHBondContact O-N 3.36Å
283R91.8Very high91.8Very high156 Ų156105.1 Ų105.159%0.58950%0.503SS*.Hα-helixtrans-64.1-38.6176.1-74.5-179.369.4-145.4-3.2112.8L279 E280 Q281 A287L279-R283 WeakPolarHBondContact O-CB 3.46Å; L279-R283 VanDerWaalsContact O-CG 3.28Å; L279-R283 WeakPolarHBondContact O-CG 3.27Å; L279-R283 PolarHBondContact O-N 2.95Å; E280-R283 PolarHBondContact O-N 3.48Å; E280-R283 IonicContact OE1-NH1 3.39Å; E280-R283 PolarHBondContact OE1-NH1 2.92Å; E280-R283 IonicContact OE2-NH1 3.93Å; Q281-R283 VanDerWaalsContact C-N 3.3Å; Q281-R283 PolarHBondContact O-N 2.97Å; R283-A287 WeakPolarHBondContact O-CB 3.46Å; R283-A287 PolarHBondContact O-N 3.24Å
284F90Very high91.1Very high141 Ų141106.4 Ų106.462%0.61851%0.508SS*.Hα-helixtrans-65.2-45.1175.9-174.7-91.9000110.7E280 Q281 D282 A287 E288E280-F284 WeakPolarHBondContact O-CB 3.44Å; E280-F284 PolarHBondContact O-N 3.02Å; Q281-F284 WeakPolarHBondContact O-CB 3.22Å; Q281-F284 PolarHBondContact O-N 3.33Å; Q281-F284 VanDerWaalsContact O-N 3.1Å; D282-F284 VanDerWaalsContact C-N 3.35Å; D282-F284 PolarHBondContact O-N 3.32Å; F284-A287 PolarHBondContact O-N 3.27Å; F284-E288 WeakPolarHBondContact O-CB 3.48Å; F284-E288 PolarHBondContact O-N 3.39Å
285E92.4Very high90.3Very high86 Ų86106.5 Ų106.540%0.40251%0.505SS..Hα-helixtrans-63.9-40.6176.5-70.2177.6-165.300112Q281 D282 E288 N289Q281-E285 HydrophobicContact CG-CG 4.46Å; Q281-E285 WeakPolarHBondContact CG-OE1 3.3Å; Q281-E285 PolarHBondContact NE2-OE1 3.24Å; Q281-E285 WeakPolarHBondContact O-CG 3.24Å; Q281-E285 PolarHBondContact O-N 3.34Å; D282-E285 PolarHBondContact O-N 3.39Å; E285-E288 PolarHBondContact O-N 2.84Å; E285-N289 VanDerWaalsContact O-CB 3.29Å; E285-N289 WeakPolarHBondContact O-CB 3.41Å; E285-N289 VanDerWaalsContact O-CG 3.29Å; E285-N289 PolarHBondContact O-N 3.5Å; E285-N289 PolarHBondContact O-ND2 3.32Å; E285-N289 VanDerWaalsContact O-ND2 3.17Å
286E91.8Very high89.6Confident127 Ų127106.8 Ų106.859%0.59351%0.506SS*.Hα-helixtrans-61.1-46.3172.4-76.9178.5176.500111.9D282 N289 C290D282-E286 WeakPolarHBondContact O-CB 3.44Å; D282-E286 VanDerWaalsContact O-CG 3.32Å; D282-E286 WeakPolarHBondContact O-CG 2.92Å; D282-E286 PolarHBondContact O-N 3.36Å; E286-N289 PolarHBondContact O-N 2.86Å; E286-C290 PolarHBondContact O-N 3.49Å; E286-C290 PolarHBondContact O-SG 2.69Å
287A87.8Confident88.9Confident60 Ų60106 Ų10650%0.49651%0.505SS..Hα-helixtrans-65-41.6177.800000111.9R283 F284 C290 L291R283-A287 WeakPolarHBondContact O-CB 3.46Å; R283-A287 PolarHBondContact O-N 3.24Å; F284-A287 PolarHBondContact O-N 3.27Å; A287-C290 PolarHBondContact O-N 3.18Å; A287-L291 WeakPolarHBondContact O-CB 3.29Å; A287-L291 PolarHBondContact O-N 3.5Å
288E89.6Confident88Confident88 Ų88105.6 Ų105.641%0.41151%0.506SS..Hα-helixtrans-62.1-44.9174.4-163.4-162.314700110.9F284 E285 C290 L291 R292F284-E288 WeakPolarHBondContact O-CB 3.48Å; F284-E288 PolarHBondContact O-N 3.39Å; E285-E288 PolarHBondContact O-N 2.84Å; E288-C290 PolarHBondContact O-N 2.98Å; E288-L291 PolarHBondContact O-N 2.85Å; E288-R292 VanDerWaalsContact O-CB 3.29Å; E288-R292 WeakPolarHBondContact O-CB 3.39Å; E288-R292 PolarHBondContact O-N 3.48Å; E288-R292 IonicContact OE1-CZ 3.82Å; E288-R292 IonicContact OE1-NH2 2.73Å; E288-R292 PolarHBondContact OE1-NH2 3.35Å
