A0A060X8A2_ONCMY Loading...

PRA1 family protein

AlphaFold DB , UniProt , Accession A0A060X8A2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110532446, Length 191 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
1M41.6Very low68.8Low243 Ų243103.2 Ų103.2100%1.19758%0.579SS**  0125.50-61.6-166.6-141.400107.1S3M1-S3 PolarHBondContact O-N 3.45Å
2A48.8Very low70.2Confident83 Ų83107.8 Ų107.869%0.68658%0.581SS**  trans-67121.1177.400000108.6M4A2-M4 PolarHBondContact O-N 3.23Å
3S54Low71.3Confident89 Ų89110 Ų11062%0.62259%0.592SS**  trans-63.6112.9170.643.80000108.2M1 E5M1-S3 PolarHBondContact O-N 3.45Å; S3-E5 PolarHBondContact O-N 2.93Å
4M60.5Low72.2Confident125 Ų125105.4 Ų105.462%0.61657%0.567SS**  trans-68.1113.6169.3-82.1-170.7-94.500107.8A2 K160 P162 I165A2-M4 PolarHBondContact O-N 3.23Å; M4-K160 WeakPolarHBondContact CG-O 3.07Å; M4-P162 HydrophobicContact SD-CG 4.13Å; M4-I165 HydrophobicContact CG-CD1 4.23Å; M4-I165 HydrophobicContact SD-CD1 3.7Å
5E67.2Low73.2Confident137 Ų13798.5 Ų98.564%0.6453%0.53SS*.PPolyproline II helixtrans-90.1129.9173.6-70.4-178.917200109S3S3-E5 PolarHBondContact O-N 2.93Å
6L66.4Low74Confident139 Ų13998 Ų9873%0.72852%0.522SS*.PPolyproline II helixtrans-71.6135.1171.7-69.8174.4000108.9P162L6-P162 HydrophobicContact CD2-CG 4.46Å
7A76.4Confident74.3Confident14 Ų1494.2 Ų94.212%0.11650%0.504CS..PPolyproline II helixtrans-61.314317400000109.9Q45 T46A7-Q45 HydrophobicContact CB-CB 4.33Å; A7-T46 WeakPolarHBondContact O-CB 3.39Å; A7-T46 PolarHBondContact O-OG1 2.99Å
8P82Confident74.5Confident76 Ų7691.4 Ų91.449%0.49450%0.5SS..PPolyproline II helixtrans-64.1146.4176.527.1-34.2000110.9R10P8-R10 PolarHBondContact O-N 3.28Å
9L84.9Confident74.6Confident112 Ų11291.3 Ų91.359%0.58651%0.513SS*.PPolyproline II helixtrans-66.5126.7170.7-175.272.6000109T46 N47 A50L9-T46 HydrophobicContact CB-CG2 4Å; L9-T46 HydrophobicContact CD1-CG2 3.89Å; L9-N47 HydrophobicContact CD1-CB 4.36Å; L9-A50 HydrophobicContact CD1-CB 4.49Å
10R87.5Confident74.6Confident29 Ų2992.7 Ų92.711%0.10952%0.519CS..PPolyproline II helixtrans-83.7148.2-180-56.6-58.6179.3175-0.8111.3P8 Y43 Y44 N47 E154P8-R10 PolarHBondContact O-N 3.28Å; R10-Y43 HydrophobicContact CG-CD1 4.42Å; R10-Y43 HydrophobicContact CG-CE1 4.03Å; R10-Y43 PolarHBondContact NE-O 3.29Å; R10-Y44 HydrophobicContact CB-CD1 3.84Å; R10-Y44 HydrophobicContact CB-CE1 3.84Å; R10-Y44 HydrophobicContact CG-CD1 3.69Å; R10-Y44 HydrophobicContact CG-CE1 3.94Å; R10-N47 WeakPolarHBondContact CB-OD1 3.45Å; R10-N47 PolarHBondContact N-OD1 3.42Å; R10-N47 PolarHBondContact O-ND2 2.82Å; R10-E154 IonicContact CZ-OE1 3.26Å; R10-E154 VanDerWaalsContact CZ-OE1 3.26Å; R10-E154 IonicContact CZ-OE2 3.76Å; R10-E154 IonicContact NH1-OE1 2.85Å; R10-E154 PolarHBondContact NH1-OE1 2.87Å; R10-E154 IonicContact NH2-OE1 2.75Å; R10-E154 PolarHBondContact NH2-OE1 3.14Å; R10-E154 IonicContact NH2-OE2 2.8Å; R10-E154 PolarHBondContact NH2-OE2 2.81Å
11P87.3Confident74.9Confident88 Ų8892.9 Ų92.957%0.57151%0.512SS*.PPolyproline II helixtrans-53.7144.9175-24.634000112.4D13 D14 F15P11-D13 VanDerWaalsContact C-N 3.33Å; P11-D13 PolarHBondContact O-N 2.92Å; P11-D14 PolarHBondContact O-N 3.36Å; P11-F15 PolarHBondContact O-N 3.38Å; P11-F15 VanDerWaalsContact O-N 3.07Å
12W85.3Confident76.9Confident159 Ų15984.1 Ų84.160%0.60247%0.467SS*.Hα-helixtrans-62.4-39.4-177.8-169.9-101.5000112.8D14 F15 F16W12-D14 PolarHBondContact O-N 2.93Å; W12-F15 HydrophobicContact CE3-CD1 4.15Å; W12-F15 AromaticContact CZ3-CD1 3.97Å; W12-F15 HydrophobicContact CZ3-CD1 3.97Å; W12-F15 HydrophobicContact CZ3-CE1 4.39Å; W12-F15 PolarHBondContact O-N 2.9Å; W12-F16 HydrophobicContact CD2-CD2 4.03Å; W12-F16 AromaticContact CE2-CD2 3.54Å; W12-F16 HydrophobicContact CE3-CD2 4.19Å; W12-F16 HydrophobicContact CE3-CE2 4.49Å; W12-F16 AromaticContact CH2-CD2 3.51Å; W12-F16 HydrophobicContact CH2-CD2 3.51Å; W12-F16 AromaticContact CH2-CE2 3.27Å; W12-F16 HydrophobicContact CH2-CE2 3.27Å; W12-F16 HydrophobicContact CH2-CZ 4.46Å; W12-F16 AromaticContact CZ2-CD2 3.27Å; W12-F16 HydrophobicContact CZ2-CD2 3.27Å; W12-F16 AromaticContact CZ2-CE2 3.49Å; W12-F16 HydrophobicContact CZ2-CE2 3.49Å; W12-F16 VanDerWaalsContact CZ2-CE2 3.49Å; W12-F16 HydrophobicContact CZ2-CG 4.3Å; W12-F16 AromaticContact CZ3-CD2 3.95Å; W12-F16 HydrophobicContact CZ3-CD2 3.95Å; W12-F16 AromaticContact CZ3-CE2 3.82Å; W12-F16 HydrophobicContact CZ3-CE2 3.82Å; W12-F16 PolarHBondContact O-N 3.44Å
13D85.3Confident78.6Confident136 Ų13681.8 Ų81.873%0.72745%0.448SS*.Hα-helixtrans-65.3-25178.8-58.1-36.1000113.1P11 P17P11-D13 VanDerWaalsContact C-N 3.33Å; P11-D13 PolarHBondContact O-N 2.92Å; D13-P17 WeakPolarHBondContact O-CA 3.41Å
14D84.1Confident80Confident46 Ų4685.5 Ų85.525%0.24645%0.453CS..Hα-helixtrans-82.4-34.5171.2178.872.2000111.2P11 W12 P17 Y43 Y44 R141P11-D14 PolarHBondContact O-N 3.36Å; W12-D14 PolarHBondContact O-N 2.93Å; D14-P17 WeakPolarHBondContact O-CD 3.28Å; D14-Y43 WeakPolarHBondContact OD2-CE1 3.28Å; D14-Y44 VanDerWaalsContact CG-OH 3.29Å; D14-Y44 PolarHBondContact O-OH 3.43Å; D14-Y44 WeakPolarHBondContact OD2-CE1 3.21Å; D14-Y44 VanDerWaalsContact OD2-CZ 3.28Å; D14-Y44 PolarHBondContact OD2-OH 2.87Å; D14-R141 IonicContact OD1-NH2 3.96Å; D14-R141 IonicContact OD2-NH2 3.87Å
15F86.8Confident81.1Confident2 Ų280.4 Ų80.41%0.00943%0.429CS..Hα-helixtrans-72.1-48.3179.8-171.6-124.9000112.6P11 W12 P17 Y44 N47 Y48 V51 H137P11-F15 PolarHBondContact O-N 3.38Å; P11-F15 VanDerWaalsContact O-N 3.07Å; W12-F15 HydrophobicContact CE3-CD1 4.15Å; W12-F15 AromaticContact CZ3-CD1 3.97Å; W12-F15 HydrophobicContact CZ3-CD1 3.97Å; W12-F15 HydrophobicContact CZ3-CE1 4.39Å; W12-F15 PolarHBondContact O-N 2.9Å; F15-P17 WeakPolarHBondContact O-CD 3.3Å; F15-Y44 HydrophobicContact CB-CD1 4.47Å; F15-Y44 HydrophobicContact CB-CE1 4.16Å; F15-Y44 AromaticContact CD2-CD1 3.47Å; F15-Y44 HydrophobicContact CD2-CD1 3.47Å; F15-Y44 VanDerWaalsContact CD2-CD1 3.47Å; F15-Y44 AromaticContact CD2-CD2 3.9Å; F15-Y44 HydrophobicContact CD2-CD2 3.9Å; F15-Y44 AromaticContact CD2-CE1 3.8Å; F15-Y44 HydrophobicContact CD2-CE1 3.8Å; F15-Y44 HydrophobicContact CD2-CE2 4.14Å; F15-Y44 AromaticContact CD2-CG 3.54Å; F15-Y44 HydrophobicContact CD2-CG 3.54Å; F15-Y44 HydrophobicContact CE2-CD1 4.17Å; F15-Y44 HydrophobicContact CE2-CD2 4.1Å; F15-Y44 AromaticContact CE2-CG 3.8Å; F15-Y44 HydrophobicContact CE2-CG 3.8Å; F15-Y44 HydrophobicContact CG-CD1 4.39Å; F15-Y44 HydrophobicContact CG-CE1 4.48Å; F15-N47 HydrophobicContact CD1-CB 4.1Å; F15-N47 HydrophobicContact CD2-CB 3.76Å; F15-N47 HydrophobicContact CE1-CB 4.03Å; F15-N47 HydrophobicContact CE2-CB 3.67Å; F15-N47 HydrophobicContact CG-CB 3.98Å; F15-N47 HydrophobicContact CZ-CB 3.83Å; F15-Y48 AromaticContact CE2-CD1 3.88Å; F15-Y48 HydrophobicContact CE2-CD1 3.88Å; F15-Y48 AromaticContact CE2-CE1 3.54Å; F15-Y48 HydrophobicContact CE2-CE1 3.54Å; F15-Y48 AromaticContact CZ-CD1 3.7Å; F15-Y48 HydrophobicContact CZ-CD1 3.7Å; F15-Y48 AromaticContact CZ-CE1 3.65Å; F15-Y48 HydrophobicContact CZ-CE1 3.65Å; F15-V51 HydrophobicContact CE1-CG2 3.79Å; F15-V51 HydrophobicContact CZ-CG2 4.24Å; F15-H137 AromaticContact CD2-CE1 3.51Å; F15-H137 AromaticContact CE2-CE1 3.3Å; F15-H137 WeakPolarHBondContact CE2-CE1 3.35Å; F15-H137 AromaticContact CE2-ND1 3.57Å; F15-H137 AromaticContact CE2-NE2 3.97Å; F15-H137 AromaticContact CZ-CE1 3.92Å; F15-H137 PolarHBondContact O-CE1 3.05Å; F15-H137 VanDerWaalsContact O-CE1 3.32Å; F15-H137 PolarHBondContact O-NE2 3.13Å
16F85.8Confident81.7Confident90 Ų9077.3 Ų77.340%0.39542%0.417SS..SBendtrans-114.673.7173.4-71.8-75.9000111.1W12 F22 H137W12-F16 HydrophobicContact CD2-CD2 4.03Å; W12-F16 AromaticContact CE2-CD2 3.54Å; W12-F16 HydrophobicContact CE3-CD2 4.19Å; W12-F16 HydrophobicContact CE3-CE2 4.49Å; W12-F16 AromaticContact CH2-CD2 3.51Å; W12-F16 HydrophobicContact CH2-CD2 3.51Å; W12-F16 AromaticContact CH2-CE2 3.27Å; W12-F16 HydrophobicContact CH2-CE2 3.27Å; W12-F16 HydrophobicContact CH2-CZ 4.46Å; W12-F16 AromaticContact CZ2-CD2 3.27Å; W12-F16 HydrophobicContact CZ2-CD2 3.27Å; W12-F16 AromaticContact CZ2-CE2 3.49Å; W12-F16 HydrophobicContact CZ2-CE2 3.49Å; W12-F16 VanDerWaalsContact CZ2-CE2 3.49Å; W12-F16 HydrophobicContact CZ2-CG 4.3Å; W12-F16 AromaticContact CZ3-CD2 3.95Å; W12-F16 HydrophobicContact CZ3-CD2 3.95Å; W12-F16 AromaticContact CZ3-CE2 3.82Å; W12-F16 HydrophobicContact CZ3-CE2 3.82Å; W12-F16 PolarHBondContact O-N 3.44Å; F16-F22 HydrophobicContact CD1-CZ 4.38Å; F16-H137 AromaticContact CE1-CD2 3.63Å
17P78.5Confident82.4Confident34 Ų3476.4 Ų76.422%0.22141%0.408CS..  trans-72.7-179.8177.232.3-37.8000111.8D13 D14 F15 R21 F22D13-P17 WeakPolarHBondContact O-CA 3.41Å; D14-P17 WeakPolarHBondContact O-CD 3.28Å; F15-P17 WeakPolarHBondContact O-CD 3.3Å; P17-R21 HydrophobicContact CB-CB 3.84Å; P17-R21 HydrophobicContact CB-CG 3.74Å; P17-R21 HydrophobicContact CG-CB 3.37Å; P17-R21 HydrophobicContact CG-CG 3.84Å; P17-F22 HydrophobicContact CG-CE2 3.92Å; P17-F22 HydrophobicContact CG-CZ 4.28Å; P17-F22 WeakPolarHBondContact O-CE2 3.29Å
18G78.4Confident82.6Confident43 Ų4379.4 Ų79.444%0.44344%0.439SS..  trans-53.8159.4170.600000113.5D20 R21G18-D20 WeakPolarHBondContact CA-OD1 3.31Å; G18-D20 PolarHBondContact O-N 2.86Å; G18-R21 PolarHBondContact O-N 3.39Å
19A75.5Confident82.8Confident90 Ų9079 Ų7974%0.74443%0.434SS*.G310 helixtrans-58.5-21.3-177.200000113.9R21 F22A19-R21 PolarHBondContact O-N 3.09Å; A19-F22 PolarHBondContact O-N 3.08Å
20D76.3Confident82.8Confident119 Ų11978.8 Ų78.864%0.63643%0.432SS*.G310 helixtrans-64.8-20.3176.165.6-56.9000113.7G18G18-D20 WeakPolarHBondContact CA-OD1 3.31Å; G18-D20 PolarHBondContact O-N 2.86Å
21R79.7Confident82.6Confident96 Ų9680.3 Ų80.336%0.36245%0.451SS..G310 helixtrans-95.52.8178.1-63.2-66-173.2-178.2-2.1113.2P17 G18 A19 L142 N144P17-R21 HydrophobicContact CB-CB 3.84Å; P17-R21 HydrophobicContact CB-CG 3.74Å; P17-R21 HydrophobicContact CG-CB 3.37Å; P17-R21 HydrophobicContact CG-CG 3.84Å; G18-R21 PolarHBondContact O-N 3.39Å; A19-R21 PolarHBondContact O-N 3.09Å; R21-L142 WeakPolarHBondContact O-CB 3.5Å; R21-L142 PolarHBondContact O-N 2.84Å; R21-N144 VanDerWaalsContact NH1-CG 3.31Å; R21-N144 PolarHBondContact NH1-ND2 3.16Å
22F83.7Confident82.4Confident59 Ų5981.4 Ų81.426%0.25945%0.447SS..BIsolated β-bridgetrans-112.3131.2172-66.6-81000109.4F16 P17 A19 H137 L140 R141F16-F22 HydrophobicContact CD1-CZ 4.38Å; P17-F22 HydrophobicContact CG-CE2 3.92Å; P17-F22 HydrophobicContact CG-CZ 4.28Å; P17-F22 WeakPolarHBondContact O-CE2 3.29Å; A19-F22 PolarHBondContact O-N 3.08Å; F22-H137 AromaticContact CE1-CD2 3.86Å; F22-H137 AromaticContact CE1-NE2 3.76Å; F22-H137 AromaticContact CZ-NE2 3.8Å; F22-L140 WeakPolarHBondContact CA-O 3.38Å; F22-L140 HydrophobicContact CD1-CB 3.79Å; F22-R141 HydrophobicContact CD1-CB 4.34Å; F22-R141 HydrophobicContact CE1-CB 4.05Å
23A84.9Confident82.4Confident34 Ų3477.3 Ų77.328%0.28143%0.431SS..  trans-138.3147.8173.700000110.9L140 L142A23-L140 PolarHBondContact N-O 2.95Å; A23-L140 WeakPolarHBondContact O-CA 3.47Å; A23-L142 HydrophobicContact CB-CD1 3.47Å; A23-L142 VanDerWaalsContact CB-CD1 3.47Å; A23-L142 HydrophobicContact CB-CD2 4Å; A23-L142 HydrophobicContact CB-CG 3.75Å
24K84.4Confident82.3Confident167 Ų16774 Ų7473%0.72641%0.414SS*.  trans-53136.7175.4-169.6-179.8176.8-178.70109.7D26K24-D26 PolarHBondContact O-N 3.08Å
25P82.1Confident82.3Confident18 Ų1876.9 Ų76.912%0.11743%0.429CS..  trans-58.8139.6172.126-36.4000110.2F27 W33P25-F27 HydrophobicContact CB-CE1 4.12Å; P25-F27 HydrophobicContact CB-CE2 4.41Å; P25-F27 HydrophobicContact CB-CZ 4.03Å; P25-F27 HydrophobicContact CG-CE1 3.92Å; P25-F27 HydrophobicContact CG-CE2 3.69Å; P25-F27 HydrophobicContact CG-CZ 3.35Å; P25-F27 PolarHBondContact O-N 3.41Å; P25-W33 VanDerWaalsContact CB-CD1 3.44Å; P25-W33 HydrophobicContact CB-CD2 4.47Å; P25-W33 HydrophobicContact CB-CG 4.08Å
26D79.9Confident82.3Confident72 Ų7278.5 Ų78.539%0.38544%0.435SS..  trans-90.298.3174.7-176.11.4000107.9K24 G28 D29K24-D26 PolarHBondContact O-N 3.08Å; D26-G28 PolarHBondContact O-N 2.83Å; D26-G28 PolarHBondContact OD1-N 3.37Å; D26-G28 VanDerWaalsContact OD1-N 3.12Å; D26-D29 PolarHBondContact O-N 3.47Å
27F80.6Confident82.3Confident121 Ų12175 Ų7553%0.53142%0.421SS..THydrogen-bonded Turntrans-76.2-7.4-179.8-60.7-68.4000112.9P25 W33P25-F27 HydrophobicContact CB-CE1 4.12Å; P25-F27 HydrophobicContact CB-CE2 4.41Å; P25-F27 HydrophobicContact CB-CZ 4.03Å; P25-F27 HydrophobicContact CG-CE1 3.92Å; P25-F27 HydrophobicContact CG-CE2 3.69Å; P25-F27 HydrophobicContact CG-CZ 3.35Å; P25-F27 PolarHBondContact O-N 3.41Å; F27-W33 HydrophobicContact CE1-CH2 4.38Å; F27-W33 HydrophobicContact CE1-CZ2 4.34Å
28G81.9Confident82.6Confident76 Ų7675.7 Ų75.778%0.78442%0.422SS*.THydrogen-bonded Turntrans-76.2-26.8173.600000113D26D26-G28 PolarHBondContact O-N 2.83Å; D26-G28 PolarHBondContact OD1-N 3.37Å; D26-G28 VanDerWaalsContact OD1-N 3.12Å
29D85.3Confident82.9Confident69 Ų6974.5 Ų74.537%0.36941%0.407SS..  trans-121.882.5175.1-175-11.9000109.9D26 A31 K32 W33D26-D29 PolarHBondContact O-N 3.47Å; D29-A31 PolarHBondContact O-N 2.87Å; D29-A31 PolarHBondContact OD1-N 3.49Å; D29-K32 HydrophobicContact CB-CB 4.03Å; D29-K32 PolarHBondContact O-N 3.44Å; D29-K32 WeakPolarHBondContact OD1-CB 3.09Å; D29-K32 PolarHBondContact OD1-N 3.35Å; D29-K32 VanDerWaalsContact OD2-CB 3.26Å; D29-K32 WeakPolarHBondContact OD2-CB 3.32Å; D29-W33 PolarHBondContact O-N 3.05Å
