A0A077Z148_TRITR Loading...

Ribosomal S19e domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z148, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 154 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M57.2Low84.2Confident219 Ų21980.4 Ų80.4100%1.07939%0.387SS*.  0122.50-154.5175.2-165.800108I3M1-I3 PolarHBondContact O-N 2.89Å
2R73.9Confident84.8Confident226 Ų22678.3 Ų78.385%0.85338%0.378SS*.  trans-79100.4177.5-175.9176.3176.2161-0.6108.1
3I85.6Confident85.4Confident31 Ų3172.3 Ų72.316%0.15935%0.35CS..  trans-80.8129.4178.3-61.9151.8000107.9M1 D7 V8 A135 A136 F139M1-I3 PolarHBondContact O-N 2.89Å; I3-D7 HydrophobicContact CG2-CB 4.48Å; I3-V8 HydrophobicContact CG2-CG2 3.94Å; I3-A135 HydrophobicContact CG2-CB 4.41Å; I3-A136 HydrophobicContact CD1-CB 4.5Å; I3-F139 HydrophobicContact CD1-CB 3.87Å; I3-F139 HydrophobicContact CD1-CD1 3.44Å; I3-F139 VanDerWaalsContact CD1-CD1 3.44Å; I3-F139 HydrophobicContact CD1-CD2 4.16Å; I3-F139 HydrophobicContact CD1-CE1 3.99Å; I3-F139 HydrophobicContact CD1-CG 3.55Å; I3-F139 HydrophobicContact CG1-CG 4.37Å; I3-F139 HydrophobicContact CG2-CB 4.46Å
4S88Confident86.1Confident24 Ų2468.4 Ų68.417%0.16833%0.333CS..  trans-105.4161.8175.176.80000110.8K6 D7S4-K6 PolarHBondContact O-N 3.42Å; S4-K6 PolarHBondContact OG-N 3.04Å; S4-D7 WeakPolarHBondContact CA-OD2 3.35Å; S4-D7 WeakPolarHBondContact CB-OD2 3.47Å; S4-D7 PolarHBondContact N-OD2 3.19Å; S4-D7 PolarHBondContact O-N 3.05Å; S4-D7 PolarHBondContact OG-OD2 2.79Å
5A87Confident86.7Confident2 Ų269.7 Ų69.72%0.01734%0.341CS..THydrogen-bonded Turntrans-59.3-8.8173.200000114.6L13 Y64 D132A5-L13 HydrophobicContact CB-CD2 3.92Å; A5-Y64 HydrophobicContact CB-CD1 3.97Å; A5-Y64 HydrophobicContact CB-CD2 4.01Å; A5-Y64 HydrophobicContact CB-CE1 3.91Å; A5-Y64 HydrophobicContact CB-CE2 3.87Å; A5-Y64 HydrophobicContact CB-CG 4.06Å; A5-D132 PolarHBondContact N-OD1 3.15Å
6K88.4Confident87.2Confident116 Ų11668.7 Ų68.750%0.50434%0.336SS..THydrogen-bonded Turntrans-85.6-20.5175.7-65.7177.1178.4-1740113.5S4 Y64S4-K6 PolarHBondContact O-N 3.42Å; S4-K6 PolarHBondContact OG-N 3.04Å; K6-Y64 HydrophobicContact CD-CE1 4.42Å; K6-Y64 HydrophobicContact CG-CD1 4.27Å; K6-Y64 HydrophobicContact CG-CE1 3.95Å
7D87.9Confident87.6Confident72 Ų7264.6 Ų64.639%0.38532%0.316SS..SBendtrans-91.3-11.4-170.4-52.9-51.9000112.9I3 S4 M147I3-D7 HydrophobicContact CG2-CB 4.48Å; S4-D7 WeakPolarHBondContact CA-OD2 3.35Å; S4-D7 WeakPolarHBondContact CB-OD2 3.47Å; S4-D7 PolarHBondContact N-OD2 3.19Å; S4-D7 PolarHBondContact O-N 3.05Å; S4-D7 PolarHBondContact OG-OD2 2.79Å; D7-M147 PolarHBondContact O-N 3.28Å
8V87.2Confident88Confident7 Ų761.6 Ų61.64%0.04230%0.303CS..BIsolated β-bridgetrans-102.1147.6-175.7-177.70000110.5I3 Q10 L13 A135 V138I3-V8 HydrophobicContact CG2-CG2 3.94Å; V8-Q10 PolarHBondContact O-N 3.39Å; V8-L13 HydrophobicContact CG1-CB 4.29Å; V8-A135 HydrophobicContact CG2-CB 3.87Å; V8-V138 HydrophobicContact CG1-CB 3.84Å; V8-V138 HydrophobicContact CG1-CG1 3.53Å
9D89.4Confident88.4Confident33 Ų3360.4 Ų60.418%0.17630%0.304CS..  trans-51.3133170.9178.663.7000111.9S11 L12 L13 L145D9-S11 VanDerWaalsContact C-N 3.34Å; D9-S11 PolarHBondContact O-N 3.26Å; D9-S11 WeakPolarHBondContact OD2-CA 3.24Å; D9-S11 VanDerWaalsContact OD2-CB 3.29Å; D9-S11 WeakPolarHBondContact OD2-CB 3.5Å; D9-S11 PolarHBondContact OD2-N 3.48Å; D9-L12 HydrophobicContact CB-CB 4.45Å; D9-L12 HydrophobicContact CB-CD1 4.36Å; D9-L12 HydrophobicContact CB-CG 4.38Å; D9-L12 PolarHBondContact OD2-N 3.4Å; D9-L13 VanDerWaalsContact O-CB 3.31Å; D9-L13 WeakPolarHBondContact O-CB 3.42Å; D9-L13 PolarHBondContact O-N 3.42Å; D9-L145 HydrophobicContact CB-CB 4.48Å
10Q90.1Very high88.7Confident89 Ų8961.1 Ų61.142%0.41631%0.305SS..Hα-helixtrans-68-34.6-172.666.8176.6-0.700113.5V8 V14 R61V8-Q10 PolarHBondContact O-N 3.39Å; Q10-V14 WeakPolarHBondContact O-CB 3.26Å; Q10-V14 VanDerWaalsContact O-CG2 3.24Å; Q10-V14 WeakPolarHBondContact O-CG2 3.47Å; Q10-V14 PolarHBondContact O-N 3.45Å; Q10-V14 VanDerWaalsContact O-N 3.1Å; Q10-R61 VanDerWaalsContact CB-NH2 3.28Å
11S91.1Very high89Confident65 Ų6558.1 Ų58.146%0.45529%0.29SS..Hα-helixtrans-74.5-46-173.2-450000108.8D9 V14 N15D9-S11 VanDerWaalsContact C-N 3.34Å; D9-S11 PolarHBondContact O-N 3.26Å; D9-S11 WeakPolarHBondContact OD2-CA 3.24Å; D9-S11 VanDerWaalsContact OD2-CB 3.29Å; D9-S11 WeakPolarHBondContact OD2-CB 3.5Å; D9-S11 PolarHBondContact OD2-N 3.48Å; S11-V14 PolarHBondContact O-N 3.04Å; S11-N15 VanDerWaalsContact O-CG 3.31Å; S11-N15 PolarHBondContact O-N 3.01Å; S11-N15 VanDerWaalsContact O-N 3.14Å; S11-N15 PolarHBondContact O-ND2 2.99Å
12L91.7Very high90.7Very high55 Ų5552.7 Ų52.729%0.28826%0.26SS..Hα-helixtrans-62.2-44.2175.1-64.4-175.5000112.1D9 V14 N15 E16 V138 C142 L145D9-L12 HydrophobicContact CB-CB 4.45Å; D9-L12 HydrophobicContact CB-CD1 4.36Å; D9-L12 HydrophobicContact CB-CG 4.38Å; D9-L12 PolarHBondContact OD2-N 3.4Å; L12-V14 VanDerWaalsContact C-N 3.35Å; L12-V14 PolarHBondContact O-N 3.33Å; L12-N15 PolarHBondContact O-N 2.64Å; L12-E16 WeakPolarHBondContact O-CG 3.31Å; L12-E16 PolarHBondContact O-N 2.83Å; L12-V138 HydrophobicContact CB-CG1 3.9Å; L12-V138 HydrophobicContact CD1-CG1 4.48Å; L12-C142 HydrophobicContact CD1-CB 4.47Å; L12-L145 HydrophobicContact CD1-CD1 3.38Å
13L92.8Very high91.7Very high1 Ų150.5 Ų50.51%0.00526%0.257CS..Hα-helixtrans-61.8-43.3179.4-177.462.7000111.8A5 V8 D9 N15 E16 I17 A135 V138A5-L13 HydrophobicContact CB-CD2 3.92Å; V8-L13 HydrophobicContact CG1-CB 4.29Å; D9-L13 VanDerWaalsContact O-CB 3.31Å; D9-L13 WeakPolarHBondContact O-CB 3.42Å; D9-L13 PolarHBondContact O-N 3.42Å; L13-N15 VanDerWaalsContact C-N 3.34Å; L13-N15 PolarHBondContact O-N 3.37Å; L13-E16 PolarHBondContact O-N 2.92Å; L13-I17 HydrophobicContact CD1-CD1 4.07Å; L13-I17 HydrophobicContact CD1-CG1 4.28Å; L13-I17 HydrophobicContact CD2-CD1 4.45Å; L13-I17 HydrophobicContact CG-CD1 3.76Å; L13-I17 HydrophobicContact CG-CG1 4.43Å; L13-I17 WeakPolarHBondContact O-CD1 3.47Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 3.22Å; L13-A135 HydrophobicContact CD1-CB 4.07Å; L13-V138 HydrophobicContact CD1-CG2 4.22Å
14V95.3Very high91.9Very high18 Ų1850.7 Ų50.711%0.10926%0.261CS..Hα-helixtrans-63.3-41.4178.5168.50000111.3Q10 S11 L12 I17 A18 I54 A57 A58 R61Q10-V14 WeakPolarHBondContact O-CB 3.26Å; Q10-V14 VanDerWaalsContact O-CG2 3.24Å; Q10-V14 WeakPolarHBondContact O-CG2 3.47Å; Q10-V14 PolarHBondContact O-N 3.45Å; Q10-V14 VanDerWaalsContact O-N 3.1Å; S11-V14 PolarHBondContact O-N 3.04Å; L12-V14 VanDerWaalsContact C-N 3.35Å; L12-V14 PolarHBondContact O-N 3.33Å; V14-I17 PolarHBondContact O-N 2.94Å; V14-A18 WeakPolarHBondContact O-CB 3.4Å; V14-A18 PolarHBondContact O-N 3.35Å; V14-I54 HydrophobicContact CG1-CG2 4.02Å; V14-A57 HydrophobicContact CG1-CB 3.96Å; V14-A57 WeakPolarHBondContact O-CB 3.38Å; V14-A58 HydrophobicContact CG1-CB 4.39Å; V14-R61 HydrophobicContact CG2-CB 4.47Å
15N94.3Very high91.9Very high87 Ų8752.5 Ų52.547%0.46528%0.284SS..Hα-helixtrans-65.5-41.9178.5-68.4-14.1000112.1S11 L12 L13 A18 A19S11-N15 VanDerWaalsContact O-CG 3.31Å; S11-N15 PolarHBondContact O-N 3.01Å; S11-N15 VanDerWaalsContact O-N 3.14Å; S11-N15 PolarHBondContact O-ND2 2.99Å; L12-N15 PolarHBondContact O-N 2.64Å; L13-N15 VanDerWaalsContact C-N 3.34Å; L13-N15 PolarHBondContact O-N 3.37Å; N15-A18 PolarHBondContact O-N 3.28Å; N15-A19 WeakPolarHBondContact O-CB 3.49Å; N15-A19 PolarHBondContact O-N 3.44Å
16E94.6Very high91.9Very high54 Ų5460.4 Ų60.425%0.25231%0.313SS..Hα-helixtrans-70-36.9178.2-70.5-71.7170.700112L12 L13 A19 F20 V138 K141L12-E16 WeakPolarHBondContact O-CG 3.31Å; L12-E16 PolarHBondContact O-N 2.83Å; L13-E16 PolarHBondContact O-N 2.92Å; E16-A19 PolarHBondContact O-N 3.11Å; E16-F20 WeakPolarHBondContact O-CB 3.29Å; E16-F20 PolarHBondContact O-N 3.38Å; E16-V138 HydrophobicContact CB-CG2 3.73Å; E16-V138 HydrophobicContact CG-CG2 3.66Å; E16-K141 IonicContact OE1-NZ 2.78Å; E16-K141 PolarHBondContact OE1-NZ 3.06Å
17I95Very high92Very high0 Ų055.4 Ų55.40%029%0.292CS..Hα-helixtrans-62.9-44.3170.8-64.5160.3000110.3L13 V14 A19 F20 L21 A57 W111 L131 L134L13-I17 HydrophobicContact CD1-CD1 4.07Å; L13-I17 HydrophobicContact CD1-CG1 4.28Å; L13-I17 HydrophobicContact CD2-CD1 4.45Å; L13-I17 HydrophobicContact CG-CD1 3.76Å; L13-I17 HydrophobicContact CG-CG1 4.43Å; L13-I17 WeakPolarHBondContact O-CD1 3.47Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 3.22Å; V14-I17 PolarHBondContact O-N 2.94Å; I17-A19 VanDerWaalsContact C-N 3.32Å; I17-A19 PolarHBondContact O-N 3.18Å; I17-F20 PolarHBondContact O-N 3.16Å; I17-L21 HydrophobicContact CG2-CD1 4Å; I17-L21 HydrophobicContact CG2-CG 4.16Å; I17-L21 WeakPolarHBondContact O-CB 3.41Å; I17-L21 VanDerWaalsContact O-CG 3.27Å; I17-L21 WeakPolarHBondContact O-CG 3.5Å; I17-L21 PolarHBondContact O-N 3.1Å; I17-A57 HydrophobicContact CB-CB 3.77Å; I17-A57 HydrophobicContact CG2-CB 3.55Å; I17-W111 HydrophobicContact CG2-CH2 4.35Å; I17-W111 HydrophobicContact CG2-CZ3 4.03Å; I17-L131 HydrophobicContact CD1-CD2 3.41Å; I17-L131 VanDerWaalsContact CD1-CD2 3.41Å; I17-L131 HydrophobicContact CG1-CD2 3.83Å; I17-L131 HydrophobicContact CG2-CD2 4.42Å; I17-L134 HydrophobicContact CB-CD1 4.4Å; I17-L134 HydrophobicContact CG1-CD1 3.82Å
18A95.3Very high91.9Very high10 Ų1055.8 Ų55.88%0.08330%0.297CS..Hα-helixtrans-60.6-43.2178.200000111.5V14 N15 F20 L21 K22 I54 A57V14-A18 WeakPolarHBondContact O-CB 3.4Å; V14-A18 PolarHBondContact O-N 3.35Å; N15-A18 PolarHBondContact O-N 3.28Å; A18-F20 PolarHBondContact O-N 3.31Å; A18-L21 PolarHBondContact O-N 3.41Å; A18-K22 PolarHBondContact O-N 3.47Å; A18-I54 HydrophobicContact CB-CG1 3.93Å; A18-A57 HydrophobicContact CB-CB 4.2Å
19A95Very high92Very high38 Ų3859.4 Ų59.431%0.31432%0.316SS..Hα-helixtrans-63-41.1175.400000112.3N15 E16 I17 K22 K23N15-A19 WeakPolarHBondContact O-CB 3.49Å; N15-A19 PolarHBondContact O-N 3.44Å; E16-A19 PolarHBondContact O-N 3.11Å; I17-A19 VanDerWaalsContact C-N 3.32Å; I17-A19 PolarHBondContact O-N 3.18Å; A19-K22 PolarHBondContact O-N 3.06Å; A19-K23 VanDerWaalsContact O-CG 3.31Å; A19-K23 WeakPolarHBondContact O-CG 3.4Å; A19-K23 PolarHBondContact O-N 3.3Å