289N88Confident87.2Confident75 Ų75105.4 Ų105.440%0.40151%0.505SS..Hα-helixtrans-61.5-43.5175.4-80.6-35.4000111.9E285 E286 L291 R292 I293E285-N289 VanDerWaalsContact O-CB 3.29Å; E285-N289 WeakPolarHBondContact O-CB 3.41Å; E285-N289 VanDerWaalsContact O-CG 3.29Å; E285-N289 PolarHBondContact O-N 3.5Å; E285-N289 PolarHBondContact O-ND2 3.32Å; E285-N289 VanDerWaalsContact O-ND2 3.17Å; E286-N289 PolarHBondContact O-N 2.86Å; N289-L291 PolarHBondContact O-N 3.49Å; N289-R292 PolarHBondContact O-N 2.93Å; N289-R292 PolarHBondContact OD1-NH1 3.35Å; N289-I293 VanDerWaalsContact O-CG1 3.25Å; N289-I293 WeakPolarHBondContact O-CG1 3.44Å; N289-I293 PolarHBondContact O-N 3.18Å
290C87.6Confident86.3Confident84 Ų84104.6 Ų104.657%0.56850%0.499SS*.Hα-helixtrans-60.8-44174-77.20000112.2E286 A287 E288 R292 I293 M294E286-C290 PolarHBondContact O-N 3.49Å; E286-C290 PolarHBondContact O-SG 2.69Å; A287-C290 PolarHBondContact O-N 3.18Å; E288-C290 PolarHBondContact O-N 2.98Å; C290-R292 VanDerWaalsContact C-N 3.34Å; C290-I293 PolarHBondContact O-N 3.44Å; C290-M294 WeakPolarHBondContact O-CB 3.49Å; C290-M294 PolarHBondContact O-N 3Å
291L82.9Confident85.3Confident119 Ų119106.4 Ų106.462%0.62351%0.507SS*.Hα-helixtrans-65-40.3178.2-158.5111.5000111.1A287 E288 N289 M294 Q295A287-L291 WeakPolarHBondContact O-CB 3.29Å; A287-L291 PolarHBondContact O-N 3.5Å; E288-L291 PolarHBondContact O-N 2.85Å; N289-L291 PolarHBondContact O-N 3.49Å; L291-M294 PolarHBondContact O-N 3.5Å; L291-Q295 WeakPolarHBondContact O-CB 3.49Å; L291-Q295 PolarHBondContact O-N 2.82Å
292R87.3Confident84Confident131 Ų131107.3 Ų107.349%0.49451%0.512SS..Hα-helixtrans-61.9-43.8174.8-167.5-175.4-62.1164.5-0.5111.7E288 N289 C290 Q295 H296E288-R292 VanDerWaalsContact O-CB 3.29Å; E288-R292 WeakPolarHBondContact O-CB 3.39Å; E288-R292 PolarHBondContact O-N 3.48Å; E288-R292 IonicContact OE1-CZ 3.82Å; E288-R292 IonicContact OE1-NH2 2.73Å; E288-R292 PolarHBondContact OE1-NH2 3.35Å; N289-R292 PolarHBondContact O-N 2.93Å; N289-R292 PolarHBondContact OD1-NH1 3.35Å; C290-R292 VanDerWaalsContact C-N 3.34Å; R292-Q295 PolarHBondContact O-N 2.76Å; R292-H296 WeakPolarHBondContact O-CB 3.19Å; R292-H296 PolarHBondContact O-N 3.37Å
293I87.1Confident82.8Confident93 Ų93110.6 Ų110.648%0.47752%0.518SS..Hα-helixtrans-62.5-44.2174.1-68.6164.3000110.7N289 C290 H296 K297N289-I293 VanDerWaalsContact O-CG1 3.25Å; N289-I293 WeakPolarHBondContact O-CG1 3.44Å; N289-I293 PolarHBondContact O-N 3.18Å; C290-I293 PolarHBondContact O-N 3.44Å; I293-H296 PolarHBondContact O-N 3.32Å; I293-K297 HydrophobicContact CG2-CD 4.31Å; I293-K297 WeakPolarHBondContact O-CG 3.4Å; I293-K297 PolarHBondContact O-N 3.06Å
294M80.9Confident81.4Confident123 Ų123107.8 Ų107.861%0.60652%0.515SS*.Hα-helixtrans-64.2-42.7178-176177.1-71.200111.9C290 L291 H296 K297 L298C290-M294 WeakPolarHBondContact O-CB 3.49Å; C290-M294 PolarHBondContact O-N 3Å; L291-M294 PolarHBondContact O-N 3.5Å; M294-H296 VanDerWaalsContact C-N 3.34Å; M294-K297 PolarHBondContact O-N 3.5Å; M294-L298 HydrophobicContact CG-CD1 4.33Å; M294-L298 WeakPolarHBondContact O-CG 3.03Å; M294-L298 PolarHBondContact O-N 2.85Å
295Q79.9Confident80Confident95 Ų95107.3 Ų107.344%0.44452%0.518SS..Hα-helixtrans-63.3-40.5175.4-171.6-177.423.900111.7L291 R292 L298 R299L291-Q295 WeakPolarHBondContact O-CB 3.49Å; L291-Q295 PolarHBondContact O-N 2.82Å; R292-Q295 PolarHBondContact O-N 2.76Å; Q295-L298 PolarHBondContact O-N 3.31Å; Q295-R299 PolarHBondContact O-N 3.41Å