30L85.3Confident83.5Confident107 Ų10770.2 Ų70.256%0.5637%0.372SS*.Hα-helixtrans-59.5-34.3-179.6-65.4177.3000112.3W33 N34L30-W33 HydrophobicContact CD2-CE3 4.12Å; L30-W33 PolarHBondContact O-N 2.87Å; L30-N34 VanDerWaalsContact O-CB 3.28Å; L30-N34 WeakPolarHBondContact O-CB 3.37Å; L30-N34 PolarHBondContact O-N 3.39Å
31A83.7Confident84.1Confident61 Ų6165.2 Ų65.250%0.50435%0.345SS..Hα-helixtrans-65.4-43.3178.600000110.9D29 N35D29-A31 PolarHBondContact O-N 2.87Å; D29-A31 PolarHBondContact OD1-N 3.49Å; A31-N35 VanDerWaalsContact O-CB 3.31Å; A31-N35 WeakPolarHBondContact O-CB 3.31Å; A31-N35 VanDerWaalsContact O-CG 3.26Å; A31-N35 PolarHBondContact O-N 3.48Å; A31-N35 PolarHBondContact O-ND2 2.88Å
32K82.7Confident84.3Confident110 Ų11062 Ų6248%0.47834%0.335SS..Hα-helixtrans-67.5-38.2175.7-177.6-176.9-179.4-173.80112.5D29 R36D29-K32 HydrophobicContact CB-CB 4.03Å; D29-K32 PolarHBondContact O-N 3.44Å; D29-K32 WeakPolarHBondContact OD1-CB 3.09Å; D29-K32 PolarHBondContact OD1-N 3.35Å; D29-K32 VanDerWaalsContact OD2-CB 3.26Å; D29-K32 WeakPolarHBondContact OD2-CB 3.32Å; K32-R36 WeakPolarHBondContact O-CB 3.39Å; K32-R36 PolarHBondContact O-N 3.42Å; K32-R36 VanDerWaalsContact O-N 3.08Å
33W84.8Confident84.3Confident73 Ų7359.7 Ų59.728%0.27733%0.325SS..Hα-helixtrans-66.4-46.2174.7175.851.4000111.8P25 F27 D29 L30 N35 R36 V37 S139P25-W33 VanDerWaalsContact CB-CD1 3.44Å; P25-W33 HydrophobicContact CB-CD2 4.47Å; P25-W33 HydrophobicContact CB-CG 4.08Å; F27-W33 HydrophobicContact CE1-CH2 4.38Å; F27-W33 HydrophobicContact CE1-CZ2 4.34Å; D29-W33 PolarHBondContact O-N 3.05Å; L30-W33 HydrophobicContact CD2-CE3 4.12Å; L30-W33 PolarHBondContact O-N 2.87Å; W33-N35 PolarHBondContact O-N 2.96Å; W33-R36 WeakPolarHBondContact O-CA 3.33Å; W33-R36 VanDerWaalsContact O-CB 3.28Å; W33-R36 WeakPolarHBondContact O-CB 3.26Å; W33-R36 PolarHBondContact O-N 2.96Å; W33-V37 HydrophobicContact CZ2-CG2 4.42Å; W33-V37 WeakPolarHBondContact O-CG2 3.25Å; W33-V37 PolarHBondContact O-N 3.3Å; W33-S139 PolarHBondContact NE1-OG 3.33Å
34N84.9Confident84.4Confident68 Ų6858.1 Ų58.136%0.36431%0.311SS..Hα-helixtrans-58.2-48.2176.2-173.832.8000111.4L30 R36 V37 I38L30-N34 VanDerWaalsContact O-CB 3.28Å; L30-N34 WeakPolarHBondContact O-CB 3.37Å; L30-N34 PolarHBondContact O-N 3.39Å; N34-R36 PolarHBondContact O-N 3.49Å; N34-V37 PolarHBondContact O-N 3.39Å; N34-V37 VanDerWaalsContact O-N 3.09Å; N34-I38 WeakPolarHBondContact O-CG1 3.28Å; N34-I38 PolarHBondContact O-N 3.34Å; N34-I38 WeakPolarHBondContact OD1-CD1 3.16Å
35N83.6Confident84.6Confident105 Ų10551.1 Ų51.156%0.56128%0.281SS*.Hα-helixtrans-57-36.2175.2-80.6-47.8000112.8A31 W33 S39A31-N35 VanDerWaalsContact O-CB 3.31Å; A31-N35 WeakPolarHBondContact O-CB 3.31Å; A31-N35 VanDerWaalsContact O-CG 3.26Å; A31-N35 PolarHBondContact O-N 3.48Å; A31-N35 PolarHBondContact O-ND2 2.88Å; W33-N35 PolarHBondContact O-N 2.96Å; N35-S39 WeakPolarHBondContact O-CB 3.33Å; N35-S39 PolarHBondContact O-N 2.88Å
36R85.4Confident84.9Confident36 Ų3652 Ų5214%0.13629%0.286CS..Hα-helixtrans-66.2-49.1174.9-176-170.3-58.7-176.22.7111.1K32 W33 N34 S39 N40 S139K32-R36 WeakPolarHBondContact O-CB 3.39Å; K32-R36 PolarHBondContact O-N 3.42Å; K32-R36 VanDerWaalsContact O-N 3.08Å; W33-R36 WeakPolarHBondContact O-CA 3.33Å; W33-R36 VanDerWaalsContact O-CB 3.28Å; W33-R36 WeakPolarHBondContact O-CB 3.26Å; W33-R36 PolarHBondContact O-N 2.96Å; N34-R36 PolarHBondContact O-N 3.49Å; R36-S39 PolarHBondContact O-N 2.73Å; R36-N40 WeakPolarHBondContact O-CB 3.24Å; R36-N40 PolarHBondContact O-N 3.27Å; R36-N40 PolarHBondContact O-ND2 3.45Å; R36-S139 WeakPolarHBondContact CD-O 3.09Å
37V87.6Confident85.6Confident16 Ų1648.9 Ų48.910%0.09727%0.27CS..Hα-helixtrans-59.7-55.3179.8174.60000110.4W33 N34 S39 N40 L41 A138W33-V37 HydrophobicContact CZ2-CG2 4.42Å; W33-V37 WeakPolarHBondContact O-CG2 3.25Å; W33-V37 PolarHBondContact O-N 3.3Å; N34-V37 PolarHBondContact O-N 3.39Å; N34-V37 VanDerWaalsContact O-N 3.09Å; V37-S39 VanDerWaalsContact C-N 3.34Å; V37-S39 PolarHBondContact O-N 3.15Å; V37-N40 PolarHBondContact O-N 3.47Å; V37-L41 HydrophobicContact CG1-CD1 3.82Å; V37-L41 HydrophobicContact CG1-CG 4.12Å; V37-L41 WeakPolarHBondContact O-CB 3.49Å; V37-L41 WeakPolarHBondContact O-CG 3.33Å; V37-L41 PolarHBondContact O-N 2.82Å; V37-A138 HydrophobicContact CG1-CB 4.18Å
38I84.9Confident86.2Confident49 Ų4943.4 Ų43.425%0.25125%0.245SC..Hα-helixtrans-55.2-49.5179.5-69.9173.5000111N34 N40 L41 L42 L167N34-I38 WeakPolarHBondContact O-CG1 3.28Å; N34-I38 PolarHBondContact O-N 3.34Å; N34-I38 WeakPolarHBondContact OD1-CD1 3.16Å; I38-N40 VanDerWaalsContact C-N 3.27Å; I38-N40 PolarHBondContact O-N 2.9Å; I38-L41 PolarHBondContact O-N 3.22Å; I38-L42 HydrophobicContact CG2-CD1 4.08Å; I38-L42 WeakPolarHBondContact O-CG 3.26Å; I38-L42 PolarHBondContact O-N 2.96Å; I38-L167 HydrophobicContact CG1-CD2 4.46Å; I38-L167 HydrophobicContact CG2-CD1 4.24Å
39S83.3Confident86.7Confident18 Ų1846.5 Ų46.513%0.12624%0.238CC..Hα-helixtrans-56.7-41.5177.81640000112.5N35 R36 V37 Y43 R143N35-S39 WeakPolarHBondContact O-CB 3.33Å; N35-S39 PolarHBondContact O-N 2.88Å; R36-S39 PolarHBondContact O-N 2.73Å; V37-S39 VanDerWaalsContact C-N 3.34Å; V37-S39 PolarHBondContact O-N 3.15Å; S39-Y43 VanDerWaalsContact O-CB 3.3Å; S39-Y43 WeakPolarHBondContact O-CB 3.46Å; S39-Y43 PolarHBondContact O-N 3.18Å; S39-R143 PolarHBondContact OG-NE 3.18Å; S39-R143 PolarHBondContact OG-NH1 2.8Å
40N88.8Confident87Confident0 Ų045.1 Ų45.10%024%0.236CC..Hα-helixtrans-74.8-41.1-179.6-72.1-25.3000111.9R36 V37 I38 L42 Y43 Y44 Y48 A138 R141R36-N40 WeakPolarHBondContact O-CB 3.24Å; R36-N40 PolarHBondContact O-N 3.27Å; R36-N40 PolarHBondContact O-ND2 3.45Å; V37-N40 PolarHBondContact O-N 3.47Å; I38-N40 VanDerWaalsContact C-N 3.27Å; I38-N40 PolarHBondContact O-N 2.9Å; N40-L42 VanDerWaalsContact C-N 3.33Å; N40-L42 PolarHBondContact O-N 3.32Å; N40-Y43 PolarHBondContact O-N 3.34Å; N40-Y44 PolarHBondContact O-N 3.48Å; N40-Y48 WeakPolarHBondContact O-CE2 3.19Å; N40-A138 HydrophobicContact CB-CB 4.05Å; N40-A138 PolarHBondContact ND2-O 3.13Å; N40-R141 PolarHBondContact ND2-O 3.37Å; N40-R141 WeakPolarHBondContact OD1-CD 3.39Å; N40-R141 PolarHBondContact OD1-NH1 3.45Å
41L88.2Confident87.4Confident14 Ų1441.4 Ų41.47%0.07322%0.217CC..Hα-helixtrans-56.3-44.8175.6-74.1-178000112.3V37 I38 Q45 Y48 I134 A138 M163 L167V37-L41 HydrophobicContact CG1-CD1 3.82Å; V37-L41 HydrophobicContact CG1-CG 4.12Å; V37-L41 WeakPolarHBondContact O-CB 3.49Å; V37-L41 WeakPolarHBondContact O-CG 3.33Å; V37-L41 PolarHBondContact O-N 2.82Å; I38-L41 PolarHBondContact O-N 3.22Å; L41-Q45 WeakPolarHBondContact O-CA 3.32Å; L41-Q45 PolarHBondContact O-N 3.43Å; L41-Y48 HydrophobicContact CD2-CD2 4.18Å; L41-Y48 HydrophobicContact CD2-CE2 3.96Å; L41-I134 HydrophobicContact CD2-CG2 3.58Å; L41-A138 HydrophobicContact CD2-CB 3.85Å; L41-A138 HydrophobicContact CG-CB 4.09Å; L41-M163 HydrophobicContact CB-CE 3.88Å; L41-M163 HydrophobicContact CB-CG 4.49Å; L41-M163 HydrophobicContact CD1-CE 4.28Å; L41-M163 HydrophobicContact CD2-CE 3.78Å; L41-M163 HydrophobicContact CG-CE 4.17Å; L41-L167 HydrophobicContact CB-CD1 4.21Å; L41-L167 HydrophobicContact CD1-CD2 4.25Å
42L84.7Confident87.9Confident29 Ų2939.7 Ų39.715%0.15220%0.203CC..Hα-helixtrans-67.8-48177.1-68.6173.6000112I38 N40 Y44 M158 M163 L167I38-L42 HydrophobicContact CG2-CD1 4.08Å; I38-L42 WeakPolarHBondContact O-CG 3.26Å; I38-L42 PolarHBondContact O-N 2.96Å; N40-L42 VanDerWaalsContact C-N 3.33Å; N40-L42 PolarHBondContact O-N 3.32Å; L42-Y44 PolarHBondContact O-N 2.86Å; L42-M158 HydrophobicContact CB-CE 3.76Å; L42-M158 HydrophobicContact CB-SD 3.8Å; L42-M158 HydrophobicContact CD1-CE 4.43Å; L42-M163 HydrophobicContact CD2-CB 4.37Å; L42-M163 HydrophobicContact CD2-CG 4.36Å; L42-L167 HydrophobicContact CD1-CD1 4.43Å; L42-L167 HydrophobicContact CD2-CD1 3.69Å; L42-L167 HydrophobicContact CG-CD1 3.76Å
43Y83.6Confident88.4Confident11 Ų1138 Ų384%0.04320%0.199CC..Hα-helixtrans-67.7-36.2-173-174.5-101.2000113.7R10 D14 S39 N40 N151R10-Y43 HydrophobicContact CG-CD1 4.42Å; R10-Y43 HydrophobicContact CG-CE1 4.03Å; R10-Y43 PolarHBondContact NE-O 3.29Å; D14-Y43 WeakPolarHBondContact OD2-CE1 3.28Å; S39-Y43 VanDerWaalsContact O-CB 3.3Å; S39-Y43 WeakPolarHBondContact O-CB 3.46Å; S39-Y43 PolarHBondContact O-N 3.18Å; N40-Y43 PolarHBondContact O-N 3.34Å; Y43-N151 WeakPolarHBondContact CD2-ND2 3.46Å; Y43-N151 WeakPolarHBondContact CD2-OD1 3.32Å
44Y87.1Confident88.8Confident0 Ų038.5 Ų38.50%021%0.21CC..THydrogen-bonded Turntrans-107.319.1-178.1-67.4-57.1000114R10 D14 F15 N40 L42 T46 N47 Y48 R141R10-Y44 HydrophobicContact CB-CD1 3.84Å; R10-Y44 HydrophobicContact CB-CE1 3.84Å; R10-Y44 HydrophobicContact CG-CD1 3.69Å; R10-Y44 HydrophobicContact CG-CE1 3.94Å; D14-Y44 VanDerWaalsContact CG-OH 3.29Å; D14-Y44 PolarHBondContact O-OH 3.43Å; D14-Y44 WeakPolarHBondContact OD2-CE1 3.21Å; D14-Y44 VanDerWaalsContact OD2-CZ 3.28Å; D14-Y44 PolarHBondContact OD2-OH 2.87Å; F15-Y44 HydrophobicContact CB-CD1 4.47Å; F15-Y44 HydrophobicContact CB-CE1 4.16Å; F15-Y44 AromaticContact CD2-CD1 3.47Å; F15-Y44 HydrophobicContact CD2-CD1 3.47Å; F15-Y44 VanDerWaalsContact CD2-CD1 3.47Å; F15-Y44 AromaticContact CD2-CD2 3.9Å; F15-Y44 HydrophobicContact CD2-CD2 3.9Å; F15-Y44 AromaticContact CD2-CE1 3.8Å; F15-Y44 HydrophobicContact CD2-CE1 3.8Å; F15-Y44 HydrophobicContact CD2-CE2 4.14Å; F15-Y44 AromaticContact CD2-CG 3.54Å; F15-Y44 HydrophobicContact CD2-CG 3.54Å; F15-Y44 HydrophobicContact CE2-CD1 4.17Å; F15-Y44 HydrophobicContact CE2-CD2 4.1Å; F15-Y44 AromaticContact CE2-CG 3.8Å; F15-Y44 HydrophobicContact CE2-CG 3.8Å; F15-Y44 HydrophobicContact CG-CD1 4.39Å; F15-Y44 HydrophobicContact CG-CE1 4.48Å; N40-Y44 PolarHBondContact O-N 3.48Å; L42-Y44 PolarHBondContact O-N 2.86Å; Y44-T46 PolarHBondContact O-N 3.29Å; Y44-T46 VanDerWaalsContact O-N 3.08Å; Y44-N47 WeakPolarHBondContact O-CA 3.12Å; Y44-N47 WeakPolarHBondContact O-CB 3.49Å; Y44-N47 PolarHBondContact O-N 2.87Å; Y44-Y48 VanDerWaalsContact CB-CE2 3.5Å; Y44-Y48 VanDerWaalsContact O-CD2 3.28Å; Y44-Y48 WeakPolarHBondContact O-CD2 3.24Å; Y44-Y48 PolarHBondContact O-N 2.94Å; Y44-R141 HydrophobicContact CE2-CG 4.13Å; Y44-R141 VanDerWaalsContact CZ-NH2 3.33Å; Y44-R141 PolarHBondContact OH-NE 3.39Å; Y44-R141 PolarHBondContact OH-NH2 2.92Å
45Q87.9Confident89.2Confident21 Ų2136.2 Ų36.210%0.09820%0.198CC..Hα-helixtrans-43.7-49.5-176.4176.2-176.8-34.200112.9A7 L41 Y48 F49 S161 M163A7-Q45 HydrophobicContact CB-CB 4.33Å; L41-Q45 WeakPolarHBondContact O-CA 3.32Å; L41-Q45 PolarHBondContact O-N 3.43Å; Q45-Y48 PolarHBondContact O-N 3.35Å; Q45-F49 PolarHBondContact O-N 3.43Å; Q45-S161 VanDerWaalsContact OE1-CB 3.24Å; Q45-S161 PolarHBondContact OE1-OG 3.43Å; Q45-M163 HydrophobicContact CB-CB 4.32Å; Q45-M163 VanDerWaalsContact CD-CB 3.44Å; Q45-M163 HydrophobicContact CG-CB 3.75Å; Q45-M163 HydrophobicContact CG-CG 4.48Å
46T89.3Confident89.5Confident37 Ų3735 Ų3523%0.22719%0.188CC..Hα-helixtrans-73.2-34.2-176.7-55.10000112.4A7 L9 Y44 F49 A50A7-T46 WeakPolarHBondContact O-CB 3.39Å; A7-T46 PolarHBondContact O-OG1 2.99Å; L9-T46 HydrophobicContact CB-CG2 4Å; L9-T46 HydrophobicContact CD1-CG2 3.89Å; Y44-T46 PolarHBondContact O-N 3.29Å; Y44-T46 VanDerWaalsContact O-N 3.08Å; T46-F49 PolarHBondContact O-N 3.02Å; T46-A50 WeakPolarHBondContact O-CB 3.27Å; T46-A50 PolarHBondContact O-N 3.07Å
47N93.3Very high89.8Confident6 Ų638.4 Ų38.43%0.03221%0.208CC..Hα-helixtrans-64.4-43.6172.2-64.165.9000111.1L9 R10 F15 Y44 F49 A50 V51L9-N47 HydrophobicContact CD1-CB 4.36Å; R10-N47 WeakPolarHBondContact CB-OD1 3.45Å; R10-N47 PolarHBondContact N-OD1 3.42Å; R10-N47 PolarHBondContact O-ND2 2.82Å; F15-N47 HydrophobicContact CD1-CB 4.1Å; F15-N47 HydrophobicContact CD2-CB 3.76Å; F15-N47 HydrophobicContact CE1-CB 4.03Å; F15-N47 HydrophobicContact CE2-CB 3.67Å; F15-N47 HydrophobicContact CG-CB 3.98Å; F15-N47 HydrophobicContact CZ-CB 3.83Å; Y44-N47 WeakPolarHBondContact O-CA 3.12Å; Y44-N47 WeakPolarHBondContact O-CB 3.49Å; Y44-N47 PolarHBondContact O-N 2.87Å; N47-F49 PolarHBondContact O-N 2.85Å; N47-A50 PolarHBondContact O-N 2.78Å; N47-V51 WeakPolarHBondContact O-CG2 3.49Å; N47-V51 PolarHBondContact O-N 2.7Å
48Y93.4Very high90Very high5 Ų542 Ų422%0.0223%0.226CC..Hα-helixtrans-62.9-41.8176.5-69.3-44.5000112.4F15 N40 L41 Y44 Q45 A50 V51 A52 I134 H137 A138F15-Y48 AromaticContact CE2-CD1 3.88Å; F15-Y48 HydrophobicContact CE2-CD1 3.88Å; F15-Y48 AromaticContact CE2-CE1 3.54Å; F15-Y48 HydrophobicContact CE2-CE1 3.54Å; F15-Y48 AromaticContact CZ-CD1 3.7Å; F15-Y48 HydrophobicContact CZ-CD1 3.7Å; F15-Y48 AromaticContact CZ-CE1 3.65Å; F15-Y48 HydrophobicContact CZ-CE1 3.65Å; N40-Y48 WeakPolarHBondContact O-CE2 3.19Å; L41-Y48 HydrophobicContact CD2-CD2 4.18Å; L41-Y48 HydrophobicContact CD2-CE2 3.96Å; Y44-Y48 VanDerWaalsContact CB-CE2 3.5Å; Y44-Y48 VanDerWaalsContact O-CD2 3.28Å; Y44-Y48 WeakPolarHBondContact O-CD2 3.24Å; Y44-Y48 PolarHBondContact O-N 2.94Å; Q45-Y48 PolarHBondContact O-N 3.35Å; Y48-A50 VanDerWaalsContact C-N 3.35Å; Y48-V51 PolarHBondContact O-N 2.88Å; Y48-A52 WeakPolarHBondContact O-CB 3.41Å; Y48-A52 PolarHBondContact O-N 3.38Å; Y48-I134 HydrophobicContact CD1-CB 3.98Å; Y48-I134 HydrophobicContact CD1-CG1 3.69Å; Y48-I134 HydrophobicContact CD1-CG2 3.67Å; Y48-I134 HydrophobicContact CD2-CG2 4Å; Y48-I134 HydrophobicContact CE1-CB 4.45Å; Y48-I134 HydrophobicContact CE1-CG2 4.05Å; Y48-I134 HydrophobicContact CE2-CG2 4.35Å; Y48-I134 HydrophobicContact CG-CB 4.33Å; Y48-I134 HydrophobicContact CG-CG1 4Å; Y48-I134 HydrophobicContact CG-CG2 3.64Å; Y48-H137 HydrophobicContact CE1-CB 3.98Å; Y48-H137 AromaticContact CE1-CG 3.88Å; Y48-H137 AromaticContact CE1-ND1 3.34Å; Y48-H137 VanDerWaalsContact CE1-ND1 3.34Å; Y48-H137 WeakPolarHBondContact CE1-ND1 3.18Å; Y48-H137 AromaticContact CZ-ND1 3.52Å; Y48-H137 PolarHBondContact OH-ND1 3.36Å; Y48-A138 WeakPolarHBondContact OH-CA 3.32Å; Y48-A138 PolarHBondContact OH-N 2.96Å
