A0A096MNU8_PAPAN Loading...

Mediator of RNA polymerase II transcription subunit 10

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB (A0A2K6PH24), UniProt , Accession A0A096MNU8, Species PAPAN (Papio anubis, Olive baboon), Gene MED10, Length 135 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
1M57.3Low84.3Confident181 Ų18186.5 Ų86.589%0.89243%0.432SS*.  0-460-119.7179.4-159.500111K4 F5M1-K4 VanDerWaalsContact O-CG 3.3Å; M1-K4 WeakPolarHBondContact O-CG 3.45Å; M1-F5 WeakPolarHBondContact O-CD2 3.39Å
2A68.4Low85.3Confident61 Ų6185.8 Ų85.850%0.50443%0.429SS..Hα-helixtrans-62.8-45.7173.500000113K4 F5 D6A2-K4 VanDerWaalsContact C-N 3.27Å; A2-K4 PolarHBondContact O-N 2.83Å; A2-F5 WeakPolarHBondContact O-CA 3.25Å; A2-F5 WeakPolarHBondContact O-CB 3.34Å; A2-F5 PolarHBondContact O-N 3.34Å; A2-D6 VanDerWaalsContact O-CG 3.24Å; A2-D6 PolarHBondContact O-N 3.38Å
3E77.4Confident86.1Confident160 Ų16088.8 Ų88.875%0.74844%0.441SS*.Hα-helixtrans-52.6-34.9-174.4-65.3176.9162.300115.7D6 H7E3-D6 WeakPolarHBondContact CA-OD2 3.49Å; E3-D6 PolarHBondContact N-OD2 2.96Å; E3-H7 PolarHBondContact O-N 3.18Å
4K81.4Confident86.8Confident38 Ų3889.8 Ų89.817%0.16544%0.442CS..Hα-helixtrans-72.4-29.6177.362.2174.1-176.5-179.80113.1M1 A2 Q57 L58 D60M1-K4 VanDerWaalsContact O-CG 3.3Å; M1-K4 WeakPolarHBondContact O-CG 3.45Å; A2-K4 VanDerWaalsContact C-N 3.27Å; A2-K4 PolarHBondContact O-N 2.83Å; K4-Q57 HydrophobicContact CB-CB 4.38Å; K4-Q57 WeakPolarHBondContact CD-O 3.38Å; K4-L58 HydrophobicContact CB-CD2 4.45Å; K4-L58 HydrophobicContact CD-CD2 3.96Å; K4-L58 HydrophobicContact CG-CD2 4.11Å; K4-D60 IonicContact NZ-OD1 2.77Å; K4-D60 PolarHBondContact NZ-OD1 3.28Å; K4-D60 IonicContact NZ-OD2 2.61Å; K4-D60 PolarHBondContact NZ-OD2 3.11Å
5F88.8Confident87.4Confident92 Ų9285.8 Ų85.840%0.40442%0.421SS..Hα-helixtrans-78.8-40.3173.8-66.4-73000110.9M1 A2 H7 L8 E9 L58 I61M1-F5 WeakPolarHBondContact O-CD2 3.39Å; A2-F5 WeakPolarHBondContact O-CA 3.25Å; A2-F5 WeakPolarHBondContact O-CB 3.34Å; A2-F5 PolarHBondContact O-N 3.34Å; F5-H7 PolarHBondContact O-N 3.37Å; F5-L8 PolarHBondContact O-N 3.06Å; F5-L8 VanDerWaalsContact O-N 3.1Å; F5-E9 WeakPolarHBondContact O-CB 3.4Å; F5-E9 PolarHBondContact O-N 3.35Å; F5-L58 HydrophobicContact CD1-CD2 4.02Å; F5-L58 HydrophobicContact CE1-CD2 3.92Å; F5-L58 HydrophobicContact CZ-CD2 4.48Å; F5-I61 HydrophobicContact CE1-CD1 3.36Å; F5-I61 HydrophobicContact CE2-CD1 4.15Å; F5-I61 HydrophobicContact CZ-CD1 3.14Å; F5-I61 HydrophobicContact CZ-CG1 4.13Å
6D90.9Very high88Confident83 Ų8386.4 Ų86.444%0.44443%0.431SS..Hα-helixtrans-56.1-41177.8-55.4-22.9000110.7A2 E3 E9 E10A2-D6 VanDerWaalsContact O-CG 3.24Å; A2-D6 PolarHBondContact O-N 3.38Å; E3-D6 WeakPolarHBondContact CA-OD2 3.49Å; E3-D6 PolarHBondContact N-OD2 2.96Å; D6-E9 PolarHBondContact O-N 3.32Å; D6-E10 WeakPolarHBondContact O-CB 3.31Å; D6-E10 PolarHBondContact O-N 2.69Å
7H89.9Confident88.5Confident72 Ų7285.4 Ų85.433%0.33343%0.425SS..Hα-helixtrans-67.2-43.2177.3-164.657.4000113.3E3 F5 E9 H11E3-H7 PolarHBondContact O-N 3.18Å; F5-H7 PolarHBondContact O-N 3.37Å; H7-E9 VanDerWaalsContact C-N 3.34Å; H7-H11 AromaticContact CD2-CD2 3.72Å; H7-H11 AromaticContact CD2-NE2 3.67Å; H7-H11 AromaticContact CE1-CD2 3.7Å; H7-H11 AromaticContact CE1-NE2 3.07Å; H7-H11 PolarHBondContact CE1-NE2 3.43Å; H7-H11 AromaticContact ND1-NE2 3.79Å; H7-H11 AromaticContact NE2-CD2 3.51Å; H7-H11 AromaticContact NE2-NE2 2.96Å; H7-H11 PolarHBondContact NE2-NE2 3.37Å; H7-H11 PolarHBondContact O-CD2 2.86Å; H7-H11 PolarHBondContact O-N 3.07Å
8L92.1Very high88.8Confident38 Ų3882.3 Ų82.320%0.19941%0.41CS..Hα-helixtrans-64-43.3176.1174.363.7000110.7F5 H11 L12 I51 C54 L58F5-L8 PolarHBondContact O-N 3.06Å; F5-L8 VanDerWaalsContact O-N 3.1Å; L8-H11 PolarHBondContact O-N 3.34Å; L8-L12 HydrophobicContact CD1-CD1 4.06Å; L8-L12 HydrophobicContact CD1-CG 4.07Å; L8-L12 HydrophobicContact CD2-CD1 4.33Å; L8-L12 HydrophobicContact CG-CD1 3.83Å; L8-L12 HydrophobicContact CG-CG 4.29Å; L8-L12 WeakPolarHBondContact O-CB 3.34Å; L8-L12 VanDerWaalsContact O-CG 3.3Å; L8-L12 WeakPolarHBondContact O-CG 3.44Å; L8-L12 PolarHBondContact O-N 3.28Å; L8-I51 HydrophobicContact CD1-CG2 4.15Å; L8-C54 HydrophobicContact CB-CB 4.42Å; L8-C54 HydrophobicContact CD1-CB 3.96Å; L8-L58 HydrophobicContact CB-CD1 4.42Å; L8-L58 HydrophobicContact CD2-CD1 3.42Å; L8-L58 VanDerWaalsContact CD2-CD1 3.42Å; L8-L58 HydrophobicContact CG-CD1 4.4Å
9E93.5Very high89.2Confident105 Ų10582.2 Ų82.249%0.49141%0.41SS..Hα-helixtrans-59.2-49.1178.1-176.2169.8-161.300111F5 D6 H7 H11 L12 E13F5-E9 WeakPolarHBondContact O-CB 3.4Å; F5-E9 PolarHBondContact O-N 3.35Å; D6-E9 PolarHBondContact O-N 3.32Å; H7-E9 VanDerWaalsContact C-N 3.34Å; E9-H11 VanDerWaalsContact C-N 3.32Å; E9-H11 PolarHBondContact O-N 3.42Å; E9-L12 PolarHBondContact O-N 2.91Å; E9-L12 VanDerWaalsContact O-N 3.13Å; E9-E13 WeakPolarHBondContact O-CG 3.42Å; E9-E13 PolarHBondContact O-N 3.38Å
10E94.1Very high89.6Confident88 Ų8884.6 Ų84.641%0.41141%0.414SS..Hα-helixtrans-57-43.3177.3-173.4-172.6177.100112.2D6 K14D6-E10 WeakPolarHBondContact O-CB 3.31Å; D6-E10 PolarHBondContact O-N 2.69Å; E10-K14 VanDerWaalsContact CD-NZ 3.35Å; E10-K14 HydrophobicContact CG-CD 4.34Å; E10-K14 WeakPolarHBondContact O-CB 3.41Å; E10-K14 VanDerWaalsContact O-CG 3.27Å; E10-K14 WeakPolarHBondContact O-CG 3.48Å; E10-K14 PolarHBondContact O-N 2.96Å; E10-K14 VanDerWaalsContact OE1-CE 3.3Å; E10-K14 WeakPolarHBondContact OE1-CE 3.44Å; E10-K14 IonicContact OE1-NZ 3.55Å; E10-K14 PolarHBondContact OE1-NZ 2.97Å
11H93.9Very high89.8Confident34 Ų3483.4 Ų83.416%0.15741%0.408CS..Hα-helixtrans-68.7-38.9177.2-76.9-62.8000112.7H7 L8 E9 F15 I51H7-H11 AromaticContact CD2-CD2 3.72Å; H7-H11 AromaticContact CD2-NE2 3.67Å; H7-H11 AromaticContact CE1-CD2 3.7Å; H7-H11 AromaticContact CE1-NE2 3.07Å; H7-H11 PolarHBondContact CE1-NE2 3.43Å; H7-H11 AromaticContact ND1-NE2 3.79Å; H7-H11 AromaticContact NE2-CD2 3.51Å; H7-H11 AromaticContact NE2-NE2 2.96Å; H7-H11 PolarHBondContact NE2-NE2 3.37Å; H7-H11 PolarHBondContact O-CD2 2.86Å; H7-H11 PolarHBondContact O-N 3.07Å; L8-H11 PolarHBondContact O-N 3.34Å; E9-H11 VanDerWaalsContact C-N 3.32Å; E9-H11 PolarHBondContact O-N 3.42Å; H11-F15 VanDerWaalsContact O-CB 3.23Å; H11-F15 WeakPolarHBondContact O-CB 3.28Å; H11-F15 PolarHBondContact O-N 3.33Å; H11-I51 HydrophobicContact CB-CG1 4.13Å
12L95.9Very high91.6Very high77 Ų7776.2 Ų76.240%0.40337%0.373SS..Hα-helixtrans-64.1-45175.6-74.7171.6000111.4L8 E9 F15 V16 I51L8-L12 HydrophobicContact CD1-CD1 4.06Å; L8-L12 HydrophobicContact CD1-CG 4.07Å; L8-L12 HydrophobicContact CD2-CD1 4.33Å; L8-L12 HydrophobicContact CG-CD1 3.83Å; L8-L12 HydrophobicContact CG-CG 4.29Å; L8-L12 WeakPolarHBondContact O-CB 3.34Å; L8-L12 VanDerWaalsContact O-CG 3.3Å; L8-L12 WeakPolarHBondContact O-CG 3.44Å; L8-L12 PolarHBondContact O-N 3.28Å; E9-L12 PolarHBondContact O-N 2.91Å; E9-L12 VanDerWaalsContact O-N 3.13Å; L12-F15 WeakPolarHBondContact O-CB 3.29Å; L12-F15 PolarHBondContact O-N 3.48Å; L12-V16 WeakPolarHBondContact O-CG2 3.47Å; L12-V16 PolarHBondContact O-N 3.04Å; L12-I51 HydrophobicContact CD2-CD1 3.93Å; L12-I51 HydrophobicContact CD2-CG1 4.34Å; L12-I51 HydrophobicContact CD2-CG2 4.39Å
13E96.2Very high92.9Very high125 Ų12575 Ų7558%0.58437%0.366SS*.Hα-helixtrans-60.7-48.2176.8-73.2-173156.900111.6E9 F15 V16 E17E9-E13 WeakPolarHBondContact O-CG 3.42Å; E9-E13 PolarHBondContact O-N 3.38Å; E13-F15 VanDerWaalsContact C-N 3.26Å; E13-F15 PolarHBondContact O-N 2.71Å; E13-V16 PolarHBondContact O-N 3.46Å; E13-E17 WeakPolarHBondContact O-CB 3.45Å; E13-E17 PolarHBondContact O-N 3.25Å
14K94.9Very high93.8Very high103 Ų10371.7 Ų71.745%0.44835%0.352SS..Hα-helixtrans-59.2-39.2175.1-74.6173-174.4169.40111.8E10 N18E10-K14 VanDerWaalsContact CD-NZ 3.35Å; E10-K14 HydrophobicContact CG-CD 4.34Å; E10-K14 WeakPolarHBondContact O-CB 3.41Å; E10-K14 VanDerWaalsContact O-CG 3.27Å; E10-K14 WeakPolarHBondContact O-CG 3.48Å; E10-K14 PolarHBondContact O-N 2.96Å; E10-K14 VanDerWaalsContact OE1-CE 3.3Å; E10-K14 WeakPolarHBondContact OE1-CE 3.44Å; E10-K14 IonicContact OE1-NZ 3.55Å; E10-K14 PolarHBondContact OE1-NZ 2.97Å; K14-N18 WeakPolarHBondContact O-CB 3.44Å; K14-N18 PolarHBondContact O-N 3.01Å; K14-N18 PolarHBondContact O-ND2 3.39Å; K14-N18 VanDerWaalsContact O-ND2 3.1Å