296H81.4Confident78.3Confident114 Ų114111.2 Ų111.253%0.52854%0.538SS..Hα-helixtrans-61.9-46.6174.5-175.1-79000111.4R292 I293 M294 L298 R299 E300R292-H296 WeakPolarHBondContact O-CB 3.19Å; R292-H296 PolarHBondContact O-N 3.37Å; I293-H296 PolarHBondContact O-N 3.32Å; M294-H296 VanDerWaalsContact C-N 3.34Å; H296-L298 PolarHBondContact O-N 2.95Å; H296-R299 PolarHBondContact O-N 2.92Å; H296-E300 IonicContact CE1-OE2 3.75Å; H296-E300 IonicContact ND1-OE2 3.75Å; H296-E300 WeakPolarHBondContact O-CB 3.29Å; H296-E300 PolarHBondContact O-N 3.45Å
297K81.9Confident76.5Confident117 Ų117113.5 Ų113.551%0.50955%0.547SS..Hα-helixtrans-60-44.8176.5-74.1178.1179.3-178.40112.5I293 M294 R299 E300 E301I293-K297 HydrophobicContact CG2-CD 4.31Å; I293-K297 WeakPolarHBondContact O-CG 3.4Å; I293-K297 PolarHBondContact O-N 3.06Å; M294-K297 PolarHBondContact O-N 3.5Å; K297-R299 PolarHBondContact O-N 2.9Å; K297-E300 WeakPolarHBondContact O-CB 3.08Å; K297-E300 PolarHBondContact O-N 3.47Å; K297-E301 WeakPolarHBondContact O-CG 3.49Å; K297-E301 PolarHBondContact O-N 2.91Å
298L75.8Confident74.8Confident94 Ų94113.9 Ų113.949%0.49256%0.556SS.*Hα-helixtrans-62.7-41.9177-75.6169000112.3M294 Q295 H296 E300 E301 E302M294-L298 HydrophobicContact CG-CD1 4.33Å; M294-L298 WeakPolarHBondContact O-CG 3.03Å; M294-L298 PolarHBondContact O-N 2.85Å; Q295-L298 PolarHBondContact O-N 3.31Å; H296-L298 PolarHBondContact O-N 2.95Å; L298-E300 VanDerWaalsContact C-N 3.29Å; L298-E300 PolarHBondContact O-N 3.16Å; L298-E301 PolarHBondContact O-N 3.3Å; L298-E302 WeakPolarHBondContact O-CB 3.33Å; L298-E302 WeakPolarHBondContact O-CG 3.43Å; L298-E302 PolarHBondContact O-N 2.96Å
299R79.1Confident72.6Confident144 Ų144114.2 Ų114.254%0.54357%0.568SS.*Hα-helixtrans-64-34.6173.9-81.5-175.1-175.31501.2112.8Q295 H296 K297 R303Q295-R299 PolarHBondContact O-N 3.41Å; H296-R299 PolarHBondContact O-N 2.92Å; K297-R299 PolarHBondContact O-N 2.9Å; R299-R303 WeakPolarHBondContact O-CB 3.13Å; R299-R303 PolarHBondContact O-N 3.45Å
300E76.3Confident70.1Confident86 Ų86118 Ų11840%0.40259%0.588SS.*Hα-helixtrans-69.7-44.3176.1-167.6174.1-172.200111.2H296 K297 L298 R303 D304H296-E300 IonicContact CE1-OE2 3.75Å; H296-E300 IonicContact ND1-OE2 3.75Å; H296-E300 WeakPolarHBondContact O-CB 3.29Å; H296-E300 PolarHBondContact O-N 3.45Å; K297-E300 WeakPolarHBondContact O-CB 3.08Å; K297-E300 PolarHBondContact O-N 3.47Å; L298-E300 VanDerWaalsContact C-N 3.29Å; L298-E300 PolarHBondContact O-N 3.16Å; E300-R303 WeakPolarHBondContact O-CB 3.31Å; E300-R303 PolarHBondContact O-N 3.32Å; E300-D304 PolarHBondContact O-N 3.45Å
301E72.6Confident67.8Low111 Ų111123.5 Ų123.552%0.51960%0.602SS.*Hα-helixtrans-63.4-40.2173.4-72174.3-172.900112.3K297 L298 D304 L305K297-E301 WeakPolarHBondContact O-CG 3.49Å; K297-E301 PolarHBondContact O-N 2.91Å; L298-E301 PolarHBondContact O-N 3.3Å; E301-D304 PolarHBondContact O-N 3.38Å; E301-L305 WeakPolarHBondContact O-CB 3.3Å; E301-L305 WeakPolarHBondContact O-CD1 3.3Å; E301-L305 WeakPolarHBondContact O-CG 3.44Å; E301-L305 PolarHBondContact O-N 2.79Å
302E67.1Low65.6Low133 Ų133124.6 Ų124.662%0.62161%0.609SS**Hα-helixtrans-62.6-41.2171.7-79.7-176.316300111.8L298 D304 L305 M306L298-E302 WeakPolarHBondContact O-CB 3.33Å; L298-E302 WeakPolarHBondContact O-CG 3.43Å; L298-E302 PolarHBondContact O-N 2.96Å; E302-D304 VanDerWaalsContact C-N 3.33Å; E302-L305 PolarHBondContact O-N 2.83Å; E302-M306 VanDerWaalsContact O-CB 3.23Å; E302-M306 WeakPolarHBondContact O-CB 3.25Å; E302-M306 PolarHBondContact O-N 2.85Å
303R66.9Low63.3Low146 Ų146124.3 Ų124.355%0.55163%0.627SS**Hα-helixtrans-63.4-40.4175.5-168.3-172-60.9116.9-2.5111.2R299 E300 K307R299-R303 WeakPolarHBondContact O-CB 3.13Å; R299-R303 PolarHBondContact O-N 3.45Å; E300-R303 WeakPolarHBondContact O-CB 3.31Å; E300-R303 PolarHBondContact O-N 3.32Å; R303-K307 WeakPolarHBondContact O-CB 3.49Å; R303-K307 PolarHBondContact O-N 2.89Å
