A0A087X160_HUMAN Loading...

IZUMO family member 4

AlphaFold DB , UniProt , Accession A0A087X160, Species HUMAN (Homo sapiens, Human), Gene IZUMO4, Length 152 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
1V49.4Very low55.8Low175 Ų17570.8 Ų70.8100%1.06144%0.439SS*.  0-37.50-173.70000110.7G3 A4V1-G3 VanDerWaalsContact C-N 3.31Å; V1-G3 PolarHBondContact O-N 2.99Å; V1-A4 PolarHBondContact O-N 2.8Å
2S45.6Very low56.6Low25 Ų2572.5 Ų72.518%0.17544%0.443CS..G310 helixtrans-55.4-35.9176.1-260000114.8A4 L5 Y38 D42S2-A4 VanDerWaalsContact C-N 3.3Å; S2-A4 PolarHBondContact O-N 2.93Å; S2-L5 PolarHBondContact O-N 3.23Å; S2-L5 VanDerWaalsContact O-N 3.15Å; S2-Y38 WeakPolarHBondContact O-CE1 3.31Å; S2-D42 PolarHBondContact OG-OD1 3.28Å
3G42.9Very low57.2Low49 Ų4968.1 Ų68.151%0.50542%0.416SS..G310 helixtrans-65-20.7-176.700000116.6V1V1-G3 VanDerWaalsContact C-N 3.31Å; V1-G3 PolarHBondContact O-N 2.99Å
4A53.4Low57.6Low79 Ų7969.6 Ų69.665%0.65342%0.418SS*.G310 helixtrans-76.8-24.7175.600000112.5V1 S2 L6V1-A4 PolarHBondContact O-N 2.8Å; S2-A4 VanDerWaalsContact C-N 3.3Å; S2-A4 PolarHBondContact O-N 2.93Å; A4-L6 VanDerWaalsContact C-N 3.26Å; A4-L6 PolarHBondContact O-N 3.34Å
5L51Low58.1Low106 Ų10674.7 Ų74.756%0.55543%0.433SS*.THydrogen-bonded Turntrans-78.4-13.2177.9-68157.8000112.1S2 Y38S2-L5 PolarHBondContact O-N 3.23Å; S2-L5 VanDerWaalsContact O-N 3.15Å; L5-Y38 HydrophobicContact CB-CE1 3.96Å; L5-Y38 WeakPolarHBondContact CB-OH 3.46Å; L5-Y38 PolarHBondContact O-OH 3.39Å
6L51.3Low58.4Low60 Ų6078.9 Ų78.931%0.31445%0.447SS..THydrogen-bonded Turntrans-78.4-28179.8-94.6169.6000113.9A4 D8 W9 A34 Y38A4-L6 VanDerWaalsContact C-N 3.26Å; A4-L6 PolarHBondContact O-N 3.34Å; L6-D8 PolarHBondContact O-N 1.98Å; L6-W9 PolarHBondContact O-N 3.46Å; L6-A34 HydrophobicContact CD2-CB 3.6Å; L6-Y38 HydrophobicContact CB-CE2 4.26Å; L6-Y38 HydrophobicContact CD1-CD2 3.81Å; L6-Y38 HydrophobicContact CD1-CE2 4.28Å; L6-Y38 HydrophobicContact CD1-CG 4.05Å; L6-Y38 HydrophobicContact CD2-CD2 3.15Å; L6-Y38 HydrophobicContact CD2-CE2 3.17Å; L6-Y38 HydrophobicContact CD2-CG 4.18Å; L6-Y38 HydrophobicContact CG-CD1 4.42Å; L6-Y38 HydrophobicContact CG-CD2 3.26Å; L6-Y38 HydrophobicContact CG-CE1 4.38Å; L6-Y38 HydrophobicContact CG-CE2 3.25Å; L6-Y38 HydrophobicContact CG-CG 3.89Å
7T61Low58.5Low99 Ų9977.3 Ų77.361%0.60744%0.436SS*.THydrogen-bonded Turntrans-63.1-36.1-167-50.90000111.7
8D65.3Low58.3Low90 Ų9081.6 Ų81.648%0.48145%0.452SS..THydrogen-bonded Turntrans-112.9-0.7-175.4-55.6-37.5000112.9L6 S10 D11 D12L6-D8 PolarHBondContact O-N 1.98Å; D8-S10 VanDerWaalsContact C-N 3.3Å; D8-S10 PolarHBondContact O-N 3.47Å; D8-D11 PolarHBondContact O-N 3.32Å; D8-D12 PolarHBondContact O-N 2.86Å
9W67.6Low57.9Low24 Ų2481.2 Ų81.29%0.09145%0.449CS..Hα-helixtrans-57.5-40.1-173-176.894.3000113.1L6 D11 T13 L30 V33 A34 Q66 I70L6-W9 PolarHBondContact O-N 3.46Å; W9-D11 VanDerWaalsContact C-N 3.34Å; W9-T13 HydrophobicContact CH2-CG2 4.26Å; W9-T13 HydrophobicContact CZ3-CG2 4.43Å; W9-T13 WeakPolarHBondContact O-CB 3.37Å; W9-T13 PolarHBondContact O-N 2.02Å; W9-T13 PolarHBondContact O-OG1 3.22Å; W9-L30 HydrophobicContact CH2-CD2 4.4Å; W9-L30 HydrophobicContact CZ3-CB 4.03Å; W9-L30 HydrophobicContact CZ3-CD2 3.98Å; W9-L30 WeakPolarHBondContact CZ3-O 3.36Å; W9-V33 HydrophobicContact CH2-CB 3.94Å; W9-V33 HydrophobicContact CH2-CG1 3.63Å; W9-V33 HydrophobicContact CZ2-CG1 4.18Å; W9-V33 HydrophobicContact CZ3-CB 4.41Å; W9-A34 HydrophobicContact CD2-CB 3.78Å; W9-A34 HydrophobicContact CE3-CB 3.49Å; W9-A34 VanDerWaalsContact CE3-CB 3.49Å; W9-A34 HydrophobicContact CG-CB 4.31Å; W9-A34 HydrophobicContact CH2-CB 4.49Å; W9-A34 HydrophobicContact CZ3-CB 3.9Å; W9-Q66 HydrophobicContact CZ2-CG 3.92Å; W9-Q66 VanDerWaalsContact CZ2-NE2 3.29Å; W9-I70 HydrophobicContact CH2-CD1 4.1Å; W9-I70 HydrophobicContact CH2-CG1 4.3Å; W9-I70 HydrophobicContact CZ2-CD1 4.27Å
10S62.8Low57Low3 Ų382.4 Ų82.42%0.02147%0.47CS..Hα-helixtrans-64.2-42178.167.60000111.3D8 M14 R27D8-S10 VanDerWaalsContact C-N 3.3Å; D8-S10 PolarHBondContact O-N 3.47Å; S10-M14 WeakPolarHBondContact O-CB 3.18Å; S10-M14 VanDerWaalsContact O-CG 3.27Å; S10-M14 WeakPolarHBondContact O-CG 3.5Å; S10-M14 PolarHBondContact O-N 3.36Å; S10-R27 PolarHBondContact OG-NH2 3.33Å
11D63.9Low56.2Low69 Ų6985 Ų8537%0.36948%0.48SS..Hα-helixtrans-73.1-42.2-177.6-70.3-28.3000110.6D8 W9 M14 K15 R27D8-D11 PolarHBondContact O-N 3.32Å; W9-D11 VanDerWaalsContact C-N 3.34Å; D11-M14 PolarHBondContact O-N 3.46Å; D11-K15 WeakPolarHBondContact O-CB 3.24Å; D11-K15 PolarHBondContact O-N 3.23Å; D11-R27 VanDerWaalsContact CG-NH2 3.26Å; D11-R27 IonicContact OD1-CZ 3.16Å; D11-R27 IonicContact OD1-NH1 2.78Å; D11-R27 PolarHBondContact OD1-NH1 2.69Å; D11-R27 IonicContact OD1-NH2 3.16Å; D11-R27 PolarHBondContact OD1-NH2 2.62Å; D11-R27 VanDerWaalsContact OD1-NH2 3.16Å; D11-R27 IonicContact OD2-CZ 3.52Å; D11-R27 IonicContact OD2-NH1 3.5Å; D11-R27 PolarHBondContact OD2-NH1 3.48Å; D11-R27 IonicContact OD2-NH2 2.74Å; D11-R27 PolarHBondContact OD2-NH2 2.9Å
12D65.6Low55.8Low91 Ų9181.8 Ų81.849%0.48746%0.463SS..Hα-helixtrans-61.8-45.3173.7-72.8-21.7000111.4D8 M14 K15 E16D8-D12 PolarHBondContact O-N 2.86Å; D12-M14 PolarHBondContact O-N 3.18Å; D12-K15 WeakPolarHBondContact O-CB 2.96Å; D12-K15 PolarHBondContact O-N 2.82Å; D12-E16 VanDerWaalsContact O-CG 3.31Å; D12-E16 WeakPolarHBondContact O-CG 3.46Å; D12-E16 PolarHBondContact O-N 3.46Å
13T64.2Low56.1Low15 Ų1581.3 Ų81.39%0.09246%0.461CS..Hα-helixtrans-64.1-42.5178.3-61.70000111.4W9 K15 E16 L17 L30 I70W9-T13 HydrophobicContact CH2-CG2 4.26Å; W9-T13 HydrophobicContact CZ3-CG2 4.43Å; W9-T13 WeakPolarHBondContact O-CB 3.37Å; W9-T13 PolarHBondContact O-N 2.02Å; W9-T13 PolarHBondContact O-OG1 3.22Å; T13-K15 VanDerWaalsContact C-N 3.31Å; T13-K15 PolarHBondContact O-N 3.02Å; T13-E16 PolarHBondContact O-N 3.01Å; T13-L17 HydrophobicContact CG2-CD1 3.61Å; T13-L17 HydrophobicContact CG2-CG 4.11Å; T13-L17 WeakPolarHBondContact O-CB 3.37Å; T13-L17 WeakPolarHBondContact O-CG 3.44Å; T13-L17 PolarHBondContact O-N 2.87Å; T13-L30 HydrophobicContact CG2-CD2 4.01Å; T13-I70 HydrophobicContact CG2-CD1 3.86Å
14M62.7Low56.8Low90 Ų9085.7 Ų85.744%0.44347%0.466SS..Hα-helixtrans-64-37175.8-78.2-62.7-66.400112.6S10 D11 D12 L30S10-M14 WeakPolarHBondContact O-CB 3.18Å; S10-M14 VanDerWaalsContact O-CG 3.27Å; S10-M14 WeakPolarHBondContact O-CG 3.5Å; S10-M14 PolarHBondContact O-N 3.36Å; D11-M14 PolarHBondContact O-N 3.46Å; D12-M14 PolarHBondContact O-N 3.18Å; M14-L30 HydrophobicContact CG-CD1 3.5Å; M14-L30 VanDerWaalsContact CG-CD1 3.5Å; M14-L30 HydrophobicContact SD-CD1 3.6Å
15K64.7Low57.3Low146 Ų14682.4 Ų82.464%0.63544%0.437SS*.Hα-helixtrans-66.6-41.1176.9-174.7-179.4175.7-171.70111.9D11 D12 T13 H18D11-K15 WeakPolarHBondContact O-CB 3.24Å; D11-K15 PolarHBondContact O-N 3.23Å; D12-K15 WeakPolarHBondContact O-CB 2.96Å; D12-K15 PolarHBondContact O-N 2.82Å; T13-K15 VanDerWaalsContact C-N 3.31Å; T13-K15 PolarHBondContact O-N 3.02Å; K15-H18 PolarHBondContact O-CE1 3.5Å
16E63.5Low58.1Low141 Ų14180.4 Ų80.466%0.65943%0.43SS*.Hα-helixtrans-76.8-30.9-179.9-69.4-65.5141.600113.5D12 T13 H18D12-E16 VanDerWaalsContact O-CG 3.31Å; D12-E16 WeakPolarHBondContact O-CG 3.46Å; D12-E16 PolarHBondContact O-N 3.46Å; T13-E16 PolarHBondContact O-N 3.01Å; E16-H18 PolarHBondContact O-CD2 3.13Å; E16-H18 PolarHBondContact O-N 3.26Å
17L59.6Low58.8Low52 Ų5284 Ų8427%0.27244%0.439SS..SBendtrans-69.6-16-175.2-81.9170.4000114.2T13 L19 I25 I70T13-L17 HydrophobicContact CG2-CD1 3.61Å; T13-L17 HydrophobicContact CG2-CG 4.11Å; T13-L17 WeakPolarHBondContact O-CB 3.37Å; T13-L17 WeakPolarHBondContact O-CG 3.44Å; T13-L17 PolarHBondContact O-N 2.87Å; L17-L19 HydrophobicContact CB-CD1 4.41Å; L17-L19 HydrophobicContact CB-CD2 4.25Å; L17-L19 HydrophobicContact CB-CG 3.96Å; L17-L19 PolarHBondContact O-N 3.2Å; L17-I25 HydrophobicContact CD1-CD1 4.32Å; L17-I70 HydrophobicContact CD1-CG2 3.96Å; L17-I70 HydrophobicContact CD2-CG2 4.17Å
18H54.8Low59.4Low155 Ų15585.7 Ų85.772%0.71844%0.44SS*.  trans38.844.9174.7-67.2-62.7000114.4K15 E16 A20K15-H18 PolarHBondContact O-CE1 3.5Å; E16-H18 PolarHBondContact O-CD2 3.13Å; E16-H18 PolarHBondContact O-N 3.26Å; H18-A20 PolarHBondContact O-N 3.46Å; H18-A20 VanDerWaalsContact O-N 3.14Å
19L51.5Low59.7Low74 Ų7484.1 Ų84.139%0.38743%0.429SS..  trans-71112.9-171.9-60.3174.7000110.5L17 I25 I74L17-L19 HydrophobicContact CB-CD1 4.41Å; L17-L19 HydrophobicContact CB-CD2 4.25Å; L17-L19 HydrophobicContact CB-CG 3.96Å; L17-L19 PolarHBondContact O-N 3.2Å; L19-I25 HydrophobicContact CD1-CD1 4.27Å; L19-I74 HydrophobicContact CD2-CD1 4.46Å
20A39.1Very low59.7Low105 Ų10583 Ų8387%0.86843%0.425SS*.SBendtrans-77.9-16.9-178.700000114.3H18H18-A20 PolarHBondContact O-N 3.46Å; H18-A20 VanDerWaalsContact O-N 3.14Å
21I41Very low60.2Low136 Ų13686.4 Ų86.470%0.69744%0.443SS*.SBendtrans-124.8135.7179.6-58.4176.5000107A23I21-A23 PolarHBondContact O-N 3.43Å
22P41.2Very low60.8Low108 Ų10887.6 Ų87.670%0.70145%0.446SS*.  trans-75.870.2-171.232.3-36.2000111.6K24P22-K24 PolarHBondContact O-N 3.4Å
