A0A077Z087_TRITR Loading...

Elongation of very long chain fatty acids protein

AlphaFold DB , UniProt , Accession A0A077Z087, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 278 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
1M32Very low57Low245 Ų245103.7 Ų103.7100%1.20761%0.607SS**  090.10-74.5-175.5-85.800107.9A3M1-A3 PolarHBondContact O-N 2.64Å
2A27.6Very low59.3Low97 Ų97101.9 Ų101.980%0.80260%0.598SS**  trans-69.4117.1167.500000106.2M4A2-M4 PolarHBondContact O-N 2.85Å
3A34.6Very low61.3Low80 Ų8097 Ų9766%0.66157%0.569SS**  trans-52.2118.8164.800000105.9M1 T5M1-A3 PolarHBondContact O-N 2.64Å; A3-T5 PolarHBondContact O-N 3.34Å
4M43.1Very low63.2Low145 Ų14595.5 Ų95.571%0.71455%0.553SS**  trans-62.592.7172.5-77.8176.399.800106.4A2A2-M4 PolarHBondContact O-N 2.85Å
5T52.9Low64.7Low120 Ų12095.3 Ų95.374%0.73656%0.556SS**  trans-61.7142.5179.143.10000108.3A3 L7A3-T5 PolarHBondContact O-N 3.34Å; T5-L7 PolarHBondContact O-N 3.07Å
6S58.6Low66.1Low29 Ų2995.4 Ų95.420%0.20355%0.547CS..  trans-47.2136.3175.352.90000110.3V8S6-V8 PolarHBondContact O-N 3.19Å; S6-V8 PolarHBondContact OG-O 3.21Å
7L65.6Low67.4Low67 Ų6789.9 Ų89.935%0.35152%0.516SS..SBendtrans-55.5-23.6179.3-78.4161.8000113T5 F95 Y99 S105T5-L7 PolarHBondContact O-N 3.07Å; L7-F95 HydrophobicContact CD2-CE2 4.17Å; L7-F95 HydrophobicContact CD2-CZ 3.99Å; L7-Y99 HydrophobicContact CD1-CE1 4.31Å; L7-Y99 WeakPolarHBondContact CD1-OH 2.97Å; L7-S105 VanDerWaalsContact CD1-CB 3.47Å; L7-S105 VanDerWaalsContact CD1-OG 3.23Å; L7-S105 WeakPolarHBondContact CD1-OG 3.32Å
8V76.2Confident68.2Low19 Ų1995.1 Ų95.112%0.11553%0.526CS..SBendtrans-106.2136-179.3-179.10000110.9S6 Y10 P86 E87 H90S6-V8 PolarHBondContact O-N 3.19Å; S6-V8 PolarHBondContact OG-O 3.21Å; V8-Y10 HydrophobicContact CB-CD2 4.39Å; V8-Y10 HydrophobicContact CB-CE2 4.09Å; V8-Y10 HydrophobicContact CG1-CD2 4.48Å; V8-Y10 HydrophobicContact CG1-CE2 4.46Å; V8-Y10 WeakPolarHBondContact O-CD2 3.43Å; V8-Y10 PolarHBondContact O-N 2.83Å; V8-P86 HydrophobicContact CG1-CB 4.07Å; V8-E87 HydrophobicContact CG2-CB 4.22Å; V8-H90 HydrophobicContact CG2-CB 3.52Å
9N76.3Confident69.1Low163 Ų16396.1 Ų96.187%0.87254%0.535SS*.  trans-77.997.7165.3-82.1-16.5000109.7
10Y81Confident70Confident29 Ų2992.6 Ų92.611%0.11451%0.514CS..  trans-70.8131.6173.9-75.9-93000110.8V8 V12 R83 P86 V110 T111V8-Y10 HydrophobicContact CB-CD2 4.39Å; V8-Y10 HydrophobicContact CB-CE2 4.09Å; V8-Y10 HydrophobicContact CG1-CD2 4.48Å; V8-Y10 HydrophobicContact CG1-CE2 4.46Å; V8-Y10 WeakPolarHBondContact O-CD2 3.43Å; V8-Y10 PolarHBondContact O-N 2.83Å; Y10-V12 VanDerWaalsContact C-N 3.29Å; Y10-V12 PolarHBondContact O-N 3.24Å; Y10-R83 VanDerWaalsContact CE1-O 3.3Å; Y10-R83 WeakPolarHBondContact CE1-O 3.25Å; Y10-R83 PolarHBondContact OH-O 2.98Å; Y10-P86 HydrophobicContact CE1-CB 4.24Å; Y10-P86 HydrophobicContact CE1-CG 4.08Å; Y10-V110 HydrophobicContact CD1-CG1 4.27Å; Y10-V110 HydrophobicContact CD1-CG2 4.47Å; Y10-V110 HydrophobicContact CD2-CB 4.08Å; Y10-V110 HydrophobicContact CD2-CG2 3.8Å; Y10-V110 HydrophobicContact CE1-CB 4.25Å; Y10-V110 HydrophobicContact CE1-CG1 3.81Å; Y10-V110 HydrophobicContact CE2-CB 3.71Å; Y10-V110 HydrophobicContact CE2-CG1 4.19Å; Y10-V110 HydrophobicContact CE2-CG2 3.98Å; Y10-V110 HydrophobicContact CG-CG2 4.07Å; Y10-T111 WeakPolarHBondContact OH-CG2 3.36Å
11T79.4Confident70.8Confident147 Ų14792.1 Ų92.190%0.90251%0.511SS*.SBendtrans-63.7-34.2177.145.60000112.9
12V84Confident73.3Confident82 Ų8281.7 Ų81.750%0.49746%0.461SS..  trans-130.6128175.1-178.40000108.3Y10 F14 R83Y10-V12 VanDerWaalsContact C-N 3.29Å; Y10-V12 PolarHBondContact O-N 3.24Å; V12-F14 HydrophobicContact CG1-CE1 4.48Å; V12-R83 VanDerWaalsContact O-CZ 3.24Å; V12-R83 PolarHBondContact O-NH1 3Å; V12-R83 PolarHBondContact O-NH2 3.44Å
13V85.9Confident76.3Confident38 Ų3882.4 Ų82.423%0.2345%0.451CS..  trans-125.7118.1172.4-170.50000108.9E17 R18 V110V13-E17 HydrophobicContact CG1-CB 3.96Å; V13-R18 HydrophobicContact CB-CG 4.16Å; V13-R18 HydrophobicContact CG1-CG 3.45Å; V13-R18 VanDerWaalsContact CG1-CG 3.45Å; V13-R18 PolarHBondContact O-NE 3.44Å; V13-R18 PolarHBondContact O-NH2 2.92Å; V13-V110 HydrophobicContact CG1-CG2 3.85Å; V13-V110 HydrophobicContact CG2-CG2 4.3Å
14F87Confident79Confident76 Ų7682 Ų8233%0.33344%0.442SS..  trans-70.4152.9179.7-65.1-68.6000111.1V12 F16 E17 R18V12-F14 HydrophobicContact CG1-CE1 4.48Å; F14-F16 VanDerWaalsContact C-N 3.3Å; F14-F16 HydrophobicContact CB-CD1 3.81Å; F14-F16 HydrophobicContact CB-CD2 4.46Å; F14-F16 HydrophobicContact CB-CE1 3.36Å; F14-F16 HydrophobicContact CB-CE2 4.07Å; F14-F16 HydrophobicContact CB-CG 4.34Å; F14-F16 HydrophobicContact CB-CZ 3.49Å; F14-F16 VanDerWaalsContact CB-CZ 3.49Å; F14-F16 HydrophobicContact CD1-CE1 4.36Å; F14-F16 HydrophobicContact CD2-CE1 4.24Å; F14-F16 HydrophobicContact CD2-CE2 4.46Å; F14-F16 AromaticContact CD2-CZ 3.72Å; F14-F16 HydrophobicContact CD2-CZ 3.72Å; F14-F16 AromaticContact CG-CE1 3.76Å; F14-F16 HydrophobicContact CG-CE1 3.76Å; F14-F16 AromaticContact CG-CZ 3.71Å; F14-F16 HydrophobicContact CG-CZ 3.71Å; F14-F16 PolarHBondContact O-N 2.87Å; F14-E17 HydrophobicContact CB-CG 4.15Å; F14-E17 WeakPolarHBondContact CD2-OE2 3.38Å; F14-E17 PolarHBondContact N-OE2 2.89Å; F14-E17 PolarHBondContact O-N 2.99Å; F14-E17 VanDerWaalsContact O-N 3.08Å; F14-R18 PolarHBondContact O-N 2.93Å; F14-R18 VanDerWaalsContact O-N 3.13Å
15P86.4Confident81.2Confident92 Ų9275.5 Ų75.560%0.59741%0.41SS*.Hα-helixtrans-54.9-43.9-178.7-27.135.2000113.2E17 R18 T19P15-E17 VanDerWaalsContact C-N 3.28Å; P15-E17 PolarHBondContact O-N 3.15Å; P15-R18 PolarHBondContact O-N 3.44Å; P15-R18 VanDerWaalsContact O-N 3.15Å; P15-T19 PolarHBondContact O-N 2.93Å; P15-T19 VanDerWaalsContact O-N 3.11Å; P15-T19 PolarHBondContact O-OG1 3.44Å
16F86.7Confident83Confident97 Ų9770.4 Ų70.443%0.42538%0.379SS..Hα-helixtrans-65.1-28.8179.858.4-99000113.4F14 T19 F113F14-F16 VanDerWaalsContact C-N 3.3Å; F14-F16 HydrophobicContact CB-CD1 3.81Å; F14-F16 HydrophobicContact CB-CD2 4.46Å; F14-F16 HydrophobicContact CB-CE1 3.36Å; F14-F16 HydrophobicContact CB-CE2 4.07Å; F14-F16 HydrophobicContact CB-CG 4.34Å; F14-F16 HydrophobicContact CB-CZ 3.49Å; F14-F16 VanDerWaalsContact CB-CZ 3.49Å; F14-F16 HydrophobicContact CD1-CE1 4.36Å; F14-F16 HydrophobicContact CD2-CE1 4.24Å; F14-F16 HydrophobicContact CD2-CE2 4.46Å; F14-F16 AromaticContact CD2-CZ 3.72Å; F14-F16 HydrophobicContact CD2-CZ 3.72Å; F14-F16 AromaticContact CG-CE1 3.76Å; F14-F16 HydrophobicContact CG-CE1 3.76Å; F14-F16 AromaticContact CG-CZ 3.71Å; F14-F16 HydrophobicContact CG-CZ 3.71Å; F14-F16 PolarHBondContact O-N 2.87Å; F16-T19 WeakPolarHBondContact CA-OG1 3.32Å; F16-T19 PolarHBondContact O-OG1 3.35Å; F16-T19 VanDerWaalsContact O-OG1 3.09Å; F16-F113 HydrophobicContact CD2-CD1 4.25Å; F16-F113 AromaticContact CD2-CE1 3.62Å; F16-F113 HydrophobicContact CD2-CE1 3.62Å; F16-F113 HydrophobicContact CD2-CE2 4.17Å; F16-F113 AromaticContact CD2-CZ 3.58Å; F16-F113 HydrophobicContact CD2-CZ 3.58Å; F16-F113 HydrophobicContact CE2-CD1 4.29Å; F16-F113 AromaticContact CE2-CE1 3.63Å; F16-F113 HydrophobicContact CE2-CE1 3.63Å; F16-F113 HydrophobicContact CE2-CZ 4.01Å
