A0A087WQH1_MOUSE Loading...

LEM domain containing 1

AlphaFold DB , UniProt , Accession A0A087WQH1, Species MOUSE (Mus musculus, Mouse), Gene Lemd1, Length 203 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
1M64.8Low81.9Confident243 Ų24399.8 Ų99.8100%1.19751%0.51SS*.  0129.30-114.4153.766.200107.3D3M1-D3 PolarHBondContact O-N 3.23Å
2V69.1Low82.6Confident85 Ų8591.8 Ų91.852%0.51547%0.468SS..  trans-71.1122.4176176.80000107.6V4 L7V2-V4 PolarHBondContact O-N 3.41Å; V2-V4 VanDerWaalsContact O-N 3.14Å; V2-L7 HydrophobicContact CG1-CD1 3.91Å
3D81Confident83.3Confident95 Ų9589.5 Ų89.551%0.50845%0.454SS..  trans-75.6102.4175.5-175.74.2000109.3M1 K5 C6 L7M1-D3 PolarHBondContact O-N 3.23Å; D3-K5 PolarHBondContact O-N 3.22Å; D3-K5 PolarHBondContact OD1-N 3.34Å; D3-C6 HydrophobicContact CB-CB 4.45Å; D3-C6 PolarHBondContact O-N 2.87Å; D3-C6 PolarHBondContact OD2-SG 2.82Å; D3-L7 WeakPolarHBondContact O-CD1 2.89Å
4V78.4Confident83.7Confident18 Ų1892.3 Ų92.311%0.10946%0.462CS..THydrogen-bonded Turntrans-66.3-22.6-171.6-179.10000112.7V2 L7 E35 L38 V39V2-V4 PolarHBondContact O-N 3.41Å; V2-V4 VanDerWaalsContact O-N 3.14Å; V4-L7 VanDerWaalsContact CA-CD1 3.41Å; V4-L7 HydrophobicContact CB-CD1 4.46Å; V4-L7 WeakPolarHBondContact O-CD1 3.03Å; V4-E35 HydrophobicContact CG1-CB 3.59Å; V4-E35 HydrophobicContact CG1-CG 3.82Å; V4-L38 HydrophobicContact CG1-CB 4.47Å; V4-L38 HydrophobicContact CG1-CD2 4.19Å; V4-L38 HydrophobicContact CG2-CD2 4.43Å; V4-V39 HydrophobicContact CB-CG2 4.08Å; V4-V39 HydrophobicContact CG1-CG2 4.13Å; V4-V39 HydrophobicContact CG2-CG2 3.65Å
5K80.8Confident84.2Confident166 Ų16690.7 Ų90.772%0.72245%0.452SS*.THydrogen-bonded Turntrans-84-19.3-178.2-69.4178.9-180174.40114D3D3-K5 PolarHBondContact O-N 3.22Å; D3-K5 PolarHBondContact OD1-N 3.34Å
6C81.1Confident84.6Confident99 Ų9985 Ų8567%0.66942%0.424SS*.SBendtrans-96.30.5-178.5-68.60000113.2D3D3-C6 HydrophobicContact CB-CB 4.45Å; D3-C6 PolarHBondContact O-N 2.87Å; D3-C6 PolarHBondContact OD2-SG 2.82Å
7L84.4Confident84.8Confident24 Ų2486.4 Ų86.413%0.12643%0.43CS..SBendtrans-72.3142.2173.5-70.9106.7000110.6V2 D3 V4 E11V2-L7 HydrophobicContact CG1-CD1 3.91Å; D3-L7 WeakPolarHBondContact O-CD1 2.89Å; V4-L7 VanDerWaalsContact CA-CD1 3.41Å; V4-L7 HydrophobicContact CB-CD1 4.46Å; V4-L7 WeakPolarHBondContact O-CD1 3.03Å; L7-E11 HydrophobicContact CB-CB 4.23Å; L7-E11 HydrophobicContact CD2-CB 3.71Å; L7-E11 HydrophobicContact CG-CB 4.45Å
8S88.9Confident85.1Confident57 Ų5791.8 Ų91.840%0.39945%0.451SS..  trans-69.2158.4164.965.80000110.8Y10 E11 L12S8-Y10 PolarHBondContact O-N 2.77Å; S8-E11 PolarHBondContact N-OE2 2.76Å; S8-E11 PolarHBondContact O-N 3.34Å; S8-E11 VanDerWaalsContact OG-CG 3.27Å; S8-E11 WeakPolarHBondContact OG-CG 3.45Å; S8-E11 PolarHBondContact OG-N 3.17Å; S8-L12 PolarHBondContact O-N 2.94Å
9D91.3Very high85.2Confident52 Ų5290.7 Ų90.728%0.27845%0.447SS..Hα-helixtrans-55.5-40.5178.5-67.2-28.2000112.1E11 L12 H13 I26 R31D9-E11 PolarHBondContact O-N 2.8Å; D9-L12 PolarHBondContact O-N 2.79Å; D9-H13 WeakPolarHBondContact O-CB 3.05Å; D9-H13 PolarHBondContact O-N 3.39Å; D9-I26 HydrophobicContact CB-CB 4.3Å; D9-I26 HydrophobicContact CB-CD1 4.22Å; D9-I26 HydrophobicContact CB-CG2 3.94Å; D9-I26 WeakPolarHBondContact O-CD1 3.44Å; D9-I26 WeakPolarHBondContact OD1-CG2 3.31Å; D9-R31 IonicContact OD1-CZ 3.65Å; D9-R31 IonicContact OD1-NE 3.99Å; D9-R31 PolarHBondContact OD1-NE 3.02Å; D9-R31 IonicContact OD1-NH2 2.68Å; D9-R31 PolarHBondContact OD1-NH2 3.35Å; D9-R31 IonicContact OD2-CZ 3.85Å; D9-R31 IonicContact OD2-NE 2.68Å; D9-R31 IonicContact OD2-NH2 3.16Å; D9-R31 PolarHBondContact OD2-NH2 3.45Å
10Y88.9Confident85.2Confident170 Ų17089.7 Ų89.767%0.66746%0.46SS*.Hα-helixtrans-62.5-43.7177.1176.5-104.4000112.3S8 H13 K14S8-Y10 PolarHBondContact O-N 2.77Å; Y10-H13 WeakPolarHBondContact O-CB 3.2Å; Y10-H13 PolarHBondContact O-N 3.44Å; Y10-K14 WeakPolarHBondContact O-CB 3.28Å; Y10-K14 PolarHBondContact O-N 3.4Å
11E91.7Very high85.2Confident89 Ų8988.7 Ų88.742%0.41645%0.453SS..Hα-helixtrans-69.1-40.9178.3-68.4173.4165.200111.5L7 S8 D9 H13 K14 H15L7-E11 HydrophobicContact CB-CB 4.23Å; L7-E11 HydrophobicContact CD2-CB 3.71Å; L7-E11 HydrophobicContact CG-CB 4.45Å; S8-E11 PolarHBondContact N-OE2 2.76Å; S8-E11 PolarHBondContact O-N 3.34Å; S8-E11 VanDerWaalsContact OG-CG 3.27Å; S8-E11 WeakPolarHBondContact OG-CG 3.45Å; S8-E11 PolarHBondContact OG-N 3.17Å; D9-E11 PolarHBondContact O-N 2.8Å; E11-H13 VanDerWaalsContact C-N 3.31Å; E11-H13 PolarHBondContact O-N 2.83Å; E11-K14 PolarHBondContact O-N 3.47Å; E11-H15 PolarHBondContact O-N 3.41Å; E11-H15 PolarHBondContact O-ND1 3.03Å
12L91.1Very high86.2Confident3 Ų382.9 Ų82.92%0.01643%0.431CS..Hα-helixtrans-57.5-46174.5-179.460.1000110.8S8 D9 H15 L16 R31 E35 L38S8-L12 PolarHBondContact O-N 2.94Å; D9-L12 PolarHBondContact O-N 2.79Å; L12-H15 PolarHBondContact O-N 3.21Å; L12-L16 HydrophobicContact CD1-CD1 4.45Å; L12-L16 HydrophobicContact CG-CD1 4.37Å; L12-L16 WeakPolarHBondContact O-CG 3.28Å; L12-L16 PolarHBondContact O-N 2.82Å; L12-L16 VanDerWaalsContact O-N 3.08Å; L12-R31 HydrophobicContact CD2-CG 4.33Å; L12-E35 HydrophobicContact CD1-CG 4.42Å; L12-E35 HydrophobicContact CD2-CG 4.01Å; L12-L38 HydrophobicContact CD1-CB 4.11Å; L12-L38 HydrophobicContact CD1-CD2 3.75Å
13H90.8Very high87Confident62 Ų6279.5 Ų79.529%0.28741%0.411SS..Hα-helixtrans-58.1-49.5175-168.1-83.8000112D9 Y10 E11 H15 L16 M17 P23 I26D9-H13 WeakPolarHBondContact O-CB 3.05Å; D9-H13 PolarHBondContact O-N 3.39Å; Y10-H13 WeakPolarHBondContact O-CB 3.2Å; Y10-H13 PolarHBondContact O-N 3.44Å; E11-H13 VanDerWaalsContact C-N 3.31Å; E11-H13 PolarHBondContact O-N 2.83Å; H13-H15 VanDerWaalsContact C-N 3.34Å; H13-H15 PolarHBondContact O-N 2.9Å; H13-L16 PolarHBondContact O-N 3.27Å; H13-M17 PolarHBondContact CE1-SD 3.2Å; H13-M17 PolarHBondContact ND1-SD 3.04Å; H13-M17 VanDerWaalsContact ND1-SD 3.39Å; H13-M17 WeakPolarHBondContact O-CG 3.06Å; H13-M17 PolarHBondContact O-N 2.91Å; H13-P23 WeakPolarHBondContact CD2-CG 3.15Å; H13-I26 HydrophobicContact CB-CD1 3.72Å
14K90.1Very high87.4Confident129 Ų12976.6 Ų76.656%0.56140%0.403SS*.Hα-helixtrans-60.6-41.2-179.6-175.7179.5-179.6-179.50112.5Y10 E11 K18Y10-K14 WeakPolarHBondContact O-CB 3.28Å; Y10-K14 PolarHBondContact O-N 3.4Å; E11-K14 PolarHBondContact O-N 3.47Å; K14-K18 WeakPolarHBondContact O-CB 3.38Å; K14-K18 PolarHBondContact O-N 3.17Å
15H90.6Very high87.7Confident68 Ų6877.5 Ų77.532%0.31541%0.409SS..Hα-helixtrans-67-40.8177.7-75.288.2000111.8E11 L12 H13 K18 L19 L38E11-H15 PolarHBondContact O-N 3.41Å; E11-H15 PolarHBondContact O-ND1 3.03Å; L12-H15 PolarHBondContact O-N 3.21Å; H13-H15 VanDerWaalsContact C-N 3.34Å; H13-H15 PolarHBondContact O-N 2.9Å; H15-K18 PolarHBondContact O-N 3.5Å; H15-L19 VanDerWaalsContact O-CG 3.3Å; H15-L19 WeakPolarHBondContact O-CG 3.33Å; H15-L19 PolarHBondContact O-N 3.34Å; H15-L19 VanDerWaalsContact O-N 3.17Å; H15-L38 HydrophobicContact CB-CD1 3.75Å; H15-L38 HydrophobicContact CB-CD2 4.06Å