304D63.7Low60.9Low97 Ų97128 Ų12852%0.51965%0.647SS.*Hα-helixtrans-72.1-36.9177.5-78.9-12.9000112.7E300 E301 E302 K307 G308E300-D304 PolarHBondContact O-N 3.45Å; E301-D304 PolarHBondContact O-N 3.38Å; E302-D304 VanDerWaalsContact C-N 3.33Å; D304-K307 WeakPolarHBondContact O-CB 3.4Å; D304-K307 PolarHBondContact O-N 2.99Å; D304-G308 PolarHBondContact O-N 3.29Å
305L59.9Low59Low130 Ų130127.5 Ų127.568%0.68166%0.656SS**Hα-helixtrans-66.9-39.2172.4-80.5157.4000112E301 E302 K307 G308 S309E301-L305 WeakPolarHBondContact O-CB 3.3Å; E301-L305 WeakPolarHBondContact O-CD1 3.3Å; E301-L305 WeakPolarHBondContact O-CG 3.44Å; E301-L305 PolarHBondContact O-N 2.79Å; E302-L305 PolarHBondContact O-N 2.83Å; L305-K307 PolarHBondContact O-N 3.34Å; L305-G308 PolarHBondContact O-N 3.18Å; L305-G308 VanDerWaalsContact O-N 3.11Å; L305-S309 PolarHBondContact O-N 3.09Å
306M57.5Low57.4Low168 Ų168129.8 Ų129.883%0.82867%0.671SS**Hα-helixtrans-68.8-24.6174-161.4163.1-170.600111.9E302E302-M306 VanDerWaalsContact O-CB 3.23Å; E302-M306 WeakPolarHBondContact O-CB 3.25Å; E302-M306 PolarHBondContact O-N 2.85Å
307K54.1Low55.5Low176 Ų176131.7 Ų131.777%0.76568%0.684SS**Hα-helixtrans-78.3-21.5170.5-140.7172.4-174.5177.10113.3R303 D304 L305R303-K307 WeakPolarHBondContact O-CB 3.49Å; R303-K307 PolarHBondContact O-N 2.89Å; D304-K307 WeakPolarHBondContact O-CB 3.4Å; D304-K307 PolarHBondContact O-N 2.99Å; L305-K307 PolarHBondContact O-N 3.34Å
308G50.7Low53.4Low68 Ų68132.5 Ų132.570%0.70169%0.694SS**Hα-helixtrans-90.8-11.3-176.400000116.2D304 L305D304-G308 PolarHBondContact O-N 3.29Å; L305-G308 PolarHBondContact O-N 3.18Å; L305-G308 VanDerWaalsContact O-N 3.11Å
309S43.2Very low51.8Low95 Ų95134.9 Ų134.966%0.66471%0.712SS**SBendtrans-138.358.7-177.2-173.50000113.6L305L305-S309 PolarHBondContact O-N 3.09Å
310L36.9Very low50.3Low154 Ų154132.6 Ų132.681%0.80672%0.716SS**  trans-174.5107.6141.2-109.7135.4000109.6
311K38.8Very low48.6Very low200 Ų200137 Ų13787%0.8774%0.737SS**  trans-83.5104.3153.4-127.1-176.9-177.1-178.10105.6
312D35.8Very low47Very low142 Ų142137.8 Ų137.876%0.75974%0.744SS**  trans163.297.4141.6-93.2-10.3000111.3
313S38.9Very low45.9Very low125 Ų125139.7 Ų139.787%0.87475%0.753SS**SBendtrans161.4124.5131.5-80.60000109.8S315S313-S315 PolarHBondContact O-N 3.19Å
314D37.4Very low44.4Very low171 Ų171136.4 Ų136.491%0.91476%0.764SS**  trans-13.6111.9172.9-79.7-33.1000117.8
315S41.8Very low43.4Very low111 Ų111137.7 Ų137.778%0.77678%0.781SS**  trans-60.7151.6144.5-141.50000108.8S313S313-S315 PolarHBondContact O-N 3.19Å
316D45.1Very low42.3Very low143 Ų143137.9 Ų137.977%0.76578%0.783SS**  cis174.5114.3-0.6172.522.5000104.2
317L41.5Very low41.4Very low155 Ų155135.5 Ų135.581%0.81278%0.783SS**  trans-161.8114.9174.8-131.9141.3000111.2
318D38.5Very low40.7Very low134 Ų134133.4 Ų133.472%0.71778%0.78SS**  trans44.9113.8158.1-75.2-29.6000121.2
319V41.8Very low40.3Very low143 Ų143137.2 Ų137.287%0.86778%0.784SS**  -141.5129.5126.1-176.50000109.3
320P47.9Very low40.2Very low96 Ų96141.6 Ų141.662%0.62379%0.794SS**  trans-94179-174.139.8-36.6000114
321E41Very low40.2Very low180 Ų180141.8 Ų141.884%0.84179%0.79SS**  trans78.9135.9166-53.4177179.400114.6
322D38.2Very low40Very low127 Ų127136.6 Ų136.668%0.67978%0.779SS**  cis-168.2151.930.5-162.614.9000112.3
323E43.5Very low39.9Very low173 Ų173141.4 Ų141.481%0.80879%0.787SS**  trans44.7110.4160.2-79.4174.9-171.600119.2