17E88.5Confident84.7Confident3 Ų373 Ų731%0.01439%0.39CS..Hα-helixtrans-77-32.9175.4-58.7171.2140.500111.3V13 F14 P15 F20 R83 V110 F113 W114V13-E17 HydrophobicContact CG1-CB 3.96Å; F14-E17 HydrophobicContact CB-CG 4.15Å; F14-E17 WeakPolarHBondContact CD2-OE2 3.38Å; F14-E17 PolarHBondContact N-OE2 2.89Å; F14-E17 PolarHBondContact O-N 2.99Å; F14-E17 VanDerWaalsContact O-N 3.08Å; P15-E17 VanDerWaalsContact C-N 3.28Å; P15-E17 PolarHBondContact O-N 3.15Å; E17-F20 WeakPolarHBondContact O-CB 3.17Å; E17-F20 PolarHBondContact O-N 3.49Å; E17-R83 VanDerWaalsContact CD-NH2 3.33Å; E17-R83 IonicContact OE1-CZ 3.65Å; E17-R83 IonicContact OE1-NE 3.96Å; E17-R83 PolarHBondContact OE1-NE 3.48Å; E17-R83 IonicContact OE1-NH2 2.82Å; E17-R83 PolarHBondContact OE1-NH2 2.74Å; E17-R83 IonicContact OE2-CZ 3.74Å; E17-R83 IonicContact OE2-NE 3.35Å; E17-R83 IonicContact OE2-NH2 3.07Å; E17-R83 PolarHBondContact OE2-NH2 3.45Å; E17-V110 HydrophobicContact CB-CG2 4.23Å; E17-F113 HydrophobicContact CG-CD1 4.13Å; E17-W114 PolarHBondContact OE1-NE1 3.36Å
18R82.6Confident86Confident183 Ų18375 Ų7569%0.69139%0.392SS*.Hα-helixtrans-69.6-35.6175.9-68-173.2-1391774.9112.3V13 F14 P15 F20V13-R18 HydrophobicContact CB-CG 4.16Å; V13-R18 HydrophobicContact CG1-CG 3.45Å; V13-R18 VanDerWaalsContact CG1-CG 3.45Å; V13-R18 PolarHBondContact O-NE 3.44Å; V13-R18 PolarHBondContact O-NH2 2.92Å; F14-R18 PolarHBondContact O-N 2.93Å; F14-R18 VanDerWaalsContact O-N 3.13Å; P15-R18 PolarHBondContact O-N 3.44Å; P15-R18 VanDerWaalsContact O-N 3.15Å; R18-F20 PolarHBondContact O-N 2.98Å
19T84.7Confident86.9Confident113 Ų11374.1 Ų74.169%0.69339%0.387SS*.THydrogen-bonded Turntrans-79.5-3.9179.653.20000113P15 F16 D21P15-T19 PolarHBondContact O-N 2.93Å; P15-T19 VanDerWaalsContact O-N 3.11Å; P15-T19 PolarHBondContact O-OG1 3.44Å; F16-T19 WeakPolarHBondContact CA-OG1 3.32Å; F16-T19 PolarHBondContact O-OG1 3.35Å; F16-T19 VanDerWaalsContact O-OG1 3.09Å; T19-D21 PolarHBondContact O-N 3.46Å
20F87.5Confident87.6Confident26 Ų2672.2 Ų72.211%0.11437%0.371CS..  trans-68.6116.4178.7175.1-102.7000110.8E17 R18 P22 G109 G112 F113 Q116E17-F20 WeakPolarHBondContact O-CB 3.17Å; E17-F20 PolarHBondContact O-N 3.49Å; R18-F20 PolarHBondContact O-N 2.98Å; F20-P22 HydrophobicContact CE1-CB 3.94Å; F20-P22 HydrophobicContact CZ-CB 4.26Å; F20-G109 WeakPolarHBondContact CD1-O 2.73Å; F20-G112 VanDerWaalsContact CZ-C 3.41Å; F20-G112 WeakPolarHBondContact CZ-O 3.38Å; F20-F113 HydrophobicContact CB-CB 3.88Å; F20-F113 HydrophobicContact CB-CD2 4.12Å; F20-F113 HydrophobicContact CB-CG 4.43Å; F20-F113 HydrophobicContact CD1-CB 4.05Å; F20-F113 HydrophobicContact CD2-CB 3.95Å; F20-F113 AromaticContact CD2-CD2 3.89Å; F20-F113 HydrophobicContact CD2-CD2 3.89Å; F20-F113 HydrophobicContact CD2-CG 4.43Å; F20-F113 VanDerWaalsContact CE1-N 3.3Å; F20-F113 HydrophobicContact CG-CB 3.67Å; F20-F113 HydrophobicContact CG-CD2 4.2Å; F20-F113 HydrophobicContact CG-CG 4.45Å; F20-Q116 HydrophobicContact CE2-CB 4.1Å; F20-Q116 VanDerWaalsContact CE2-OE1 3.25Å; F20-Q116 HydrophobicContact CZ-CB 4.48Å
21D86Confident88.2Confident84 Ų8477.8 Ų77.845%0.44940%0.398SS..  trans-103.5117.4169.4-173.9-10.4000109.6T19 L23 P24T19-D21 PolarHBondContact O-N 3.46Å; D21-L23 PolarHBondContact O-N 2.86Å; D21-L23 PolarHBondContact OD1-N 2.96Å; D21-P24 HydrophobicContact CB-CG 4.09Å; D21-P24 WeakPolarHBondContact OD1-CD 3.34Å; D21-P24 VanDerWaalsContact OD2-CD 3.27Å; D21-P24 WeakPolarHBondContact OD2-CD 3.47Å
22P85.8Confident88.9Confident25 Ų2572.5 Ų72.516%0.16236%0.364CS..Hα-helixtrans-64.3-26.1178.625.7-34000113F20 T26F20-P22 HydrophobicContact CE1-CB 3.94Å; F20-P22 HydrophobicContact CZ-CB 4.26Å; P22-T26 WeakPolarHBondContact O-CB 3.3Å; P22-T26 PolarHBondContact O-N 3.3Å; P22-T26 PolarHBondContact O-OG1 3.3Å
23L89.1Confident89.3Confident113 Ų11372.2 Ų72.259%0.59235%0.354SS*.Hα-helixtrans-69.8-54.9-173.4179.974.5000112.5D21 S25 T26 I27D21-L23 PolarHBondContact O-N 2.86Å; D21-L23 PolarHBondContact OD1-N 2.96Å; L23-S25 VanDerWaalsContact C-N 3.26Å; L23-S25 PolarHBondContact O-N 3.43Å; L23-T26 PolarHBondContact O-N 3.15Å; L23-I27 HydrophobicContact CD1-CD1 4.28Å; L23-I27 HydrophobicContact CG-CD1 4.07Å; L23-I27 WeakPolarHBondContact O-CG1 3.43Å; L23-I27 PolarHBondContact O-N 3.04Å
24P91Very high89.7Confident72 Ų7272.6 Ų72.647%0.46836%0.361SS..Hα-helixtrans-57.3-40.1173.2-24.233.4000112.5D21 T26 I27 W28D21-P24 HydrophobicContact CB-CG 4.09Å; D21-P24 WeakPolarHBondContact OD1-CD 3.34Å; D21-P24 VanDerWaalsContact OD2-CD 3.27Å; D21-P24 WeakPolarHBondContact OD2-CD 3.47Å; P24-T26 VanDerWaalsContact C-N 3.33Å; P24-T26 PolarHBondContact O-N 3.39Å; P24-I27 PolarHBondContact O-N 3.1Å; P24-W28 WeakPolarHBondContact O-CB 3.34Å; P24-W28 PolarHBondContact O-N 3.26Å
25S91.1Very high90.1Very high7 Ų773.6 Ų73.65%0.04937%0.367CS..Hα-helixtrans-59.5-44.2177.4-177.90000112L23 M29 Q116 Y158L23-S25 VanDerWaalsContact C-N 3.26Å; L23-S25 PolarHBondContact O-N 3.43Å; S25-M29 PolarHBondContact O-N 3.25Å; S25-Q116 WeakPolarHBondContact OG-CG 3.41Å; S25-Q116 PolarHBondContact OG-NE2 3.26Å; S25-Y158 PolarHBondContact OG-OH 2.88Å
26T90.7Very high90.6Very high14 Ų1469.2 Ų69.29%0.08634%0.338CS..Hα-helixtrans-66.3-45.8178.1-56.70000111.7P22 L23 P24 W28 M29 K30 H161P22-T26 WeakPolarHBondContact O-CB 3.3Å; P22-T26 PolarHBondContact O-N 3.3Å; P22-T26 PolarHBondContact O-OG1 3.3Å; L23-T26 PolarHBondContact O-N 3.15Å; P24-T26 VanDerWaalsContact C-N 3.33Å; P24-T26 PolarHBondContact O-N 3.39Å; T26-W28 VanDerWaalsContact C-N 3.32Å; T26-W28 PolarHBondContact O-N 2.97Å; T26-M29 PolarHBondContact O-N 3.45Å; T26-K30 HydrophobicContact CG2-CD 4.33Å; T26-K30 WeakPolarHBondContact O-CG 3.47Å; T26-K30 PolarHBondContact O-N 2.71Å; T26-H161 WeakPolarHBondContact CG2-NE2 3.39Å; T26-H161 PolarHBondContact OG1-CE1 2.84Å; T26-H161 PolarHBondContact OG1-NE2 2.79Å
27I92.9Very high91.1Very high83 Ų8368.8 Ų68.843%0.42634%0.34SS..Hα-helixtrans-60.1-47.6178.5-68.8167.8000109.4L23 P24 M29 K30 H31L23-I27 HydrophobicContact CD1-CD1 4.28Å; L23-I27 HydrophobicContact CG-CD1 4.07Å; L23-I27 WeakPolarHBondContact O-CG1 3.43Å; L23-I27 PolarHBondContact O-N 3.04Å; P24-I27 PolarHBondContact O-N 3.1Å; I27-M29 VanDerWaalsContact C-N 3.34Å; I27-M29 PolarHBondContact O-N 3.02Å; I27-K30 PolarHBondContact O-N 2.89Å; I27-H31 PolarHBondContact O-CD2 3.09Å; I27-H31 PolarHBondContact O-N 3.15Å; I27-H31 VanDerWaalsContact O-N 3.11Å
28W94.3Very high91.5Very high109 Ų10972.3 Ų72.341%0.41336%0.362SS..Hα-helixtrans-57.5-47.5176.7-17689.4000111.3P24 T26 K30 H31 N32 L120 W155P24-W28 WeakPolarHBondContact O-CB 3.34Å; P24-W28 PolarHBondContact O-N 3.26Å; T26-W28 VanDerWaalsContact C-N 3.32Å; T26-W28 PolarHBondContact O-N 2.97Å; W28-K30 PolarHBondContact O-N 3.4Å; W28-H31 PolarHBondContact O-N 3.2Å; W28-N32 HydrophobicContact CD2-CB 4.2Å; W28-N32 HydrophobicContact CE3-CB 4.34Å; W28-N32 HydrophobicContact CH2-CB 4.12Å; W28-N32 HydrophobicContact CZ2-CB 3.97Å; W28-N32 HydrophobicContact CZ3-CB 4.3Å; W28-N32 PolarHBondContact NE1-ND2 3.25Å; W28-N32 VanDerWaalsContact O-CB 3.29Å; W28-N32 WeakPolarHBondContact O-CB 3.29Å; W28-N32 PolarHBondContact O-N 3.35Å; W28-N32 PolarHBondContact O-ND2 3.41Å; W28-L120 HydrophobicContact CH2-CD2 4.01Å; W28-L120 HydrophobicContact CZ3-CD2 3.93Å; W28-W155 HydrophobicContact CH2-CH2 4.21Å; W28-W155 HydrophobicContact CH2-CZ3 4.39Å