49F91.9Very high90.2Very high142 Ų14240.9 Ų40.962%0.62322%0.221SC*.Hα-helixtrans-63.3-42.2175.1-168.8-112.2000111.8Q45 T46 N47 A52 I53Q45-F49 PolarHBondContact O-N 3.43Å; T46-F49 PolarHBondContact O-N 3.02Å; N47-F49 PolarHBondContact O-N 2.85Å; F49-A52 PolarHBondContact O-N 3.4Å; F49-I53 HydrophobicContact CD1-CD1 3.67Å; F49-I53 HydrophobicContact CE1-CD1 3.38Å; F49-I53 HydrophobicContact CE1-CG1 4.33Å; F49-I53 HydrophobicContact CG-CD1 4.44Å; F49-I53 HydrophobicContact CZ-CD1 3.92Å; F49-I53 HydrophobicContact CZ-CG1 4.47Å; F49-I53 WeakPolarHBondContact O-CG1 3.41Å; F49-I53 PolarHBondContact O-N 3.21Å
50A93.4Very high90.4Very high40 Ų4040.7 Ų40.733%0.33122%0.222SC..Hα-helixtrans-62.1-45.8175.300000112L9 T46 N47 Y48 A52 I53 V54L9-A50 HydrophobicContact CD1-CB 4.49Å; T46-A50 WeakPolarHBondContact O-CB 3.27Å; T46-A50 PolarHBondContact O-N 3.07Å; N47-A50 PolarHBondContact O-N 2.78Å; Y48-A50 VanDerWaalsContact C-N 3.35Å; A50-A52 VanDerWaalsContact C-N 3.3Å; A50-A52 PolarHBondContact O-N 3.27Å; A50-I53 PolarHBondContact O-N 2.95Å; A50-V54 WeakPolarHBondContact O-CG2 3.33Å; A50-V54 PolarHBondContact O-N 3.22Å
51V93.5Very high90.5Very high28 Ų2849.1 Ų49.117%0.1726%0.259CS..Hα-helixtrans-59-43.4174.4169.50000110.8F15 N47 Y48 I53 V54 V55F15-V51 HydrophobicContact CE1-CG2 3.79Å; F15-V51 HydrophobicContact CZ-CG2 4.24Å; N47-V51 WeakPolarHBondContact O-CG2 3.49Å; N47-V51 PolarHBondContact O-N 2.7Å; Y48-V51 PolarHBondContact O-N 2.88Å; V51-I53 PolarHBondContact O-N 3.48Å; V51-V54 PolarHBondContact O-N 3.05Å; V51-V55 HydrophobicContact CG1-CG2 4.16Å; V51-V55 WeakPolarHBondContact O-CB 3.42Å; V51-V55 VanDerWaalsContact O-CG2 3.28Å; V51-V55 WeakPolarHBondContact O-CG2 3.35Å; V51-V55 PolarHBondContact O-N 3.39Å
52A93.3Very high90.5Very high26 Ų2655 Ų5522%0.21529%0.29CS..Hα-helixtrans-61-43.817800000112.5Y48 F49 A50 F56 P130 I134Y48-A52 WeakPolarHBondContact O-CB 3.41Å; Y48-A52 PolarHBondContact O-N 3.38Å; F49-A52 PolarHBondContact O-N 3.4Å; A50-A52 VanDerWaalsContact C-N 3.3Å; A50-A52 PolarHBondContact O-N 3.27Å; A52-F56 WeakPolarHBondContact O-CB 3.34Å; A52-F56 PolarHBondContact O-N 3.35Å; A52-P130 HydrophobicContact CB-CB 4Å; A52-I134 HydrophobicContact CB-CD1 4.28Å
53I93.4Very high90.7Very high75 Ų7557 Ų5739%0.38530%0.301SS..Hα-helixtrans-61.8-49.2174.7-69.5166.3000110.7F49 A50 V51 V55 F56 L57F49-I53 HydrophobicContact CD1-CD1 3.67Å; F49-I53 HydrophobicContact CE1-CD1 3.38Å; F49-I53 HydrophobicContact CE1-CG1 4.33Å; F49-I53 HydrophobicContact CG-CD1 4.44Å; F49-I53 HydrophobicContact CZ-CD1 3.92Å; F49-I53 HydrophobicContact CZ-CG1 4.47Å; F49-I53 WeakPolarHBondContact O-CG1 3.41Å; F49-I53 PolarHBondContact O-N 3.21Å; A50-I53 PolarHBondContact O-N 2.95Å; V51-I53 PolarHBondContact O-N 3.48Å; I53-V55 PolarHBondContact O-N 3.02Å; I53-F56 PolarHBondContact O-N 3.06Å; I53-L57 HydrophobicContact CG2-CD1 3.82Å; I53-L57 HydrophobicContact CG2-CG 4.2Å; I53-L57 WeakPolarHBondContact O-CB 3.44Å; I53-L57 VanDerWaalsContact O-CG 3.27Å; I53-L57 WeakPolarHBondContact O-CG 3.49Å; I53-L57 PolarHBondContact O-N 3.42Å
54V94.1Very high90.9Very high82 Ų8259.4 Ų59.450%0.49732%0.318SS..Hα-helixtrans-59.8-47.2-178.4169.90000111A50 V51 L57 I58A50-V54 WeakPolarHBondContact O-CG2 3.33Å; A50-V54 PolarHBondContact O-N 3.22Å; V51-V54 PolarHBondContact O-N 3.05Å; V54-L57 PolarHBondContact O-N 3.31Å; V54-I58 HydrophobicContact CG1-CD1 3.84Å; V54-I58 VanDerWaalsContact O-CG1 3.28Å; V54-I58 WeakPolarHBondContact O-CG1 3.38Å; V54-I58 PolarHBondContact O-N 3.04Å
55V92.2Very high90.9Very high20 Ų2066.1 Ų66.112%0.12135%0.353CS..Hα-helixtrans-63.9-43.1178174.50000110.9V51 I53 L57 I58 V59 F129 P130 L133V51-V55 HydrophobicContact CG1-CG2 4.16Å; V51-V55 WeakPolarHBondContact O-CB 3.42Å; V51-V55 VanDerWaalsContact O-CG2 3.28Å; V51-V55 WeakPolarHBondContact O-CG2 3.35Å; V51-V55 PolarHBondContact O-N 3.39Å; I53-V55 PolarHBondContact O-N 3.02Å; V55-L57 VanDerWaalsContact C-N 3.33Å; V55-L57 PolarHBondContact O-N 3.29Å; V55-I58 PolarHBondContact O-N 3.31Å; V55-V59 HydrophobicContact CG1-CG2 4.43Å; V55-V59 WeakPolarHBondContact O-CG2 3.31Å; V55-V59 PolarHBondContact O-N 2.95Å; V55-F129 HydrophobicContact CG1-CD1 3.7Å; V55-F129 HydrophobicContact CG1-CE1 4.12Å; V55-P130 HydrophobicContact CB-CG 4.04Å; V55-P130 HydrophobicContact CG1-CB 4.47Å; V55-P130 HydrophobicContact CG1-CG 3.69Å; V55-L133 HydrophobicContact CG2-CD1 4.04Å
56F90.4Very high90.9Very high79 Ų7965.7 Ų65.735%0.34635%0.354SS..Hα-helixtrans-59.6-43175.9-179.4-94.3000112.1A52 I53 V59 G60 M67 G126A52-F56 WeakPolarHBondContact O-CB 3.34Å; A52-F56 PolarHBondContact O-N 3.35Å; I53-F56 PolarHBondContact O-N 3.06Å; F56-V59 PolarHBondContact O-N 3.18Å; F56-G60 PolarHBondContact O-N 2.84Å; F56-M67 HydrophobicContact CD2-CE 4.04Å; F56-M67 HydrophobicContact CE1-CE 4.02Å; F56-M67 HydrophobicContact CE1-SD 4.33Å; F56-M67 HydrophobicContact CE2-CE 3.46Å; F56-M67 VanDerWaalsContact CE2-CE 3.46Å; F56-M67 HydrophobicContact CE2-SD 3.86Å; F56-M67 HydrophobicContact CZ-CE 3.45Å; F56-M67 VanDerWaalsContact CZ-CE 3.45Å; F56-M67 HydrophobicContact CZ-SD 3.49Å; F56-M67 WeakPolarHBondContact CZ-SD 3.39Å; F56-G126 WeakPolarHBondContact CD2-O 3.35Å
57L91.7Very high90.8Very high109 Ų10965.3 Ų65.357%0.57135%0.35SS*.Hα-helixtrans-65.2-41.1176.4-70.3175.7000112I53 V54 V55 G60 F61I53-L57 HydrophobicContact CG2-CD1 3.82Å; I53-L57 HydrophobicContact CG2-CG 4.2Å; I53-L57 WeakPolarHBondContact O-CB 3.44Å; I53-L57 VanDerWaalsContact O-CG 3.27Å; I53-L57 WeakPolarHBondContact O-CG 3.49Å; I53-L57 PolarHBondContact O-N 3.42Å; V54-L57 PolarHBondContact O-N 3.31Å; V55-L57 VanDerWaalsContact C-N 3.33Å; V55-L57 PolarHBondContact O-N 3.29Å; L57-G60 PolarHBondContact O-N 3.24Å; L57-F61 WeakPolarHBondContact O-CB 3.5Å; L57-F61 PolarHBondContact O-N 3.46Å
58I91.2Very high90.7Very high92 Ų9272.7 Ų72.747%0.47238%0.382SS..Hα-helixtrans-61.1-49.7175.2-69.4165.6000110.1V54 V55 G60 F61 L62V54-I58 HydrophobicContact CG1-CD1 3.84Å; V54-I58 VanDerWaalsContact O-CG1 3.28Å; V54-I58 WeakPolarHBondContact O-CG1 3.38Å; V54-I58 PolarHBondContact O-N 3.04Å; V55-I58 PolarHBondContact O-N 3.31Å; I58-G60 VanDerWaalsContact C-N 3.32Å; I58-G60 PolarHBondContact O-N 2.95Å; I58-F61 PolarHBondContact O-N 2.92Å; I58-L62 HydrophobicContact CG2-CD1 4.01Å; I58-L62 HydrophobicContact CG2-CG 4.46Å; I58-L62 VanDerWaalsContact O-CG 3.32Å; I58-L62 WeakPolarHBondContact O-CG 3.33Å; I58-L62 PolarHBondContact O-N 3.42Å
59V88.9Confident90.5Very high24 Ų2476.3 Ų76.315%0.14540%0.401CS..Hα-helixtrans-60.5-43.1177.8173.10000111V55 F56 F61 L62 N63 V122 F125V55-V59 HydrophobicContact CG1-CG2 4.43Å; V55-V59 WeakPolarHBondContact O-CG2 3.31Å; V55-V59 PolarHBondContact O-N 2.95Å; F56-V59 PolarHBondContact O-N 3.18Å; V59-F61 VanDerWaalsContact C-N 3.33Å; V59-F61 PolarHBondContact O-N 3.43Å; V59-L62 PolarHBondContact O-N 3.36Å; V59-N63 PolarHBondContact O-N 2.85Å; V59-V122 HydrophobicContact CG1-CG1 4.3Å; V59-F125 HydrophobicContact CG1-CB 4.18Å; V59-F125 HydrophobicContact CG2-CB 4.24Å
60G88.4Confident90.3Very high14 Ų1469.5 Ų69.514%0.14437%0.372CS..Hα-helixtrans-62.9-36.717600000113.1F56 L57 I58 N63 P64F56-G60 PolarHBondContact O-N 2.84Å; L57-G60 PolarHBondContact O-N 3.24Å; I58-G60 VanDerWaalsContact C-N 3.32Å; I58-G60 PolarHBondContact O-N 2.95Å; G60-N63 CarbonylContact O-C 3.28Å; G60-N63 VanDerWaalsContact O-C 3.28Å; G60-P64 WeakPolarHBondContact O-CA 3.46Å
61F89.7Confident90.1Very high178 Ų17868.9 Ų68.978%0.78137%0.369SS*.Hα-helixtrans-71.9-35.5176.1-171.5-97.2000112.5L57 I58 V59 N63 P64L57-F61 WeakPolarHBondContact O-CB 3.5Å; L57-F61 PolarHBondContact O-N 3.46Å; I58-F61 PolarHBondContact O-N 2.92Å; V59-F61 VanDerWaalsContact C-N 3.33Å; V59-F61 PolarHBondContact O-N 3.43Å; F61-N63 VanDerWaalsContact C-N 3.35Å; F61-P64 WeakPolarHBondContact O-CD 3.42Å
62L89.9Confident90Very high137 Ų13769.8 Ų69.872%0.71738%0.379SS*.Hα-helixtrans-72.5-27.8177-67.8174.9000112.8I58 V59I58-L62 HydrophobicContact CG2-CD1 4.01Å; I58-L62 HydrophobicContact CG2-CG 4.46Å; I58-L62 VanDerWaalsContact O-CG 3.32Å; I58-L62 WeakPolarHBondContact O-CG 3.33Å; I58-L62 PolarHBondContact O-N 3.42Å; V59-L62 PolarHBondContact O-N 3.36Å
63N87.3Confident89.9Confident70 Ų7069.4 Ų69.437%0.37437%0.374SS..SBendtrans-139.671.8176.4-167.8-9.9000112V59 G60 F61 L65 G66 M67 V122V59-N63 PolarHBondContact O-N 2.85Å; G60-N63 CarbonylContact O-C 3.28Å; G60-N63 VanDerWaalsContact O-C 3.28Å; F61-N63 VanDerWaalsContact C-N 3.35Å; N63-L65 PolarHBondContact O-N 3.17Å; N63-G66 PolarHBondContact O-N 2.94Å; N63-G66 WeakPolarHBondContact OD1-CA 3.34Å; N63-G66 PolarHBondContact OD1-N 3.42Å; N63-M67 WeakPolarHBondContact O-CB 3.2Å; N63-M67 PolarHBondContact O-N 3.09Å; N63-V122 HydrophobicContact CB-CG2 4.04Å; N63-V122 VanDerWaalsContact ND2-CG2 3.33Å; N63-V122 WeakPolarHBondContact ND2-CG2 3.37Å
64P88.6Confident89.8Confident63 Ų6368.4 Ų68.441%0.40937%0.371SS..Hα-helixtrans-67.4-40.2-173.525.3-33.1000111.9G60 F61 M67 F68G60-P64 WeakPolarHBondContact O-CA 3.46Å; F61-P64 WeakPolarHBondContact O-CD 3.42Å; P64-M67 PolarHBondContact O-N 3.38Å; P64-F68 WeakPolarHBondContact O-CD2 3.31Å; P64-F68 PolarHBondContact O-N 3.06Å
65L87.8Confident89.7Confident141 Ų14167.5 Ų67.574%0.73837%0.369SS*.Hα-helixtrans-64.2-44.7178.2-67.7178.9000111.7N63 M67 F68 L69N63-L65 PolarHBondContact O-N 3.17Å; L65-M67 VanDerWaalsContact C-N 3.29Å; L65-M67 PolarHBondContact O-N 3.33Å; L65-F68 PolarHBondContact O-N 3.23Å; L65-L69 WeakPolarHBondContact O-CB 3.25Å; L65-L69 PolarHBondContact O-N 2.93Å
66G87.4Confident89.9Confident11 Ų1171.6 Ų71.611%0.11339%0.389CS..Hα-helixtrans-63.2-36.4176.200000112.4N63 G70N63-G66 PolarHBondContact O-N 2.94Å; N63-G66 WeakPolarHBondContact OD1-CA 3.34Å; N63-G66 PolarHBondContact OD1-N 3.42Å; G66-G70 WeakPolarHBondContact O-CA 3.44Å; G66-G70 PolarHBondContact O-N 3.21Å
67M87.7Confident90.1Very high30 Ų3068.7 Ų68.715%0.14838%0.378CS..Hα-helixtrans-66.5-48.1175.2-174.663.179.700112.1F56 N63 P64 L65 G71 V122F56-M67 HydrophobicContact CD2-CE 4.04Å; F56-M67 HydrophobicContact CE1-CE 4.02Å; F56-M67 HydrophobicContact CE1-SD 4.33Å; F56-M67 HydrophobicContact CE2-CE 3.46Å; F56-M67 VanDerWaalsContact CE2-CE 3.46Å; F56-M67 HydrophobicContact CE2-SD 3.86Å; F56-M67 HydrophobicContact CZ-CE 3.45Å; F56-M67 VanDerWaalsContact CZ-CE 3.45Å; F56-M67 HydrophobicContact CZ-SD 3.49Å; F56-M67 WeakPolarHBondContact CZ-SD 3.39Å; N63-M67 WeakPolarHBondContact O-CB 3.2Å; N63-M67 PolarHBondContact O-N 3.09Å; P64-M67 PolarHBondContact O-N 3.38Å; L65-M67 VanDerWaalsContact C-N 3.29Å; L65-M67 PolarHBondContact O-N 3.33Å; M67-G71 PolarHBondContact O-N 2.85Å; M67-V122 HydrophobicContact CB-CG1 4.07Å; M67-V122 HydrophobicContact CE-CG1 3.63Å; M67-V122 HydrophobicContact SD-CG1 3.95Å
68F89.6Confident90.2Very high160 Ų16069.7 Ų69.770%0.70238%0.378SS*.Hα-helixtrans-65.6-45.7178-77.7-62.3000112.2P64 L65 G70 G71 A72P64-F68 WeakPolarHBondContact O-CD2 3.31Å; P64-F68 PolarHBondContact O-N 3.06Å; L65-F68 PolarHBondContact O-N 3.23Å; F68-G70 VanDerWaalsContact C-N 3.34Å; F68-G71 PolarHBondContact O-N 3.14Å; F68-A72 VanDerWaalsContact O-CB 3.25Å; F68-A72 WeakPolarHBondContact O-CB 3.45Å; F68-A72 PolarHBondContact O-N 3.39Å
69L89.6Confident90.4Very high81 Ų8171.3 Ų71.342%0.42439%0.385SS..Hα-helixtrans-63.2-45.2178.6-175.562.6000110.6L65 A72 V73 C117L65-L69 WeakPolarHBondContact O-CB 3.25Å; L65-L69 PolarHBondContact O-N 2.93Å; L69-A72 PolarHBondContact O-N 3.26Å; L69-V73 VanDerWaalsContact O-CG2 3.32Å; L69-V73 WeakPolarHBondContact O-CG2 3.41Å; L69-V73 PolarHBondContact O-N 3.3Å; L69-C117 HydrophobicContact CD2-CB 3.74Å; L69-C117 HydrophobicContact CG-CB 4.17Å
70G88.6Confident90.6Very high0 Ų074 Ų740%040%0.404CS..Hα-helixtrans-59.4-49.9176.100000112.5G66 F68 A72 V73 V74 F123G66-G70 WeakPolarHBondContact O-CA 3.44Å; G66-G70 PolarHBondContact O-N 3.21Å; F68-G70 VanDerWaalsContact C-N 3.34Å; G70-A72 PolarHBondContact O-N 3.44Å; G70-V73 PolarHBondContact O-N 2.76Å; G70-V74 WeakPolarHBondContact O-CG2 3.2Å; G70-V74 PolarHBondContact O-N 3.49Å; G70-F123 VanDerWaalsContact C-CZ 3.42Å; G70-F123 VanDerWaalsContact CA-CE2 3.43Å
71G88.9Confident90.9Very high27 Ų2774.1 Ų74.128%0.27840%0.403SS..Hα-helixtrans-58.6-46.1175.800000112.1M67 F68 V73 V74 S75M67-G71 PolarHBondContact O-N 2.85Å; F68-G71 PolarHBondContact O-N 3.14Å; G71-V73 PolarHBondContact O-N 2.92Å; G71-V74 PolarHBondContact O-N 3.43Å; G71-S75 WeakPolarHBondContact O-CB 3.41Å; G71-S75 PolarHBondContact O-N 3.25Å; G71-S75 PolarHBondContact O-OG 2.91Å; G71-S75 VanDerWaalsContact O-OG 3.05Å