16L90.3Very high88.1Confident0 Ų070.8 Ų70.80%038%0.381CS..Hα-helixtrans-63.5-45175.5-72.3172.3000111.9L12 H13 K18 L19 G20 F21 P23 Y34 K37 L38 L41L12-L16 HydrophobicContact CD1-CD1 4.45Å; L12-L16 HydrophobicContact CG-CD1 4.37Å; L12-L16 WeakPolarHBondContact O-CG 3.28Å; L12-L16 PolarHBondContact O-N 2.82Å; L12-L16 VanDerWaalsContact O-N 3.08Å; H13-L16 PolarHBondContact O-N 3.27Å; L16-K18 VanDerWaalsContact C-N 3.32Å; L16-K18 PolarHBondContact O-N 3.08Å; L16-L19 CarbonylContact O-C 3.22Å; L16-L19 PolarHBondContact O-N 2.96Å; L16-L19 VanDerWaalsContact O-N 3.09Å; L16-G20 PolarHBondContact O-N 2.95Å; L16-F21 CarbonylContact C-O 3.55Å; L16-F21 HydrophobicContact CB-CB 4.29Å; L16-F21 HydrophobicContact CB-CD1 4.17Å; L16-F21 HydrophobicContact CD1-CD1 4.27Å; L16-F21 HydrophobicContact CD2-CB 4.47Å; L16-F21 HydrophobicContact CD2-CD1 4.21Å; L16-F21 HydrophobicContact CG-CD1 4.46Å; L16-F21 PolarHBondContact O-N 3.49Å; L16-F21 VanDerWaalsContact O-O 3.13Å; L16-P23 HydrophobicContact CB-CG 4.16Å; L16-P23 HydrophobicContact CD1-CB 4.08Å; L16-P23 HydrophobicContact CD1-CG 4.19Å; L16-Y34 HydrophobicContact CD1-CD1 3.83Å; L16-Y34 HydrophobicContact CD1-CG 4.05Å; L16-K37 HydrophobicContact CD2-CB 4.26Å; L16-L38 HydrophobicContact CD2-CB 4.13Å; L16-L41 HydrophobicContact CD2-CD1 4Å
17M89.3Confident88.5Confident108 Ų10869.7 Ų69.753%0.53237%0.368SS..Hα-helixtrans-60.2-41.6175.2-72.1-172.486.500112.2H13 L19 G20 F21H13-M17 PolarHBondContact CE1-SD 3.2Å; H13-M17 PolarHBondContact ND1-SD 3.04Å; H13-M17 VanDerWaalsContact ND1-SD 3.39Å; H13-M17 WeakPolarHBondContact O-CG 3.06Å; H13-M17 PolarHBondContact O-N 2.91Å; M17-L19 PolarHBondContact O-N 3.48Å; M17-G20 PolarHBondContact O-N 3.24Å; M17-F21 VanDerWaalsContact CA-O 3.26Å; M17-F21 WeakPolarHBondContact CA-O 3.2Å; M17-F21 PolarHBondContact N-O 3.47Å
18K89.8Confident88.5Confident185 Ų18573.8 Ų73.880%0.80440%0.396SS*.Hα-helixtrans-61.2-30.7176.6-174.7177.5177.9-176.70112.5K14 H15 L16 G20K14-K18 WeakPolarHBondContact O-CB 3.38Å; K14-K18 PolarHBondContact O-N 3.17Å; H15-K18 PolarHBondContact O-N 3.5Å; L16-K18 VanDerWaalsContact C-N 3.32Å; L16-K18 PolarHBondContact O-N 3.08Å; K18-G20 VanDerWaalsContact C-N 3.27Å
19L85.9Confident88.3Confident71 Ų7175.4 Ų75.437%0.37241%0.408SS..THydrogen-bonded Turntrans-86.94.2176.8-62.4167.7000112.7H15 L16 M17 L38 L41 L42H15-L19 VanDerWaalsContact O-CG 3.3Å; H15-L19 WeakPolarHBondContact O-CG 3.33Å; H15-L19 PolarHBondContact O-N 3.34Å; H15-L19 VanDerWaalsContact O-N 3.17Å; L16-L19 CarbonylContact O-C 3.22Å; L16-L19 PolarHBondContact O-N 2.96Å; L16-L19 VanDerWaalsContact O-N 3.09Å; M17-L19 PolarHBondContact O-N 3.48Å; L19-L38 HydrophobicContact CD1-CD1 3.49Å; L19-L38 VanDerWaalsContact CD1-CD1 3.49Å; L19-L41 HydrophobicContact CB-CB 4.42Å; L19-L41 HydrophobicContact CB-CD1 3.9Å; L19-L41 HydrophobicContact CD1-CB 3.68Å; L19-L41 HydrophobicContact CD1-CD1 4.06Å; L19-L42 HydrophobicContact CD1-CD2 4.23Å; L19-L42 HydrophobicContact CD1-CG 4.44Å
20G85.4Confident88.3Confident69 Ų6974.9 Ų74.971%0.71141%0.407SS*.THydrogen-bonded Turntrans82.712.5178.600000114.4L16 M17 K18L16-G20 PolarHBondContact O-N 2.95Å; M17-G20 PolarHBondContact O-N 3.24Å; K18-G20 VanDerWaalsContact C-N 3.27Å
21F84.9Confident88.4Confident70 Ų7071.2 Ų71.231%0.30739%0.392SS..  trans-94.8129172.6-171-97.2000109.5L16 M17 P23 Y34 L41L16-F21 CarbonylContact C-O 3.55Å; L16-F21 HydrophobicContact CB-CB 4.29Å; L16-F21 HydrophobicContact CB-CD1 4.17Å; L16-F21 HydrophobicContact CD1-CD1 4.27Å; L16-F21 HydrophobicContact CD2-CB 4.47Å; L16-F21 HydrophobicContact CD2-CD1 4.21Å; L16-F21 HydrophobicContact CG-CD1 4.46Å; L16-F21 PolarHBondContact O-N 3.49Å; L16-F21 VanDerWaalsContact O-O 3.13Å; M17-F21 VanDerWaalsContact CA-O 3.26Å; M17-F21 WeakPolarHBondContact CA-O 3.2Å; M17-F21 PolarHBondContact N-O 3.47Å; F21-P23 HydrophobicContact CD1-CB 4.04Å; F21-P23 HydrophobicContact CD1-CG 4.49Å; F21-P23 HydrophobicContact CE1-CB 3.91Å; F21-P23 WeakPolarHBondContact O-CD 3.32Å; F21-Y34 HydrophobicContact CE1-CD1 4.04Å; F21-Y34 AromaticContact CE1-CE1 3.81Å; F21-Y34 HydrophobicContact CE1-CE1 3.81Å; F21-Y34 HydrophobicContact CZ-CE1 4.46Å; F21-L41 HydrophobicContact CB-CD1 4.16Å
22T86.9Confident88.4Confident120 Ų12074.1 Ų74.174%0.73640%0.403SS*.  trans-98.389.5174.651.50000109
23P86.4Confident88.4Confident14 Ų1477.7 Ų77.79%0.09143%0.425CS..  trans-66.9148.1178.130.2-36.1000110.7H13 L16 F21 Y34H13-P23 WeakPolarHBondContact CD2-CG 3.15Å; L16-P23 HydrophobicContact CB-CG 4.16Å; L16-P23 HydrophobicContact CD1-CB 4.08Å; L16-P23 HydrophobicContact CD1-CG 4.19Å; F21-P23 HydrophobicContact CD1-CB 4.04Å; F21-P23 HydrophobicContact CD1-CG 4.49Å; F21-P23 HydrophobicContact CE1-CB 3.91Å; F21-P23 WeakPolarHBondContact O-CD 3.32Å; P23-Y34 HydrophobicContact CB-CD1 3.94Å; P23-Y34 HydrophobicContact CB-CE1 3.53Å
24G87.7Confident88.4Confident34 Ų3476.1 Ų76.135%0.35142%0.416SS..  trans-79.1-161.4165.600000111.1I26 Y34G24-I26 PolarHBondContact O-N 3.38Å; G24-Y34 WeakPolarHBondContact CA-OH 3.47Å; G24-Y34 PolarHBondContact N-OH 2.91Å; G24-Y34 PolarHBondContact O-OH 2.73Å
25P85.1Confident88.5Confident37 Ų3771.3 Ų71.324%0.2440%0.396CS..  trans-63.4136.2-175.630.6-34000110.4L27 T30 W167P25-L27 HydrophobicContact CB-CD1 3.62Å; P25-L27 HydrophobicContact CG-CD1 3.69Å; P25-L27 WeakPolarHBondContact O-CD1 3.15Å; P25-L27 PolarHBondContact O-N 3.28Å; P25-T30 PolarHBondContact O-OG1 2.83Å; P25-W167 HydrophobicContact CB-CH2 3.66Å; P25-W167 HydrophobicContact CB-CZ2 3.59Å; P25-W167 HydrophobicContact CG-CH2 3.67Å; P25-W167 HydrophobicContact CG-CZ2 3.61Å
26I88.8Confident88.4Confident25 Ų2575.4 Ų75.413%0.12841%0.413CS..  trans-88.794.4-179.2-58.9177.8000107.8D9 H13 G24 R31 Y34D9-I26 HydrophobicContact CB-CB 4.3Å; D9-I26 HydrophobicContact CB-CD1 4.22Å; D9-I26 HydrophobicContact CB-CG2 3.94Å; D9-I26 WeakPolarHBondContact O-CD1 3.44Å; D9-I26 WeakPolarHBondContact OD1-CG2 3.31Å; H13-I26 HydrophobicContact CB-CD1 3.72Å; G24-I26 PolarHBondContact O-N 3.38Å; I26-R31 HydrophobicContact CG2-CB 4.35Å; I26-Y34 HydrophobicContact CG1-CD2 4Å; I26-Y34 HydrophobicContact CG1-CE2 4Å; I26-Y34 HydrophobicContact CG2-CD2 4.41Å
27L89.8Confident88.3Confident76 Ų7677.9 Ų77.940%0.39842%0.424SS..  trans-91.4155.2173.4-7875.7000109.4P25 S29 T30 R31P25-L27 HydrophobicContact CB-CD1 3.62Å; P25-L27 HydrophobicContact CG-CD1 3.69Å; P25-L27 WeakPolarHBondContact O-CD1 3.15Å; P25-L27 PolarHBondContact O-N 3.28Å; L27-S29 PolarHBondContact O-N 2.92Å; L27-S29 VanDerWaalsContact O-N 3.09Å; L27-T30 PolarHBondContact N-OG1 2.86Å; L27-T30 CarbonylContact O-C 3.55Å; L27-T30 PolarHBondContact O-N 3.47Å; L27-T30 PolarHBondContact O-OG1 2.81Å; L27-R31 PolarHBondContact O-N 3.23Å
28P84.6Confident88.2Confident110 Ų11072.8 Ų72.871%0.71440%0.399SS*.Hα-helixtrans-54.2-32172.8-2634.1000113.3
29S85.1Confident88.1Confident91 Ų9167.5 Ų67.564%0.63638%0.382SS*.Hα-helixtrans-71.4-30.8175.855.50000113.4L27L27-S29 PolarHBondContact O-N 2.92Å; L27-S29 VanDerWaalsContact O-N 3.09Å