23A51.5Low61.3Low15 Ų1583.6 Ų83.612%0.12443%0.425CS..  trans-69.491148.900000105.7I21 I25 I74 I78I21-A23 PolarHBondContact O-N 3.43Å; A23-I25 PolarHBondContact O-N 3.14Å; A23-I74 HydrophobicContact CB-CG2 3.9Å; A23-I78 HydrophobicContact CB-CD1 4.17Å; A23-I78 HydrophobicContact CB-CG1 3.86Å
24K57.9Low61.6Low141 Ų14183 Ų8361%0.61342%0.421SS*.  trans-7577.4-175.4-154.4-179.9-172.5-1770108.6P22 T26 Y81P22-K24 PolarHBondContact O-N 3.4Å; K24-T26 PolarHBondContact O-N 3.06Å; K24-Y81 HydrophobicContact CB-CE2 3.96Å; K24-Y81 WeakPolarHBondContact CB-OH 3.11Å
25I62.8Low62.3Low10 Ų1082 Ų825%0.05142%0.42CS..  trans-59.6121.7168.3-48.9174.7000106.6L17 L19 A23 K29 L30 I70 A73 I74L17-I25 HydrophobicContact CD1-CD1 4.32Å; L19-I25 HydrophobicContact CD1-CD1 4.27Å; A23-I25 PolarHBondContact O-N 3.14Å; I25-K29 HydrophobicContact CG2-CB 4.04Å; I25-L30 HydrophobicContact CG2-CD1 4.34Å; I25-L30 HydrophobicContact CG2-CD2 4.2Å; I25-L30 HydrophobicContact CG2-CG 3.8Å; I25-I70 HydrophobicContact CD1-CG2 4.49Å; I25-A73 HydrophobicContact CG2-CB 4.17Å; I25-I74 HydrophobicContact CD1-CB 4.45Å; I25-I74 HydrophobicContact CD1-CD1 4.04Å; I25-I74 HydrophobicContact CD1-CG1 3.25Å; I25-I74 HydrophobicContact CG1-CG1 3.73Å
26T68.9Low63.1Low65 Ų6576.2 Ų76.240%0.39940%0.4SS..  trans-71147.6177640000109.7K24 E28 K29 L30K24-T26 PolarHBondContact O-N 3.06Å; T26-E28 PolarHBondContact O-N 3.27Å; T26-K29 PolarHBondContact O-N 3.35Å; T26-K29 PolarHBondContact OG1-N 3.16Å; T26-L30 PolarHBondContact O-N 3.33Å
27R65.8Low63.4Low136 Ų13669.7 Ų69.751%0.51337%0.37SS..Hα-helixtrans-54.8-37.2175-166.8170.8-177.7131.82.8111.6S10 D11 K29 L30 D31S10-R27 PolarHBondContact OG-NH2 3.33Å; D11-R27 VanDerWaalsContact CG-NH2 3.26Å; D11-R27 IonicContact OD1-CZ 3.16Å; D11-R27 IonicContact OD1-NH1 2.78Å; D11-R27 PolarHBondContact OD1-NH1 2.69Å; D11-R27 IonicContact OD1-NH2 3.16Å; D11-R27 PolarHBondContact OD1-NH2 2.62Å; D11-R27 VanDerWaalsContact OD1-NH2 3.16Å; D11-R27 IonicContact OD2-CZ 3.52Å; D11-R27 IonicContact OD2-NH1 3.5Å; D11-R27 PolarHBondContact OD2-NH1 3.48Å; D11-R27 IonicContact OD2-NH2 2.74Å; D11-R27 PolarHBondContact OD2-NH2 2.9Å; R27-K29 VanDerWaalsContact C-N 3.34Å; R27-K29 PolarHBondContact O-N 3.49Å; R27-L30 WeakPolarHBondContact O-CB 2.79Å; R27-L30 PolarHBondContact O-N 3.16Å; R27-D31 PolarHBondContact O-N 2.98Å
28E72.2Confident63.9Low134 Ų13468.2 Ų68.263%0.62636%0.361SS*.Hα-helixtrans-57.9-41.3174.2-174.3-179.3-17500113.1T26 D31 Q32T26-E28 PolarHBondContact O-N 3.27Å; E28-D31 PolarHBondContact O-N 2.93Å; E28-Q32 WeakPolarHBondContact O-CG 3.45Å; E28-Q32 PolarHBondContact O-N 3.44Å
29K71.8Confident65Low56 Ų5666.3 Ų66.324%0.24335%0.353CS..Hα-helixtrans-69.8-36.9178.5-159.676.6-161.6-171.40111.4I25 T26 R27 Q32 V33 A73 E76I25-K29 HydrophobicContact CG2-CB 4.04Å; T26-K29 PolarHBondContact O-N 3.35Å; T26-K29 PolarHBondContact OG1-N 3.16Å; R27-K29 VanDerWaalsContact C-N 3.34Å; R27-K29 PolarHBondContact O-N 3.49Å; K29-Q32 WeakPolarHBondContact O-CB 3.24Å; K29-Q32 PolarHBondContact O-N 3.49Å; K29-V33 WeakPolarHBondContact O-CG2 3.25Å; K29-V33 PolarHBondContact O-N 3.47Å; K29-V33 VanDerWaalsContact O-N 3.12Å; K29-A73 HydrophobicContact CG-CB 3.55Å; K29-E76 WeakPolarHBondContact CE-OE2 2.98Å; K29-E76 IonicContact NZ-OE1 3.96Å; K29-E76 IonicContact NZ-OE2 2.62Å; K29-E76 PolarHBondContact NZ-OE2 2.82Å
30L68.7Low66.3Low2 Ų265.4 Ų65.41%0.0135%0.347CS..Hα-helixtrans-63.5-42.3172.5-72.6166000111.5W9 T13 M14 I25 T26 R27 Q32 V33 A34W9-L30 HydrophobicContact CH2-CD2 4.4Å; W9-L30 HydrophobicContact CZ3-CB 4.03Å; W9-L30 HydrophobicContact CZ3-CD2 3.98Å; W9-L30 WeakPolarHBondContact CZ3-O 3.36Å; T13-L30 HydrophobicContact CG2-CD2 4.01Å; M14-L30 HydrophobicContact CG-CD1 3.5Å; M14-L30 VanDerWaalsContact CG-CD1 3.5Å; M14-L30 HydrophobicContact SD-CD1 3.6Å; I25-L30 HydrophobicContact CG2-CD1 4.34Å; I25-L30 HydrophobicContact CG2-CD2 4.2Å; I25-L30 HydrophobicContact CG2-CG 3.8Å; T26-L30 PolarHBondContact O-N 3.33Å; R27-L30 WeakPolarHBondContact O-CB 2.79Å; R27-L30 PolarHBondContact O-N 3.16Å; L30-Q32 VanDerWaalsContact C-N 3.29Å; L30-Q32 PolarHBondContact O-N 2.95Å; L30-V33 PolarHBondContact O-N 3.33Å; L30-V33 VanDerWaalsContact O-N 3.14Å; L30-A34 WeakPolarHBondContact O-CB 2.94Å; L30-A34 PolarHBondContact O-N 3.08Å
31D72.1Confident67.9Low73 Ų7361.9 Ų61.939%0.3931%0.313SS..Hα-helixtrans-62.9-35.2176.6-70.3-15.1000112.2R27 E28 A34 T35R27-D31 PolarHBondContact O-N 2.98Å; E28-D31 PolarHBondContact O-N 2.93Å; D31-A34 PolarHBondContact O-N 2.91Å; D31-T35 WeakPolarHBondContact O-CB 3.45Å; D31-T35 PolarHBondContact O-N 3.19Å; D31-T35 PolarHBondContact O-OG1 3.26Å
32Q78.1Confident69.5Low94 Ų9458.9 Ų58.944%0.43930%0.298SS..Hα-helixtrans-63.5-45.1172.3-71.1172.37.900111.8E28 K29 L30 T35 A36E28-Q32 WeakPolarHBondContact O-CG 3.45Å; E28-Q32 PolarHBondContact O-N 3.44Å; K29-Q32 WeakPolarHBondContact O-CB 3.24Å; K29-Q32 PolarHBondContact O-N 3.49Å; L30-Q32 VanDerWaalsContact C-N 3.29Å; L30-Q32 PolarHBondContact O-N 2.95Å; Q32-T35 PolarHBondContact O-N 3.2Å; Q32-A36 PolarHBondContact O-N 3.45Å; Q32-A36 VanDerWaalsContact O-N 3.11Å
33V75.5Confident71.3Confident7 Ų760.2 Ų60.24%0.04230%0.295CS..Hα-helixtrans-62.6-45.7176.2176.20000110.8W9 K29 L30 T35 A36 V37 L69 I70W9-V33 HydrophobicContact CH2-CB 3.94Å; W9-V33 HydrophobicContact CH2-CG1 3.63Å; W9-V33 HydrophobicContact CZ2-CG1 4.18Å; W9-V33 HydrophobicContact CZ3-CB 4.41Å; K29-V33 WeakPolarHBondContact O-CG2 3.25Å; K29-V33 PolarHBondContact O-N 3.47Å; K29-V33 VanDerWaalsContact O-N 3.12Å; L30-V33 PolarHBondContact O-N 3.33Å; L30-V33 VanDerWaalsContact O-N 3.14Å; V33-T35 PolarHBondContact O-N 3.43Å; V33-A36 PolarHBondContact O-N 2.93Å; V33-V37 HydrophobicContact CG1-CG2 4.4Å; V33-V37 WeakPolarHBondContact O-CG2 3.39Å; V33-V37 PolarHBondContact O-N 2.74Å; V33-L69 HydrophobicContact CB-CB 4.32Å; V33-L69 HydrophobicContact CG1-CB 3.61Å; V33-L69 HydrophobicContact CG1-CD1 4.15Å; V33-L69 HydrophobicContact CG2-CB 3.87Å; V33-I70 HydrophobicContact CG1-CG1 4.03Å
34A71.1Confident72.4Confident2 Ų260.3 Ų60.32%0.01729%0.293CS..Hα-helixtrans-55.9-52.8177.100000110.1L6 W9 L30 D31 A36 V37 Y38L6-A34 HydrophobicContact CD2-CB 3.6Å; W9-A34 HydrophobicContact CD2-CB 3.78Å; W9-A34 HydrophobicContact CE3-CB 3.49Å; W9-A34 VanDerWaalsContact CE3-CB 3.49Å; W9-A34 HydrophobicContact CG-CB 4.31Å; W9-A34 HydrophobicContact CH2-CB 4.49Å; W9-A34 HydrophobicContact CZ3-CB 3.9Å; L30-A34 WeakPolarHBondContact O-CB 2.94Å; L30-A34 PolarHBondContact O-N 3.08Å; D31-A34 PolarHBondContact O-N 2.91Å; A34-A36 VanDerWaalsContact C-N 3.28Å; A34-A36 PolarHBondContact O-N 3.23Å; A34-V37 PolarHBondContact O-N 3.33Å; A34-V37 VanDerWaalsContact O-N 3.07Å; A34-Y38 HydrophobicContact CB-CE2 4.46Å; A34-Y38 WeakPolarHBondContact O-CD2 3.43Å; A34-Y38 PolarHBondContact O-N 3.12Å
35T77.4Confident73Confident69 Ų6958.8 Ų58.842%0.42329%0.285SS..Hα-helixtrans-53.2-44.6179.2-59.90000112.2D31 Q32 V33 Y38 Q39D31-T35 WeakPolarHBondContact O-CB 3.45Å; D31-T35 PolarHBondContact O-N 3.19Å; D31-T35 PolarHBondContact O-OG1 3.26Å; Q32-T35 PolarHBondContact O-N 3.2Å; V33-T35 PolarHBondContact O-N 3.43Å; T35-Y38 PolarHBondContact O-N 3.48Å; T35-Q39 WeakPolarHBondContact O-CG 3.34Å; T35-Q39 PolarHBondContact O-N 2.78Å
36A79.8Confident73.5Confident26 Ų2665 Ų6522%0.21531%0.314CS..Hα-helixtrans-63.5-45.3177.700000112.4Q32 V33 A34 Y38 Q39 M40 L69Q32-A36 PolarHBondContact O-N 3.45Å; Q32-A36 VanDerWaalsContact O-N 3.11Å; V33-A36 PolarHBondContact O-N 2.93Å; A34-A36 VanDerWaalsContact C-N 3.28Å; A34-A36 PolarHBondContact O-N 3.23Å; A36-Y38 PolarHBondContact O-N 3.5Å; A36-Q39 PolarHBondContact O-N 2.62Å; A36-M40 WeakPolarHBondContact O-CG 3.43Å; A36-M40 PolarHBondContact O-N 3.11Å; A36-L69 HydrophobicContact CB-CD1 4.01Å
37V71.8Confident73.2Confident4 Ų466.2 Ų66.22%0.02434%0.339CS..Hα-helixtrans-60.6-44.2177.9170.20000111.2V33 A34 M40 M41 I62 Q66V33-V37 HydrophobicContact CG1-CG2 4.4Å; V33-V37 WeakPolarHBondContact O-CG2 3.39Å; V33-V37 PolarHBondContact O-N 2.74Å; A34-V37 PolarHBondContact O-N 3.33Å; A34-V37 VanDerWaalsContact O-N 3.07Å; V37-M40 WeakPolarHBondContact O-CB 3.39Å; V37-M40 PolarHBondContact O-N 3.16Å; V37-M41 HydrophobicContact CG1-SD 4.3Å; V37-M41 WeakPolarHBondContact O-CG 3.48Å; V37-M41 PolarHBondContact O-N 3.32Å; V37-I62 HydrophobicContact CG1-CG2 3.83Å; V37-Q66 HydrophobicContact CG2-CB 3.68Å; V37-Q66 HydrophobicContact CG2-CG 3.92Å