20F94.5Very high92.2Very high74 Ų7458.9 Ų58.933%0.32531%0.314SS..Hα-helixtrans-62.8-45.6174.5174.5-95.3000111.9E16 I17 A18 K22 K23 S24 M109 W111 L134E16-F20 WeakPolarHBondContact O-CB 3.29Å; E16-F20 PolarHBondContact O-N 3.38Å; I17-F20 PolarHBondContact O-N 3.16Å; A18-F20 PolarHBondContact O-N 3.31Å; F20-K22 VanDerWaalsContact C-N 3.33Å; F20-K22 PolarHBondContact O-N 3.49Å; F20-K23 PolarHBondContact O-N 2.65Å; F20-S24 WeakPolarHBondContact O-CB 3.25Å; F20-S24 PolarHBondContact O-N 3.27Å; F20-M109 HydrophobicContact CE1-CE 4.08Å; F20-W111 AromaticContact CD1-CH2 3.79Å; F20-W111 HydrophobicContact CD1-CH2 3.79Å; F20-W111 AromaticContact CD1-CZ2 3.97Å; F20-W111 HydrophobicContact CD1-CZ2 3.97Å; F20-W111 AromaticContact CE1-CH2 3.84Å; F20-W111 HydrophobicContact CE1-CH2 3.84Å; F20-W111 AromaticContact CE1-CZ2 3.51Å; F20-W111 HydrophobicContact CE1-CZ2 3.51Å; F20-W111 HydrophobicContact CZ-CZ2 4.49Å; F20-L134 HydrophobicContact CB-CD1 4.11Å; F20-L134 HydrophobicContact CB-CD2 3.9Å; F20-L134 HydrophobicContact CD1-CD1 4.1Å; F20-L134 HydrophobicContact CD2-CD2 4Å; F20-L134 HydrophobicContact CG-CD1 4.05Å; F20-L134 HydrophobicContact CG-CD2 3.96Å
21L93.9Very high92.3Very high0 Ų062.4 Ų62.40%034%0.336CS..Hα-helixtrans-60.1-44.1178.8-75.1-179.4000111.3I17 A18 S24 I27 Y53 A56 A57 L106 M109 W111I17-L21 HydrophobicContact CG2-CD1 4Å; I17-L21 HydrophobicContact CG2-CG 4.16Å; I17-L21 WeakPolarHBondContact O-CB 3.41Å; I17-L21 VanDerWaalsContact O-CG 3.27Å; I17-L21 WeakPolarHBondContact O-CG 3.5Å; I17-L21 PolarHBondContact O-N 3.1Å; A18-L21 PolarHBondContact O-N 3.41Å; L21-S24 PolarHBondContact O-N 3.5Å; L21-S24 PolarHBondContact O-OG 2.95Å; L21-I27 HydrophobicContact CB-CD1 3.94Å; L21-I27 HydrophobicContact CD1-CD1 3.84Å; L21-I27 HydrophobicContact CD2-CD1 3.73Å; L21-I27 HydrophobicContact CG-CD1 4.03Å; L21-Y53 HydrophobicContact CB-CD1 4.03Å; L21-A56 HydrophobicContact CD1-CB 4.04Å; L21-A57 HydrophobicContact CD1-CB 4.48Å; L21-L106 HydrophobicContact CD1-CD2 4.46Å; L21-M109 HydrophobicContact CD2-CE 3.91Å; L21-M109 HydrophobicContact CD2-SD 3.58Å; L21-M109 VanDerWaalsContact CD2-SD 3.58Å; L21-W111 HydrophobicContact CD2-CE3 4.38Å; L21-W111 HydrophobicContact CD2-CH2 3.94Å; L21-W111 HydrophobicContact CD2-CZ3 3.8Å; L21-W111 HydrophobicContact CG-CZ3 4.4Å
22K93.4Very high92.4Very high104 Ų10463 Ų6345%0.45233%0.328SS..Hα-helixtrans-60.8-46.8174.7-176.1169.8178.6160.70112.2A18 A19 F20 S24 G25 D50 Y53A18-K22 PolarHBondContact O-N 3.47Å; A19-K22 PolarHBondContact O-N 3.06Å; F20-K22 VanDerWaalsContact C-N 3.33Å; F20-K22 PolarHBondContact O-N 3.49Å; K22-S24 VanDerWaalsContact C-N 3.27Å; K22-S24 PolarHBondContact O-N 3.4Å; K22-G25 PolarHBondContact O-N 3.41Å; K22-D50 IonicContact NZ-OD1 2.78Å; K22-D50 PolarHBondContact NZ-OD1 3.38Å; K22-D50 IonicContact NZ-OD2 3.51Å; K22-D50 PolarHBondContact NZ-OD2 3.32Å; K22-Y53 HydrophobicContact CB-CD2 4.4Å; K22-Y53 HydrophobicContact CB-CE2 4.4Å; K22-Y53 HydrophobicContact CB-CG 4.46Å; K22-Y53 HydrophobicContact CG-CE2 4.33Å
23K94.3Very high92.4Very high180 Ų18060.7 Ų60.778%0.78332%0.316SS*.Hα-helixtrans-64-31.2177.8-73.3174.7-177.2179.10113.3A19 F20 G25A19-K23 VanDerWaalsContact O-CG 3.31Å; A19-K23 WeakPolarHBondContact O-CG 3.4Å; A19-K23 PolarHBondContact O-N 3.3Å; F20-K23 PolarHBondContact O-N 2.65Å; K23-G25 VanDerWaalsContact C-N 3.29Å; K23-G25 PolarHBondContact O-N 2.91Å
24S90.5Very high92.2Very high35 Ų3566.9 Ų66.925%0.24535%0.349CS..Hα-helixtrans-70-25.4-177.277.10000113.6F20 L21 K22 R26 M109F20-S24 WeakPolarHBondContact O-CB 3.25Å; F20-S24 PolarHBondContact O-N 3.27Å; L21-S24 PolarHBondContact O-N 3.5Å; L21-S24 PolarHBondContact O-OG 2.95Å; K22-S24 VanDerWaalsContact C-N 3.27Å; K22-S24 PolarHBondContact O-N 3.4Å; S24-R26 WeakPolarHBondContact O-CG 3.29Å; S24-R26 PolarHBondContact O-N 3.1Å; S24-R26 PolarHBondContact OG-N 3.06Å; S24-M109 VanDerWaalsContact OG-CE 3.24Å; S24-M109 WeakPolarHBondContact OG-CE 3.49Å
25G88.6Confident92.1Very high63 Ų6373.2 Ų73.265%0.64938%0.382SS*.  trans61.88.3-178.100000115.3K22 K23K22-G25 PolarHBondContact O-N 3.41Å; K23-G25 VanDerWaalsContact C-N 3.29Å; K23-G25 PolarHBondContact O-N 2.91Å
26R87.7Confident92Very high167 Ų16771 Ų7163%0.6337%0.371SS*.  trans-87.6-13.1-175-60-169.3-175.5167.50.4114.3S24 M109S24-R26 WeakPolarHBondContact O-CG 3.29Å; S24-R26 PolarHBondContact O-N 3.1Å; S24-R26 PolarHBondContact OG-N 3.06Å; R26-M109 HydrophobicContact CB-CE 4.2Å; R26-M109 HydrophobicContact CB-CG 4.29Å; R26-M109 HydrophobicContact CG-CE 4.44Å
27I88.5Confident92Very high11 Ų1172.7 Ų72.76%0.05638%0.378CS..SBendtrans-85.5120.8179.6-75.5174.9000108.7L21 L29 F52 Y53 A105L21-I27 HydrophobicContact CB-CD1 3.94Å; L21-I27 HydrophobicContact CD1-CD1 3.84Å; L21-I27 HydrophobicContact CD2-CD1 3.73Å; L21-I27 HydrophobicContact CG-CD1 4.03Å; I27-L29 PolarHBondContact O-N 3.42Å; I27-F52 HydrophobicContact CG2-CD1 4.25Å; I27-F52 HydrophobicContact CG2-CE1 3.89Å; I27-Y53 HydrophobicContact CB-CE1 4.16Å; I27-Y53 HydrophobicContact CD1-CD1 4.25Å; I27-Y53 HydrophobicContact CD1-CE1 4.47Å; I27-Y53 HydrophobicContact CG2-CE1 4.14Å; I27-A105 HydrophobicContact CG1-CB 4.4Å; I27-A105 HydrophobicContact CG2-CB 4.07Å
28T86.6Confident92Very high81 Ų8173.1 Ų73.150%0.49738%0.381SS..  trans-71.5111.4167.746.60000108.9P30 E108T28-P30 WeakPolarHBondContact O-CD 3.5Å; T28-E108 PolarHBondContact OG1-OE2 2.98Å; T28-E108 VanDerWaalsContact OG1-OE2 3.06Å
29L90.4Very high91.9Very high83 Ų8372.7 Ų72.744%0.43538%0.377SS..  trans-74.1128.3173-79.3164.5000109.1I27 V33 F52 Y53I27-L29 PolarHBondContact O-N 3.42Å; L29-V33 HydrophobicContact CD2-CG1 4.47Å; L29-V33 HydrophobicContact CD2-CG2 4.23Å; L29-F52 HydrophobicContact CD2-CB 4.07Å; L29-F52 HydrophobicContact CD2-CD1 3.82Å; L29-F52 HydrophobicContact CD2-CG 4.12Å; L29-Y53 HydrophobicContact CD1-CE2 4.37Å; L29-Y53 VanDerWaalsContact CD1-OH 3.31Å; L29-Y53 WeakPolarHBondContact CD1-OH 3.47Å; L29-Y53 HydrophobicContact CD2-CE2 4.24Å
30P92.2Very high91.8Very high22 Ų2273.9 Ų73.914%0.14338%0.382CS..  trans-64.5144.3170.5-19.929.5000112.2T28 W32 V33 F52 K101T28-P30 WeakPolarHBondContact O-CD 3.5Å; P30-W32 HydrophobicContact CB-CD2 3.87Å; P30-W32 HydrophobicContact CB-CE3 4.27Å; P30-W32 HydrophobicContact CB-CG 4.41Å; P30-W32 HydrophobicContact CB-CH2 4.06Å; P30-W32 HydrophobicContact CB-CZ2 3.7Å; P30-W32 HydrophobicContact CB-CZ3 4.33Å; P30-W32 HydrophobicContact CG-CH2 3.99Å; P30-W32 HydrophobicContact CG-CZ2 3.94Å; P30-W32 HydrophobicContact CG-CZ3 4.46Å; P30-W32 PolarHBondContact O-N 2.91Å; P30-V33 HydrophobicContact CB-CG2 4.06Å; P30-V33 HydrophobicContact CG-CG2 4.08Å; P30-V33 WeakPolarHBondContact O-CB 3.29Å; P30-V33 WeakPolarHBondContact O-CG2 3.48Å; P30-V33 PolarHBondContact O-N 3.38Å; P30-V33 VanDerWaalsContact O-N 3.15Å; P30-F52 HydrophobicContact CG-CE2 3.92Å; P30-F52 HydrophobicContact CG-CZ 3.9Å; P30-K101 HydrophobicContact CG-CB 4.19Å; P30-K101 HydrophobicContact CG-CG 4.37Å
31D92.3Very high91.8Very high162 Ų16272 Ų7287%0.86637%0.373SS*.THydrogen-bonded Turntrans-58-27.9-177.6-48.8-34.8000114
32W92.8Very high91.9Very high77 Ų7776.5 Ų76.529%0.29239%0.392SS..THydrogen-bonded Turntrans-89.84.1-175.548.4-108.3000114.6P30 D34 L35 V36 W51 I98 K101P30-W32 HydrophobicContact CB-CD2 3.87Å; P30-W32 HydrophobicContact CB-CE3 4.27Å; P30-W32 HydrophobicContact CB-CG 4.41Å; P30-W32 HydrophobicContact CB-CH2 4.06Å; P30-W32 HydrophobicContact CB-CZ2 3.7Å; P30-W32 HydrophobicContact CB-CZ3 4.33Å; P30-W32 HydrophobicContact CG-CH2 3.99Å; P30-W32 HydrophobicContact CG-CZ2 3.94Å; P30-W32 HydrophobicContact CG-CZ3 4.46Å; P30-W32 PolarHBondContact O-N 2.91Å; W32-D34 PolarHBondContact O-N 2.92Å; W32-D34 VanDerWaalsContact O-N 3.13Å; W32-L35 PolarHBondContact O-N 3.24Å; W32-V36 HydrophobicContact CB-CG1 4.2Å; W32-V36 HydrophobicContact CD2-CG1 4.26Å; W32-V36 HydrophobicContact CE3-CB 4.27Å; W32-V36 HydrophobicContact CE3-CG1 3.78Å; W32-V36 HydrophobicContact CE3-CG2 3.48Å; W32-V36 VanDerWaalsContact CE3-CG2 3.48Å; W32-V36 HydrophobicContact CG-CG1 4.46Å; W32-V36 HydrophobicContact CZ3-CG2 3.71Å; W32-V36 WeakPolarHBondContact O-CG1 3.47Å; W32-V36 PolarHBondContact O-N 3.07Å; W32-W51 HydrophobicContact CZ3-CH2 4.39Å; W32-I98 HydrophobicContact CH2-CB 4.42Å; W32-I98 HydrophobicContact CH2-CG1 3.84Å; W32-I98 HydrophobicContact CZ3-CG1 3.86Å; W32-K101 HydrophobicContact CH2-CB 4.42Å; W32-K101 HydrophobicContact CH2-CG 4.38Å; W32-K101 HydrophobicContact CZ2-CB 4.36Å; W32-K101 HydrophobicContact CZ2-CG 3.84Å
33V92.1Very high91.9Very high7 Ų778.1 Ų78.14%0.04240%0.401CS..THydrogen-bonded Turntrans-54.1-35.9-172.3163.80000113L29 P30 W51 F52L29-V33 HydrophobicContact CD2-CG1 4.47Å; L29-V33 HydrophobicContact CD2-CG2 4.23Å; P30-V33 HydrophobicContact CB-CG2 4.06Å; P30-V33 HydrophobicContact CG-CG2 4.08Å; P30-V33 WeakPolarHBondContact O-CB 3.29Å; P30-V33 WeakPolarHBondContact O-CG2 3.48Å; P30-V33 PolarHBondContact O-N 3.38Å; P30-V33 VanDerWaalsContact O-N 3.15Å; V33-W51 HydrophobicContact CG1-CZ2 4.02Å; V33-W51 WeakPolarHBondContact O-CZ2 3.45Å; V33-W51 PolarHBondContact O-NE1 3.12Å; V33-F52 HydrophobicContact CG1-CB 4.2Å; V33-F52 HydrophobicContact CG2-CB 4.43Å; V33-F52 HydrophobicContact CG2-CD2 3.98Å; V33-F52 HydrophobicContact CG2-CG 4.24Å
34D89.7Confident91.8Very high131 Ų13176.3 Ų76.370%0.70140%0.4SS*.THydrogen-bonded Turntrans-83.1-15.8-176.2-57.4-35000113.5W32W32-D34 PolarHBondContact O-N 2.92Å; W32-D34 VanDerWaalsContact O-N 3.13Å
35L91.6Very high91.9Very high152 Ų15277.3 Ų77.380%0.79641%0.41SS*.THydrogen-bonded Turntrans-96.2-22.3-173.9-60.9174.9000112.9W32W32-L35 PolarHBondContact O-N 3.24Å