30T90.3Very high88.1Confident42 Ų4267 Ų6726%0.25838%0.377SS..Hα-helixtrans-101.1-14.7-178.360.60000113.5P25 L27 K32 T33 Y34P25-T30 PolarHBondContact O-OG1 2.83Å; L27-T30 PolarHBondContact N-OG1 2.86Å; L27-T30 CarbonylContact O-C 3.55Å; L27-T30 PolarHBondContact O-N 3.47Å; L27-T30 PolarHBondContact O-OG1 2.81Å; T30-K32 PolarHBondContact O-N 2.95Å; T30-T33 WeakPolarHBondContact O-CA 3.38Å; T30-T33 VanDerWaalsContact O-CB 3.23Å; T30-T33 WeakPolarHBondContact O-CB 3.21Å; T30-T33 PolarHBondContact O-N 3.24Å; T30-Y34 WeakPolarHBondContact O-CD2 3.23Å; T30-Y34 PolarHBondContact O-N 3.3Å; T30-Y34 VanDerWaalsContact O-N 3.15Å
31R92.3Very high87.8Confident93 Ų9365.3 Ų65.335%0.35135%0.352SS..Hα-helixtrans-49.5-50.9179.7-176.1-175.9-73.6169.4-1.9112.5D9 L12 I26 L27 T33 Y34 E35D9-R31 IonicContact OD1-CZ 3.65Å; D9-R31 IonicContact OD1-NE 3.99Å; D9-R31 PolarHBondContact OD1-NE 3.02Å; D9-R31 IonicContact OD1-NH2 2.68Å; D9-R31 PolarHBondContact OD1-NH2 3.35Å; D9-R31 IonicContact OD2-CZ 3.85Å; D9-R31 IonicContact OD2-NE 2.68Å; D9-R31 IonicContact OD2-NH2 3.16Å; D9-R31 PolarHBondContact OD2-NH2 3.45Å; L12-R31 HydrophobicContact CD2-CG 4.33Å; I26-R31 HydrophobicContact CG2-CB 4.35Å; L27-R31 PolarHBondContact O-N 3.23Å; R31-T33 PolarHBondContact O-N 3.42Å; R31-Y34 PolarHBondContact O-N 2.8Å; R31-Y34 VanDerWaalsContact O-N 3.11Å; R31-E35 WeakPolarHBondContact CG-OE1 3.44Å; R31-E35 WeakPolarHBondContact O-CG 3.25Å; R31-E35 PolarHBondContact O-N 3.3Å
32K91.4Very high87.6Confident149 Ų14966.9 Ų66.965%0.64836%0.363SS*.Hα-helixtrans-60.9-29.5178.2-69.2-176.4179.8176.50113.3T30 K36T30-K32 PolarHBondContact O-N 2.95Å; K32-K36 VanDerWaalsContact O-CG 3.27Å; K32-K36 WeakPolarHBondContact O-CG 3.31Å; K32-K36 PolarHBondContact O-N 3.31Å
33T90.3Very high87.2Confident78 Ų7865.2 Ų65.248%0.47936%0.361SS..Hα-helixtrans-70.5-45176.8-57.30000110.2T30 R31 K36 K37T30-T33 WeakPolarHBondContact O-CA 3.38Å; T30-T33 VanDerWaalsContact O-CB 3.23Å; T30-T33 WeakPolarHBondContact O-CB 3.21Å; T30-T33 PolarHBondContact O-N 3.24Å; R31-T33 PolarHBondContact O-N 3.42Å; T33-K36 PolarHBondContact O-N 2.95Å; T33-K37 VanDerWaalsContact O-CG 3.3Å; T33-K37 WeakPolarHBondContact O-CG 3.33Å; T33-K37 PolarHBondContact O-N 3.48Å
34Y92Very high86.1Confident29 Ų2966.9 Ų66.911%0.11437%0.373CS..Hα-helixtrans-66-38.8177.3-70-49.5000112.9L16 F21 P23 G24 I26 T30 R31 K37 L38L16-Y34 HydrophobicContact CD1-CD1 3.83Å; L16-Y34 HydrophobicContact CD1-CG 4.05Å; F21-Y34 HydrophobicContact CE1-CD1 4.04Å; F21-Y34 AromaticContact CE1-CE1 3.81Å; F21-Y34 HydrophobicContact CE1-CE1 3.81Å; F21-Y34 HydrophobicContact CZ-CE1 4.46Å; P23-Y34 HydrophobicContact CB-CD1 3.94Å; P23-Y34 HydrophobicContact CB-CE1 3.53Å; G24-Y34 WeakPolarHBondContact CA-OH 3.47Å; G24-Y34 PolarHBondContact N-OH 2.91Å; G24-Y34 PolarHBondContact O-OH 2.73Å; I26-Y34 HydrophobicContact CG1-CD2 4Å; I26-Y34 HydrophobicContact CG1-CE2 4Å; I26-Y34 HydrophobicContact CG2-CD2 4.41Å; T30-Y34 WeakPolarHBondContact O-CD2 3.23Å; T30-Y34 PolarHBondContact O-N 3.3Å; T30-Y34 VanDerWaalsContact O-N 3.15Å; R31-Y34 PolarHBondContact O-N 2.8Å; R31-Y34 VanDerWaalsContact O-N 3.11Å; Y34-K37 WeakPolarHBondContact O-CB 3.27Å; Y34-K37 PolarHBondContact O-N 3.03Å; Y34-L38 PolarHBondContact O-N 2.91Å
35E91Very high84.8Confident28 Ų2870.9 Ų70.913%0.13139%0.393CS..Hα-helixtrans-57.6-48.9171.7-73.3175.4-156.100112V4 L12 R31 K37 L38 V39V4-E35 HydrophobicContact CG1-CB 3.59Å; V4-E35 HydrophobicContact CG1-CG 3.82Å; L12-E35 HydrophobicContact CD1-CG 4.42Å; L12-E35 HydrophobicContact CD2-CG 4.01Å; R31-E35 WeakPolarHBondContact CG-OE1 3.44Å; R31-E35 WeakPolarHBondContact O-CG 3.25Å; R31-E35 PolarHBondContact O-N 3.3Å; E35-K37 VanDerWaalsContact C-N 3.28Å; E35-K37 PolarHBondContact O-N 2.91Å; E35-L38 WeakPolarHBondContact O-CB 3.33Å; E35-L38 PolarHBondContact O-N 3.09Å; E35-L38 VanDerWaalsContact O-N 3.14Å; E35-V39 WeakPolarHBondContact O-CG2 3.49Å; E35-V39 PolarHBondContact O-N 3.24Å
36K89.8Confident83.2Confident154 Ų15474.5 Ų74.567%0.6742%0.417SS*.Hα-helixtrans-61.1-38.7176.1-71.9173.5-178.3-175.50111.7K32 T33 V39 Q40K32-K36 VanDerWaalsContact O-CG 3.27Å; K32-K36 WeakPolarHBondContact O-CG 3.31Å; K32-K36 PolarHBondContact O-N 3.31Å; T33-K36 PolarHBondContact O-N 2.95Å; K36-V39 PolarHBondContact O-N 3.34Å; K36-Q40 VanDerWaalsContact O-CB 3.24Å; K36-Q40 WeakPolarHBondContact O-CB 3.02Å; K36-Q40 PolarHBondContact O-N 2.95Å
37K87.2Confident81Confident52 Ų5279.2 Ų79.223%0.22643%0.433CS..Hα-helixtrans-64.6-38.9175.1-70.4-66.6179.6-171.50111.9L16 T33 Y34 E35 Q40 L41L16-K37 HydrophobicContact CD2-CB 4.26Å; T33-K37 VanDerWaalsContact O-CG 3.3Å; T33-K37 WeakPolarHBondContact O-CG 3.33Å; T33-K37 PolarHBondContact O-N 3.48Å; Y34-K37 WeakPolarHBondContact O-CB 3.27Å; Y34-K37 PolarHBondContact O-N 3.03Å; E35-K37 VanDerWaalsContact C-N 3.28Å; E35-K37 PolarHBondContact O-N 2.91Å; K37-Q40 WeakPolarHBondContact O-CB 3.5Å; K37-Q40 PolarHBondContact O-N 2.96Å; K37-L41 WeakPolarHBondContact O-CB 3.43Å; K37-L41 VanDerWaalsContact O-CG 3.26Å; K37-L41 WeakPolarHBondContact O-CG 3.21Å; K37-L41 PolarHBondContact O-N 2.89Å
38L88.3Confident79.1Confident1 Ų184.4 Ų84.41%0.00545%0.452CS..Hα-helixtrans-63.9-48.8175.3-179.859.4000111.2V4 L12 H15 L16 L19 Y34 E35 Q40 L41 L42V4-L38 HydrophobicContact CG1-CB 4.47Å; V4-L38 HydrophobicContact CG1-CD2 4.19Å; V4-L38 HydrophobicContact CG2-CD2 4.43Å; L12-L38 HydrophobicContact CD1-CB 4.11Å; L12-L38 HydrophobicContact CD1-CD2 3.75Å; H15-L38 HydrophobicContact CB-CD1 3.75Å; H15-L38 HydrophobicContact CB-CD2 4.06Å; L16-L38 HydrophobicContact CD2-CB 4.13Å; L19-L38 HydrophobicContact CD1-CD1 3.49Å; L19-L38 VanDerWaalsContact CD1-CD1 3.49Å; Y34-L38 PolarHBondContact O-N 2.91Å; E35-L38 WeakPolarHBondContact O-CB 3.33Å; E35-L38 PolarHBondContact O-N 3.09Å; E35-L38 VanDerWaalsContact O-N 3.14Å; L38-Q40 VanDerWaalsContact C-N 3.25Å; L38-Q40 PolarHBondContact O-N 3.27Å; L38-L41 PolarHBondContact O-N 2.86Å; L38-L42 HydrophobicContact CD1-CD1 4.03Å; L38-L42 HydrophobicContact CD1-CG 4.15Å; L38-L42 HydrophobicContact CG-CD1 4.02Å; L38-L42 WeakPolarHBondContact O-CB 3.28Å; L38-L42 VanDerWaalsContact O-CG 3.27Å; L38-L42 WeakPolarHBondContact O-CG 3.3Å; L38-L42 PolarHBondContact O-N 2.86Å
39V87.3Confident77.4Confident74 Ų7483.8 Ų83.845%0.44845%0.448SS..Hα-helixtrans-57-43.3174.8176.80000110.5V4 E35 K36 L42 A43V4-V39 HydrophobicContact CB-CG2 4.08Å; V4-V39 HydrophobicContact CG1-CG2 4.13Å; V4-V39 HydrophobicContact CG2-CG2 3.65Å; E35-V39 WeakPolarHBondContact O-CG2 3.49Å; E35-V39 PolarHBondContact O-N 3.24Å; K36-V39 PolarHBondContact O-N 3.34Å; V39-L42 PolarHBondContact O-N 2.99Å; V39-A43 WeakPolarHBondContact O-CB 3.43Å; V39-A43 PolarHBondContact O-N 3.35Å