38Y69.4Low73Confident20 Ų2065 Ų658%0.07834%0.337CS..Hα-helixtrans-70.4-32.8179-74.9-74000113.2S2 L5 L6 A34 T35 A36 M40 M41 D42S2-Y38 WeakPolarHBondContact O-CE1 3.31Å; L5-Y38 HydrophobicContact CB-CE1 3.96Å; L5-Y38 WeakPolarHBondContact CB-OH 3.46Å; L5-Y38 PolarHBondContact O-OH 3.39Å; L6-Y38 HydrophobicContact CB-CE2 4.26Å; L6-Y38 HydrophobicContact CD1-CD2 3.81Å; L6-Y38 HydrophobicContact CD1-CE2 4.28Å; L6-Y38 HydrophobicContact CD1-CG 4.05Å; L6-Y38 HydrophobicContact CD2-CD2 3.15Å; L6-Y38 HydrophobicContact CD2-CE2 3.17Å; L6-Y38 HydrophobicContact CD2-CG 4.18Å; L6-Y38 HydrophobicContact CG-CD1 4.42Å; L6-Y38 HydrophobicContact CG-CD2 3.26Å; L6-Y38 HydrophobicContact CG-CE1 4.38Å; L6-Y38 HydrophobicContact CG-CE2 3.25Å; L6-Y38 HydrophobicContact CG-CG 3.89Å; A34-Y38 HydrophobicContact CB-CE2 4.46Å; A34-Y38 WeakPolarHBondContact O-CD2 3.43Å; A34-Y38 PolarHBondContact O-N 3.12Å; T35-Y38 PolarHBondContact O-N 3.48Å; A36-Y38 PolarHBondContact O-N 3.5Å; Y38-M40 VanDerWaalsContact C-N 3.32Å; Y38-M41 HydrophobicContact CD1-SD 3.98Å; Y38-M41 HydrophobicContact CE1-SD 4.09Å; Y38-M41 PolarHBondContact O-N 3.21Å; Y38-D42 WeakPolarHBondContact O-CB 3.46Å; Y38-D42 PolarHBondContact O-N 3.25Å
39Q77.6Confident72.3Confident116 Ų11666.1 Ų66.154%0.54235%0.345SS..Hα-helixtrans-61.6-41.8170.1-75.2174.8-3.700111.6T35 A36 M41 D42 Q43T35-Q39 WeakPolarHBondContact O-CG 3.34Å; T35-Q39 PolarHBondContact O-N 2.78Å; A36-Q39 PolarHBondContact O-N 2.62Å; Q39-M41 VanDerWaalsContact C-N 3.34Å; Q39-D42 PolarHBondContact O-N 3.2Å; Q39-Q43 WeakPolarHBondContact O-CB 3.42Å; Q39-Q43 VanDerWaalsContact O-CG 3.26Å; Q39-Q43 WeakPolarHBondContact O-CG 3.38Å; Q39-Q43 PolarHBondContact O-N 3.21Å
40M79.3Confident71.5Confident55 Ų5571.1 Ų71.127%0.27136%0.363SS..Hα-helixtrans-63.7-41.2174.8-63.6170-168.800111.4A36 V37 Y38 L44 I62 E65 L69A36-M40 WeakPolarHBondContact O-CG 3.43Å; A36-M40 PolarHBondContact O-N 3.11Å; V37-M40 WeakPolarHBondContact O-CB 3.39Å; V37-M40 PolarHBondContact O-N 3.16Å; Y38-M40 VanDerWaalsContact C-N 3.32Å; M40-L44 WeakPolarHBondContact O-CB 3.07Å; M40-L44 PolarHBondContact O-N 3.14Å; M40-I62 HydrophobicContact CB-CD1 4.09Å; M40-I62 HydrophobicContact CB-CG1 3.98Å; M40-I62 HydrophobicContact CB-CG2 4.49Å; M40-E65 HydrophobicContact CE-CG 3.64Å; M40-E65 HydrophobicContact SD-CB 4.25Å; M40-E65 HydrophobicContact SD-CG 3.96Å; M40-L69 HydrophobicContact CE-CD1 4.49Å
41M71.5Confident71Confident31 Ų3177.2 Ų77.215%0.15339%0.389CS..Hα-helixtrans-63.6-49.1174.8-70.518068.500111.6V37 Y38 Q39 Q43 L44 Y45 I62V37-M41 HydrophobicContact CG1-SD 4.3Å; V37-M41 WeakPolarHBondContact O-CG 3.48Å; V37-M41 PolarHBondContact O-N 3.32Å; Y38-M41 HydrophobicContact CD1-SD 3.98Å; Y38-M41 HydrophobicContact CE1-SD 4.09Å; Y38-M41 PolarHBondContact O-N 3.21Å; Q39-M41 VanDerWaalsContact C-N 3.34Å; M41-Q43 VanDerWaalsContact C-N 3.3Å; M41-Q43 PolarHBondContact O-N 3.28Å; M41-L44 WeakPolarHBondContact O-CA 3.35Å; M41-L44 WeakPolarHBondContact O-CB 3.39Å; M41-L44 PolarHBondContact O-N 3.43Å; M41-Y45 HydrophobicContact CB-CD2 4.35Å; M41-Y45 HydrophobicContact CB-CE2 4.18Å; M41-Y45 HydrophobicContact CE-CE2 4.05Å; M41-Y45 WeakPolarHBondContact O-CD2 3.06Å; M41-Y45 PolarHBondContact O-N 2.96Å; M41-I62 HydrophobicContact CG-CD1 4.08Å; M41-I62 HydrophobicContact CG-CG2 4.2Å
42D75.9Confident70.1Confident73 Ų7378.8 Ų78.839%0.3940%0.404SS..Hα-helixtrans-61.6-39.3179.5-77.8-9.7000111.1S2 Y38 Q39 Y45 Q46S2-D42 PolarHBondContact OG-OD1 3.28Å; Y38-D42 WeakPolarHBondContact O-CB 3.46Å; Y38-D42 PolarHBondContact O-N 3.25Å; Q39-D42 PolarHBondContact O-N 3.2Å; D42-Y45 PolarHBondContact O-N 3.38Å; D42-Q46 WeakPolarHBondContact O-CB 3.5Å; D42-Q46 VanDerWaalsContact O-CG 3.29Å; D42-Q46 WeakPolarHBondContact O-CG 3.43Å; D42-Q46 PolarHBondContact O-N 2.91Å
43Q79.2Confident69.2Low136 Ų13676.4 Ų76.464%0.63641%0.405SS*.Hα-helixtrans-61.4-41.8170.8-76.2176.3-4.800112.4Q39 M41 Y45 Q46Q39-Q43 WeakPolarHBondContact O-CB 3.42Å; Q39-Q43 VanDerWaalsContact O-CG 3.26Å; Q39-Q43 WeakPolarHBondContact O-CG 3.38Å; Q39-Q43 PolarHBondContact O-N 3.21Å; M41-Q43 VanDerWaalsContact C-N 3.3Å; M41-Q43 PolarHBondContact O-N 3.28Å; Q43-Y45 VanDerWaalsContact C-N 3.31Å; Q43-Y45 PolarHBondContact O-N 2.98Å; Q43-Q46 PolarHBondContact O-N 2.75Å
44L74.6Confident68.7Low16 Ų1680.4 Ų80.48%0.08442%0.419CS..Hα-helixtrans-62.5-38.4176.2176.561.4000111.8M40 M41 Y54 F55 E58 L59 I62M40-L44 WeakPolarHBondContact O-CB 3.07Å; M40-L44 PolarHBondContact O-N 3.14Å; M41-L44 WeakPolarHBondContact O-CA 3.35Å; M41-L44 WeakPolarHBondContact O-CB 3.39Å; M41-L44 PolarHBondContact O-N 3.43Å; L44-Y54 HydrophobicContact CD1-CE1 4.34Å; L44-F55 HydrophobicContact CD1-CE1 4.42Å; L44-F55 HydrophobicContact CD1-CZ 4.3Å; L44-F55 HydrophobicContact CD2-CD1 4.05Å; L44-F55 HydrophobicContact CD2-CE1 3.63Å; L44-F55 HydrophobicContact CD2-CZ 4.24Å; L44-F55 HydrophobicContact CG-CD1 4.39Å; L44-F55 HydrophobicContact CG-CE1 3.69Å; L44-F55 HydrophobicContact CG-CE2 4.5Å; L44-F55 HydrophobicContact CG-CZ 3.75Å; L44-E58 HydrophobicContact CD1-CB 3.42Å; L44-E58 VanDerWaalsContact CD1-CB 3.42Å; L44-E58 HydrophobicContact CD1-CG 3.69Å; L44-E58 HydrophobicContact CD2-CB 3.76Å; L44-E58 HydrophobicContact CG-CB 4.23Å; L44-L59 HydrophobicContact CD2-CD2 4.04Å; L44-L59 HydrophobicContact CD2-CG 4.12Å; L44-I62 HydrophobicContact CB-CD1 4.31Å; L44-I62 HydrophobicContact CD2-CD1 3.78Å
45Y70.1Confident68.5Low109 Ų10980.8 Ų80.843%0.42742%0.421SS..Hα-helixtrans-83.3-17.4179.4-69-68.8000114M41 D42 Q43 G47 F55M41-Y45 HydrophobicContact CB-CD2 4.35Å; M41-Y45 HydrophobicContact CB-CE2 4.18Å; M41-Y45 HydrophobicContact CE-CE2 4.05Å; M41-Y45 WeakPolarHBondContact O-CD2 3.06Å; M41-Y45 PolarHBondContact O-N 2.96Å; D42-Y45 PolarHBondContact O-N 3.38Å; Q43-Y45 VanDerWaalsContact C-N 3.31Å; Q43-Y45 PolarHBondContact O-N 2.98Å; Y45-G47 PolarHBondContact O-N 3.14Å; Y45-F55 AromaticContact CD1-CE1 3.59Å; Y45-F55 HydrophobicContact CD1-CE1 3.59Å; Y45-F55 HydrophobicContact CD1-CE2 4.39Å; Y45-F55 AromaticContact CD1-CZ 3.25Å; Y45-F55 HydrophobicContact CD1-CZ 3.25Å; Y45-F55 HydrophobicContact CE1-CD1 4.16Å; Y45-F55 AromaticContact CE1-CE1 3.06Å; Y45-F55 HydrophobicContact CE1-CE1 3.06Å; Y45-F55 HydrophobicContact CE1-CE2 4.48Å; Y45-F55 AromaticContact CE1-CZ 3.27Å; Y45-F55 HydrophobicContact CE1-CZ 3.27Å; Y45-F55 HydrophobicContact CE2-CE1 4.35Å; Y45-F55 HydrophobicContact CG-CE1 4.4Å; Y45-F55 HydrophobicContact CG-CZ 4.08Å; Y45-F55 AromaticContact CZ-CE1 3.48Å; Y45-F55 VanDerWaalsContact CZ-CE1 3.48Å
46Q73.3Confident68Low142 Ų14280.6 Ų80.666%0.66442%0.421SS*.THydrogen-bonded Turntrans-66.5115.3-178.9-90.5-178.212.500112.2D42 Q43 K48D42-Q46 WeakPolarHBondContact O-CB 3.5Å; D42-Q46 VanDerWaalsContact O-CG 3.29Å; D42-Q46 WeakPolarHBondContact O-CG 3.43Å; D42-Q46 PolarHBondContact O-N 2.91Å; Q43-Q46 PolarHBondContact O-N 2.75Å; Q46-K48 PolarHBondContact O-N 1.98Å
47G63Low67.4Low90 Ų9084.1 Ų84.193%0.92844%0.436SS*.THydrogen-bonded Turntrans70.99.2169.600000115.8Y45Y45-G47 PolarHBondContact O-N 3.14Å
48K61.6Low67.6Low109 Ų10986.8 Ų86.847%0.47445%0.448SS..  trans-111122-175.9-61-104.5-177162.60110.5Q46 Y54Q46-K48 PolarHBondContact O-N 1.98Å; K48-Y54 HydrophobicContact CD-CE1 4.33Å; K48-Y54 PolarHBondContact NZ-OH 3.5Å
49M56.5Low67.6Low159 Ų15988 Ų8878%0.78346%0.456SS*.  trans-68.1148.3162.3-99.2-173.4-79.400109.4F51M49-F51 WeakPolarHBondContact O-CD2 3.45Å; M49-F51 PolarHBondContact O-N 3.04Å; M49-F51 VanDerWaalsContact O-N 3.1Å
50Y55.4Low67.2Low161 Ų16189.8 Ų89.863%0.63146%0.458SS*.  trans-58.3115178.1178.7-94.9000111P52 F55Y50-P52 HydrophobicContact CD1-CG 4.49Å; Y50-P52 HydrophobicContact CE1-CB 4.5Å; Y50-P52 HydrophobicContact CE1-CG 4.12Å; Y50-F55 HydrophobicContact CD2-CB 4.14Å; Y50-F55 HydrophobicContact CD2-CD2 4.16Å; Y50-F55 HydrophobicContact CD2-CG 4.12Å; Y50-F55 HydrophobicContact CE2-CB 3.96Å; Y50-F55 HydrophobicContact CE2-CG 4.37Å
51F58.4Low66.9Low129 Ų12991 Ų9157%0.56647%0.465SS*.  trans-104.7118.2171.3-78.2-83.5000109.4M49 G53 Y54 F55M49-F51 WeakPolarHBondContact O-CD2 3.45Å; M49-F51 PolarHBondContact O-N 3.04Å; M49-F51 VanDerWaalsContact O-N 3.1Å; F51-G53 PolarHBondContact O-N 3.37Å; F51-Y54 PolarHBondContact O-N 2.8Å; F51-F55 PolarHBondContact O-N 2.85Å
52P52.7Low66.9Low107 Ų10790.3 Ų90.370%0.69546%0.462SS*.THydrogen-bonded Turntrans-55.1131.8178.2-23.732.2000111.7Y50 Y54Y50-P52 HydrophobicContact CD1-CG 4.49Å; Y50-P52 HydrophobicContact CE1-CB 4.5Å; Y50-P52 HydrophobicContact CE1-CG 4.12Å; P52-Y54 VanDerWaalsContact C-N 3.28Å; P52-Y54 PolarHBondContact O-N 3.35Å
53G58.7Low66.6Low44 Ų4493 Ų9345%0.45447%0.47SS..THydrogen-bonded Turntrans84.4-28.4179.200000115.9F51F51-G53 PolarHBondContact O-N 3.37Å
54Y64.8Low66Low90 Ų9093.5 Ų93.535%0.35347%0.466SS..Hα-helixtrans-73.4-51.4173.6179.7-108.9000111.2L44 K48 F51 P52 N57 E58L44-Y54 HydrophobicContact CD1-CE1 4.34Å; K48-Y54 HydrophobicContact CD-CE1 4.33Å; K48-Y54 PolarHBondContact NZ-OH 3.5Å; F51-Y54 PolarHBondContact O-N 2.8Å; P52-Y54 VanDerWaalsContact C-N 3.28Å; P52-Y54 PolarHBondContact O-N 3.35Å; Y54-N57 PolarHBondContact O-N 2.93Å; Y54-E58 HydrophobicContact CD1-CG 4.49Å; Y54-E58 HydrophobicContact CD2-CG 4.35Å; Y54-E58 HydrophobicContact CE1-CG 4.13Å; Y54-E58 HydrophobicContact CE2-CG 3.95Å; Y54-E58 VanDerWaalsContact CE2-OE1 3.28Å; Y54-E58 WeakPolarHBondContact CE2-OE1 3.33Å; Y54-E58 PolarHBondContact O-N 3.48Å; Y54-E58 VanDerWaalsContact O-N 3.14Å; Y54-E58 PolarHBondContact OH-OE1 2.89Å