15F96.8Very high94.4Very high30 Ų3071.8 Ų71.813%0.13235%0.354CS..Hα-helixtrans-66.4-47.3178.9-178-106.1000112.1H11 L12 E13 E17 N18 I19 I44 L48 I51H11-F15 VanDerWaalsContact O-CB 3.23Å; H11-F15 WeakPolarHBondContact O-CB 3.28Å; H11-F15 PolarHBondContact O-N 3.33Å; L12-F15 WeakPolarHBondContact O-CB 3.29Å; L12-F15 PolarHBondContact O-N 3.48Å; E13-F15 VanDerWaalsContact C-N 3.26Å; E13-F15 PolarHBondContact O-N 2.71Å; F15-E17 VanDerWaalsContact C-N 3.3Å; F15-E17 PolarHBondContact O-N 3.5Å; F15-N18 PolarHBondContact O-N 3.09Å; F15-I19 HydrophobicContact CD1-CD1 3.91Å; F15-I19 HydrophobicContact CE1-CD1 3.34Å; F15-I19 HydrophobicContact CE1-CG1 4.33Å; F15-I19 HydrophobicContact CE2-CD1 4.39Å; F15-I19 HydrophobicContact CZ-CD1 3.62Å; F15-I19 HydrophobicContact CZ-CG1 4.31Å; F15-I19 PolarHBondContact O-N 2.86Å; F15-I44 HydrophobicContact CE2-CB 4.34Å; F15-I44 HydrophobicContact CE2-CG2 3.8Å; F15-I44 HydrophobicContact CZ-CG2 4.23Å; F15-L48 HydrophobicContact CE1-CD2 4.14Å; F15-L48 HydrophobicContact CE2-CD1 4.49Å; F15-L48 HydrophobicContact CE2-CD2 3.85Å; F15-L48 HydrophobicContact CE2-CG 3.65Å; F15-L48 HydrophobicContact CZ-CD1 4.39Å; F15-L48 HydrophobicContact CZ-CD2 3.49Å; F15-L48 VanDerWaalsContact CZ-CD2 3.49Å; F15-L48 HydrophobicContact CZ-CG 3.74Å; F15-I51 HydrophobicContact CB-CD1 3.8Å; F15-I51 HydrophobicContact CD1-CD1 4.05Å; F15-I51 HydrophobicContact CD2-CD1 4.2Å; F15-I51 HydrophobicContact CG-CD1 3.75Å
16V96.7Very high94.7Very high95 Ų9571.5 Ų71.558%0.57636%0.36SS*.Hα-helixtrans-58.7-43.7175.41710000110.7L12 E13 N18 I19 R20L12-V16 WeakPolarHBondContact O-CG2 3.47Å; L12-V16 PolarHBondContact O-N 3.04Å; E13-V16 PolarHBondContact O-N 3.46Å; V16-N18 PolarHBondContact O-N 2.87Å; V16-I19 PolarHBondContact O-N 3.03Å; V16-R20 PolarHBondContact O-N 3.17Å
17E95.8Very high95Very high70 Ų7072.7 Ų72.733%0.32738%0.375SS..Hα-helixtrans-64.8-39.7177.6178.454.9-158.300112.4E13 F15 I19 R20 Q21E13-E17 WeakPolarHBondContact O-CB 3.45Å; E13-E17 PolarHBondContact O-N 3.25Å; F15-E17 VanDerWaalsContact C-N 3.3Å; F15-E17 PolarHBondContact O-N 3.5Å; E17-I19 VanDerWaalsContact C-N 3.35Å; E17-I19 PolarHBondContact O-N 3.3Å; E17-R20 WeakPolarHBondContact O-CB 3.38Å; E17-R20 PolarHBondContact O-N 3.24Å; E17-R20 IonicContact OE1-CZ 3.51Å; E17-R20 IonicContact OE1-NE 3.56Å; E17-R20 PolarHBondContact OE1-NE 3.45Å; E17-R20 IonicContact OE1-NH2 3.79Å; E17-R20 PolarHBondContact OE1-NH2 3.33Å; E17-R20 IonicContact OE2-CZ 3.08Å; E17-R20 IonicContact OE2-NE 2.66Å; E17-R20 PolarHBondContact OE2-NE 3.05Å; E17-R20 IonicContact OE2-NH2 3.42Å; E17-Q21 WeakPolarHBondContact O-CG 3.33Å; E17-Q21 PolarHBondContact O-N 3.43Å; E17-Q21 WeakPolarHBondContact OE1-CG 3.4Å; E17-Q21 PolarHBondContact OE1-NE2 3.18Å
18N94.9Very high95.3Very high29 Ų2974.9 Ų74.916%0.15539%0.389CS..Hα-helixtrans-62.1-40.5173.9-80.8-42.7000112.3K14 F15 V16 Q21 L22 K40 I44K14-N18 WeakPolarHBondContact O-CB 3.44Å; K14-N18 PolarHBondContact O-N 3.01Å; K14-N18 PolarHBondContact O-ND2 3.39Å; K14-N18 VanDerWaalsContact O-ND2 3.1Å; F15-N18 PolarHBondContact O-N 3.09Å; V16-N18 PolarHBondContact O-N 2.87Å; N18-Q21 PolarHBondContact O-N 3.04Å; N18-L22 WeakPolarHBondContact O-CB 3.49Å; N18-L22 PolarHBondContact O-N 3.47Å; N18-K40 PolarHBondContact OD1-NZ 3.21Å; N18-I44 HydrophobicContact CB-CG1 4.41Å
19I96.1Very high95.5Very high81 Ų8177.3 Ų77.342%0.41540%0.398SS..Hα-helixtrans-63.8-44.1174.4-70.3176.6000110.7F15 V16 E17 Q21 L22 G23 I44F15-I19 HydrophobicContact CD1-CD1 3.91Å; F15-I19 HydrophobicContact CE1-CD1 3.34Å; F15-I19 HydrophobicContact CE1-CG1 4.33Å; F15-I19 HydrophobicContact CE2-CD1 4.39Å; F15-I19 HydrophobicContact CZ-CD1 3.62Å; F15-I19 HydrophobicContact CZ-CG1 4.31Å; F15-I19 PolarHBondContact O-N 2.86Å; V16-I19 PolarHBondContact O-N 3.03Å; E17-I19 VanDerWaalsContact C-N 3.35Å; E17-I19 PolarHBondContact O-N 3.3Å; I19-Q21 PolarHBondContact O-N 2.8Å; I19-L22 WeakPolarHBondContact O-CB 3.3Å; I19-L22 PolarHBondContact O-N 3.48Å; I19-G23 PolarHBondContact O-N 2.91Å; I19-I44 HydrophobicContact CG1-CD1 4.29Å; I19-I44 HydrophobicContact CG1-CG1 4.44Å
20R96.5Very high95.5Very high129 Ų12977 Ų7749%0.48740%0.397SS..Hα-helixtrans-59-47.3177.9-170.3-166.770.280.73.9111.4V16 E17 G23 I24V16-R20 PolarHBondContact O-N 3.17Å; E17-R20 WeakPolarHBondContact O-CB 3.38Å; E17-R20 PolarHBondContact O-N 3.24Å; E17-R20 IonicContact OE1-CZ 3.51Å; E17-R20 IonicContact OE1-NE 3.56Å; E17-R20 PolarHBondContact OE1-NE 3.45Å; E17-R20 IonicContact OE1-NH2 3.79Å; E17-R20 PolarHBondContact OE1-NH2 3.33Å; E17-R20 IonicContact OE2-CZ 3.08Å; E17-R20 IonicContact OE2-NE 2.66Å; E17-R20 PolarHBondContact OE2-NE 3.05Å; E17-R20 IonicContact OE2-NH2 3.42Å; R20-G23 PolarHBondContact O-N 2.93Å; R20-I24 PolarHBondContact O-N 3.29Å; R20-I24 VanDerWaalsContact O-N 3.09Å
21Q94.1Very high95.5Very high61 Ų6178.4 Ų78.429%0.28541%0.413SS..Hα-helixtrans-64.4-39.9177.7-69.6177.89.800112.3E17 N18 I19 G23 I24 I25 K40E17-Q21 WeakPolarHBondContact O-CG 3.33Å; E17-Q21 PolarHBondContact O-N 3.43Å; E17-Q21 WeakPolarHBondContact OE1-CG 3.4Å; E17-Q21 PolarHBondContact OE1-NE2 3.18Å; N18-Q21 PolarHBondContact O-N 3.04Å; I19-Q21 PolarHBondContact O-N 2.8Å; Q21-G23 VanDerWaalsContact C-N 3.31Å; Q21-G23 PolarHBondContact O-N 3.19Å; Q21-I24 PolarHBondContact O-N 3.12Å; Q21-I25 WeakPolarHBondContact O-CG1 3.47Å; Q21-I25 PolarHBondContact O-N 3.31Å; Q21-K40 HydrophobicContact CB-CD 4.36Å
22L95.5Very high95.6Very high30 Ų3081.2 Ų81.216%0.15744%0.436CS..Hα-helixtrans-57.4-46.8171.7174.966.3000110.8N18 I19 I24 I25 V26 L37 K40 L41 I44N18-L22 WeakPolarHBondContact O-CB 3.49Å; N18-L22 PolarHBondContact O-N 3.47Å; I19-L22 WeakPolarHBondContact O-CB 3.3Å; I19-L22 PolarHBondContact O-N 3.48Å; L22-I24 VanDerWaalsContact C-N 3.27Å; L22-I24 PolarHBondContact O-N 2.99Å; L22-I25 PolarHBondContact O-N 3.48Å; L22-V26 HydrophobicContact CD1-CG2 4.02Å; L22-V26 HydrophobicContact CG-CG2 4.36Å; L22-V26 WeakPolarHBondContact O-CG2 3.48Å; L22-V26 PolarHBondContact O-N 2.93Å; L22-L37 HydrophobicContact CD1-CD1 3.18Å; L22-K40 HydrophobicContact CD1-CB 4.38Å; L22-L41 HydrophobicContact CD1-CD2 4.37Å; L22-L41 HydrophobicContact CD2-CD2 4.07Å; L22-I44 HydrophobicContact CB-CD1 4.2Å; L22-I44 HydrophobicContact CD2-CD1 3.35Å; L22-I44 HydrophobicContact CG-CD1 4.32Å
23G95.7Very high95.5Very high35 Ų3579.2 Ų79.236%0.36143%0.429SS..Hα-helixtrans-56.7-40.1177.300000112.8I19 R20 Q21 S27I19-G23 PolarHBondContact O-N 2.91Å; R20-G23 PolarHBondContact O-N 2.93Å; Q21-G23 VanDerWaalsContact C-N 3.31Å; Q21-G23 PolarHBondContact O-N 3.19Å; G23-S27 WeakPolarHBondContact O-CB 3.31Å; G23-S27 PolarHBondContact O-N 2.87Å; G23-S27 PolarHBondContact O-OG 3.49Å
24I95.3Very high95.4Very high91 Ų9177.2 Ų77.247%0.46742%0.42SS..Hα-helixtrans-64.5-48.7175.5-67.7166.1000111.3R20 Q21 L22 V26 S27 D28R20-I24 PolarHBondContact O-N 3.29Å; R20-I24 VanDerWaalsContact O-N 3.09Å; Q21-I24 PolarHBondContact O-N 3.12Å; L22-I24 VanDerWaalsContact C-N 3.27Å; L22-I24 PolarHBondContact O-N 2.99Å; I24-V26 VanDerWaalsContact C-N 3.28Å; I24-V26 PolarHBondContact O-N 3.38Å; I24-S27 PolarHBondContact O-N 2.92Å; I24-D28 PolarHBondContact O-N 3.26Å
25I95.1Very high95.4Very high39 Ų3975.8 Ų75.820%0.243%0.427CS..Hα-helixtrans-60.4-40.4-179.5-66.6166.2000111.1Q21 L22 D28 F29 L37 K40Q21-I25 WeakPolarHBondContact O-CG1 3.47Å; Q21-I25 PolarHBondContact O-N 3.31Å; L22-I25 PolarHBondContact O-N 3.48Å; I25-D28 CarbonylContact O-C 3.43Å; I25-F29 VanDerWaalsContact O-CA 3.27Å; I25-F29 WeakPolarHBondContact O-CA 3.44Å; I25-F29 PolarHBondContact O-N 3.17Å; I25-L37 HydrophobicContact CG2-CB 4.06Å; I25-L37 HydrophobicContact CG2-CD1 4.39Å; I25-K40 HydrophobicContact CD1-CG 3.96Å
26V95.9Very high95.2Very high87 Ų8775.6 Ų75.653%0.52743%0.434SS..Hα-helixtrans-72.5-34.3179.4173.80000111.5L22 I24 L37L22-V26 HydrophobicContact CD1-CG2 4.02Å; L22-V26 HydrophobicContact CG-CG2 4.36Å; L22-V26 WeakPolarHBondContact O-CG2 3.48Å; L22-V26 PolarHBondContact O-N 2.93Å; I24-V26 VanDerWaalsContact C-N 3.28Å; I24-V26 PolarHBondContact O-N 3.38Å; V26-L37 HydrophobicContact CG2-CD1 3.97Å
27S96.9Very high95.1Very high108 Ų10872.3 Ų72.376%0.75541%0.413SS*.Hα-helixtrans-68.5-31.9179.8-60.30000113.2G23 I24G23-S27 WeakPolarHBondContact O-CB 3.31Å; G23-S27 PolarHBondContact O-N 2.87Å; G23-S27 PolarHBondContact O-OG 3.49Å; I24-S27 PolarHBondContact O-N 2.92Å
28D94.8Very high95.1Very high117 Ų11772.6 Ų72.663%0.62642%0.417SS*.THydrogen-bonded Turntrans-127.760.3176.4-172.528.1000110.8I24 I25 Q30I24-D28 PolarHBondContact O-N 3.26Å; I25-D28 CarbonylContact O-C 3.43Å; D28-Q30 PolarHBondContact O-N 3.01Å
29F96.1Very high95.1Very high89 Ų8976.4 Ų76.439%0.3943%0.434SS..  trans-73.4130.3-174.8-177.8-96000112.2I25 Q34 L37I25-F29 VanDerWaalsContact O-CA 3.27Å; I25-F29 WeakPolarHBondContact O-CA 3.44Å; I25-F29 PolarHBondContact O-N 3.17Å; F29-Q34 HydrophobicContact CE2-CB 4.46Å; F29-Q34 HydrophobicContact CZ-CB 4.15Å; F29-Q34 VanDerWaalsContact CZ-OE1 3.28Å; F29-L37 HydrophobicContact CD2-CD2 4.23Å; F29-L37 HydrophobicContact CE2-CD2 3.83Å