324G35.3Very low40.5Very low76 Ų76140.7 Ų140.778%0.78478%0.779SS**  9385.658.200000110.2
325S42.9Very low40.2Very low125 Ų125138.1 Ų138.187%0.87477%0.774SS**  trans-156.8101.4150.1-144.50000111.1
326D37.2Very low40.1Very low134 Ų134142.5 Ų142.572%0.71778%0.779SS**  trans-72.5126.6176.7-160.30.4000109.6
327S39Very low40Very low118 Ų118141.4 Ų141.483%0.82578%0.78SS**  trans-138.767.7163.453.40000109.1L329S327-L329 PolarHBondContact O-N 3.33Å
328D39.4Very low39.6Very low131 Ų131142.8 Ų142.870%0.70178%0.782SS**  trans-62.4113.5160.4-90.4-19.3000110.5
329L43Very low39.9Very low149 Ų149141.3 Ų141.378%0.7878%0.78SS**  10.1123.6122.4-77.3146.9000116.3S327S327-L329 PolarHBondContact O-N 3.33Å
330E39.2Very low39.4Very low187 Ų187139.3 Ų139.387%0.87477%0.773SS**  trans-146.6140.1133.4-99.9-58166.800110.6
331E37.8Very low38.7Very low158 Ų158144.5 Ų144.574%0.73878%0.78SS**  trans-102.3158.9-170.3-170.4-177.6167.500109.6
332S35Very low38.3Very low91 Ų91142.4 Ų142.464%0.63677%0.774SS**  trans9896154.7-53.60000120.2
333R34.3Very low38Very low243 Ų243141.1 Ų141.192%0.91778%0.782SS**  46.6164.3120.5-62.3-177.3178.7-175.30.9120.8
334P50.8Low38.2Very low110 Ų110138.5 Ų138.571%0.71478%0.779SS**  -132.8-179.7-55.737.8-20.2000113.1
335S32.1Very low38.3Very low116 Ų116143.5 Ų143.581%0.81179%0.785SS**  trans116.9130.4149.1-45.40000118.9
336K39.4Very low37.9Very low203 Ų203142.3 Ų142.388%0.88378%0.782SS**  trans-47172.3165.3-79.7174.2174.4174.10114.1
337P43.2Very low37.7Very low121 Ų121139.2 Ų139.279%0.78678%0.782SS**  cis-138.9177.215.328.4-2.7000116.9
338Q32.1Very low37.5Very low183 Ų183146.3 Ų146.386%0.85579%0.791SS**  trans1.5170.6152.5-89.3-158.6-16.700122.4
339P44.9Very low37.2Very low103 Ų103144.1 Ų144.167%0.66980%0.799SS**  cis-144.4178.40.136.2-13.3000117.7
340S31Very low37Very low102 Ų102141.4 Ų141.471%0.71380%0.798SS**  trans79.2137.7139.2100.10000124.7
341R33.8Very low37.1Very low205 Ų205143.9 Ų143.977%0.77480%0.799SS**  trans80.2111.2140.1-84.2177.578.1164.7-1.1120.7
342N32.3Very low36.9Very low135 Ų135145.5 Ų145.572%0.72280%0.804SS**  67.4112.9124-60.64.5000118.5
343A32.7Very low37.1Very low101 Ų101148.6 Ų148.684%0.83581%0.812SS**  -155.2154.2128.800000111.6
344P46.2Very low37.1Very low117 Ų117140.1 Ų140.176%0.7680%0.801SS**  trans-109.9168.6-166.137.1-22.6000114.6
345M37.5Very low36.4Very low182 Ų182142.8 Ų142.890%0.89781%0.809SS**  trans75.7136.2138.4-84.1-73-177.300123.3
346A35.4Very low36.9Very low99 Ų99145.8 Ų145.882%0.81881%0.812SS**  trans79.6129.7149.300000118.1
347G32.5Very low36.6Very low69 Ų69145.5 Ų145.571%0.71181%0.814SS**  cis158.3151.20.600000110.3
348R35.8Very low36.3Very low268 Ų268143.1 Ų143.1100%1.01181%0.811SS**  trans148.1132.8140.3-90.2-176166.7-161.2-2113.7
349G32Very low36.5Very low84 Ų84142.4 Ų142.487%0.86681%0.813SS**  trans158.693154.600000114.7
350A39.2Very low36.2Very low93 Ų93144.5 Ų144.577%0.76982%0.819SS**  trans-97.4147.6175.300000111.4
351R40.3Very low36.9Very low238 Ų238145.6 Ų145.690%0.89883%0.826SS**  163.8131.194.5-86.7-179.2179.9173.3-0.8107.1
352F34Very low37.5Very low192 Ų192144.6 Ų144.684%0.84283%0.831SS**  99.7129.581.7-153.2-102.2000114
353I38.8Very low37.8Very low156 Ų156147.3 Ų147.380%0.884%0.839SS**  trans150.5123.1135.5-74.1175.5000114.8
354G35.6Very low38.1Very low66 Ų66148 Ų14868%0.6884%0.838SS**  trans104.8144.7133.500000118.6
355N35Very low37.6Very low166 Ų166149.9 Ų149.989%0.88884%0.841SS**  cis-169.6159.5-30.6-127.350.5000107.2