29M93.2Very high92.2Very high1 Ų166.5 Ų66.51%0.00534%0.344CS..Hα-helixtrans-63.6-40.1178.2-168.665.268.300112S25 T26 I27 H31 N32 W33 A119 W155 Y158 K159S25-M29 PolarHBondContact O-N 3.25Å; T26-M29 PolarHBondContact O-N 3.45Å; I27-M29 VanDerWaalsContact C-N 3.34Å; I27-M29 PolarHBondContact O-N 3.02Å; M29-H31 VanDerWaalsContact C-N 3.25Å; M29-H31 PolarHBondContact O-N 3.46Å; M29-N32 PolarHBondContact O-N 2.74Å; M29-W33 HydrophobicContact CG-CB 4.4Å; M29-W33 WeakPolarHBondContact O-CA 3.21Å; M29-W33 VanDerWaalsContact O-CB 3.27Å; M29-W33 WeakPolarHBondContact O-CB 3.29Å; M29-W33 PolarHBondContact O-N 3.28Å; M29-W33 HydrophobicContact SD-CB 4.32Å; M29-A119 HydrophobicContact CE-CB 4.03Å; M29-W155 HydrophobicContact SD-CB 4.02Å; M29-W155 HydrophobicContact SD-CD2 4.04Å; M29-W155 HydrophobicContact SD-CE3 4.08Å; M29-W155 HydrophobicContact SD-CG 4.06Å; M29-Y158 HydrophobicContact CB-CD1 3.6Å; M29-Y158 HydrophobicContact CB-CE1 3.99Å; M29-Y158 HydrophobicContact CE-CD1 3.92Å; M29-Y158 HydrophobicContact CE-CE1 4.4Å; M29-Y158 HydrophobicContact CE-CG 4.19Å; M29-Y158 HydrophobicContact CG-CD1 3.56Å; M29-Y158 HydrophobicContact CG-CE1 4.41Å; M29-Y158 HydrophobicContact CG-CG 4.26Å; M29-K159 HydrophobicContact CG-CB 4.14Å
30K91.9Very high92.8Very high122 Ų12261.5 Ų61.553%0.5331%0.313SS..Hα-helixtrans-59.9-34.6177.1-78-178.2176-176.30113.1T26 I27 W28 W33 K159T26-K30 HydrophobicContact CG2-CD 4.33Å; T26-K30 WeakPolarHBondContact O-CG 3.47Å; T26-K30 PolarHBondContact O-N 2.71Å; I27-K30 PolarHBondContact O-N 2.89Å; W28-K30 PolarHBondContact O-N 3.4Å; K30-W33 VanDerWaalsContact O-CD1 3.28Å; K30-K159 WeakPolarHBondContact CE-O 3.49Å; K30-K159 HydrophobicContact CG-CB 4.13Å
31H93.6Very high93.2Very high147 Ų14762.9 Ų62.968%0.68133%0.329SS*.Hα-helixtrans-82-32.2176-73.8-70.5000113.3I27 W28 M29I27-H31 PolarHBondContact O-CD2 3.09Å; I27-H31 PolarHBondContact O-N 3.15Å; I27-H31 VanDerWaalsContact O-N 3.11Å; W28-H31 PolarHBondContact O-N 3.2Å; M29-H31 VanDerWaalsContact C-N 3.25Å; M29-H31 PolarHBondContact O-N 3.46Å
32N94.5Very high93.7Very high36 Ų3663.6 Ų63.619%0.19333%0.333CS..Hα-helixtrans-106.7-6.1-168.1-68.2-82.8000114.4W28 M29 A34 H35W28-N32 HydrophobicContact CD2-CB 4.2Å; W28-N32 HydrophobicContact CE3-CB 4.34Å; W28-N32 HydrophobicContact CH2-CB 4.12Å; W28-N32 HydrophobicContact CZ2-CB 3.97Å; W28-N32 HydrophobicContact CZ3-CB 4.3Å; W28-N32 PolarHBondContact NE1-ND2 3.25Å; W28-N32 VanDerWaalsContact O-CB 3.29Å; W28-N32 WeakPolarHBondContact O-CB 3.29Å; W28-N32 PolarHBondContact O-N 3.35Å; W28-N32 PolarHBondContact O-ND2 3.41Å; M29-N32 PolarHBondContact O-N 2.74Å; N32-A34 PolarHBondContact O-N 2.96Å; N32-A34 VanDerWaalsContact O-N 3.11Å; N32-H35 VanDerWaalsContact O-CB 3.28Å; N32-H35 WeakPolarHBondContact O-CB 3.23Å; N32-H35 PolarHBondContact O-CD2 3.21Å; N32-H35 PolarHBondContact O-N 2.99Å; N32-H35 PolarHBondContact OD1-CD2 2.9Å; N32-H35 PolarHBondContact OD1-NE2 2.94Å
33W93.2Very high94.3Very high75 Ų7563 Ų6328%0.28433%0.327SS..THydrogen-bonded Turntrans-56.5-35.8-174.875.8-85.9000112M29 K30 H35 S36 I37 W155 H156 K159M29-W33 HydrophobicContact CG-CB 4.4Å; M29-W33 WeakPolarHBondContact O-CA 3.21Å; M29-W33 VanDerWaalsContact O-CB 3.27Å; M29-W33 WeakPolarHBondContact O-CB 3.29Å; M29-W33 PolarHBondContact O-N 3.28Å; M29-W33 HydrophobicContact SD-CB 4.32Å; K30-W33 VanDerWaalsContact O-CD1 3.28Å; W33-H35 PolarHBondContact O-N 3.25Å; W33-H35 VanDerWaalsContact O-N 3.14Å; W33-S36 WeakPolarHBondContact O-CB 3.22Å; W33-S36 PolarHBondContact O-N 3.06Å; W33-S36 PolarHBondContact O-OG 2.75Å; W33-I37 HydrophobicContact CH2-CD1 4.46Å; W33-I37 HydrophobicContact CZ3-CD1 4.11Å; W33-W155 HydrophobicContact CB-CB 4.29Å; W33-H156 HydrophobicContact CE3-CB 4.31Å; W33-H156 AromaticContact CZ3-CD2 3.96Å; W33-K159 HydrophobicContact CB-CD 4.43Å; W33-K159 HydrophobicContact CD2-CD 4.04Å; W33-K159 HydrophobicContact CG-CD 3.77Å
34A94.3Very high94.7Very high46 Ų4659.6 Ų59.638%0.3832%0.316SS..THydrogen-bonded Turntrans-62-21.8179.600000113.3N32 S36 I37 T38N32-A34 PolarHBondContact O-N 2.96Å; N32-A34 VanDerWaalsContact O-N 3.11Å; A34-S36 PolarHBondContact O-N 3.28Å; A34-I37 WeakPolarHBondContact O-CB 3.15Å; A34-I37 PolarHBondContact O-N 2.94Å; A34-T38 PolarHBondContact O-N 3.49Å
35H95.3Very high95Very high97 Ų9761.6 Ų61.645%0.44932%0.322SS..Hα-helixtrans-62.5-20.9172.2-67.6-53.5000112.6N32 W33 I37 T38 L39 W155N32-H35 VanDerWaalsContact O-CB 3.28Å; N32-H35 WeakPolarHBondContact O-CB 3.23Å; N32-H35 PolarHBondContact O-CD2 3.21Å; N32-H35 PolarHBondContact O-N 2.99Å; N32-H35 PolarHBondContact OD1-CD2 2.9Å; N32-H35 PolarHBondContact OD1-NE2 2.94Å; W33-H35 PolarHBondContact O-N 3.25Å; W33-H35 VanDerWaalsContact O-N 3.14Å; H35-I37 PolarHBondContact O-N 2.8Å; H35-T38 PolarHBondContact O-N 3.37Å; H35-L39 VanDerWaalsContact O-CB 3.31Å; H35-L39 WeakPolarHBondContact O-CB 3.45Å; H35-L39 VanDerWaalsContact O-CG 3.24Å; H35-L39 WeakPolarHBondContact O-CG 3.33Å; H35-L39 PolarHBondContact O-N 2.86Å; H35-W155 HydrophobicContact CB-CZ3 4.15Å
36S96.4Very high95.3Very high0 Ų064.9 Ų64.90%034%0.336CS..Hα-helixtrans-59-35171730000112W33 A34 S40 V152W33-S36 WeakPolarHBondContact O-CB 3.22Å; W33-S36 PolarHBondContact O-N 3.06Å; W33-S36 PolarHBondContact O-OG 2.75Å; A34-S36 PolarHBondContact O-N 3.28Å; S36-S40 VanDerWaalsContact O-CB 3.31Å; S36-S40 WeakPolarHBondContact O-CB 3.33Å; S36-S40 PolarHBondContact O-N 3.05Å; S36-S40 PolarHBondContact O-OG 3.13Å; S36-V152 WeakPolarHBondContact OG-CA 3.47Å
37I96.4Very high95.6Very high89 Ų8965 Ų6546%0.45634%0.335SS..Hα-helixtrans-72.3-47.1178.2-58174.8000109.5W33 A34 H35 L39 S40 A41 V152W33-I37 HydrophobicContact CH2-CD1 4.46Å; W33-I37 HydrophobicContact CZ3-CD1 4.11Å; A34-I37 WeakPolarHBondContact O-CB 3.15Å; A34-I37 PolarHBondContact O-N 2.94Å; H35-I37 PolarHBondContact O-N 2.8Å; I37-L39 PolarHBondContact O-N 3Å; I37-S40 WeakPolarHBondContact O-CB 3.24Å; I37-S40 PolarHBondContact O-N 3.21Å; I37-A41 PolarHBondContact O-N 3.47Å; I37-V152 HydrophobicContact CG1-CG1 4.27Å; I37-V152 HydrophobicContact CG1-CG2 4.29Å
38T96.6Very high95.7Very high77 Ų7765.6 Ų65.647%0.47234%0.336SS..Hα-helixtrans-59.8-46.4176.4-48.90000111.3A34 H35 S40 A41 L42A34-T38 PolarHBondContact O-N 3.49Å; H35-T38 PolarHBondContact O-N 3.37Å; T38-S40 VanDerWaalsContact C-N 3.3Å; T38-S40 PolarHBondContact O-N 2.91Å; T38-A41 PolarHBondContact O-N 3.28Å; T38-L42 HydrophobicContact CG2-CD1 4.36Å; T38-L42 WeakPolarHBondContact O-CG 3.32Å; T38-L42 PolarHBondContact O-N 2.88Å
39L97.2Very high95.8Very high60 Ų6065.9 Ų65.931%0.31434%0.342SS..Hα-helixtrans-60.9-39.2175.8-73172.9000111.8H35 I37 L42 Y43 A123 L151 W155H35-L39 VanDerWaalsContact O-CB 3.31Å; H35-L39 WeakPolarHBondContact O-CB 3.45Å; H35-L39 VanDerWaalsContact O-CG 3.24Å; H35-L39 WeakPolarHBondContact O-CG 3.33Å; H35-L39 PolarHBondContact O-N 2.86Å; I37-L39 PolarHBondContact O-N 3Å; L39-L42 PolarHBondContact O-N 3.43Å; L39-Y43 WeakPolarHBondContact O-CB 3.28Å; L39-Y43 PolarHBondContact O-N 3.29Å; L39-A123 HydrophobicContact CD1-CB 4.28Å; L39-L151 HydrophobicContact CB-CD2 4.05Å; L39-W155 HydrophobicContact CD1-CH2 4.28Å