72A91.7Very high91.1Very high46 Ų4667.8 Ų67.838%0.3838%0.379SS..Hα-helixtrans-60.3-46.1178.200000112.1F68 L69 G70 S75 L76F68-A72 VanDerWaalsContact O-CB 3.25Å; F68-A72 WeakPolarHBondContact O-CB 3.45Å; F68-A72 PolarHBondContact O-N 3.39Å; L69-A72 PolarHBondContact O-N 3.26Å; G70-A72 PolarHBondContact O-N 3.44Å; A72-S75 PolarHBondContact O-N 3.39Å; A72-L76 VanDerWaalsContact O-CB 3.28Å; A72-L76 WeakPolarHBondContact O-CB 3.47Å; A72-L76 WeakPolarHBondContact O-CG 3.33Å; A72-L76 PolarHBondContact O-N 3.15Å
73V91.6Very high91.3Very high18 Ų1868.5 Ų68.511%0.10937%0.372CS..Hα-helixtrans-59.1-50.9177.2168.60000110.7L69 G70 G71 S75 L76 V77 L113 L114L69-V73 VanDerWaalsContact O-CG2 3.32Å; L69-V73 WeakPolarHBondContact O-CG2 3.41Å; L69-V73 PolarHBondContact O-N 3.3Å; G70-V73 PolarHBondContact O-N 2.76Å; G71-V73 PolarHBondContact O-N 2.92Å; V73-S75 PolarHBondContact O-N 3.2Å; V73-L76 PolarHBondContact O-N 3.35Å; V73-V77 HydrophobicContact CG1-CG2 4.44Å; V73-V77 WeakPolarHBondContact O-CB 3.5Å; V73-V77 VanDerWaalsContact O-CG2 3.24Å; V73-V77 WeakPolarHBondContact O-CG2 3.4Å; V73-V77 PolarHBondContact O-N 2.93Å; V73-L113 HydrophobicContact CG1-CB 3.59Å; V73-L113 HydrophobicContact CG1-CD1 4.32Å; V73-L114 HydrophobicContact CB-CD2 3.96Å; V73-L114 HydrophobicContact CG1-CD2 3.96Å; V73-L114 HydrophobicContact CG1-CG 4.1Å
74V90.2Very high91.6Very high54 Ų5465.9 Ų65.933%0.32736%0.36SS..Hα-helixtrans-62.6-45.5-179.3174.60000111.2G70 G71 V77 F78 L114 F123G70-V74 WeakPolarHBondContact O-CG2 3.2Å; G70-V74 PolarHBondContact O-N 3.49Å; G71-V74 PolarHBondContact O-N 3.43Å; V74-V77 PolarHBondContact O-N 3.49Å; V74-F78 WeakPolarHBondContact O-CB 3.49Å; V74-F78 PolarHBondContact O-N 3.39Å; V74-L114 HydrophobicContact CG2-CD1 3.89Å; V74-L114 HydrophobicContact CG2-CD2 4.44Å; V74-L114 HydrophobicContact CG2-CG 4.46Å; V74-F123 HydrophobicContact CG2-CE2 4.37Å; V74-F123 HydrophobicContact CG2-CZ 3.96Å
75S92.5Very high91.6Very high64 Ų6463.1 Ų63.145%0.44834%0.343SS..Hα-helixtrans-62.7-43.8178.6-65.80000112.3G71 A72 V73 F78 M79G71-S75 WeakPolarHBondContact O-CB 3.41Å; G71-S75 PolarHBondContact O-N 3.25Å; G71-S75 PolarHBondContact O-OG 2.91Å; G71-S75 VanDerWaalsContact O-OG 3.05Å; A72-S75 PolarHBondContact O-N 3.39Å; V73-S75 PolarHBondContact O-N 3.2Å; S75-F78 PolarHBondContact O-N 3.47Å; S75-M79 WeakPolarHBondContact O-CB 3.39Å; S75-M79 VanDerWaalsContact O-CG 3.3Å; S75-M79 WeakPolarHBondContact O-CG 3.36Å; S75-M79 PolarHBondContact O-N 3.02Å
76L95.6Very high91.8Very high105 Ų10562.7 Ų62.755%0.5534%0.337SS..Hα-helixtrans-65.4-47178.5-74.9171.5000111.5A72 V73 F78 M79 C80A72-L76 VanDerWaalsContact O-CB 3.28Å; A72-L76 WeakPolarHBondContact O-CB 3.47Å; A72-L76 WeakPolarHBondContact O-CG 3.33Å; A72-L76 PolarHBondContact O-N 3.15Å; V73-L76 PolarHBondContact O-N 3.35Å; L76-F78 VanDerWaalsContact C-N 3.29Å; L76-F78 PolarHBondContact O-N 2.9Å; L76-M79 PolarHBondContact O-N 3.29Å; L76-C80 VanDerWaalsContact O-CB 3.29Å; L76-C80 WeakPolarHBondContact O-CB 3.48Å; L76-C80 PolarHBondContact O-N 3.26Å; L76-C80 PolarHBondContact O-SG 2.98Å
77V94.9Very high91.9Very high19 Ų1966.5 Ų66.512%0.11536%0.355CS..Hα-helixtrans-59.8-43.6177.4174.40000110.5V73 V74 S81 V106 T109 S110 L113V73-V77 HydrophobicContact CG1-CG2 4.44Å; V73-V77 WeakPolarHBondContact O-CB 3.5Å; V73-V77 VanDerWaalsContact O-CG2 3.24Å; V73-V77 WeakPolarHBondContact O-CG2 3.4Å; V73-V77 PolarHBondContact O-N 2.93Å; V74-V77 PolarHBondContact O-N 3.49Å; V77-S81 VanDerWaalsContact O-CB 3.26Å; V77-S81 WeakPolarHBondContact O-CB 3.28Å; V77-S81 PolarHBondContact O-N 2.93Å; V77-S81 PolarHBondContact O-OG 3.36Å; V77-V106 HydrophobicContact CG1-CG1 4.21Å; V77-T109 HydrophobicContact CG1-CG2 4.31Å; V77-S110 WeakPolarHBondContact CG1-OG 3.39Å; V77-L113 HydrophobicContact CG2-CD1 3.5Å; V77-L113 VanDerWaalsContact CG2-CD1 3.5Å
78F93.4Very high92.1Very high130 Ų13070.2 Ų70.257%0.5737%0.37SS*.Hα-helixtrans-61.6-51.9176.8-175.1-104.1000111.4V74 S75 L76 C80 S81 V82V74-F78 WeakPolarHBondContact O-CB 3.49Å; V74-F78 PolarHBondContact O-N 3.39Å; S75-F78 PolarHBondContact O-N 3.47Å; L76-F78 VanDerWaalsContact C-N 3.29Å; L76-F78 PolarHBondContact O-N 2.9Å; F78-C80 PolarHBondContact O-N 3.45Å; F78-S81 PolarHBondContact O-N 2.9Å; F78-S81 VanDerWaalsContact O-N 3.15Å; F78-S81 PolarHBondContact O-OG 3.49Å; F78-V82 HydrophobicContact CD1-CG2 4.27Å; F78-V82 HydrophobicContact CE1-CG2 3.91Å; F78-V82 HydrophobicContact CE2-CG2 4.17Å; F78-V82 HydrophobicContact CZ-CG2 3.85Å; F78-V82 WeakPolarHBondContact O-CG2 3.47Å; F78-V82 PolarHBondContact O-N 2.91Å
79M95.4Very high92.1Very high126 Ų12668.3 Ų68.362%0.62137%0.368SS*.Hα-helixtrans-58.7-46.7178.5-74.8-177.8-177.700112.2S75 L76 S81 V82 W83S75-M79 WeakPolarHBondContact O-CB 3.39Å; S75-M79 VanDerWaalsContact O-CG 3.3Å; S75-M79 WeakPolarHBondContact O-CG 3.36Å; S75-M79 PolarHBondContact O-N 3.02Å; L76-M79 PolarHBondContact O-N 3.29Å; M79-S81 VanDerWaalsContact C-N 3.32Å; M79-S81 PolarHBondContact O-N 3.42Å; M79-V82 PolarHBondContact O-N 3.49Å; M79-W83 VanDerWaalsContact O-CB 3.31Å; M79-W83 WeakPolarHBondContact O-CB 3.46Å; M79-W83 PolarHBondContact O-N 3.44Å
80C94.8Very high92.2Very high79 Ų7972.2 Ų72.253%0.53438%0.381SS..Hα-helixtrans-60.5-41.5176-720000111.6L76 F78 A84L76-C80 VanDerWaalsContact O-CB 3.29Å; L76-C80 WeakPolarHBondContact O-CB 3.48Å; L76-C80 PolarHBondContact O-N 3.26Å; L76-C80 PolarHBondContact O-SG 2.98Å; F78-C80 PolarHBondContact O-N 3.45Å; C80-A84 WeakPolarHBondContact O-CB 3.48Å; C80-A84 PolarHBondContact O-N 3.42Å
81S93.7Very high92.2Very high17 Ų1774.6 Ų74.612%0.11939%0.394CS..Hα-helixtrans-67.4-40179.476.80000112.6V77 F78 M79 G85V77-S81 VanDerWaalsContact O-CB 3.26Å; V77-S81 WeakPolarHBondContact O-CB 3.28Å; V77-S81 PolarHBondContact O-N 2.93Å; V77-S81 PolarHBondContact O-OG 3.36Å; F78-S81 PolarHBondContact O-N 2.9Å; F78-S81 VanDerWaalsContact O-N 3.15Å; F78-S81 PolarHBondContact O-OG 3.49Å; M79-S81 VanDerWaalsContact C-N 3.32Å; M79-S81 PolarHBondContact O-N 3.42Å; S81-G85 PolarHBondContact O-N 3.41Å
82V93.3Very high92.4Very high45 Ų4577.3 Ų77.327%0.27340%0.398SS..Hα-helixtrans-65.4-51.8176.5171.10000109.8F78 M79 A84 G85 E86F78-V82 HydrophobicContact CD1-CG2 4.27Å; F78-V82 HydrophobicContact CE1-CG2 3.91Å; F78-V82 HydrophobicContact CE2-CG2 4.17Å; F78-V82 HydrophobicContact CZ-CG2 3.85Å; F78-V82 WeakPolarHBondContact O-CG2 3.47Å; F78-V82 PolarHBondContact O-N 2.91Å; M79-V82 PolarHBondContact O-N 3.49Å; V82-A84 VanDerWaalsContact C-N 3.33Å; V82-A84 PolarHBondContact O-N 2.59Å; V82-G85 PolarHBondContact O-N 2.94Å; V82-G85 VanDerWaalsContact O-N 3.13Å; V82-E86 PolarHBondContact O-N 3.27Å
83W95.3Very high92.5Very high152 Ų15279.4 Ų79.458%0.57640%0.402SS*.Hα-helixtrans-57.7-46178.1178.484.2000112M79 G85 E86 N87M79-W83 VanDerWaalsContact O-CB 3.31Å; M79-W83 WeakPolarHBondContact O-CB 3.46Å; M79-W83 PolarHBondContact O-N 3.44Å; W83-G85 VanDerWaalsContact C-N 3.33Å; W83-G85 PolarHBondContact O-N 2.82Å; W83-E86 PolarHBondContact O-N 3.3Å; W83-N87 HydrophobicContact CZ2-CB 4.48Å; W83-N87 VanDerWaalsContact CZ2-ND2 3.28Å; W83-N87 WeakPolarHBondContact CZ2-ND2 3.28Å; W83-N87 VanDerWaalsContact O-CB 3.28Å; W83-N87 WeakPolarHBondContact O-CB 3.28Å; W83-N87 PolarHBondContact O-N 2.88Å
84A92.4Very high92.5Very high16 Ų1682 Ų8213%0.13241%0.413CS..Hα-helixtrans-65-38.1178.100000111.9C80 V82 E86 K88 I91C80-A84 WeakPolarHBondContact O-CB 3.48Å; C80-A84 PolarHBondContact O-N 3.42Å; V82-A84 VanDerWaalsContact C-N 3.33Å; V82-A84 PolarHBondContact O-N 2.59Å; A84-E86 VanDerWaalsContact C-N 3.27Å; A84-E86 PolarHBondContact O-N 2.92Å; A84-K88 VanDerWaalsContact O-CB 3.32Å; A84-K88 WeakPolarHBondContact O-CB 3.34Å; A84-K88 PolarHBondContact O-N 2.67Å; A84-I91 HydrophobicContact CB-CD1 3.67Å; A84-I91 HydrophobicContact CB-CG2 4.49Å
85G90.4Very high92.5Very high4 Ų483.3 Ų83.34%0.04141%0.414CS..Hα-helixtrans-68.1-20.917600000114.7S81 V82 W83 K92S81-G85 PolarHBondContact O-N 3.41Å; V82-G85 PolarHBondContact O-N 2.94Å; V82-G85 VanDerWaalsContact O-N 3.13Å; W83-G85 VanDerWaalsContact C-N 3.33Å; W83-G85 PolarHBondContact O-N 2.82Å; G85-K92 VanDerWaalsContact O-CA 3.31Å; G85-K92 WeakPolarHBondContact O-CA 3.48Å; G85-K92 WeakPolarHBondContact O-CB 3.25Å; G85-K92 WeakPolarHBondContact O-CG 3.32Å
86E90.6Very high92.5Very high132 Ų13287.6 Ų87.662%0.61742%0.424SS*.Hα-helixtrans-93.9-40.5176.3-70.5-177.4172.600112.5V82 W83 A84V82-E86 PolarHBondContact O-N 3.27Å; W83-E86 PolarHBondContact O-N 3.3Å; A84-E86 VanDerWaalsContact C-N 3.27Å; A84-E86 PolarHBondContact O-N 2.92Å
87N90Very high92.5Very high92 Ų9290.6 Ų90.649%0.49243%0.433SS..Hα-helixtrans-95.8-21.9-169.2-16643.4000114.2W83W83-N87 HydrophobicContact CZ2-CB 4.48Å; W83-N87 VanDerWaalsContact CZ2-ND2 3.28Å; W83-N87 WeakPolarHBondContact CZ2-ND2 3.28Å; W83-N87 VanDerWaalsContact O-CB 3.28Å; W83-N87 WeakPolarHBondContact O-CB 3.28Å; W83-N87 PolarHBondContact O-N 2.88Å
88K92.2Very high92.4Very high107 Ų10793.1 Ų93.147%0.46545%0.446SS..  trans-106.3114.7179.8-58.5-63.4-174.7-179.40110.4A84 F90 I91 K92A84-K88 VanDerWaalsContact O-CB 3.32Å; A84-K88 WeakPolarHBondContact O-CB 3.34Å; A84-K88 PolarHBondContact O-N 2.67Å; K88-F90 PolarHBondContact O-N 3.16Å; K88-F90 VanDerWaalsContact O-N 3.16Å; K88-I91 HydrophobicContact CB-CB 4.29Å; K88-I91 HydrophobicContact CB-CD1 4.15Å; K88-I91 HydrophobicContact CB-CG1 4.24Å; K88-I91 HydrophobicContact CG-CD1 4.41Å; K88-I91 PolarHBondContact O-N 3.04Å; K88-I91 VanDerWaalsContact O-N 3.09Å; K88-K92 WeakPolarHBondContact O-CB 3.45Å; K88-K92 PolarHBondContact O-N 2.75Å
89N89.8Confident92.3Very high121 Ų12190.3 Ų90.365%0.64744%0.44SS*.Hα-helixtrans-54.2-38.5-178.5-70.7-18000113.1N93N89-N93 VanDerWaalsContact O-CB 3.26Å; N89-N93 WeakPolarHBondContact O-CB 3.49Å; N89-N93 PolarHBondContact O-N 3Å; N89-N93 PolarHBondContact O-ND2 3.17Å; N89-N93 VanDerWaalsContact O-ND2 3.08Å
90F90.8Very high92.1Very high163 Ų16389.2 Ų89.272%0.71544%0.441SS*.Hα-helixtrans-61-52.1175.8178.6-100.3000112.5K88 N93 F94K88-F90 PolarHBondContact O-N 3.16Å; K88-F90 VanDerWaalsContact O-N 3.16Å; F90-N93 PolarHBondContact O-N 3.29Å; F90-F94 WeakPolarHBondContact O-CB 3.38Å; F90-F94 PolarHBondContact O-N 3.4Å
91I89.7Confident92Very high50 Ų5089.8 Ų89.826%0.25644%0.438SS..Hα-helixtrans-69.7-38.4-177.5-59.9174.3000110.4A84 K88 N93 F94 K95 F102A84-I91 HydrophobicContact CB-CD1 3.67Å; A84-I91 HydrophobicContact CB-CG2 4.49Å; K88-I91 HydrophobicContact CB-CB 4.29Å; K88-I91 HydrophobicContact CB-CD1 4.15Å; K88-I91 HydrophobicContact CB-CG1 4.24Å; K88-I91 HydrophobicContact CG-CD1 4.41Å; K88-I91 PolarHBondContact O-N 3.04Å; K88-I91 VanDerWaalsContact O-N 3.09Å; I91-N93 VanDerWaalsContact C-N 3.35Å; I91-N93 PolarHBondContact O-N 3.14Å; I91-F94 PolarHBondContact O-N 3.19Å; I91-K95 WeakPolarHBondContact O-CB 3.37Å; I91-K95 PolarHBondContact O-N 2.94Å; I91-F102 HydrophobicContact CG2-CD2 4.44Å; I91-F102 HydrophobicContact CG2-CE2 3.79Å
92K92Very high92Very high83 Ų8390.1 Ų90.136%0.36144%0.438SS..Hα-helixtrans-57.6-47172.8-171.7171.6-175.9170.80111.9G85 K88 K96G85-K92 VanDerWaalsContact O-CA 3.31Å; G85-K92 WeakPolarHBondContact O-CA 3.48Å; G85-K92 WeakPolarHBondContact O-CB 3.25Å; G85-K92 WeakPolarHBondContact O-CG 3.32Å; K88-K92 WeakPolarHBondContact O-CB 3.45Å; K88-K92 PolarHBondContact O-N 2.75Å; K92-K96 WeakPolarHBondContact O-CG 3.24Å; K92-K96 PolarHBondContact O-N 3.35Å; K92-K96 VanDerWaalsContact O-N 3.08Å
93N93.1Very high92Very high90 Ų9091.7 Ų91.748%0.48145%0.447SS..Hα-helixtrans-67.5-39.4177.7-71.6-24.1000111.6N89 F90 I91 K96 K97N89-N93 VanDerWaalsContact O-CB 3.26Å; N89-N93 WeakPolarHBondContact O-CB 3.49Å; N89-N93 PolarHBondContact O-N 3Å; N89-N93 PolarHBondContact O-ND2 3.17Å; N89-N93 VanDerWaalsContact O-ND2 3.08Å; F90-N93 PolarHBondContact O-N 3.29Å; I91-N93 VanDerWaalsContact C-N 3.35Å; I91-N93 PolarHBondContact O-N 3.14Å; N93-K96 PolarHBondContact O-N 3.3Å; N93-K97 WeakPolarHBondContact O-CB 3.43Å; N93-K97 WeakPolarHBondContact O-CG 3.37Å; N93-K97 PolarHBondContact O-N 2.95Å
94F92Very high91.9Very high74 Ų7489.1 Ų89.133%0.32544%0.444SS..Hα-helixtrans-63.2-49175.1179.8-101000112.2F90 I91 K96 K97 N98 L101 F102F90-F94 WeakPolarHBondContact O-CB 3.38Å; F90-F94 PolarHBondContact O-N 3.4Å; I91-F94 PolarHBondContact O-N 3.19Å; F94-K96 VanDerWaalsContact C-N 3.29Å; F94-K96 PolarHBondContact O-N 3.19Å; F94-K97 PolarHBondContact O-N 3.37Å; F94-N98 HydrophobicContact CE2-CB 4.45Å; F94-N98 PolarHBondContact O-N 3.44Å; F94-L101 HydrophobicContact CE1-CB 4.5Å; F94-L101 HydrophobicContact CZ-CB 3.93Å; F94-F102 HydrophobicContact CD1-CB 4.24Å; F94-F102 HydrophobicContact CD1-CD2 4.19Å; F94-F102 HydrophobicContact CE1-CB 4.04Å; F94-F102 HydrophobicContact CE1-CD2 4.46Å
95K91.3Very high92Very high80 Ų8090.8 Ų90.835%0.34846%0.457SS..Hα-helixtrans-57-40.6176.1179.1-177.6176-176.90112I91 P99 F102I91-K95 WeakPolarHBondContact O-CB 3.37Å; I91-K95 PolarHBondContact O-N 2.94Å; K95-P99 VanDerWaalsContact O-CA 3.24Å; K95-P99 WeakPolarHBondContact O-CA 3.31Å; K95-F102 HydrophobicContact CB-CB 4.45Å; K95-F102 HydrophobicContact CB-CD1 4.35Å; K95-F102 HydrophobicContact CB-CD2 4.11Å; K95-F102 HydrophobicContact CB-CE2 4.47Å; K95-F102 HydrophobicContact CB-CG 4.03Å; K95-F102 HydrophobicContact CD-CD1 4.17Å; K95-F102 HydrophobicContact CD-CE1 3.94Å; K95-F102 HydrophobicContact CD-CZ 4.24Å; K95-F102 HydrophobicContact CG-CD1 3.86Å; K95-F102 HydrophobicContact CG-CD2 4.5Å; K95-F102 HydrophobicContact CG-CE1 4.15Å; K95-F102 HydrophobicContact CG-CG 4.04Å