356M43.8Very low37.9Very low179 Ų179147.9 Ų147.988%0.88283%0.834SS**  trans-67.9156.9-173.1-66.3153.479.800116.7
357Q31.9Very low38.3Very low197 Ų197148.9 Ų148.992%0.92184%0.835SS**  trans-147.2124.4147.4-160.186.934.500109
358G37.3Very low39.1Very low70 Ų70154.6 Ų154.672%0.72284%0.843SS**  trans-104165.6174.400000112.1
359D36.6Very low39.5Very low168 Ų168149.4 Ų149.490%0.89883%0.834SS**  trans-154136.6162.6-156.816.3000110.7
360D39.3Very low40.1Very low147 Ų147153 Ų15379%0.78683%0.834SS**  trans-85.1146.7-176.6-93-37.4000111
361S44.2Very low40.4Very low125 Ų125152.4 Ų152.487%0.87483%0.829SS**  trans-160.9111149.9-760000110
362E47.1Very low40.6Very low185 Ų185148.1 Ų148.186%0.86482%0.823SS**  trans-79142.6163.3-61-167.1168.300110
363E39.6Very low41Very low191 Ų191147.7 Ų147.789%0.89382%0.824SS**  174.4121.7121.1-89-158.8-172.200111.6
364S37.3Very low41.3Very low116 Ų116147.3 Ų147.381%0.81182%0.824SS**  trans35.2116.8138.8-161.40000120.9
365D36.4Very low41.7Very low157 Ų157150.4 Ų150.484%0.8483%0.825SS**  -163.7142.1117.9-153.75.9000111.9
366D43.2Very low42.2Very low140 Ų140151.1 Ų151.175%0.74982%0.823SS**  trans-64.1141.5178.9-91.7-40.8000112.4
367S45.3Very low42.3Very low120 Ų120150 Ų15084%0.83982%0.815SS**  trans-157.5103.9148.9-75.60000109.9
368E48.3Very low42.9Very low188 Ų188148.2 Ų148.288%0.87981%0.812SS**  trans-52.5129.4167.3-61.8178.5155.200110.9
369I44.1Very low43.1Very low160 Ų160153 Ų15382%0.82182%0.816SS**  trans-139109.5159.4-114.6163.5000107.5A371I369-A371 PolarHBondContact O-N 3.27Å
370D45Very low43.4Very low160 Ų160152.1 Ų152.186%0.85681%0.811SS**  trans-65.1116.4167.1-83.6-34.5000108.5
371A45.8Very low43.5Very low80 Ų80153 Ų15366%0.66181%0.811SS**  trans-12788.516500000107.1I369 E373I369-A371 PolarHBondContact O-N 3.27Å; A371-E373 PolarHBondContact O-N 3.39Å
372D43.4Very low43.4Very low147 Ų147154.4 Ų154.479%0.78681%0.808SS**  trans-66.897.4163.9-70.5-38.2000107.8D374D372-D374 PolarHBondContact O-N 2.86Å
373E43.3Very low43Very low183 Ų183154.3 Ų154.386%0.85581%0.808SS**  trans-80.288.5160-81.1-177.5158.200108.1A371 N375A371-E373 PolarHBondContact O-N 3.39Å; E373-N375 PolarHBondContact O-N 3.11Å
374D45.3Very low42.9Very low149 Ų149153.7 Ų153.780%0.79781%0.805SS**  trans-76.4100.6162.8-83.2-27.8000108.9D372 E376D372-D374 PolarHBondContact O-N 2.86Å; D374-E376 PolarHBondContact O-N 2.98Å
375N44.1Very low42.9Very low131 Ų131151.8 Ų151.870%0.70180%0.803SS**  trans-76.992.2166-172.352.4000107.9E373 E377E373-N375 PolarHBondContact O-N 3.11Å; N375-E377 PolarHBondContact O-N 2.96Å
376E45.9Very low43Very low181 Ų181153 Ų15385%0.84680%0.804SS**  trans-78.7100.8168.2-72.7-163.3175.500109D374D374-E376 PolarHBondContact O-N 2.98Å
377E44.7Very low42.7Very low154 Ų154155.6 Ų155.672%0.7281%0.812SS**  trans-66.6125163.8-69178163.600108.9N375 E379N375-E377 PolarHBondContact O-N 2.96Å; E377-E379 PolarHBondContact O-N 2.96Å; E377-E379 VanDerWaalsContact O-N 3.1Å
378D43.9Very low42.3Very low160 Ų160157 Ų15786%0.85681%0.805SS**  trans-63.1103.3170.3-72.1-53.6000109.5D380D378-D380 PolarHBondContact O-N 3.44Å
379E42.5Very low41.9Very low171 Ų171155.7 Ų155.780%0.79980%0.799SS**  trans-84.6102.6164.6-74.1-173.4165.300109.4E377 E381E377-E379 PolarHBondContact O-N 2.96Å; E377-E379 VanDerWaalsContact O-N 3.1Å; E379-E381 PolarHBondContact O-N 3.46Å
380D42.4Very low41.6Very low150 Ų150157.3 Ų157.380%0.80280%0.795SS**  trans-67.2103.4163.4-72.1-48.7000109.3D378 D382D378-D380 PolarHBondContact O-N 3.44Å; D380-D382 PolarHBondContact O-N 3Å