40S97.3Very high96Very high8 Ų866.3 Ų66.36%0.05635%0.347CS..Hα-helixtrans-65.5-39.7176.2-64.10000112.8S36 I37 T38 Y43 A44S36-S40 VanDerWaalsContact O-CB 3.31Å; S36-S40 WeakPolarHBondContact O-CB 3.33Å; S36-S40 PolarHBondContact O-N 3.05Å; S36-S40 PolarHBondContact O-OG 3.13Å; I37-S40 WeakPolarHBondContact O-CB 3.24Å; I37-S40 PolarHBondContact O-N 3.21Å; T38-S40 VanDerWaalsContact C-N 3.3Å; T38-S40 PolarHBondContact O-N 2.91Å; S40-Y43 WeakPolarHBondContact O-CB 3.5Å; S40-Y43 PolarHBondContact O-N 2.9Å; S40-A44 PolarHBondContact O-N 2.89Å
41A97Very high96.2Very high55 Ų5564 Ų6446%0.45534%0.338SS..Hα-helixtrans-65.8-45.717500000111.4I37 T38 Y43 A44 L45I37-A41 PolarHBondContact O-N 3.47Å; T38-A41 PolarHBondContact O-N 3.28Å; A41-Y43 VanDerWaalsContact C-N 3.29Å; A41-Y43 PolarHBondContact O-N 3.16Å; A41-A44 PolarHBondContact O-N 2.85Å; A41-L45 WeakPolarHBondContact O-CG 3.23Å; A41-L45 PolarHBondContact O-N 3.44Å
42L97.3Very high96.3Very high100 Ų10063.6 Ų63.652%0.52433%0.331SS..Hα-helixtrans-60.8-39.2174.5-69.8175.3000111.8T38 L39 L45 F46T38-L42 HydrophobicContact CG2-CD1 4.36Å; T38-L42 WeakPolarHBondContact O-CG 3.32Å; T38-L42 PolarHBondContact O-N 2.88Å; L39-L42 PolarHBondContact O-N 3.43Å; L42-L45 PolarHBondContact O-N 2.84Å; L42-F46 WeakPolarHBondContact O-CB 3.3Å; L42-F46 PolarHBondContact O-N 3.4Å
43Y97.7Very high96.3Very high11 Ų1167.7 Ų67.74%0.04334%0.344CS..Hα-helixtrans-63.3-44.4175.5170.1-101000112.4L39 S40 A41 F46 I47 L126 T129 W144 H147 I148L39-Y43 WeakPolarHBondContact O-CB 3.28Å; L39-Y43 PolarHBondContact O-N 3.29Å; S40-Y43 WeakPolarHBondContact O-CB 3.5Å; S40-Y43 PolarHBondContact O-N 2.9Å; A41-Y43 VanDerWaalsContact C-N 3.29Å; A41-Y43 PolarHBondContact O-N 3.16Å; Y43-F46 WeakPolarHBondContact O-CB 3.45Å; Y43-F46 PolarHBondContact O-N 3.29Å; Y43-I47 HydrophobicContact CD1-CD1 4.02Å; Y43-I47 HydrophobicContact CE1-CD1 3.47Å; Y43-I47 VanDerWaalsContact CE1-CD1 3.47Å; Y43-I47 HydrophobicContact CE2-CD1 4.21Å; Y43-I47 WeakPolarHBondContact O-CG1 3.4Å; Y43-I47 PolarHBondContact O-N 3.36Å; Y43-L126 HydrophobicContact CD1-CD2 4.48Å; Y43-L126 HydrophobicContact CD2-CB 4.01Å; Y43-L126 HydrophobicContact CD2-CD1 4.18Å; Y43-L126 HydrophobicContact CD2-CD2 3.76Å; Y43-L126 HydrophobicContact CD2-CG 4.2Å; Y43-L126 HydrophobicContact CE2-CB 4.19Å; Y43-L126 HydrophobicContact CE2-CD2 3.81Å; Y43-L126 HydrophobicContact CG-CD1 4.39Å; Y43-L126 HydrophobicContact CG-CD2 4.08Å; Y43-T129 VanDerWaalsContact CE2-CB 3.49Å; Y43-T129 HydrophobicContact CE2-CG2 3.78Å; Y43-T129 VanDerWaalsContact CE2-OG1 3.27Å; Y43-T129 WeakPolarHBondContact CE2-OG1 3.36Å; Y43-T129 PolarHBondContact OH-OG1 3.35Å; Y43-W144 HydrophobicContact CE1-CB 4.06Å; Y43-H147 HydrophobicContact CE1-CB 4.25Å; Y43-I148 HydrophobicContact CD1-CD1 3.95Å; Y43-I148 HydrophobicContact CD1-CG1 3.56Å; Y43-I148 HydrophobicContact CE1-CD1 4.24Å; Y43-I148 HydrophobicContact CE1-CG1 3.8Å
44A96.9Very high96.4Very high42 Ų4264.4 Ų64.435%0.34733%0.331SS..Hα-helixtrans-63.1-42.8175.300000111.8S40 A41 F46 I47 H48 I148S40-A44 PolarHBondContact O-N 2.89Å; A41-A44 PolarHBondContact O-N 2.85Å; A44-F46 VanDerWaalsContact C-N 3.33Å; A44-F46 PolarHBondContact O-N 2.84Å; A44-I47 PolarHBondContact O-N 2.91Å; A44-H48 PolarHBondContact O-N 3.31Å; A44-H48 VanDerWaalsContact O-N 3.17Å; A44-I148 HydrophobicContact CB-CD1 4.32Å
45L97.3Very high96.4Very high114 Ų11468.3 Ų68.360%0.59734%0.342SS*.Hα-helixtrans-61.4-41.7173.4-71.2172.1000111.7A41 L42 H48 Q49A41-L45 WeakPolarHBondContact O-CG 3.23Å; A41-L45 PolarHBondContact O-N 3.44Å; L42-L45 PolarHBondContact O-N 2.84Å; L45-H48 PolarHBondContact O-N 3.01Å; L45-Q49 VanDerWaalsContact O-CB 3.28Å; L45-Q49 WeakPolarHBondContact O-CB 3.21Å; L45-Q49 PolarHBondContact O-N 3.46Å
46F97.3Very high96.3Very high77 Ų7773.1 Ų73.134%0.33836%0.361SS..Hα-helixtrans-61.1-43.7176.4168.9-93.7000111.9L42 Y43 A44 G50 V130 V133L42-F46 WeakPolarHBondContact O-CB 3.3Å; L42-F46 PolarHBondContact O-N 3.4Å; Y43-F46 WeakPolarHBondContact O-CB 3.45Å; Y43-F46 PolarHBondContact O-N 3.29Å; A44-F46 VanDerWaalsContact C-N 3.33Å; A44-F46 PolarHBondContact O-N 2.84Å; F46-G50 VanDerWaalsContact O-CA 3.24Å; F46-G50 WeakPolarHBondContact O-CA 3.27Å; F46-G50 PolarHBondContact O-N 3.32Å; F46-V130 HydrophobicContact CE1-CB 4.27Å; F46-V130 HydrophobicContact CE1-CG2 3.79Å; F46-V130 HydrophobicContact CE2-CG2 4.48Å; F46-V130 HydrophobicContact CZ-CB 4.05Å; F46-V130 HydrophobicContact CZ-CG1 4Å; F46-V130 HydrophobicContact CZ-CG2 3.73Å; F46-V133 HydrophobicContact CE1-CB 4.38Å; F46-V133 HydrophobicContact CE1-CG2 4.18Å
47I96.8Very high96.3Very high16 Ų1679.1 Ų79.18%0.08238%0.384CS..Hα-helixtrans-58.6-53.1176.7-68.6166.5000109.7Y43 A44 Q51 T129 V139 W144Y43-I47 HydrophobicContact CD1-CD1 4.02Å; Y43-I47 HydrophobicContact CE1-CD1 3.47Å; Y43-I47 VanDerWaalsContact CE1-CD1 3.47Å; Y43-I47 HydrophobicContact CE2-CD1 4.21Å; Y43-I47 WeakPolarHBondContact O-CG1 3.4Å; Y43-I47 PolarHBondContact O-N 3.36Å; A44-I47 PolarHBondContact O-N 2.91Å; I47-Q51 VanDerWaalsContact O-CB 3.32Å; I47-Q51 WeakPolarHBondContact O-CB 3.41Å; I47-Q51 VanDerWaalsContact O-CG 3.23Å; I47-Q51 WeakPolarHBondContact O-CG 3.5Å; I47-Q51 PolarHBondContact O-N 2.75Å; I47-T129 HydrophobicContact CD1-CG2 3.96Å; I47-T129 HydrophobicContact CG1-CG2 3.63Å; I47-V139 HydrophobicContact CD1-CG1 4.35Å; I47-V139 HydrophobicContact CG2-CG1 4.48Å; I47-V139 HydrophobicContact CG2-CG2 4.45Å; I47-W144 HydrophobicContact CD1-CB 3.57Å; I47-W144 HydrophobicContact CD1-CG 4.37Å
48H95.6Very high96.1Very high95 Ų9579.7 Ų79.744%0.4439%0.393SS..Hα-helixtrans-62.3-51-176.1-17870000112.2A44 L45 R52A44-H48 PolarHBondContact O-N 3.31Å; A44-H48 VanDerWaalsContact O-N 3.17Å; L45-H48 PolarHBondContact O-N 3.01Å; H48-R52 VanDerWaalsContact NE2-CZ 3.31Å; H48-R52 PolarHBondContact NE2-NH1 2.99Å; H48-R52 WeakPolarHBondContact O-CG 3.38Å; H48-R52 PolarHBondContact O-N 3.02Å
49Q96.7Very high96Very high115 Ų11579.6 Ų79.654%0.53739%0.394SS..Hα-helixtrans-72.3-37.5-177.7-170.657.240.400112L45 R52 W53L45-Q49 VanDerWaalsContact O-CB 3.28Å; L45-Q49 WeakPolarHBondContact O-CB 3.21Å; L45-Q49 PolarHBondContact O-N 3.46Å; Q49-R52 PolarHBondContact O-N 2.79Å; Q49-W53 VanDerWaalsContact O-CB 3.3Å; Q49-W53 WeakPolarHBondContact O-CB 3.4Å; Q49-W53 PolarHBondContact O-N 3.1Å
50G96.4Very high95.9Very high11 Ų1180.4 Ų80.411%0.11340%0.398CS..Hα-helixtrans-65.4-41.7177.800000112.2F46 W53 M54 V133F46-G50 VanDerWaalsContact O-CA 3.24Å; F46-G50 WeakPolarHBondContact O-CA 3.27Å; F46-G50 PolarHBondContact O-N 3.32Å; G50-W53 PolarHBondContact O-N 3.34Å; G50-M54 WeakPolarHBondContact O-CB 3.4Å; G50-M54 WeakPolarHBondContact O-CG 3.43Å; G50-M54 PolarHBondContact O-N 3.09Å; G50-V133 VanDerWaalsContact C-CG1 3.41Å
51Q95.8Very high95.7Very high74 Ų7491.4 Ų91.435%0.34644%0.439SS..Hα-helixtrans-62.3-49.6174-75.6179.3-33.600111.3I47 W53 M54 E55 V133I47-Q51 VanDerWaalsContact O-CB 3.32Å; I47-Q51 WeakPolarHBondContact O-CB 3.41Å; I47-Q51 VanDerWaalsContact O-CG 3.23Å; I47-Q51 WeakPolarHBondContact O-CG 3.5Å; I47-Q51 PolarHBondContact O-N 2.75Å; Q51-W53 VanDerWaalsContact C-N 3.32Å; Q51-W53 PolarHBondContact O-N 3.28Å; Q51-M54 PolarHBondContact O-N 3.46Å; Q51-M54 VanDerWaalsContact O-N 3.15Å; Q51-E55 WeakPolarHBondContact O-CG 3.46Å; Q51-E55 PolarHBondContact O-N 3.01Å; Q51-V133 HydrophobicContact CG-CG1 4.42Å; Q51-V133 HydrophobicContact CG-CG2 4.28Å