55F67.1Low65.9Low11 Ų1196.6 Ų96.65%0.04848%0.481CS..Hα-helixtrans-58.2-45.8-178.7-120.7-80.9000114.1L44 Y45 Y50 F51 N57 E58 L59L44-F55 HydrophobicContact CD1-CE1 4.42Å; L44-F55 HydrophobicContact CD1-CZ 4.3Å; L44-F55 HydrophobicContact CD2-CD1 4.05Å; L44-F55 HydrophobicContact CD2-CE1 3.63Å; L44-F55 HydrophobicContact CD2-CZ 4.24Å; L44-F55 HydrophobicContact CG-CD1 4.39Å; L44-F55 HydrophobicContact CG-CE1 3.69Å; L44-F55 HydrophobicContact CG-CE2 4.5Å; L44-F55 HydrophobicContact CG-CZ 3.75Å; Y45-F55 AromaticContact CD1-CE1 3.59Å; Y45-F55 HydrophobicContact CD1-CE1 3.59Å; Y45-F55 HydrophobicContact CD1-CE2 4.39Å; Y45-F55 AromaticContact CD1-CZ 3.25Å; Y45-F55 HydrophobicContact CD1-CZ 3.25Å; Y45-F55 HydrophobicContact CE1-CD1 4.16Å; Y45-F55 AromaticContact CE1-CE1 3.06Å; Y45-F55 HydrophobicContact CE1-CE1 3.06Å; Y45-F55 HydrophobicContact CE1-CE2 4.48Å; Y45-F55 AromaticContact CE1-CZ 3.27Å; Y45-F55 HydrophobicContact CE1-CZ 3.27Å; Y45-F55 HydrophobicContact CE2-CE1 4.35Å; Y45-F55 HydrophobicContact CG-CE1 4.4Å; Y45-F55 HydrophobicContact CG-CZ 4.08Å; Y45-F55 AromaticContact CZ-CE1 3.48Å; Y45-F55 VanDerWaalsContact CZ-CE1 3.48Å; Y50-F55 HydrophobicContact CD2-CB 4.14Å; Y50-F55 HydrophobicContact CD2-CD2 4.16Å; Y50-F55 HydrophobicContact CD2-CG 4.12Å; Y50-F55 HydrophobicContact CE2-CB 3.96Å; Y50-F55 HydrophobicContact CE2-CG 4.37Å; F51-F55 PolarHBondContact O-N 2.85Å; F55-N57 VanDerWaalsContact C-N 3.35Å; F55-N57 PolarHBondContact O-N 3.14Å; F55-E58 PolarHBondContact O-N 3.11Å; F55-L59 HydrophobicContact CD1-CD1 4.2Å; F55-L59 HydrophobicContact CD1-CG 4.36Å; F55-L59 WeakPolarHBondContact O-CB 3.4Å; F55-L59 VanDerWaalsContact O-CG 3.3Å; F55-L59 WeakPolarHBondContact O-CG 3.49Å; F55-L59 PolarHBondContact O-N 3.31Å
56P66.8Low65.9Low64 Ų6492.9 Ų92.942%0.41647%0.467SS..Hα-helixtrans-63-34.6177.3-25.635.9000114.5R60P56-R60 WeakPolarHBondContact O-CB 2.98Å; P56-R60 PolarHBondContact O-N 3.25Å
57N68.9Low65.6Low100 Ų10089.8 Ų89.854%0.53546%0.457SS..Hα-helixtrans-72-43.4178.4-82.1-16.2000111.7Y54 F55 R60 N61Y54-N57 PolarHBondContact O-N 2.93Å; F55-N57 VanDerWaalsContact C-N 3.35Å; F55-N57 PolarHBondContact O-N 3.14Å; N57-R60 WeakPolarHBondContact O-CB 3.11Å; N57-R60 PolarHBondContact O-N 3.42Å; N57-N61 PolarHBondContact O-N 3.12Å
58E74.7Confident65.9Low61 Ų6190 Ų9029%0.28543%0.434SS..Hα-helixtrans-65.1-40.6176.4-63.7-66.2179.100111.4L44 Y54 F55 R60 N61 I62L44-E58 HydrophobicContact CD1-CB 3.42Å; L44-E58 VanDerWaalsContact CD1-CB 3.42Å; L44-E58 HydrophobicContact CD1-CG 3.69Å; L44-E58 HydrophobicContact CD2-CB 3.76Å; L44-E58 HydrophobicContact CG-CB 4.23Å; Y54-E58 HydrophobicContact CD1-CG 4.49Å; Y54-E58 HydrophobicContact CD2-CG 4.35Å; Y54-E58 HydrophobicContact CE1-CG 4.13Å; Y54-E58 HydrophobicContact CE2-CG 3.95Å; Y54-E58 VanDerWaalsContact CE2-OE1 3.28Å; Y54-E58 WeakPolarHBondContact CE2-OE1 3.33Å; Y54-E58 PolarHBondContact O-N 3.48Å; Y54-E58 VanDerWaalsContact O-N 3.14Å; Y54-E58 PolarHBondContact OH-OE1 2.89Å; F55-E58 PolarHBondContact O-N 3.11Å; E58-R60 VanDerWaalsContact C-N 3.34Å; E58-R60 PolarHBondContact O-N 3.44Å; E58-N61 WeakPolarHBondContact O-CB 3.46Å; E58-N61 PolarHBondContact O-N 3.47Å; E58-N61 VanDerWaalsContact O-N 3.14Å; E58-I62 WeakPolarHBondContact O-CG1 3.37Å; E58-I62 PolarHBondContact O-N 2.91Å
59L70.2Confident66.4Low46 Ų4686.8 Ų86.824%0.24142%0.422CS..Hα-helixtrans-59.3-43171.9-75.9174000112.2L44 F55 N61 I62 F63L44-L59 HydrophobicContact CD2-CD2 4.04Å; L44-L59 HydrophobicContact CD2-CG 4.12Å; F55-L59 HydrophobicContact CD1-CD1 4.2Å; F55-L59 HydrophobicContact CD1-CG 4.36Å; F55-L59 WeakPolarHBondContact O-CB 3.4Å; F55-L59 VanDerWaalsContact O-CG 3.3Å; F55-L59 WeakPolarHBondContact O-CG 3.49Å; F55-L59 PolarHBondContact O-N 3.31Å; L59-N61 VanDerWaalsContact C-N 3.28Å; L59-N61 PolarHBondContact O-N 3.19Å; L59-I62 PolarHBondContact O-N 2.96Å; L59-F63 WeakPolarHBondContact O-CD2 3.17Å; L59-F63 PolarHBondContact O-N 3.5Å
60R68.8Low66.9Low153 Ų15379.9 Ų79.958%0.57739%0.388SS*.Hα-helixtrans-62.2-35.4175.9-176.4178.6-114.1-179.8-2.3112.2P56 N57 E58 R64P56-R60 WeakPolarHBondContact O-CB 2.98Å; P56-R60 PolarHBondContact O-N 3.25Å; N57-R60 WeakPolarHBondContact O-CB 3.11Å; N57-R60 PolarHBondContact O-N 3.42Å; E58-R60 VanDerWaalsContact C-N 3.34Å; E58-R60 PolarHBondContact O-N 3.44Å; R60-R64 WeakPolarHBondContact O-CG 3.42Å; R60-R64 PolarHBondContact O-N 3.32Å; R60-R64 VanDerWaalsContact O-N 3.1Å
61N73.2Confident67.2Low81 Ų8176.8 Ų76.843%0.43338%0.38SS..Hα-helixtrans-67.1-44.3174.1-68.7-20.7000111.2N57 E58 L59 F63 R64 E65N57-N61 PolarHBondContact O-N 3.12Å; E58-N61 WeakPolarHBondContact O-CB 3.46Å; E58-N61 PolarHBondContact O-N 3.47Å; E58-N61 VanDerWaalsContact O-N 3.14Å; L59-N61 VanDerWaalsContact C-N 3.28Å; L59-N61 PolarHBondContact O-N 3.19Å; N61-F63 VanDerWaalsContact C-N 3.33Å; N61-F63 PolarHBondContact O-N 3.48Å; N61-R64 WeakPolarHBondContact O-CB 3.42Å; N61-R64 PolarHBondContact O-N 3.02Å; N61-R64 VanDerWaalsContact O-N 3.14Å; N61-E65 PolarHBondContact O-N 3.09Å
62I71.3Confident67.6Low16 Ų1674.2 Ų74.28%0.08237%0.371CS..Hα-helixtrans-59.1-43.6175.5-66.8171000111.1V37 M40 M41 L44 E58 L59 R64 E65 Q66V37-I62 HydrophobicContact CG1-CG2 3.83Å; M40-I62 HydrophobicContact CB-CD1 4.09Å; M40-I62 HydrophobicContact CB-CG1 3.98Å; M40-I62 HydrophobicContact CB-CG2 4.49Å; M41-I62 HydrophobicContact CG-CD1 4.08Å; M41-I62 HydrophobicContact CG-CG2 4.2Å; L44-I62 HydrophobicContact CB-CD1 4.31Å; L44-I62 HydrophobicContact CD2-CD1 3.78Å; E58-I62 WeakPolarHBondContact O-CG1 3.37Å; E58-I62 PolarHBondContact O-N 2.91Å; L59-I62 PolarHBondContact O-N 2.96Å; I62-R64 PolarHBondContact O-N 2.98Å; I62-E65 PolarHBondContact O-N 2.76Å; I62-Q66 PolarHBondContact O-N 3.48Å
63F69.3Low68.2Low129 Ų12969.2 Ų69.257%0.56634%0.339SS*.Hα-helixtrans-62.3-39.9175.2-81.2-65.9000112.9L59 N61 E65 Q66 V67L59-F63 WeakPolarHBondContact O-CD2 3.17Å; L59-F63 PolarHBondContact O-N 3.5Å; N61-F63 VanDerWaalsContact C-N 3.33Å; N61-F63 PolarHBondContact O-N 3.48Å; F63-E65 VanDerWaalsContact C-N 3.33Å; F63-Q66 WeakPolarHBondContact O-CB 3.25Å; F63-Q66 PolarHBondContact O-N 3.42Å; F63-V67 WeakPolarHBondContact O-CG2 3.46Å; F63-V67 PolarHBondContact O-N 3.49Å; F63-V67 VanDerWaalsContact O-N 3.12Å
64R66.7Low68.4Low146 Ų14668.8 Ų68.855%0.55133%0.326SS*.Hα-helixtrans-63.6-41.6175.2-76173174174-4.6111.4R60 N61 I62 V67 H68R60-R64 WeakPolarHBondContact O-CG 3.42Å; R60-R64 PolarHBondContact O-N 3.32Å; R60-R64 VanDerWaalsContact O-N 3.1Å; N61-R64 WeakPolarHBondContact O-CB 3.42Å; N61-R64 PolarHBondContact O-N 3.02Å; N61-R64 VanDerWaalsContact O-N 3.14Å; I62-R64 PolarHBondContact O-N 2.98Å; R64-V67 PolarHBondContact O-N 3.41Å; R64-H68 PolarHBondContact O-CD2 2.83Å; R64-H68 VanDerWaalsContact O-CD2 3.29Å; R64-H68 PolarHBondContact O-N 3.2Å; R64-H68 VanDerWaalsContact O-N 3.08Å
65E72.9Confident68.1Low82 Ų8266 Ų6638%0.38332%0.317SS..Hα-helixtrans-66.7-40.9178.7-16458.7-154.200111.7M40 N61 I62 F63 V67 H68 L69M40-E65 HydrophobicContact CE-CG 3.64Å; M40-E65 HydrophobicContact SD-CB 4.25Å; M40-E65 HydrophobicContact SD-CG 3.96Å; N61-E65 PolarHBondContact O-N 3.09Å; I62-E65 PolarHBondContact O-N 2.76Å; F63-E65 VanDerWaalsContact C-N 3.33Å; E65-V67 VanDerWaalsContact C-N 3.31Å; E65-V67 PolarHBondContact O-N 3.14Å; E65-H68 PolarHBondContact O-N 3Å; E65-H68 VanDerWaalsContact O-N 3.14Å; E65-L69 HydrophobicContact CG-CD1 4.41Å; E65-L69 VanDerWaalsContact O-CG 3.32Å; E65-L69 WeakPolarHBondContact O-CG 3.4Å; E65-L69 PolarHBondContact O-N 2.91Å
66Q68.9Low67.8Low31 Ų3169.6 Ų69.615%0.14533%0.334CS..Hα-helixtrans-54.2-46.9171.1178.8-176.5-15.300111.6W9 V37 I62 F63 H68 L69 I70W9-Q66 HydrophobicContact CZ2-CG 3.92Å; W9-Q66 VanDerWaalsContact CZ2-NE2 3.29Å; V37-Q66 HydrophobicContact CG2-CB 3.68Å; V37-Q66 HydrophobicContact CG2-CG 3.92Å; I62-Q66 PolarHBondContact O-N 3.48Å; F63-Q66 WeakPolarHBondContact O-CB 3.25Å; F63-Q66 PolarHBondContact O-N 3.42Å; Q66-H68 VanDerWaalsContact C-N 3.33Å; Q66-H68 PolarHBondContact O-N 3.41Å; Q66-L69 PolarHBondContact O-N 3.22Å; Q66-I70 HydrophobicContact CG-CD1 3.98Å; Q66-I70 WeakPolarHBondContact O-CG1 3.43Å; Q66-I70 PolarHBondContact O-N 2.94Å
67V67.9Low67.3Low76 Ų7666.9 Ų66.946%0.46132%0.317SS..Hα-helixtrans-60.7-43178170.80000111F63 R64 E65 I70 Q71F63-V67 WeakPolarHBondContact O-CG2 3.46Å; F63-V67 PolarHBondContact O-N 3.49Å; F63-V67 VanDerWaalsContact O-N 3.12Å; R64-V67 PolarHBondContact O-N 3.41Å; E65-V67 VanDerWaalsContact C-N 3.31Å; E65-V67 PolarHBondContact O-N 3.14Å; V67-I70 PolarHBondContact O-N 3.02Å; V67-Q71 WeakPolarHBondContact O-CB 3.5Å; V67-Q71 VanDerWaalsContact O-CG 3.28Å; V67-Q71 WeakPolarHBondContact O-CG 3.44Å; V67-Q71 PolarHBondContact O-N 3.07Å
68H69.9Low66.3Low94 Ų9464.1 Ų64.144%0.43530%0.301SS..Hα-helixtrans-64.3-42.4176.7-74.4-47.5000113R64 E65 Q66 I70 Q71 N72R64-H68 PolarHBondContact O-CD2 2.83Å; R64-H68 VanDerWaalsContact O-CD2 3.29Å; R64-H68 PolarHBondContact O-N 3.2Å; R64-H68 VanDerWaalsContact O-N 3.08Å; E65-H68 PolarHBondContact O-N 3Å; E65-H68 VanDerWaalsContact O-N 3.14Å; Q66-H68 VanDerWaalsContact C-N 3.33Å; Q66-H68 PolarHBondContact O-N 3.41Å; H68-I70 PolarHBondContact O-N 3.47Å; H68-Q71 PolarHBondContact ND1-OE1 3.26Å; H68-Q71 PolarHBondContact O-N 2.91Å; H68-N72 VanDerWaalsContact O-CG 3.3Å; H68-N72 PolarHBondContact O-N 3.31Å; H68-N72 PolarHBondContact O-ND2 2.92Å