30Q94.4Very high95Very high100 Ų10074 Ų7447%0.46742%0.42SS..  trans-122.7152.3169.9-62.5-173.7-16.700109.9D28 S32 S33D28-Q30 PolarHBondContact O-N 3.01Å; Q30-S32 PolarHBondContact O-N 3.38Å; Q30-S32 VanDerWaalsContact O-N 3.12Å; Q30-S33 WeakPolarHBondContact O-CA 3.32Å; Q30-S33 VanDerWaalsContact O-CB 3.25Å; Q30-S33 WeakPolarHBondContact O-CB 3.27Å; Q30-S33 PolarHBondContact O-N 2.99Å
31P94.7Very high95Very high117 Ų11771.6 Ų71.676%0.7642%0.416SS*.G310 helixtrans-55-32.5177.5-27.435.3000114S33 Q34P31-S33 VanDerWaalsContact C-N 3.26Å; P31-S33 PolarHBondContact O-N 3.46Å; P31-Q34 WeakPolarHBondContact O-CB 3.48Å; P31-Q34 PolarHBondContact O-N 3.03Å
32S94.5Very high95.1Very high92 Ų9273.7 Ų73.764%0.64343%0.43SS*.G310 helixtrans-63.6-27.8173460000113.3Q30 Q34Q30-S32 PolarHBondContact O-N 3.38Å; Q30-S32 VanDerWaalsContact O-N 3.12Å; S32-Q34 VanDerWaalsContact C-N 3.32Å; S32-Q34 PolarHBondContact O-N 3.07Å
33S93.9Very high95.1Very high36 Ų3676.4 Ų76.425%0.25244%0.44SS..G310 helixtrans-79.8-9.4-178.9-540000113.7Q30 P31 A35 G36 L37Q30-S33 WeakPolarHBondContact O-CA 3.32Å; Q30-S33 VanDerWaalsContact O-CB 3.25Å; Q30-S33 WeakPolarHBondContact O-CB 3.27Å; Q30-S33 PolarHBondContact O-N 2.99Å; P31-S33 VanDerWaalsContact C-N 3.26Å; P31-S33 PolarHBondContact O-N 3.46Å; S33-A35 VanDerWaalsContact C-N 3.28Å; S33-A35 PolarHBondContact O-N 3.4Å; S33-G36 PolarHBondContact O-N 3.35Å; S33-G36 VanDerWaalsContact O-N 3.09Å; S33-L37 PolarHBondContact O-N 3.49Å
34Q94.8Very high95.1Very high82 Ų8276 Ų7638%0.38343%0.43SS..Hα-helixtrans-55.3-40.8-177.3-175.764.653.900113F29 P31 S32 L37 N38F29-Q34 HydrophobicContact CE2-CB 4.46Å; F29-Q34 HydrophobicContact CZ-CB 4.15Å; F29-Q34 VanDerWaalsContact CZ-OE1 3.28Å; P31-Q34 WeakPolarHBondContact O-CB 3.48Å; P31-Q34 PolarHBondContact O-N 3.03Å; S32-Q34 VanDerWaalsContact C-N 3.32Å; S32-Q34 PolarHBondContact O-N 3.07Å; Q34-L37 WeakPolarHBondContact O-CB 3.39Å; Q34-L37 PolarHBondContact O-N 2.78Å; Q34-N38 PolarHBondContact NE2-OD1 3.5Å; Q34-N38 VanDerWaalsContact O-CG 3.31Å; Q34-N38 PolarHBondContact O-N 3.29Å
35A94.9Very high95.1Very high73 Ų7375.5 Ų75.560%0.60343%0.431SS*.Hα-helixtrans-64.6-44.2178.800000111.6S33 N38 Q39S33-A35 VanDerWaalsContact C-N 3.28Å; S33-A35 PolarHBondContact O-N 3.4Å; A35-N38 PolarHBondContact O-N 3.44Å; A35-Q39 WeakPolarHBondContact O-CB 3.46Å; A35-Q39 PolarHBondContact O-N 3.18Å
36G92.9Very high95.1Very high27 Ų2776.6 Ų76.628%0.27844%0.44SS..Hα-helixtrans-65.5-37.7176.500000112.7S33 Q39 K40S33-G36 PolarHBondContact O-N 3.35Å; S33-G36 VanDerWaalsContact O-N 3.09Å; G36-Q39 PolarHBondContact O-N 3.47Å; G36-K40 WeakPolarHBondContact O-CG 3.45Å; G36-K40 PolarHBondContact O-N 2.93Å
37L95.1Very high95.1Very high25 Ų2573.1 Ų73.113%0.13142%0.421CS..Hα-helixtrans-59.4-52.2173.1175.860.7000111.5L22 I25 V26 F29 S33 Q34 Q39 K40 L41L22-L37 HydrophobicContact CD1-CD1 3.18Å; I25-L37 HydrophobicContact CG2-CB 4.06Å; I25-L37 HydrophobicContact CG2-CD1 4.39Å; V26-L37 HydrophobicContact CG2-CD1 3.97Å; F29-L37 HydrophobicContact CD2-CD2 4.23Å; F29-L37 HydrophobicContact CE2-CD2 3.83Å; S33-L37 PolarHBondContact O-N 3.49Å; Q34-L37 WeakPolarHBondContact O-CB 3.39Å; Q34-L37 PolarHBondContact O-N 2.78Å; L37-Q39 VanDerWaalsContact C-N 3.29Å; L37-Q39 PolarHBondContact O-N 3.39Å; L37-K40 PolarHBondContact O-N 3.25Å; L37-K40 VanDerWaalsContact O-N 3.14Å; L37-L41 HydrophobicContact CD1-CD1 4.43Å; L37-L41 HydrophobicContact CD1-CG 4.45Å; L37-L41 HydrophobicContact CG-CD1 4.36Å; L37-L41 WeakPolarHBondContact O-CG 3.36Å; L37-L41 PolarHBondContact O-N 2.9Å
38N95.4Very high95.1Very high77 Ų7772.5 Ų72.541%0.41241%0.409SS..Hα-helixtrans-59.6-41.5178.7-70.4-10.9000111.6Q34 A35 L41 N42Q34-N38 PolarHBondContact NE2-OD1 3.5Å; Q34-N38 VanDerWaalsContact O-CG 3.31Å; Q34-N38 PolarHBondContact O-N 3.29Å; A35-N38 PolarHBondContact O-N 3.44Å; N38-L41 PolarHBondContact O-N 3.48Å; N38-N42 PolarHBondContact O-N 2.97Å; N38-N42 VanDerWaalsContact O-N 3.09Å; N38-N42 PolarHBondContact O-ND2 2.94Å
39Q94.8Very high95.1Very high108 Ų10872 Ų7251%0.50540%0.403SS..Hα-helixtrans-61.8-44.1175.8-171.7-177.99.500111.7A35 G36 L37 N42 F43A35-Q39 WeakPolarHBondContact O-CB 3.46Å; A35-Q39 PolarHBondContact O-N 3.18Å; G36-Q39 PolarHBondContact O-N 3.47Å; L37-Q39 VanDerWaalsContact C-N 3.29Å; L37-Q39 PolarHBondContact O-N 3.39Å; Q39-N42 PolarHBondContact O-N 2.93Å; Q39-F43 HydrophobicContact CG-CD2 4.21Å; Q39-F43 HydrophobicContact CG-CE1 4.43Å; Q39-F43 HydrophobicContact CG-CE2 3.64Å; Q39-F43 HydrophobicContact CG-CZ 3.78Å; Q39-F43 WeakPolarHBondContact O-CG 3.41Å; Q39-F43 PolarHBondContact O-N 3.34Å
40K94.4Very high94.9Very high30 Ų3069.9 Ų69.913%0.1340%0.395CS..Hα-helixtrans-65.7-39.1178.3-76.7-74.1152.6-1760112.8N18 Q21 L22 I25 G36 L37 N42 F43 I44N18-K40 PolarHBondContact OD1-NZ 3.21Å; Q21-K40 HydrophobicContact CB-CD 4.36Å; L22-K40 HydrophobicContact CD1-CB 4.38Å; I25-K40 HydrophobicContact CD1-CG 3.96Å; G36-K40 WeakPolarHBondContact O-CG 3.45Å; G36-K40 PolarHBondContact O-N 2.93Å; L37-K40 PolarHBondContact O-N 3.25Å; L37-K40 VanDerWaalsContact O-N 3.14Å; K40-N42 VanDerWaalsContact C-N 3.33Å; K40-N42 PolarHBondContact O-N 3.06Å; K40-F43 HydrophobicContact CD-CD2 4.32Å; K40-F43 PolarHBondContact O-N 2.95Å; K40-I44 WeakPolarHBondContact O-CG1 3.44Å; K40-I44 PolarHBondContact O-N 3.08Å
41L95.7Very high94.9Very high79 Ų7966.7 Ų66.741%0.41438%0.381SS..Hα-helixtrans-60-44.3173.5-71.6172000111.5L22 L37 N38 F43 I44 V45L22-L41 HydrophobicContact CD1-CD2 4.37Å; L22-L41 HydrophobicContact CD2-CD2 4.07Å; L37-L41 HydrophobicContact CD1-CD1 4.43Å; L37-L41 HydrophobicContact CD1-CG 4.45Å; L37-L41 HydrophobicContact CG-CD1 4.36Å; L37-L41 WeakPolarHBondContact O-CG 3.36Å; L37-L41 PolarHBondContact O-N 2.9Å; N38-L41 PolarHBondContact O-N 3.48Å; L41-F43 VanDerWaalsContact C-N 3.33Å; L41-F43 PolarHBondContact O-N 2.86Å; L41-I44 PolarHBondContact O-N 3.42Å; L41-V45 WeakPolarHBondContact O-CG2 3.39Å; L41-V45 PolarHBondContact O-N 3.08Å
42N96Very high94.8Very high106 Ų10666 Ų6657%0.56737%0.371SS*.Hα-helixtrans-61.6-41.8174.9-71.8-34.5000111.8N38 Q39 K40 I44 V45 T46N38-N42 PolarHBondContact O-N 2.97Å; N38-N42 VanDerWaalsContact O-N 3.09Å; N38-N42 PolarHBondContact O-ND2 2.94Å; Q39-N42 PolarHBondContact O-N 2.93Å; K40-N42 VanDerWaalsContact C-N 3.33Å; K40-N42 PolarHBondContact O-N 3.06Å; N42-I44 VanDerWaalsContact C-N 3.31Å; N42-I44 PolarHBondContact O-N 3.46Å; N42-V45 PolarHBondContact O-N 2.82Å; N42-T46 PolarHBondContact O-N 2.78Å; N42-T46 PolarHBondContact O-OG1 2.98Å; N42-T46 VanDerWaalsContact O-OG1 3.13Å
43F95.5Very high94.7Very high86 Ų8667.2 Ų67.238%0.37737%0.365SS..Hα-helixtrans-63.9-33.1175.7-68.1-27.4000113.6Q39 K40 L41 G47Q39-F43 HydrophobicContact CG-CD2 4.21Å; Q39-F43 HydrophobicContact CG-CE1 4.43Å; Q39-F43 HydrophobicContact CG-CE2 3.64Å; Q39-F43 HydrophobicContact CG-CZ 3.78Å; Q39-F43 WeakPolarHBondContact O-CG 3.41Å; Q39-F43 PolarHBondContact O-N 3.34Å; K40-F43 HydrophobicContact CD-CD2 4.32Å; K40-F43 PolarHBondContact O-N 2.95Å; L41-F43 VanDerWaalsContact C-N 3.33Å; L41-F43 PolarHBondContact O-N 2.86Å; F43-G47 WeakPolarHBondContact O-CA 3.41Å; F43-G47 PolarHBondContact O-N 3.4Å
44I95.3Very high94.5Very high27 Ų2765.7 Ų65.714%0.13835%0.354CS..Hα-helixtrans-66.7-44.7173.4-72.3167.4000110.4F15 N18 I19 L22 K40 L41 N42 G47 L48F15-I44 HydrophobicContact CE2-CB 4.34Å; F15-I44 HydrophobicContact CE2-CG2 3.8Å; F15-I44 HydrophobicContact CZ-CG2 4.23Å; N18-I44 HydrophobicContact CB-CG1 4.41Å; I19-I44 HydrophobicContact CG1-CD1 4.29Å; I19-I44 HydrophobicContact CG1-CG1 4.44Å; L22-I44 HydrophobicContact CB-CD1 4.2Å; L22-I44 HydrophobicContact CD2-CD1 3.35Å; L22-I44 HydrophobicContact CG-CD1 4.32Å; K40-I44 WeakPolarHBondContact O-CG1 3.44Å; K40-I44 PolarHBondContact O-N 3.08Å; L41-I44 PolarHBondContact O-N 3.42Å; N42-I44 VanDerWaalsContact C-N 3.31Å; N42-I44 PolarHBondContact O-N 3.46Å; I44-G47 PolarHBondContact O-N 3.38Å; I44-L48 HydrophobicContact CG2-CD1 4.48Å; I44-L48 WeakPolarHBondContact O-CG 3.36Å; I44-L48 PolarHBondContact O-N 2.88Å
45V96.3Very high94.2Very high80 Ų8070.5 Ų70.549%0.48537%0.369SS..Hα-helixtrans-60.5-48.7177174.10000110.9L41 N42 L48 Q49L41-V45 WeakPolarHBondContact O-CG2 3.39Å; L41-V45 PolarHBondContact O-N 3.08Å; N42-V45 PolarHBondContact O-N 2.82Å; V45-L48 PolarHBondContact O-N 3.36Å; V45-Q49 WeakPolarHBondContact O-CG 3.35Å; V45-Q49 PolarHBondContact O-N 2.87Å
46T95.9Very high93.8Very high63 Ų6374.6 Ų74.639%0.38738%0.375SS..Hα-helixtrans-64.7-40.3177.2-53.60000111.7N42 L48 Q49 D50N42-T46 PolarHBondContact O-N 2.78Å; N42-T46 PolarHBondContact O-OG1 2.98Å; N42-T46 VanDerWaalsContact O-OG1 3.13Å; T46-L48 PolarHBondContact O-N 3.33Å; T46-Q49 WeakPolarHBondContact O-CB 3.3Å; T46-Q49 PolarHBondContact O-N 2.83Å; T46-Q49 VanDerWaalsContact O-N 3.11Å; T46-D50 PolarHBondContact O-N 3.45Å