40Q85.1Confident75.5Confident61 Ų6183.7 Ų83.729%0.28545%0.446SS..Hα-helixtrans-63.1-42.7-179.9-174.8179.38.300112.9K36 K37 L38 A43 S44K36-Q40 VanDerWaalsContact O-CB 3.24Å; K36-Q40 WeakPolarHBondContact O-CB 3.02Å; K36-Q40 PolarHBondContact O-N 2.95Å; K37-Q40 WeakPolarHBondContact O-CB 3.5Å; K37-Q40 PolarHBondContact O-N 2.96Å; L38-Q40 VanDerWaalsContact C-N 3.25Å; L38-Q40 PolarHBondContact O-N 3.27Å; Q40-A43 PolarHBondContact O-N 3.45Å; Q40-S44 PolarHBondContact O-N 3.03Å; Q40-S44 PolarHBondContact O-OG 3.36Å
41L79.8Confident73.2Confident33 Ų3387.8 Ų87.817%0.17347%0.47CS..Hα-helixtrans-72.8-29.5178.9-69.6170000112.6L16 L19 F21 K37 L38 S44L16-L41 HydrophobicContact CD2-CD1 4Å; L19-L41 HydrophobicContact CB-CB 4.42Å; L19-L41 HydrophobicContact CB-CD1 3.9Å; L19-L41 HydrophobicContact CD1-CB 3.68Å; L19-L41 HydrophobicContact CD1-CD1 4.06Å; F21-L41 HydrophobicContact CB-CD1 4.16Å; K37-L41 WeakPolarHBondContact O-CB 3.43Å; K37-L41 VanDerWaalsContact O-CG 3.26Å; K37-L41 WeakPolarHBondContact O-CG 3.21Å; K37-L41 PolarHBondContact O-N 2.89Å; L38-L41 PolarHBondContact O-N 2.86Å; L41-S44 VanDerWaalsContact O-O 3.09Å
42L80.7Confident70.8Confident104 Ų10492 Ų9255%0.54550%0.496SS..Hα-helixtrans-76.2-32.2173.4-67.3174.8000112L19 L38 V39L19-L42 HydrophobicContact CD1-CD2 4.23Å; L19-L42 HydrophobicContact CD1-CG 4.44Å; L38-L42 HydrophobicContact CD1-CD1 4.03Å; L38-L42 HydrophobicContact CD1-CG 4.15Å; L38-L42 HydrophobicContact CG-CD1 4.02Å; L38-L42 WeakPolarHBondContact O-CB 3.28Å; L38-L42 VanDerWaalsContact O-CG 3.27Å; L38-L42 WeakPolarHBondContact O-CG 3.3Å; L38-L42 PolarHBondContact O-N 2.86Å; V39-L42 PolarHBondContact O-N 2.99Å
43A78.6Confident68.5Low84 Ų8494.4 Ų94.469%0.69451%0.506SS*.Hα-helixtrans-86.5-21.8-179.900000113.8V39 Q40V39-A43 WeakPolarHBondContact O-CB 3.43Å; V39-A43 PolarHBondContact O-N 3.35Å; Q40-A43 PolarHBondContact O-N 3.45Å
44S63.5Low66.4Low50 Ų50101.6 Ų101.635%0.3553%0.525SS..SBendtrans-143.1143.2-177.566.70000113.6Q40 L41Q40-S44 PolarHBondContact O-N 3.03Å; Q40-S44 PolarHBondContact O-OG 3.36Å; L41-S44 VanDerWaalsContact O-O 3.09Å
45P59.8Low64.1Low117 Ų117105.4 Ų105.476%0.7655%0.553SS**SBendtrans-60.1167.1174.7-20.431.6000114.2
46P50.9Low61.9Low114 Ų114110.5 Ų110.574%0.7459%0.586SS**  trans-59.4132.5-150.723.5-33.1000114.6K48P46-K48 PolarHBondContact O-N 3.38Å; P46-K48 VanDerWaalsContact O-N 3.08Å
47W44.1Very low59.4Low124 Ų124114 Ų11447%0.4760%0.595SS.*  trans-59.5103.5-179.8179.7-101.3000111.8P50W47-P50 HydrophobicContact CH2-CG 3.53Å; W47-P50 HydrophobicContact CZ2-CG 3.38Å; W47-P50 HydrophobicContact CZ3-CG 4.44Å
48K48.5Very low57.5Low184 Ų184117.2 Ų117.280%0.862%0.621SS**  trans-69.8127.6152.1-69178.6-177.5177.80106.6P46P46-K48 PolarHBondContact O-N 3.38Å; P46-K48 VanDerWaalsContact O-N 3.08Å
49P49.3Very low55.1Low97 Ų97126.7 Ų126.763%0.6367%0.665SS**  trans-54.2140.5176.921.1-30000109.2V51P49-V51 PolarHBondContact O-N 3.03Å
50P44.7Very low52.5Low90 Ų90126.2 Ų126.258%0.58468%0.676SS**  trans-61.3109.1179.3-14.728.6000107.2W47 M52W47-P50 HydrophobicContact CH2-CG 3.53Å; W47-P50 HydrophobicContact CZ2-CG 3.38Å; W47-P50 HydrophobicContact CZ3-CG 4.44Å; P50-M52 VanDerWaalsContact C-N 3.34Å; P50-M52 PolarHBondContact O-N 3.23Å
51V41.8Very low50.3Low128 Ų128129 Ų12978%0.77670%0.701SS**  trans-57.2108.9158.3174.90000104P49 K53P49-V51 PolarHBondContact O-N 3.03Å; V51-K53 VanDerWaalsContact C-N 3.33Å; V51-K53 PolarHBondContact O-N 3.42Å
52M42.3Very low48.9Very low180 Ų180135.7 Ų135.789%0.88773%0.732SS**  trans-48107166.1-93.4178.5149.400105.9P50 R54P50-M52 VanDerWaalsContact C-N 3.34Å; P50-M52 PolarHBondContact O-N 3.23Å; M52-R54 VanDerWaalsContact C-N 3.27Å; M52-R54 PolarHBondContact O-N 3.25Å
53K44Very low46.7Very low200 Ų200137.8 Ų137.887%0.8774%0.744SS**  trans-63.7102168.8-68.7-172-179.1-1750104.9V51V51-K53 VanDerWaalsContact C-N 3.33Å; V51-K53 PolarHBondContact O-N 3.42Å
54R45.2Very low45.1Very low230 Ų230138.9 Ų138.987%0.86875%0.746SS**  trans-49.9127.7172.2-155.8179.2-165.1174.22.9106.9M52 T56M52-R54 VanDerWaalsContact C-N 3.27Å; M52-R54 PolarHBondContact O-N 3.25Å; R54-T56 PolarHBondContact O-N 3.11Å; R54-T56 VanDerWaalsContact O-N 3.08Å
55P44.2Very low44.4Very low109 Ų109144 Ų14471%0.70877%0.77SS**  trans-58.1118.8175.7-2332.5000109.5R57P55-R57 PolarHBondContact O-N 3.15Å
56T44.4Very low43.8Very low134 Ų134145.6 Ų145.682%0.82277%0.772SS**  trans-43.7122.2162.5-59.70000109.4R54R54-T56 PolarHBondContact O-N 3.11Å; R54-T56 VanDerWaalsContact O-N 3.08Å
57R37.9Very low44.1Very low228 Ų228145.3 Ų145.386%0.8677%0.773SS**  trans-124.9120.4160.1-70.7-169.4-177.9179.31108P55P55-R57 PolarHBondContact O-N 3.15Å
58P46.9Very low44.3Very low119 Ų119147.3 Ų147.377%0.77379%0.787SS**  trans-76.3150.317427.9-27.2000111.6
59H38.2Very low44.4Very low200 Ų200145.2 Ų145.293%0.92679%0.785SS**  trans-14.3140.2170.9-111.1-63.3000119.6
60G32.5Very low44.8Very low65 Ų65144.5 Ų144.567%0.6778%0.78SS**  trans-175102158.300000113.5
61S38.9Very low45.2Very low118 Ų118143.1 Ų143.183%0.82578%0.776SS**  trans46.1135.3148.156.60000123.3
62E50.1Low45.6Very low174 Ų174143.6 Ų143.681%0.81377%0.773SS**  trans-53.7149.2165.9-66.2154.7125.900113.6
63D34.9Very low45.9Very low149 Ų149142.7 Ų142.780%0.79776%0.764SS**  168.7119.4122.8-86.4-16.9000113.2
64S44.2Very low46.6Very low106 Ų106138.7 Ų138.774%0.74175%0.751SS**  trans50.1131.7140.244.90000125.1
65D49.1Very low47Very low159 Ų159134.5 Ų134.585%0.8575%0.745SS**  trans46.8121.5141.4-81.3-32000121.8
66D48.4Very low47.6Very low150 Ų150137.2 Ų137.280%0.80275%0.752SS**  168.9144.495.5-153.8-4.6000111.8
67S56.8Low47.9Very low108 Ų108139.4 Ų139.476%0.75575%0.75SS**  trans69.191.4169.373.30000119.9
68E47.5Very low48Very low165 Ų165130.8 Ų130.877%0.77173%0.732SS**  trans-81122.8159.4-60-9614500109.2P70E68-P70 WeakPolarHBondContact O-CD 3.47Å
69D52Low48.3Very low140 Ų140132.6 Ų132.675%0.74974%0.735SS**  trans-84.599.3158.2-90.2-42000108.7A71D69-A71 PolarHBondContact O-N 3.2Å
70P56Low49.1Very low83 Ų83130.2 Ų130.254%0.53973%0.728SS.*THydrogen-bonded Turntrans-69.6-16.5-178.727.5-35.8000112.9E68 I72 K73 I74E68-P70 WeakPolarHBondContact O-CD 3.47Å; P70-I72 PolarHBondContact O-N 2.9Å; P70-K73 PolarHBondContact O-N 2.98Å; P70-I74 WeakPolarHBondContact O-CG1 3.3Å; P70-I74 PolarHBondContact O-N 2.8Å
71A53.2Low50.1Low61 Ų61136.6 Ų136.650%0.50474%0.738SS.*Hα-helixtrans-63.9-35.5-167.400000114.8D69 K73D69-A71 PolarHBondContact O-N 3.2Å; A71-K73 VanDerWaalsContact C-N 3.34Å
72I51.8Low50.6Low137 Ų137140.6 Ų140.670%0.70374%0.74SS**Hα-helixtrans-77.1-26.9-178.5-56.7175.9000110.9P70P70-I72 PolarHBondContact O-N 2.9Å
73K47.8Very low50.6Low161 Ų161137.8 Ų137.870%0.774%0.74SS**Hα-helixtrans-82.8-21.6-175.8-153.2174.6-175.8-177.10113.1P70 A71P70-K73 PolarHBondContact O-N 2.98Å; A71-K73 VanDerWaalsContact C-N 3.34Å
74I58.2Low51.2Low116 Ų116139.2 Ų139.260%0.59574%0.739SS**Hα-helixtrans-79.7-26.8179-9.5177.4000112.8P70 L76 K77P70-I74 WeakPolarHBondContact O-CG1 3.3Å; P70-I74 PolarHBondContact O-N 2.8Å; I74-L76 VanDerWaalsContact C-N 3.3Å; I74-L76 PolarHBondContact O-N 3.28Å; I74-K77 PolarHBondContact O-N 3.43Å
75I54.2Low51.1Low143 Ų143141.4 Ų141.473%0.73374%0.742SS**Hα-helixtrans-69-30178.7-62174.5000111.4