36V93.3Very high92.2Very high39 Ų3976.3 Ų76.324%0.23639%0.392CS..  trans-95.4145.2-166.8-63.10000113.6W32 W51 I98W32-V36 HydrophobicContact CB-CG1 4.2Å; W32-V36 HydrophobicContact CD2-CG1 4.26Å; W32-V36 HydrophobicContact CE3-CB 4.27Å; W32-V36 HydrophobicContact CE3-CG1 3.78Å; W32-V36 HydrophobicContact CE3-CG2 3.48Å; W32-V36 VanDerWaalsContact CE3-CG2 3.48Å; W32-V36 HydrophobicContact CG-CG1 4.46Å; W32-V36 HydrophobicContact CZ3-CG2 3.71Å; W32-V36 WeakPolarHBondContact O-CG1 3.47Å; W32-V36 PolarHBondContact O-N 3.07Å; V36-W51 HydrophobicContact CG2-CH2 4.03Å; V36-W51 HydrophobicContact CG2-CZ2 3.7Å; V36-I98 HydrophobicContact CG2-CD1 4.07Å
37K94.2Very high92.5Very high90 Ų9075.4 Ų75.439%0.39141%0.405SS..  trans-82.5147158.662.2177.1-178.9178.10111.3A39 P40 K42 I98K37-A39 VanDerWaalsContact C-N 3.28Å; K37-A39 WeakPolarHBondContact CD-O 3.18Å; K37-A39 PolarHBondContact O-N 3.29Å; K37-P40 PolarHBondContact NZ-O 3.01Å; K37-K42 WeakPolarHBondContact CD-O 3.35Å; K37-K42 PolarHBondContact NZ-O 2.78Å; K37-I98 WeakPolarHBondContact O-CD1 3.38Å
38T94.2Very high92.7Very high9 Ų978.2 Ų78.26%0.05542%0.42CS..SBendtrans-68.9-23.8-175.352.90000114.7P46 W51 S95T38-P46 HydrophobicContact CG2-CG 3.5Å; T38-P46 VanDerWaalsContact CG2-CG 3.5Å; T38-W51 HydrophobicContact CG2-CD2 4.24Å; T38-W51 HydrophobicContact CG2-CE3 3.67Å; T38-W51 HydrophobicContact CG2-CH2 4.28Å; T38-W51 HydrophobicContact CG2-CZ3 3.72Å; T38-S95 WeakPolarHBondContact O-CB 3.46Å
39A94.7Very high93Very high2 Ų278.8 Ų78.82%0.01743%0.426CS..SBendtrans-154.9156.5179.500000111.8K37 Y41 K42 A94K37-A39 VanDerWaalsContact C-N 3.28Å; K37-A39 WeakPolarHBondContact CD-O 3.18Å; K37-A39 PolarHBondContact O-N 3.29Å; A39-Y41 HydrophobicContact CB-CD1 3.44Å; A39-Y41 VanDerWaalsContact CB-CD1 3.44Å; A39-Y41 HydrophobicContact CB-CE1 3.15Å; A39-Y41 HydrophobicContact CB-CE2 4.38Å; A39-Y41 HydrophobicContact CB-CG 4.17Å; A39-Y41 PolarHBondContact O-N 3.05Å; A39-K42 HydrophobicContact CB-CG 4.36Å; A39-K42 PolarHBondContact O-N 3.11Å; A39-K42 VanDerWaalsContact O-N 3.15Å; A39-A94 HydrophobicContact CB-CB 4.36Å
40P93.1Very high93.1Very high63 Ų6377.2 Ų77.241%0.40942%0.417SS..THydrogen-bonded Turntrans-56.6-36.6177.1-24.834.3000113.3K37 K42 V92K37-P40 PolarHBondContact NZ-O 3.01Å; P40-K42 VanDerWaalsContact C-N 3.25Å; P40-K42 PolarHBondContact O-N 2.97Å; P40-V92 HydrophobicContact CB-CG1 4.46Å
41Y94.7Very high93.2Very high33 Ų3376.8 Ų76.813%0.12941%0.413CS..THydrogen-bonded Turntrans-75.7-7.2-177.469.2-101.1000114.6A39 F78 G80A39-Y41 HydrophobicContact CB-CD1 3.44Å; A39-Y41 VanDerWaalsContact CB-CD1 3.44Å; A39-Y41 HydrophobicContact CB-CE1 3.15Å; A39-Y41 HydrophobicContact CB-CE2 4.38Å; A39-Y41 HydrophobicContact CB-CG 4.17Å; A39-Y41 PolarHBondContact O-N 3.05Å; Y41-F78 PolarHBondContact OH-O 3.49Å; Y41-G80 VanDerWaalsContact CE1-N 3.29Å
42K94.5Very high93.4Very high95 Ų9569.1 Ų69.141%0.41337%0.372SS..  trans-85.4138.5173.5-68-66.9-168.41770109.1K37 A39 P40K37-K42 WeakPolarHBondContact CD-O 3.35Å; K37-K42 PolarHBondContact NZ-O 2.78Å; A39-K42 HydrophobicContact CB-CG 4.36Å; A39-K42 PolarHBondContact O-N 3.11Å; A39-K42 VanDerWaalsContact O-N 3.15Å; P40-K42 VanDerWaalsContact C-N 3.25Å; P40-K42 PolarHBondContact O-N 2.97Å
43E92.8Very high93.5Very high138 Ų13866.6 Ų66.665%0.64536%0.363SS*.SBendtrans-81.6-40.6173.1-59.3-56.5150.500111.1
44L93.1Very high93.7Very high143 Ų14368.6 Ų68.675%0.74937%0.372SS*.SBendtrans-114158.3-175.3-60.3175.7000112.2
45A92.5Very high94Very high55 Ų5564.9 Ų64.946%0.45535%0.349SS..  trans-69.6161.4170.200000111.3
46P95.3Very high94.1Very high42 Ų4257.7 Ų57.727%0.27331%0.311SS..  trans-59.3139.3172.8-22.135.5000111.9T38 W51T38-P46 HydrophobicContact CG2-CG 3.5Å; T38-P46 VanDerWaalsContact CG2-CG 3.5Å; P46-W51 HydrophobicContact CB-CB 3.65Å; P46-W51 HydrophobicContact CB-CD2 4.35Å; P46-W51 HydrophobicContact CB-CG 3.63Å; P46-W51 HydrophobicContact CG-CB 4.06Å; P46-W51 HydrophobicContact CG-CD2 3.81Å; P46-W51 HydrophobicContact CG-CE3 4.42Å; P46-W51 HydrophobicContact CG-CG 3.63Å
47T93.9Very high94.3Very high149 Ų14955.8 Ų55.891%0.91430%0.3SS*.SBendtrans-73.3-31.4178-43.60000112.6
48D93.2Very high94.3Very high69 Ų6952.7 Ų52.737%0.36929%0.291SS..SBendtrans-84.5123.2179.3-172.3-22.4000109.9D50 W51 I54D48-D50 PolarHBondContact O-N 2.85Å; D48-D50 WeakPolarHBondContact OD1-CA 3.38Å; D48-D50 WeakPolarHBondContact OD1-CB 3.45Å; D48-D50 PolarHBondContact OD1-N 2.98Å; D48-W51 VanDerWaalsContact O-CB 3.31Å; D48-W51 WeakPolarHBondContact O-CB 3.33Å; D48-W51 VanDerWaalsContact O-CD1 3.23Å; D48-W51 PolarHBondContact O-N 3.41Å; D48-I54 WeakPolarHBondContact OD2-CD1 3.41Å
49P91.6Very high94.4Very high94 Ų9452.3 Ų52.361%0.6129%0.288SS*.THydrogen-bonded Turntrans-63.4-27.7176.227.5-35.4000112.6W51P49-W51 PolarHBondContact O-N 3.17Å
50D92.7Very high94.4Very high49 Ų4952.2 Ų52.226%0.26229%0.287SS..THydrogen-bonded Turntrans-85.414.9-179.6-65.1-41.3000112.9K22 D48 F52 Y53 I54K22-D50 IonicContact NZ-OD1 2.78Å; K22-D50 PolarHBondContact NZ-OD1 3.38Å; K22-D50 IonicContact NZ-OD2 3.51Å; K22-D50 PolarHBondContact NZ-OD2 3.32Å; D48-D50 PolarHBondContact O-N 2.85Å; D48-D50 WeakPolarHBondContact OD1-CA 3.38Å; D48-D50 WeakPolarHBondContact OD1-CB 3.45Å; D48-D50 PolarHBondContact OD1-N 2.98Å; D50-F52 PolarHBondContact O-N 3.36Å; D50-Y53 HydrophobicContact CB-CD2 4Å; D50-Y53 WeakPolarHBondContact O-CB 3.49Å; D50-Y53 PolarHBondContact O-N 3.08Å; D50-I54 PolarHBondContact O-N 2.95Å
51W94.9Very high94.4Very high14 Ų1451.5 Ų51.55%0.05328%0.277CS..Hα-helixtrans-55.9-28.9-175.770.5-93.7000113.6W32 V33 V36 T38 P46 D48 P49 I54 R55 I98W32-W51 HydrophobicContact CZ3-CH2 4.39Å; V33-W51 HydrophobicContact CG1-CZ2 4.02Å; V33-W51 WeakPolarHBondContact O-CZ2 3.45Å; V33-W51 PolarHBondContact O-NE1 3.12Å; V36-W51 HydrophobicContact CG2-CH2 4.03Å; V36-W51 HydrophobicContact CG2-CZ2 3.7Å; T38-W51 HydrophobicContact CG2-CD2 4.24Å; T38-W51 HydrophobicContact CG2-CE3 3.67Å; T38-W51 HydrophobicContact CG2-CH2 4.28Å; T38-W51 HydrophobicContact CG2-CZ3 3.72Å; P46-W51 HydrophobicContact CB-CB 3.65Å; P46-W51 HydrophobicContact CB-CD2 4.35Å; P46-W51 HydrophobicContact CB-CG 3.63Å; P46-W51 HydrophobicContact CG-CB 4.06Å; P46-W51 HydrophobicContact CG-CD2 3.81Å; P46-W51 HydrophobicContact CG-CE3 4.42Å; P46-W51 HydrophobicContact CG-CG 3.63Å; D48-W51 VanDerWaalsContact O-CB 3.31Å; D48-W51 WeakPolarHBondContact O-CB 3.33Å; D48-W51 VanDerWaalsContact O-CD1 3.23Å; D48-W51 PolarHBondContact O-N 3.41Å; P49-W51 PolarHBondContact O-N 3.17Å; W51-I54 PolarHBondContact O-N 3.17Å; W51-R55 WeakPolarHBondContact O-CB 3.44Å; W51-R55 PolarHBondContact O-N 2.97Å; W51-I98 HydrophobicContact CH2-CD1 3.94Å; W51-I98 HydrophobicContact CH2-CG1 4.3Å; W51-I98 HydrophobicContact CH2-CG2 3.75Å; W51-I98 HydrophobicContact CZ3-CD1 4.44Å; W51-I98 HydrophobicContact CZ3-CG2 3.58Å
52F95.7Very high94.4Very high1 Ų151.3 Ų51.30%0.00428%0.277CS..Hα-helixtrans-65.5-40.8179-169.7-95.6000111.6I27 L29 P30 V33 D50 R55 A56 K101 C102I27-F52 HydrophobicContact CG2-CD1 4.25Å; I27-F52 HydrophobicContact CG2-CE1 3.89Å; L29-F52 HydrophobicContact CD2-CB 4.07Å; L29-F52 HydrophobicContact CD2-CD1 3.82Å; L29-F52 HydrophobicContact CD2-CG 4.12Å; P30-F52 HydrophobicContact CG-CE2 3.92Å; P30-F52 HydrophobicContact CG-CZ 3.9Å; V33-F52 HydrophobicContact CG1-CB 4.2Å; V33-F52 HydrophobicContact CG2-CB 4.43Å; V33-F52 HydrophobicContact CG2-CD2 3.98Å; V33-F52 HydrophobicContact CG2-CG 4.24Å; D50-F52 PolarHBondContact O-N 3.36Å; F52-R55 WeakPolarHBondContact O-CB 3.38Å; F52-R55 PolarHBondContact O-N 3.48Å; F52-A56 PolarHBondContact O-N 3.46Å; F52-K101 HydrophobicContact CE2-CB 4.5Å; F52-K101 HydrophobicContact CZ-CB 4.38Å; F52-C102 WeakPolarHBondContact CE2-SG 3.44Å; F52-C102 HydrophobicContact CZ-CB 4.41Å
53Y95.7Very high94.4Very high24 Ų2446.9 Ų46.99%0.09426%0.258CS..Hα-helixtrans-66-41.8175.7-61.5-70.7000111.4L21 K22 I27 L29 D50 R55 A56 A57L21-Y53 HydrophobicContact CB-CD1 4.03Å; K22-Y53 HydrophobicContact CB-CD2 4.4Å; K22-Y53 HydrophobicContact CB-CE2 4.4Å; K22-Y53 HydrophobicContact CB-CG 4.46Å; K22-Y53 HydrophobicContact CG-CE2 4.33Å; I27-Y53 HydrophobicContact CB-CE1 4.16Å; I27-Y53 HydrophobicContact CD1-CD1 4.25Å; I27-Y53 HydrophobicContact CD1-CE1 4.47Å; I27-Y53 HydrophobicContact CG2-CE1 4.14Å; L29-Y53 HydrophobicContact CD1-CE2 4.37Å; L29-Y53 VanDerWaalsContact CD1-OH 3.31Å; L29-Y53 WeakPolarHBondContact CD1-OH 3.47Å; L29-Y53 HydrophobicContact CD2-CE2 4.24Å; D50-Y53 HydrophobicContact CB-CD2 4Å; D50-Y53 WeakPolarHBondContact O-CB 3.49Å; D50-Y53 PolarHBondContact O-N 3.08Å; Y53-R55 VanDerWaalsContact C-N 3.3Å; Y53-R55 PolarHBondContact O-N 3.5Å; Y53-A56 PolarHBondContact O-N 3.28Å; Y53-A57 VanDerWaalsContact O-CB 3.31Å; Y53-A57 WeakPolarHBondContact O-CB 3.47Å; Y53-A57 PolarHBondContact O-N 3.07Å
54I95.8Very high94.4Very high48 Ų4841 Ų4125%0.24623%0.23CC..Hα-helixtrans-61.5-41.1175.2-60.8174.8000110.4V14 A18 D48 D50 W51 A57 A58V14-I54 HydrophobicContact CG1-CG2 4.02Å; A18-I54 HydrophobicContact CB-CG1 3.93Å; D48-I54 WeakPolarHBondContact OD2-CD1 3.41Å; D50-I54 PolarHBondContact O-N 2.95Å; W51-I54 PolarHBondContact O-N 3.17Å; I54-A57 PolarHBondContact O-N 3.3Å; I54-A58 WeakPolarHBondContact O-CB 3.42Å; I54-A58 PolarHBondContact O-N 3.49Å
55R95.4Very high94.3Very high54 Ų5437.6 Ų37.620%0.20421%0.212CC..Hα-helixtrans-62.8-46.8176.2-163.1117.4-50.8-170.78.5111.7W51 F52 Y53 A58 I59W51-R55 WeakPolarHBondContact O-CB 3.44Å; W51-R55 PolarHBondContact O-N 2.97Å; F52-R55 WeakPolarHBondContact O-CB 3.38Å; F52-R55 PolarHBondContact O-N 3.48Å; Y53-R55 VanDerWaalsContact C-N 3.3Å; Y53-R55 PolarHBondContact O-N 3.5Å; R55-A58 PolarHBondContact O-N 3Å; R55-I59 HydrophobicContact CG-CD1 4.22Å; R55-I59 VanDerWaalsContact O-CG1 3.32Å; R55-I59 WeakPolarHBondContact O-CG1 3.32Å; R55-I59 PolarHBondContact O-N 3.14Å