47G95.1Very high93.5Very high13 Ų1377.7 Ų77.713%0.13438%0.383CS..Hα-helixtrans-60.5-42.6177.500000112.8F43 I44 Q49 D50 I51F43-G47 WeakPolarHBondContact O-CA 3.41Å; F43-G47 PolarHBondContact O-N 3.4Å; I44-G47 PolarHBondContact O-N 3.38Å; G47-Q49 VanDerWaalsContact C-N 3.33Å; G47-Q49 PolarHBondContact O-N 3.37Å; G47-D50 PolarHBondContact O-N 3.28Å; G47-I51 VanDerWaalsContact O-CG1 3.29Å; G47-I51 WeakPolarHBondContact O-CG1 3.25Å; G47-I51 PolarHBondContact O-N 2.89Å
48L95.8Very high93.1Very high96 Ų9678 Ų7850%0.50338%0.384SS..Hα-helixtrans-61.7-40.3173.3-74.6172.1000112.1F15 I44 V45 T46 D52F15-L48 HydrophobicContact CE1-CD2 4.14Å; F15-L48 HydrophobicContact CE2-CD1 4.49Å; F15-L48 HydrophobicContact CE2-CD2 3.85Å; F15-L48 HydrophobicContact CE2-CG 3.65Å; F15-L48 HydrophobicContact CZ-CD1 4.39Å; F15-L48 HydrophobicContact CZ-CD2 3.49Å; F15-L48 VanDerWaalsContact CZ-CD2 3.49Å; F15-L48 HydrophobicContact CZ-CG 3.74Å; I44-L48 HydrophobicContact CG2-CD1 4.48Å; I44-L48 WeakPolarHBondContact O-CG 3.36Å; I44-L48 PolarHBondContact O-N 2.88Å; V45-L48 PolarHBondContact O-N 3.36Å; T46-L48 PolarHBondContact O-N 3.33Å; L48-D52 PolarHBondContact O-N 3.28Å
49Q95.4Very high92.6Very high106 Ų10681.9 Ų81.950%0.49540%0.4SS..Hα-helixtrans-65.3-38.8176.5-68.6172.7-19.100112V45 T46 G47 D52 K53V45-Q49 WeakPolarHBondContact O-CG 3.35Å; V45-Q49 PolarHBondContact O-N 2.87Å; T46-Q49 WeakPolarHBondContact O-CB 3.3Å; T46-Q49 PolarHBondContact O-N 2.83Å; T46-Q49 VanDerWaalsContact O-N 3.11Å; G47-Q49 VanDerWaalsContact C-N 3.33Å; G47-Q49 PolarHBondContact O-N 3.37Å; Q49-D52 PolarHBondContact O-N 2.92Å; Q49-K53 VanDerWaalsContact O-CG 3.31Å; Q49-K53 WeakPolarHBondContact O-CG 3.42Å; Q49-K53 PolarHBondContact O-N 3.33Å
50D92.9Very high92.3Very high44 Ų4480.9 Ų80.924%0.23540%0.398CS..Hα-helixtrans-72-37.9179.5-68.9-22.1000111.8T46 G47 K53 C54T46-D50 PolarHBondContact O-N 3.45Å; G47-D50 PolarHBondContact O-N 3.28Å; D50-K53 PolarHBondContact O-N 3.43Å; D50-K53 IonicContact OD1-NZ 3.38Å; D50-K53 PolarHBondContact OD1-NZ 2.92Å; D50-C54 PolarHBondContact O-N 2.93Å; D50-C54 PolarHBondContact O-SG 3.2Å
51I94.1Very high92.1Very high34 Ų3482.4 Ų82.417%0.17441%0.407CS..Hα-helixtrans-60.4-45.3170.4-68.4162.9000110.7L8 H11 L12 F15 G47 K53 C54L8-I51 HydrophobicContact CD1-CG2 4.15Å; H11-I51 HydrophobicContact CB-CG1 4.13Å; L12-I51 HydrophobicContact CD2-CD1 3.93Å; L12-I51 HydrophobicContact CD2-CG1 4.34Å; L12-I51 HydrophobicContact CD2-CG2 4.39Å; F15-I51 HydrophobicContact CB-CD1 3.8Å; F15-I51 HydrophobicContact CD1-CD1 4.05Å; F15-I51 HydrophobicContact CD2-CD1 4.2Å; F15-I51 HydrophobicContact CG-CD1 3.75Å; G47-I51 VanDerWaalsContact O-CG1 3.29Å; G47-I51 WeakPolarHBondContact O-CG1 3.25Å; G47-I51 PolarHBondContact O-N 2.89Å; I51-K53 VanDerWaalsContact C-N 3.33Å; I51-K53 PolarHBondContact O-N 2.95Å; I51-C54 WeakPolarHBondContact O-CB 3.31Å; I51-C54 PolarHBondContact O-N 3.49Å; I51-C54 VanDerWaalsContact O-N 3.12Å
52D93.2Very high91.8Very high103 Ų10384.8 Ų84.855%0.55143%0.425SS*.Hα-helixtrans-63.9-36.5178.8-173.260.7000112.3L48 Q49 C54 R55L48-D52 PolarHBondContact O-N 3.28Å; Q49-D52 PolarHBondContact O-N 2.92Å; D52-C54 VanDerWaalsContact C-N 3.28Å; D52-C54 PolarHBondContact O-N 3.06Å; D52-R55 WeakPolarHBondContact O-CB 3.47Å; D52-R55 PolarHBondContact O-N 3.34Å; D52-R55 VanDerWaalsContact O-N 3.12Å
53K91.8Very high91.6Very high116 Ų11683.4 Ų83.450%0.50442%0.42SS..Hα-helixtrans-61.6-35.3173.2-70.3168.1-160.61600112.5Q49 D50 I51 R55 Q56Q49-K53 VanDerWaalsContact O-CG 3.31Å; Q49-K53 WeakPolarHBondContact O-CG 3.42Å; Q49-K53 PolarHBondContact O-N 3.33Å; D50-K53 PolarHBondContact O-N 3.43Å; D50-K53 IonicContact OD1-NZ 3.38Å; D50-K53 PolarHBondContact OD1-NZ 2.92Å; I51-K53 VanDerWaalsContact C-N 3.33Å; I51-K53 PolarHBondContact O-N 2.95Å; K53-R55 PolarHBondContact O-N 3.39Å; K53-Q56 PolarHBondContact O-N 3.36Å
54C90.3Very high91.5Very high5 Ų581.9 Ų81.93%0.03442%0.418CS..Hα-helixtrans-62.3-26.2177.6-63.70000112.2L8 D50 I51 D52 Q56 Q57L8-C54 HydrophobicContact CB-CB 4.42Å; L8-C54 HydrophobicContact CD1-CB 3.96Å; D50-C54 PolarHBondContact O-N 2.93Å; D50-C54 PolarHBondContact O-SG 3.2Å; I51-C54 WeakPolarHBondContact O-CB 3.31Å; I51-C54 PolarHBondContact O-N 3.49Å; I51-C54 VanDerWaalsContact O-N 3.12Å; D52-C54 VanDerWaalsContact C-N 3.28Å; D52-C54 PolarHBondContact O-N 3.06Å; C54-Q56 PolarHBondContact O-N 2.88Å; C54-Q56 VanDerWaalsContact O-N 3.14Å; C54-Q57 WeakPolarHBondContact O-CB 3.4Å; C54-Q57 PolarHBondContact O-N 3.45Å
55R86.8Confident91.5Very high183 Ų18387 Ų8769%0.69145%0.445SS*.G310 helixtrans-52.5-37.4177.4-174.8-175.6173.9176.80.5113D52 K53 Q57 L58D52-R55 WeakPolarHBondContact O-CB 3.47Å; D52-R55 PolarHBondContact O-N 3.34Å; D52-R55 VanDerWaalsContact O-N 3.12Å; K53-R55 PolarHBondContact O-N 3.39Å; R55-Q57 PolarHBondContact O-N 3.29Å; R55-L58 PolarHBondContact O-N 3.24Å
56Q86.8Confident91.4Very high158 Ų15887.7 Ų87.774%0.73844%0.443SS*.G310 helixtrans-60.4-29.9-178.4-64.9-175.2-8.200112.4K53 C54 L58 H59K53-Q56 PolarHBondContact O-N 3.36Å; C54-Q56 PolarHBondContact O-N 2.88Å; C54-Q56 VanDerWaalsContact O-N 3.14Å; Q56-L58 VanDerWaalsContact C-N 3.3Å; Q56-L58 PolarHBondContact O-N 3.29Å; Q56-H59 PolarHBondContact O-ND1 3.37Å
57Q86.4Confident91.4Very high93 Ų9385.5 Ų85.544%0.43543%0.43SS..G310 helixtrans-80.6-12.6-179.7-55.3-178.21100112.8K4 C54 R55K4-Q57 HydrophobicContact CB-CB 4.38Å; K4-Q57 WeakPolarHBondContact CD-O 3.38Å; C54-Q57 WeakPolarHBondContact O-CB 3.4Å; C54-Q57 PolarHBondContact O-N 3.45Å; R55-Q57 PolarHBondContact O-N 3.29Å
58L86.9Confident91.4Very high30 Ų3089.5 Ų89.516%0.15744%0.444CS..G310 helixtrans-112.814.5-171.7-58.5172.1000112.9K4 F5 L8 R55 Q56 D60 I61K4-L58 HydrophobicContact CB-CD2 4.45Å; K4-L58 HydrophobicContact CD-CD2 3.96Å; K4-L58 HydrophobicContact CG-CD2 4.11Å; F5-L58 HydrophobicContact CD1-CD2 4.02Å; F5-L58 HydrophobicContact CE1-CD2 3.92Å; F5-L58 HydrophobicContact CZ-CD2 4.48Å; L8-L58 HydrophobicContact CB-CD1 4.42Å; L8-L58 HydrophobicContact CD2-CD1 3.42Å; L8-L58 VanDerWaalsContact CD2-CD1 3.42Å; L8-L58 HydrophobicContact CG-CD1 4.4Å; R55-L58 PolarHBondContact O-N 3.24Å; Q56-L58 VanDerWaalsContact C-N 3.3Å; Q56-L58 PolarHBondContact O-N 3.29Å; L58-D60 PolarHBondContact O-N 2.78Å; L58-D60 VanDerWaalsContact O-N 3.15Å; L58-I61 HydrophobicContact CB-CD1 3.97Å; L58-I61 HydrophobicContact CD2-CD1 3.42Å; L58-I61 VanDerWaalsContact CD2-CD1 3.42Å; L58-I61 HydrophobicContact CG-CD1 4.27Å; L58-I61 PolarHBondContact O-N 3.47Å; L58-I61 VanDerWaalsContact O-N 3.08Å
59H85.2Confident91.3Very high160 Ų16090.7 Ų90.774%0.74145%0.447SS*.THydrogen-bonded Turntrans-62.1-21.7-175.762.8-89.5000114.3Q56 I61Q56-H59 PolarHBondContact O-ND1 3.37Å; H59-I61 VanDerWaalsContact C-N 3.32Å
60D89Confident91.4Very high86 Ų8686.7 Ų86.746%0.4643%0.427SS..THydrogen-bonded Turntrans-84.9-2.9178.961.6-42.2000113.4K4 L58K4-D60 IonicContact NZ-OD1 2.77Å; K4-D60 PolarHBondContact NZ-OD1 3.28Å; K4-D60 IonicContact NZ-OD2 2.61Å; K4-D60 PolarHBondContact NZ-OD2 3.11Å; L58-D60 PolarHBondContact O-N 2.78Å; L58-D60 VanDerWaalsContact O-N 3.15Å
61I89.6Confident91.5Very high62 Ų6288.8 Ų88.832%0.31844%0.438SS..  trans-103.6128.4-174.1-59.9161.4000109.8F5 L58 H59 V63F5-I61 HydrophobicContact CE1-CD1 3.36Å; F5-I61 HydrophobicContact CE2-CD1 4.15Å; F5-I61 HydrophobicContact CZ-CD1 3.14Å; F5-I61 HydrophobicContact CZ-CG1 4.13Å; L58-I61 HydrophobicContact CB-CD1 3.97Å; L58-I61 HydrophobicContact CD2-CD1 3.42Å; L58-I61 VanDerWaalsContact CD2-CD1 3.42Å; L58-I61 HydrophobicContact CG-CD1 4.27Å; L58-I61 PolarHBondContact O-N 3.47Å; L58-I61 VanDerWaalsContact O-N 3.08Å; H59-I61 VanDerWaalsContact C-N 3.32Å; I61-V63 HydrophobicContact CG2-CG2 4.49Å
62T90.6Very high91.5Very high130 Ų13093.7 Ų93.780%0.79846%0.464SS*.  trans-115.5127.2172.1-55.90000109.1
63V91.1Very high91.7Very high77 Ų7794.6 Ų94.647%0.46747%0.465SS..  trans-100.2122.2174.6-177.20000108.1I61 V67 F68I61-V63 HydrophobicContact CG2-CG2 4.49Å; V63-V67 HydrophobicContact CG1-CB 4.29Å; V63-F68 HydrophobicContact CG1-CE2 4.24Å; V63-F68 HydrophobicContact CG1-CZ 4.28Å
64P94.3Very high91.9Very high53 Ų5392.5 Ų92.534%0.34448%0.477SS..  trans-59.3138.5175-21.832.5000111.3E66 V67 Y80P64-E66 WeakPolarHBondContact CB-OE2 3.38Å; P64-E66 PolarHBondContact O-N 3.28Å; P64-V67 HydrophobicContact CB-CG2 4.13Å; P64-V67 HydrophobicContact CG-CG2 4.31Å; P64-V67 WeakPolarHBondContact O-CB 2.83Å; P64-V67 PolarHBondContact O-N 3.5Å; P64-V67 VanDerWaalsContact O-N 3.11Å; P64-Y80 HydrophobicContact CB-CE1 4.01Å; P64-Y80 HydrophobicContact CG-CE1 4.04Å