69L71.6Confident65Low42 Ų4264 Ų6422%0.2230%0.3CS..Hα-helixtrans-63.3-41177.9-71172.2000112V33 A36 M40 E65 Q66 N72 A73V33-L69 HydrophobicContact CB-CB 4.32Å; V33-L69 HydrophobicContact CG1-CB 3.61Å; V33-L69 HydrophobicContact CG1-CD1 4.15Å; V33-L69 HydrophobicContact CG2-CB 3.87Å; A36-L69 HydrophobicContact CB-CD1 4.01Å; M40-L69 HydrophobicContact CE-CD1 4.49Å; E65-L69 HydrophobicContact CG-CD1 4.41Å; E65-L69 VanDerWaalsContact O-CG 3.32Å; E65-L69 WeakPolarHBondContact O-CG 3.4Å; E65-L69 PolarHBondContact O-N 2.91Å; Q66-L69 PolarHBondContact O-N 3.22Å; L69-N72 PolarHBondContact O-N 3.26Å; L69-A73 WeakPolarHBondContact O-CB 3.37Å; L69-A73 PolarHBondContact O-N 3.3Å
70I67.1Low63.8Low15 Ų1568.8 Ų68.88%0.07732%0.321CS..Hα-helixtrans-65.6-44.1174.6-66.4170.3000110.8W9 T13 L17 I25 V33 Q66 V67 H68 N72 A73 I74W9-I70 HydrophobicContact CH2-CD1 4.1Å; W9-I70 HydrophobicContact CH2-CG1 4.3Å; W9-I70 HydrophobicContact CZ2-CD1 4.27Å; T13-I70 HydrophobicContact CG2-CD1 3.86Å; L17-I70 HydrophobicContact CD1-CG2 3.96Å; L17-I70 HydrophobicContact CD2-CG2 4.17Å; I25-I70 HydrophobicContact CD1-CG2 4.49Å; V33-I70 HydrophobicContact CG1-CG1 4.03Å; Q66-I70 HydrophobicContact CG-CD1 3.98Å; Q66-I70 WeakPolarHBondContact O-CG1 3.43Å; Q66-I70 PolarHBondContact O-N 2.94Å; V67-I70 PolarHBondContact O-N 3.02Å; H68-I70 PolarHBondContact O-N 3.47Å; I70-N72 VanDerWaalsContact C-N 3.32Å; I70-N72 PolarHBondContact O-N 3.35Å; I70-A73 WeakPolarHBondContact O-CB 3.48Å; I70-A73 PolarHBondContact O-N 3.21Å; I70-I74 HydrophobicContact CG2-CD1 4.02Å; I70-I74 HydrophobicContact CG2-CG1 4.5Å; I70-I74 WeakPolarHBondContact O-CG1 3.48Å; I70-I74 PolarHBondContact O-N 3.5Å
71Q61.8Low62.4Low96 Ų9667 Ų6745%0.44932%0.315SS..Hα-helixtrans-59.1-44176.1-76.5175-15.300111.8V67 H68 A73 I74 I75V67-Q71 WeakPolarHBondContact O-CB 3.5Å; V67-Q71 VanDerWaalsContact O-CG 3.28Å; V67-Q71 WeakPolarHBondContact O-CG 3.44Å; V67-Q71 PolarHBondContact O-N 3.07Å; H68-Q71 PolarHBondContact ND1-OE1 3.26Å; H68-Q71 PolarHBondContact O-N 2.91Å; Q71-A73 VanDerWaalsContact C-N 3.34Å; Q71-A73 PolarHBondContact O-N 2.79Å; Q71-I74 PolarHBondContact O-N 3.26Å; Q71-I75 WeakPolarHBondContact O-CB 3.47Å; Q71-I75 WeakPolarHBondContact O-CD1 3.48Å; Q71-I75 VanDerWaalsContact O-CG1 3.25Å; Q71-I75 WeakPolarHBondContact O-CG1 3.46Å; Q71-I75 PolarHBondContact O-N 3.4Å
72N67.2Low60.9Low74 Ų7470.4 Ų70.440%0.39633%0.329SS..Hα-helixtrans-62.8-42.2175.8-71.8-18.5000111.4H68 L69 I70 I74 I75 E76H68-N72 VanDerWaalsContact O-CG 3.3Å; H68-N72 PolarHBondContact O-N 3.31Å; H68-N72 PolarHBondContact O-ND2 2.92Å; L69-N72 PolarHBondContact O-N 3.26Å; I70-N72 VanDerWaalsContact C-N 3.32Å; I70-N72 PolarHBondContact O-N 3.35Å; N72-I74 PolarHBondContact O-N 2.84Å; N72-I75 PolarHBondContact O-N 3.01Å; N72-E76 WeakPolarHBondContact O-CB 3.37Å; N72-E76 WeakPolarHBondContact O-CG 3.45Å; N72-E76 PolarHBondContact O-N 2.97Å
73A64.7Low59.6Low2 Ų273.8 Ų73.82%0.01735%0.35CS..Hα-helixtrans-62.3-39.4175.600000112.9I25 K29 L69 I70 Q71 S77I25-A73 HydrophobicContact CG2-CB 4.17Å; K29-A73 HydrophobicContact CG-CB 3.55Å; L69-A73 WeakPolarHBondContact O-CB 3.37Å; L69-A73 PolarHBondContact O-N 3.3Å; I70-A73 WeakPolarHBondContact O-CB 3.48Å; I70-A73 PolarHBondContact O-N 3.21Å; Q71-A73 VanDerWaalsContact C-N 3.34Å; Q71-A73 PolarHBondContact O-N 2.79Å; A73-S77 WeakPolarHBondContact O-CB 3.35Å; A73-S77 PolarHBondContact O-N 2.92Å; A73-S77 PolarHBondContact O-OG 2.99Å
74I62Low58.6Low36 Ų3670.1 Ų70.119%0.18534%0.336CS..Hα-helixtrans-60.5-50.7172.8-71.2167.8000109.8L19 A23 I25 I70 Q71 N72 E76 S77 I78L19-I74 HydrophobicContact CD2-CD1 4.46Å; A23-I74 HydrophobicContact CB-CG2 3.9Å; I25-I74 HydrophobicContact CD1-CB 4.45Å; I25-I74 HydrophobicContact CD1-CD1 4.04Å; I25-I74 HydrophobicContact CD1-CG1 3.25Å; I25-I74 HydrophobicContact CG1-CG1 3.73Å; I70-I74 HydrophobicContact CG2-CD1 4.02Å; I70-I74 HydrophobicContact CG2-CG1 4.5Å; I70-I74 WeakPolarHBondContact O-CG1 3.48Å; I70-I74 PolarHBondContact O-N 3.5Å; Q71-I74 PolarHBondContact O-N 3.26Å; N72-I74 PolarHBondContact O-N 2.84Å; I74-E76 PolarHBondContact O-N 3Å; I74-S77 PolarHBondContact O-N 3.2Å; I74-S77 VanDerWaalsContact O-N 3.16Å; I74-S77 PolarHBondContact O-OG 3.45Å; I74-I78 HydrophobicContact CG2-CD1 3.86Å; I74-I78 WeakPolarHBondContact O-CG1 3.39Å; I74-I78 PolarHBondContact O-N 2.73Å
75I60Low57.8Low31 Ų3164.4 Ų64.416%0.15932%0.318CS..Hα-helixtrans-60.7-46.3-179.3-69.5163.8000110.7Q71 N72 S77 I78 F79 W107Q71-I75 WeakPolarHBondContact O-CB 3.47Å; Q71-I75 WeakPolarHBondContact O-CD1 3.48Å; Q71-I75 VanDerWaalsContact O-CG1 3.25Å; Q71-I75 WeakPolarHBondContact O-CG1 3.46Å; Q71-I75 PolarHBondContact O-N 3.4Å; N72-I75 PolarHBondContact O-N 3.01Å; I75-S77 PolarHBondContact O-N 3.25Å; I75-I78 WeakPolarHBondContact O-CB 3.49Å; I75-I78 PolarHBondContact O-N 3Å; I75-I78 VanDerWaalsContact O-N 3.16Å; I75-F79 HydrophobicContact CG2-CD2 3.75Å; I75-F79 HydrophobicContact CG2-CE2 3.3Å; I75-F79 HydrophobicContact CG2-CZ 4.16Å; I75-F79 WeakPolarHBondContact O-CD2 3.25Å; I75-F79 PolarHBondContact O-N 3.49Å; I75-W107 HydrophobicContact CD1-CZ3 4.27Å; I75-W107 HydrophobicContact CG1-CE3 4.35Å; I75-W107 HydrophobicContact CG1-CH2 4.27Å; I75-W107 HydrophobicContact CG1-CZ3 3.86Å; I75-W107 HydrophobicContact CG2-CD2 4.21Å; I75-W107 HydrophobicContact CG2-CE3 3.92Å; I75-W107 HydrophobicContact CG2-CZ3 4.25Å
76E60.4Low57.1Low87 Ų8761.5 Ų61.541%0.40731%0.307SS..Hα-helixtrans-57.1-41.1172-75.4-179.5-162.900113.7K29 N72 I74 I78 F79 Q80K29-E76 WeakPolarHBondContact CE-OE2 2.98Å; K29-E76 IonicContact NZ-OE1 3.96Å; K29-E76 IonicContact NZ-OE2 2.62Å; K29-E76 PolarHBondContact NZ-OE2 2.82Å; N72-E76 WeakPolarHBondContact O-CB 3.37Å; N72-E76 WeakPolarHBondContact O-CG 3.45Å; N72-E76 PolarHBondContact O-N 2.97Å; I74-E76 PolarHBondContact O-N 3Å; E76-I78 VanDerWaalsContact C-N 3.33Å; E76-I78 PolarHBondContact O-N 2.88Å; E76-F79 WeakPolarHBondContact O-CB 3.16Å; E76-F79 PolarHBondContact O-N 3.37Å; E76-Q80 PolarHBondContact O-N 2.94Å
77S55.3Low56.5Low7 Ų765.9 Ų65.95%0.04933%0.331CS..Hα-helixtrans-67.5-34.817673.80000112.1A73 I74 I75 F79 Q80 Y81A73-S77 WeakPolarHBondContact O-CB 3.35Å; A73-S77 PolarHBondContact O-N 2.92Å; A73-S77 PolarHBondContact O-OG 2.99Å; I74-S77 PolarHBondContact O-N 3.2Å; I74-S77 VanDerWaalsContact O-N 3.16Å; I74-S77 PolarHBondContact O-OG 3.45Å; I75-S77 PolarHBondContact O-N 3.25Å; S77-F79 VanDerWaalsContact C-N 3.34Å; S77-Q80 WeakPolarHBondContact O-CB 3.41Å; S77-Q80 PolarHBondContact O-N 3.45Å; S77-Y81 WeakPolarHBondContact O-CD2 3.48Å
78I49.1Very low55.8Low41 Ų4166.8 Ų66.821%0.2133%0.333CS..Hα-helixtrans-69-35.3174.2-65.1164.2000110.7A23 I74 I75 E76 Q80 Y81 I84 W107A23-I78 HydrophobicContact CB-CD1 4.17Å; A23-I78 HydrophobicContact CB-CG1 3.86Å; I74-I78 HydrophobicContact CG2-CD1 3.86Å; I74-I78 WeakPolarHBondContact O-CG1 3.39Å; I74-I78 PolarHBondContact O-N 2.73Å; I75-I78 WeakPolarHBondContact O-CB 3.49Å; I75-I78 PolarHBondContact O-N 3Å; I75-I78 VanDerWaalsContact O-N 3.16Å; E76-I78 VanDerWaalsContact C-N 3.33Å; E76-I78 PolarHBondContact O-N 2.88Å; I78-Q80 VanDerWaalsContact C-N 3.28Å; I78-Q80 PolarHBondContact O-N 3.23Å; I78-Y81 PolarHBondContact O-N 3.14Å; I78-I84 HydrophobicContact CG2-CD1 4.03Å; I78-W107 HydrophobicContact CD1-CZ2 4.32Å; I78-W107 HydrophobicContact CG2-CZ2 4.01Å
79F47.7Very low54.9Low58 Ų5863.1 Ų63.125%0.25432%0.318SS..Hα-helixtrans-60.1-35.4173.1-77.7-64.1000113.2I75 E76 S77 Y81 E82 C101 S103 W107I75-F79 HydrophobicContact CG2-CD2 3.75Å; I75-F79 HydrophobicContact CG2-CE2 3.3Å; I75-F79 HydrophobicContact CG2-CZ 4.16Å; I75-F79 WeakPolarHBondContact O-CD2 3.25Å; I75-F79 PolarHBondContact O-N 3.49Å; E76-F79 WeakPolarHBondContact O-CB 3.16Å; E76-F79 PolarHBondContact O-N 3.37Å; S77-F79 VanDerWaalsContact C-N 3.34Å; F79-Y81 PolarHBondContact O-N 3.21Å; F79-E82 PolarHBondContact O-N 2.93Å; F79-C101 HydrophobicContact CD1-CB 4.22Å; F79-C101 HydrophobicContact CE1-CB 3.52Å; F79-C101 HydrophobicContact CZ-CB 4.47Å; F79-S103 WeakPolarHBondContact CZ-O 3.27Å; F79-W107 AromaticContact CD1-CD1 3.91Å; F79-W107 HydrophobicContact CD1-CG 4.43Å; F79-W107 HydrophobicContact CE1-CB 3.39Å; F79-W107 AromaticContact CE1-CD1 3.34Å; F79-W107 AromaticContact CE1-CG 3.54Å; F79-W107 HydrophobicContact CE1-CG 3.54Å; F79-W107 HydrophobicContact CE2-CB 4.19Å; F79-W107 HydrophobicContact CE2-CG 4.31Å; F79-W107 HydrophobicContact CZ-CB 3.12Å; F79-W107 AromaticContact CZ-CD1 3.78Å; F79-W107 HydrophobicContact CZ-CD2 4.37Å; F79-W107 AromaticContact CZ-CG 3.49Å; F79-W107 HydrophobicContact CZ-CG 3.49Å; F79-W107 VanDerWaalsContact CZ-CG 3.49Å
80Q43.6Very low54.1Low147 Ų14764 Ų6469%0.68733%0.325SS*.THydrogen-bonded Turntrans-64.6-20.9173.3-77.8-175.2-12.500113.2E76 S77 I78E76-Q80 PolarHBondContact O-N 2.94Å; S77-Q80 WeakPolarHBondContact O-CB 3.41Å; S77-Q80 PolarHBondContact O-N 3.45Å; I78-Q80 VanDerWaalsContact C-N 3.28Å; I78-Q80 PolarHBondContact O-N 3.23Å