56A95.4Very high94.2Very high0 Ų043.2 Ų43.20%022%0.221CC..Hα-helixtrans-61.7-44177.500000111.5L21 F52 Y53 A58 I59 A60 C102 L106L21-A56 HydrophobicContact CD1-CB 4.04Å; F52-A56 PolarHBondContact O-N 3.46Å; Y53-A56 PolarHBondContact O-N 3.28Å; A56-A58 PolarHBondContact O-N 2.96Å; A56-I59 PolarHBondContact O-N 3.4Å; A56-A60 WeakPolarHBondContact O-CB 3.5Å; A56-A60 PolarHBondContact O-N 3.46Å; A56-C102 HydrophobicContact CB-CB 4.44Å; A56-L106 HydrophobicContact CB-CD1 4.22Å; A56-L106 HydrophobicContact CB-CD2 4.37Å; A56-L106 HydrophobicContact CB-CG 4.33Å
57A95.9Very high93.7Very high0 Ų044.1 Ų44.10%023%0.228CC..Hα-helixtrans-59.4-46.6175.500000112.6V14 I17 A18 L21 Y53 I54 I59 A60 R61V14-A57 HydrophobicContact CG1-CB 3.96Å; V14-A57 WeakPolarHBondContact O-CB 3.38Å; I17-A57 HydrophobicContact CB-CB 3.77Å; I17-A57 HydrophobicContact CG2-CB 3.55Å; A18-A57 HydrophobicContact CB-CB 4.2Å; L21-A57 HydrophobicContact CD1-CB 4.48Å; Y53-A57 VanDerWaalsContact O-CB 3.31Å; Y53-A57 WeakPolarHBondContact O-CB 3.47Å; Y53-A57 PolarHBondContact O-N 3.07Å; I54-A57 PolarHBondContact O-N 3.3Å; A57-I59 VanDerWaalsContact C-N 3.32Å; A57-I59 PolarHBondContact O-N 3.44Å; A57-A60 PolarHBondContact O-N 3.14Å; A57-R61 PolarHBondContact O-N 3.48Å
58A95.8Very high93.7Very high25 Ų2540 Ų4021%0.20720%0.204CC..Hα-helixtrans-62.2-39.2177.600000112.3V14 I54 R55 A56 H62 F78V14-A58 HydrophobicContact CG1-CB 4.39Å; I54-A58 WeakPolarHBondContact O-CB 3.42Å; I54-A58 PolarHBondContact O-N 3.49Å; R55-A58 PolarHBondContact O-N 3Å; A56-A58 PolarHBondContact O-N 2.96Å; A58-H62 WeakPolarHBondContact O-CB 3.4Å; A58-H62 PolarHBondContact O-N 3.46Å; A58-F78 HydrophobicContact CB-CE1 4.23Å; A58-F78 HydrophobicContact CB-CZ 4.14Å
59I95.4Very high93.6Very high0 Ų037 Ų370%019%0.189CC..Hα-helixtrans-65.1-47175.3-73168.9000111R55 A56 A57 R61 H62 L63 F74 F78 C102 L103 L106R55-I59 HydrophobicContact CG-CD1 4.22Å; R55-I59 VanDerWaalsContact O-CG1 3.32Å; R55-I59 WeakPolarHBondContact O-CG1 3.32Å; R55-I59 PolarHBondContact O-N 3.14Å; A56-I59 PolarHBondContact O-N 3.4Å; A57-I59 VanDerWaalsContact C-N 3.32Å; A57-I59 PolarHBondContact O-N 3.44Å; I59-R61 PolarHBondContact O-N 2.91Å; I59-H62 PolarHBondContact O-N 2.95Å; I59-L63 HydrophobicContact CG2-CD1 4.37Å; I59-L63 PolarHBondContact O-N 3.41Å; I59-F74 HydrophobicContact CB-CE1 4.43Å; I59-F74 HydrophobicContact CG1-CD1 4.19Å; I59-F74 HydrophobicContact CG1-CE1 4.31Å; I59-F74 HydrophobicContact CG2-CE1 4.03Å; I59-F74 HydrophobicContact CG2-CE2 4.24Å; I59-F74 HydrophobicContact CG2-CZ 3.85Å; I59-F78 HydrophobicContact CD1-CE2 4.26Å; I59-F78 HydrophobicContact CG1-CE2 3.64Å; I59-F78 HydrophobicContact CG1-CZ 3.9Å; I59-C102 HydrophobicContact CD1-CB 3.72Å; I59-L103 HydrophobicContact CG2-CD2 3.32Å; I59-L103 HydrophobicContact CG2-CG 4.04Å; I59-L106 HydrophobicContact CG2-CD1 4.23Å
60A94.4Very high93.6Very high0 Ų033.6 Ų33.60%017%0.171CC..Hα-helixtrans-59.7-45.3178.800000111.4A56 A57 H62 L63 Y64 L106A56-A60 WeakPolarHBondContact O-CB 3.5Å; A56-A60 PolarHBondContact O-N 3.46Å; A57-A60 PolarHBondContact O-N 3.14Å; A60-H62 PolarHBondContact O-N 3.4Å; A60-L63 PolarHBondContact O-N 2.92Å; A60-Y64 PolarHBondContact O-N 2.97Å; A60-Y64 VanDerWaalsContact O-N 3.17Å; A60-L106 HydrophobicContact CB-CD1 4.32Å
61R94.4Very high93.7Very high48 Ų4832.6 Ų32.618%0.18117%0.167CC..Hα-helixtrans-60.4-44.9173.7-178.7-175.5171.1-98.2-2.5111.7Q10 V14 A57 I59 L63 Y64 I65Q10-R61 VanDerWaalsContact CB-NH2 3.28Å; V14-R61 HydrophobicContact CG2-CB 4.47Å; A57-R61 PolarHBondContact O-N 3.48Å; I59-R61 PolarHBondContact O-N 2.91Å; R61-L63 VanDerWaalsContact C-N 3.29Å; R61-L63 PolarHBondContact O-N 3.3Å; R61-Y64 VanDerWaalsContact O-CB 3.29Å; R61-Y64 WeakPolarHBondContact O-CB 3.31Å; R61-Y64 PolarHBondContact O-N 3.21Å; R61-Y64 VanDerWaalsContact O-N 3.12Å; R61-I65 HydrophobicContact CG-CD1 4.39Å; R61-I65 PolarHBondContact O-N 3.1Å
62H94.2Very high93.7Very high30 Ų3034.1 Ų34.114%0.13919%0.187CC..Hα-helixtrans-61.3-40.3-179.7-176.6-73.8000111.6A58 I59 A60 Y64 I65 R66 F74A58-H62 WeakPolarHBondContact O-CB 3.4Å; A58-H62 PolarHBondContact O-N 3.46Å; I59-H62 PolarHBondContact O-N 2.95Å; A60-H62 PolarHBondContact O-N 3.4Å; H62-Y64 VanDerWaalsContact C-N 3.28Å; H62-Y64 PolarHBondContact O-N 2.92Å; H62-I65 PolarHBondContact O-N 3.43Å; H62-R66 PolarHBondContact O-N 3.24Å; H62-F74 HydrophobicContact CB-CE1 3.98Å; H62-F74 AromaticContact CG-CE1 3.85Å; H62-F74 AromaticContact ND1-CE1 3.58Å
63L93.7Very high93.6Very high1 Ų136.2 Ų36.21%0.00520%0.204CC..Hα-helixtrans-63.6-32.2175.2-74.6171.6000113.3I59 A60 R61 I65 S67 A69 F74 L103 I112 R121I59-L63 HydrophobicContact CG2-CD1 4.37Å; I59-L63 PolarHBondContact O-N 3.41Å; A60-L63 PolarHBondContact O-N 2.92Å; R61-L63 VanDerWaalsContact C-N 3.29Å; R61-L63 PolarHBondContact O-N 3.3Å; L63-I65 VanDerWaalsContact C-N 3.29Å; L63-I65 PolarHBondContact O-N 2.9Å; L63-S67 WeakPolarHBondContact O-CB 3.4Å; L63-A69 HydrophobicContact CD2-CB 3.79Å; L63-F74 HydrophobicContact CD1-CZ 4.4Å; L63-F74 HydrophobicContact CD2-CE2 4.34Å; L63-F74 HydrophobicContact CD2-CZ 3.82Å; L63-F74 HydrophobicContact CG-CZ 3.83Å; L63-L103 HydrophobicContact CD1-CD2 4.22Å; L63-I112 HydrophobicContact CD1-CD1 3.28Å; L63-I112 HydrophobicContact CD1-CG1 3.83Å; L63-I112 HydrophobicContact CD1-CG2 4.3Å; L63-R121 WeakPolarHBondContact CD2-O 3.4Å
64Y93.3Very high93.6Very high16 Ų1635 Ų356%0.06320%0.2CC..Hα-helixtrans-62.1-39.3174.1-169.4-77000111.8A5 K6 A60 R61 H62 L123 R128 L131 D132A5-Y64 HydrophobicContact CB-CD1 3.97Å; A5-Y64 HydrophobicContact CB-CD2 4.01Å; A5-Y64 HydrophobicContact CB-CE1 3.91Å; A5-Y64 HydrophobicContact CB-CE2 3.87Å; A5-Y64 HydrophobicContact CB-CG 4.06Å; K6-Y64 HydrophobicContact CD-CE1 4.42Å; K6-Y64 HydrophobicContact CG-CD1 4.27Å; K6-Y64 HydrophobicContact CG-CE1 3.95Å; A60-Y64 PolarHBondContact O-N 2.97Å; A60-Y64 VanDerWaalsContact O-N 3.17Å; R61-Y64 VanDerWaalsContact O-CB 3.29Å; R61-Y64 WeakPolarHBondContact O-CB 3.31Å; R61-Y64 PolarHBondContact O-N 3.21Å; R61-Y64 VanDerWaalsContact O-N 3.12Å; H62-Y64 VanDerWaalsContact C-N 3.28Å; H62-Y64 PolarHBondContact O-N 2.92Å; Y64-L123 HydrophobicContact CD2-CD2 3.79Å; Y64-L123 HydrophobicContact CG-CD2 4.48Å; Y64-R128 HydrophobicContact CD2-CG 3.98Å; Y64-R128 HydrophobicContact CE2-CG 3.47Å; Y64-R128 VanDerWaalsContact CE2-CG 3.47Å; Y64-L131 HydrophobicContact CD2-CB 4.32Å; Y64-L131 HydrophobicContact CD2-CD1 3.97Å; Y64-D132 VanDerWaalsContact CE2-OD1 3.26Å; Y64-D132 WeakPolarHBondContact CE2-OD1 3.48Å; Y64-D132 VanDerWaalsContact CZ-OD1 3.24Å; Y64-D132 PolarHBondContact OH-OD1 2.86Å; Y64-D132 PolarHBondContact OH-OD2 3.12Å
65I91.6Very high93.6Very high71 Ų7136.7 Ų36.736%0.36420%0.203SC..Hα-helixtrans-84.7-47.2-176-57.8174.3000111.2R61 H62 L63R61-I65 HydrophobicContact CG-CD1 4.39Å; R61-I65 PolarHBondContact O-N 3.1Å; H62-I65 PolarHBondContact O-N 3.43Å; L63-I65 VanDerWaalsContact C-N 3.29Å; L63-I65 PolarHBondContact O-N 2.9Å
66R89.1Confident93.7Very high172 Ų17241.1 Ų41.165%0.64922%0.223SC*.SBendtrans-126.1104.2-177.3-67.1-176.8-178.6132.3-2.5109.6H62H62-R66 PolarHBondContact O-N 3.24Å
67S86.3Confident93.7Very high62 Ų6244.5 Ų44.543%0.43424%0.244SC..  trans-122.8141.3175.5-162.40000110L63L63-S67 WeakPolarHBondContact O-CB 3.4Å
68P92.2Very high93.7Very high61 Ų6146.3 Ų46.340%0.39625%0.252SS..SBendcis-85152.6-2.832.5-33.6000113.6K119 V122P68-K119 HydrophobicContact CG-CB 4.06Å; P68-V122 HydrophobicContact CB-CG2 4.04Å
69A92.1Very high93.7Very high7 Ų745.9 Ų45.96%0.05825%0.25CC..BIsolated β-bridgetrans-133.7140.9173.700000112.5L63 A73 F74 R121L63-A69 HydrophobicContact CD2-CB 3.79Å; A69-A73 HydrophobicContact CB-CB 4.38Å; A69-F74 HydrophobicContact CB-CE1 4.39Å; A69-F74 HydrophobicContact CB-CE2 3.72Å; A69-F74 HydrophobicContact CB-CZ 3.63Å; A69-R121 PolarHBondContact N-O 3.02Å; A69-R121 PolarHBondContact O-N 3.3Å
70G92.2Very high93.8Very high23 Ų2346.5 Ų46.524%0.23726%0.256CS..  trans-109.7175.6177.300000113G72 A73 F74G70-G72 VanDerWaalsContact C-N 3.27Å; G70-G72 PolarHBondContact O-N 3.05Å; G70-A73 WeakPolarHBondContact O-CB 3.34Å; G70-A73 PolarHBondContact O-N 3.32Å; G70-F74 WeakPolarHBondContact O-CD2 3.27Å; G70-F74 PolarHBondContact O-N 3.32Å; G70-F74 VanDerWaalsContact O-N 3.16Å
71V94.3Very high93.9Very high27 Ų2755.8 Ų55.816%0.16429%0.292CS..Hα-helixtrans-54.5-43.2179.7-179.30000111.3A73 F74 R75 I99 R100 L103V71-A73 VanDerWaalsContact C-N 3.33Å; V71-A73 PolarHBondContact O-N 2.98Å; V71-F74 PolarHBondContact O-N 2.77Å; V71-R75 HydrophobicContact CG1-CG 4.44Å; V71-R75 VanDerWaalsContact O-CG 3.32Å; V71-R75 WeakPolarHBondContact O-CG 3.46Å; V71-R75 PolarHBondContact O-N 3.1Å; V71-I99 HydrophobicContact CB-CG2 4.41Å; V71-I99 HydrophobicContact CG1-CB 4.33Å; V71-I99 HydrophobicContact CG1-CG2 3.96Å; V71-R100 HydrophobicContact CG2-CB 4.3Å; V71-L103 HydrophobicContact CG2-CD1 4.01Å
72G94Very high93.9Very high47 Ų4756 Ų5649%0.48529%0.294SS..Hα-helixtrans-62.8-35178.700000114.2G70 R75 K76G70-G72 VanDerWaalsContact C-N 3.27Å; G70-G72 PolarHBondContact O-N 3.05Å; G72-R75 PolarHBondContact O-N 2.98Å; G72-K76 PolarHBondContact O-N 2.87Å
73A94.1Very high93.9Very high44 Ų4463.5 Ų63.536%0.36432%0.322SS..Hα-helixtrans-67.8-46.9175.600000110.6A69 G70 V71 R75 K76 V77A69-A73 HydrophobicContact CB-CB 4.38Å; G70-A73 WeakPolarHBondContact O-CB 3.34Å; G70-A73 PolarHBondContact O-N 3.32Å; V71-A73 VanDerWaalsContact C-N 3.33Å; V71-A73 PolarHBondContact O-N 2.98Å; A73-R75 VanDerWaalsContact C-N 3.26Å; A73-R75 PolarHBondContact O-N 2.89Å; A73-K76 WeakPolarHBondContact O-CB 3.31Å; A73-K76 PolarHBondContact O-N 2.98Å; A73-V77 WeakPolarHBondContact O-CG2 3.12Å; A73-V77 PolarHBondContact O-N 3.05Å