65L93.7Very high92.1Very high134 Ų13498.4 Ų98.470%0.70250%0.498SS*.Hα-helixtrans-64.7-32-174.9-72176.5000112.1V67 F68L65-V67 PolarHBondContact O-N 3.05Å; L65-V67 VanDerWaalsContact O-N 3.17Å; L65-F68 HydrophobicContact CD2-CD2 4.1Å; L65-F68 HydrophobicContact CD2-CE2 4.05Å; L65-F68 WeakPolarHBondContact O-CB 3.49Å; L65-F68 WeakPolarHBondContact O-CD2 3.17Å; L65-F68 PolarHBondContact O-N 3.14Å
66E93.8Very high92.6Very high95 Ų9593.5 Ų93.544%0.44449%0.486SS..Hα-helixtrans-61.2-24.5178.5-58.284.4171.800112.1P64 F68 E69 Y70 Y80P64-E66 WeakPolarHBondContact CB-OE2 3.38Å; P64-E66 PolarHBondContact O-N 3.28Å; E66-F68 VanDerWaalsContact C-N 3.3Å; E66-F68 PolarHBondContact O-N 3.08Å; E66-E69 PolarHBondContact O-N 3.18Å; E66-Y70 WeakPolarHBondContact O-CD2 3.33Å; E66-Y80 HydrophobicContact CB-CD2 3.99Å; E66-Y80 HydrophobicContact CB-CE2 3.48Å; E66-Y80 VanDerWaalsContact CB-CE2 3.48Å; E66-Y80 HydrophobicContact CG-CE2 4.19Å
67V96.4Very high93Very high18 Ų1888.4 Ų88.411%0.10947%0.466CS..Hα-helixtrans-66.9-33.1175.9177.40000111.3V63 P64 L65 E69 Y70 I71 P77 Y80V63-V67 HydrophobicContact CG1-CB 4.29Å; P64-V67 HydrophobicContact CB-CG2 4.13Å; P64-V67 HydrophobicContact CG-CG2 4.31Å; P64-V67 WeakPolarHBondContact O-CB 2.83Å; P64-V67 PolarHBondContact O-N 3.5Å; P64-V67 VanDerWaalsContact O-N 3.11Å; L65-V67 PolarHBondContact O-N 3.05Å; L65-V67 VanDerWaalsContact O-N 3.17Å; V67-E69 VanDerWaalsContact C-N 3.25Å; V67-E69 PolarHBondContact O-N 2.89Å; V67-Y70 WeakPolarHBondContact O-CB 3.39Å; V67-Y70 PolarHBondContact O-N 3.44Å; V67-Y70 VanDerWaalsContact O-N 3.11Å; V67-I71 HydrophobicContact CG1-CD1 4.21Å; V67-I71 PolarHBondContact O-N 3.17Å; V67-P77 HydrophobicContact CG1-CB 3.86Å; V67-Y80 HydrophobicContact CG2-CD1 3.4Å; V67-Y80 HydrophobicContact CG2-CE1 3.83Å; V67-Y80 HydrophobicContact CG2-CG 3.86Å
68F95.2Very high93.4Very high97 Ų9790.7 Ų90.743%0.42548%0.477SS..Hα-helixtrans-62.4-34.6178.8-68-75.3000111.8V63 L65 E66 Y70 I71 D72V63-F68 HydrophobicContact CG1-CE2 4.24Å; V63-F68 HydrophobicContact CG1-CZ 4.28Å; L65-F68 HydrophobicContact CD2-CD2 4.1Å; L65-F68 HydrophobicContact CD2-CE2 4.05Å; L65-F68 WeakPolarHBondContact O-CB 3.49Å; L65-F68 WeakPolarHBondContact O-CD2 3.17Å; L65-F68 PolarHBondContact O-N 3.14Å; E66-F68 VanDerWaalsContact C-N 3.3Å; E66-F68 PolarHBondContact O-N 3.08Å; F68-Y70 VanDerWaalsContact C-N 3.25Å; F68-Y70 PolarHBondContact O-N 2.96Å; F68-I71 PolarHBondContact O-N 3.02Å; F68-I71 VanDerWaalsContact O-N 3.07Å; F68-D72 WeakPolarHBondContact O-CB 3.34Å; F68-D72 PolarHBondContact O-N 2.84Å
69E94.9Very high93.8Very high120 Ų12092.3 Ų92.356%0.56149%0.485SS*.Hα-helixtrans-60.8-34.7176-62.7-176.5177.500112.5E66 V67 Q73E66-E69 PolarHBondContact O-N 3.18Å; V67-E69 VanDerWaalsContact C-N 3.25Å; V67-E69 PolarHBondContact O-N 2.89Å; E69-Q73 WeakPolarHBondContact O-CB 3.27Å; E69-Q73 VanDerWaalsContact O-CD 3.3Å; E69-Q73 WeakPolarHBondContact O-CG 3.31Å; E69-Q73 PolarHBondContact O-N 3.07Å; E69-Q73 PolarHBondContact O-NE2 3.24Å
70Y95.7Very high94.3Very high22 Ų2286.5 Ų86.59%0.08646%0.457CS..Hα-helixtrans-69.1-42.7174.8-71.6-105.5000110.7E66 V67 F68 Q73 G74 R75 L79 Y80 E83E66-Y70 WeakPolarHBondContact O-CD2 3.33Å; V67-Y70 WeakPolarHBondContact O-CB 3.39Å; V67-Y70 PolarHBondContact O-N 3.44Å; V67-Y70 VanDerWaalsContact O-N 3.11Å; F68-Y70 VanDerWaalsContact C-N 3.25Å; F68-Y70 PolarHBondContact O-N 2.96Å; Y70-Q73 PolarHBondContact O-N 3.25Å; Y70-G74 PolarHBondContact O-N 3.19Å; Y70-R75 HydrophobicContact CD1-CB 4.12Å; Y70-R75 WeakPolarHBondContact O-CA 3.46Å; Y70-R75 WeakPolarHBondContact O-CB 3.43Å; Y70-R75 PolarHBondContact O-N 3.06Å; Y70-L79 HydrophobicContact CD1-CB 4.04Å; Y70-L79 HydrophobicContact CE1-CB 3.74Å; Y70-Y80 AromaticContact CE2-CD2 3.92Å; Y70-Y80 HydrophobicContact CE2-CD2 3.92Å; Y70-Y80 HydrophobicContact CE2-CG 4.28Å; Y70-E83 PolarHBondContact OH-OE1 3.28Å; Y70-E83 PolarHBondContact OH-OE2 3.34Å
71I95.6Very high94.6Very high89 Ų8986.3 Ų86.346%0.45646%0.459SS..Hα-helixtrans-64-49.2179.7-62171.7000110.7V67 F68 Q73 G74 P77V67-I71 HydrophobicContact CG1-CD1 4.21Å; V67-I71 PolarHBondContact O-N 3.17Å; F68-I71 PolarHBondContact O-N 3.02Å; F68-I71 VanDerWaalsContact O-N 3.07Å; I71-Q73 PolarHBondContact O-N 3.11Å; I71-G74 WeakPolarHBondContact O-CA 3.5Å; I71-G74 PolarHBondContact O-N 2.97Å; I71-P77 HydrophobicContact CD1-CG 4.34Å; I71-P77 HydrophobicContact CG1-CG 3.71Å
72D95.5Very high94.9Very high137 Ų13788.7 Ų88.773%0.73347%0.467SS*.Hα-helixtrans-62.5-29.9-178-71-16.7000112.3F68 G74F68-D72 WeakPolarHBondContact O-CB 3.34Å; F68-D72 PolarHBondContact O-N 2.84Å; D72-G74 VanDerWaalsContact C-N 3.31Å
73Q96.4Very high95.2Very high121 Ų12185.5 Ų85.557%0.56544%0.443SS*.THydrogen-bonded Turntrans-85.70.5174.8-66.2171.125.800113.4E69 Y70 I71 R75E69-Q73 WeakPolarHBondContact O-CB 3.27Å; E69-Q73 VanDerWaalsContact O-CD 3.3Å; E69-Q73 WeakPolarHBondContact O-CG 3.31Å; E69-Q73 PolarHBondContact O-N 3.07Å; E69-Q73 PolarHBondContact O-NE2 3.24Å; Y70-Q73 PolarHBondContact O-N 3.25Å; I71-Q73 PolarHBondContact O-N 3.11Å; Q73-R75 VanDerWaalsContact C-N 3.25Å; Q73-R75 HydrophobicContact CB-CG 3.92Å; Q73-R75 PolarHBondContact O-N 2.67Å
74G95.3Very high95.4Very high73 Ų7384.4 Ų84.475%0.75344%0.438SS*.THydrogen-bonded Turntrans67.821.5-175.900000114.1Y70 I71 D72Y70-G74 PolarHBondContact O-N 3.19Å; I71-G74 WeakPolarHBondContact O-CA 3.5Å; I71-G74 PolarHBondContact O-N 2.97Å; D72-G74 VanDerWaalsContact C-N 3.31Å
75R96.2Very high95.5Very high129 Ų12987.5 Ų87.549%0.48745%0.451SS..  trans-90.9155.9177.8-55.7-179.587.2-172.93.3110.2Y70 Q73 P77Y70-R75 HydrophobicContact CD1-CB 4.12Å; Y70-R75 WeakPolarHBondContact O-CA 3.46Å; Y70-R75 WeakPolarHBondContact O-CB 3.43Å; Y70-R75 PolarHBondContact O-N 3.06Å; Q73-R75 VanDerWaalsContact C-N 3.25Å; Q73-R75 HydrophobicContact CB-CG 3.92Å; Q73-R75 PolarHBondContact O-N 2.67Å; R75-P77 VanDerWaalsContact O-CD 3.27Å; R75-P77 WeakPolarHBondContact O-CD 3.36Å
76N95.7Very high95.7Very high80 Ų8085.9 Ų85.943%0.42844%0.44SS..  trans-68.3120.1177.1-178.6-11.2000110.9Q78 L79N76-Q78 PolarHBondContact O-N 3.08Å; N76-Q78 VanDerWaalsContact O-N 3.14Å; N76-Q78 WeakPolarHBondContact OD1-CB 3.44Å; N76-Q78 WeakPolarHBondContact OD1-CG 3.32Å; N76-Q78 PolarHBondContact OD1-N 3.25Å; N76-L79 HydrophobicContact CB-CD1 4.38Å; N76-L79 HydrophobicContact CB-CG 4.28Å; N76-L79 VanDerWaalsContact O-CB 3.31Å; N76-L79 WeakPolarHBondContact O-CB 3.44Å; N76-L79 WeakPolarHBondContact O-CG 3.41Å; N76-L79 PolarHBondContact O-N 3.2Å
77P95.8Very high95.9Very high50 Ų5087.3 Ų87.333%0.32544%0.442SS..THydrogen-bonded Turntrans-55.8-27.6176.8-30.339.8000114.9V67 I71 R75 L79 Y80V67-P77 HydrophobicContact CG1-CB 3.86Å; I71-P77 HydrophobicContact CD1-CG 4.34Å; I71-P77 HydrophobicContact CG1-CG 3.71Å; R75-P77 VanDerWaalsContact O-CD 3.27Å; R75-P77 WeakPolarHBondContact O-CD 3.36Å; P77-L79 PolarHBondContact O-N 3.09Å; P77-Y80 WeakPolarHBondContact O-CB 3.39Å; P77-Y80 PolarHBondContact O-N 3.46Å; P77-Y80 VanDerWaalsContact O-N 3.08Å
78Q94.5Very high96Very high141 Ų14189.2 Ų89.266%0.65946%0.459SS*.Hα-helixtrans-64.8-20178.5-64.3-179.6-16.600112.9N76 Y80 T81 K82N76-Q78 PolarHBondContact O-N 3.08Å; N76-Q78 VanDerWaalsContact O-N 3.14Å; N76-Q78 WeakPolarHBondContact OD1-CB 3.44Å; N76-Q78 WeakPolarHBondContact OD1-CG 3.32Å; N76-Q78 PolarHBondContact OD1-N 3.25Å; Q78-Y80 VanDerWaalsContact C-N 3.3Å; Q78-Y80 PolarHBondContact O-N 3.49Å; Q78-T81 PolarHBondContact O-N 2.96Å; Q78-K82 PolarHBondContact O-N 2.94Å
79L95.7Very high96.1Very high64 Ų6489.5 Ų89.534%0.33547%0.465SS..Hα-helixtrans-63.5-37.8173.1-65.5175.1000111.3Y70 N76 P77 T81 K82 E83Y70-L79 HydrophobicContact CD1-CB 4.04Å; Y70-L79 HydrophobicContact CE1-CB 3.74Å; N76-L79 HydrophobicContact CB-CD1 4.38Å; N76-L79 HydrophobicContact CB-CG 4.28Å; N76-L79 VanDerWaalsContact O-CB 3.31Å; N76-L79 WeakPolarHBondContact O-CB 3.44Å; N76-L79 WeakPolarHBondContact O-CG 3.41Å; N76-L79 PolarHBondContact O-N 3.2Å; P77-L79 PolarHBondContact O-N 3.09Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-T81 PolarHBondContact O-N 3.47Å; L79-K82 PolarHBondContact O-N 3.21Å; L79-E83 WeakPolarHBondContact O-CG 3.5Å; L79-E83 PolarHBondContact O-N 2.9Å
80Y95.6Very high96.3Very high39 Ų3986.3 Ų86.315%0.15346%0.459CS..Hα-helixtrans-58.3-48173.3173-100.5000111.2P64 E66 V67 Y70 P77 Q78 K82 E83 C84P64-Y80 HydrophobicContact CB-CE1 4.01Å; P64-Y80 HydrophobicContact CG-CE1 4.04Å; E66-Y80 HydrophobicContact CB-CD2 3.99Å; E66-Y80 HydrophobicContact CB-CE2 3.48Å; E66-Y80 VanDerWaalsContact CB-CE2 3.48Å; E66-Y80 HydrophobicContact CG-CE2 4.19Å; V67-Y80 HydrophobicContact CG2-CD1 3.4Å; V67-Y80 HydrophobicContact CG2-CE1 3.83Å; V67-Y80 HydrophobicContact CG2-CG 3.86Å; Y70-Y80 AromaticContact CE2-CD2 3.92Å; Y70-Y80 HydrophobicContact CE2-CD2 3.92Å; Y70-Y80 HydrophobicContact CE2-CG 4.28Å; P77-Y80 WeakPolarHBondContact O-CB 3.39Å; P77-Y80 PolarHBondContact O-N 3.46Å; P77-Y80 VanDerWaalsContact O-N 3.08Å; Q78-Y80 VanDerWaalsContact C-N 3.3Å; Q78-Y80 PolarHBondContact O-N 3.49Å; Y80-K82 VanDerWaalsContact C-N 3.33Å; Y80-K82 PolarHBondContact O-N 3.27Å; Y80-E83 PolarHBondContact O-N 3.26Å; Y80-C84 VanDerWaalsContact O-CB 3.31Å; Y80-C84 WeakPolarHBondContact O-CB 3.34Å; Y80-C84 PolarHBondContact O-N 2.66Å