96K92.5Very high92.1Very high155 Ų15591.9 Ų91.967%0.67446%0.463SS*.Hα-helixtrans-70.2-41.8177.2-76.5-174.8176.2-168.30112.9K92 N93 F94K92-K96 WeakPolarHBondContact O-CG 3.24Å; K92-K96 PolarHBondContact O-N 3.35Å; K92-K96 VanDerWaalsContact O-N 3.08Å; N93-K96 PolarHBondContact O-N 3.3Å; F94-K96 VanDerWaalsContact C-N 3.29Å; F94-K96 PolarHBondContact O-N 3.19Å
97K94.6Very high92.2Very high168 Ų16891.7 Ų91.773%0.7346%0.464SS*.Hα-helixtrans-72.8-40.3-179.1-75-178.9175.9-171.50112.2N93 F94N93-K97 WeakPolarHBondContact O-CB 3.43Å; N93-K97 WeakPolarHBondContact O-CG 3.37Å; N93-K97 PolarHBondContact O-N 2.95Å; F94-K97 PolarHBondContact O-N 3.37Å
98N92.9Very high92.3Very high71 Ų7189.2 Ų89.238%0.3846%0.46SS..  trans-136.770-173.8-58.3-71.4000111.1F94 T100 L101 F102F94-N98 HydrophobicContact CE2-CB 4.45Å; F94-N98 PolarHBondContact O-N 3.44Å; N98-T100 VanDerWaalsContact C-N 3.28Å; N98-T100 PolarHBondContact O-N 2.89Å; N98-L101 HydrophobicContact CB-CB 3.99Å; N98-L101 HydrophobicContact CB-CD1 3.95Å; N98-L101 HydrophobicContact CB-CG 4.29Å; N98-L101 PolarHBondContact O-N 3.32Å; N98-F102 PolarHBondContact O-N 2.89Å
99P91.4Very high92.4Very high71 Ų7187.5 Ų87.546%0.46146%0.459SS..Hα-helixtrans-60-38.1-176.823.3-33.5000112.5K95 F102 V103K95-P99 VanDerWaalsContact O-CA 3.24Å; K95-P99 WeakPolarHBondContact O-CA 3.31Å; P99-F102 WeakPolarHBondContact O-CB 3.36Å; P99-F102 PolarHBondContact O-N 3.34Å; P99-V103 WeakPolarHBondContact O-CG2 3.33Å; P99-V103 PolarHBondContact O-N 2.87Å
100T91.8Very high92.5Very high103 Ų10382.4 Ų82.463%0.63243%0.433SS*.Hα-helixtrans-64.3-47178.2-46.30000112N98 F102 V103 I104N98-T100 VanDerWaalsContact C-N 3.28Å; N98-T100 PolarHBondContact O-N 2.89Å; T100-F102 VanDerWaalsContact C-N 3.28Å; T100-F102 PolarHBondContact O-N 2.99Å; T100-V103 PolarHBondContact O-N 3.39Å; T100-I104 HydrophobicContact CG2-CD1 4.06Å; T100-I104 WeakPolarHBondContact O-CG1 3.11Å; T100-I104 PolarHBondContact O-N 3.31Å
101L92.6Very high92.5Very high91 Ų9181.7 Ų81.748%0.47643%0.426SS..Hα-helixtrans-63.7-35.7177.3-72.7175.8000111.9F94 N98 I104 A105F94-L101 HydrophobicContact CE1-CB 4.5Å; F94-L101 HydrophobicContact CZ-CB 3.93Å; N98-L101 HydrophobicContact CB-CB 3.99Å; N98-L101 HydrophobicContact CB-CD1 3.95Å; N98-L101 HydrophobicContact CB-CG 4.29Å; N98-L101 PolarHBondContact O-N 3.32Å; L101-I104 PolarHBondContact O-N 3.46Å; L101-A105 WeakPolarHBondContact O-CB 3.46Å; L101-A105 PolarHBondContact O-N 3.37Å
102F92.9Very high92.6Very high25 Ų2585.2 Ų85.211%0.1144%0.44CS..Hα-helixtrans-61.7-46.8173.9178-97.9000111.8I91 F94 K95 N98 P99 T100 A105 V106I91-F102 HydrophobicContact CG2-CD2 4.44Å; I91-F102 HydrophobicContact CG2-CE2 3.79Å; F94-F102 HydrophobicContact CD1-CB 4.24Å; F94-F102 HydrophobicContact CD1-CD2 4.19Å; F94-F102 HydrophobicContact CE1-CB 4.04Å; F94-F102 HydrophobicContact CE1-CD2 4.46Å; K95-F102 HydrophobicContact CB-CB 4.45Å; K95-F102 HydrophobicContact CB-CD1 4.35Å; K95-F102 HydrophobicContact CB-CD2 4.11Å; K95-F102 HydrophobicContact CB-CE2 4.47Å; K95-F102 HydrophobicContact CB-CG 4.03Å; K95-F102 HydrophobicContact CD-CD1 4.17Å; K95-F102 HydrophobicContact CD-CE1 3.94Å; K95-F102 HydrophobicContact CD-CZ 4.24Å; K95-F102 HydrophobicContact CG-CD1 3.86Å; K95-F102 HydrophobicContact CG-CD2 4.5Å; K95-F102 HydrophobicContact CG-CE1 4.15Å; K95-F102 HydrophobicContact CG-CG 4.04Å; N98-F102 PolarHBondContact O-N 2.89Å; P99-F102 WeakPolarHBondContact O-CB 3.36Å; P99-F102 PolarHBondContact O-N 3.34Å; T100-F102 VanDerWaalsContact C-N 3.28Å; T100-F102 PolarHBondContact O-N 2.99Å; F102-A105 PolarHBondContact O-N 3.25Å; F102-V106 HydrophobicContact CD1-CG2 4.47Å; F102-V106 HydrophobicContact CE1-CG2 4.1Å; F102-V106 HydrophobicContact CE2-CG2 4.39Å; F102-V106 HydrophobicContact CZ-CG2 4.06Å; F102-V106 WeakPolarHBondContact O-CG2 3.5Å; F102-V106 PolarHBondContact O-N 3.5Å
103V93.1Very high92.5Very high77 Ų7784.2 Ų84.247%0.46744%0.438SS..Hα-helixtrans-62.2-44.7176.1174.20000111.1P99 T100 A105 V106 M107P99-V103 WeakPolarHBondContact O-CG2 3.33Å; P99-V103 PolarHBondContact O-N 2.87Å; T100-V103 PolarHBondContact O-N 3.39Å; V103-A105 VanDerWaalsContact C-N 3.32Å; V103-A105 PolarHBondContact O-N 2.9Å; V103-V106 PolarHBondContact O-N 3.27Å; V103-M107 HydrophobicContact CG1-CG 4.28Å; V103-M107 HydrophobicContact CG1-SD 3.99Å; V103-M107 WeakPolarHBondContact O-CG 3.36Å; V103-M107 PolarHBondContact O-N 3.47Å
104I94.2Very high92.3Very high99 Ų9980.6 Ų80.651%0.50842%0.419SS..Hα-helixtrans-58.7-44176.6-69.2167.9000111T100 L101 V106 M107 G108T100-I104 HydrophobicContact CG2-CD1 4.06Å; T100-I104 WeakPolarHBondContact O-CG1 3.11Å; T100-I104 PolarHBondContact O-N 3.31Å; L101-I104 PolarHBondContact O-N 3.46Å; I104-V106 PolarHBondContact O-N 2.92Å; I104-M107 PolarHBondContact O-N 2.91Å; I104-G108 PolarHBondContact O-N 2.9Å
105A93.1Very high92.1Very high51 Ų5180.2 Ų80.242%0.42143%0.426SS..Hα-helixtrans-63.6-40.817800000112.2L101 F102 V103 T109L101-A105 WeakPolarHBondContact O-CB 3.46Å; L101-A105 PolarHBondContact O-N 3.37Å; F102-A105 PolarHBondContact O-N 3.25Å; V103-A105 VanDerWaalsContact C-N 3.32Å; V103-A105 PolarHBondContact O-N 2.9Å; A105-T109 VanDerWaalsContact O-CB 3.31Å; A105-T109 WeakPolarHBondContact O-CB 3.45Å; A105-T109 PolarHBondContact O-N 3.49Å; A105-T109 PolarHBondContact O-OG1 3.41Å
106V93.7Very high92Very high26 Ų2682.1 Ų82.116%0.15844%0.439CS..Hα-helixtrans-65.3-45176.3171.20000111.1V77 F102 V103 I104 T109 S110V77-V106 HydrophobicContact CG1-CG1 4.21Å; F102-V106 HydrophobicContact CD1-CG2 4.47Å; F102-V106 HydrophobicContact CE1-CG2 4.1Å; F102-V106 HydrophobicContact CE2-CG2 4.39Å; F102-V106 HydrophobicContact CZ-CG2 4.06Å; F102-V106 WeakPolarHBondContact O-CG2 3.5Å; F102-V106 PolarHBondContact O-N 3.5Å; V103-V106 PolarHBondContact O-N 3.27Å; I104-V106 PolarHBondContact O-N 2.92Å; V106-T109 PolarHBondContact O-N 3.01Å; V106-S110 WeakPolarHBondContact O-CB 3.4Å; V106-S110 PolarHBondContact O-N 2.89Å; V106-S110 PolarHBondContact O-OG 3.08Å
107M91.9Very high91.5Very high128 Ų12877.4 Ų77.463%0.63143%0.425SS*.Hα-helixtrans-63.3-46.3176.4-71-17877.600111.7V103 I104 T109 S110 Y111V103-M107 HydrophobicContact CG1-CG 4.28Å; V103-M107 HydrophobicContact CG1-SD 3.99Å; V103-M107 WeakPolarHBondContact O-CG 3.36Å; V103-M107 PolarHBondContact O-N 3.47Å; I104-M107 PolarHBondContact O-N 2.91Å; M107-T109 PolarHBondContact O-N 3.21Å; M107-S110 PolarHBondContact O-N 2.97Å; M107-Y111 WeakPolarHBondContact O-CB 3.28Å; M107-Y111 PolarHBondContact O-N 3.21Å
108G93.6Very high90.8Very high41 Ų4172.1 Ų72.142%0.42342%0.418SS..Hα-helixtrans-62.4-42.2177.900000112.5I104 Y111 F112I104-G108 PolarHBondContact O-N 2.9Å; G108-Y111 PolarHBondContact O-N 3.03Å; G108-F112 WeakPolarHBondContact O-CB 3.3Å; G108-F112 PolarHBondContact O-N 2.85Å
109T93.3Very high90.1Very high70 Ų7068.8 Ų68.843%0.42940%0.4SS..Hα-helixtrans-62.4-45174.5-560000111.4V77 A105 V106 M107 F112 L113V77-T109 HydrophobicContact CG1-CG2 4.31Å; A105-T109 VanDerWaalsContact O-CB 3.31Å; A105-T109 WeakPolarHBondContact O-CB 3.45Å; A105-T109 PolarHBondContact O-N 3.49Å; A105-T109 PolarHBondContact O-OG1 3.41Å; V106-T109 PolarHBondContact O-N 3.01Å; M107-T109 PolarHBondContact O-N 3.21Å; T109-F112 PolarHBondContact O-N 2.75Å; T109-L113 HydrophobicContact CG2-CD1 4.2Å; T109-L113 WeakPolarHBondContact O-CG 3.33Å; T109-L113 PolarHBondContact O-N 2.8Å
110S91.2Very high89.5Confident15 Ų1566.6 Ų66.611%0.10539%0.386CS..Hα-helixtrans-60.6-47.6177.6-57.20000111V77 V106 M107 F112 L113 L114V77-S110 WeakPolarHBondContact CG1-OG 3.39Å; V106-S110 WeakPolarHBondContact O-CB 3.4Å; V106-S110 PolarHBondContact O-N 2.89Å; V106-S110 PolarHBondContact O-OG 3.08Å; M107-S110 PolarHBondContact O-N 2.97Å; S110-F112 PolarHBondContact O-N 2.83Å; S110-L113 PolarHBondContact O-N 3.27Å; S110-L114 WeakPolarHBondContact O-CB 3.46Å; S110-L114 WeakPolarHBondContact O-CG 3.34Å; S110-L114 PolarHBondContact O-N 2.96Å
111Y90.7Very high88.9Confident148 Ų14867.4 Ų67.458%0.5838%0.384SS*.Hα-helixtrans-60.3-45.1177.2177.7-99.1000112.3M107 G108 L113 L114 S115 V120M107-Y111 WeakPolarHBondContact O-CB 3.28Å; M107-Y111 PolarHBondContact O-N 3.21Å; G108-Y111 PolarHBondContact O-N 3.03Å; Y111-L113 PolarHBondContact O-N 3.43Å; Y111-L114 PolarHBondContact O-N 3.37Å; Y111-S115 WeakPolarHBondContact O-CB 3.38Å; Y111-S115 PolarHBondContact O-N 2.84Å; Y111-V120 HydrophobicContact CE2-CG1 4.03Å; Y111-V120 HydrophobicContact CE2-CG2 4.44Å
112F92.4Very high88.2Confident124 Ų12463.3 Ų63.354%0.54436%0.362SS..Hα-helixtrans-58.8-49177.7176.9-105.2000111.8G108 T109 S110 L114 S115 L116G108-F112 WeakPolarHBondContact O-CB 3.3Å; G108-F112 PolarHBondContact O-N 2.85Å; T109-F112 PolarHBondContact O-N 2.75Å; S110-F112 PolarHBondContact O-N 2.83Å; F112-L114 PolarHBondContact O-N 3.07Å; F112-S115 VanDerWaalsContact O-CB 3.31Å; F112-S115 WeakPolarHBondContact O-CB 3.45Å; F112-S115 PolarHBondContact O-N 2.92Å; F112-L116 HydrophobicContact CD1-CD1 4.27Å; F112-L116 HydrophobicContact CE1-CD1 3.68Å; F112-L116 HydrophobicContact CE1-CG 4.39Å; F112-L116 HydrophobicContact CZ-CD1 3.94Å; F112-L116 HydrophobicContact CZ-CD2 4.38Å; F112-L116 HydrophobicContact CZ-CG 4.35Å; F112-L116 PolarHBondContact O-N 2.97Å; F112-L116 VanDerWaalsContact O-N 3.14Å
113L90.9Very high87.5Confident61 Ų6164.2 Ų64.232%0.31937%0.367SS..Hα-helixtrans-65.1-40.1178.5-68.2176.1000112.4V73 V77 T109 S110 Y111 S115 L116 C117V73-L113 HydrophobicContact CG1-CB 3.59Å; V73-L113 HydrophobicContact CG1-CD1 4.32Å; V77-L113 HydrophobicContact CG2-CD1 3.5Å; V77-L113 VanDerWaalsContact CG2-CD1 3.5Å; T109-L113 HydrophobicContact CG2-CD1 4.2Å; T109-L113 WeakPolarHBondContact O-CG 3.33Å; T109-L113 PolarHBondContact O-N 2.8Å; S110-L113 PolarHBondContact O-N 3.27Å; Y111-L113 PolarHBondContact O-N 3.43Å; L113-S115 VanDerWaalsContact C-N 3.26Å; L113-S115 PolarHBondContact O-N 3.07Å; L113-L116 HydrophobicContact CD2-CD1 4.39Å; L113-L116 PolarHBondContact O-N 3.41Å; L113-C117 PolarHBondContact O-N 3.5Å; L113-C117 PolarHBondContact O-SG 3.23Å
114L89.2Confident87Confident14 Ų1464.2 Ų64.27%0.07336%0.363CS..Hα-helixtrans-61.4-36.4174.3-72.9175.5000112.4V73 V74 S110 Y111 F112 C117 G118 G119 V120 F123V73-L114 HydrophobicContact CB-CD2 3.96Å; V73-L114 HydrophobicContact CG1-CD2 3.96Å; V73-L114 HydrophobicContact CG1-CG 4.1Å; V74-L114 HydrophobicContact CG2-CD1 3.89Å; V74-L114 HydrophobicContact CG2-CD2 4.44Å; V74-L114 HydrophobicContact CG2-CG 4.46Å; S110-L114 WeakPolarHBondContact O-CB 3.46Å; S110-L114 WeakPolarHBondContact O-CG 3.34Å; S110-L114 PolarHBondContact O-N 2.96Å; Y111-L114 PolarHBondContact O-N 3.37Å; F112-L114 PolarHBondContact O-N 3.07Å; L114-C117 CarbonylContact O-C 3.59Å; L114-C117 PolarHBondContact O-N 3.32Å; L114-G118 PolarHBondContact O-N 2.97Å; L114-G118 VanDerWaalsContact O-N 3.09Å; L114-G119 PolarHBondContact O-N 3.13Å; L114-V120 HydrophobicContact CB-CG2 4.07Å; L114-F123 HydrophobicContact CD1-CD2 3.72Å; L114-F123 HydrophobicContact CD1-CE2 3.7Å; L114-F123 HydrophobicContact CD2-CD2 4.13Å; L114-F123 HydrophobicContact CD2-CE2 3.55Å; L114-F123 HydrophobicContact CG-CE2 4.27Å
115S87.5Confident86.5Confident67 Ų6764.4 Ų64.447%0.46936%0.36SS..Hα-helixtrans-62.7-44.3175.1-170.90000111.5Y111 F112 L113 C117 G118Y111-S115 WeakPolarHBondContact O-CB 3.38Å; Y111-S115 PolarHBondContact O-N 2.84Å; F112-S115 VanDerWaalsContact O-CB 3.31Å; F112-S115 WeakPolarHBondContact O-CB 3.45Å; F112-S115 PolarHBondContact O-N 2.92Å; L113-S115 VanDerWaalsContact C-N 3.26Å; L113-S115 PolarHBondContact O-N 3.07Å; S115-C117 VanDerWaalsContact C-N 3.29Å; S115-C117 PolarHBondContact O-N 2.97Å; S115-G118 PolarHBondContact O-N 3.5Å
116L87.8Confident86.2Confident119 Ų11962.1 Ų62.162%0.62334%0.342SS*.Hα-helixtrans-62.9-36.2175.7-62.8179.8000112.6F112 L113 G118F112-L116 HydrophobicContact CD1-CD1 4.27Å; F112-L116 HydrophobicContact CE1-CD1 3.68Å; F112-L116 HydrophobicContact CE1-CG 4.39Å; F112-L116 HydrophobicContact CZ-CD1 3.94Å; F112-L116 HydrophobicContact CZ-CD2 4.38Å; F112-L116 HydrophobicContact CZ-CG 4.35Å; F112-L116 PolarHBondContact O-N 2.97Å; F112-L116 VanDerWaalsContact O-N 3.14Å; L113-L116 HydrophobicContact CD2-CD1 4.39Å; L113-L116 PolarHBondContact O-N 3.41Å; L116-G118 VanDerWaalsContact C-N 3.32Å
117C83.2Confident85.8Confident56 Ų5665.1 Ų65.138%0.37836%0.356SS..THydrogen-bonded Turntrans-84.4-1.1179.6-66.70000114.1L69 L113 L114 S115 G119L69-C117 HydrophobicContact CD2-CB 3.74Å; L69-C117 HydrophobicContact CG-CB 4.17Å; L113-C117 PolarHBondContact O-N 3.5Å; L113-C117 PolarHBondContact O-SG 3.23Å; L114-C117 CarbonylContact O-C 3.59Å; L114-C117 PolarHBondContact O-N 3.32Å; S115-C117 VanDerWaalsContact C-N 3.29Å; S115-C117 PolarHBondContact O-N 2.97Å; C117-G119 PolarHBondContact O-N 3.45Å
118G79.4Confident85.7Confident57 Ų5762.2 Ų62.259%0.58835%0.346SS*.THydrogen-bonded Turntrans65.612-174.900000114.6L114 S115 L116 V120L114-G118 PolarHBondContact O-N 2.97Å; L114-G118 VanDerWaalsContact O-N 3.09Å; S115-G118 PolarHBondContact O-N 3.5Å; L116-G118 VanDerWaalsContact C-N 3.32Å; G118-V120 VanDerWaalsContact C-N 3.31Å; G118-V120 PolarHBondContact O-N 3.02Å