381E41Very low41.4Very low166 Ų166159.6 Ų159.678%0.77679%0.791SS**  trans-85.196.9165.9-79.3-172.6160.900110.2E379 E383E379-E381 PolarHBondContact O-N 3.46Å; E381-E383 PolarHBondContact O-N 3.24Å
382D42.6Very low41Very low153 Ų153164.4 Ų164.482%0.81880%0.8SS**  trans-70.196.8160.4-77.8-42.9000109.7D380 E384D380-D382 PolarHBondContact O-N 3Å; D382-E384 PolarHBondContact O-N 3.45Å
383E39.5Very low41Very low184 Ų184166.3 Ų166.386%0.8680%0.804SS**  trans-82.998.6164.4-88-168.2159.100110.4E381 G385E381-E383 PolarHBondContact O-N 3.24Å; E383-G385 PolarHBondContact O-N 2.84Å
384E37.6Very low40.6Very low178 Ų178165 Ų16583%0.83280%0.803SS**  trans-61.6115.1163.6-69.5-167.4159.100110.4D382 E386D382-E384 PolarHBondContact O-N 3.45Å; E384-E386 PolarHBondContact O-N 3.38Å
385G36.6Very low40.4Very low76 Ų76165.1 Ų165.178%0.78480%0.804SS**  trans-76102.2172.300000111.7E383 E387E383-G385 PolarHBondContact O-N 2.84Å; G385-E387 PolarHBondContact O-N 3.39Å
386E38.5Very low39.9Very low182 Ų182164.6 Ų164.685%0.8581%0.806SS**  trans-71.6119.6166.9-68.6-170.1159.800110.9E384 E388E384-E386 PolarHBondContact O-N 3.38Å; E386-E388 PolarHBondContact O-N 3.49Å
387E37.7Very low39.6Very low195 Ų195163.4 Ų163.491%0.91180%0.804SS**  trans-76.5100.4170.9-65.8-174.6160.500110.4G385 E389G385-E387 PolarHBondContact O-N 3.39Å; E387-E389 PolarHBondContact O-N 2.84Å
388E37.1Very low39.2Very low148 Ų148164.8 Ų164.869%0.69281%0.81SS**  trans-83.5103.8162.1-87.3-154.4169.400110.7E386 R390E386-E388 PolarHBondContact O-N 3.49Å; E388-R390 PolarHBondContact O-N 3.48Å; E388-R390 VanDerWaalsContact O-N 3.16Å; E388-R390 IonicContact OE2-CZ 2.93Å; E388-R390 IonicContact OE2-NE 2.69Å; E388-R390 PolarHBondContact OE2-NE 3.39Å; E388-R390 IonicContact OE2-NH2 2.79Å; E388-R390 PolarHBondContact OE2-NH2 2.83Å
389E40Very low38.7Very low161 Ų161162.3 Ų162.375%0.75280%0.801SS**  trans-63.2104.5160.5-74.4-166.7163.500110.4E387E387-E389 PolarHBondContact O-N 2.84Å
390R36.3Very low38.4Very low195 Ų195162.3 Ų162.374%0.73681%0.805SS**  trans-102.4102.6157.8-72.9-172.4-167.5-142.80.3110.3E388 E392E388-R390 PolarHBondContact O-N 3.48Å; E388-R390 VanDerWaalsContact O-N 3.16Å; E388-R390 IonicContact OE2-CZ 2.93Å; E388-R390 IonicContact OE2-NE 2.69Å; E388-R390 PolarHBondContact OE2-NE 3.39Å; E388-R390 IonicContact OE2-NH2 2.79Å; E388-R390 PolarHBondContact OE2-NH2 2.83Å; R390-E392 PolarHBondContact O-N 2.67Å
391R40.8Very low38Very low208 Ų208162.9 Ų162.979%0.78581%0.808SS**  trans-73.2112.4160.5-68.4180-175.7-171.61.2108.4
392E38.5Very low37.7Very low180 Ų180160.8 Ų160.884%0.84181%0.812SS**  trans-116.4109.3155.9-72.3-172.8174.400107.7R390 D394R390-E392 PolarHBondContact O-N 2.67Å; E392-D394 PolarHBondContact O-N 2.88Å
393E42.1Very low37.3Very low187 Ų187163.3 Ų163.387%0.87482%0.815SS**  trans-70.6114.9166.4-64.5174.1169.500107.4
394D35.3Very low36.9Very low155 Ų155160.1 Ų160.183%0.82981%0.813SS**  trans-136.5120.9152.1-154.14.3000110.2E392E392-D394 PolarHBondContact O-N 2.88Å
395D41.8Very low36.7Very low153 Ų153159.3 Ų159.382%0.81881%0.814SS**  trans-98.4102.2-168.8-164.112.3000106.5
396T32.7Very low36.6Very low120 Ų120167 Ų16774%0.73682%0.82SS**  trans-142.499.8167.5-52.80000111.3Q398T396-Q398 PolarHBondContact O-N 3.16Å
397L40Very low36.7Very low155 Ų155163.8 Ų163.881%0.81282%0.815SS**  trans-20.2120.3154.3-72.3151.4000114.6
398Q35.4Very low36.8Very low183 Ų183160.7 Ų160.786%0.85581%0.811SS**  -177.4138.3115.9-105.3-177.91200116.6T396T396-Q398 PolarHBondContact O-N 3.16Å