52R95.5Very high95.4Very high137 Ų13790.3 Ų90.352%0.51743%0.425SS..Hα-helixtrans-58.1-41.3176.3-78.6-177.9160.4176.1-2.5113.3H48 Q49 E55H48-R52 VanDerWaalsContact NE2-CZ 3.31Å; H48-R52 PolarHBondContact NE2-NH1 2.99Å; H48-R52 WeakPolarHBondContact O-CG 3.38Å; H48-R52 PolarHBondContact O-N 3.02Å; Q49-R52 PolarHBondContact O-N 2.79Å; R52-E55 PolarHBondContact O-N 3.26Å
53W95.9Very high95.2Very high123 Ų12389.2 Ų89.247%0.46642%0.42SS..Hα-helixtrans-68-39177.7-179.877.8000112.1Q49 G50 Q51 R57 L134Q49-W53 VanDerWaalsContact O-CB 3.3Å; Q49-W53 WeakPolarHBondContact O-CB 3.4Å; Q49-W53 PolarHBondContact O-N 3.1Å; G50-W53 PolarHBondContact O-N 3.34Å; Q51-W53 VanDerWaalsContact C-N 3.32Å; Q51-W53 PolarHBondContact O-N 3.28Å; W53-R57 VanDerWaalsContact CZ2-NE 3.26Å; W53-L134 HydrophobicContact CZ3-CD2 4.21Å
54M95.5Very high95Very high5 Ų599.5 Ų99.53%0.02546%0.458CS..Hα-helixtrans-72.4-26.4177.7-76-60.8-60.100112.9G50 Q51 K56 R57 L60 V133 L134 K136G50-M54 WeakPolarHBondContact O-CB 3.4Å; G50-M54 WeakPolarHBondContact O-CG 3.43Å; G50-M54 PolarHBondContact O-N 3.09Å; Q51-M54 PolarHBondContact O-N 3.46Å; Q51-M54 VanDerWaalsContact O-N 3.15Å; M54-K56 PolarHBondContact O-N 3.04Å; M54-K56 VanDerWaalsContact O-N 3.07Å; M54-R57 HydrophobicContact CE-CB 4.37Å; M54-R57 PolarHBondContact O-N 3.24Å; M54-R57 VanDerWaalsContact O-O 3.12Å; M54-R57 HydrophobicContact SD-CB 4.42Å; M54-L60 HydrophobicContact CE-CG 4.45Å; M54-V133 HydrophobicContact CG-CG1 4.24Å; M54-L134 WeakPolarHBondContact CE-O 3.45Å; M54-L134 HydrophobicContact CG-CD2 4.49Å; M54-L134 HydrophobicContact SD-CD2 4.01Å; M54-K136 VanDerWaalsContact C-CE 3.47Å; M54-K136 HydrophobicContact CB-CG 4.38Å; M54-K136 HydrophobicContact CE-CG 4.07Å; M54-K136 WeakPolarHBondContact O-CE 3.19Å; M54-K136 PolarHBondContact O-NZ 3.37Å
55E93.1Very high95Very high129 Ų129102.7 Ų102.760%0.60347%0.469SS*.Hα-helixtrans-45.8-45.2179.7-81.7168.3-163.200112.6Q51 R52 R57 K136Q51-E55 WeakPolarHBondContact O-CG 3.46Å; Q51-E55 PolarHBondContact O-N 3.01Å; R52-E55 PolarHBondContact O-N 3.26Å; E55-R57 VanDerWaalsContact C-N 3.3Å; E55-R57 PolarHBondContact O-N 3.39Å; E55-K136 PolarHBondContact O-NZ 2.72Å
56K94.2Very high94.9Very high198 Ų19898 Ų9886%0.86145%0.445SS*.THydrogen-bonded Turntrans-81.52.7-178.4-57.1-177.7-177.2-178.50114.8M54M54-K56 PolarHBondContact O-N 3.04Å; M54-K56 VanDerWaalsContact O-N 3.07Å
57R94.9Very high94.8Very high125 Ų12595.1 Ų95.147%0.47243%0.433SS..SBendtrans-123.5152.3-172.6-64.2179.9-179.8-106.1-2.7112.4W53 M54 E55 K136W53-R57 VanDerWaalsContact CZ2-NE 3.26Å; M54-R57 HydrophobicContact CE-CB 4.37Å; M54-R57 PolarHBondContact O-N 3.24Å; M54-R57 VanDerWaalsContact O-O 3.12Å; M54-R57 HydrophobicContact SD-CB 4.42Å; E55-R57 VanDerWaalsContact C-N 3.3Å; E55-R57 PolarHBondContact O-N 3.39Å; R57-K136 WeakPolarHBondContact O-CE 3.2Å; R57-K136 PolarHBondContact O-NZ 2.66Å
58P94Very high94.9Very high101 Ų10197.4 Ų97.466%0.65646%0.455SS*.PPolyproline II helixtrans-67.1151.717128.4-34.1000111.4
59P94.3Very high95Very high75 Ų7595 Ų9549%0.48744%0.442SS..PPolyproline II helixtrans-64.4135175.227.4-33.1000110.9R135 K136P59-R135 WeakPolarHBondContact CB-O 3.38Å; P59-K136 HydrophobicContact CB-CB 4.12Å; P59-K136 HydrophobicContact CB-CD 4.18Å; P59-K136 HydrophobicContact CB-CG 4.1Å
60L94.2Very high95Very high77 Ų7789.8 Ų89.840%0.40342%0.418SS..PPolyproline II helixtrans-78.5138-179.2-60.5-178.1000111.5M54 L62 L134M54-L60 HydrophobicContact CE-CG 4.45Å; L60-L62 HydrophobicContact CB-CD1 4.1Å; L60-L62 HydrophobicContact CB-CD2 4.24Å; L60-L62 HydrophobicContact CB-CG 3.84Å; L60-L62 PolarHBondContact O-N 3.44Å; L60-L134 HydrophobicContact CD1-CB 4.29Å; L60-L134 HydrophobicContact CD1-CD2 4.18Å; L60-L134 PolarHBondContact N-O 2.81Å
61R92.3Very high95.1Very high240 Ų24091.9 Ų91.991%0.90643%0.43SS*.  trans-88.583.5175.3-66.6-174.6-179.5-174.71.1110.4
62L92.6Very high95.2Very high31 Ų3192.9 Ų92.916%0.16244%0.437CS..  trans-99.123.1-175-59.9173.6000113.9L60 R64 L65 L66 F131 L134L60-L62 HydrophobicContact CB-CD1 4.1Å; L60-L62 HydrophobicContact CB-CD2 4.24Å; L60-L62 HydrophobicContact CB-CG 3.84Å; L60-L62 PolarHBondContact O-N 3.44Å; L62-R64 VanDerWaalsContact C-N 3.33Å; L62-R64 PolarHBondContact O-N 3.3Å; L62-L65 PolarHBondContact O-N 3.22Å; L62-L66 VanDerWaalsContact O-CB 3.32Å; L62-L66 WeakPolarHBondContact O-CB 3.37Å; L62-L66 PolarHBondContact O-N 3.18Å; L62-F131 HydrophobicContact CB-CD1 4.22Å; L62-F131 HydrophobicContact CB-CE1 4.42Å; L62-F131 HydrophobicContact CD1-CD1 4.06Å; L62-F131 HydrophobicContact CD1-CE1 4.46Å; L62-L134 HydrophobicContact CD1-CB 3.77Å; L62-L134 HydrophobicContact CD1-CD1 3.82Å; L62-L134 HydrophobicContact CD1-CG 4.48Å
63N91.5Very high95.3Very high77 Ų7786.5 Ų86.541%0.41241%0.413SS..Hα-helixtrans-57.1-40.4-169-64.9-5.1000113.7T67N63-T67 WeakPolarHBondContact O-CB 3.3Å; N63-T67 PolarHBondContact O-N 3.41Å; N63-T67 PolarHBondContact O-OG1 3.24Å
64R94.1Very high95.4Very high227 Ų22781 Ų8186%0.85739%0.393SS*.Hα-helixtrans-66-47.7178.6-67.6-176.2-178.41750.2111.8L62 T67 A68L62-R64 VanDerWaalsContact C-N 3.33Å; L62-R64 PolarHBondContact O-N 3.3Å; R64-T67 PolarHBondContact O-N 3.43Å; R64-A68 PolarHBondContact O-N 2.94Å
65L96.7Very high95.6Very high110 Ų11084 Ų8458%0.57641%0.412SS*.Hα-helixtrans-64.5-43.4178-84.770.2000111L62 T67 A68 W69 F131L62-L65 PolarHBondContact O-N 3.22Å; L65-T67 VanDerWaalsContact C-N 3.3Å; L65-T67 PolarHBondContact O-N 2.96Å; L65-A68 PolarHBondContact O-N 3.4Å; L65-W69 VanDerWaalsContact O-CB 3.29Å; L65-W69 WeakPolarHBondContact O-CB 3.27Å; L65-W69 PolarHBondContact O-N 3.17Å; L65-F131 HydrophobicContact CB-CE1 4.01Å; L65-F131 HydrophobicContact CB-CZ 4.45Å
66L95.6Very high95.8Very high16 Ų1680.2 Ų80.28%0.08439%0.394CS..Hα-helixtrans-62.6-38.5176.4179.460.2000111.7L62 W69 N70 F131L62-L66 VanDerWaalsContact O-CB 3.32Å; L62-L66 WeakPolarHBondContact O-CB 3.37Å; L62-L66 PolarHBondContact O-N 3.18Å; L66-W69 PolarHBondContact O-N 2.96Å; L66-N70 WeakPolarHBondContact O-CB 3.35Å; L66-N70 VanDerWaalsContact O-CG 3.25Å; L66-N70 PolarHBondContact O-N 2.82Å; L66-N70 PolarHBondContact O-ND2 3.41Å; L66-N70 VanDerWaalsContact O-ND2 3.15Å; L66-F131 HydrophobicContact CB-CD1 4.17Å; L66-F131 HydrophobicContact CB-CE1 4.37Å; L66-F131 HydrophobicContact CD1-CB 3.95Å; L66-F131 HydrophobicContact CD1-CD1 4.21Å; L66-F131 HydrophobicContact CD1-CD2 4.04Å; L66-F131 HydrophobicContact CD1-CG 3.81Å
67T96.2Very high96Very high16 Ų1670.9 Ų70.910%0.09835%0.354CS..Hα-helixtrans-64.6-49.3174.8-58.10000110.9N63 R64 L65 W69 N70 C71 S187 L188N63-T67 WeakPolarHBondContact O-CB 3.3Å; N63-T67 PolarHBondContact O-N 3.41Å; N63-T67 PolarHBondContact O-OG1 3.24Å; R64-T67 PolarHBondContact O-N 3.43Å; L65-T67 VanDerWaalsContact C-N 3.3Å; L65-T67 PolarHBondContact O-N 2.96Å; T67-W69 VanDerWaalsContact C-N 3.26Å; T67-W69 PolarHBondContact O-N 2.72Å; T67-N70 PolarHBondContact O-N 3.34Å; T67-C71 WeakPolarHBondContact O-CB 3.16Å; T67-C71 PolarHBondContact O-N 3.09Å; T67-C71 PolarHBondContact O-SG 3.33Å; T67-S187 WeakPolarHBondContact CA-OG 3.33Å; T67-S187 WeakPolarHBondContact CB-OG 3.34Å; T67-S187 VanDerWaalsContact OG1-CB 3.29Å; T67-S187 WeakPolarHBondContact OG1-CB 3.28Å; T67-S187 PolarHBondContact OG1-OG 3.24Å; T67-L188 HydrophobicContact CG2-CD1 4.2Å; T67-L188 HydrophobicContact CG2-CD2 3.71Å; T67-L188 HydrophobicContact CG2-CG 3.65Å