119G79.2Confident85.6Confident1 Ų164.4 Ų64.41%0.0134%0.344CS..THydrogen-bonded Turntrans-80.4-7.4-174.900000114.5L114 C117 M121 V122 F123L114-G119 PolarHBondContact O-N 3.13Å; C117-G119 PolarHBondContact O-N 3.45Å; G119-M121 VanDerWaalsContact C-N 3.33Å; G119-M121 PolarHBondContact O-N 3.26Å; G119-V122 PolarHBondContact O-N 2.95Å; G119-F123 WeakPolarHBondContact O-CD2 3.41Å
120V77.2Confident85.5Confident26 Ų2661.2 Ų61.216%0.15833%0.325CS..Hα-helixtrans-58.4-42.8-173.8-179.40000112Y111 L114 G118 V122 F123 I124Y111-V120 HydrophobicContact CE2-CG1 4.03Å; Y111-V120 HydrophobicContact CE2-CG2 4.44Å; L114-V120 HydrophobicContact CB-CG2 4.07Å; G118-V120 VanDerWaalsContact C-N 3.31Å; G118-V120 PolarHBondContact O-N 3.02Å; V120-V122 VanDerWaalsContact C-N 3.27Å; V120-V122 PolarHBondContact O-N 2.95Å; V120-F123 PolarHBondContact O-N 3.19Å; V120-F123 VanDerWaalsContact O-N 3.15Å; V120-I124 HydrophobicContact CG1-CD1 3.66Å; V120-I124 HydrophobicContact CG1-CG1 4.14Å; V120-I124 WeakPolarHBondContact O-CG1 3.33Å; V120-I124 PolarHBondContact O-N 3.02Å
121M79.9Confident85.5Confident119 Ų11965.1 Ų65.159%0.58634%0.344SS*.Hα-helixtrans-61.5-36.4-178.4-71.5-59.4-142.200112.4G119 F123 I124 F125G119-M121 VanDerWaalsContact C-N 3.33Å; G119-M121 PolarHBondContact O-N 3.26Å; M121-F123 VanDerWaalsContact C-N 3.29Å; M121-F123 PolarHBondContact O-N 2.91Å; M121-I124 PolarHBondContact O-N 3.07Å; M121-I124 HydrophobicContact SD-CD1 4.45Å; M121-F125 HydrophobicContact CB-CD2 4.39Å; M121-F125 WeakPolarHBondContact O-CB 3.24Å; M121-F125 VanDerWaalsContact O-CD2 3.24Å; M121-F125 WeakPolarHBondContact O-CD2 3.46Å; M121-F125 PolarHBondContact O-N 3.27Å; M121-F125 HydrophobicContact SD-CE2 4.11Å
122V78Confident85.6Confident5 Ų562.6 Ų62.63%0.0334%0.34CS..Hα-helixtrans-65.3-35.1179.5-179.70000111.2V59 N63 M67 G119 V120 G126V59-V122 HydrophobicContact CG1-CG1 4.3Å; N63-V122 HydrophobicContact CB-CG2 4.04Å; N63-V122 VanDerWaalsContact ND2-CG2 3.33Å; N63-V122 WeakPolarHBondContact ND2-CG2 3.37Å; M67-V122 HydrophobicContact CB-CG1 4.07Å; M67-V122 HydrophobicContact CE-CG1 3.63Å; M67-V122 HydrophobicContact SD-CG1 3.95Å; G119-V122 PolarHBondContact O-N 2.95Å; V120-V122 VanDerWaalsContact C-N 3.27Å; V120-V122 PolarHBondContact O-N 2.95Å; V122-G126 VanDerWaalsContact O-CA 3.25Å; V122-G126 WeakPolarHBondContact O-CA 3.29Å; V122-G126 PolarHBondContact O-N 3.46Å
123F77.9Confident85.7Confident45 Ų4559.8 Ų59.820%0.19733%0.33CS..Hα-helixtrans-78-37.6175.5-72.9-74.5000113.1G70 V74 L114 G119 V120 M121 G126 I127G70-F123 VanDerWaalsContact C-CZ 3.42Å; G70-F123 VanDerWaalsContact CA-CE2 3.43Å; V74-F123 HydrophobicContact CG2-CE2 4.37Å; V74-F123 HydrophobicContact CG2-CZ 3.96Å; L114-F123 HydrophobicContact CD1-CD2 3.72Å; L114-F123 HydrophobicContact CD1-CE2 3.7Å; L114-F123 HydrophobicContact CD2-CD2 4.13Å; L114-F123 HydrophobicContact CD2-CE2 3.55Å; L114-F123 HydrophobicContact CG-CE2 4.27Å; G119-F123 WeakPolarHBondContact O-CD2 3.41Å; V120-F123 PolarHBondContact O-N 3.19Å; V120-F123 VanDerWaalsContact O-N 3.15Å; M121-F123 VanDerWaalsContact C-N 3.29Å; M121-F123 PolarHBondContact O-N 2.91Å; F123-G126 PolarHBondContact O-N 3.18Å; F123-I127 HydrophobicContact CD1-CD1 3.99Å; F123-I127 WeakPolarHBondContact O-CB 3.35Å; F123-I127 PolarHBondContact O-N 3.41Å
124I83.1Confident85.8Confident76 Ų7657.8 Ų57.839%0.3932%0.319SS..Iπ-helixtrans-60.1-51.6174-67.5175.3000109.6V120 M121 T128 F129V120-I124 HydrophobicContact CG1-CD1 3.66Å; V120-I124 HydrophobicContact CG1-CG1 4.14Å; V120-I124 WeakPolarHBondContact O-CG1 3.33Å; V120-I124 PolarHBondContact O-N 3.02Å; M121-I124 PolarHBondContact O-N 3.07Å; M121-I124 HydrophobicContact SD-CD1 4.45Å; I124-T128 WeakPolarHBondContact O-CA 3.41Å; I124-T128 WeakPolarHBondContact O-CB 3.28Å; I124-T128 PolarHBondContact O-N 2.86Å; I124-T128 PolarHBondContact O-OG1 2.91Å; I124-F129 PolarHBondContact O-N 2.69Å
125F84.3Confident86Confident103 Ų10361.1 Ų61.145%0.45234%0.337SS..Iπ-helixtrans-75.1-30178.8-73.3-72.1000113.1V59 M121 F129 P130V59-F125 HydrophobicContact CG1-CB 4.18Å; V59-F125 HydrophobicContact CG2-CB 4.24Å; M121-F125 HydrophobicContact CB-CD2 4.39Å; M121-F125 WeakPolarHBondContact O-CB 3.24Å; M121-F125 VanDerWaalsContact O-CD2 3.24Å; M121-F125 WeakPolarHBondContact O-CD2 3.46Å; M121-F125 PolarHBondContact O-N 3.27Å; M121-F125 HydrophobicContact SD-CE2 4.11Å; F125-F129 HydrophobicContact CD1-CB 4.27Å; F125-F129 WeakPolarHBondContact O-CB 3.45Å; F125-P130 VanDerWaalsContact O-CD 3.24Å; F125-P130 WeakPolarHBondContact O-CD 3.22Å
126G85.6Confident86.2Confident4 Ų461.7 Ų61.74%0.04134%0.338CS..Iπ-helixtrans-75.6-26.8179.400000113.7F56 V122 F123 P130F56-G126 WeakPolarHBondContact CD2-O 3.35Å; V122-G126 VanDerWaalsContact O-CA 3.25Å; V122-G126 WeakPolarHBondContact O-CA 3.29Å; V122-G126 PolarHBondContact O-N 3.46Å; F123-G126 PolarHBondContact O-N 3.18Å; G126-P130 VanDerWaalsContact O-CG 3.31Å; G126-P130 WeakPolarHBondContact O-CG 3.34Å
127I86.5Confident86.4Confident88 Ų8856.8 Ų56.845%0.45131%0.311SS..Iπ-helixtrans-117.6-56.6-175.7-56.6176.3000111.2F123 F129 P130 L131F123-I127 HydrophobicContact CD1-CD1 3.99Å; F123-I127 WeakPolarHBondContact O-CB 3.35Å; F123-I127 PolarHBondContact O-N 3.41Å; I127-F129 PolarHBondContact O-N 2.82Å; I127-P130 WeakPolarHBondContact O-CD 3.24Å; I127-L131 HydrophobicContact CG2-CD1 4.14Å; I127-L131 WeakPolarHBondContact O-CG 3.49Å; I127-L131 PolarHBondContact O-N 3.41Å
128T89.3Confident86.8Confident68 Ų6854.1 Ų54.142%0.41729%0.293SS..Iπ-helixtrans-66.2-42.8-174.3-50.80000111.7I124 L131 L132I124-T128 WeakPolarHBondContact O-CA 3.41Å; I124-T128 WeakPolarHBondContact O-CB 3.28Å; I124-T128 PolarHBondContact O-N 2.86Å; I124-T128 PolarHBondContact O-OG1 2.91Å; T128-L131 PolarHBondContact O-N 3.42Å; T128-L132 HydrophobicContact CG2-CD1 4.1Å; T128-L132 HydrophobicContact CG2-CG 4.3Å; T128-L132 WeakPolarHBondContact O-CG 3.34Å; T128-L132 PolarHBondContact O-N 3.32Å
129F90.6Very high87.3Confident86 Ų8652 Ų5238%0.37727%0.27SS..Hα-helixtrans-63.1-47-178.6-179.3-111.5000113.4V55 I124 F125 I127 L131 L132 L133V55-F129 HydrophobicContact CG1-CD1 3.7Å; V55-F129 HydrophobicContact CG1-CE1 4.12Å; I124-F129 PolarHBondContact O-N 2.69Å; F125-F129 HydrophobicContact CD1-CB 4.27Å; F125-F129 WeakPolarHBondContact O-CB 3.45Å; I127-F129 PolarHBondContact O-N 2.82Å; F129-L131 VanDerWaalsContact C-N 3.32Å; F129-L131 PolarHBondContact O-N 3.36Å; F129-L132 WeakPolarHBondContact O-CB 3.28Å; F129-L132 PolarHBondContact O-N 3.24Å; F129-L133 HydrophobicContact CD1-CD1 4.12Å; F129-L133 HydrophobicContact CE1-CD1 3.64Å; F129-L133 HydrophobicContact CE1-CG 4.24Å; F129-L133 HydrophobicContact CE2-CD2 4.21Å; F129-L133 HydrophobicContact CE2-CG 4.29Å; F129-L133 HydrophobicContact CZ-CD1 3.87Å; F129-L133 HydrophobicContact CZ-CD2 4.05Å; F129-L133 HydrophobicContact CZ-CG 4.09Å; F129-L133 WeakPolarHBondContact O-CG 3.38Å; F129-L133 PolarHBondContact O-N 2.91Å
130P91.1Very high87.7Confident4 Ų454.7 Ų54.73%0.02628%0.283CS..Hα-helixtrans-55.9-42.8170.7-21.822.8000114.4A52 V55 F125 G126 I127 L132 L133 I134A52-P130 HydrophobicContact CB-CB 4Å; V55-P130 HydrophobicContact CB-CG 4.04Å; V55-P130 HydrophobicContact CG1-CB 4.47Å; V55-P130 HydrophobicContact CG1-CG 3.69Å; F125-P130 VanDerWaalsContact O-CD 3.24Å; F125-P130 WeakPolarHBondContact O-CD 3.22Å; G126-P130 VanDerWaalsContact O-CG 3.31Å; G126-P130 WeakPolarHBondContact O-CG 3.34Å; I127-P130 WeakPolarHBondContact O-CD 3.24Å; P130-L132 VanDerWaalsContact C-N 3.32Å; P130-L132 PolarHBondContact O-N 2.94Å; P130-L133 PolarHBondContact O-N 3.46Å; P130-I134 WeakPolarHBondContact O-CD1 3.3Å; P130-I134 VanDerWaalsContact O-CG1 3.22Å; P130-I134 WeakPolarHBondContact O-CG1 3.13Å; P130-I134 PolarHBondContact O-N 2.83Å
131L92.1Very high88.2Confident97 Ų9753.6 Ų53.651%0.50828%0.276SS..Hα-helixtrans-62.1-41.5177.6-69.8174.2000111.4I127 T128 F129 I134 L135I127-L131 HydrophobicContact CG2-CD1 4.14Å; I127-L131 WeakPolarHBondContact O-CG 3.49Å; I127-L131 PolarHBondContact O-N 3.41Å; T128-L131 PolarHBondContact O-N 3.42Å; F129-L131 VanDerWaalsContact C-N 3.32Å; F129-L131 PolarHBondContact O-N 3.36Å; L131-I134 PolarHBondContact O-N 3.2Å; L131-L135 WeakPolarHBondContact O-CG 3.32Å; L131-L135 PolarHBondContact O-N 2.71Å
132L93.3Very high88.2Confident94 Ų9450.8 Ų50.849%0.49226%0.264SS..Hα-helixtrans-62.1-45.1174.6-71.5173.5000111.7T128 F129 P130 I134 L135 V136T128-L132 HydrophobicContact CG2-CD1 4.1Å; T128-L132 HydrophobicContact CG2-CG 4.3Å; T128-L132 WeakPolarHBondContact O-CG 3.34Å; T128-L132 PolarHBondContact O-N 3.32Å; F129-L132 WeakPolarHBondContact O-CB 3.28Å; F129-L132 PolarHBondContact O-N 3.24Å; P130-L132 VanDerWaalsContact C-N 3.32Å; P130-L132 PolarHBondContact O-N 2.94Å; L132-I134 VanDerWaalsContact C-N 3.32Å; L132-I134 PolarHBondContact O-N 3.35Å; L132-L135 PolarHBondContact O-N 3.21Å; L132-V136 WeakPolarHBondContact O-CB 3.22Å; L132-V136 VanDerWaalsContact O-CG2 3.24Å; L132-V136 WeakPolarHBondContact O-CG2 3.48Å; L132-V136 PolarHBondContact O-N 2.85Å
133L93Very high87.7Confident66 Ų6653.8 Ų53.835%0.34627%0.274SS..Hα-helixtrans-59.9-43.1176.7-69.1179.3000111.9V55 F129 P130 V136 H137V55-L133 HydrophobicContact CG2-CD1 4.04Å; F129-L133 HydrophobicContact CD1-CD1 4.12Å; F129-L133 HydrophobicContact CE1-CD1 3.64Å; F129-L133 HydrophobicContact CE1-CG 4.24Å; F129-L133 HydrophobicContact CE2-CD2 4.21Å; F129-L133 HydrophobicContact CE2-CG 4.29Å; F129-L133 HydrophobicContact CZ-CD1 3.87Å; F129-L133 HydrophobicContact CZ-CD2 4.05Å; F129-L133 HydrophobicContact CZ-CG 4.09Å; F129-L133 WeakPolarHBondContact O-CG 3.38Å; F129-L133 PolarHBondContact O-N 2.91Å; P130-L133 PolarHBondContact O-N 3.46Å; L133-V136 PolarHBondContact O-N 2.67Å; L133-H137 VanDerWaalsContact O-CB 3.28Å; L133-H137 WeakPolarHBondContact O-CB 3.11Å; L133-H137 PolarHBondContact O-N 2.67Å
134I94Very high86.9Confident18 Ų1855.4 Ų55.49%0.09229%0.285CS..Hα-helixtrans-60.3-47.9175.9-69.1164000110.6L41 Y48 A52 P130 L131 L132 H137 A138L41-I134 HydrophobicContact CD2-CG2 3.58Å; Y48-I134 HydrophobicContact CD1-CB 3.98Å; Y48-I134 HydrophobicContact CD1-CG1 3.69Å; Y48-I134 HydrophobicContact CD1-CG2 3.67Å; Y48-I134 HydrophobicContact CD2-CG2 4Å; Y48-I134 HydrophobicContact CE1-CB 4.45Å; Y48-I134 HydrophobicContact CE1-CG2 4.05Å; Y48-I134 HydrophobicContact CE2-CG2 4.35Å; Y48-I134 HydrophobicContact CG-CB 4.33Å; Y48-I134 HydrophobicContact CG-CG1 4Å; Y48-I134 HydrophobicContact CG-CG2 3.64Å; A52-I134 HydrophobicContact CB-CD1 4.28Å; P130-I134 WeakPolarHBondContact O-CD1 3.3Å; P130-I134 VanDerWaalsContact O-CG1 3.22Å; P130-I134 WeakPolarHBondContact O-CG1 3.13Å; P130-I134 PolarHBondContact O-N 2.83Å; L131-I134 PolarHBondContact O-N 3.2Å; L132-I134 VanDerWaalsContact C-N 3.32Å; L132-I134 PolarHBondContact O-N 3.35Å; I134-H137 PolarHBondContact O-N 3.46Å; I134-A138 VanDerWaalsContact O-CB 3.24Å; I134-A138 WeakPolarHBondContact O-CB 3.39Å; I134-A138 PolarHBondContact O-N 2.91Å
135L92.2Very high85.4Confident84 Ų8458.6 Ų58.644%0.4430%0.3SS..Hα-helixtrans-66.1-41-179.8-72.7176.6000112.5L131 L132 A138 S139L131-L135 WeakPolarHBondContact O-CG 3.32Å; L131-L135 PolarHBondContact O-N 2.71Å; L132-L135 PolarHBondContact O-N 3.21Å; L135-A138 PolarHBondContact O-N 3.46Å; L135-S139 WeakPolarHBondContact O-CB 3.36Å; L135-S139 PolarHBondContact O-N 3.04Å; L135-S139 PolarHBondContact O-OG 3.29Å
136V92.6Very high83.7Confident80 Ų8061.9 Ų61.949%0.48531%0.314SS..Hα-helixtrans-61.1-49.4175.5167.90000109.7L132 L133 S139 L140L132-V136 WeakPolarHBondContact O-CB 3.22Å; L132-V136 VanDerWaalsContact O-CG2 3.24Å; L132-V136 WeakPolarHBondContact O-CG2 3.48Å; L132-V136 PolarHBondContact O-N 2.85Å; L133-V136 PolarHBondContact O-N 2.67Å; V136-S139 PolarHBondContact O-N 2.99Å; V136-L140 HydrophobicContact CG1-CD1 3.62Å; V136-L140 HydrophobicContact CG1-CG 4.42Å; V136-L140 WeakPolarHBondContact O-CB 3.33Å; V136-L140 VanDerWaalsContact O-CG 3.28Å; V136-L140 WeakPolarHBondContact O-CG 3.3Å; V136-L140 PolarHBondContact O-N 3.31Å
137H92.5Very high82.3Confident15 Ų1562.8 Ų62.87%0.06932%0.318CS..Hα-helixtrans-60.8-48.1177.7-175.3-86.9000112.1F15 F16 F22 Y48 L133 I134 S139 L140 R141F15-H137 AromaticContact CD2-CE1 3.51Å; F15-H137 AromaticContact CE2-CE1 3.3Å; F15-H137 WeakPolarHBondContact CE2-CE1 3.35Å; F15-H137 AromaticContact CE2-ND1 3.57Å; F15-H137 AromaticContact CE2-NE2 3.97Å; F15-H137 AromaticContact CZ-CE1 3.92Å; F15-H137 PolarHBondContact O-CE1 3.05Å; F15-H137 VanDerWaalsContact O-CE1 3.32Å; F15-H137 PolarHBondContact O-NE2 3.13Å; F16-H137 AromaticContact CE1-CD2 3.63Å; F22-H137 AromaticContact CE1-CD2 3.86Å; F22-H137 AromaticContact CE1-NE2 3.76Å; F22-H137 AromaticContact CZ-NE2 3.8Å; Y48-H137 HydrophobicContact CE1-CB 3.98Å; Y48-H137 AromaticContact CE1-CG 3.88Å; Y48-H137 AromaticContact CE1-ND1 3.34Å; Y48-H137 VanDerWaalsContact CE1-ND1 3.34Å; Y48-H137 WeakPolarHBondContact CE1-ND1 3.18Å; Y48-H137 AromaticContact CZ-ND1 3.52Å; Y48-H137 PolarHBondContact OH-ND1 3.36Å; L133-H137 VanDerWaalsContact O-CB 3.28Å; L133-H137 WeakPolarHBondContact O-CB 3.11Å; L133-H137 PolarHBondContact O-N 2.67Å; I134-H137 PolarHBondContact O-N 3.46Å; H137-S139 PolarHBondContact O-N 3.07Å; H137-L140 PolarHBondContact O-N 3.48Å; H137-R141 WeakPolarHBondContact O-CB 3.44Å; H137-R141 PolarHBondContact O-N 3.07Å