399V33.6Very low36.7Very low109 Ų109165.8 Ų165.866%0.66182%0.824SS**  trans78101.4145.2-175.30000118.9L401V399-L401 HydrophobicContact CG1-CG 4.31Å; V399-L401 PolarHBondContact O-N 2.9Å
400L37.8Very low36.3Very low170 Ų170161.5 Ų161.589%0.8982%0.823SS**  trans-53.5112.3155.8-66164000111.7
401L33.6Very low36.3Very low163 Ų163156.1 Ų156.185%0.85383%0.828SS**  trans-130.8130.6151.8-76.9174.5000110.1V399V399-L401 HydrophobicContact CG1-CG 4.31Å; V399-L401 PolarHBondContact O-N 2.9Å
402S34.8Very low36.3Very low122 Ų122152.8 Ų152.885%0.85383%0.831SS**  trans-72.3136.2-158.8-52.40000114.2
403K34.6Very low36.5Very low206 Ų206155.5 Ų155.590%0.89683%0.834SS**  trans-37.6130.7166.6-70.6167.2171.7175.50114.4
404S30.8Very low36.3Very low116 Ų116152.8 Ų152.881%0.81183%0.832SS**  trans-117.2117.2150.661.10000109.6
405N33Very low36.6Very low161 Ų161150.1 Ų150.186%0.86183%0.831SS**PPolyproline II helixtrans-50.8127.7178.7-80.9-15.3000113.6
406R35.1Very low36.7Very low237 Ų237150.6 Ų150.689%0.89483%0.833SS**PPolyproline II helixtrans-104135154.7-95.8-177.3173.6-176.2-0.4109
407P40.3Very low37.3Very low116 Ų116150.6 Ų150.675%0.75384%0.835SS**PPolyproline II helixtrans-82160.9169.633.8-30.8000111.4
408P39.3Very low37.2Very low129 Ų129152.5 Ų152.584%0.83884%0.84SS**PPolyproline II helixtrans-79.5140.9-170.732.9-33.1000111.5G410P408-G410 PolarHBondContact O-N 3.16Å
409R34Very low37.5Very low256 Ų256153 Ų15397%0.96684%0.842SS**  trans-93.287.6178.4-151.2-178.9-170.1-152.12.1108.5
410G32.7Very low37.9Very low70 Ų70152.9 Ų152.972%0.72285%0.846SS**  trans-81.9121.4164.400000109.6P408P408-G410 PolarHBondContact O-N 3.16Å
411G35.9Very low38.3Very low82 Ų82152.5 Ų152.585%0.84585%0.845SS**  trans-80.9120.5175.600000111.1
412V40.2Very low39Very low139 Ų139151.6 Ų151.684%0.84284%0.841SS**  trans-113.7118.6162.4178.30000106.6
413R43.1Very low39.8Very low237 Ų237153.2 Ų153.289%0.89484%0.84SS**PPolyproline II helixtrans-62.4139.3171-77.4179170.1-170.9-2.5109.7
414P39.2Very low40.3Very low129 Ų129157.2 Ų157.284%0.83886%0.858SS**PPolyproline II helixtrans-78.5136.2164-5.323000110.5
415A41Very low40.8Very low99 Ų99159.3 Ų159.382%0.81886%0.86SS**PPolyproline II helixtrans-68.7147.3169.800000111.3
416L44.7Very low41.2Very low164 Ų164159.2 Ų159.286%0.85986%0.86SS**PPolyproline II helixtrans-65.7146.8174.1-66.9162.6000110.6
417P44.4Very low41.6Very low119 Ų119154.8 Ų154.877%0.77386%0.858SS**PPolyproline II helixtrans-79132.7172.819.7-9.6000111.2
418E37.3Very low41.6Very low195 Ų195157.1 Ų157.191%0.91187%0.865SS**PPolyproline II helixtrans-60.8132.1169.5-70.9172.9151.600110.5
419E41.6Very low41.8Very low195 Ų195158.9 Ų158.991%0.91187%0.866SS**PPolyproline II helixtrans-70.4130.1167.8-75.1177.4153.900109.4D421E419-D421 PolarHBondContact O-N 3.16Å
420S42.9Very low42.3Very low106 Ų106152.4 Ų152.474%0.74186%0.86SS**  trans-78.8110175-179.90000108.7
421D45.4Very low43Very low161 Ų161158.3 Ų158.386%0.86187%0.869SS**  trans-94.297.7168.4-134.98.8000107.3E419E419-D421 PolarHBondContact O-N 3.16Å
422D49.9Very low43.5Very low145 Ų145164.2 Ų164.278%0.77587%0.871SS**  trans-129.685.2168.7-102.1-33.4000107.1
423D50.4Low43.8Very low156 Ų156166.3 Ų166.383%0.83487%0.874SS**  trans-15294.7157.3-103.3-21.9000107.9
424F45.9Very low43.9Very low289 Ų289159.8 Ų159.8100%1.26887%0.872SS**  trans-1630144.6-116.9-76.3000112.3

Retrieved 424 of 424 residues in 157.5 ms (Link to these results)

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