81Y39.5Very low53.3Low116 Ų11669.6 Ų69.646%0.45536%0.355SS..THydrogen-bonded Turntrans-91.115.5179.4-75.7-72.2000114K24 S77 I78 F79 T83K24-Y81 HydrophobicContact CB-CE2 3.96Å; K24-Y81 WeakPolarHBondContact CB-OH 3.11Å; S77-Y81 WeakPolarHBondContact O-CD2 3.48Å; I78-Y81 PolarHBondContact O-N 3.14Å; F79-Y81 PolarHBondContact O-N 3.21Å; Y81-T83 WeakPolarHBondContact O-CB 3.21Å; Y81-T83 VanDerWaalsContact O-CG2 3.24Å; Y81-T83 WeakPolarHBondContact O-CG2 3.33Å; Y81-T83 PolarHBondContact O-N 3.25Å; Y81-T83 PolarHBondContact O-OG1 3.45Å
82E41.8Very low52.7Low153 Ų15369.3 Ų69.372%0.71536%0.364SS*.THydrogen-bonded Turntrans39.143170.7-68.7-170.616500115.4F79F79-E82 PolarHBondContact O-N 2.93Å
83T44Very low52Low86 Ų8671.8 Ų71.853%0.52837%0.373SS..  trans-120.71.2-16725.40000115.5Y81 G98Y81-T83 WeakPolarHBondContact O-CB 3.21Å; Y81-T83 VanDerWaalsContact O-CG2 3.24Å; Y81-T83 WeakPolarHBondContact O-CG2 3.33Å; Y81-T83 PolarHBondContact O-N 3.25Å; Y81-T83 PolarHBondContact O-OG1 3.45Å; T83-G98 WeakPolarHBondContact O-CA 3.4Å
84I49.3Very low50.9Low53 Ų5377.4 Ų77.427%0.27241%0.407SS..  trans-127.2130.2178.8-67.1169.8000111.3I78 W107 V111I78-I84 HydrophobicContact CG2-CD1 4.03Å; I84-W107 HydrophobicContact CD1-CZ2 3.32Å; I84-W107 HydrophobicContact CG2-CG 4.37Å; I84-V111 HydrophobicContact CD1-CG2 4.2Å; I84-V111 HydrophobicContact CG2-CG2 4.37Å
85S49.1Very low50.1Low25 Ų2579.9 Ų79.918%0.17543%0.432CS..  trans-87.5135.8175.61760000110.1N87 Y99 A110S85-N87 VanDerWaalsContact C-N 3.3Å; S85-N87 PolarHBondContact O-N 3.42Å; S85-Y99 VanDerWaalsContact CA-O 3.31Å; S85-Y99 WeakPolarHBondContact CA-O 3.34Å; S85-A110 VanDerWaalsContact O-CB 3.25Å; S85-A110 WeakPolarHBondContact O-CB 3.32Å
86C57.4Low49.8Very low22 Ų2280 Ų8015%0.14944%0.436CS..SBendtrans-876.1-177.3-1000000115.9C101 Q106 W107C86-C101 WeakPolarHBondContact CA-SG 3.32Å; C86-C101 HydrophobicContact CB-CB 3.75Å; C86-C101 WeakPolarHBondContact CB-SG 3.48Å; C86-C101 PolarHBondContact N-SG 3.01Å; C86-C101 WeakPolarHBondContact SG-CA 3.28Å; C86-C101 WeakPolarHBondContact SG-CB 3.48Å; C86-C101 CovalentContact SG-SG 1.98Å; C86-C101 PolarHBondContact SG-SG 3.3Å; C86-Q106 HydrophobicContact CB-CB 4.29Å; C86-Q106 WeakPolarHBondContact SG-CB 3.41Å; C86-W107 VanDerWaalsContact SG-CA 3.58Å; C86-W107 PolarHBondContact SG-N 3.07Å
87N56.2Low48.8Very low122 Ų12284.5 Ų84.565%0.65245%0.454SS*.SBendtrans-89.4145.2173.3-65.6-33.9000110.2S85 C89S85-N87 VanDerWaalsContact C-N 3.3Å; S85-N87 PolarHBondContact O-N 3.42Å; N87-C89 PolarHBondContact O-N 3.23Å
88N53.1Low48.5Very low95 Ų9584.4 Ų84.451%0.50845%0.454SS..  trans-65.7132.3175.5-74.8-19.1000110.6T90N88-T90 PolarHBondContact O-N 2.96Å
89C52.7Low48.3Very low18 Ų1890.5 Ų90.512%0.12248%0.476CS..  trans-71111.2171.6-48.60000108.9N87 C96 Y117N87-C89 PolarHBondContact O-N 3.23Å; C89-C96 WeakPolarHBondContact CA-SG 3.35Å; C89-C96 HydrophobicContact CB-CB 4.2Å; C89-C96 WeakPolarHBondContact CB-SG 3.33Å; C89-C96 WeakPolarHBondContact SG-CB 3.37Å; C89-C96 CovalentContact SG-SG 2.02Å; C89-C96 PolarHBondContact SG-SG 3.35Å; C89-Y117 HydrophobicContact CB-CG 4.36Å
90T53.8Low48.2Very low60 Ų6094.9 Ų94.937%0.36850%0.502SS..  trans-115.8163.5174.858.90000109.7N88 S92 H93N88-T90 PolarHBondContact O-N 2.96Å; T90-S92 PolarHBondContact O-N 3.29Å; T90-S92 PolarHBondContact OG1-OG 2.95Å; T90-H93 CarbonylContact O-C 3.38Å; T90-H93 PolarHBondContact O-N 3.37Å
91D51.3Low49Very low132 Ų13289.2 Ų89.271%0.70648%0.478SS*.THydrogen-bonded Turntrans-56.5-23.3178.4-58.3-29.4000113.4
92S48.4Very low50.1Low91 Ų9192 Ų9264%0.63650%0.496SS*.THydrogen-bonded Turntrans-82.6-14.9175.959.80000114.6T90T90-S92 PolarHBondContact O-N 3.29Å; T90-S92 PolarHBondContact OG1-OG 2.95Å
93H51.6Low51.2Low125 Ų12587 Ų8758%0.57948%0.478SS*.  trans-128.483.1-178-68-36.9000109.8T90 A95T90-H93 CarbonylContact O-C 3.38Å; T90-H93 PolarHBondContact O-N 3.37Å; H93-A95 VanDerWaalsContact C-N 3.28Å; H93-A95 PolarHBondContact O-N 3.02Å
94V42.6Very low51.8Low121 Ų12186 Ų8673%0.73347%0.474SS*.  trans-72.3-18.1-173-170.30000113
95A45.7Very low52.6Low87 Ų8786.8 Ų86.872%0.71949%0.488SS*.  trans-101.396.2178.800000111.5H93H93-A95 VanDerWaalsContact C-N 3.28Å; H93-A95 PolarHBondContact O-N 3.02Å
96C53.3Low53.2Low33 Ų3389.2 Ų89.222%0.22350%0.497CS..  trans-9967.7163.7-81.90000110.5C89C89-C96 WeakPolarHBondContact CA-SG 3.35Å; C89-C96 HydrophobicContact CB-CB 4.2Å; C89-C96 WeakPolarHBondContact CB-SG 3.33Å; C89-C96 WeakPolarHBondContact SG-CB 3.37Å; C89-C96 CovalentContact SG-SG 2.02Å; C89-C96 PolarHBondContact SG-SG 3.35Å
97F40.1Very low53.5Low182 Ų18289.6 Ų89.680%0.79850%0.495SS*.  trans-120.6100.4166.1-80.8-81000109.4
98G47.3Very low53.9Low5 Ų590 Ų905%0.05249%0.491CS..  trans65.867.213800000123.2T83T83-G98 WeakPolarHBondContact O-CA 3.4Å
99Y46.5Very low54.5Low169 Ų16988.5 Ų88.566%0.66349%0.488SS*.  trans-154.3145.1160.5-68.8-74.8000114.9S85S85-Y99 VanDerWaalsContact CA-O 3.31Å; S85-Y99 WeakPolarHBondContact CA-O 3.34Å
100N45.6Very low54.9Low151 Ų15187.9 Ų87.981%0.80748%0.484SS*.  trans66.251.3158.1-76-7.3000119.9
101C58.9Low55.2Low28 Ų2886.9 Ų86.919%0.18948%0.478CS..  trans-84.1122.9162.6-70.80000112.3F79 C86 W107F79-C101 HydrophobicContact CD1-CB 4.22Å; F79-C101 HydrophobicContact CE1-CB 3.52Å; F79-C101 HydrophobicContact CZ-CB 4.47Å; C86-C101 WeakPolarHBondContact CA-SG 3.32Å; C86-C101 HydrophobicContact CB-CB 3.75Å; C86-C101 WeakPolarHBondContact CB-SG 3.48Å; C86-C101 PolarHBondContact N-SG 3.01Å; C86-C101 WeakPolarHBondContact SG-CA 3.28Å; C86-C101 WeakPolarHBondContact SG-CB 3.48Å; C86-C101 CovalentContact SG-SG 1.98Å; C86-C101 PolarHBondContact SG-SG 3.3Å; C101-W107 HydrophobicContact CB-CB 4.48Å
102E64.2Low55.8Low175 Ų17585.6 Ų85.682%0.81847%0.467SS*.  trans-87.2-10.9180-60.9-178.5166.900113.1
103S64.6Low56.5Low48 Ų4882 Ų8234%0.33644%0.444SS..SBendtrans-158.6160.4-179.865.10000114.7F79 A105 Q106 W107F79-S103 WeakPolarHBondContact CZ-O 3.27Å; S103-A105 VanDerWaalsContact C-N 3.28Å; S103-A105 PolarHBondContact O-N 3.04Å; S103-Q106 PolarHBondContact O-N 3.25Å; S103-Q106 WeakPolarHBondContact OG-CG 3.03Å; S103-Q106 PolarHBondContact OG-N 3.44Å; S103-W107 PolarHBondContact O-N 3.46Å
104S56.1Low56.9Low64 Ų6479.2 Ų79.245%0.44843%0.434SS..Hα-helixtrans-56.2-37174.158.60000113.9K108S104-K108 PolarHBondContact O-N 3.45Å; S104-K108 VanDerWaalsContact O-N 3.12Å
105A65.8Low57.6Low69 Ų6978 Ų7857%0.5742%0.422SS*.Hα-helixtrans-66.7-43.3177.700000112.3S103 K108 S109S103-A105 VanDerWaalsContact C-N 3.28Å; S103-A105 PolarHBondContact O-N 3.04Å; A105-K108 PolarHBondContact O-N 3.49Å; A105-S109 PolarHBondContact O-N 3.06Å; A105-S109 VanDerWaalsContact O-N 3.11Å
106Q62.4Low58.4Low77 Ų7778.3 Ų78.336%0.3641%0.412SS..Hα-helixtrans-64.4-41.4178.4-74.4175.9-9.600111.5C86 S103 S109 A110C86-Q106 HydrophobicContact CB-CB 4.29Å; C86-Q106 WeakPolarHBondContact SG-CB 3.41Å; S103-Q106 PolarHBondContact O-N 3.25Å; S103-Q106 WeakPolarHBondContact OG-CG 3.03Å; S103-Q106 PolarHBondContact OG-N 3.44Å; Q106-S109 WeakPolarHBondContact O-CB 3.31Å; Q106-S109 PolarHBondContact O-N 3Å; Q106-A110 PolarHBondContact O-N 3.31Å
107W64Low58.7Low30 Ų3078.9 Ų78.911%0.11441%0.41CS..Hα-helixtrans-63.6-44.3177.5-179.398.2000112.7I75 I78 F79 I84 C86 C101 S103 S109 A110 V111I75-W107 HydrophobicContact CD1-CZ3 4.27Å; I75-W107 HydrophobicContact CG1-CE3 4.35Å; I75-W107 HydrophobicContact CG1-CH2 4.27Å; I75-W107 HydrophobicContact CG1-CZ3 3.86Å; I75-W107 HydrophobicContact CG2-CD2 4.21Å; I75-W107 HydrophobicContact CG2-CE3 3.92Å; I75-W107 HydrophobicContact CG2-CZ3 4.25Å; I78-W107 HydrophobicContact CD1-CZ2 4.32Å; I78-W107 HydrophobicContact CG2-CZ2 4.01Å; F79-W107 AromaticContact CD1-CD1 3.91Å; F79-W107 HydrophobicContact CD1-CG 4.43Å; F79-W107 HydrophobicContact CE1-CB 3.39Å; F79-W107 AromaticContact CE1-CD1 3.34Å; F79-W107 AromaticContact CE1-CG 3.54Å; F79-W107 HydrophobicContact CE1-CG 3.54Å; F79-W107 HydrophobicContact CE2-CB 4.19Å; F79-W107 HydrophobicContact CE2-CG 4.31Å; F79-W107 HydrophobicContact CZ-CB 3.12Å; F79-W107 AromaticContact CZ-CD1 3.78Å; F79-W107 HydrophobicContact CZ-CD2 4.37Å; F79-W107 AromaticContact CZ-CG 3.49Å; F79-W107 HydrophobicContact CZ-CG 3.49Å; F79-W107 VanDerWaalsContact CZ-CG 3.49Å; I84-W107 HydrophobicContact CD1-CZ2 3.32Å; I84-W107 HydrophobicContact CG2-CG 4.37Å; C86-W107 VanDerWaalsContact SG-CA 3.58Å; C86-W107 PolarHBondContact SG-N 3.07Å; C101-W107 HydrophobicContact CB-CB 4.48Å; S103-W107 PolarHBondContact O-N 3.46Å; W107-S109 PolarHBondContact O-N 2.97Å; W107-A110 PolarHBondContact O-N 3.3Å; W107-A110 VanDerWaalsContact O-N 3.08Å; W107-V111 HydrophobicContact CD2-CG2 3.91Å; W107-V111 HydrophobicContact CE3-CG2 3.97Å; W107-V111 HydrophobicContact CH2-CG2 3.78Å; W107-V111 HydrophobicContact CZ2-CG2 3.74Å; W107-V111 HydrophobicContact CZ3-CG2 3.89Å; W107-V111 WeakPolarHBondContact O-CG2 3.43Å; W107-V111 PolarHBondContact O-N 3.46Å