138A90.6Very high81Confident0 Ų066 Ų660%033%0.325CS..Hα-helixtrans-62.6-31.4178.300000112.7V37 N40 L41 Y48 I134 L135V37-A138 HydrophobicContact CG1-CB 4.18Å; N40-A138 HydrophobicContact CB-CB 4.05Å; N40-A138 PolarHBondContact ND2-O 3.13Å; L41-A138 HydrophobicContact CD2-CB 3.85Å; L41-A138 HydrophobicContact CG-CB 4.09Å; Y48-A138 WeakPolarHBondContact OH-CA 3.32Å; Y48-A138 PolarHBondContact OH-N 2.96Å; I134-A138 VanDerWaalsContact O-CB 3.24Å; I134-A138 WeakPolarHBondContact O-CB 3.39Å; I134-A138 PolarHBondContact O-N 2.91Å; L135-A138 PolarHBondContact O-N 3.46Å
139S89.9Confident79.3Confident14 Ų1468.8 Ų68.810%0.09834%0.336CS..Hα-helixtrans-75.5-40177.6-65.70000112.9W33 R36 L135 V136 H137W33-S139 PolarHBondContact NE1-OG 3.33Å; R36-S139 WeakPolarHBondContact CD-O 3.09Å; L135-S139 WeakPolarHBondContact O-CB 3.36Å; L135-S139 PolarHBondContact O-N 3.04Å; L135-S139 PolarHBondContact O-OG 3.29Å; V136-S139 PolarHBondContact O-N 2.99Å; H137-S139 PolarHBondContact O-N 3.07Å
140L89Confident77.6Confident56 Ų5669.2 Ų69.229%0.29334%0.339SS..Hα-helixtrans-84-34-174-65.9172.5000112.8F22 A23 V136 H137 L142F22-L140 WeakPolarHBondContact CA-O 3.38Å; F22-L140 HydrophobicContact CD1-CB 3.79Å; A23-L140 PolarHBondContact N-O 2.95Å; A23-L140 WeakPolarHBondContact O-CA 3.47Å; V136-L140 HydrophobicContact CG1-CD1 3.62Å; V136-L140 HydrophobicContact CG1-CG 4.42Å; V136-L140 WeakPolarHBondContact O-CB 3.33Å; V136-L140 VanDerWaalsContact O-CG 3.28Å; V136-L140 WeakPolarHBondContact O-CG 3.3Å; V136-L140 PolarHBondContact O-N 3.31Å; H137-L140 PolarHBondContact O-N 3.48Å; L140-L142 PolarHBondContact O-N 2.98Å
141R86.3Confident76.1Confident4 Ų469.4 Ų69.42%0.01534%0.34CS..BIsolated β-bridgetrans-65.5122.3-174.4-176-97.3-175.2149.43.4111.8D14 F22 N40 Y44 H137 N147D14-R141 IonicContact OD1-NH2 3.96Å; D14-R141 IonicContact OD2-NH2 3.87Å; F22-R141 HydrophobicContact CD1-CB 4.34Å; F22-R141 HydrophobicContact CE1-CB 4.05Å; N40-R141 PolarHBondContact ND2-O 3.37Å; N40-R141 WeakPolarHBondContact OD1-CD 3.39Å; N40-R141 PolarHBondContact OD1-NH1 3.45Å; Y44-R141 HydrophobicContact CE2-CG 4.13Å; Y44-R141 VanDerWaalsContact CZ-NH2 3.33Å; Y44-R141 PolarHBondContact OH-NE 3.39Å; Y44-R141 PolarHBondContact OH-NH2 2.92Å; H137-R141 WeakPolarHBondContact O-CB 3.44Å; H137-R141 PolarHBondContact O-N 3.07Å; R141-N147 PolarHBondContact NH2-ND2 3.06Å; R141-N147 VanDerWaalsContact NH2-ND2 3.14Å
142L80.6Confident74.6Confident60 Ų6073.2 Ų73.231%0.31435%0.353SS..PPolyproline II helixtrans-86.2134.4171.1-68.9175.8000110.2R21 A23 L140R21-L142 WeakPolarHBondContact O-CB 3.5Å; R21-L142 PolarHBondContact O-N 2.84Å; A23-L142 HydrophobicContact CB-CD1 3.47Å; A23-L142 VanDerWaalsContact CB-CD1 3.47Å; A23-L142 HydrophobicContact CB-CD2 4Å; A23-L142 HydrophobicContact CB-CG 3.75Å; L140-L142 PolarHBondContact O-N 2.98Å
143R67.2Low72.7Confident68 Ų6875.9 Ų75.926%0.25736%0.364SS..PPolyproline II helixtrans-103.1122.3176.8-167.1176.978.1179.2-4.5110.9S39 N147 N151S39-R143 PolarHBondContact OG-NE 3.18Å; S39-R143 PolarHBondContact OG-NH1 2.8Å; R143-N147 HydrophobicContact CG-CB 3.55Å; R143-N151 PolarHBondContact NH1-ND2 3.3Å; R143-N151 PolarHBondContact NH1-OD1 3.44Å
144N60.8Low70.9Confident78 Ų7874.8 Ų74.842%0.41736%0.357SS..PPolyproline II helixtrans-74.9160.8176.6-1511.1000112.5R21 K146 N147 R148R21-N144 VanDerWaalsContact NH1-CG 3.31Å; R21-N144 PolarHBondContact NH1-ND2 3.16Å; N144-K146 VanDerWaalsContact C-N 3.32Å; N144-K146 PolarHBondContact O-N 3.44Å; N144-N147 WeakPolarHBondContact O-CB 3.3Å; N144-N147 PolarHBondContact O-N 3.5Å; N144-N147 VanDerWaalsContact O-N 3.14Å; N144-R148 PolarHBondContact O-N 3.11Å
145M52.6Low69.1Low144 Ų14475.1 Ų75.171%0.70937%0.365SS*.Hα-helixtrans-62.5-29.7-176.4-78-177.944.700115N147 R148 L149M145-N147 VanDerWaalsContact C-N 3.29Å; M145-N147 PolarHBondContact O-N 3Å; M145-R148 WeakPolarHBondContact O-CB 3.29Å; M145-R148 PolarHBondContact O-N 3.49Å; M145-L149 PolarHBondContact O-N 3.26Å
146K48.6Very low67.3Low171 Ų17176.5 Ų76.574%0.74338%0.377SS*.Hα-helixtrans-59.8-41.9174-167.9175.4177.3-175.20111.2N144 R148 L149 E150N144-K146 VanDerWaalsContact C-N 3.32Å; N144-K146 PolarHBondContact O-N 3.44Å; K146-R148 VanDerWaalsContact C-N 3.33Å; K146-R148 PolarHBondContact O-N 3.22Å; K146-L149 PolarHBondContact O-N 3.38Å; K146-E150 PolarHBondContact O-N 3.45Å
147N56.1Low65.4Low24 Ų2474.5 Ų74.513%0.12837%0.373CS..Hα-helixtrans-71.6-26.4175.5-59.716.6000111.3R141 R143 N144 M145 L149 N151R141-N147 PolarHBondContact NH2-ND2 3.06Å; R141-N147 VanDerWaalsContact NH2-ND2 3.14Å; R143-N147 HydrophobicContact CG-CB 3.55Å; N144-N147 WeakPolarHBondContact O-CB 3.3Å; N144-N147 PolarHBondContact O-N 3.5Å; N144-N147 VanDerWaalsContact O-N 3.14Å; M145-N147 VanDerWaalsContact C-N 3.29Å; M145-N147 PolarHBondContact O-N 3Å; N147-L149 VanDerWaalsContact C-N 3.31Å; N147-L149 PolarHBondContact O-N 3.18Å; N147-N151 WeakPolarHBondContact O-CB 3.31Å; N147-N151 PolarHBondContact O-N 3.08Å; N147-N151 PolarHBondContact O-ND2 3.46Å
148R58.5Low63.7Low156 Ų15674.9 Ų74.959%0.58937%0.374SS*.Hα-helixtrans-64.2-34.6173.9-71.7-174.8170.4-161.2-5.4112.6N144 M145 K146 K152N144-R148 PolarHBondContact O-N 3.11Å; M145-R148 WeakPolarHBondContact O-CB 3.29Å; M145-R148 PolarHBondContact O-N 3.49Å; K146-R148 VanDerWaalsContact C-N 3.33Å; K146-R148 PolarHBondContact O-N 3.22Å; R148-K152 PolarHBondContact O-N 3.02Å
149L53.7Low62.2Low125 Ų12582.5 Ų82.565%0.65441%0.408SS*.Hα-helixtrans-77.1-43.6-177-157.6141000111M145 K146 N147 N151 K152 M153M145-L149 PolarHBondContact O-N 3.26Å; K146-L149 PolarHBondContact O-N 3.38Å; N147-L149 VanDerWaalsContact C-N 3.31Å; N147-L149 PolarHBondContact O-N 3.18Å; L149-N151 VanDerWaalsContact C-N 3.32Å; L149-N151 PolarHBondContact O-N 3.3Å; L149-K152 PolarHBondContact O-N 3.15Å; L149-M153 PolarHBondContact O-N 3.25Å
150E55Low61.1Low95 Ų9587.1 Ų87.144%0.44443%0.426SS..Hα-helixtrans-60-41.1169.7-130.6169.2-16900111.6K146 K152 M153 E154K146-E150 PolarHBondContact O-N 3.45Å; E150-K152 VanDerWaalsContact C-N 3.32Å; E150-K152 PolarHBondContact O-N 3.07Å; E150-M153 PolarHBondContact O-N 3.27Å; E150-M153 VanDerWaalsContact O-N 3.13Å; E150-E154 WeakPolarHBondContact O-CG 3.33Å; E150-E154 PolarHBondContact O-N 2.98Å
151N59.8Low60.6Low9 Ų984.6 Ų84.65%0.04841%0.413CS..Hα-helixtrans-68-22.7176.8-87.9-85.6000114.8Y43 R143 N147 L149 G155 M158Y43-N151 WeakPolarHBondContact CD2-ND2 3.46Å; Y43-N151 WeakPolarHBondContact CD2-OD1 3.32Å; R143-N151 PolarHBondContact NH1-ND2 3.3Å; R143-N151 PolarHBondContact NH1-OD1 3.44Å; N147-N151 WeakPolarHBondContact O-CB 3.31Å; N147-N151 PolarHBondContact O-N 3.08Å; N147-N151 PolarHBondContact O-ND2 3.46Å; L149-N151 VanDerWaalsContact C-N 3.32Å; L149-N151 PolarHBondContact O-N 3.3Å; N151-G155 WeakPolarHBondContact O-CA 3.48Å; N151-G155 PolarHBondContact O-N 2.96Å; N151-M158 VanDerWaalsContact OD1-CE 3.29Å; N151-M158 WeakPolarHBondContact OD1-CE 3.45Å
152K60Low60.3Low177 Ų17786.6 Ų86.677%0.7743%0.426SS*.Hα-helixtrans-73.1-34.1171.4-85.5-164.9173.5-158.60111.5R148 L149 E150R148-K152 PolarHBondContact O-N 3.02Å; L149-K152 PolarHBondContact O-N 3.15Å; E150-K152 VanDerWaalsContact C-N 3.32Å; E150-K152 PolarHBondContact O-N 3.07Å
153M54.4Low60.5Low149 Ų14985.6 Ų85.673%0.73442%0.421SS*.Hα-helixtrans-74.2-40175.9-66.2176.260.400111.2L149 E150L149-M153 PolarHBondContact O-N 3.25Å; E150-M153 PolarHBondContact O-N 3.27Å; E150-M153 VanDerWaalsContact O-N 3.13Å
154E55.4Low61.1Low43 Ų4382.8 Ų82.820%0.20141%0.413CS..Hα-helixtrans-74.5-25.2173.8-65.5178.6156.900112.7R10 E150 V156 G157 M158R10-E154 IonicContact CZ-OE1 3.26Å; R10-E154 VanDerWaalsContact CZ-OE1 3.26Å; R10-E154 IonicContact CZ-OE2 3.76Å; R10-E154 IonicContact NH1-OE1 2.85Å; R10-E154 PolarHBondContact NH1-OE1 2.87Å; R10-E154 IonicContact NH2-OE1 2.75Å; R10-E154 PolarHBondContact NH2-OE1 3.14Å; R10-E154 IonicContact NH2-OE2 2.8Å; R10-E154 PolarHBondContact NH2-OE2 2.81Å; E150-E154 WeakPolarHBondContact O-CG 3.33Å; E150-E154 PolarHBondContact O-N 2.98Å; E154-V156 PolarHBondContact O-N 2.85Å; E154-V156 VanDerWaalsContact O-N 3.07Å; E154-G157 CarbonylContact O-C 3.49Å; E154-G157 WeakPolarHBondContact O-CA 3.24Å; E154-G157 PolarHBondContact O-N 2.75Å; E154-M158 HydrophobicContact CB-CG 4.1Å; E154-M158 WeakPolarHBondContact O-CG 3.43Å; E154-M158 PolarHBondContact O-N 2.79Å
155G54.9Low62.2Low25 Ų2582.2 Ų82.226%0.25841%0.409SS..Hα-helixtrans-60-20.5-176.900000115.2N151N151-G155 WeakPolarHBondContact O-CA 3.48Å; N151-G155 PolarHBondContact O-N 2.96Å
156V53.8Low63.7Low114 Ų11479.6 Ų79.669%0.69140%0.397SS*.Hα-helixtrans-79-29.6172.1-178.10000111.6E154E154-V156 PolarHBondContact O-N 2.85Å; E154-V156 VanDerWaalsContact O-N 3.07Å
157G54.6Low65.4Low38 Ų3872.8 Ų72.839%0.39237%0.369SS..Hα-helixtrans-88.3-34.117400000113.9E154 K159 K160E154-G157 CarbonylContact O-C 3.49Å; E154-G157 WeakPolarHBondContact O-CA 3.24Å; E154-G157 PolarHBondContact O-N 2.75Å; G157-K159 VanDerWaalsContact C-N 3.31Å; G157-K159 PolarHBondContact O-N 2.8Å; G157-K160 WeakPolarHBondContact O-CA 3.4Å; G157-K160 WeakPolarHBondContact O-CB 3.21Å; G157-K160 PolarHBondContact O-N 3.22Å
158M56.2Low66.7Low22 Ų2275.6 Ų75.611%0.10838%0.384CS..Hα-helixtrans-68.4-25.8-178.4-67.9-150.2-63.700113.3L42 N151 E154 K160 S161 G164L42-M158 HydrophobicContact CB-CE 3.76Å; L42-M158 HydrophobicContact CB-SD 3.8Å; L42-M158 HydrophobicContact CD1-CE 4.43Å; N151-M158 VanDerWaalsContact OD1-CE 3.29Å; N151-M158 WeakPolarHBondContact OD1-CE 3.45Å; E154-M158 HydrophobicContact CB-CG 4.1Å; E154-M158 WeakPolarHBondContact O-CG 3.43Å; E154-M158 PolarHBondContact O-N 2.79Å; M158-K160 PolarHBondContact O-N 3.32Å; M158-S161 PolarHBondContact O-N 3.14Å; M158-S161 VanDerWaalsContact O-N 3.14Å; M158-S161 PolarHBondContact O-OG 3.28Å; M158-G164 WeakPolarHBondContact O-CA 3.28Å
159K58Low67.9Low161 Ų16172.5 Ų72.570%0.738%0.378SS*.THydrogen-bonded Turntrans-61.8-19.1168.6-73.8-170.2176-161.40113G157G157-K159 VanDerWaalsContact C-N 3.31Å; G157-K159 PolarHBondContact O-N 2.8Å
160K68.1Low69.4Low111 Ų11171.5 Ų71.548%0.48337%0.373SS..THydrogen-bonded Turntrans-97.3-1177.6-56.2-177.4-177.6175.10113.3M4 G157 M158M4-K160 WeakPolarHBondContact CG-O 3.07Å; G157-K160 WeakPolarHBondContact O-CA 3.4Å; G157-K160 WeakPolarHBondContact O-CB 3.21Å; G157-K160 PolarHBondContact O-N 3.22Å; M158-K160 PolarHBondContact O-N 3.32Å
161S78.4Confident70.7Confident3 Ų370.8 Ų70.82%0.02137%0.372CS..SBendtrans-81.9155.9176.284.40000110.8Q45 M158 M163 G164 I165Q45-S161 VanDerWaalsContact OE1-CB 3.24Å; Q45-S161 PolarHBondContact OE1-OG 3.43Å; M158-S161 PolarHBondContact O-N 3.14Å; M158-S161 VanDerWaalsContact O-N 3.14Å; M158-S161 PolarHBondContact O-OG 3.28Å; S161-M163 VanDerWaalsContact C-N 3.3Å; S161-M163 PolarHBondContact O-N 2.89Å; S161-G164 WeakPolarHBondContact O-CA 3.39Å; S161-G164 PolarHBondContact O-N 3.21Å; S161-G164 PolarHBondContact OG-N 3.31Å; S161-G164 VanDerWaalsContact OG-N 3.16Å; S161-I165 WeakPolarHBondContact O-CG1 3.28Å; S161-I165 PolarHBondContact O-N 3.32Å
162P80.4Confident71.9Confident45 Ų4574.2 Ų74.229%0.29239%0.388SS..Hα-helixtrans-53-42.6175.5-29.534000114.1M4 L6 I165 I166M4-P162 HydrophobicContact SD-CG 4.13Å; L6-P162 HydrophobicContact CD2-CG 4.46Å; P162-I165 PolarHBondContact O-N 3.35Å; P162-I166 VanDerWaalsContact O-CG1 3.28Å; P162-I166 WeakPolarHBondContact O-CG1 3.48Å; P162-I166 PolarHBondContact O-N 2.82Å
163M83.4Confident73.2Confident40 Ų4070.7 Ų70.720%0.19737%0.374CS..Hα-helixtrans-68.4-36.4177.7-164.568.4134.400111.9L41 L42 Q45 S161 I166 L167L41-M163 HydrophobicContact CB-CE 3.88Å; L41-M163 HydrophobicContact CB-CG 4.49Å; L41-M163 HydrophobicContact CD1-CE 4.28Å; L41-M163 HydrophobicContact CD2-CE 3.78Å; L41-M163 HydrophobicContact CG-CE 4.17Å; L42-M163 HydrophobicContact CD2-CB 4.37Å; L42-M163 HydrophobicContact CD2-CG 4.36Å; Q45-M163 HydrophobicContact CB-CB 4.32Å; Q45-M163 VanDerWaalsContact CD-CB 3.44Å; Q45-M163 HydrophobicContact CG-CB 3.75Å; Q45-M163 HydrophobicContact CG-CG 4.48Å; S161-M163 VanDerWaalsContact C-N 3.3Å; S161-M163 PolarHBondContact O-N 2.89Å; M163-I166 PolarHBondContact O-N 3.09Å; M163-L167 HydrophobicContact CG-CD1 4Å; M163-L167 HydrophobicContact CG-CG 4.48Å; M163-L167 WeakPolarHBondContact O-CB 3.5Å; M163-L167 VanDerWaalsContact O-CG 3.3Å; M163-L167 WeakPolarHBondContact O-CG 3.35Å; M163-L167 PolarHBondContact O-N 2.97Å
164G79.5Confident74.6Confident9 Ų968.5 Ų68.59%0.09336%0.362CS..Hα-helixtrans-58.4-46.9173.200000112.5M158 S161 L167 D168M158-G164 WeakPolarHBondContact O-CA 3.28Å; S161-G164 WeakPolarHBondContact O-CA 3.39Å; S161-G164 PolarHBondContact O-N 3.21Å; S161-G164 PolarHBondContact OG-N 3.31Å; S161-G164 VanDerWaalsContact OG-N 3.16Å; G164-L167 PolarHBondContact O-N 3.06Å; G164-D168 WeakPolarHBondContact O-CB 2.99Å; G164-D168 PolarHBondContact O-N 3.08Å
165I83.8Confident76.1Confident66 Ų6671.1 Ų71.134%0.33838%0.375SS..Hα-helixtrans-64.5-44.3177.9-63.2165.6000110.7M4 S161 P162 L167 D168 L169M4-I165 HydrophobicContact CG-CD1 4.23Å; M4-I165 HydrophobicContact SD-CD1 3.7Å; S161-I165 WeakPolarHBondContact O-CG1 3.28Å; S161-I165 PolarHBondContact O-N 3.32Å; P162-I165 PolarHBondContact O-N 3.35Å; I165-L167 VanDerWaalsContact C-N 3.33Å; I165-L167 PolarHBondContact O-N 3.34Å; I165-D168 PolarHBondContact O-N 3.45Å; I165-L169 HydrophobicContact CG2-CD1 4.05Å; I165-L169 HydrophobicContact CG2-CG 4.41Å; I165-L169 WeakPolarHBondContact O-CB 3.48Å; I165-L169 VanDerWaalsContact O-CG 3.25Å; I165-L169 WeakPolarHBondContact O-CG 3.37Å; I165-L169 PolarHBondContact O-N 3.06Å