74F95.9Very high93.9Very high0 Ų066.1 Ų66.10%034%0.335CS..Hα-helixtrans-62.4-32.9175.8-70.1-62.8000113I59 H62 L63 A69 G70 V71 K76 V77 F78 I99 L103I59-F74 HydrophobicContact CB-CE1 4.43Å; I59-F74 HydrophobicContact CG1-CD1 4.19Å; I59-F74 HydrophobicContact CG1-CE1 4.31Å; I59-F74 HydrophobicContact CG2-CE1 4.03Å; I59-F74 HydrophobicContact CG2-CE2 4.24Å; I59-F74 HydrophobicContact CG2-CZ 3.85Å; H62-F74 HydrophobicContact CB-CE1 3.98Å; H62-F74 AromaticContact CG-CE1 3.85Å; H62-F74 AromaticContact ND1-CE1 3.58Å; L63-F74 HydrophobicContact CD1-CZ 4.4Å; L63-F74 HydrophobicContact CD2-CE2 4.34Å; L63-F74 HydrophobicContact CD2-CZ 3.82Å; L63-F74 HydrophobicContact CG-CZ 3.83Å; A69-F74 HydrophobicContact CB-CE1 4.39Å; A69-F74 HydrophobicContact CB-CE2 3.72Å; A69-F74 HydrophobicContact CB-CZ 3.63Å; G70-F74 WeakPolarHBondContact O-CD2 3.27Å; G70-F74 PolarHBondContact O-N 3.32Å; G70-F74 VanDerWaalsContact O-N 3.16Å; V71-F74 PolarHBondContact O-N 2.77Å; F74-K76 PolarHBondContact O-N 3.41Å; F74-V77 PolarHBondContact O-N 3.28Å; F74-F78 HydrophobicContact CB-CD2 4.19Å; F74-F78 HydrophobicContact CB-CE2 4.23Å; F74-F78 AromaticContact CD1-CE2 3.9Å; F74-F78 HydrophobicContact CD1-CE2 3.9Å; F74-F78 HydrophobicContact CG-CE2 4.46Å; F74-F78 WeakPolarHBondContact O-CD2 3.41Å; F74-F78 PolarHBondContact O-N 2.92Å; F74-I99 HydrophobicContact CB-CD1 3.9Å; F74-I99 HydrophobicContact CB-CG1 4.37Å; F74-I99 HydrophobicContact CB-CG2 3.5Å; F74-I99 VanDerWaalsContact CB-CG2 3.5Å; F74-I99 HydrophobicContact CD2-CG2 4.11Å; F74-I99 HydrophobicContact CG-CG2 4.09Å; F74-L103 HydrophobicContact CD2-CD1 3.86Å; F74-L103 HydrophobicContact CD2-CD2 4.44Å; F74-L103 HydrophobicContact CE2-CD1 4.01Å; F74-L103 HydrophobicContact CE2-CD2 3.87Å; F74-L103 HydrophobicContact CE2-CG 4.49Å; F74-L103 HydrophobicContact CZ-CD2 4.45Å
75R96.5Very high93.9Very high82 Ų8268.1 Ų68.131%0.30936%0.361SS..Hα-helixtrans-61.4-33174.1-74.6179.781.2-164.7-1.9112.9V71 G72 A73 G79 L93 A94 I99V71-R75 HydrophobicContact CG1-CG 4.44Å; V71-R75 VanDerWaalsContact O-CG 3.32Å; V71-R75 WeakPolarHBondContact O-CG 3.46Å; V71-R75 PolarHBondContact O-N 3.1Å; G72-R75 PolarHBondContact O-N 2.98Å; A73-R75 VanDerWaalsContact C-N 3.26Å; A73-R75 PolarHBondContact O-N 2.89Å; R75-G79 WeakPolarHBondContact O-CA 3.36Å; R75-G79 PolarHBondContact O-N 2.89Å; R75-G79 VanDerWaalsContact O-N 3.1Å; R75-L93 HydrophobicContact CB-CB 4.26Å; R75-L93 HydrophobicContact CB-CD2 4.38Å; R75-A94 PolarHBondContact NE-O 2.97Å; R75-A94 PolarHBondContact O-N 3.44Å; R75-I99 HydrophobicContact CB-CD1 4.4Å; R75-I99 HydrophobicContact CG-CD1 3.82Å
76K96.1Very high94Very high147 Ų14770.8 Ų70.864%0.63939%0.386SS*.Hα-helixtrans-75.5-44.4173.4-68.3-178.3178.7-1750111.1G72 A73 F74 F78 G79 L93G72-K76 PolarHBondContact O-N 2.87Å; A73-K76 WeakPolarHBondContact O-CB 3.31Å; A73-K76 PolarHBondContact O-N 2.98Å; F74-K76 PolarHBondContact O-N 3.41Å; K76-F78 PolarHBondContact O-N 3.28Å; K76-G79 PolarHBondContact O-N 3.09Å; K76-G79 VanDerWaalsContact O-N 3.12Å; K76-L93 HydrophobicContact CB-CD2 4.39Å; K76-L93 HydrophobicContact CG-CD2 3.62Å
77V95.5Very high94.3Very high72 Ų7271.9 Ų71.944%0.43639%0.39SS..Hα-helixtrans-59.6-44.2179.4174.30000112.1A73 F74 G79A73-V77 WeakPolarHBondContact O-CG2 3.12Å; A73-V77 PolarHBondContact O-N 3.05Å; F74-V77 PolarHBondContact O-N 3.28Å; V77-G79 VanDerWaalsContact C-N 3.35Å
78F96.4Very high94.8Very high37 Ų3773.5 Ų73.516%0.16240%0.399CS..THydrogen-bonded Turntrans-93.87.5177.7-58.5-64.7000113.2Y41 A58 I59 F74 K76 A94 I99Y41-F78 PolarHBondContact OH-O 3.49Å; A58-F78 HydrophobicContact CB-CE1 4.23Å; A58-F78 HydrophobicContact CB-CZ 4.14Å; I59-F78 HydrophobicContact CD1-CE2 4.26Å; I59-F78 HydrophobicContact CG1-CE2 3.64Å; I59-F78 HydrophobicContact CG1-CZ 3.9Å; F74-F78 HydrophobicContact CB-CD2 4.19Å; F74-F78 HydrophobicContact CB-CE2 4.23Å; F74-F78 AromaticContact CD1-CE2 3.9Å; F74-F78 HydrophobicContact CD1-CE2 3.9Å; F74-F78 HydrophobicContact CG-CE2 4.46Å; F74-F78 WeakPolarHBondContact O-CD2 3.41Å; F74-F78 PolarHBondContact O-N 2.92Å; K76-F78 PolarHBondContact O-N 3.28Å; F78-A94 HydrophobicContact CB-CB 3.83Å; F78-A94 WeakPolarHBondContact O-CB 3.22Å; F78-I99 HydrophobicContact CD2-CD1 4.14Å; F78-I99 HydrophobicContact CD2-CG1 4.4Å
79G96.4Very high95Very high16 Ų1672.8 Ų72.817%0.16540%0.398CS..  trans-67.3164.1173.700000110.9R75 K76 V77 F91 V92R75-G79 WeakPolarHBondContact O-CA 3.36Å; R75-G79 PolarHBondContact O-N 2.89Å; R75-G79 VanDerWaalsContact O-N 3.1Å; K76-G79 PolarHBondContact O-N 3.09Å; K76-G79 VanDerWaalsContact O-N 3.12Å; V77-G79 VanDerWaalsContact C-N 3.35Å; G79-F91 VanDerWaalsContact C-CE2 3.42Å; G79-V92 VanDerWaalsContact CA-O 3.31Å; G79-V92 WeakPolarHBondContact CA-O 3.32Å
80G96.5Very high95.2Very high13 Ų1378 Ų7813%0.13442%0.422CS..EExtended strand (participates in β ladder)trans-159175.3-175.300000113Y41 F91 V92Y41-G80 VanDerWaalsContact CE1-N 3.29Å; G80-F91 WeakPolarHBondContact O-CA 3.41Å; G80-V92 PolarHBondContact N-O 3.35Å; G80-V92 PolarHBondContact O-N 3.39Å
81R96Very high95.5Very high196 Ų19682.8 Ų82.874%0.7444%0.436SS*.EExtended strand (participates in β ladder)trans-77.9122.6176.8177.1179.5145.1-141.2-3.4109.8A89R81-A89 HydrophobicContact CG-CB 3.74Å
82Q95.7Very high95.6Very high51 Ų5183.3 Ų83.324%0.23844%0.439CS..EExtended strand (participates in β ladder)trans-91.5134.1171.4-173168.4-4.400110.5N84 A89 H90 V92Q82-N84 WeakPolarHBondContact CG-OD1 3.48Å; Q82-A89 WeakPolarHBondContact O-CA 3.31Å; Q82-A89 WeakPolarHBondContact O-CB 3.41Å; Q82-H90 PolarHBondContact N-O 3.28Å; Q82-H90 PolarHBondContact O-N 2.86Å; Q82-V92 HydrophobicContact CB-CB 4.35Å; Q82-V92 HydrophobicContact CB-CG2 3.91Å; Q82-V92 VanDerWaalsContact OE1-CG2 3.28Å
83R94.3Very high95.7Very high189 Ų18983.8 Ų83.871%0.71343%0.43SS*.EExtended strand (participates in β ladder)trans-87.8113170.6-175.3-178.1-178.4-172.80.5108.6G85R83-G85 VanDerWaalsContact C-N 3.28Å; R83-G85 PolarHBondContact O-N 3.35Å
84N92.7Very high95.9Very high55 Ų5581.8 Ų81.829%0.29441%0.413SS..EExtended strand (participates in β ladder)trans-93.838.6-178-63.6-34.6000112.5Q82 S86 R87 P88Q82-N84 WeakPolarHBondContact CG-OD1 3.48Å; N84-S86 PolarHBondContact O-N 3.39Å; N84-S86 VanDerWaalsContact O-N 3.13Å; N84-R87 HydrophobicContact CB-CB 3.88Å; N84-R87 PolarHBondContact O-N 2.92Å; N84-R87 VanDerWaalsContact O-N 3.12Å; N84-P88 PolarHBondContact ND2-O 3.43Å; N84-P88 VanDerWaalsContact ND2-O 3.08Å
85G93.4Very high95.9Very high58 Ų5883.5 Ų83.560%0.59843%0.426SS*.THydrogen-bonded Turntrans63.3-111.4-174.400000112R83R83-G85 VanDerWaalsContact C-N 3.28Å; R83-G85 PolarHBondContact O-N 3.35Å
86S95.3Very high95.8Very high127 Ų12781.9 Ų81.989%0.88843%0.427SS*.THydrogen-bonded Turntrans-82.2-22177.6580000113.9N84N84-S86 PolarHBondContact O-N 3.39Å; N84-S86 VanDerWaalsContact O-N 3.13Å
87R95.2Very high95.8Very high195 Ų19576.4 Ų76.474%0.73641%0.412SS*.EExtended strand (participates in β ladder)trans-77.3152.6179.1-65.6-179.7179.3178.6-0.2110.9N84N84-R87 HydrophobicContact CB-CB 3.88Å; N84-R87 PolarHBondContact O-N 2.92Å; N84-R87 VanDerWaalsContact O-N 3.12Å
88P96.2Very high95.7Very high96 Ų9673.3 Ų73.362%0.62339%0.393SS*.EExtended strand (participates in β ladder)trans-52148.4175.7-27.134.9000113.3N84 H90N84-P88 PolarHBondContact ND2-O 3.43Å; N84-P88 VanDerWaalsContact ND2-O 3.08Å; P88-H90 PolarHBondContact O-CD2 3.42Å
89A96.4Very high95.7Very high46 Ų4671.7 Ų71.738%0.3839%0.386SS..EExtended strand (participates in β ladder)trans-75.8137.4179.200000110.8R81 Q82R81-A89 HydrophobicContact CG-CB 3.74Å; Q82-A89 WeakPolarHBondContact O-CA 3.31Å; Q82-A89 WeakPolarHBondContact O-CB 3.41Å
90H96.4Very high95.6Very high118 Ų11877.1 Ų77.155%0.54640%0.402SS..EExtended strand (participates in β ladder)trans-126.6156177.3-69.8-75000111.2Q82 P88Q82-H90 PolarHBondContact N-O 3.28Å; Q82-H90 PolarHBondContact O-N 2.86Å; P88-H90 PolarHBondContact O-CD2 3.42Å
91F97.3Very high95.6Very high123 Ų12381.1 Ų81.154%0.53942%0.415SS..EExtended strand (participates in β ladder)trans-76.9131173.5176.6-94.2000110.5G79 G80 L93G79-F91 VanDerWaalsContact C-CE2 3.42Å; G80-F91 WeakPolarHBondContact O-CA 3.41Å; F91-L93 HydrophobicContact CE1-CD2 3.93Å
92V96.9Very high95.5Very high38 Ų3871.8 Ų71.823%0.2338%0.38CS..EExtended strand (participates in β ladder)trans-129.3142.2179.31770000110.6P40 G79 G80 Q82P40-V92 HydrophobicContact CB-CG1 4.46Å; G79-V92 VanDerWaalsContact CA-O 3.31Å; G79-V92 WeakPolarHBondContact CA-O 3.32Å; G80-V92 PolarHBondContact N-O 3.35Å; G80-V92 PolarHBondContact O-N 3.39Å; Q82-V92 HydrophobicContact CB-CB 4.35Å; Q82-V92 HydrophobicContact CB-CG2 3.91Å; Q82-V92 VanDerWaalsContact OE1-CG2 3.28Å
93L97.6Very high95.5Very high56 Ų5669.4 Ų69.429%0.29337%0.369SS..PPolyproline II helixtrans-69.6149.8-179-64177.1000112.1R75 K76 F91R75-L93 HydrophobicContact CB-CB 4.26Å; R75-L93 HydrophobicContact CB-CD2 4.38Å; K76-L93 HydrophobicContact CB-CD2 4.39Å; K76-L93 HydrophobicContact CG-CD2 3.62Å; F91-L93 HydrophobicContact CE1-CD2 3.93Å
94A97.1Very high95.4Very high2 Ų264.3 Ų64.32%0.01735%0.353CS..PPolyproline II helixtrans-67.8166.8173.400000113A39 R75 F78 S96 I99A39-A94 HydrophobicContact CB-CB 4.36Å; R75-A94 PolarHBondContact NE-O 2.97Å; R75-A94 PolarHBondContact O-N 3.44Å; F78-A94 HydrophobicContact CB-CB 3.83Å; F78-A94 WeakPolarHBondContact O-CB 3.22Å; A94-S96 PolarHBondContact O-N 3.32Å; A94-I99 HydrophobicContact CB-CD1 4.03Å
95S95.5Very high95.5Very high37 Ų3761.9 Ų61.926%0.25934%0.341SS..PPolyproline II helixtrans-61.4124.8173.6-179.30000110.9T38 I99T38-S95 WeakPolarHBondContact O-CB 3.46Å; S95-I99 WeakPolarHBondContact O-CD1 3.47Å; S95-I99 WeakPolarHBondContact O-CG1 3.31Å
96S95.8Very high95.5Very high48 Ų4859.1 Ų59.134%0.33631%0.312SS..Hα-helixtrans-71.5-34.4177.448.30000112.7A94 R100A94-S96 PolarHBondContact O-N 3.32Å; S96-R100 VanDerWaalsContact O-CB 3.28Å; S96-R100 WeakPolarHBondContact O-CB 3.3Å; S96-R100 PolarHBondContact O-N 3.49Å
97G94.7Very high95.5Very high32 Ų3255.7 Ų55.733%0.3328%0.282SS..Hα-helixtrans-63.8-47.5-17500000112R100 K101G97-R100 PolarHBondContact O-N 2.86Å; G97-K101 PolarHBondContact O-N 3.44Å