81T95.4Very high96.4Very high81 Ų8190.8 Ų90.850%0.49748%0.479SS..Hα-helixtrans-59.2-46.2178.1-54.70000111Q78 L79 C84 L85Q78-T81 PolarHBondContact O-N 2.96Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-T81 PolarHBondContact O-N 3.47Å; T81-C84 PolarHBondContact O-N 3.38Å; T81-L85 HydrophobicContact CG2-CD1 4.39Å; T81-L85 WeakPolarHBondContact O-CG 3.49Å; T81-L85 PolarHBondContact O-N 3.28Å
82K96.3Very high96.5Very high112 Ų11291.7 Ų91.749%0.48749%0.485SS..Hα-helixtrans-57.6-52.9176.7177.1-177.3169.2-178.10111.4Q78 L79 Y80 C84 L85 E86Q78-K82 PolarHBondContact O-N 2.94Å; L79-K82 PolarHBondContact O-N 3.21Å; Y80-K82 VanDerWaalsContact C-N 3.33Å; Y80-K82 PolarHBondContact O-N 3.27Å; K82-C84 VanDerWaalsContact C-N 3.28Å; K82-C84 PolarHBondContact O-N 2.75Å; K82-L85 PolarHBondContact O-N 3.41Å; K82-E86 WeakPolarHBondContact CE-OE1 3.32Å; K82-E86 IonicContact NZ-OE1 2.69Å; K82-E86 WeakPolarHBondContact O-CG 3.36Å; K82-E86 PolarHBondContact O-N 2.96Å
83E95.6Very high96.7Very high63 Ų6391.1 Ų91.129%0.29448%0.478SS..Hα-helixtrans-63.3-35.6-179.2-69.9177.3-154.900112.3Y70 L79 Y80 E86 R87Y70-E83 PolarHBondContact OH-OE1 3.28Å; Y70-E83 PolarHBondContact OH-OE2 3.34Å; L79-E83 WeakPolarHBondContact O-CG 3.5Å; L79-E83 PolarHBondContact O-N 2.9Å; Y80-E83 PolarHBondContact O-N 3.26Å; E83-E86 PolarHBondContact O-N 3.5Å; E83-R87 WeakPolarHBondContact O-CB 3.47Å; E83-R87 VanDerWaalsContact O-CG 3.3Å; E83-R87 WeakPolarHBondContact O-CG 3.46Å; E83-R87 PolarHBondContact O-N 2.9Å; E83-R87 IonicContact OE2-NH1 2.7Å; E83-R87 PolarHBondContact OE2-NH1 3.21Å; E83-R87 VanDerWaalsContact OE2-NH1 3.08Å
84C95.6Very high96.8Very high54 Ų5490 Ų9037%0.36547%0.472SS..Hα-helixtrans-61.8-45.2175.8-171.40000111.1Y80 T81 K82 R87 A88Y80-C84 VanDerWaalsContact O-CB 3.31Å; Y80-C84 WeakPolarHBondContact O-CB 3.34Å; Y80-C84 PolarHBondContact O-N 2.66Å; T81-C84 PolarHBondContact O-N 3.38Å; K82-C84 VanDerWaalsContact C-N 3.28Å; K82-C84 PolarHBondContact O-N 2.75Å; C84-R87 PolarHBondContact O-N 2.96Å; C84-A88 WeakPolarHBondContact O-CB 3.47Å; C84-A88 PolarHBondContact O-N 3.36Å
85L97.3Very high96.9Very high118 Ų11889.4 Ų89.462%0.61845%0.454SS*.Hα-helixtrans-63.2-44.1175.4-68171.4000111.7T81 K82 A88 L89T81-L85 HydrophobicContact CG2-CD1 4.39Å; T81-L85 WeakPolarHBondContact O-CG 3.49Å; T81-L85 PolarHBondContact O-N 3.28Å; K82-L85 PolarHBondContact O-N 3.41Å; L85-A88 PolarHBondContact O-N 3.18Å; L85-L89 WeakPolarHBondContact O-CB 3.42Å; L85-L89 PolarHBondContact O-N 2.77Å
86E97.9Very high97Very high100 Ų10089.3 Ų89.347%0.46746%0.457SS..Hα-helixtrans-62.6-43.9177.3-72174.7167.600111.8K82 E83 A88 L89 A90K82-E86 WeakPolarHBondContact CE-OE1 3.32Å; K82-E86 IonicContact NZ-OE1 2.69Å; K82-E86 WeakPolarHBondContact O-CG 3.36Å; K82-E86 PolarHBondContact O-N 2.96Å; E83-E86 PolarHBondContact O-N 3.5Å; E86-A88 PolarHBondContact O-N 3.33Å; E86-L89 PolarHBondContact O-N 2.86Å; E86-A90 WeakPolarHBondContact O-CB 3.36Å; E86-A90 PolarHBondContact O-N 3.15Å
87R97.3Very high97.2Very high125 Ų12587.1 Ų87.147%0.47245%0.453SS..Hα-helixtrans-61.8-42.6174.3-76.1-171.2-62.9-96.52.7111.8E83 C84 K91E83-R87 WeakPolarHBondContact O-CB 3.47Å; E83-R87 VanDerWaalsContact O-CG 3.3Å; E83-R87 WeakPolarHBondContact O-CG 3.46Å; E83-R87 PolarHBondContact O-N 2.9Å; E83-R87 IonicContact OE2-NH1 2.7Å; E83-R87 PolarHBondContact OE2-NH1 3.21Å; E83-R87 VanDerWaalsContact OE2-NH1 3.08Å; C84-R87 PolarHBondContact O-N 2.96Å; R87-K91 VanDerWaalsContact O-CB 3.25Å; R87-K91 WeakPolarHBondContact O-CB 3.3Å; R87-K91 PolarHBondContact O-N 3.5Å
88A98.2Very high97.3Very high58 Ų5890.8 Ų90.848%0.47946%0.464SS..Hα-helixtrans-63.3-43.417800000111.5C84 L85 E86 K91 N92C84-A88 WeakPolarHBondContact O-CB 3.47Å; C84-A88 PolarHBondContact O-N 3.36Å; L85-A88 PolarHBondContact O-N 3.18Å; E86-A88 PolarHBondContact O-N 3.33Å; A88-K91 PolarHBondContact O-N 3.2Å; A88-N92 WeakPolarHBondContact O-CB 3.27Å; A88-N92 PolarHBondContact O-N 3.01Å
89L98.2Very high97.5Very high103 Ų10388 Ų8854%0.53945%0.453SS..Hα-helixtrans-61.4-53.6175.8178.562.9000111.4L85 E86 K91 N92 E93L85-L89 WeakPolarHBondContact O-CB 3.42Å; L85-L89 PolarHBondContact O-N 2.77Å; E86-L89 PolarHBondContact O-N 2.86Å; L89-K91 PolarHBondContact O-N 3.47Å; L89-N92 WeakPolarHBondContact O-CB 3.43Å; L89-N92 PolarHBondContact O-N 3.12Å; L89-E93 HydrophobicContact CD1-CG 4.49Å; L89-E93 PolarHBondContact O-N 3.42Å
90A98.4Very high97.6Very high54 Ų5488.7 Ų88.745%0.44646%0.457SS..Hα-helixtrans-58-38.6178.700000111.7E86 Q94E86-A90 WeakPolarHBondContact O-CB 3.36Å; E86-A90 PolarHBondContact O-N 3.15Å; A90-Q94 WeakPolarHBondContact O-CB 3.36Å; A90-Q94 PolarHBondContact O-N 3.03Å
91K98.3Very high97.7Very high115 Ų11591.5 Ų91.550%0.548%0.478SS..Hα-helixtrans-67-41.1176.7-170.959.6173.8-173.90112.2R87 A88 L89 Q94 V95R87-K91 VanDerWaalsContact O-CB 3.25Å; R87-K91 WeakPolarHBondContact O-CB 3.3Å; R87-K91 PolarHBondContact O-N 3.5Å; A88-K91 PolarHBondContact O-N 3.2Å; L89-K91 PolarHBondContact O-N 3.47Å; K91-Q94 PolarHBondContact O-N 3.06Å; K91-V95 HydrophobicContact CD-CG2 4.47Å; K91-V95 WeakPolarHBondContact O-CB 3.17Å; K91-V95 VanDerWaalsContact O-CG2 3.27Å; K91-V95 WeakPolarHBondContact O-CG2 3.42Å; K91-V95 PolarHBondContact O-N 2.96Å
92N98.4Very high97.8Very high108 Ų10893.6 Ų93.658%0.57848%0.484SS*.Hα-helixtrans-61.6-49.1177.3-171.5-12.5000110.8A88 L89 Q94 V95 K96A88-N92 WeakPolarHBondContact O-CB 3.27Å; A88-N92 PolarHBondContact O-N 3.01Å; L89-N92 WeakPolarHBondContact O-CB 3.43Å; L89-N92 PolarHBondContact O-N 3.12Å; N92-Q94 VanDerWaalsContact C-N 3.34Å; N92-Q94 PolarHBondContact O-N 3.48Å; N92-V95 PolarHBondContact O-N 2.96Å; N92-K96 WeakPolarHBondContact O-CB 3.43Å; N92-K96 PolarHBondContact O-N 3.35Å
93E98.4Very high97.8Very high126 Ų12693.3 Ų93.359%0.58948%0.483SS*.Hα-helixtrans-59.6-43.8176.3-68.2-179.1154.800112.1L89 V95 K96 G97L89-E93 HydrophobicContact CD1-CG 4.49Å; L89-E93 PolarHBondContact O-N 3.42Å; E93-V95 PolarHBondContact O-N 3.1Å; E93-K96 PolarHBondContact O-N 2.92Å; E93-G97 PolarHBondContact O-N 3.13Å
94Q98.4Very high97.9Very high96 Ų9697.3 Ų97.345%0.44950%0.499SS..Hα-helixtrans-59.3-45.4175.7-171.5-169.734.700111.7A90 K91 N92 G97 K98A90-Q94 WeakPolarHBondContact O-CB 3.36Å; A90-Q94 PolarHBondContact O-N 3.03Å; K91-Q94 PolarHBondContact O-N 3.06Å; N92-Q94 VanDerWaalsContact C-N 3.34Å; N92-Q94 PolarHBondContact O-N 3.48Å; Q94-G97 PolarHBondContact O-N 3.21Å; Q94-K98 WeakPolarHBondContact O-CG 3.48Å; Q94-K98 PolarHBondContact O-N 3.32Å; Q94-K98 VanDerWaalsContact O-N 3.12Å
95V98.4Very high98Very high61 Ų61100.5 Ų100.537%0.3751%0.507SS..Hα-helixtrans-67.1-41.7179.8170.20000110.7K91 N92 E93 G97 K98 I99K91-V95 HydrophobicContact CD-CG2 4.47Å; K91-V95 WeakPolarHBondContact O-CB 3.17Å; K91-V95 VanDerWaalsContact O-CG2 3.27Å; K91-V95 WeakPolarHBondContact O-CG2 3.42Å; K91-V95 PolarHBondContact O-N 2.96Å; N92-V95 PolarHBondContact O-N 2.96Å; E93-V95 PolarHBondContact O-N 3.1Å; V95-G97 PolarHBondContact O-N 2.91Å; V95-K98 WeakPolarHBondContact O-CB 3.44Å; V95-K98 PolarHBondContact O-N 2.77Å; V95-I99 HydrophobicContact CG1-CD1 3.96Å; V95-I99 HydrophobicContact CG1-CG1 4.48Å; V95-I99 WeakPolarHBondContact O-CG1 3.33Å; V95-I99 PolarHBondContact O-N 3.31Å
96K98.3Very high97.9Very high128 Ų12899 Ų9956%0.55750%0.496SS*.Hα-helixtrans-57.7-48.6174.4-174.8179.5178-177.80111.5N92 E93 K98 I99 D100N92-K96 WeakPolarHBondContact O-CB 3.43Å; N92-K96 PolarHBondContact O-N 3.35Å; E93-K96 PolarHBondContact O-N 2.92Å; K96-K98 VanDerWaalsContact C-N 3.28Å; K96-K98 PolarHBondContact O-N 2.7Å; K96-I99 WeakPolarHBondContact O-CB 3.05Å; K96-I99 PolarHBondContact O-N 3.18Å; K96-I99 VanDerWaalsContact O-N 3.08Å; K96-D100 PolarHBondContact O-N 2.95Å
97G98.4Very high97.7Very high33 Ų3397.9 Ų97.934%0.3450%0.499SS..Hα-helixtrans-59.3-36.9176.700000113.4E93 Q94 V95 T101E93-G97 PolarHBondContact O-N 3.13Å; Q94-G97 PolarHBondContact O-N 3.21Å; V95-G97 PolarHBondContact O-N 2.91Å; G97-T101 WeakPolarHBondContact O-CB 3.4Å; G97-T101 PolarHBondContact O-N 3.47Å; G97-T101 PolarHBondContact O-OG1 3.26Å