76L56.5Low51.1Low166 Ų166142.3 Ų142.387%0.86974%0.739SS**THydrogen-bonded Turntrans-85.7-11.3179.9-12099.2000114.3I74I74-L76 VanDerWaalsContact C-N 3.3Å; I74-L76 PolarHBondContact O-N 3.28Å
77K51.5Low50.7Low179 Ų179138.5 Ų138.578%0.77874%0.735SS**THydrogen-bonded Turntrans-115.432.1-175.6-157.3174.5176.6-177.30111.8I74I74-K77 PolarHBondContact O-N 3.43Å
78G39.5Very low50.5Low47 Ų47142.9 Ų142.949%0.48574%0.74SS.*  trans-109.2109.5174.100000110.5I80G78-I80 WeakPolarHBondContact O-CG1 3.23Å; G78-I80 PolarHBondContact O-N 2.8Å
79N53.5Low50.2Low157 Ų157142.8 Ų142.884%0.8474%0.739SS**  trans-64.296.1178.9-33.1-13.2000108.1K81N79-K81 PolarHBondContact O-N 3.49Å
80I54.3Low49.6Very low150 Ų150139.8 Ų139.877%0.76974%0.742SS**  trans-68.2104.2-178.6-40.9175.4000108.1G78 F82G78-I80 WeakPolarHBondContact O-CG1 3.23Å; G78-I80 PolarHBondContact O-N 2.8Å; I80-F82 PolarHBondContact O-N 2.95Å
81K53.6Low49.4Very low200 Ų200144 Ų14487%0.8775%0.752SS**  trans-71.4106.1165.9-95.5-174.4173.8-174.60108.1N79 S83N79-K81 PolarHBondContact O-N 3.49Å; K81-S83 PolarHBondContact O-N 3.34Å
82F50.5Low48.9Very low202 Ų202151.1 Ų151.189%0.88677%0.771SS**  trans-60.4105.4163.2-95.6-91.2000109.2I80 K84I80-F82 PolarHBondContact O-N 2.95Å; F82-K84 PolarHBondContact O-N 3.08Å
83S48.7Very low48.1Very low115 Ų115155.8 Ų155.880%0.80478%0.78SS**  trans-76.3107.3171.7610000109.8K81 N85K81-S83 PolarHBondContact O-N 3.34Å; S83-N85 PolarHBondContact O-N 2.79Å
84K48.3Very low47.8Very low179 Ų179155 Ų15578%0.77878%0.783SS**  trans-66.699.9170.2179.8175.8179.4174.10110.1F82 K86F82-K84 PolarHBondContact O-N 3.08Å; K84-K86 HydrophobicContact CG-CG 4.23Å; K84-K86 PolarHBondContact O-N 2.92Å
85N42.6Very low46.6Very low151 Ų151157.7 Ų157.781%0.80779%0.793SS**  trans-74.5107.3163.7163.2-14.9000108.5S83S83-N85 PolarHBondContact O-N 2.79Å
86K48.2Very low45.5Very low179 Ų179155.1 Ų155.178%0.77879%0.792SS**  trans-122.9108.7158.7-80-87.5-177.81790105.8K84K84-K86 HydrophobicContact CG-CG 4.23Å; K84-K86 PolarHBondContact O-N 2.92Å
87G40Very low45Very low69 Ų69152.4 Ų152.471%0.71179%0.787SS**  trans-133109.3168.300000109.6
88K53.4Low44.4Very low201 Ų201150.7 Ų150.787%0.87479%0.792SS**  trans-88.3147.4170-72.3-175.9175.3-177.90109.5
89E39.9Very low44.5Very low162 Ų162153.2 Ų153.276%0.75780%0.795SS**  trans80.8126.7140.6-158.9167.8-17300120K91E89-K91 IonicContact OE1-NZ 2.99Å
90G40.7Very low44.2Very low77 Ų77155.8 Ų155.879%0.79480%0.798SS**  trans-179.393.3168.400000112
91K50.7Low43.8Very low172 Ų172158 Ų15875%0.74880%0.797SS**  trans-63.4150-179.6-63.9166.7176.7165.50113.6E89E89-K91 IonicContact OE1-NZ 2.99Å
92K42Very low43.6Very low211 Ų211158.9 Ų158.992%0.91780%0.795SS**  trans167.3100.2140.1-88.3161-161.9-169.90108.8
93R34.9Very low43.3Very low235 Ų235156.8 Ų156.889%0.88779%0.791SS**  79.1103.191.8-167.1175.9-178.5179.8-0.2114.8
94L41.9Very low43.3Very low144 Ų144157.8 Ų157.875%0.75479%0.787SS**  trans31.5123.7138.2-94.597.4000120.1
95E33.2Very low43Very low173 Ų173155.2 Ų155.281%0.80878%0.782SS**  171.1161.491.5-95.3-111.415400113.9
96A30.6Very low43.3Very low88 Ų88155.3 Ų155.373%0.72778%0.781SS**  trans73.8102.5170.600000118.4
97S45.9Very low42.9Very low109 Ų109157.1 Ų157.176%0.76278%0.784SS**  83.99160.4174.70000114.3
98T38.9Very low43.4Very low143 Ų143160.2 Ų160.288%0.87778%0.784SS**  trans-133.997.2139.655.70000109.3
99N42.2Very low43.1Very low101 Ų101155.6 Ų155.654%0.5478%0.776SS.*  trans-56.1118.6178.7169.7-44.2000112.5R101N99-R101 WeakPolarHBondContact OD1-CA 3.42Å; N99-R101 WeakPolarHBondContact OD1-CB 3.27Å; N99-R101 PolarHBondContact OD1-N 3.32Å
100K47Very low43.2Very low210 Ų210157.2 Ų157.291%0.91378%0.784SS**  trans-103.252.3155.6-72.4-174.5179.5179.20109.7
101R45.6Very low43.3Very low198 Ų198163.1 Ų163.175%0.74779%0.788SS**  trans-96.660.8167.3-64.9-177.7174.4161-2.2110.1N99N99-R101 WeakPolarHBondContact OD1-CA 3.42Å; N99-R101 WeakPolarHBondContact OD1-CB 3.27Å; N99-R101 PolarHBondContact OD1-N 3.32Å
102R50.4Low43.2Very low218 Ų218160.4 Ų160.482%0.82379%0.788SS**  trans-114.1-6.5171.3-84-171.7179.21690.5114.7
103I43.4Very low43.1Very low158 Ų158156.5 Ų156.581%0.8178%0.782SS**SBendtrans-97.7-21.1-173.3-60.7179000112.5
104L48.4Very low43.5Very low136 Ų136154.6 Ų154.671%0.71278%0.78SS**SBendtrans-96.4-9.7-174.6-152.774.4000115
105D42.5Very low43.8Very low125 Ų125156.5 Ų156.567%0.66878%0.782SS**SBendtrans-91.8-11-178-89.1-20.1000114.2
106I48.3Very low44.2Very low153 Ų153153.5 Ų153.579%0.78578%0.776SS**SBendtrans-82-24178.6-61177.6000111.5
107Y41.3Very low45.4Very low217 Ų217159.5 Ų159.585%0.85178%0.779SS**SBendtrans-94.1-13.6-174.7-159-102.4000114.7
108L49.9Very low45.1Very low134 Ų134164.5 Ų164.570%0.70278%0.783SS**SBendtrans-100.3-0.9-174.2-94.9106.4000116.1
109S47.9Very low45.5Very low103 Ų103163 Ų16372%0.7279%0.786SS**  trans-114.425.8-170-87.80000117.1
110Q40.9Very low45.5Very low196 Ų196163 Ų16392%0.91680%0.8SS**  trans-118.798.3165-74.4-171.623.200112.2
111K43.6Very low45.7Very low202 Ų202164.8 Ų164.888%0.87880%0.8SS**  trans-128.3166.3154.9-73.9-173.6179.4179.90107.1
112P48Very low45.5Very low115 Ų115161.4 Ų161.475%0.74780%0.804SS**  cis-133.5149.8-45.335.6-20.8000110.9
113T41.1Very low45.5Very low129 Ų129155.5 Ų155.579%0.79180%0.796SS**  trans-146.9121164.142.80000114.6
114K43.4Very low45.6Very low194 Ų194153.7 Ų153.784%0.84380%0.795SS**  trans81.290145.9-61174.3-174.7-178.90119
115K46.5Very low45.9Very low184 Ų184158.6 Ų158.680%0.880%0.804SS**  trans11.9108.5133.9-165.8-173-171.8-175.60117.1
116V43Very low46Very low111 Ų111159.5 Ų159.567%0.67381%0.807SS**  trans-141.1126.5142.3-175.50000108.1Y118V116-Y118 HydrophobicContact CG1-CD2 3.82Å; V116-Y118 HydrophobicContact CG1-CE2 3.28Å
117R54.4Low45.8Very low213 Ų213162 Ų16280%0.80481%0.812SS**  trans-82.9126.4177.3-67177.8177.2169.6-2.2108.8
118Y39.8Very low45.4Very low214 Ų214162.6 Ų162.684%0.83981%0.813SS**  trans-142.2127.7152-68-71.7000109.2V116V116-Y118 HydrophobicContact CG1-CD2 3.82Å; V116-Y118 HydrophobicContact CG1-CE2 3.28Å
119A46.9Very low44.5Very low113 Ų113167.1 Ų167.193%0.93482%0.821SS**  trans-74.5134.5174.200000109.8
120A43.3Very low44.1Very low101 Ų101168.1 Ų168.184%0.83583%0.827SS**  trans-133.4130.5172.400000110.5
121R50.3Low43.9Very low246 Ų246164.3 Ų164.393%0.92882%0.816SS**  trans-66.4158.3-170.7-61.4178.5176.4-175.2-1.7113.7
122P42.4Very low43.6Very low127 Ų127159.1 Ų159.183%0.82581%0.805SS**  trans-90.6134.8171.433.9-28.3000112.3
123S49.2Very low43.2Very low94 Ų94161.8 Ų161.866%0.65781%0.808SS**  trans147.8122.3140.3165.60000113.3
124P46.1Very low43.2Very low120 Ų120163.3 Ų163.378%0.77981%0.806SS**  trans-111.5117.8139.612.27.5000110.2I126P124-I126 PolarHBondContact O-N 3.43Å
125R54.5Low42.7Very low239 Ų239162.1 Ų162.190%0.90281%0.809SS**  trans-65.3112.1164-72.5174.4175155.5-2.4108.6
126I44.5Very low42.1Very low144 Ų144164.1 Ų164.174%0.73881%0.813SS**  trans-128.494.8160.7-63.2176.3000107.7P124P124-I126 PolarHBondContact O-N 3.43Å