108K63.4Low59.5Low131 Ų13173.2 Ų73.257%0.5739%0.387SS*.Hα-helixtrans-58-42.4176.4-177.2179.1179178.20110.8S104 A105 Q112S104-K108 PolarHBondContact O-N 3.45Å; S104-K108 VanDerWaalsContact O-N 3.12Å; A105-K108 PolarHBondContact O-N 3.49Å; K108-Q112 PolarHBondContact O-N 2.88Å; K108-Q112 VanDerWaalsContact O-N 3.07Å; K108-Q112 PolarHBondContact O-OE1 3.2Å
109S67.3Low60Low63 Ų6377.4 Ų77.444%0.44141%0.408SS..Hα-helixtrans-62-44175-171.30000112A105 Q106 W107 Q112 G113A105-S109 PolarHBondContact O-N 3.06Å; A105-S109 VanDerWaalsContact O-N 3.11Å; Q106-S109 WeakPolarHBondContact O-CB 3.31Å; Q106-S109 PolarHBondContact O-N 3Å; W107-S109 PolarHBondContact O-N 2.97Å; S109-Q112 PolarHBondContact O-N 3.47Å; S109-G113 PolarHBondContact O-N 3.34Å
110A60.2Low60.7Low4 Ų474.1 Ų74.13%0.03340%0.403CS..Hα-helixtrans-66.2-40.9-179.500000112.7S85 Q106 W107 Q112 G113 L114S85-A110 VanDerWaalsContact O-CB 3.25Å; S85-A110 WeakPolarHBondContact O-CB 3.32Å; Q106-A110 PolarHBondContact O-N 3.31Å; W107-A110 PolarHBondContact O-N 3.3Å; W107-A110 VanDerWaalsContact O-N 3.08Å; A110-Q112 VanDerWaalsContact C-N 3.35Å; A110-Q112 PolarHBondContact O-N 3.14Å; A110-G113 PolarHBondContact O-N 3.48Å; A110-L114 PolarHBondContact O-N 3.08Å
111V60.2Low61.1Low39 Ų3972.9 Ų72.924%0.23639%0.387CS..Hα-helixtrans-62.2-42.2173.6172.60000111.1I84 W107 G113 L114 L115I84-V111 HydrophobicContact CD1-CG2 4.2Å; I84-V111 HydrophobicContact CG2-CG2 4.37Å; W107-V111 HydrophobicContact CD2-CG2 3.91Å; W107-V111 HydrophobicContact CE3-CG2 3.97Å; W107-V111 HydrophobicContact CH2-CG2 3.78Å; W107-V111 HydrophobicContact CZ2-CG2 3.74Å; W107-V111 HydrophobicContact CZ3-CG2 3.89Å; W107-V111 WeakPolarHBondContact O-CG2 3.43Å; W107-V111 PolarHBondContact O-N 3.46Å; V111-G113 VanDerWaalsContact C-N 3.34Å; V111-G113 PolarHBondContact O-N 3.4Å; V111-L114 PolarHBondContact O-N 3.4Å; V111-L115 HydrophobicContact CG1-CD1 4.31Å; V111-L115 WeakPolarHBondContact O-CG 3.4Å; V111-L115 PolarHBondContact O-N 3.18Å
112Q63.4Low60.7Low105 Ų10576 Ų7649%0.49140%0.398SS..Hα-helixtrans-64.1-38.5174.2-82.4172.9-58.300112.4K108 S109 A110 L115 N116K108-Q112 PolarHBondContact O-N 2.88Å; K108-Q112 VanDerWaalsContact O-N 3.07Å; K108-Q112 PolarHBondContact O-OE1 3.2Å; S109-Q112 PolarHBondContact O-N 3.47Å; A110-Q112 VanDerWaalsContact C-N 3.35Å; A110-Q112 PolarHBondContact O-N 3.14Å; Q112-L115 PolarHBondContact O-N 3.15Å; Q112-N116 WeakPolarHBondContact O-CB 2.96Å; Q112-N116 PolarHBondContact O-N 3.28Å; Q112-N116 PolarHBondContact O-ND2 2.94Å
113G64.2Low60.1Low15 Ų1574.2 Ų74.216%0.15540%0.395CS..Hα-helixtrans-58.8-46172.700000112.6S109 A110 V111 N116 Y117S109-G113 PolarHBondContact O-N 3.34Å; A110-G113 PolarHBondContact O-N 3.48Å; V111-G113 VanDerWaalsContact C-N 3.34Å; V111-G113 PolarHBondContact O-N 3.4Å; G113-N116 PolarHBondContact O-N 3.44Å; G113-Y117 WeakPolarHBondContact O-CB 3.44Å; G113-Y117 PolarHBondContact O-N 3.43Å
114L58.4Low59.3Low68 Ų6878.4 Ų78.436%0.35641%0.412SS..Hα-helixtrans-61.4-46.5176.5177.762.6000112.3A110 V111 N116 Y117 I118A110-L114 PolarHBondContact O-N 3.08Å; V111-L114 PolarHBondContact O-N 3.4Å; L114-N116 VanDerWaalsContact C-N 3.3Å; L114-N116 PolarHBondContact O-N 3.23Å; L114-Y117 WeakPolarHBondContact O-CB 3.39Å; L114-Y117 PolarHBondContact O-N 3.28Å; L114-I118 HydrophobicContact CD1-CD1 4.1Å; L114-I118 HydrophobicContact CD1-CG1 4.34Å; L114-I118 HydrophobicContact CG-CD1 4.03Å; L114-I118 WeakPolarHBondContact O-CG1 3.32Å; L114-I118 PolarHBondContact O-N 3.48Å
115L58.6Low58.9Low94 Ų9478.1 Ų78.149%0.49241%0.408SS..Hα-helixtrans-60.8-41.4177.8-71.2171.7000111.7V111 Q112 I118 N119V111-L115 HydrophobicContact CG1-CD1 4.31Å; V111-L115 WeakPolarHBondContact O-CG 3.4Å; V111-L115 PolarHBondContact O-N 3.18Å; Q112-L115 PolarHBondContact O-N 3.15Å; L115-I118 PolarHBondContact O-N 2.91Å; L115-N119 WeakPolarHBondContact O-CB 3.46Å; L115-N119 VanDerWaalsContact O-CG 3.23Å; L115-N119 PolarHBondContact O-N 2.97Å; L115-N119 PolarHBondContact O-ND2 3.21Å; L115-N119 VanDerWaalsContact O-ND2 3.09Å
116N61.9Low58Low95 Ų9579.1 Ų79.151%0.50841%0.411SS..Hα-helixtrans-65.6-41.3176.1-70.6-21.8000111.9Q112 G113 L114 N119 N120Q112-N116 WeakPolarHBondContact O-CB 2.96Å; Q112-N116 PolarHBondContact O-N 3.28Å; Q112-N116 PolarHBondContact O-ND2 2.94Å; G113-N116 PolarHBondContact O-N 3.44Å; L114-N116 VanDerWaalsContact C-N 3.3Å; L114-N116 PolarHBondContact O-N 3.23Å; N116-N119 PolarHBondContact O-N 2.91Å; N116-N120 WeakPolarHBondContact O-CB 3.39Å; N116-N120 PolarHBondContact O-N 3.34Å; N116-N120 PolarHBondContact O-ND2 2.93Å
117Y58.8Low57.5Low44 Ų4479.5 Ų79.517%0.17342%0.42CS..Hα-helixtrans-59.6-50174.8175.8-97.7000111.4C89 G113 L114 N119 N120 W121C89-Y117 HydrophobicContact CB-CG 4.36Å; G113-Y117 WeakPolarHBondContact O-CB 3.44Å; G113-Y117 PolarHBondContact O-N 3.43Å; L114-Y117 WeakPolarHBondContact O-CB 3.39Å; L114-Y117 PolarHBondContact O-N 3.28Å; Y117-N119 VanDerWaalsContact C-N 3.34Å; Y117-N119 PolarHBondContact O-N 3.04Å; Y117-N120 PolarHBondContact O-N 3.25Å; Y117-W121 HydrophobicContact CE1-CD2 4.26Å; Y117-W121 HydrophobicContact CE1-CE3 4.06Å; Y117-W121 VanDerWaalsContact O-CB 3.25Å; Y117-W121 WeakPolarHBondContact O-CB 3.45Å; Y117-W121 PolarHBondContact O-N 3.42Å
118I57.3Low56.8Low63 Ų6380.6 Ų80.632%0.32344%0.435SS..Hα-helixtrans-57.8-46.9177.3-66.8167000110.6L114 L115 N120 W121 H122L114-I118 HydrophobicContact CD1-CD1 4.1Å; L114-I118 HydrophobicContact CD1-CG1 4.34Å; L114-I118 HydrophobicContact CG-CD1 4.03Å; L114-I118 WeakPolarHBondContact O-CG1 3.32Å; L114-I118 PolarHBondContact O-N 3.48Å; L115-I118 PolarHBondContact O-N 2.91Å; I118-N120 VanDerWaalsContact C-N 3.34Å; I118-N120 PolarHBondContact O-N 3.19Å; I118-W121 PolarHBondContact O-N 2.94Å; I118-H122 WeakPolarHBondContact O-CB 3.49Å; I118-H122 PolarHBondContact O-CD2 3.43Å; I118-H122 PolarHBondContact O-N 2.78Å
119N59.4Low56.3Low93 Ų9377.2 Ų77.250%0.49742%0.423SS..Hα-helixtrans-63.2-38.5179.1-72.5-31.3000112.9L115 N116 Y117 N123L115-N119 WeakPolarHBondContact O-CB 3.46Å; L115-N119 VanDerWaalsContact O-CG 3.23Å; L115-N119 PolarHBondContact O-N 2.97Å; L115-N119 PolarHBondContact O-ND2 3.21Å; L115-N119 VanDerWaalsContact O-ND2 3.09Å; N116-N119 PolarHBondContact O-N 2.91Å; Y117-N119 VanDerWaalsContact C-N 3.34Å; Y117-N119 PolarHBondContact O-N 3.04Å; N119-N123 PolarHBondContact O-N 3.12Å; N119-N123 PolarHBondContact O-ND2 3.38Å
120N61.2Low55.7Low101 Ų10182.3 Ų82.354%0.5443%0.433SS..Hα-helixtrans-71.2-36.2175.6-71.1-21.1000111.7N116 Y117 I118 N123 L124N116-N120 WeakPolarHBondContact O-CB 3.39Å; N116-N120 PolarHBondContact O-N 3.34Å; N116-N120 PolarHBondContact O-ND2 2.93Å; Y117-N120 PolarHBondContact O-N 3.25Å; I118-N120 VanDerWaalsContact C-N 3.34Å; I118-N120 PolarHBondContact O-N 3.19Å; N120-N123 WeakPolarHBondContact O-CB 3.29Å; N120-N123 PolarHBondContact O-N 3.25Å; N120-L124 PolarHBondContact O-N 3.28Å
121W52.6Low55.3Low124 Ų12484.1 Ų84.147%0.4745%0.445SS..Hα-helixtrans-69.4-35.5176.9-159.833.4000112Y117 I118 N123 L124 V125Y117-W121 HydrophobicContact CE1-CD2 4.26Å; Y117-W121 HydrophobicContact CE1-CE3 4.06Å; Y117-W121 VanDerWaalsContact O-CB 3.25Å; Y117-W121 WeakPolarHBondContact O-CB 3.45Å; Y117-W121 PolarHBondContact O-N 3.42Å; I118-W121 PolarHBondContact O-N 2.94Å; W121-N123 PolarHBondContact O-N 3.23Å; W121-L124 WeakPolarHBondContact O-CA 3.26Å; W121-L124 WeakPolarHBondContact O-CB 3.38Å; W121-L124 PolarHBondContact O-N 3.46Å; W121-V125 HydrophobicContact CD2-CG2 4.33Å; W121-V125 HydrophobicContact CG-CG2 4.11Å; W121-V125 WeakPolarHBondContact O-CG2 3.37Å; W121-V125 PolarHBondContact O-N 2.88Å
122H50.9Low54.9Low93 Ų9384.1 Ų84.143%0.43144%0.443SS..Hα-helixtrans-58.1-30.2169.2-90.3-119.1000113I118 L124I118-H122 WeakPolarHBondContact O-CB 3.49Å; I118-H122 PolarHBondContact O-CD2 3.43Å; I118-H122 PolarHBondContact O-N 2.78Å; H122-L124 VanDerWaalsContact C-N 3.29Å
123N52.3Low54.4Low139 Ų13983.4 Ų83.474%0.74344%0.44SS*.THydrogen-bonded Turntrans-79-11.6174.2-65.3-41.1000113.2N119 N120 W121N119-N123 PolarHBondContact O-N 3.12Å; N119-N123 PolarHBondContact O-ND2 3.38Å; N120-N123 WeakPolarHBondContact O-CB 3.29Å; N120-N123 PolarHBondContact O-N 3.25Å; W121-N123 PolarHBondContact O-N 3.23Å
124L46.4Very low53.6Low135 Ų13587.1 Ų87.171%0.70746%0.461SS*.THydrogen-bonded Turntrans-106.8-25.7-174.9-75.5161.1000113.8N120 W121 H122N120-L124 PolarHBondContact O-N 3.28Å; W121-L124 WeakPolarHBondContact O-CA 3.26Å; W121-L124 WeakPolarHBondContact O-CB 3.38Å; W121-L124 PolarHBondContact O-N 3.46Å; H122-L124 VanDerWaalsContact C-N 3.29Å
125V47.5Very low53.2Low59 Ų5988.5 Ų88.536%0.35847%0.474SS..  trans-100.2121.2-170.2-173.80000113.4W121 L129W121-V125 HydrophobicContact CD2-CG2 4.33Å; W121-V125 HydrophobicContact CG-CG2 4.11Å; W121-V125 WeakPolarHBondContact O-CG2 3.37Å; W121-V125 PolarHBondContact O-N 2.88Å; V125-L129 HydrophobicContact CB-CD1 3.93Å; V125-L129 HydrophobicContact CG1-CD1 3.48Å; V125-L129 VanDerWaalsContact CG1-CD1 3.48Å; V125-L129 HydrophobicContact CG1-CG 4Å; V125-L129 HydrophobicContact CG2-CD1 4.42Å