68A97.6Very high96.2Very high64 Ų6468 Ų6853%0.52935%0.347SS..Hα-helixtrans-58-42.2177.300000111.5R64 L65 C71 L72R64-A68 PolarHBondContact O-N 2.94Å; L65-A68 PolarHBondContact O-N 3.4Å; A68-C71 PolarHBondContact O-N 2.98Å; A68-L72 WeakPolarHBondContact O-CB 3.33Å; A68-L72 PolarHBondContact O-N 3.26Å
69W98Very high96.3Very high44 Ų4467.6 Ų67.617%0.16734%0.335CS..Hα-helixtrans-60.9-51.1175.8-179.3-93.2000112.7L65 L66 T67 C71 L72 L73 F124 D128 F131L65-W69 VanDerWaalsContact O-CB 3.29Å; L65-W69 WeakPolarHBondContact O-CB 3.27Å; L65-W69 PolarHBondContact O-N 3.17Å; L66-W69 PolarHBondContact O-N 2.96Å; T67-W69 VanDerWaalsContact C-N 3.26Å; T67-W69 PolarHBondContact O-N 2.72Å; W69-C71 VanDerWaalsContact C-N 3.33Å; W69-C71 PolarHBondContact O-N 3.11Å; W69-L72 WeakPolarHBondContact O-CB 3.47Å; W69-L72 PolarHBondContact O-N 3.49Å; W69-L73 HydrophobicContact CZ2-CD1 4.26Å; W69-L73 VanDerWaalsContact NE1-CD1 3.28Å; W69-L73 PolarHBondContact O-N 2.88Å; W69-F124 HydrophobicContact CE3-CE1 4.1Å; W69-F124 HydrophobicContact CE3-CZ 4.21Å; W69-F124 AromaticContact CH2-CD1 3.52Å; W69-F124 HydrophobicContact CH2-CD1 3.52Å; W69-F124 HydrophobicContact CH2-CD2 4.24Å; W69-F124 AromaticContact CH2-CE1 3.18Å; W69-F124 HydrophobicContact CH2-CE1 3.18Å; W69-F124 AromaticContact CH2-CE2 3.96Å; W69-F124 HydrophobicContact CH2-CE2 3.96Å; W69-F124 HydrophobicContact CH2-CG 4.05Å; W69-F124 AromaticContact CH2-CZ 3.43Å; W69-F124 HydrophobicContact CH2-CZ 3.43Å; W69-F124 VanDerWaalsContact CH2-CZ 3.43Å; W69-F124 WeakPolarHBondContact CH2-O 3.34Å; W69-F124 AromaticContact CZ2-CD1 3.88Å; W69-F124 HydrophobicContact CZ2-CD1 3.88Å; W69-F124 AromaticContact CZ2-CE1 3.78Å; W69-F124 HydrophobicContact CZ2-CE1 3.78Å; W69-F124 HydrophobicContact CZ2-CZ 4.44Å; W69-F124 WeakPolarHBondContact CZ2-O 3.4Å; W69-F124 HydrophobicContact CZ3-CD1 4.2Å; W69-F124 AromaticContact CZ3-CE1 3.38Å; W69-F124 HydrophobicContact CZ3-CE1 3.38Å; W69-F124 HydrophobicContact CZ3-CE2 4.04Å; W69-F124 AromaticContact CZ3-CZ 3.29Å; W69-F124 HydrophobicContact CZ3-CZ 3.29Å; W69-D128 PolarHBondContact NE1-OD1 2.65Å; W69-F131 HydrophobicContact CB-CE2 3.87Å; W69-F131 HydrophobicContact CB-CZ 4.04Å; W69-F131 AromaticContact CD1-CE2 3.86Å; W69-F131 AromaticContact CD2-CE2 3.64Å; W69-F131 HydrophobicContact CD2-CE2 3.64Å; W69-F131 HydrophobicContact CD2-CZ 4.38Å; W69-F131 HydrophobicContact CE3-CE2 4.1Å; W69-F131 HydrophobicContact CG-CD2 4.27Å; W69-F131 AromaticContact CG-CE2 3.51Å; W69-F131 HydrophobicContact CG-CE2 3.51Å; W69-F131 HydrophobicContact CG-CZ 4.16Å
70N97.5Very high96.4Very high6 Ų664 Ų643%0.03231%0.312CS..Hα-helixtrans-64.5-38.1178.3-70.7-33.3000111.8L66 T67 L72 L73 A74 Y183 A184L66-N70 WeakPolarHBondContact O-CB 3.35Å; L66-N70 VanDerWaalsContact O-CG 3.25Å; L66-N70 PolarHBondContact O-N 2.82Å; L66-N70 PolarHBondContact O-ND2 3.41Å; L66-N70 VanDerWaalsContact O-ND2 3.15Å; T67-N70 PolarHBondContact O-N 3.34Å; N70-L72 VanDerWaalsContact C-N 3.35Å; N70-L73 PolarHBondContact O-N 3.21Å; N70-A74 WeakPolarHBondContact O-CB 3.24Å; N70-A74 PolarHBondContact O-N 3.22Å; N70-Y183 PolarHBondContact ND2-O 3.37Å; N70-A184 HydrophobicContact CB-CB 3.71Å
71C97.8Very high96.6Very high55 Ų5561.6 Ų61.637%0.37230%0.299SS..Hα-helixtrans-63.7-40.5174.5-72.90000111.8T67 A68 W69 T75T67-C71 WeakPolarHBondContact O-CB 3.16Å; T67-C71 PolarHBondContact O-N 3.09Å; T67-C71 PolarHBondContact O-SG 3.33Å; A68-C71 PolarHBondContact O-N 2.98Å; W69-C71 VanDerWaalsContact C-N 3.33Å; W69-C71 PolarHBondContact O-N 3.11Å; C71-T75 VanDerWaalsContact O-CB 3.28Å; C71-T75 WeakPolarHBondContact O-CB 3.35Å; C71-T75 PolarHBondContact O-N 3.15Å; C71-T75 PolarHBondContact O-OG1 3.48Å
72L98.1Very high96.8Very high94 Ų9454.9 Ų54.949%0.49228%0.28SS..Hα-helixtrans-60.8-50.1175.5178.167.2000110.8A68 W69 N70 T75 F76 F124A68-L72 WeakPolarHBondContact O-CB 3.33Å; A68-L72 PolarHBondContact O-N 3.26Å; W69-L72 WeakPolarHBondContact O-CB 3.47Å; W69-L72 PolarHBondContact O-N 3.49Å; N70-L72 VanDerWaalsContact C-N 3.35Å; L72-T75 PolarHBondContact O-N 2.95Å; L72-F76 WeakPolarHBondContact O-CB 3.38Å; L72-F76 PolarHBondContact O-N 3.24Å; L72-F124 HydrophobicContact CD2-CE1 3.92Å; L72-F124 HydrophobicContact CD2-CZ 4.02Å
73L98Very high96.8Very high4 Ų454.3 Ų54.32%0.02128%0.276CS..Hα-helixtrans-66.9-37.2179.6-70.7-179.3000113W69 N70 S77 F124 E125 Y180W69-L73 HydrophobicContact CZ2-CD1 4.26Å; W69-L73 VanDerWaalsContact NE1-CD1 3.28Å; W69-L73 PolarHBondContact O-N 2.88Å; N70-L73 PolarHBondContact O-N 3.21Å; L73-S77 WeakPolarHBondContact O-CB 3.43Å; L73-S77 PolarHBondContact O-N 3.33Å; L73-S77 PolarHBondContact O-OG 3.36Å; L73-F124 HydrophobicContact CD2-CD1 3.92Å; L73-F124 HydrophobicContact CD2-CE1 4.26Å; L73-E125 HydrophobicContact CD2-CG 4.41Å; L73-Y180 HydrophobicContact CB-CD1 3.77Å; L73-Y180 HydrophobicContact CB-CD2 3.79Å; L73-Y180 HydrophobicContact CB-CE1 4.03Å; L73-Y180 HydrophobicContact CB-CE2 4.02Å; L73-Y180 HydrophobicContact CB-CG 3.66Å; L73-Y180 HydrophobicContact CD1-CD1 3.9Å; L73-Y180 HydrophobicContact CD1-CE1 3.34Å; L73-Y180 HydrophobicContact CD1-CE2 4.13Å; L73-Y180 VanDerWaalsContact CD1-CZ 3.48Å; L73-Y180 HydrophobicContact CG-CD1 4.49Å; L73-Y180 HydrophobicContact CG-CE1 4.33Å
74A98.1Very high97Very high6 Ų650.7 Ų50.75%0.0526%0.257CS..Hα-helixtrans-61.9-50.2173.500000110.7N70 F76 S77 I78N70-A74 WeakPolarHBondContact O-CB 3.24Å; N70-A74 PolarHBondContact O-N 3.22Å; A74-F76 PolarHBondContact O-N 3.48Å; A74-S77 PolarHBondContact O-N 2.88Å; A74-I78 WeakPolarHBondContact O-CB 3.28Å; A74-I78 VanDerWaalsContact O-CG1 3.22Å; A74-I78 WeakPolarHBondContact O-CG1 3.33Å; A74-I78 PolarHBondContact O-N 3.21Å
75T98.2Very high97.1Very high69 Ų6941.6 Ų41.642%0.42323%0.226SC..Hα-helixtrans-59.8-49.9179.2-57.30000110.5C71 L72 S77 I78 F79C71-T75 VanDerWaalsContact O-CB 3.28Å; C71-T75 WeakPolarHBondContact O-CB 3.35Å; C71-T75 PolarHBondContact O-N 3.15Å; C71-T75 PolarHBondContact O-OG1 3.48Å; L72-T75 PolarHBondContact O-N 2.95Å; T75-S77 VanDerWaalsContact C-N 3.3Å; T75-S77 PolarHBondContact O-N 2.77Å; T75-I78 PolarHBondContact O-N 3.29Å; T75-F79 HydrophobicContact CG2-CD2 3.61Å; T75-F79 HydrophobicContact CG2-CE2 3.56Å; T75-F79 VanDerWaalsContact O-CD2 3.29Å; T75-F79 WeakPolarHBondContact O-CD2 3.34Å; T75-F79 PolarHBondContact O-N 2.95Å
76F98.1Very high96.9Very high49 Ų4938.9 Ų38.922%0.21522%0.215CC..Hα-helixtrans-53.4-47.1175.6173.4-103.3000112.1L72 A74 F79 G80 W114 M117 S121 Y173L72-F76 WeakPolarHBondContact O-CB 3.38Å; L72-F76 PolarHBondContact O-N 3.24Å; A74-F76 PolarHBondContact O-N 3.48Å; F76-F79 PolarHBondContact O-N 3.02Å; F76-G80 PolarHBondContact O-N 3.12Å; F76-W114 HydrophobicContact CD2-CZ3 4.07Å; F76-W114 HydrophobicContact CE2-CE3 4.36Å; F76-W114 AromaticContact CE2-CZ3 3.88Å; F76-W114 HydrophobicContact CE2-CZ3 3.88Å; F76-M117 HydrophobicContact CE2-CB 3.89Å; F76-M117 HydrophobicContact CZ-CB 3.89Å; F76-S121 VanDerWaalsContact CE1-CB 3.45Å; F76-Y173 HydrophobicContact CD1-CE1 4.28Å; F76-Y173 AromaticContact CE1-CE1 3.69Å; F76-Y173 HydrophobicContact CE1-CE1 3.69Å; F76-Y173 HydrophobicContact CZ-CE1 4.11Å