127K44.3Very low42.3Very low206 Ų206163.2 Ų163.290%0.89681%0.812SS**  trans-83104.7157.9-89.3-175.4176.6179.10107
128R33.5Very low41.2Very low230 Ų230164.4 Ų164.487%0.86882%0.816SS**  trans-119.189.3149.6-77.9-165.6-177.2-176.72.5107.6C130R128-C130 PolarHBondContact O-N 3.33Å
129R31.8Very low40.7Very low228 Ų228159.5 Ų159.586%0.8681%0.812SS**  trans-64.3111.7169.7174.1-177.1-107-175-7.8106.8V131R129-V131 HydrophobicContact CG-CG2 3.76Å
130C39.2Very low40.2Very low125 Ų125161.1 Ų161.185%0.84581%0.805SS**  trans-82.7115.5161.7-62.10000106.7R128R128-C130 PolarHBondContact O-N 3.33Å
131V35.5Very low39.8Very low116 Ų116165.5 Ų165.570%0.70381%0.805SS**  trans-144.2120.2164.5175.60000108.1R129R129-V131 HydrophobicContact CG-CG2 3.76Å
132S37.6Very low39Very low92 Ų92165.5 Ų165.564%0.64381%0.805SS**  trans32.1120.6144.3-145.90000121
133E39.3Very low38.7Very low172 Ų172164.4 Ų164.480%0.80480%0.8SS**  22.8141.2122-122.1174.8179.500120.8
134E42Very low38Very low160 Ų160168.9 Ų168.975%0.74881%0.808SS**  trans106.8109.6160.2-58.3167-147.500116.6
135D31.8Very low37.3Very low170 Ų170168.4 Ų168.491%0.90981%0.808SS**  trans-168.295.3135.6-94.1-25.9000110.7
136Y35.3Very low36.4Very low225 Ų225162.2 Ų162.288%0.88280%0.801SS**  trans-76.4115.6170.5-153.2-95.9000108.7
137S46.3Very low35.9Very low92 Ų92160.5 Ų160.564%0.64380%0.801SS**  trans13.9111.9158.253.60000119.7
138R32.4Very low36Very low239 Ų239155.1 Ų155.190%0.90279%0.787SS**  trans-161.8106.5137.6-167.4164.1-86.6178.8-5.7114.3
139C28.6Very low36.1Very low110 Ų110154.3 Ų154.374%0.74379%0.786SS**  trans23.6129.1136.7-78.50000122.2
140N35.6Very low36.2Very low147 Ų147152.9 Ų152.979%0.78679%0.789SS**  54.3124.4127.4-85.2-20.7000120.9
141K36.5Very low35.7Very low194 Ų194154.1 Ų154.184%0.84379%0.787SS**  trans67109.8156.3-60.2-175.2-178.9-176.30116
142R33Very low36.5Very low245 Ų245153 Ų15393%0.92578%0.783SS**  -163.1118.8121.7-122171.2175.8171.1-2.1114.2
143S36Very low36.3Very low104 Ų104159.2 Ų159.273%0.72779%0.792SS**  trans-70.8141.7147.4-48.70000109.7
144K33.8Very low35.9Very low189 Ų189157 Ų15782%0.82279%0.786SS**  trans77.8116.1149.9-63.9177.8-179.1-176.30120.3
145S32.9Very low35.5Very low110 Ų110156.5 Ų156.577%0.76979%0.788SS**  trans66.7111.6130.763.50000122.1
146S35.4Very low35.8Very low109 Ų109158 Ų15876%0.76279%0.787SS**  trans-3.2118144.655.80000122
147S32.6Very low36.5Very low107 Ų107152.2 Ų152.275%0.74878%0.777SS**  59.8158.5112.9158.80000121
148P47.4Very low35.8Very low93 Ų93153.4 Ų153.460%0.60478%0.784SS**  cis-140.7176.63242.6000118.8
149Y34.9Very low35.8Very low214 Ų214150.7 Ų150.784%0.83978%0.782SS**  trans81.6108.7155.8-61-66.2000121.9
150Q33.6Very low36.3Very low197 Ų197152.6 Ų152.692%0.92178%0.784SS**  172.7164.6103-87.1-168.614.200111.4
151N29.4Very low37.4Very low151 Ų151150.2 Ų150.281%0.80778%0.777SS**  trans-86.7-156-152.1-163.415.4000115.4
152P53Low37.3Very low93 Ų93150 Ų15060%0.60478%0.779SS**  -101.5159.7-100.629.1-12.5000114.3
153R32.5Very low37.8Very low222 Ų222145.4 Ų145.484%0.83877%0.773SS**  171.1137.4124.3-103.4179.8-173.1-1611.1113.7
154N31.6Very low38.1Very low126 Ų126145.2 Ų145.267%0.67477%0.772SS**  trans99.6101.6146.1-55.2-14.6000119
155N34Very low38.4Very low150 Ų150145.9 Ų145.980%0.80278%0.775SS**  trans88.591.7131.5-59.4-0.1000118.6
156F38.2Very low38.6Very low200 Ų200146.9 Ų146.988%0.87777%0.771SS**  trans-42.4176.4144.1-71.4-80.9000114.6
157P49.4Very low38.8Very low104 Ų104150 Ų15068%0.67577%0.766SS**  -121.9-170.9-8430.6-7000107.6
158C31.6Very low39.3Very low117 Ų117150.1 Ų150.179%0.79176%0.755SS**  trans174.7100.9143.2-87.80000105.5
159Q31.9Very low39.2Very low183 Ų183149.4 Ų149.486%0.85575%0.752SS**  49.110086.8-80.4171.2-12.500113
160N38.7Very low39.9Very low150 Ų150142.8 Ų142.880%0.80274%0.737SS**  trans-13.5176.6139.4-93.6-16.9000117.3
161P59.4Low40.8Very low97 Ų97141.7 Ų141.763%0.6373%0.732SS**  cis-135154.1-25.633.3-16.1000111.6
162E34.8Very low42.2Very low188 Ų188141 Ų14188%0.87973%0.728SS**  trans-136.5104.2171.3-63.5-67.916300111
163D43.5Very low42.7Very low149 Ų149141.4 Ų141.480%0.79773%0.725SS**  trans-52.1132.2150.5-75.2-43.5000109
164S41.3Very low44.6Very low101 Ų101133.1 Ų133.171%0.70670%0.699SS**  161.8141124.6-69.70000112.3
165F40.3Very low47.2Very low202 Ų202130.7 Ų130.789%0.88669%0.69SS**  trans86.160.1166.6-69.2-81.1000118.1
166L36.3Very low49.7Very low132 Ų132133.7 Ų133.769%0.69169%0.69SS**  trans-100101.4160.5-136.2-179.4000108.5
167W41.6Very low52Low175 Ų175128.1 Ų128.166%0.66368%0.676SS**  trans-109.7-0.6165.184.5-88.3000113.4P25P25-W167 HydrophobicContact CB-CH2 3.66Å; P25-W167 HydrophobicContact CB-CZ2 3.59Å; P25-W167 HydrophobicContact CG-CH2 3.67Å; P25-W167 HydrophobicContact CG-CZ2 3.61Å
168E41Very low54Low108 Ų108127.6 Ų127.651%0.50567%0.667SS.*SBendtrans-12760.6-174.2-150.5160.8-171.300111.5
169S46.5Very low56.8Low79 Ų79126 Ų12655%0.55265%0.647SS**  trans-158.630.7157.1-76.60000111.8E171 N173S169-E171 PolarHBondContact O-N 2.91Å; S169-N173 PolarHBondContact O-ND2 2.86Å
170S49.5Very low59.8Low74 Ų74122.8 Ų122.852%0.51764%0.635SS.*THydrogen-bonded Turntrans-9629.2-170.5-164.30000114.9N172S170-N172 VanDerWaalsContact C-N 3.35Å
171E52.6Low62.5Low175 Ų175118 Ų11882%0.81862%0.616SS**THydrogen-bonded Turntrans-84.4-17165.6-66.7-170.2163.200111.9S169S169-E171 PolarHBondContact O-N 2.91Å
172N58.1Low64.3Low135 Ų135117.7 Ų117.772%0.72261%0.612SS**SBendtrans-107.9-5.3179-64.7-34.5000114.4S170S170-N172 VanDerWaalsContact C-N 3.35Å
173N63.3Low67.2Low103 Ų103113 Ų11355%0.55159%0.593SS**  trans-95.73-173.5-63.6-28.5000114.7S169 P175S169-N173 PolarHBondContact O-ND2 2.86Å; N173-P175 WeakPolarHBondContact O-CD 3.45Å; N173-P175 VanDerWaalsContact O-N 3.15Å
174V73.4Confident69.7Low48 Ų48107.2 Ų107.229%0.29157%0.568SS.*SBendtrans-66.5117.2169.8-179.80000107.2W176 L178 K179V174-W176 PolarHBondContact O-N 3.14Å; V174-L178 HydrophobicContact CG1-CB 3.62Å; V174-L178 HydrophobicContact CG1-CD2 3.59Å; V174-L178 HydrophobicContact CG1-CG 3.81Å; V174-K179 HydrophobicContact CB-CG 4.13Å; V174-K179 HydrophobicContact CG1-CG 3.76Å
175P86.2Confident72.3Confident74 Ų74107.5 Ų107.548%0.48156%0.561SS.*  trans-56.1138.9-178.425.5-34.9000107.9N173 S177 L178 K179N173-P175 WeakPolarHBondContact O-CD 3.45Å; N173-P175 VanDerWaalsContact O-N 3.15Å; P175-S177 WeakPolarHBondContact CB-OG 3.44Å; P175-S177 PolarHBondContact O-N 3.2Å; P175-L178 HydrophobicContact CG-CB 4Å; P175-L178 PolarHBondContact O-N 2.98Å; P175-K179 PolarHBondContact O-N 2.68Å
176W86.3Confident75Confident213 Ų213104 Ų10481%0.80755%0.546SS*.Hα-helixtrans-53.2-27.5-178.7-83.621000112.1V174 L178 K179 L180V174-W176 PolarHBondContact O-N 3.14Å; W176-L178 PolarHBondContact O-N 3.37Å; W176-K179 PolarHBondContact O-N 2.99Å; W176-L180 WeakPolarHBondContact O-CB 3.45Å; W176-L180 WeakPolarHBondContact O-CG 3.34Å; W176-L180 PolarHBondContact O-N 2.68Å