98I94.9Very high95.3Very high6 Ų652 Ų523%0.03127%0.273CS..Hα-helixtrans-61-51.9179.4-62.5173.2000110.7W32 V36 K37 W51 R100 K101 C102W32-I98 HydrophobicContact CH2-CB 4.42Å; W32-I98 HydrophobicContact CH2-CG1 3.84Å; W32-I98 HydrophobicContact CZ3-CG1 3.86Å; V36-I98 HydrophobicContact CG2-CD1 4.07Å; K37-I98 WeakPolarHBondContact O-CD1 3.38Å; W51-I98 HydrophobicContact CH2-CD1 3.94Å; W51-I98 HydrophobicContact CH2-CG1 4.3Å; W51-I98 HydrophobicContact CH2-CG2 3.75Å; W51-I98 HydrophobicContact CZ3-CD1 4.44Å; W51-I98 HydrophobicContact CZ3-CG2 3.58Å; I98-R100 VanDerWaalsContact C-N 3.28Å; I98-R100 PolarHBondContact O-N 3.22Å; I98-K101 PolarHBondContact O-N 3.02Å; I98-C102 PolarHBondContact O-N 2.91Å; I98-C102 PolarHBondContact O-SG 3Å
99I95.7Very high95.1Very high3 Ų348.1 Ų48.12%0.01525%0.247CC..Hα-helixtrans-58.1-42.7178.7-68.2169000111V71 F74 R75 F78 A94 S95 L103V71-I99 HydrophobicContact CB-CG2 4.41Å; V71-I99 HydrophobicContact CG1-CB 4.33Å; V71-I99 HydrophobicContact CG1-CG2 3.96Å; F74-I99 HydrophobicContact CB-CD1 3.9Å; F74-I99 HydrophobicContact CB-CG1 4.37Å; F74-I99 HydrophobicContact CB-CG2 3.5Å; F74-I99 VanDerWaalsContact CB-CG2 3.5Å; F74-I99 HydrophobicContact CD2-CG2 4.11Å; F74-I99 HydrophobicContact CG-CG2 4.09Å; R75-I99 HydrophobicContact CB-CD1 4.4Å; R75-I99 HydrophobicContact CG-CD1 3.82Å; F78-I99 HydrophobicContact CD2-CD1 4.14Å; F78-I99 HydrophobicContact CD2-CG1 4.4Å; A94-I99 HydrophobicContact CB-CD1 4.03Å; S95-I99 WeakPolarHBondContact O-CD1 3.47Å; S95-I99 WeakPolarHBondContact O-CG1 3.31Å; I99-L103 HydrophobicContact CG2-CD1 3.89Å; I99-L103 WeakPolarHBondContact O-CB 3.4Å; I99-L103 WeakPolarHBondContact O-CD1 3.48Å; I99-L103 VanDerWaalsContact O-CG 3.3Å; I99-L103 WeakPolarHBondContact O-CG 3.5Å; I99-L103 PolarHBondContact O-N 3.18Å; I99-L103 VanDerWaalsContact O-N 3.09Å
100R94.7Very high94.9Very high130 Ų13053.5 Ų53.549%0.49126%0.262SS..Hα-helixtrans-61.7-46.3178.9-176.3-174.5-60.6-91.13111.2V71 S96 G97 I98 L103 Q104V71-R100 HydrophobicContact CG2-CB 4.3Å; S96-R100 VanDerWaalsContact O-CB 3.28Å; S96-R100 WeakPolarHBondContact O-CB 3.3Å; S96-R100 PolarHBondContact O-N 3.49Å; G97-R100 PolarHBondContact O-N 2.86Å; I98-R100 VanDerWaalsContact C-N 3.28Å; I98-R100 PolarHBondContact O-N 3.22Å; R100-L103 PolarHBondContact O-N 2.9Å; R100-Q104 WeakPolarHBondContact O-CG 3.47Å; R100-Q104 PolarHBondContact O-N 3.24Å
101K95Very high94.7Very high98 Ų9848.1 Ų48.143%0.42624%0.237SC..Hα-helixtrans-65.9-43.5179-75.6-69-176.1173.60112.4P30 W32 F52 G97 I98 L103 Q104 A105P30-K101 HydrophobicContact CG-CB 4.19Å; P30-K101 HydrophobicContact CG-CG 4.37Å; W32-K101 HydrophobicContact CH2-CB 4.42Å; W32-K101 HydrophobicContact CH2-CG 4.38Å; W32-K101 HydrophobicContact CZ2-CB 4.36Å; W32-K101 HydrophobicContact CZ2-CG 3.84Å; F52-K101 HydrophobicContact CE2-CB 4.5Å; F52-K101 HydrophobicContact CZ-CB 4.38Å; G97-K101 PolarHBondContact O-N 3.44Å; I98-K101 PolarHBondContact O-N 3.02Å; K101-L103 VanDerWaalsContact C-N 3.28Å; K101-L103 PolarHBondContact O-N 3.05Å; K101-Q104 PolarHBondContact O-N 2.97Å; K101-Q104 VanDerWaalsContact O-N 3.11Å; K101-A105 PolarHBondContact O-N 3.4Å
102C94.9Very high94.6Very high0 Ų042.4 Ų42.40%021%0.212CC..Hα-helixtrans-56.8-44.8174.5-63.40000111.6F52 A56 I59 I98 A105 L106F52-C102 WeakPolarHBondContact CE2-SG 3.44Å; F52-C102 HydrophobicContact CZ-CB 4.41Å; A56-C102 HydrophobicContact CB-CB 4.44Å; I59-C102 HydrophobicContact CD1-CB 3.72Å; I98-C102 PolarHBondContact O-N 2.91Å; I98-C102 PolarHBondContact O-SG 3Å; C102-A105 PolarHBondContact O-N 3.24Å; C102-L106 VanDerWaalsContact O-CG 3.31Å; C102-L106 WeakPolarHBondContact O-CG 3.42Å; C102-L106 PolarHBondContact O-N 3.44Å
103L94.6Very high94.4Very high0 Ų045.2 Ų45.20%022%0.223CC..Hα-helixtrans-70.3-30.5178.9-71.2164.8000113.1I59 L63 V71 F74 I99 R100 K101 E107 I112 R121I59-L103 HydrophobicContact CG2-CD2 3.32Å; I59-L103 HydrophobicContact CG2-CG 4.04Å; L63-L103 HydrophobicContact CD1-CD2 4.22Å; V71-L103 HydrophobicContact CG2-CD1 4.01Å; F74-L103 HydrophobicContact CD2-CD1 3.86Å; F74-L103 HydrophobicContact CD2-CD2 4.44Å; F74-L103 HydrophobicContact CE2-CD1 4.01Å; F74-L103 HydrophobicContact CE2-CD2 3.87Å; F74-L103 HydrophobicContact CE2-CG 4.49Å; F74-L103 HydrophobicContact CZ-CD2 4.45Å; I99-L103 HydrophobicContact CG2-CD1 3.89Å; I99-L103 WeakPolarHBondContact O-CB 3.4Å; I99-L103 WeakPolarHBondContact O-CD1 3.48Å; I99-L103 VanDerWaalsContact O-CG 3.3Å; I99-L103 WeakPolarHBondContact O-CG 3.5Å; I99-L103 PolarHBondContact O-N 3.18Å; I99-L103 VanDerWaalsContact O-N 3.09Å; R100-L103 PolarHBondContact O-N 2.9Å; K101-L103 VanDerWaalsContact C-N 3.28Å; K101-L103 PolarHBondContact O-N 3.05Å; L103-E107 VanDerWaalsContact O-CB 3.31Å; L103-E107 WeakPolarHBondContact O-CB 3.36Å; L103-E107 PolarHBondContact O-N 3.11Å; L103-E107 VanDerWaalsContact O-N 3.1Å; L103-I112 HydrophobicContact CD2-CD1 3.91Å; L103-R121 VanDerWaalsContact CD1-NH1 3.27Å
104Q94Very high94.1Very high83 Ų8349 Ų4939%0.38824%0.236SC..Hα-helixtrans-69.2-42.6172.5-75.8173.9-41.500111.2R100 K101 L106 E107 E108R100-Q104 WeakPolarHBondContact O-CG 3.47Å; R100-Q104 PolarHBondContact O-N 3.24Å; K101-Q104 PolarHBondContact O-N 2.97Å; K101-Q104 VanDerWaalsContact O-N 3.11Å; Q104-L106 VanDerWaalsContact C-N 3.33Å; Q104-L106 PolarHBondContact O-N 3.38Å; Q104-E107 WeakPolarHBondContact O-CB 3.31Å; Q104-E107 PolarHBondContact O-N 3.16Å; Q104-E107 VanDerWaalsContact O-N 3.11Å; Q104-E108 PolarHBondContact O-N 2.87Å
105A94.2Very high93.7Very high4 Ų451 Ų513%0.03325%0.245CC..Hα-helixtrans-62.4-39.5176.200000112.2I27 K101 C102 E107 E108 M109I27-A105 HydrophobicContact CG1-CB 4.4Å; I27-A105 HydrophobicContact CG2-CB 4.07Å; K101-A105 PolarHBondContact O-N 3.4Å; C102-A105 PolarHBondContact O-N 3.24Å; A105-E107 VanDerWaalsContact C-N 3.31Å; A105-E107 PolarHBondContact O-N 3.32Å; A105-E108 PolarHBondContact O-N 3.05Å; A105-M109 PolarHBondContact O-N 2.84Å; A105-M109 VanDerWaalsContact O-N 3.15Å
106L94Very high93.1Very high0 Ų054.7 Ų54.70%027%0.269CS..Hα-helixtrans-70.9-26.2174.5-70.1171.9000113.3L21 A56 I59 A60 C102 Q104 K110 W111 I112L21-L106 HydrophobicContact CD1-CD2 4.46Å; A56-L106 HydrophobicContact CB-CD1 4.22Å; A56-L106 HydrophobicContact CB-CD2 4.37Å; A56-L106 HydrophobicContact CB-CG 4.33Å; I59-L106 HydrophobicContact CG2-CD1 4.23Å; A60-L106 HydrophobicContact CB-CD1 4.32Å; C102-L106 VanDerWaalsContact O-CG 3.31Å; C102-L106 WeakPolarHBondContact O-CG 3.42Å; C102-L106 PolarHBondContact O-N 3.44Å; Q104-L106 VanDerWaalsContact C-N 3.33Å; Q104-L106 PolarHBondContact O-N 3.38Å; L106-K110 PolarHBondContact O-N 3.24Å; L106-W111 HydrophobicContact CD2-CE3 4.02Å; L106-W111 PolarHBondContact O-N 3.34Å; L106-W111 VanDerWaalsContact O-N 3.09Å; L106-I112 HydrophobicContact CB-CB 4.4Å; L106-I112 HydrophobicContact CB-CD1 3.49Å; L106-I112 VanDerWaalsContact CB-CD1 3.49Å; L106-I112 HydrophobicContact CB-CG1 3.94Å; L106-I112 HydrophobicContact CD1-CD1 3.52Å; L106-I112 HydrophobicContact CG-CD1 4.13Å; L106-I112 PolarHBondContact O-N 3.42Å
107E93.4Very high92.6Very high54 Ų5459.9 Ų59.925%0.25229%0.285SS..Hα-helixtrans-72.7-40.5173.5-174.7174.1176.300110.7L103 Q104 A105 M109 K110 I112 K114 R121L103-E107 VanDerWaalsContact O-CB 3.31Å; L103-E107 WeakPolarHBondContact O-CB 3.36Å; L103-E107 PolarHBondContact O-N 3.11Å; L103-E107 VanDerWaalsContact O-N 3.1Å; Q104-E107 WeakPolarHBondContact O-CB 3.31Å; Q104-E107 PolarHBondContact O-N 3.16Å; Q104-E107 VanDerWaalsContact O-N 3.11Å; A105-E107 VanDerWaalsContact C-N 3.31Å; A105-E107 PolarHBondContact O-N 3.32Å; E107-M109 VanDerWaalsContact C-N 3.32Å; E107-M109 PolarHBondContact O-N 3.47Å; E107-K110 WeakPolarHBondContact O-CA 3.46Å; E107-K110 PolarHBondContact O-N 3.08Å; E107-I112 WeakPolarHBondContact CA-O 3.24Å; E107-K114 WeakPolarHBondContact OE1-CE 3.43Å; E107-K114 IonicContact OE1-NZ 2.61Å; E107-R121 IonicContact OE2-CZ 2.8Å; E107-R121 IonicContact OE2-NE 3.36Å; E107-R121 PolarHBondContact OE2-NE 3.41Å; E107-R121 IonicContact OE2-NH2 3.82Å; E107-R121 PolarHBondContact OE2-NH2 3.15Å
108E92.8Very high91.8Very high118 Ų11865.4 Ų65.455%0.55131%0.307SS*.Hα-helixtrans-60.7-39.2172.9-172.5172-161.400112.1T28 Q104 A105 K110T28-E108 PolarHBondContact OG1-OE2 2.98Å; T28-E108 VanDerWaalsContact OG1-OE2 3.06Å; Q104-E108 PolarHBondContact O-N 2.87Å; A105-E108 PolarHBondContact O-N 3.05Å; E108-K110 PolarHBondContact O-N 3.03Å
109M90.6Very high91.1Very high15 Ų1571.8 Ų71.87%0.07434%0.335CS..THydrogen-bonded Turntrans-71.8-4.8173.4-157.2-175.9-160.400113.9F20 L21 S24 R26 A105 E107 W111F20-M109 HydrophobicContact CE1-CE 4.08Å; L21-M109 HydrophobicContact CD2-CE 3.91Å; L21-M109 HydrophobicContact CD2-SD 3.58Å; L21-M109 VanDerWaalsContact CD2-SD 3.58Å; S24-M109 VanDerWaalsContact OG-CE 3.24Å; S24-M109 WeakPolarHBondContact OG-CE 3.49Å; R26-M109 HydrophobicContact CB-CE 4.2Å; R26-M109 HydrophobicContact CB-CG 4.29Å; R26-M109 HydrophobicContact CG-CE 4.44Å; A105-M109 PolarHBondContact O-N 2.84Å; A105-M109 VanDerWaalsContact O-N 3.15Å; E107-M109 VanDerWaalsContact C-N 3.32Å; E107-M109 PolarHBondContact O-N 3.47Å; M109-W111 VanDerWaalsContact C-N 3.26Å; M109-W111 PolarHBondContact O-N 2.93Å; M109-W111 HydrophobicContact SD-CD2 4.12Å; M109-W111 HydrophobicContact SD-CG 4.43Å; M109-W111 HydrophobicContact SD-CZ2 4.47Å
110K92.4Very high90.7Very high159 Ų15972.8 Ų72.869%0.69135%0.345SS*.THydrogen-bonded Turntrans6126.5-176.2-53.8-179.1179179.60114.8L106 E107 E108 T124 T126L106-K110 PolarHBondContact O-N 3.24Å; E107-K110 WeakPolarHBondContact O-CA 3.46Å; E107-K110 PolarHBondContact O-N 3.08Å; E108-K110 PolarHBondContact O-N 3.03Å; K110-T124 PolarHBondContact O-OG1 2.96Å; K110-T126 PolarHBondContact O-OG1 3.26Å