77S98.2Very high96.8Very high2 Ų238.2 Ų38.21%0.01421%0.212CC..Hα-helixtrans-68.1-37.7-179-56.50000112.7L73 A74 T75 L81L73-S77 WeakPolarHBondContact O-CB 3.43Å; L73-S77 PolarHBondContact O-N 3.33Å; L73-S77 PolarHBondContact O-OG 3.36Å; A74-S77 PolarHBondContact O-N 2.88Å; T75-S77 VanDerWaalsContact C-N 3.3Å; T75-S77 PolarHBondContact O-N 2.77Å; S77-L81 WeakPolarHBondContact O-CB 3.29Å; S77-L81 PolarHBondContact O-N 2.92Å
78I98.4Very high96.7Very high65 Ų6537.8 Ų37.833%0.33321%0.208SC..Hα-helixtrans-64.2-47.4175.4-69.7164.3000110.3A74 T75 L81 I82A74-I78 WeakPolarHBondContact O-CB 3.28Å; A74-I78 VanDerWaalsContact O-CG1 3.22Å; A74-I78 WeakPolarHBondContact O-CG1 3.33Å; A74-I78 PolarHBondContact O-N 3.21Å; T75-I78 PolarHBondContact O-N 3.29Å; I78-L81 WeakPolarHBondContact O-CB 3.26Å; I78-L81 PolarHBondContact O-N 2.93Å; I78-I82 HydrophobicContact CG2-CD1 3.76Å; I78-I82 HydrophobicContact CG2-CG1 4.48Å; I78-I82 VanDerWaalsContact O-CG1 3.28Å; I78-I82 WeakPolarHBondContact O-CG1 3.43Å; I78-I82 PolarHBondContact O-N 3.24Å
79F97Very high96.6Very high93 Ų9339.6 Ų39.641%0.40820%0.204SC..Hα-helixtrans-62.7-46.1176.9-85.9-80.2000111.4T75 F76 L81 I82 R83 W114T75-F79 HydrophobicContact CG2-CD2 3.61Å; T75-F79 HydrophobicContact CG2-CE2 3.56Å; T75-F79 VanDerWaalsContact O-CD2 3.29Å; T75-F79 WeakPolarHBondContact O-CD2 3.34Å; T75-F79 PolarHBondContact O-N 2.95Å; F76-F79 PolarHBondContact O-N 3.02Å; F79-L81 VanDerWaalsContact C-N 3.31Å; F79-L81 PolarHBondContact O-N 3.22Å; F79-I82 PolarHBondContact O-N 3.42Å; F79-R83 VanDerWaalsContact O-CG 3.22Å; F79-R83 WeakPolarHBondContact O-CG 3.37Å; F79-R83 PolarHBondContact O-N 3.36Å; F79-W114 HydrophobicContact CB-CH2 3.53Å; F79-W114 HydrophobicContact CB-CZ2 4.16Å; F79-W114 HydrophobicContact CB-CZ3 4.1Å
80G96.9Very high96.3Very high0 Ų040 Ų400%021%0.208CC..Hα-helixtrans-55.4-46.3174.900000112.3F76 R83 M84 W114F76-G80 PolarHBondContact O-N 3.12Å; G80-R83 PolarHBondContact O-N 3.11Å; G80-M84 WeakPolarHBondContact O-CB 3.44Å; G80-M84 WeakPolarHBondContact O-CG 3.5Å; G80-M84 PolarHBondContact O-N 2.92Å; G80-W114 VanDerWaalsContact CA-CE3 3.41Å
81L97.7Very high96.1Very high25 Ų2539.7 Ų39.713%0.13121%0.207CC..Hα-helixtrans-58.2-52175179.765.7000111.9S77 I78 F79 R83 M84 T85 W170 L174S77-L81 WeakPolarHBondContact O-CB 3.29Å; S77-L81 PolarHBondContact O-N 2.92Å; I78-L81 WeakPolarHBondContact O-CB 3.26Å; I78-L81 PolarHBondContact O-N 2.93Å; F79-L81 VanDerWaalsContact C-N 3.31Å; F79-L81 PolarHBondContact O-N 3.22Å; L81-R83 PolarHBondContact O-N 2.92Å; L81-M84 PolarHBondContact O-N 2.98Å; L81-T85 VanDerWaalsContact O-CB 3.28Å; L81-T85 WeakPolarHBondContact O-CB 3.38Å; L81-T85 PolarHBondContact O-N 3.34Å; L81-T85 PolarHBondContact O-OG1 3.43Å; L81-W170 HydrophobicContact CD1-CZ2 4.34Å; L81-L174 HydrophobicContact CD1-CB 3.84Å; L81-L174 HydrophobicContact CD1-CD1 4.15Å; L81-L174 HydrophobicContact CD2-CB 4.43Å; L81-L174 HydrophobicContact CD2-CD1 3.59Å
82I96.1Very high95.9Very high99 Ų9939.6 Ų39.651%0.50820%0.202SC..Hα-helixtrans-58.2-39.4-178.7-70.2166.8000110.9I78 F79 P86I78-I82 HydrophobicContact CG2-CD1 3.76Å; I78-I82 HydrophobicContact CG2-CG1 4.48Å; I78-I82 VanDerWaalsContact O-CG1 3.28Å; I78-I82 WeakPolarHBondContact O-CG1 3.43Å; I78-I82 PolarHBondContact O-N 3.24Å; F79-I82 PolarHBondContact O-N 3.42Å; I82-P86 WeakPolarHBondContact O-CD 3.48Å
83R94.1Very high95.8Very high20 Ų2039.8 Ų39.88%0.07521%0.207CC..Hα-helixtrans-79.9-31.2-176.5-60.2-62.4-68.5164.8-1.2113.2Y10 V12 E17 F79 G80 L81 V110 W114Y10-R83 VanDerWaalsContact CE1-O 3.3Å; Y10-R83 WeakPolarHBondContact CE1-O 3.25Å; Y10-R83 PolarHBondContact OH-O 2.98Å; V12-R83 VanDerWaalsContact O-CZ 3.24Å; V12-R83 PolarHBondContact O-NH1 3Å; V12-R83 PolarHBondContact O-NH2 3.44Å; E17-R83 VanDerWaalsContact CD-NH2 3.33Å; E17-R83 IonicContact OE1-CZ 3.65Å; E17-R83 IonicContact OE1-NE 3.96Å; E17-R83 PolarHBondContact OE1-NE 3.48Å; E17-R83 IonicContact OE1-NH2 2.82Å; E17-R83 PolarHBondContact OE1-NH2 2.74Å; E17-R83 IonicContact OE2-CZ 3.74Å; E17-R83 IonicContact OE2-NE 3.35Å; E17-R83 IonicContact OE2-NH2 3.07Å; E17-R83 PolarHBondContact OE2-NH2 3.45Å; F79-R83 VanDerWaalsContact O-CG 3.22Å; F79-R83 WeakPolarHBondContact O-CG 3.37Å; F79-R83 PolarHBondContact O-N 3.36Å; G80-R83 PolarHBondContact O-N 3.11Å; L81-R83 PolarHBondContact O-N 2.92Å; R83-V110 HydrophobicContact CB-CG1 4.14Å; R83-W114 VanDerWaalsContact CB-CD1 3.41Å; R83-W114 HydrophobicContact CB-CD2 4.22Å; R83-W114 HydrophobicContact CB-CG 3.96Å; R83-W114 HydrophobicContact CG-CD2 4.43Å; R83-W114 HydrophobicContact CG-CZ2 3.96Å
84M94.6Very high95.5Very high1 Ų145.8 Ų45.81%0.00524%0.235CC..Hα-helixtrans-79-28.2176.2-66.4-64.3-6900113.2G80 L81 E87 F88 Y106 T111 W114 V169 Y173G80-M84 WeakPolarHBondContact O-CB 3.44Å; G80-M84 WeakPolarHBondContact O-CG 3.5Å; G80-M84 PolarHBondContact O-N 2.92Å; L81-M84 PolarHBondContact O-N 2.98Å; M84-E87 PolarHBondContact O-N 2.77Å; M84-F88 WeakPolarHBondContact O-CB 3.42Å; M84-F88 PolarHBondContact O-N 3.31Å; M84-F88 VanDerWaalsContact O-N 3.08Å; M84-Y106 HydrophobicContact CE-CD2 4.05Å; M84-T111 HydrophobicContact CE-CG2 4.25Å; M84-T111 VanDerWaalsContact SD-CA 3.59Å; M84-T111 VanDerWaalsContact SD-CB 3.6Å; M84-T111 HydrophobicContact SD-CG2 3.64Å; M84-W114 HydrophobicContact CG-CB 4.21Å; M84-W114 HydrophobicContact SD-CB 3.86Å; M84-V169 HydrophobicContact CE-CG1 3.99Å; M84-Y173 HydrophobicContact CG-CD2 4.09Å; M84-Y173 HydrophobicContact CG-CE2 4.11Å
85T95.6Very high95.3Very high36 Ų3650 Ų5022%0.22125%0.252CS..Hα-helixtrans-61.2-44-171.7-67.10000115L81 E87 F88 F89 W170L81-T85 VanDerWaalsContact O-CB 3.28Å; L81-T85 WeakPolarHBondContact O-CB 3.38Å; L81-T85 PolarHBondContact O-N 3.34Å; L81-T85 PolarHBondContact O-OG1 3.43Å; T85-E87 PolarHBondContact O-N 3.32Å; T85-F88 WeakPolarHBondContact O-CB 3.47Å; T85-F88 PolarHBondContact O-N 3.49Å; T85-F89 HydrophobicContact CG2-CD2 3.51Å; T85-F89 HydrophobicContact CG2-CE2 3.59Å; T85-F89 WeakPolarHBondContact O-CD2 3.44Å; T85-F89 PolarHBondContact O-N 3.16Å; T85-W170 PolarHBondContact OG1-NE1 3.29Å
86P93.8Very high95Very high52 Ų5248.1 Ų48.134%0.33825%0.247SC..Hα-helixtrans-60-45.6179.6-2735.5000113.3V8 Y10 I82 H90V8-P86 HydrophobicContact CG1-CB 4.07Å; Y10-P86 HydrophobicContact CE1-CB 4.24Å; Y10-P86 HydrophobicContact CE1-CG 4.08Å; I82-P86 WeakPolarHBondContact O-CD 3.48Å; P86-H90 WeakPolarHBondContact O-CB 3.18Å; P86-H90 PolarHBondContact O-N 3.43Å
87E93.6Very high94.8Very high3 Ų348.9 Ų48.91%0.01425%0.25CC..Hα-helixtrans-64.3-43.1176-171.3-77.9147.100111.4V8 M84 T85 F89 H90 S91 Y106 T111 R166V8-E87 HydrophobicContact CG2-CB 4.22Å; M84-E87 PolarHBondContact O-N 2.77Å; T85-E87 PolarHBondContact O-N 3.32Å; E87-F89 PolarHBondContact O-N 2.83Å; E87-H90 PolarHBondContact O-N 3.43Å; E87-S91 WeakPolarHBondContact O-CB 3.47Å; E87-S91 PolarHBondContact O-N 2.81Å; E87-S91 PolarHBondContact O-OG 3.11Å; E87-S91 PolarHBondContact OE1-OG 2.94Å; E87-Y106 WeakPolarHBondContact OE2-CB 3.39Å; E87-T111 HydrophobicContact CB-CG2 3.44Å; E87-T111 VanDerWaalsContact CB-CG2 3.44Å; E87-T111 HydrophobicContact CG-CG2 3.85Å; E87-R166 IonicContact OE1-CZ 3.25Å; E87-R166 VanDerWaalsContact OE1-CZ 3.25Å; E87-R166 IonicContact OE1-NE 2.96Å; E87-R166 PolarHBondContact OE1-NE 3.47Å; E87-R166 IonicContact OE1-NH2 2.73Å; E87-R166 PolarHBondContact OE1-NH2 3.13Å; E87-R166 IonicContact OE2-CZ 3.95Å; E87-R166 IonicContact OE2-NE 2.99Å; E87-R166 PolarHBondContact OE2-NE 2.63Å; E87-R166 IonicContact OE2-NH2 3.99Å