98K98.4Very high97.6Very high127 Ų12796 Ų9655%0.55250%0.498SS*.Hα-helixtrans-65.8-43.6173.3-72.5-179.5-179.6-172.10112.2Q94 V95 K96 T101 M102Q94-K98 WeakPolarHBondContact O-CG 3.48Å; Q94-K98 PolarHBondContact O-N 3.32Å; Q94-K98 VanDerWaalsContact O-N 3.12Å; V95-K98 WeakPolarHBondContact O-CB 3.44Å; V95-K98 PolarHBondContact O-N 2.77Å; K96-K98 VanDerWaalsContact C-N 3.28Å; K96-K98 PolarHBondContact O-N 2.7Å; K98-T101 PolarHBondContact O-N 2.83Å; K98-M102 WeakPolarHBondContact O-CB 3.42Å; K98-M102 PolarHBondContact O-N 3.07Å
99I98.1Very high97.5Very high84 Ų8497 Ų9743%0.43149%0.494SS..Hα-helixtrans-60.2-47.8176.7-69.8167.4000110.1V95 K96 T101 M102 K103V95-I99 HydrophobicContact CG1-CD1 3.96Å; V95-I99 HydrophobicContact CG1-CG1 4.48Å; V95-I99 WeakPolarHBondContact O-CG1 3.33Å; V95-I99 PolarHBondContact O-N 3.31Å; K96-I99 WeakPolarHBondContact O-CB 3.05Å; K96-I99 PolarHBondContact O-N 3.18Å; K96-I99 VanDerWaalsContact O-N 3.08Å; I99-T101 PolarHBondContact O-N 3.1Å; I99-M102 PolarHBondContact O-N 3.22Å; I99-K103 HydrophobicContact CG2-CD 4.09Å; I99-K103 HydrophobicContact CG2-CG 4.43Å; I99-K103 WeakPolarHBondContact O-CB 3.23Å; I99-K103 WeakPolarHBondContact O-CG 3.32Å; I99-K103 PolarHBondContact O-N 3.01Å
100D98Very high97.2Very high77 Ų7794.2 Ų94.241%0.41248%0.48SS..Hα-helixtrans-64.8-41.9-178.1-66.7-20.4000111.5K96 M102 K103 K104K96-D100 PolarHBondContact O-N 2.95Å; D100-M102 PolarHBondContact O-N 2.96Å; D100-K103 PolarHBondContact O-N 3.41Å; D100-K104 WeakPolarHBondContact O-CB 3.35Å; D100-K104 PolarHBondContact O-N 2.97Å
101T98.3Very high97Very high99 Ų9996.5 Ų96.561%0.60748%0.481SS*.Hα-helixtrans-62.1-44.4174.6-57.90000111.4G97 K98 I99 K104 F105G97-T101 WeakPolarHBondContact O-CB 3.4Å; G97-T101 PolarHBondContact O-N 3.47Å; G97-T101 PolarHBondContact O-OG1 3.26Å; K98-T101 PolarHBondContact O-N 2.83Å; I99-T101 PolarHBondContact O-N 3.1Å; T101-K104 PolarHBondContact O-N 3.4Å; T101-F105 WeakPolarHBondContact O-CB 3.27Å; T101-F105 PolarHBondContact O-N 2.81Å
102M98Very high96.9Very high125 Ų12595.4 Ų95.462%0.61648%0.478SS*.Hα-helixtrans-65.4-40.8179-169.662.168.600111.7K98 I99 D100 F105 K106K98-M102 WeakPolarHBondContact O-CB 3.42Å; K98-M102 PolarHBondContact O-N 3.07Å; I99-M102 PolarHBondContact O-N 3.22Å; D100-M102 PolarHBondContact O-N 2.96Å; M102-F105 PolarHBondContact O-N 3.41Å; M102-F105 HydrophobicContact SD-CD1 4.42Å; M102-K106 VanDerWaalsContact O-CB 3.3Å; M102-K106 WeakPolarHBondContact O-CB 3.45Å; M102-K106 PolarHBondContact O-N 2.83Å
103K96.6Very high96.7Very high105 Ų10593.3 Ų93.346%0.45747%0.466SS..Hα-helixtrans-60.3-47.2173.4-76.2177.3177.8177.90111.1I99 D100 K106 S107I99-K103 HydrophobicContact CG2-CD 4.09Å; I99-K103 HydrophobicContact CG2-CG 4.43Å; I99-K103 WeakPolarHBondContact O-CB 3.23Å; I99-K103 WeakPolarHBondContact O-CG 3.32Å; I99-K103 PolarHBondContact O-N 3.01Å; D100-K103 PolarHBondContact O-N 3.41Å; K103-K106 WeakPolarHBondContact O-CB 3.44Å; K103-K106 PolarHBondContact O-N 3.4Å; K103-S107 PolarHBondContact O-N 3.37Å; K103-S107 PolarHBondContact O-OG 3.14Å
104K97.3Very high96.5Very high148 Ų14888.7 Ų88.764%0.64345%0.448SS*.Hα-helixtrans-62.3-46178-174.6175.7-178.9177.70112D100 T101 K106 S107 L108D100-K104 WeakPolarHBondContact O-CB 3.35Å; D100-K104 PolarHBondContact O-N 2.97Å; T101-K104 PolarHBondContact O-N 3.4Å; K104-K106 PolarHBondContact O-N 3.4Å; K104-S107 PolarHBondContact O-N 3.12Å; K104-L108 HydrophobicContact CG-CD1 4.28Å; K104-L108 WeakPolarHBondContact O-CG 3.43Å; K104-L108 PolarHBondContact O-N 2.95Å
105F97.4Very high96.2Very high121 Ų12190.3 Ų90.353%0.53145%0.454SS..Hα-helixtrans-58.7-48.1176.5174.8-107.5000111.5T101 M102 S107 L108 L109T101-F105 WeakPolarHBondContact O-CB 3.27Å; T101-F105 PolarHBondContact O-N 2.81Å; M102-F105 PolarHBondContact O-N 3.41Å; M102-F105 HydrophobicContact SD-CD1 4.42Å; F105-S107 VanDerWaalsContact C-N 3.32Å; F105-S107 PolarHBondContact O-N 3.01Å; F105-L108 PolarHBondContact O-N 3.48Å; F105-L109 HydrophobicContact CE1-CD2 4.08Å; F105-L109 HydrophobicContact CZ-CD2 4.22Å; F105-L109 VanDerWaalsContact O-CB 3.31Å; F105-L109 WeakPolarHBondContact O-CB 3.3Å; F105-L109 PolarHBondContact O-N 3.48Å
106K94.3Very high96.2Very high86 Ų8691.8 Ų91.837%0.37446%0.463SS..Hα-helixtrans-54.3-47.4175.1175.4-167.1170.6-172.50111.5M102 K103 K104 L109 I110 R128M102-K106 VanDerWaalsContact O-CB 3.3Å; M102-K106 WeakPolarHBondContact O-CB 3.45Å; M102-K106 PolarHBondContact O-N 2.83Å; K103-K106 WeakPolarHBondContact O-CB 3.44Å; K103-K106 PolarHBondContact O-N 3.4Å; K104-K106 PolarHBondContact O-N 3.4Å; K106-L109 PolarHBondContact O-N 3.09Å; K106-I110 HydrophobicContact CG-CD1 3.9Å; K106-I110 WeakPolarHBondContact O-CB 3.4Å; K106-I110 VanDerWaalsContact O-CG1 3.28Å; K106-I110 WeakPolarHBondContact O-CG1 3.44Å; K106-I110 PolarHBondContact O-N 3.43Å; K106-R128 VanDerWaalsContact NZ-NH1 3.12Å
107S94.1Very high96Very high77 Ų7790.8 Ų90.854%0.53846%0.459SS..Hα-helixtrans-62.3-45.9179.9-62.50000112.3K103 K104 F105 I110 Q111K103-S107 PolarHBondContact O-N 3.37Å; K103-S107 PolarHBondContact O-OG 3.14Å; K104-S107 PolarHBondContact O-N 3.12Å; F105-S107 VanDerWaalsContact C-N 3.32Å; F105-S107 PolarHBondContact O-N 3.01Å; S107-I110 PolarHBondContact O-N 2.95Å; S107-Q111 PolarHBondContact O-N 3.22Å
108L96.7Very high95.8Very high86 Ų8693 Ų9345%0.4547%0.467SS..Hα-helixtrans-64.2-42.6177.6-69.3172.6000111.8K104 F105 I110 Q111 E112K104-L108 HydrophobicContact CG-CD1 4.28Å; K104-L108 WeakPolarHBondContact O-CG 3.43Å; K104-L108 PolarHBondContact O-N 2.95Å; F105-L108 PolarHBondContact O-N 3.48Å; L108-I110 PolarHBondContact O-N 3.21Å; L108-Q111 WeakPolarHBondContact O-CB 3.25Å; L108-Q111 PolarHBondContact O-N 3.07Å; L108-E112 PolarHBondContact O-N 2.95Å
109L94.9Very high95.5Very high77 Ų7794 Ų9440%0.40347%0.473SS..Hα-helixtrans-61-45.6176.9-179.262000111.3F105 K106 Q111 E112 L113F105-L109 HydrophobicContact CE1-CD2 4.08Å; F105-L109 HydrophobicContact CZ-CD2 4.22Å; F105-L109 VanDerWaalsContact O-CB 3.31Å; F105-L109 WeakPolarHBondContact O-CB 3.3Å; F105-L109 PolarHBondContact O-N 3.48Å; K106-L109 PolarHBondContact O-N 3.09Å; L109-Q111 VanDerWaalsContact C-N 3.28Å; L109-Q111 PolarHBondContact O-N 3.3Å; L109-E112 PolarHBondContact O-N 3.32Å; L109-L113 HydrophobicContact CD1-CD1 3.99Å; L109-L113 HydrophobicContact CD1-CG 4.04Å; L109-L113 HydrophobicContact CG-CD1 3.91Å; L109-L113 HydrophobicContact CG-CG 4.34Å; L109-L113 WeakPolarHBondContact O-CB 3.35Å; L109-L113 VanDerWaalsContact O-CG 3.25Å; L109-L113 WeakPolarHBondContact O-CG 3.43Å; L109-L113 PolarHBondContact O-N 2.8Å
110I92.8Very high95.3Very high46 Ų4694.3 Ų94.324%0.23648%0.476CS..Hα-helixtrans-60.5-39.3175.8-72.7170.4000111.1K106 S107 L108 S114 M121K106-I110 HydrophobicContact CG-CD1 3.9Å; K106-I110 WeakPolarHBondContact O-CB 3.4Å; K106-I110 VanDerWaalsContact O-CG1 3.28Å; K106-I110 WeakPolarHBondContact O-CG1 3.44Å; K106-I110 PolarHBondContact O-N 3.43Å; S107-I110 PolarHBondContact O-N 2.95Å; L108-I110 PolarHBondContact O-N 3.21Å; I110-S114 VanDerWaalsContact O-CB 3.29Å; I110-S114 WeakPolarHBondContact O-CB 3.47Å; I110-S114 PolarHBondContact O-N 3.45Å; I110-S114 PolarHBondContact O-OG 2.92Å; I110-M121 HydrophobicContact CB-CE 4.27Å; I110-M121 HydrophobicContact CG1-CE 4.32Å; I110-M121 HydrophobicContact CG2-CE 3.78Å
111Q93Very high95Very high102 Ų10291.3 Ų91.348%0.47746%0.46SS..Hα-helixtrans-64-49.8178.1-178.7-178.4-9.900111.5S107 L108 L109 S114 K115S107-Q111 PolarHBondContact O-N 3.22Å; L108-Q111 WeakPolarHBondContact O-CB 3.25Å; L108-Q111 PolarHBondContact O-N 3.07Å; L109-Q111 VanDerWaalsContact C-N 3.28Å; L109-Q111 PolarHBondContact O-N 3.3Å; Q111-S114 PolarHBondContact O-N 2.99Å; Q111-K115 PolarHBondContact O-N 3.11Å
112E96.4Very high94.6Very high91 Ų9189.2 Ų89.243%0.42545%0.453SS..Hα-helixtrans-68.1-42.4-179.9-66.1-50.3128.400112L108 L109 S114 K115 V116L108-E112 PolarHBondContact O-N 2.95Å; L109-E112 PolarHBondContact O-N 3.32Å; E112-S114 VanDerWaalsContact C-N 3.26Å; E112-S114 PolarHBondContact O-N 3.4Å; E112-K115 WeakPolarHBondContact O-CB 3.5Å; E112-K115 PolarHBondContact O-N 3.2Å; E112-K115 IonicContact OE1-NZ 3.34Å; E112-K115 PolarHBondContact OE1-NZ 3.43Å; E112-K115 IonicContact OE2-NZ 2.75Å; E112-K115 PolarHBondContact OE2-NZ 3.21Å; E112-V116 PolarHBondContact O-N 2.95Å
113L94.8Very high94.3Very high64 Ų6488.7 Ų88.734%0.33545%0.447SS..Hα-helixtrans-61.5-35.1174.6-69.4177.1000112.1L109 K115 V116 F117 M121L109-L113 HydrophobicContact CD1-CD1 3.99Å; L109-L113 HydrophobicContact CD1-CG 4.04Å; L109-L113 HydrophobicContact CG-CD1 3.91Å; L109-L113 HydrophobicContact CG-CG 4.34Å; L109-L113 WeakPolarHBondContact O-CB 3.35Å; L109-L113 VanDerWaalsContact O-CG 3.25Å; L109-L113 WeakPolarHBondContact O-CG 3.43Å; L109-L113 PolarHBondContact O-N 2.8Å; L113-K115 PolarHBondContact O-N 3.43Å; L113-V116 PolarHBondContact O-N 3.28Å; L113-F117 HydrophobicContact CD2-CD2 4.07Å; L113-F117 HydrophobicContact CD2-CE2 4.36Å; L113-F117 CarbonylContact O-C 3.58Å; L113-F117 WeakPolarHBondContact O-CA 3.46Å; L113-F117 PolarHBondContact O-N 2.9Å; L113-M121 HydrophobicContact CB-CE 4.39Å; L113-M121 HydrophobicContact CB-CG 3.97Å; L113-M121 HydrophobicContact CB-SD 3.71Å; L113-M121 HydrophobicContact CD1-SD 4.27Å