166I84.4Confident77.8Confident88 Ų8875.2 Ų75.245%0.45139%0.385SS..Hα-helixtrans-60.4-45178.7-69.2164.8000110.8P162 M163 L169 L170P162-I166 VanDerWaalsContact O-CG1 3.28Å; P162-I166 WeakPolarHBondContact O-CG1 3.48Å; P162-I166 PolarHBondContact O-N 2.82Å; M163-I166 PolarHBondContact O-N 3.09Å; I166-L169 PolarHBondContact O-N 3.16Å; I166-L170 HydrophobicContact CG2-CD1 4.11Å; I166-L170 WeakPolarHBondContact O-CG 3.32Å; I166-L170 PolarHBondContact O-N 3.19Å
167L84.3Confident79.5Confident28 Ų2874.6 Ų74.615%0.14738%0.377CS..Hα-helixtrans-68.7-37.7-179.4-69.7169.6000112.1I38 L41 L42 M163 G164 I165 L169 L170 D171I38-L167 HydrophobicContact CG1-CD2 4.46Å; I38-L167 HydrophobicContact CG2-CD1 4.24Å; L41-L167 HydrophobicContact CB-CD1 4.21Å; L41-L167 HydrophobicContact CD1-CD2 4.25Å; L42-L167 HydrophobicContact CD1-CD1 4.43Å; L42-L167 HydrophobicContact CD2-CD1 3.69Å; L42-L167 HydrophobicContact CG-CD1 3.76Å; M163-L167 HydrophobicContact CG-CD1 4Å; M163-L167 HydrophobicContact CG-CG 4.48Å; M163-L167 WeakPolarHBondContact O-CB 3.5Å; M163-L167 VanDerWaalsContact O-CG 3.3Å; M163-L167 WeakPolarHBondContact O-CG 3.35Å; M163-L167 PolarHBondContact O-N 2.97Å; G164-L167 PolarHBondContact O-N 3.06Å; I165-L167 VanDerWaalsContact C-N 3.33Å; I165-L167 PolarHBondContact O-N 3.34Å; L167-L169 VanDerWaalsContact C-N 3.33Å; L167-L169 PolarHBondContact O-N 3.33Å; L167-L170 HydrophobicContact CD2-CD1 4.22Å; L167-L170 PolarHBondContact O-N 2.97Å; L167-D171 PolarHBondContact O-N 3.42Å
168D83.1Confident81.2Confident83 Ų8376.2 Ų76.244%0.44438%0.377SS..Hα-helixtrans-62.6-40.4173-16868.3000111.6G164 I165 L170 D171 Q172G164-D168 WeakPolarHBondContact O-CB 2.99Å; G164-D168 PolarHBondContact O-N 3.08Å; I165-D168 PolarHBondContact O-N 3.45Å; D168-L170 VanDerWaalsContact C-N 3.35Å; D168-L170 PolarHBondContact O-N 2.93Å; D168-D171 PolarHBondContact O-N 3.1Å; D168-Q172 WeakPolarHBondContact O-CG 3.31Å; D168-Q172 PolarHBondContact O-N 2.88Å
169L85.4Confident82.8Confident92 Ų9281.5 Ų81.548%0.48240%0.399SS..Hα-helixtrans-65.4-37.3174.5-70.8172.2000112.3I165 I166 L167 Q173I165-L169 HydrophobicContact CG2-CD1 4.05Å; I165-L169 HydrophobicContact CG2-CG 4.41Å; I165-L169 WeakPolarHBondContact O-CB 3.48Å; I165-L169 VanDerWaalsContact O-CG 3.25Å; I165-L169 WeakPolarHBondContact O-CG 3.37Å; I165-L169 PolarHBondContact O-N 3.06Å; I166-L169 PolarHBondContact O-N 3.16Å; L167-L169 VanDerWaalsContact C-N 3.33Å; L167-L169 PolarHBondContact O-N 3.33Å; L169-Q173 VanDerWaalsContact O-CG 3.28Å; L169-Q173 WeakPolarHBondContact O-CG 3.5Å; L169-Q173 PolarHBondContact O-N 2.96Å; L169-Q173 VanDerWaalsContact O-N 3.13Å
170L84.3Confident84.4Confident103 Ų10378.7 Ų78.754%0.53939%0.391SS..Hα-helixtrans-67.2-43.4176.8-72.6170.7000111.5I166 L167 D168 Q172 Q173 E174I166-L170 HydrophobicContact CG2-CD1 4.11Å; I166-L170 WeakPolarHBondContact O-CG 3.32Å; I166-L170 PolarHBondContact O-N 3.19Å; L167-L170 HydrophobicContact CD2-CD1 4.22Å; L167-L170 PolarHBondContact O-N 2.97Å; D168-L170 VanDerWaalsContact C-N 3.35Å; D168-L170 PolarHBondContact O-N 2.93Å; L170-Q172 PolarHBondContact O-N 3.32Å; L170-Q173 WeakPolarHBondContact O-CB 3.31Å; L170-Q173 PolarHBondContact O-N 2.93Å; L170-Q173 VanDerWaalsContact O-N 3.11Å; L170-E174 PolarHBondContact O-N 3.03Å
171D82.3Confident85.5Confident81 Ų8178 Ų7843%0.43339%0.389SS..Hα-helixtrans-60.1-45.9176.2-16659.3000111.3L167 D168 Q173 E174 E175L167-D171 PolarHBondContact O-N 3.42Å; D168-D171 PolarHBondContact O-N 3.1Å; D171-Q173 VanDerWaalsContact C-N 3.26Å; D171-Q173 PolarHBondContact O-N 3.11Å; D171-E174 PolarHBondContact O-N 3.18Å; D171-E175 PolarHBondContact O-N 3.28Å
172Q84.6Confident86.1Confident81 Ų8182.6 Ų82.638%0.37941%0.414SS..Hα-helixtrans-61.8-30.6174.4-73.7-179.72.400113.8D168 L170 K176D168-Q172 WeakPolarHBondContact O-CG 3.31Å; D168-Q172 PolarHBondContact O-N 2.88Å; L170-Q172 PolarHBondContact O-N 3.32Å; Q172-K176 VanDerWaalsContact O-CG 3.29Å; Q172-K176 WeakPolarHBondContact O-CG 3.42Å; Q172-K176 PolarHBondContact O-N 3.04Å
173Q87Confident86.7Confident103 Ų10386.4 Ų86.448%0.48143%0.426SS..Hα-helixtrans-74-41.8175.3-72.1-66.1-46.900111.2L169 L170 D171 E175 K176 I177L169-Q173 VanDerWaalsContact O-CG 3.28Å; L169-Q173 WeakPolarHBondContact O-CG 3.5Å; L169-Q173 PolarHBondContact O-N 2.96Å; L169-Q173 VanDerWaalsContact O-N 3.13Å; L170-Q173 WeakPolarHBondContact O-CB 3.31Å; L170-Q173 PolarHBondContact O-N 2.93Å; L170-Q173 VanDerWaalsContact O-N 3.11Å; D171-Q173 VanDerWaalsContact C-N 3.26Å; D171-Q173 PolarHBondContact O-N 3.11Å; Q173-E175 PolarHBondContact O-N 3.38Å; Q173-K176 WeakPolarHBondContact O-CB 3.4Å; Q173-K176 PolarHBondContact O-N 2.75Å; Q173-I177 WeakPolarHBondContact O-CG1 3.22Å; Q173-I177 PolarHBondContact O-N 3.04Å
174E85.4Confident87.1Confident103 Ų10389.6 Ų89.648%0.48144%0.443SS..Hα-helixtrans-58.1-47.6175.4-173.6176.716600111.2L170 D171 K176 I177 N178L170-E174 PolarHBondContact O-N 3.03Å; D171-E174 PolarHBondContact O-N 3.18Å; E174-K176 VanDerWaalsContact C-N 3.27Å; E174-K176 PolarHBondContact O-N 3.08Å; E174-I177 PolarHBondContact O-N 2.81Å; E174-I177 VanDerWaalsContact O-N 3.15Å; E174-N178 PolarHBondContact O-N 3.43Å
175E86.4Confident87.6Confident98 Ų9893.6 Ų93.646%0.45846%0.459SS..Hα-helixtrans-58.3-37.8175.9-71.9-168.6168.700113.2D171 Q173 K179D171-E175 PolarHBondContact O-N 3.28Å; Q173-E175 PolarHBondContact O-N 3.38Å; E175-K179 VanDerWaalsContact O-CG 3.31Å; E175-K179 WeakPolarHBondContact O-CG 3.47Å; E175-K179 PolarHBondContact O-N 2.91Å; E175-K179 VanDerWaalsContact O-N 3.08Å
176K90.8Very high87.9Confident110 Ų11093.5 Ų93.548%0.47846%0.464SS..Hα-helixtrans-68.6-41178-75.7173-174.1176.60111.5Q172 Q173 E174 K179 I180Q172-K176 VanDerWaalsContact O-CG 3.29Å; Q172-K176 WeakPolarHBondContact O-CG 3.42Å; Q172-K176 PolarHBondContact O-N 3.04Å; Q173-K176 WeakPolarHBondContact O-CB 3.4Å; Q173-K176 PolarHBondContact O-N 2.75Å; E174-K176 VanDerWaalsContact C-N 3.27Å; E174-K176 PolarHBondContact O-N 3.08Å; K176-K179 PolarHBondContact O-N 2.8Å; K176-I180 VanDerWaalsContact O-CG1 3.3Å; K176-I180 WeakPolarHBondContact O-CG1 3.4Å; K176-I180 PolarHBondContact O-N 3.27Å; K176-I180 VanDerWaalsContact O-N 3.07Å
177I89.6Confident88Confident101 Ų10195.7 Ų95.752%0.51847%0.471SS..Hα-helixtrans-63.5-46.5177.5-69.4166.9000109.9Q173 E174 K179 I180 Q181Q173-I177 WeakPolarHBondContact O-CG1 3.22Å; Q173-I177 PolarHBondContact O-N 3.04Å; E174-I177 PolarHBondContact O-N 2.81Å; E174-I177 VanDerWaalsContact O-N 3.15Å; I177-K179 VanDerWaalsContact C-N 3.35Å; I177-K179 PolarHBondContact O-N 2.96Å; I177-I180 WeakPolarHBondContact O-CB 3.5Å; I177-I180 PolarHBondContact O-N 3.35Å; I177-I180 VanDerWaalsContact O-N 3.1Å; I177-Q181 PolarHBondContact O-N 2.89Å
178N89.5Confident88Confident73 Ų73100.7 Ų100.739%0.3950%0.497SS..Hα-helixtrans-60.2-44.3178.4-67.1-16.7000111.4E174 I180 Q181 D182E174-N178 PolarHBondContact O-N 3.43Å; N178-I180 VanDerWaalsContact C-N 3.31Å; N178-I180 PolarHBondContact O-N 3.02Å; N178-Q181 WeakPolarHBondContact O-CB 3.28Å; N178-Q181 PolarHBondContact O-N 3.37Å; N178-Q181 VanDerWaalsContact O-N 3.16Å; N178-D182 VanDerWaalsContact O-CG 3.29Å; N178-D182 PolarHBondContact O-N 2.87Å
179K90.9Very high87.8Confident132 Ų132103 Ų10357%0.57451%0.509SS*.Hα-helixtrans-60.6-36.7174.7-75169.9-176.3163.10113.4E175 K176 I177 F183E175-K179 VanDerWaalsContact O-CG 3.31Å; E175-K179 WeakPolarHBondContact O-CG 3.47Å; E175-K179 PolarHBondContact O-N 2.91Å; E175-K179 VanDerWaalsContact O-N 3.08Å; K176-K179 PolarHBondContact O-N 2.8Å; I177-K179 VanDerWaalsContact C-N 3.35Å; I177-K179 PolarHBondContact O-N 2.96Å; K179-F183 VanDerWaalsContact O-CB 3.32Å; K179-F183 WeakPolarHBondContact O-CB 3.47Å; K179-F183 PolarHBondContact O-N 3.38Å
180I90.3Very high86.6Confident103 Ų103107.3 Ų107.353%0.52852%0.524SS..Hα-helixtrans-68-43.3176.1-69.4164.8000110K176 I177 N178 F183 L184K176-I180 VanDerWaalsContact O-CG1 3.3Å; K176-I180 WeakPolarHBondContact O-CG1 3.4Å; K176-I180 PolarHBondContact O-N 3.27Å; K176-I180 VanDerWaalsContact O-N 3.07Å; I177-I180 WeakPolarHBondContact O-CB 3.5Å; I177-I180 PolarHBondContact O-N 3.35Å; I177-I180 VanDerWaalsContact O-N 3.1Å; N178-I180 VanDerWaalsContact C-N 3.31Å; N178-I180 PolarHBondContact O-N 3.02Å; I180-F183 PolarHBondContact O-N 2.99Å; I180-L184 HydrophobicContact CG2-CD1 4.04Å; I180-L184 HydrophobicContact CG2-CG 4.42Å; I180-L184 VanDerWaalsContact O-CG 3.31Å; I180-L184 WeakPolarHBondContact O-CG 3.3Å; I180-L184 PolarHBondContact O-N 3.29Å
181Q91.2Very high85Confident97 Ų97112.1 Ų112.145%0.45355%0.55SS.*Hα-helixtrans-61.1-49.9176.8-176.2177.6-23.900111.2I177 N178 F183 L184 E185I177-Q181 PolarHBondContact O-N 2.89Å; N178-Q181 WeakPolarHBondContact O-CB 3.28Å; N178-Q181 PolarHBondContact O-N 3.37Å; N178-Q181 VanDerWaalsContact O-N 3.16Å; Q181-F183 VanDerWaalsContact C-N 3.25Å; Q181-F183 PolarHBondContact O-N 3.09Å; Q181-L184 PolarHBondContact O-N 3.47Å; Q181-L184 VanDerWaalsContact O-N 3.09Å; Q181-E185 PolarHBondContact NE2-OE1 3.31Å; Q181-E185 PolarHBondContact O-N 2.9Å
182D92.1Very high85.1Confident99 Ų99113.7 Ų113.753%0.52956%0.556SS.*Hα-helixtrans-57.1-40.7176.5-67.2-18.4000111.4N178 E185 S186N178-D182 VanDerWaalsContact O-CG 3.29Å; N178-D182 PolarHBondContact O-N 2.87Å; D182-E185 PolarHBondContact O-N 3.49Å; D182-S186 VanDerWaalsContact O-CB 3.3Å; D182-S186 WeakPolarHBondContact O-CB 3.43Å; D182-S186 PolarHBondContact O-N 3.32Å; D182-S186 PolarHBondContact O-OG 3.26Å
183F91.8Very high85.1Confident125 Ų125115.4 Ų115.455%0.54857%0.566SS.*Hα-helixtrans-63.8-44.8176.2179.7-98000112K179 I180 Q181 S186 K187K179-F183 VanDerWaalsContact O-CB 3.32Å; K179-F183 WeakPolarHBondContact O-CB 3.47Å; K179-F183 PolarHBondContact O-N 3.38Å; I180-F183 PolarHBondContact O-N 2.99Å; Q181-F183 VanDerWaalsContact C-N 3.25Å; Q181-F183 PolarHBondContact O-N 3.09Å; F183-S186 PolarHBondContact O-N 2.97Å; F183-S186 PolarHBondContact O-OG 3.26Å; F183-K187 HydrophobicContact CE1-CG 4.23Å; F183-K187 HydrophobicContact CZ-CG 4.27Å; F183-K187 PolarHBondContact O-N 2.97Å; F183-K187 VanDerWaalsContact O-N 3.11Å
184L91.6Very high85Confident107 Ų107116.1 Ų116.156%0.5657%0.57SS**Hα-helixtrans-63-44.3176.8-71171.1000111.6I180 Q181 K187 L188I180-L184 HydrophobicContact CG2-CD1 4.04Å; I180-L184 HydrophobicContact CG2-CG 4.42Å; I180-L184 VanDerWaalsContact O-CG 3.31Å; I180-L184 WeakPolarHBondContact O-CG 3.3Å; I180-L184 PolarHBondContact O-N 3.29Å; Q181-L184 PolarHBondContact O-N 3.47Å; Q181-L184 VanDerWaalsContact O-N 3.09Å; L184-K187 WeakPolarHBondContact O-CB 3.48Å; L184-K187 PolarHBondContact O-N 3.49Å; L184-L188 WeakPolarHBondContact O-CB 3.26Å; L184-L188 PolarHBondContact O-N 3.44Å
185E91.3Very high85Confident92 Ų92116.9 Ų116.943%0.4358%0.576SS.*Hα-helixtrans-63.7-40.7176.2-71.8-178.4-163.200111.7Q181 D182 K187 L188 N189Q181-E185 PolarHBondContact NE2-OE1 3.31Å; Q181-E185 PolarHBondContact O-N 2.9Å; D182-E185 PolarHBondContact O-N 3.49Å; E185-K187 VanDerWaalsContact C-N 3.25Å; E185-K187 PolarHBondContact O-N 3.4Å; E185-L188 PolarHBondContact O-N 3.5Å; E185-N189 WeakPolarHBondContact O-CB 3.43Å; E185-N189 PolarHBondContact O-N 3.45Å; E185-N189 PolarHBondContact O-ND2 3.21Å
186S89.8Confident84.9Confident64 Ų64118.1 Ų118.145%0.44858%0.583SS.*Hα-helixtrans-65.5-27.4177.179.70000113.9D182 F183D182-S186 VanDerWaalsContact O-CB 3.3Å; D182-S186 WeakPolarHBondContact O-CB 3.43Å; D182-S186 PolarHBondContact O-N 3.32Å; D182-S186 PolarHBondContact O-OG 3.26Å; F183-S186 PolarHBondContact O-N 2.97Å; F183-S186 PolarHBondContact O-OG 3.26Å
187K86.4Confident84.5Confident135 Ų135118.6 Ų118.659%0.58759%0.59SS**Hα-helixtrans-78.6-41.3174.4-89.2-86.8-174.4174.60111.3F183 L184 E185 K190F183-K187 HydrophobicContact CE1-CG 4.23Å; F183-K187 HydrophobicContact CZ-CG 4.27Å; F183-K187 PolarHBondContact O-N 2.97Å; F183-K187 VanDerWaalsContact O-N 3.11Å; L184-K187 WeakPolarHBondContact O-CB 3.48Å; L184-K187 PolarHBondContact O-N 3.49Å; E185-K187 VanDerWaalsContact C-N 3.25Å; E185-K187 PolarHBondContact O-N 3.4Å; K187-K190 PolarHBondContact O-N 3.12Å
188L84.7Confident84.2Confident132 Ų132119.9 Ų119.969%0.69160%0.595SS**Hα-helixtrans-69.8-35.7-179.2-154.589.7000112.7L184 E185 K190L184-L188 WeakPolarHBondContact O-CB 3.26Å; L184-L188 PolarHBondContact O-N 3.44Å; E185-L188 PolarHBondContact O-N 3.5Å; L188-K190 PolarHBondContact O-N 3.35Å
189N78.5Confident83.8Confident131 Ų131123.5 Ų123.570%0.70161%0.611SS**THydrogen-bonded Turntrans-81.75178.9-68.4-25000113.9E185E185-N189 WeakPolarHBondContact O-CB 3.43Å; E185-N189 PolarHBondContact O-N 3.45Å; E185-N189 PolarHBondContact O-ND2 3.21Å
190K60.8Low83.2Confident183 Ų183122.8 Ų122.880%0.79661%0.614SS**THydrogen-bonded Turntrans-104.5-4179.8-110.7-178.4-179.7176.70114K187 L188K187-K190 PolarHBondContact O-N 3.12Å; L188-K190 PolarHBondContact O-N 3.35Å
191D49.5Very low82.5Confident205 Ų205124.5 Ų124.5100%1.09662%0.622SS**  trans-102.90169.4-65.7-29.9000109.8

Retrieved 191 of 191 residues in 1336.9 ms (Link to these results)

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