111W93.2Very high90.5Very high5 Ų567.7 Ų67.72%0.01933%0.326CS..SBendtrans-85.7-26.6170.6-83.713.3000112.5I17 F20 L21 L106 M109 L123 T124 D130 L131 L134I17-W111 HydrophobicContact CG2-CH2 4.35Å; I17-W111 HydrophobicContact CG2-CZ3 4.03Å; F20-W111 AromaticContact CD1-CH2 3.79Å; F20-W111 HydrophobicContact CD1-CH2 3.79Å; F20-W111 AromaticContact CD1-CZ2 3.97Å; F20-W111 HydrophobicContact CD1-CZ2 3.97Å; F20-W111 AromaticContact CE1-CH2 3.84Å; F20-W111 HydrophobicContact CE1-CH2 3.84Å; F20-W111 AromaticContact CE1-CZ2 3.51Å; F20-W111 HydrophobicContact CE1-CZ2 3.51Å; F20-W111 HydrophobicContact CZ-CZ2 4.49Å; L21-W111 HydrophobicContact CD2-CE3 4.38Å; L21-W111 HydrophobicContact CD2-CH2 3.94Å; L21-W111 HydrophobicContact CD2-CZ3 3.8Å; L21-W111 HydrophobicContact CG-CZ3 4.4Å; L106-W111 HydrophobicContact CD2-CE3 4.02Å; L106-W111 PolarHBondContact O-N 3.34Å; L106-W111 VanDerWaalsContact O-N 3.09Å; M109-W111 VanDerWaalsContact C-N 3.26Å; M109-W111 PolarHBondContact O-N 2.93Å; M109-W111 HydrophobicContact SD-CD2 4.12Å; M109-W111 HydrophobicContact SD-CG 4.43Å; M109-W111 HydrophobicContact SD-CZ2 4.47Å; W111-L123 WeakPolarHBondContact O-CD1 3.28Å; W111-T124 VanDerWaalsContact C-OG1 3.24Å; W111-T124 WeakPolarHBondContact CA-OG1 3.36Å; W111-T124 PolarHBondContact O-N 3.45Å; W111-T124 PolarHBondContact O-OG1 3.36Å; W111-D130 HydrophobicContact CZ2-CB 3.66Å; W111-D130 PolarHBondContact NE1-OD2 3.1Å; W111-L131 HydrophobicContact CZ3-CD2 4.26Å; W111-L134 HydrophobicContact CH2-CD1 4.22Å
112I94.2Very high90.4Very high3 Ų364.3 Ų64.32%0.01531%0.314CS..EExtended strand (participates in β ladder)trans-124.1142.3-178.7-62.8180000108.9L63 L103 L106 E107 R121 V122L63-I112 HydrophobicContact CD1-CD1 3.28Å; L63-I112 HydrophobicContact CD1-CG1 3.83Å; L63-I112 HydrophobicContact CD1-CG2 4.3Å; L103-I112 HydrophobicContact CD2-CD1 3.91Å; L106-I112 HydrophobicContact CB-CB 4.4Å; L106-I112 HydrophobicContact CB-CD1 3.49Å; L106-I112 VanDerWaalsContact CB-CD1 3.49Å; L106-I112 HydrophobicContact CB-CG1 3.94Å; L106-I112 HydrophobicContact CD1-CD1 3.52Å; L106-I112 HydrophobicContact CG-CD1 4.13Å; L106-I112 PolarHBondContact O-N 3.42Å; E107-I112 WeakPolarHBondContact CA-O 3.24Å; I112-R121 HydrophobicContact CG2-CB 3.59Å; I112-R121 HydrophobicContact CG2-CG 3.82Å; I112-V122 WeakPolarHBondContact CA-O 3.48Å; I112-V122 WeakPolarHBondContact CG2-O 3.19Å
113E93.2Very high90.3Very high97 Ų9765.2 Ų65.245%0.45332%0.319SS..EExtended strand (participates in β ladder)trans-125.4159171.862.3-173.5-178.400111R121 V122 T124E113-R121 WeakPolarHBondContact O-CA 3.5Å; E113-V122 HydrophobicContact CG-CB 4.31Å; E113-V122 PolarHBondContact N-O 3.11Å; E113-V122 PolarHBondContact O-N 3.49Å; E113-T124 HydrophobicContact CB-CG2 3.72Å; E113-T124 HydrophobicContact CG-CG2 3.76Å
114K92.2Very high90.3Very high134 Ų13466 Ų6658%0.58332%0.323SS*.EExtended strand (participates in β ladder)trans-73.4134.7169.9-69.4175.4-177.1162.30108.9E107E107-K114 WeakPolarHBondContact OE1-CE 3.43Å; E107-K114 IonicContact OE1-NZ 2.61Å
115H87.8Confident90.3Very high44 Ų4466.5 Ų66.520%0.20434%0.336CS..  trans-64.4135.1175.2-168-67.9000109.3K117 N118 G120 V122H115-K117 VanDerWaalsContact C-N 3.26Å; H115-K117 PolarHBondContact ND1-N 3.27Å; H115-K117 PolarHBondContact O-N 2.66Å; H115-N118 PolarHBondContact O-N 3.43Å; H115-G120 PolarHBondContact N-O 2.96Å; H115-V122 HydrophobicContact CB-CG2 3.74Å; H115-V122 WeakPolarHBondContact CD2-CG2 3.31Å
116P83.7Confident90.2Very high116 Ų11669.4 Ų69.475%0.75335%0.353SS*.THydrogen-bonded Turntrans-57.1-37.7-177.718.7-32.2000113.1N118P116-N118 PolarHBondContact O-N 3.32Å
117K85.2Confident90.2Very high157 Ų15769.4 Ų69.468%0.68335%0.353SS*.THydrogen-bonded Turntrans-78.117.9173.8-55.4-176.1178.6-178.40115.8H115 K119H115-K117 VanDerWaalsContact C-N 3.26Å; H115-K117 PolarHBondContact ND1-N 3.27Å; H115-K117 PolarHBondContact O-N 2.66Å; K117-K119 HydrophobicContact CB-CG 4.35Å; K117-K119 PolarHBondContact O-N 3.03Å
118N76.8Confident90.2Very high147 Ų14772.5 Ų72.579%0.78636%0.363SS*.SBendtrans54.720.2-178.6-76.1-24.1000116.4H115 P116 G120H115-N118 PolarHBondContact O-N 3.43Å; P116-N118 PolarHBondContact O-N 3.32Å; N118-G120 PolarHBondContact O-N 3.09Å; N118-G120 VanDerWaalsContact O-N 3.11Å
119K80.1Confident90.3Very high141 Ų14175 Ų7561%0.61337%0.367SS*.SBendtrans-81.219.1-179.1-66.5-170.9177.4-173.90114.4P68 K117P68-K119 HydrophobicContact CG-CB 4.06Å; K117-K119 HydrophobicContact CB-CG 4.35Å; K117-K119 PolarHBondContact O-N 3.03Å
120G87.3Confident90.4Very high23 Ų2376.3 Ų76.324%0.23737%0.374CS..SBendtrans109.1-137.7-177.600000112.5H115 N118H115-G120 PolarHBondContact N-O 2.96Å; N118-G120 PolarHBondContact O-N 3.09Å; N118-G120 VanDerWaalsContact O-N 3.11Å
121R91.3Very high90.5Very high24 Ų2468.8 Ų68.89%0.09134%0.342CS..EExtended strand (participates in β ladder)trans-120.1144.8-172.5-79.7170.9167.8146-14.3111.7L63 A69 L103 E107 I112 E113L63-R121 WeakPolarHBondContact CD2-O 3.4Å; A69-R121 PolarHBondContact N-O 3.02Å; A69-R121 PolarHBondContact O-N 3.3Å; L103-R121 VanDerWaalsContact CD1-NH1 3.27Å; E107-R121 IonicContact OE2-CZ 2.8Å; E107-R121 IonicContact OE2-NE 3.36Å; E107-R121 PolarHBondContact OE2-NE 3.41Å; E107-R121 IonicContact OE2-NH2 3.82Å; E107-R121 PolarHBondContact OE2-NH2 3.15Å; I112-R121 HydrophobicContact CG2-CB 3.59Å; I112-R121 HydrophobicContact CG2-CG 3.82Å; E113-R121 WeakPolarHBondContact O-CA 3.5Å
122V92.8Very high90.5Very high27 Ų2769.5 Ų69.516%0.16435%0.346CS..EExtended strand (participates in β ladder)trans-127.4150.5-178.2-177.30000108.8P68 I112 E113 H115P68-V122 HydrophobicContact CB-CG2 4.04Å; I112-V122 WeakPolarHBondContact CA-O 3.48Å; I112-V122 WeakPolarHBondContact CG2-O 3.19Å; E113-V122 HydrophobicContact CG-CB 4.31Å; E113-V122 PolarHBondContact N-O 3.11Å; E113-V122 PolarHBondContact O-N 3.49Å; H115-V122 HydrophobicContact CB-CG2 3.74Å; H115-V122 WeakPolarHBondContact CD2-CG2 3.31Å
123L93Very high90.5Very high19 Ų1977.6 Ų77.610%0.09938%0.377CS..EExtended strand (participates in β ladder)trans-79.2130.4175.3-165.478.1000109.8Y64 W111 R128 L131Y64-L123 HydrophobicContact CD2-CD2 3.79Å; Y64-L123 HydrophobicContact CG-CD2 4.48Å; W111-L123 WeakPolarHBondContact O-CD1 3.28Å; L123-R128 HydrophobicContact CD2-CB 3.74Å; L123-R128 HydrophobicContact CD2-CG 3.99Å; L123-R128 HydrophobicContact CG-CB 4.49Å; L123-L131 HydrophobicContact CD1-CD1 4.07Å; L123-L131 HydrophobicContact CD2-CD1 3.88Å
124T94.6Very high90.5Very high15 Ų1573.3 Ų73.39%0.09236%0.357CS..  trans-72164.4176.658.10000111.3K110 W111 E113 T126 G127 R128K110-T124 PolarHBondContact O-OG1 2.96Å; W111-T124 VanDerWaalsContact C-OG1 3.24Å; W111-T124 WeakPolarHBondContact CA-OG1 3.36Å; W111-T124 PolarHBondContact O-N 3.45Å; W111-T124 PolarHBondContact O-OG1 3.36Å; E113-T124 HydrophobicContact CB-CG2 3.72Å; E113-T124 HydrophobicContact CG-CG2 3.76Å; T124-T126 VanDerWaalsContact C-N 3.26Å; T124-T126 PolarHBondContact O-N 3.03Å; T124-T126 PolarHBondContact OG1-OG1 3.26Å; T124-G127 PolarHBondContact O-N 3.42Å; T124-G127 PolarHBondContact OG1-N 3.28Å; T124-G127 VanDerWaalsContact OG1-N 3.1Å; T124-R128 PolarHBondContact O-N 3.22Å
125S92.8Very high90.5Very high94 Ų9467 Ų6766%0.65733%0.329SS*.Hα-helixtrans-58.7-38.3174-174.30000112.4R128 R129S125-R128 PolarHBondContact O-N 2.9Å; S125-R129 WeakPolarHBondContact O-CB 3.36Å; S125-R129 PolarHBondContact O-N 3.02Å; S125-R129 VanDerWaalsContact O-N 3.08Å
126T93.3Very high90.7Very high66 Ų6666.4 Ų66.441%0.40533%0.332SS..Hα-helixtrans-64.6-50.1174.7450000111.6K110 T124 R128 R129 D130K110-T126 PolarHBondContact O-OG1 3.26Å; T124-T126 VanDerWaalsContact C-N 3.26Å; T124-T126 PolarHBondContact O-N 3.03Å; T124-T126 PolarHBondContact OG1-OG1 3.26Å; T126-R128 VanDerWaalsContact C-N 3.26Å; T126-R128 PolarHBondContact O-N 3.49Å; T126-R129 WeakPolarHBondContact O-CB 3.46Å; T126-R129 PolarHBondContact O-N 3.03Å; T126-R129 VanDerWaalsContact O-N 3.14Å; T126-D130 PolarHBondContact O-N 3.43Å
127G93.4Very high91Very high0 Ų065.9 Ų65.90%032%0.32CS..Hα-helixtrans-58.7-39.2177.400000112.2T124 D130 L131T124-G127 PolarHBondContact O-N 3.42Å; T124-G127 PolarHBondContact OG1-N 3.28Å; T124-G127 VanDerWaalsContact OG1-N 3.1Å; G127-D130 PolarHBondContact O-N 3.49Å; G127-L131 WeakPolarHBondContact O-CB 3.14Å; G127-L131 VanDerWaalsContact O-CG 3.29Å; G127-L131 WeakPolarHBondContact O-CG 3.39Å; G127-L131 PolarHBondContact O-N 2.73Å
128R93.7Very high91.3Very high118 Ų11858.8 Ų58.845%0.44529%0.289SS..Hα-helixtrans-65.1-41.9176.8-158165.6-176.1149.4-2.7112.9Y64 L123 T124 S125 T126 D132Y64-R128 HydrophobicContact CD2-CG 3.98Å; Y64-R128 HydrophobicContact CE2-CG 3.47Å; Y64-R128 VanDerWaalsContact CE2-CG 3.47Å; L123-R128 HydrophobicContact CD2-CB 3.74Å; L123-R128 HydrophobicContact CD2-CG 3.99Å; L123-R128 HydrophobicContact CG-CB 4.49Å; T124-R128 PolarHBondContact O-N 3.22Å; S125-R128 PolarHBondContact O-N 2.9Å; T126-R128 VanDerWaalsContact C-N 3.26Å; T126-R128 PolarHBondContact O-N 3.49Å; R128-D132 PolarHBondContact O-N 3.29Å
129R93.9Very high91.8Very high170 Ų17054.7 Ų54.764%0.64226%0.264SS*.Hα-helixtrans-63.7-44.9177.3-174-170.1-56176.72112.1S125 T126 D132 R133S125-R129 WeakPolarHBondContact O-CB 3.36Å; S125-R129 PolarHBondContact O-N 3.02Å; S125-R129 VanDerWaalsContact O-N 3.08Å; T126-R129 WeakPolarHBondContact O-CB 3.46Å; T126-R129 PolarHBondContact O-N 3.03Å; T126-R129 VanDerWaalsContact O-N 3.14Å; R129-D132 PolarHBondContact O-N 3.36Å; R129-R133 WeakPolarHBondContact O-CB 3.32Å; R129-R133 PolarHBondContact O-N 3.4Å
130D93.7Very high92.1Very high43 Ų4356.3 Ų56.323%0.2327%0.271CS..Hα-helixtrans-66.8-41.2-179.4-72.3-23.1000111.3W111 T126 G127 D132 R133 L134W111-D130 HydrophobicContact CZ2-CB 3.66Å; W111-D130 PolarHBondContact NE1-OD2 3.1Å; T126-D130 PolarHBondContact O-N 3.43Å; G127-D130 PolarHBondContact O-N 3.49Å; D130-D132 PolarHBondContact O-N 2.79Å; D130-R133 WeakPolarHBondContact O-CB 3.44Å; D130-R133 PolarHBondContact O-N 3.33Å; D130-L134 WeakPolarHBondContact O-CG 3.33Å; D130-L134 PolarHBondContact O-N 2.61Å