177S85.5Confident77.8Confident84 Ų84103.9 Ų103.959%0.58754%0.54SS*.Hα-helixtrans-58-43.3171.155.90000113.7P175 A181P175-S177 WeakPolarHBondContact CB-OG 3.44Å; P175-S177 PolarHBondContact O-N 3.2Å; S177-A181 VanDerWaalsContact O-CB 3.28Å; S177-A181 WeakPolarHBondContact O-CB 3.48Å; S177-A181 PolarHBondContact O-N 3.46Å
178L91.9Very high80.4Confident92 Ų92100.6 Ų100.648%0.48253%0.534SS..Hα-helixtrans-72.1-39.2177.3-176.164.7000111V174 P175 W176 L180 A181 V182V174-L178 HydrophobicContact CG1-CB 3.62Å; V174-L178 HydrophobicContact CG1-CD2 3.59Å; V174-L178 HydrophobicContact CG1-CG 3.81Å; P175-L178 HydrophobicContact CG-CB 4Å; P175-L178 PolarHBondContact O-N 2.98Å; W176-L178 PolarHBondContact O-N 3.37Å; L178-L180 VanDerWaalsContact C-N 3.33Å; L178-L180 PolarHBondContact O-N 3.2Å; L178-A181 PolarHBondContact O-N 3.27Å; L178-V182 HydrophobicContact CD1-CG2 4.45Å; L178-V182 VanDerWaalsContact O-CG2 3.31Å; L178-V182 WeakPolarHBondContact O-CG2 3.35Å; L178-V182 PolarHBondContact O-N 3.23Å
179K91.4Very high82.9Confident83 Ų8399.8 Ų99.836%0.36154%0.537SS..Hα-helixtrans-59.6-44.9173.7-65-168177.3-174.80111.2V174 P175 W176 L183V174-K179 HydrophobicContact CB-CG 4.13Å; V174-K179 HydrophobicContact CG1-CG 3.76Å; P175-K179 PolarHBondContact O-N 2.68Å; W176-K179 PolarHBondContact O-N 2.99Å; K179-L183 WeakPolarHBondContact O-CB 3.47Å; K179-L183 VanDerWaalsContact O-CG 3.3Å; K179-L183 WeakPolarHBondContact O-CG 3.45Å; K179-L183 PolarHBondContact O-N 3.21Å
180L94.3Very high85.2Confident116 Ų11699.3 Ų99.361%0.60753%0.527SS*.Hα-helixtrans-68.6-35.7176.7-69.6173.8000112.7W176 L178 G184W176-L180 WeakPolarHBondContact O-CB 3.45Å; W176-L180 WeakPolarHBondContact O-CG 3.34Å; W176-L180 PolarHBondContact O-N 2.68Å; L178-L180 VanDerWaalsContact C-N 3.33Å; L178-L180 PolarHBondContact O-N 3.2Å; L180-G184 PolarHBondContact O-N 2.9Å
181A96.1Very high87.2Confident49 Ų49102.1 Ų102.141%0.40553%0.53SS..Hα-helixtrans-64.5-45.6175.700000111.5S177 L178 G184 I185S177-A181 VanDerWaalsContact O-CB 3.28Å; S177-A181 WeakPolarHBondContact O-CB 3.48Å; S177-A181 PolarHBondContact O-N 3.46Å; L178-A181 PolarHBondContact O-N 3.27Å; A181-G184 PolarHBondContact O-N 2.93Å; A181-I185 WeakPolarHBondContact O-CD1 3.48Å; A181-I185 VanDerWaalsContact O-CG1 3.27Å; A181-I185 WeakPolarHBondContact O-CG1 3.26Å; A181-I185 PolarHBondContact O-N 3.27Å
182V95.7Very high89.2Confident91 Ų9197.3 Ų97.355%0.55251%0.513SS*.Hα-helixtrans-63.2-45.5176.81740000110.8L178 G184 I185 F186L178-V182 HydrophobicContact CD1-CG2 4.45Å; L178-V182 VanDerWaalsContact O-CG2 3.31Å; L178-V182 WeakPolarHBondContact O-CG2 3.35Å; L178-V182 PolarHBondContact O-N 3.23Å; V182-G184 VanDerWaalsContact C-N 3.35Å; V182-G184 PolarHBondContact O-N 2.96Å; V182-I185 PolarHBondContact O-N 2.88Å; V182-F186 WeakPolarHBondContact O-CB 3.21Å; V182-F186 PolarHBondContact O-N 3.27Å
183L95.8Very high90.7Very high89 Ų8996.9 Ų96.947%0.46650%0.502SS..Hα-helixtrans-61.8-42174.9-72.6172.9000111.9K179 F186 F187K179-L183 WeakPolarHBondContact O-CB 3.47Å; K179-L183 VanDerWaalsContact O-CG 3.3Å; K179-L183 WeakPolarHBondContact O-CG 3.45Å; K179-L183 PolarHBondContact O-N 3.21Å; L183-F186 WeakPolarHBondContact O-CB 3.49Å; L183-F186 PolarHBondContact O-N 2.93Å; L183-F187 HydrophobicContact CB-CD2 4.49Å; L183-F187 HydrophobicContact CB-CE2 4.32Å; L183-F187 WeakPolarHBondContact O-CD2 3.46Å; L183-F187 PolarHBondContact O-N 3.41Å
184G96Very high91.9Very high28 Ų2895.4 Ų95.429%0.28949%0.493SS..Hα-helixtrans-61-45.9177.500000112.6L180 A181 V182 F186 F187 I188L180-G184 PolarHBondContact O-N 2.9Å; A181-G184 PolarHBondContact O-N 2.93Å; V182-G184 VanDerWaalsContact C-N 3.35Å; V182-G184 PolarHBondContact O-N 2.96Å; G184-F186 VanDerWaalsContact C-N 3.31Å; G184-F186 PolarHBondContact O-N 3.09Å; G184-F187 PolarHBondContact O-N 3.23Å; G184-I188 WeakPolarHBondContact O-CD1 3.47Å; G184-I188 WeakPolarHBondContact O-CG1 3.35Å; G184-I188 PolarHBondContact O-N 3.17Å
185I96.8Very high92.5Very high108 Ų10897.3 Ų97.355%0.55450%0.501SS*.Hα-helixtrans-60.7-43.7175.2-65.3161.5000110.3A181 V182 F187 I188 V189A181-I185 WeakPolarHBondContact O-CD1 3.48Å; A181-I185 VanDerWaalsContact O-CG1 3.27Å; A181-I185 WeakPolarHBondContact O-CG1 3.26Å; A181-I185 PolarHBondContact O-N 3.27Å; V182-I185 PolarHBondContact O-N 2.88Å; I185-F187 PolarHBondContact O-N 3.36Å; I185-I188 PolarHBondContact O-N 2.97Å; I185-V189 HydrophobicContact CG2-CG2 4.46Å; I185-V189 WeakPolarHBondContact O-CG2 3.35Å; I185-V189 PolarHBondContact O-N 3.26Å
186F96.7Very high92.4Very high128 Ų12899.2 Ų99.256%0.56151%0.511SS*.Hα-helixtrans-59.6-46.1177-179.8-99000112.2V182 L183 G184 I188 V189 L190V182-F186 WeakPolarHBondContact O-CB 3.21Å; V182-F186 PolarHBondContact O-N 3.27Å; L183-F186 WeakPolarHBondContact O-CB 3.49Å; L183-F186 PolarHBondContact O-N 2.93Å; G184-F186 VanDerWaalsContact C-N 3.31Å; G184-F186 PolarHBondContact O-N 3.09Å; F186-I188 VanDerWaalsContact C-N 3.35Å; F186-I188 PolarHBondContact O-N 3.36Å; F186-V189 PolarHBondContact O-N 3.4Å; F186-L190 WeakPolarHBondContact O-CB 3.24Å; F186-L190 PolarHBondContact O-N 2.98Å
187F95.6Very high91.9Very high129 Ų12994.3 Ų94.357%0.56650%0.497SS*.Hα-helixtrans-64.7-36.4176.2-75.7-64.3000113L183 G184 I185 L190 F191L183-F187 HydrophobicContact CB-CD2 4.49Å; L183-F187 HydrophobicContact CB-CE2 4.32Å; L183-F187 WeakPolarHBondContact O-CD2 3.46Å; L183-F187 PolarHBondContact O-N 3.41Å; G184-F187 PolarHBondContact O-N 3.23Å; I185-F187 PolarHBondContact O-N 3.36Å; F187-L190 PolarHBondContact O-N 3.26Å; F187-F191 VanDerWaalsContact O-CB 3.23Å; F187-F191 WeakPolarHBondContact O-CB 3Å; F187-F191 PolarHBondContact O-N 3.08Å
188I95Very high90.7Very high107 Ų10796.6 Ų96.655%0.54950%0.497SS..Hα-helixtrans-65.2-46.9176.2-68.5162.2000110.4G184 I185 F186 L190 F191 V192G184-I188 WeakPolarHBondContact O-CD1 3.47Å; G184-I188 WeakPolarHBondContact O-CG1 3.35Å; G184-I188 PolarHBondContact O-N 3.17Å; I185-I188 PolarHBondContact O-N 2.97Å; F186-I188 VanDerWaalsContact C-N 3.35Å; F186-I188 PolarHBondContact O-N 3.36Å; I188-L190 VanDerWaalsContact C-N 3.34Å; I188-L190 PolarHBondContact O-N 3.44Å; I188-F191 PolarHBondContact O-N 3.27Å; I188-V192 WeakPolarHBondContact O-CG2 3.37Å; I188-V192 PolarHBondContact O-N 3.39Å
189V95.2Very high89.5Confident91 Ų91100.5 Ų100.555%0.55251%0.51SS*.Hα-helixtrans-61.9-44.3176.9173.10000110.5I185 F186 F191 V192 Y193I185-V189 HydrophobicContact CG2-CG2 4.46Å; I185-V189 WeakPolarHBondContact O-CG2 3.35Å; I185-V189 PolarHBondContact O-N 3.26Å; F186-V189 PolarHBondContact O-N 3.4Å; V189-F191 PolarHBondContact O-N 3.41Å; V189-V192 PolarHBondContact O-N 2.97Å; V189-Y193 WeakPolarHBondContact O-CB 3.49Å; V189-Y193 PolarHBondContact O-N 2.91Å
190L93.8Very high87.9Confident68 Ų68100.8 Ų100.836%0.35652%0.52SS..Hα-helixtrans-61.6-42.2176.3-178.962.5000112F186 F187 I188 Y193 I194F186-L190 WeakPolarHBondContact O-CB 3.24Å; F186-L190 PolarHBondContact O-N 2.98Å; F187-L190 PolarHBondContact O-N 3.26Å; I188-L190 VanDerWaalsContact C-N 3.34Å; I188-L190 PolarHBondContact O-N 3.44Å; L190-Y193 PolarHBondContact O-N 3.45Å; L190-I194 HydrophobicContact CD1-CD1 3.98Å; L190-I194 HydrophobicContact CD1-CG1 4.24Å; L190-I194 HydrophobicContact CG-CD1 3.81Å; L190-I194 HydrophobicContact CG-CG1 4.45Å; L190-I194 VanDerWaalsContact O-CB 3.31Å; L190-I194 WeakPolarHBondContact O-CB 3.46Å; L190-I194 WeakPolarHBondContact O-CG1 3.16Å; L190-I194 PolarHBondContact O-N 3.14Å