126S48.5Very low52.7Low90 Ų9089.2 Ų89.263%0.62948%0.475SS*.  trans-50.1174.9172.3-122.80000115.9A128S126-A128 PolarHBondContact O-N 3.46Å
127P52Low51.9Low84 Ų8489.2 Ų89.255%0.54547%0.474SS..G310 helixtrans-53.5-5-169.5-2733.8000119.5L129 R130P127-L129 VanDerWaalsContact C-N 3.25Å; P127-L129 PolarHBondContact O-N 3.27Å; P127-R130 WeakPolarHBondContact O-CG 3.3Å
128A49.4Very low51.5Low54 Ų5491.1 Ų91.145%0.44650%0.5SS..G310 helixtrans-72.6-11.8-17700000114.2S126S126-A128 PolarHBondContact O-N 3.46Å
129L51.2Low51.1Low59 Ų5995.1 Ų95.131%0.30952%0.522SS..G310 helixtrans-110.716.7179.5-66.6176000113.7V125 P127 C131 L132V125-L129 HydrophobicContact CB-CD1 3.93Å; V125-L129 HydrophobicContact CG1-CD1 3.48Å; V125-L129 VanDerWaalsContact CG1-CD1 3.48Å; V125-L129 HydrophobicContact CG1-CG 4Å; V125-L129 HydrophobicContact CG2-CD1 4.42Å; P127-L129 VanDerWaalsContact C-N 3.25Å; P127-L129 PolarHBondContact O-N 3.27Å; L129-C131 PolarHBondContact O-N 3.36Å; L129-L132 HydrophobicContact CD2-CD1 4.2Å; L129-L132 PolarHBondContact O-N 2.94Å
130R55.1Low50.4Low170 Ų17093.2 Ų93.264%0.64251%0.511SS*.G310 helixtrans-54.2-26.2-178.5-84.4-179.2174.3-174.20.3114.6P127 L132 E133P127-R130 WeakPolarHBondContact O-CG 3.3Å; R130-L132 PolarHBondContact O-N 3.38Å; R130-E133 WeakPolarHBondContact O-CB 3.37Å; R130-E133 WeakPolarHBondContact O-CG 3.47Å; R130-E133 PolarHBondContact O-N 3.46Å
131C52.1Low50.1Low43 Ų4391.5 Ų91.529%0.29150%0.504SS..G310 helixtrans-68.7-20.3177.266.60000114L129 E133 C148L129-C131 PolarHBondContact O-N 3.36Å; C131-E133 VanDerWaalsContact C-N 3.31Å; C131-C148 HydrophobicContact CB-CB 3.86Å; C131-C148 WeakPolarHBondContact CB-SG 3.09Å; C131-C148 WeakPolarHBondContact SG-CB 3.28Å; C131-C148 CovalentContact SG-SG 1.98Å; C131-C148 PolarHBondContact SG-SG 3.48Å
132L52.4Low49.7Very low38 Ų3893.2 Ų93.220%0.19952%0.522CS..G310 helixtrans-95.115.5177.8-61.1178.5000111.7L129 R130 L140L129-L132 HydrophobicContact CD2-CD1 4.2Å; L129-L132 PolarHBondContact O-N 2.94Å; R130-L132 PolarHBondContact O-N 3.38Å; L132-L140 HydrophobicContact CD2-CD2 3.8Å
133E52.7Low49.7Very low90 Ų9096 Ų9642%0.42154%0.535SS..  trans-63.6149.5178.3-83.8-176.2-177.700112.1R130 C131 H136 L137R130-E133 WeakPolarHBondContact O-CB 3.37Å; R130-E133 WeakPolarHBondContact O-CG 3.47Å; R130-E133 PolarHBondContact O-N 3.46Å; C131-E133 VanDerWaalsContact C-N 3.31Å; E133-H136 PolarHBondContact O-N 2.92Å; E133-L137 PolarHBondContact O-N 2.95Å
134P46.1Very low49.7Very low94 Ų9493.2 Ų93.261%0.6152%0.52SS*.Hα-helixtrans-48.2-40.3-176.5-25.733.3000117.4H136 L137P134-H136 PolarHBondContact O-N 2.89Å; P134-L137 PolarHBondContact O-N 3.14Å
135P50.2Low50Low97 Ų9787.9 Ų87.963%0.6350%0.496SS*.Hα-helixtrans-66.9-15.1178.825.3-33000113.7
136H48.4Very low50.1Low108 Ų10887.4 Ų87.450%0.550%0.498SS..Hα-helixtrans-97.7-18.8176.5-63.7-65.4000113.3E133 P134 A138 N139 L140E133-H136 PolarHBondContact O-N 2.92Å; P134-H136 PolarHBondContact O-N 2.89Å; H136-A138 VanDerWaalsContact C-N 3.28Å; H136-A138 PolarHBondContact O-N 3.29Å; H136-N139 PolarHBondContact O-N 3.1Å; H136-L140 WeakPolarHBondContact O-CB 3.12Å; H136-L140 PolarHBondContact O-N 3.21Å
137L45.8Very low50.4Low95 Ų9589.1 Ų89.150%0.49750%0.496SS..Hα-helixtrans-68-21.6178.4-82164.9000114.2E133 P134 N139 L140E133-L137 PolarHBondContact O-N 2.95Å; P134-L137 PolarHBondContact O-N 3.14Å; L137-N139 PolarHBondContact O-N 3.29Å; L137-L140 HydrophobicContact CD2-CD2 4.05Å
138A50.8Low50.8Low85 Ų8586.2 Ų86.270%0.70248%0.477SS*.THydrogen-bonded Turntrans-66.6-22.4179.600000113.4H136H136-A138 VanDerWaalsContact C-N 3.28Å; H136-A138 PolarHBondContact O-N 3.29Å
139N47.9Very low50.8Low147 Ų14788.9 Ų88.979%0.78648%0.483SS*.SBendtrans-131.111.9-177.9-70.6-22.6000113H136 L137 T141H136-N139 PolarHBondContact O-N 3.1Å; L137-N139 PolarHBondContact O-N 3.29Å; N139-T141 PolarHBondContact O-N 3.38Å
140L45.9Very low50.9Low53 Ų5394.1 Ų94.128%0.27750%0.504SS..  trans-72.2113.1-174.9-155.985.1000109.8L132 H136 L137 D144 A145L132-L140 HydrophobicContact CD2-CD2 3.8Å; H136-L140 WeakPolarHBondContact O-CB 3.12Å; H136-L140 PolarHBondContact O-N 3.21Å; L137-L140 HydrophobicContact CD2-CD2 4.05Å; L140-D144 HydrophobicContact CD1-CB 4.11Å; L140-D144 HydrophobicContact CG-CB 4.25Å; L140-A145 HydrophobicContact CD2-CB 3.82Å; L140-A145 HydrophobicContact CG-CB 4.46Å
141T53.5Low50.7Low65 Ų6593.2 Ų93.240%0.39951%0.507SS..  trans-80.6163.1170.269.90000110.3N139 E143 D144 A145N139-T141 PolarHBondContact O-N 3.38Å; T141-E143 PolarHBondContact O-N 3.2Å; T141-D144 WeakPolarHBondContact CB-OD2 3.41Å; T141-D144 PolarHBondContact N-OD2 3.03Å; T141-D144 PolarHBondContact O-N 3.22Å; T141-D144 PolarHBondContact OG1-N 2.93Å; T141-D144 PolarHBondContact OG1-OD2 3.42Å; T141-A145 PolarHBondContact O-N 2.99Å; T141-A145 VanDerWaalsContact O-N 3.14Å
142L44.8Very low50.2Low159 Ų159100.4 Ų100.483%0.83254%0.536SS*.Hα-helixtrans-61.1-29.8177.8-143.188.7000111.9A146L142-A146 WeakPolarHBondContact O-CB 3.4Å; L142-A146 PolarHBondContact O-N 3.14Å; L142-A146 VanDerWaalsContact O-N 3.14Å
143E50Low50.1Low153 Ų153103.5 Ų103.572%0.71555%0.552SS**Hα-helixtrans-71.5-42.5177.4-74.2153.3167.800111.1T141 A145 A146 E147T141-E143 PolarHBondContact O-N 3.2Å; E143-A145 VanDerWaalsContact C-N 3.33Å; E143-A145 PolarHBondContact O-N 3.19Å; E143-A146 PolarHBondContact O-N 2.95Å; E143-E147 WeakPolarHBondContact O-CB 3.44Å; E143-E147 PolarHBondContact O-N 3.42Å
144D53.1Low49.9Very low79 Ų79104.2 Ų104.242%0.42256%0.559SS.*Hα-helixtrans-62.4-40.3175.7-58.8-46.6000112.1L140 T141 E147 C148L140-D144 HydrophobicContact CD1-CB 4.11Å; L140-D144 HydrophobicContact CG-CB 4.25Å; T141-D144 WeakPolarHBondContact CB-OD2 3.41Å; T141-D144 PolarHBondContact N-OD2 3.03Å; T141-D144 PolarHBondContact O-N 3.22Å; T141-D144 PolarHBondContact OG1-N 2.93Å; T141-D144 PolarHBondContact OG1-OD2 3.42Å; D144-E147 PolarHBondContact O-N 3.01Å; D144-C148 PolarHBondContact O-N 3.34Å
145A51.9Low50.2Low24 Ų24104.8 Ų104.820%0.19856%0.556CS.*Hα-helixtrans-65.5-43.717700000111.8L140 T141 E143 E147 C148 L149L140-A145 HydrophobicContact CD2-CB 3.82Å; L140-A145 HydrophobicContact CG-CB 4.46Å; T141-A145 PolarHBondContact O-N 2.99Å; T141-A145 VanDerWaalsContact O-N 3.14Å; E143-A145 VanDerWaalsContact C-N 3.33Å; E143-A145 PolarHBondContact O-N 3.19Å; A145-E147 VanDerWaalsContact C-N 3.3Å; A145-E147 PolarHBondContact O-N 3.43Å; A145-C148 PolarHBondContact O-N 3.1Å; A145-L149 WeakPolarHBondContact O-CG 3.49Å; A145-L149 PolarHBondContact O-N 3.14Å
146A50.8Low50.2Low48 Ų48105.2 Ų105.240%0.39755%0.552SS.*Hα-helixtrans-67.1-32178.300000112.4L142 E143 K150L142-A146 WeakPolarHBondContact O-CB 3.4Å; L142-A146 PolarHBondContact O-N 3.14Å; L142-A146 VanDerWaalsContact O-N 3.14Å; E143-A146 PolarHBondContact O-N 2.95Å; A146-K150 WeakPolarHBondContact O-CG 3.44Å; A146-K150 PolarHBondContact O-N 3.46Å
147E55.2Low50.3Low127 Ų127105.1 Ų105.159%0.59356%0.555SS**Hα-helixtrans-77-36.3178.5-164.4144.8-169.900112.5E143 D144 A145 L149 K150E143-E147 WeakPolarHBondContact O-CB 3.44Å; E143-E147 PolarHBondContact O-N 3.42Å; D144-E147 PolarHBondContact O-N 3.01Å; A145-E147 VanDerWaalsContact C-N 3.3Å; A145-E147 PolarHBondContact O-N 3.43Å; E147-L149 VanDerWaalsContact C-N 3.35Å; E147-L149 PolarHBondContact O-N 3.24Å; E147-K150 PolarHBondContact O-N 3.42Å
148C58.5Low50.6Low23 Ų23105.7 Ų105.716%0.15556%0.559CS.*Hα-helixtrans-63.3-42.3171.5-176.50000112.2C131 D144 A145 K150 Q151C131-C148 HydrophobicContact CB-CB 3.86Å; C131-C148 WeakPolarHBondContact CB-SG 3.09Å; C131-C148 WeakPolarHBondContact SG-CB 3.28Å; C131-C148 CovalentContact SG-SG 1.98Å; C131-C148 PolarHBondContact SG-SG 3.48Å; D144-C148 PolarHBondContact O-N 3.34Å; A145-C148 PolarHBondContact O-N 3.1Å; C148-K150 PolarHBondContact O-N 3.37Å; C148-K150 VanDerWaalsContact O-N 3.13Å; C148-Q151 PolarHBondContact O-N 3.28Å; C148-Q151 VanDerWaalsContact O-N 3.14Å
149L51.2Low50.6Low110 Ų110107.2 Ų107.258%0.57655%0.549SS*.THydrogen-bonded Turntrans-66.4-13179.3-70.3168.7000113.8A145 E147A145-L149 WeakPolarHBondContact O-CG 3.49Å; A145-L149 PolarHBondContact O-N 3.14Å; E147-L149 VanDerWaalsContact C-N 3.35Å; E147-L149 PolarHBondContact O-N 3.24Å
150K53.2Low50.8Low169 Ų169104.2 Ų104.274%0.73553%0.531SS*.THydrogen-bonded Turntrans-87.2-12.1175.2-77.5175.5-178174.90114.2A146 E147 C148 H152A146-K150 WeakPolarHBondContact O-CG 3.44Å; A146-K150 PolarHBondContact O-N 3.46Å; E147-K150 PolarHBondContact O-N 3.42Å; C148-K150 PolarHBondContact O-N 3.37Å; C148-K150 VanDerWaalsContact O-N 3.13Å; K150-H152 PolarHBondContact O-N 3.26Å
151Q50.4Low51.2Low151 Ų151108.4 Ų108.471%0.70655%0.552SS**  trans-82.62-177.9-65.4-172.81.900113.4C148C148-Q151 PolarHBondContact O-N 3.28Å; C148-Q151 VanDerWaalsContact O-N 3.14Å
152H41.3Very low50.9Low193 Ų193112.4 Ų112.489%0.89457%0.566SS**  trans-140.80175.1-68.3-43.7000110.5K150K150-H152 PolarHBondContact O-N 3.26Å

Retrieved 152 of 152 residues in 120.9 ms (Link to these results)