131L94.1Very high92Very high1 Ų162 Ų621%0.00529%0.29CS..Hα-helixtrans-62.1-42.7174.7-71.5178.9000112.5I17 Y64 W111 L123 G127 R133 L134 A135I17-L131 HydrophobicContact CD1-CD2 3.41Å; I17-L131 VanDerWaalsContact CD1-CD2 3.41Å; I17-L131 HydrophobicContact CG1-CD2 3.83Å; I17-L131 HydrophobicContact CG2-CD2 4.42Å; Y64-L131 HydrophobicContact CD2-CB 4.32Å; Y64-L131 HydrophobicContact CD2-CD1 3.97Å; W111-L131 HydrophobicContact CZ3-CD2 4.26Å; L123-L131 HydrophobicContact CD1-CD1 4.07Å; L123-L131 HydrophobicContact CD2-CD1 3.88Å; G127-L131 WeakPolarHBondContact O-CB 3.14Å; G127-L131 VanDerWaalsContact O-CG 3.29Å; G127-L131 WeakPolarHBondContact O-CG 3.39Å; G127-L131 PolarHBondContact O-N 2.73Å; L131-R133 VanDerWaalsContact C-N 3.33Å; L131-L134 PolarHBondContact O-N 2.8Å; L131-A135 WeakPolarHBondContact O-CB 3.16Å; L131-A135 PolarHBondContact O-N 2.99Å
132D94Very high91.5Very high21 Ų2163 Ų6311%0.11230%0.3CS..Hα-helixtrans-65.8-36.2176-72.7-17.7000111.5A5 Y64 R128 R129 D130 A135 A136A5-D132 PolarHBondContact N-OD1 3.15Å; Y64-D132 VanDerWaalsContact CE2-OD1 3.26Å; Y64-D132 WeakPolarHBondContact CE2-OD1 3.48Å; Y64-D132 VanDerWaalsContact CZ-OD1 3.24Å; Y64-D132 PolarHBondContact OH-OD1 2.86Å; Y64-D132 PolarHBondContact OH-OD2 3.12Å; R128-D132 PolarHBondContact O-N 3.29Å; R129-D132 PolarHBondContact O-N 3.36Å; D130-D132 PolarHBondContact O-N 2.79Å; D132-A135 PolarHBondContact O-N 3.33Å; D132-A136 PolarHBondContact O-N 3.38Å
133R93.2Very high90.5Very high173 Ų17365.7 Ų65.765%0.65332%0.318SS*.Hα-helixtrans-64.4-44.9174.3179-175.1-109.5175.8-6.3111.7R129 D130 L131 A135 A136 Q137R129-R133 WeakPolarHBondContact O-CB 3.32Å; R129-R133 PolarHBondContact O-N 3.4Å; D130-R133 WeakPolarHBondContact O-CB 3.44Å; D130-R133 PolarHBondContact O-N 3.33Å; L131-R133 VanDerWaalsContact C-N 3.33Å; R133-A135 VanDerWaalsContact C-N 3.34Å; R133-A136 PolarHBondContact O-N 3.32Å; R133-Q137 PolarHBondContact O-N 2.78Å; R133-Q137 VanDerWaalsContact O-N 3.11Å
134L93.6Very high89.3Confident7 Ų770 Ų704%0.03735%0.35CS..Hα-helixtrans-64.2-41.3176.6-69.6170.9000110.8I17 F20 W111 D130 L131 A136 Q137 V138I17-L134 HydrophobicContact CB-CD1 4.4Å; I17-L134 HydrophobicContact CG1-CD1 3.82Å; F20-L134 HydrophobicContact CB-CD1 4.11Å; F20-L134 HydrophobicContact CB-CD2 3.9Å; F20-L134 HydrophobicContact CD1-CD1 4.1Å; F20-L134 HydrophobicContact CD2-CD2 4Å; F20-L134 HydrophobicContact CG-CD1 4.05Å; F20-L134 HydrophobicContact CG-CD2 3.96Å; W111-L134 HydrophobicContact CH2-CD1 4.22Å; D130-L134 WeakPolarHBondContact O-CG 3.33Å; D130-L134 PolarHBondContact O-N 2.61Å; L131-L134 PolarHBondContact O-N 2.8Å; L134-A136 VanDerWaalsContact C-N 3.3Å; L134-A136 PolarHBondContact O-N 3.27Å; L134-Q137 WeakPolarHBondContact O-CB 3.31Å; L134-Q137 PolarHBondContact O-N 3.12Å; L134-V138 VanDerWaalsContact O-CG2 3.25Å; L134-V138 WeakPolarHBondContact O-CG2 3.5Å; L134-V138 PolarHBondContact O-N 3.3Å
135A92.4Very high87.7Confident0 Ų073.6 Ų73.60%037%0.368CS..Hα-helixtrans-57.8-42.6173.800000112I3 V8 L13 L131 D132 R133 Q137 V138 F139I3-A135 HydrophobicContact CG2-CB 4.41Å; V8-A135 HydrophobicContact CG2-CB 3.87Å; L13-A135 HydrophobicContact CD1-CB 4.07Å; L131-A135 WeakPolarHBondContact O-CB 3.16Å; L131-A135 PolarHBondContact O-N 2.99Å; D132-A135 PolarHBondContact O-N 3.33Å; R133-A135 VanDerWaalsContact C-N 3.34Å; A135-Q137 VanDerWaalsContact C-N 3.31Å; A135-Q137 PolarHBondContact O-N 2.96Å; A135-V138 PolarHBondContact O-N 2.95Å; A135-F139 PolarHBondContact O-N 2.93Å
136A91.7Very high86.3Confident32 Ų3273 Ų7326%0.26436%0.356SS..Hα-helixtrans-64.4-33.217500000113.1I3 D132 R133 L134 K140I3-A136 HydrophobicContact CD1-CB 4.5Å; D132-A136 PolarHBondContact O-N 3.38Å; R133-A136 PolarHBondContact O-N 3.32Å; L134-A136 VanDerWaalsContact C-N 3.3Å; L134-A136 PolarHBondContact O-N 3.27Å; A136-K140 WeakPolarHBondContact O-CG 3.49Å; A136-K140 PolarHBondContact O-N 2.87Å; A136-K140 VanDerWaalsContact O-N 3.16Å
137Q90.9Very high84.6Confident106 Ų10673.7 Ų73.750%0.49536%0.356SS..Hα-helixtrans-68.4-43.6174.1-71.5178-16.500111.8R133 L134 A135 F139 K140 K141R133-Q137 PolarHBondContact O-N 2.78Å; R133-Q137 VanDerWaalsContact O-N 3.11Å; L134-Q137 WeakPolarHBondContact O-CB 3.31Å; L134-Q137 PolarHBondContact O-N 3.12Å; A135-Q137 VanDerWaalsContact C-N 3.31Å; A135-Q137 PolarHBondContact O-N 2.96Å; Q137-F139 VanDerWaalsContact C-N 3.3Å; Q137-F139 PolarHBondContact O-N 3.18Å; Q137-K140 PolarHBondContact O-N 3.11Å; Q137-K141 PolarHBondContact O-N 3.13Å; Q137-K141 VanDerWaalsContact O-N 3.1Å
138V90.4Very high82.3Confident7 Ų782.1 Ų82.14%0.04239%0.393CS..Hα-helixtrans-60.8-43.6176.5-175.70000110.5V8 L12 L13 E16 L134 A135 K140 K141 C142V8-V138 HydrophobicContact CG1-CB 3.84Å; V8-V138 HydrophobicContact CG1-CG1 3.53Å; L12-V138 HydrophobicContact CB-CG1 3.9Å; L12-V138 HydrophobicContact CD1-CG1 4.48Å; L13-V138 HydrophobicContact CD1-CG2 4.22Å; E16-V138 HydrophobicContact CB-CG2 3.73Å; E16-V138 HydrophobicContact CG-CG2 3.66Å; L134-V138 VanDerWaalsContact O-CG2 3.25Å; L134-V138 WeakPolarHBondContact O-CG2 3.5Å; L134-V138 PolarHBondContact O-N 3.3Å; A135-V138 PolarHBondContact O-N 2.95Å; V138-K140 VanDerWaalsContact C-N 3.32Å; V138-K140 PolarHBondContact O-N 3.25Å; V138-K141 PolarHBondContact O-N 3.03Å; V138-K141 VanDerWaalsContact O-N 3.11Å; V138-C142 PolarHBondContact O-N 3.33Å
139F87Confident79.6Confident61 Ų6183.8 Ų83.827%0.26841%0.411SS..Hα-helixtrans-59.6-40.8177.2-177-89.9000112.6I3 A135 Q137 K141 C142 I146I3-F139 HydrophobicContact CD1-CB 3.87Å; I3-F139 HydrophobicContact CD1-CD1 3.44Å; I3-F139 VanDerWaalsContact CD1-CD1 3.44Å; I3-F139 HydrophobicContact CD1-CD2 4.16Å; I3-F139 HydrophobicContact CD1-CE1 3.99Å; I3-F139 HydrophobicContact CD1-CG 3.55Å; I3-F139 HydrophobicContact CG1-CG 4.37Å; I3-F139 HydrophobicContact CG2-CB 4.46Å; A135-F139 PolarHBondContact O-N 2.93Å; Q137-F139 VanDerWaalsContact C-N 3.3Å; Q137-F139 PolarHBondContact O-N 3.18Å; F139-K141 VanDerWaalsContact C-N 3.32Å; F139-K141 PolarHBondContact O-N 2.98Å; F139-C142 CarbonylContact O-C 3.4Å; F139-I146 HydrophobicContact CD2-CG1 4.49Å; F139-I146 HydrophobicContact CE2-CD1 3.76Å; F139-I146 HydrophobicContact CE2-CG1 3.76Å; F139-I146 HydrophobicContact CZ-CD1 4.24Å
140K86.7Confident77Confident175 Ų17581.4 Ų81.476%0.76142%0.418SS*.Hα-helixtrans-63.8-37.9175.2-75.1-179.5179.1-171.10112.4A136 Q137 V138A136-K140 WeakPolarHBondContact O-CG 3.49Å; A136-K140 PolarHBondContact O-N 2.87Å; A136-K140 VanDerWaalsContact O-N 3.16Å; Q137-K140 PolarHBondContact O-N 3.11Å; V138-K140 VanDerWaalsContact C-N 3.32Å; V138-K140 PolarHBondContact O-N 3.25Å
141K85.9Confident74.2Confident144 Ų14481.7 Ų81.763%0.62643%0.431SS*.Hα-helixtrans-73.9-39.6-178.1-164.9-178-175.6-174.20112.1E16 Q137 V138 F139E16-K141 IonicContact OE1-NZ 2.78Å; E16-K141 PolarHBondContact OE1-NZ 3.06Å; Q137-K141 PolarHBondContact O-N 3.13Å; Q137-K141 VanDerWaalsContact O-N 3.1Å; V138-K141 PolarHBondContact O-N 3.03Å; V138-K141 VanDerWaalsContact O-N 3.11Å; F139-K141 VanDerWaalsContact C-N 3.32Å; F139-K141 PolarHBondContact O-N 2.98Å
142C80.6Confident71.3Confident45 Ų4588.2 Ų88.230%0.30447%0.471SS..  trans-132.385.7-179.7-670000111.1L12 V138 F139 S144 L145L12-C142 HydrophobicContact CD1-CB 4.47Å; V138-C142 PolarHBondContact O-N 3.33Å; F139-C142 CarbonylContact O-C 3.4Å; C142-S144 PolarHBondContact O-N 2.93Å; C142-L145 HydrophobicContact CB-CD1 4.47Å
143P71Confident68.2Low82 Ų8298.8 Ų98.853%0.53251%0.51SS..THydrogen-bonded Turntrans-65.8-23.3-178.8-21.332.6000114.2L145P143-L145 VanDerWaalsContact C-N 3.35Å; P143-L145 PolarHBondContact O-N 2.88Å
144S68.3Low65.2Low111 Ų111103.5 Ų103.578%0.77654%0.535SS*.THydrogen-bonded Turntrans-77-15.7-172.151.20000114.6C142 I146C142-S144 PolarHBondContact O-N 2.93Å; S144-I146 PolarHBondContact O-N 3.15Å
145L61Low63.8Low89 Ų89108.3 Ų108.347%0.46656%0.56SS.*  trans-102.350.4-173.1-70.8167.6000112.5D9 L12 C142 P143 M147D9-L145 HydrophobicContact CB-CB 4.48Å; L12-L145 HydrophobicContact CD1-CD1 3.38Å; C142-L145 HydrophobicContact CB-CD1 4.47Å; P143-L145 VanDerWaalsContact C-N 3.35Å; P143-L145 PolarHBondContact O-N 2.88Å; L145-M147 PolarHBondContact O-N 3.18Å
146I63.3Low62.3Low81 Ų81114 Ų11442%0.41559%0.589SS.*BIsolated β-bridgetrans-74119.3167.6-57.4-178.9000107.5F139 S144 K148F139-I146 HydrophobicContact CD2-CG1 4.49Å; F139-I146 HydrophobicContact CE2-CD1 3.76Å; F139-I146 HydrophobicContact CE2-CG1 3.76Å; F139-I146 HydrophobicContact CZ-CD1 4.24Å; S144-I146 PolarHBondContact O-N 3.15Å; I146-K148 HydrophobicContact CG2-CG 4.14Å; I146-K148 PolarHBondContact O-N 3.3Å
147M57.9Low60.7Low82 Ų82118.6 Ų118.640%0.40461%0.607SS.*  trans-67.884.8164.8-81.7-160.4165.100108.2D7 L145 N149D7-M147 PolarHBondContact O-N 3.28Å; L145-M147 PolarHBondContact O-N 3.18Å; M147-N149 PolarHBondContact O-N 3.39Å
148K44.1Very low58.9Low176 Ų176119.3 Ų119.377%0.76561%0.614SS**  trans-63.9108.8169-68.6-171.7-179.7-1780107.1I146I146-K148 HydrophobicContact CG2-CG 4.14Å; I146-K148 PolarHBondContact O-N 3.3Å
149N38.3Very low56.9Low154 Ų154126.3 Ų126.382%0.82465%0.65SS**  trans65.282.7168.2-55.6-24.5000115.9M147 G151M147-N149 PolarHBondContact O-N 3.39Å; N149-G151 PolarHBondContact O-N 3.05Å
150C39.6Very low54.9Low119 Ų119130.7 Ų130.780%0.80468%0.675SS**  trans-7781.7147.2-162.20000107.5T152C150-T152 PolarHBondContact O-N 3.13Å
151G34Very low52.7Low49 Ų49127.5 Ų127.551%0.50567%0.669SS.*  trans-50.7134.6170.300000110.2N149 R153N149-G151 PolarHBondContact O-N 3.05Å; G151-R153 PolarHBondContact O-N 3.06Å
152T32.4Very low50.1Low138 Ų138126.2 Ų126.285%0.84767%0.672SS**  trans-28.797.4161.637.70000112C150 K154C150-T152 PolarHBondContact O-N 3.13Å; T152-K154 PolarHBondContact O-N 3.15Å; T152-K154 VanDerWaalsContact O-N 3.15Å
153R30Very low47.6Very low244 Ų244133 Ų13392%0.92170%0.703SS**  trans-74.6103.5154.9-72.3-169-162.2-176.74.5105.8G151G151-R153 PolarHBondContact O-N 3.06Å
154K30.8Very low45.4Very low271 Ų271137.6 Ų137.6100%1.17872%0.719SS**  trans-44.20163-73.7-179.9176.2-178.90110.5T152T152-K154 PolarHBondContact O-N 3.15Å; T152-K154 VanDerWaalsContact O-N 3.15Å

Retrieved 154 of 154 residues in 213.8 ms (Link to these results)

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