191F92.8Very high86.3Confident133 Ų133103.5 Ų103.558%0.58353%0.534SS*.Hα-helixtrans-65.1-45.9178179.1-107.2000111.9F187 I188 V189 Y193 I194 I195F187-F191 VanDerWaalsContact O-CB 3.23Å; F187-F191 WeakPolarHBondContact O-CB 3Å; F187-F191 PolarHBondContact O-N 3.08Å; I188-F191 PolarHBondContact O-N 3.27Å; V189-F191 PolarHBondContact O-N 3.41Å; F191-Y193 VanDerWaalsContact C-N 3.33Å; F191-I194 PolarHBondContact O-N 3.31Å; F191-I195 HydrophobicContact CD1-CD1 3.61Å; F191-I195 HydrophobicContact CD2-CD1 4.16Å; F191-I195 HydrophobicContact CE1-CD1 3.15Å; F191-I195 HydrophobicContact CE1-CG1 4.44Å; F191-I195 HydrophobicContact CE2-CD1 3.75Å; F191-I195 HydrophobicContact CE2-CG1 4.44Å; F191-I195 HydrophobicContact CG-CD1 4.11Å; F191-I195 HydrophobicContact CZ-CD1 3.26Å; F191-I195 HydrophobicContact CZ-CG1 4.36Å; F191-I195 WeakPolarHBondContact O-CB 3.26Å; F191-I195 VanDerWaalsContact O-CG1 3.32Å; F191-I195 WeakPolarHBondContact O-CG1 3.27Å; F191-I195 PolarHBondContact O-N 3.24Å
192V93.6Very high84.4Confident75 Ų75109.1 Ų109.146%0.45556%0.556SS.*Hα-helixtrans-61.6-44.6174.9171.80000110.2I188 V189 I194 I195 V196I188-V192 WeakPolarHBondContact O-CG2 3.37Å; I188-V192 PolarHBondContact O-N 3.39Å; V189-V192 PolarHBondContact O-N 2.97Å; V192-I194 PolarHBondContact O-N 3.41Å; V192-I195 PolarHBondContact O-N 3.5Å; V192-V196 HydrophobicContact CG1-CG2 3.93Å; V192-V196 VanDerWaalsContact O-CB 3.28Å; V192-V196 WeakPolarHBondContact O-CB 3.47Å; V192-V196 WeakPolarHBondContact O-CG2 3.38Å; V192-V196 PolarHBondContact O-N 3.4Å
193Y90.5Very high81.9Confident125 Ų125111.5 Ų111.549%0.4960%0.6SS.*Hα-helixtrans-59.1-48.3176.3-178.6-107.2000111.4V189 L190 F191 I195 V196 E197V189-Y193 WeakPolarHBondContact O-CB 3.49Å; V189-Y193 PolarHBondContact O-N 2.91Å; L190-Y193 PolarHBondContact O-N 3.45Å; F191-Y193 VanDerWaalsContact C-N 3.33Å; Y193-I195 VanDerWaalsContact C-N 3.3Å; Y193-I195 PolarHBondContact O-N 2.89Å; Y193-V196 PolarHBondContact O-N 3.07Å; Y193-E197 HydrophobicContact CD2-CG 4.32Å; Y193-E197 WeakPolarHBondContact CE1-OE2 3.48Å; Y193-E197 HydrophobicContact CE2-CG 3.99Å; Y193-E197 WeakPolarHBondContact CE2-OE1 3.2Å; Y193-E197 WeakPolarHBondContact CE2-OE2 3.44Å; Y193-E197 VanDerWaalsContact O-CB 3.28Å; Y193-E197 WeakPolarHBondContact O-CB 3.3Å; Y193-E197 PolarHBondContact O-N 3.41Å; Y193-E197 PolarHBondContact OH-OE1 3.39Å; Y193-E197 PolarHBondContact OH-OE2 2.73Å
194I87.8Confident81.2Confident72 Ų72112.7 Ų112.737%0.36961%0.607SS.*Hα-helixtrans-59.7-39.6176.5-73.6169.7000111.4L190 F191 V192 K198L190-I194 HydrophobicContact CD1-CD1 3.98Å; L190-I194 HydrophobicContact CD1-CG1 4.24Å; L190-I194 HydrophobicContact CG-CD1 3.81Å; L190-I194 HydrophobicContact CG-CG1 4.45Å; L190-I194 VanDerWaalsContact O-CB 3.31Å; L190-I194 WeakPolarHBondContact O-CB 3.46Å; L190-I194 WeakPolarHBondContact O-CG1 3.16Å; L190-I194 PolarHBondContact O-N 3.14Å; F191-I194 PolarHBondContact O-N 3.31Å; V192-I194 PolarHBondContact O-N 3.41Å; I194-K198 HydrophobicContact CG2-CD 4.4Å; I194-K198 VanDerWaalsContact O-CD 3.25Å; I194-K198 WeakPolarHBondContact O-CD 3.42Å; I194-K198 WeakPolarHBondContact O-CE 3.45Å; I194-K198 WeakPolarHBondContact O-CG 3.27Å; I194-K198 PolarHBondContact O-N 3.11Å
195I84.8Confident80.4Confident89 Ų89117.1 Ų117.146%0.45662%0.623SS.*Hα-helixtrans-72-45.5178.3-73.3172000112F191 V192 Y193 E197 K198F191-I195 HydrophobicContact CD1-CD1 3.61Å; F191-I195 HydrophobicContact CD2-CD1 4.16Å; F191-I195 HydrophobicContact CE1-CD1 3.15Å; F191-I195 HydrophobicContact CE1-CG1 4.44Å; F191-I195 HydrophobicContact CE2-CD1 3.75Å; F191-I195 HydrophobicContact CE2-CG1 4.44Å; F191-I195 HydrophobicContact CG-CD1 4.11Å; F191-I195 HydrophobicContact CZ-CD1 3.26Å; F191-I195 HydrophobicContact CZ-CG1 4.36Å; F191-I195 WeakPolarHBondContact O-CB 3.26Å; F191-I195 VanDerWaalsContact O-CG1 3.32Å; F191-I195 WeakPolarHBondContact O-CG1 3.27Å; F191-I195 PolarHBondContact O-N 3.24Å; V192-I195 PolarHBondContact O-N 3.5Å; Y193-I195 VanDerWaalsContact C-N 3.3Å; Y193-I195 PolarHBondContact O-N 2.89Å; I195-E197 VanDerWaalsContact C-N 3.34Å; I195-K198 WeakPolarHBondContact O-CB 3.18Å; I195-K198 PolarHBondContact O-N 3.27Å; I195-K198 VanDerWaalsContact O-N 3.17Å
196V84.3Confident79.5Confident113 Ų113117.6 Ų117.669%0.68563%0.627SS**Hα-helixtrans-68.9-37.3-178.71700000110.4V192 Y193 K198V192-V196 HydrophobicContact CG1-CG2 3.93Å; V192-V196 VanDerWaalsContact O-CB 3.28Å; V192-V196 WeakPolarHBondContact O-CB 3.47Å; V192-V196 WeakPolarHBondContact O-CG2 3.38Å; V192-V196 PolarHBondContact O-N 3.4Å; Y193-V196 PolarHBondContact O-N 3.07Å; V196-K198 VanDerWaalsContact C-N 3.31Å
197E75.9Confident78.5Confident111 Ų111117 Ų11752%0.51963%0.631SS.*THydrogen-bonded Turntrans-87.56.3173-73.4-168.9166.300113.7Y193 I195 K199Y193-E197 HydrophobicContact CD2-CG 4.32Å; Y193-E197 WeakPolarHBondContact CE1-OE2 3.48Å; Y193-E197 HydrophobicContact CE2-CG 3.99Å; Y193-E197 WeakPolarHBondContact CE2-OE1 3.2Å; Y193-E197 WeakPolarHBondContact CE2-OE2 3.44Å; Y193-E197 VanDerWaalsContact O-CB 3.28Å; Y193-E197 WeakPolarHBondContact O-CB 3.3Å; Y193-E197 PolarHBondContact O-N 3.41Å; Y193-E197 PolarHBondContact OH-OE1 3.39Å; Y193-E197 PolarHBondContact OH-OE2 2.73Å; I195-E197 VanDerWaalsContact C-N 3.34Å; E197-K199 PolarHBondContact O-N 2.99Å
198K61.5Low77.5Confident132 Ų132116.3 Ų116.357%0.57464%0.635SS**  trans-69.285.1160.1-69.7-41.2176.2174.70108.5I194 I195 V196I194-K198 HydrophobicContact CG2-CD 4.4Å; I194-K198 VanDerWaalsContact O-CD 3.25Å; I194-K198 WeakPolarHBondContact O-CD 3.42Å; I194-K198 WeakPolarHBondContact O-CE 3.45Å; I194-K198 WeakPolarHBondContact O-CG 3.27Å; I194-K198 PolarHBondContact O-N 3.11Å; I195-K198 WeakPolarHBondContact O-CB 3.18Å; I195-K198 PolarHBondContact O-N 3.27Å; I195-K198 VanDerWaalsContact O-N 3.17Å; V196-K198 VanDerWaalsContact C-N 3.31Å
199K66.9Low76.3Confident173 Ų173116.9 Ų116.975%0.75264%0.641SS**  -62.7118.6122-63-177-176.2-172.10104.9E197 L201E197-K199 PolarHBondContact O-N 2.99Å; K199-L201 PolarHBondContact O-N 3.31Å
200P57.3Low74.9Confident89 Ų89118.7 Ų118.758%0.57865%0.647SS**  trans-58.2114.6172.426.6-31.7000105.6L202P200-L202 PolarHBondContact O-N 3.27Å
201L59.6Low73.5Confident174 Ų174122.6 Ų122.691%0.91167%0.67SS**SBendtrans-69.519.6173-70173.1000111.8K199K199-L201 PolarHBondContact O-N 3.31Å
202L56.7Low71.9Confident166 Ų166121.8 Ų121.887%0.86968%0.677SS**  trans-146.593.6177.9-80.4161.7000106.6P200P200-L202 PolarHBondContact O-N 3.27Å
203G44Very low69.9Low142 Ų142126 Ų126100%1.46470%0.697SS**  trans163.10178.900000110.7

Retrieved 203 of 203 residues in 877.2 ms (Link to these results)