114S93.1Very high93.9Very high30 Ų3088.3 Ų88.321%0.2144%0.443CS..Hα-helixtrans-65.9-25.9176.3-630000112.9I110 Q111 E112 R125I110-S114 VanDerWaalsContact O-CB 3.29Å; I110-S114 WeakPolarHBondContact O-CB 3.47Å; I110-S114 PolarHBondContact O-N 3.45Å; I110-S114 PolarHBondContact O-OG 2.92Å; Q111-S114 PolarHBondContact O-N 2.99Å; E112-S114 VanDerWaalsContact C-N 3.26Å; E112-S114 PolarHBondContact O-N 3.4Å; S114-R125 PolarHBondContact OG-NH1 3.13Å; S114-R125 VanDerWaalsContact OG-NH1 3.09Å; S114-R125 PolarHBondContact OG-NH2 3.46Å
115K93.8Very high93.5Very high129 Ų12987.2 Ų87.256%0.56144%0.435SS*.Hα-helixtrans-78.5-41.3175.6-64.3171.9-173.5167.20111.8Q111 E112 L113Q111-K115 PolarHBondContact O-N 3.11Å; E112-K115 WeakPolarHBondContact O-CB 3.5Å; E112-K115 PolarHBondContact O-N 3.2Å; E112-K115 IonicContact OE1-NZ 3.34Å; E112-K115 PolarHBondContact OE1-NZ 3.43Å; E112-K115 IonicContact OE2-NZ 2.75Å; E112-K115 PolarHBondContact OE2-NZ 3.21Å; L113-K115 PolarHBondContact O-N 3.43Å
116V96.9Very high93Very high93 Ų9386 Ų8656%0.56444%0.442SS*.Hα-helixtrans-85.8-35.5-173.4-175.10000112.1E112 L113E112-V116 PolarHBondContact O-N 2.95Å; L113-V116 PolarHBondContact O-N 3.28Å
117F95.2Very high92.7Very high107 Ų10788.8 Ų88.847%0.46946%0.459SS..  trans-132.467.7-174.2-54.7-75.3000111.9L113 E119 D120 M121L113-F117 HydrophobicContact CD2-CD2 4.07Å; L113-F117 HydrophobicContact CD2-CE2 4.36Å; L113-F117 CarbonylContact O-C 3.58Å; L113-F117 WeakPolarHBondContact O-CA 3.46Å; L113-F117 PolarHBondContact O-N 2.9Å; F117-E119 PolarHBondContact O-N 3.43Å; F117-D120 HydrophobicContact CB-CB 4.41Å; F117-M121 WeakPolarHBondContact O-CB 3.48Å; F117-M121 WeakPolarHBondContact O-CG 3.29Å; F117-M121 PolarHBondContact O-N 3.01Å; F117-M121 VanDerWaalsContact O-N 3.07Å
118P93Very high92Very high79 Ų7990.5 Ų90.551%0.51345%0.454SS..Hα-helixtrans-63.7-40.4-171.223.2-33.2000114A122P118-A122 PolarHBondContact O-N 3.05Å
119E93.4Very high90.2Very high148 Ų14888.2 Ų88.269%0.69245%0.451SS*.Hα-helixtrans-69.1-43.4-178.6-64-172176.700112.6F117 M121 A122 K123F117-E119 PolarHBondContact O-N 3.43Å; E119-M121 VanDerWaalsContact C-N 3.33Å; E119-A122 WeakPolarHBondContact O-CB 3.4Å; E119-A122 PolarHBondContact O-N 3.24Å; E119-K123 PolarHBondContact O-N 3.12Å; E119-K123 VanDerWaalsContact O-N 3.17Å
120D93.1Very high88.3Confident90 Ų9094.2 Ų94.248%0.48148%0.477SS..Hα-helixtrans-68.5-35.7178.2-66.2-33.2000111.3F117 A122 K123 Y124F117-D120 HydrophobicContact CB-CB 4.41Å; D120-A122 VanDerWaalsContact C-N 3.32Å; D120-A122 PolarHBondContact O-N 3.35Å; D120-K123 PolarHBondContact O-N 3.21Å; D120-K123 IonicContact OD1-NZ 2.77Å; D120-Y124 WeakPolarHBondContact O-CB 3.31Å; D120-Y124 PolarHBondContact O-N 3.32Å
121M92.7Very high86.3Confident14 Ų1498.9 Ų98.97%0.06950%0.502CS..Hα-helixtrans-68.9-29.1173.8-74.8-60.2-62.600113.2I110 L113 F117 E119 Y124 R125I110-M121 HydrophobicContact CB-CE 4.27Å; I110-M121 HydrophobicContact CG1-CE 4.32Å; I110-M121 HydrophobicContact CG2-CE 3.78Å; L113-M121 HydrophobicContact CB-CE 4.39Å; L113-M121 HydrophobicContact CB-CG 3.97Å; L113-M121 HydrophobicContact CB-SD 3.71Å; L113-M121 HydrophobicContact CD1-SD 4.27Å; F117-M121 WeakPolarHBondContact O-CB 3.48Å; F117-M121 WeakPolarHBondContact O-CG 3.29Å; F117-M121 PolarHBondContact O-N 3.01Å; F117-M121 VanDerWaalsContact O-N 3.07Å; E119-M121 VanDerWaalsContact C-N 3.33Å; M121-Y124 HydrophobicContact CE-CD1 4.01Å; M121-Y124 HydrophobicContact SD-CD1 4.4Å; M121-R125 WeakPolarHBondContact O-CB 3.42Å; M121-R125 WeakPolarHBondContact O-CG 3.41Å; M121-R125 PolarHBondContact O-N 3.33Å; M121-R125 PolarHBondContact O-NE 3.02Å
122A89.8Confident84.3Confident56 Ų56101.7 Ų101.746%0.46352%0.515SS..Hα-helixtrans-65.8-44.817100000111.2P118 E119 D120 R125 S126P118-A122 PolarHBondContact O-N 3.05Å; E119-A122 WeakPolarHBondContact O-CB 3.4Å; E119-A122 PolarHBondContact O-N 3.24Å; D120-A122 VanDerWaalsContact C-N 3.32Å; D120-A122 PolarHBondContact O-N 3.35Å; A122-R125 PolarHBondContact O-N 2.81Å; A122-S126 PolarHBondContact O-N 3.14Å; A122-S126 PolarHBondContact O-OG 2.91Å
123K91.4Very high81.8Confident114 Ų114104.8 Ų104.850%0.49653%0.534SS..Hα-helixtrans-63.1-42.5174.3-63.8170.3-167.61580112.2E119 D120 R125 S126 I127E119-K123 PolarHBondContact O-N 3.12Å; E119-K123 VanDerWaalsContact O-N 3.17Å; D120-K123 PolarHBondContact O-N 3.21Å; D120-K123 IonicContact OD1-NZ 2.77Å; K123-R125 VanDerWaalsContact C-N 3.34Å; K123-R125 PolarHBondContact O-N 3.21Å; K123-S126 WeakPolarHBondContact CA-OG 3.49Å; K123-S126 PolarHBondContact O-N 3.07Å; K123-S126 PolarHBondContact O-OG 3.11Å; K123-I127 VanDerWaalsContact O-CG1 3.31Å; K123-I127 WeakPolarHBondContact O-CG1 3.3Å; K123-I127 PolarHBondContact O-N 2.61Å; K123-I127 VanDerWaalsContact O-N 3.07Å
124Y88.1Confident79.6Confident97 Ų97106 Ų10638%0.3855%0.545SS..Hα-helixtrans-58.6-45.9175.7173-100.1000111.4D120 M121 S126 I127 R128D120-Y124 WeakPolarHBondContact O-CB 3.31Å; D120-Y124 PolarHBondContact O-N 3.32Å; M121-Y124 HydrophobicContact CE-CD1 4.01Å; M121-Y124 HydrophobicContact SD-CD1 4.4Å; Y124-S126 PolarHBondContact O-N 3.09Å; Y124-I127 PolarHBondContact O-N 2.94Å; Y124-R128 WeakPolarHBondContact O-CB 3.41Å; Y124-R128 PolarHBondContact O-N 2.78Å; Y124-R128 VanDerWaalsContact OH-CZ 3.24Å; Y124-R128 PolarHBondContact OH-NH1 3.23Å
125R88Confident76.9Confident125 Ų125113.5 Ų113.547%0.47260%0.598SS.*Hα-helixtrans-63.3-39.2177.6-79.3-175-91.4-109.7-1.8112.6S114 M121 A122 K123 G129S114-R125 PolarHBondContact OG-NH1 3.13Å; S114-R125 VanDerWaalsContact OG-NH1 3.09Å; S114-R125 PolarHBondContact OG-NH2 3.46Å; M121-R125 WeakPolarHBondContact O-CB 3.42Å; M121-R125 WeakPolarHBondContact O-CG 3.41Å; M121-R125 PolarHBondContact O-N 3.33Å; M121-R125 PolarHBondContact O-NE 3.02Å; A122-R125 PolarHBondContact O-N 2.81Å; K123-R125 VanDerWaalsContact C-N 3.34Å; K123-R125 PolarHBondContact O-N 3.21Å; R125-G129 PolarHBondContact O-N 2.96Å
126S86.9Confident76.1Confident95 Ų95112.7 Ų112.766%0.66460%0.6SS**Hα-helixtrans-68.3-33.4177.558.50000113.4A122 K123 Y124A122-S126 PolarHBondContact O-N 3.14Å; A122-S126 PolarHBondContact O-OG 2.91Å; K123-S126 WeakPolarHBondContact CA-OG 3.49Å; K123-S126 PolarHBondContact O-N 3.07Å; K123-S126 PolarHBondContact O-OG 3.11Å; Y124-S126 PolarHBondContact O-N 3.09Å
127I88.4Confident75Confident144 Ų144113.7 Ų113.774%0.73860%0.602SS**Hα-helixtrans-76.2-38.4178.7-65.1163.7000111.2K123 Y124 G129K123-I127 VanDerWaalsContact O-CG1 3.31Å; K123-I127 WeakPolarHBondContact O-CG1 3.3Å; K123-I127 PolarHBondContact O-N 2.61Å; K123-I127 VanDerWaalsContact O-N 3.07Å; Y124-I127 PolarHBondContact O-N 2.94Å; I127-G129 VanDerWaalsContact C-N 3.27Å; I127-G129 PolarHBondContact O-N 3.02Å
128R79.4Confident73.9Confident113 Ų113114.1 Ų114.143%0.42661%0.609SS.*Hα-helixtrans-74.8-18.1-172.7-146.4-152.2-176.915012.6113.8K106 Y124K106-R128 VanDerWaalsContact NZ-NH1 3.12Å; Y124-R128 WeakPolarHBondContact O-CB 3.41Å; Y124-R128 PolarHBondContact O-N 2.78Å; Y124-R128 VanDerWaalsContact OH-CZ 3.24Å; Y124-R128 PolarHBondContact OH-NH1 3.23Å
129G59Low72.7Confident39 Ų39116.2 Ų116.240%0.40262%0.615SS.*  trans64.9153.1-166.600000111.4R125 I127 D131R125-G129 PolarHBondContact O-N 2.96Å; I127-G129 VanDerWaalsContact C-N 3.27Å; I127-G129 PolarHBondContact O-N 3.02Å; G129-D131 PolarHBondContact O-N 3.41Å
130E56Low71.5Confident203 Ų203114.2 Ų114.295%0.94961%0.61SS**  trans-6959.9168-70.9-172.614100111H132E130-H132 PolarHBondContact O-N 3.24Å
131D49.8Very low70Confident143 Ų143115.8 Ų115.877%0.76562%0.619SS**  trans-82.593.3172.6-92.3-34.8000110.1G129G129-D131 PolarHBondContact O-N 3.41Å
132H50.3Low68.4Low162 Ų162123.1 Ų123.175%0.7566%0.658SS**  trans60.690154.7-132.3-42000116E130 P134E130-H132 PolarHBondContact O-N 3.24Å; H132-P134 WeakPolarHBondContact O-CD 3.49Å
133L44Very low66.8Low155 Ų155128.2 Ų128.281%0.81267%0.673SS**  trans-59.9122.1145.8-80.7128.8000107.5S135L133-S135 PolarHBondContact O-N 2.77Å
134P48.3Very low64.7Low89 Ų89129.4 Ų129.458%0.57869%0.688SS**  trans-73.8121.3163.3610.3000107.2H132H132-P134 WeakPolarHBondContact O-CD 3.49Å
135S38Very low62.6Low188 Ų188132.4 Ų132.4100%1.31572%0.715SS**  trans-58.70159.5-51.90000110.9L133L133-S135 PolarHBondContact O-N 2.77Å

Retrieved 135 of 135 residues in 37.6 ms (Link to these results)