88F94.3Very high94.6Very high6 Ų653.6 Ų53.63%0.02627%0.272CS..Hα-helixtrans-57-51.9179.8-177-91.9000112M84 T85 L92 R166 W167 W170M84-F88 WeakPolarHBondContact O-CB 3.42Å; M84-F88 PolarHBondContact O-N 3.31Å; M84-F88 VanDerWaalsContact O-N 3.08Å; T85-F88 WeakPolarHBondContact O-CB 3.47Å; T85-F88 PolarHBondContact O-N 3.49Å; F88-L92 WeakPolarHBondContact O-CB 3.39Å; F88-L92 PolarHBondContact O-N 3.46Å; F88-L92 VanDerWaalsContact O-N 3.08Å; F88-R166 HydrophobicContact CD2-CG 3.88Å; F88-R166 HydrophobicContact CE2-CG 4.42Å; F88-W167 HydrophobicContact CE1-CH2 4.28Å; F88-W167 HydrophobicContact CE1-CZ2 4.5Å; F88-W167 HydrophobicContact CE1-CZ3 4.47Å; F88-W167 AromaticContact CE2-CD2 3.64Å; F88-W167 HydrophobicContact CE2-CD2 3.64Å; F88-W167 AromaticContact CE2-CE2 3.77Å; F88-W167 AromaticContact CE2-CE3 3.9Å; F88-W167 HydrophobicContact CE2-CE3 3.9Å; F88-W167 HydrophobicContact CE2-CG 4.05Å; F88-W167 HydrophobicContact CE2-CH2 4.37Å; F88-W167 HydrophobicContact CE2-CZ2 4.12Å; F88-W167 HydrophobicContact CE2-CZ3 4.27Å; F88-W167 AromaticContact CZ-CD2 3.73Å; F88-W167 HydrophobicContact CZ-CD2 3.73Å; F88-W167 AromaticContact CZ-CE2 3.72Å; F88-W167 AromaticContact CZ-CE3 3.6Å; F88-W167 HydrophobicContact CZ-CE3 3.6Å; F88-W167 AromaticContact CZ-CH2 3.5Å; F88-W167 HydrophobicContact CZ-CH2 3.5Å; F88-W167 AromaticContact CZ-CZ2 3.6Å; F88-W167 HydrophobicContact CZ-CZ2 3.6Å; F88-W167 AromaticContact CZ-CZ3 3.51Å; F88-W167 HydrophobicContact CZ-CZ3 3.51Å; F88-W170 HydrophobicContact CB-CG 4.32Å; F88-W170 HydrophobicContact CD1-CD2 4.18Å; F88-W170 HydrophobicContact CD1-CG 4.42Å; F88-W170 HydrophobicContact CD2-CB 3.91Å; F88-W170 HydrophobicContact CD2-CD2 4.22Å; F88-W170 AromaticContact CD2-CG 3.82Å; F88-W170 HydrophobicContact CD2-CG 3.82Å; F88-W170 HydrophobicContact CE1-CD2 4.25Å; F88-W170 HydrophobicContact CE1-CE3 4.28Å; F88-W170 HydrophobicContact CE1-CZ3 4.49Å; F88-W170 HydrophobicContact CE2-CB 4.23Å; F88-W170 HydrophobicContact CE2-CD2 4.3Å; F88-W170 HydrophobicContact CE2-CE3 4.38Å; F88-W170 HydrophobicContact CE2-CG 4.23Å; F88-W170 HydrophobicContact CG-CB 4.48Å; F88-W170 AromaticContact CG-CD1 3.89Å; F88-W170 HydrophobicContact CG-CD2 4.16Å; F88-W170 AromaticContact CG-CG 3.92Å; F88-W170 HydrophobicContact CG-CG 3.92Å; F88-W170 HydrophobicContact CZ-CD2 4.29Å; F88-W170 HydrophobicContact CZ-CE3 4.12Å
89F94.5Very high94.4Very high102 Ų10252.9 Ų52.945%0.44727%0.265SS..Hα-helixtrans-70.8-41.2179.9-79.9-71.2000112.4T85 E87 S91 L92 T93 W170T85-F89 HydrophobicContact CG2-CD2 3.51Å; T85-F89 HydrophobicContact CG2-CE2 3.59Å; T85-F89 WeakPolarHBondContact O-CD2 3.44Å; T85-F89 PolarHBondContact O-N 3.16Å; E87-F89 PolarHBondContact O-N 2.83Å; F89-S91 VanDerWaalsContact C-N 3.32Å; F89-S91 PolarHBondContact O-N 3.17Å; F89-L92 PolarHBondContact O-N 3.27Å; F89-T93 WeakPolarHBondContact O-CG2 3.29Å; F89-T93 PolarHBondContact O-N 3.42Å; F89-T93 PolarHBondContact O-OG1 3.2Å; F89-T93 VanDerWaalsContact O-OG1 3.04Å; F89-W170 HydrophobicContact CE2-CZ2 4.28Å
90H92.8Very high94.2Very high53 Ų5348.5 Ų48.525%0.24525%0.246CC..Hα-helixtrans-59.6-45.2176.7-179.184.5000111.5V8 P86 E87 L92 T93 H94 F95V8-H90 HydrophobicContact CG2-CB 3.52Å; P86-H90 WeakPolarHBondContact O-CB 3.18Å; P86-H90 PolarHBondContact O-N 3.43Å; E87-H90 PolarHBondContact O-N 3.43Å; H90-L92 VanDerWaalsContact C-N 3.29Å; H90-L92 PolarHBondContact O-N 3.03Å; H90-T93 PolarHBondContact O-N 2.98Å; H90-T93 PolarHBondContact O-OG1 2.94Å; H90-H94 AromaticContact CE1-CD2 3.27Å; H90-H94 PolarHBondContact CE1-CD2 3.36Å; H90-H94 AromaticContact CE1-CG 3.83Å; H90-H94 AromaticContact CE1-NE2 3.68Å; H90-H94 AromaticContact CG-CD2 3.71Å; H90-H94 AromaticContact ND1-CD2 3.1Å; H90-H94 PolarHBondContact ND1-CD2 3.38Å; H90-H94 AromaticContact ND1-NE2 3.46Å; H90-H94 PolarHBondContact ND1-NE2 3.48Å; H90-H94 AromaticContact NE2-CD2 3.94Å; H90-H94 WeakPolarHBondContact O-CB 3.45Å; H90-H94 PolarHBondContact O-CD2 2.81Å; H90-H94 PolarHBondContact O-N 3.19Å; H90-F95 AromaticContact NE2-CE2 3.99Å
91S93.2Very high94.1Very high0 Ų048.5 Ų48.50%025%0.246CC..Hα-helixtrans-62.7-38.4177.1-750000111.9E87 F89 F95 G96E87-S91 WeakPolarHBondContact O-CB 3.47Å; E87-S91 PolarHBondContact O-N 2.81Å; E87-S91 PolarHBondContact O-OG 3.11Å; E87-S91 PolarHBondContact OE1-OG 2.94Å; F89-S91 VanDerWaalsContact C-N 3.32Å; F89-S91 PolarHBondContact O-N 3.17Å; S91-F95 PolarHBondContact O-N 3.29Å; S91-G96 PolarHBondContact O-N 3.43Å
92L93.7Very high94Very high52 Ų5247.5 Ų47.527%0.27224%0.241SC..Hα-helixtrans-69.1-43.6177.8-172.462.2000112.8F88 F89 H90 G96 F97 T100 W167F88-L92 WeakPolarHBondContact O-CB 3.39Å; F88-L92 PolarHBondContact O-N 3.46Å; F88-L92 VanDerWaalsContact O-N 3.08Å; F89-L92 PolarHBondContact O-N 3.27Å; H90-L92 VanDerWaalsContact C-N 3.29Å; H90-L92 PolarHBondContact O-N 3.03Å; L92-G96 VanDerWaalsContact O-CA 3.31Å; L92-G96 WeakPolarHBondContact O-CA 3.25Å; L92-G96 PolarHBondContact O-N 2.71Å; L92-F97 HydrophobicContact CD1-CB 4.33Å; L92-F97 HydrophobicContact CD1-CD2 4.14Å; L92-T100 VanDerWaalsContact CA-CG2 3.49Å; L92-T100 HydrophobicContact CB-CG2 4Å; L92-T100 HydrophobicContact CD1-CG2 4.01Å; L92-W167 HydrophobicContact CD1-CZ2 4.34Å
93T94.1Very high93.8Very high99 Ų9944.7 Ų44.761%0.60723%0.227SC*.Hα-helixtrans-80.5-35.9-174.6570000113.3F89 H90F89-T93 WeakPolarHBondContact O-CG2 3.29Å; F89-T93 PolarHBondContact O-N 3.42Å; F89-T93 PolarHBondContact O-OG1 3.2Å; F89-T93 VanDerWaalsContact O-OG1 3.04Å; H90-T93 PolarHBondContact O-N 2.98Å; H90-T93 PolarHBondContact O-OG1 2.94Å
94H93.1Very high93.7Very high129 Ų12944 Ų4460%0.59723%0.225SC*.Hα-helixtrans-94.6-31.1-174.5-68.2-80.3000114.2H90H90-H94 AromaticContact CE1-CD2 3.27Å; H90-H94 PolarHBondContact CE1-CD2 3.36Å; H90-H94 AromaticContact CE1-CG 3.83Å; H90-H94 AromaticContact CE1-NE2 3.68Å; H90-H94 AromaticContact CG-CD2 3.71Å; H90-H94 AromaticContact ND1-CD2 3.1Å; H90-H94 PolarHBondContact ND1-CD2 3.38Å; H90-H94 AromaticContact ND1-NE2 3.46Å; H90-H94 PolarHBondContact ND1-NE2 3.48Å; H90-H94 AromaticContact NE2-CD2 3.94Å; H90-H94 WeakPolarHBondContact O-CB 3.45Å; H90-H94 PolarHBondContact O-CD2 2.81Å; H90-H94 PolarHBondContact O-N 3.19Å
95F92.6Very high93.5Very high96 Ų9644.7 Ų44.742%0.42123%0.23SC..Hα-helixtrans-114-11.5-177.6-56.2-84000113.5L7 H90 S91 Y99L7-F95 HydrophobicContact CD2-CE2 4.17Å; L7-F95 HydrophobicContact CD2-CZ 3.99Å; H90-F95 AromaticContact NE2-CE2 3.99Å; S91-F95 PolarHBondContact O-N 3.29Å; F95-Y99 HydrophobicContact CB-CD1 3.45Å; F95-Y99 VanDerWaalsContact CB-CD1 3.45Å; F95-Y99 HydrophobicContact CB-CD2 3.89Å; F95-Y99 HydrophobicContact CB-CE1 4.11Å; F95-Y99 HydrophobicContact CB-CE2 4.47Å; F95-Y99 HydrophobicContact CB-CG 3.33Å; F95-Y99 HydrophobicContact CD1-CD2 4.39Å; F95-Y99 HydrophobicContact CD1-CE2 4.32Å; F95-Y99 HydrophobicContact CD2-CD1 4.18Å; F95-Y99 HydrophobicContact CD2-CE1 4.03Å; F95-Y99 AromaticContact CG-CD1 3.91Å; F95-Y99 HydrophobicContact CG-CD1 3.91Å; F95-Y99 HydrophobicContact CG-CD2 4.26Å; F95-Y99 HydrophobicContact CG-CE1 4.04Å; F95-Y99 HydrophobicContact CG-CE2 4.36Å; F95-Y99 HydrophobicContact CG-CG 4.03Å; F95-Y99 WeakPolarHBondContact O-CB 3.39Å
96G93.3Very high93.2Very high29 Ų2943.3 Ų43.330%0.29922%0.221SC..Hα-helixtrans83170.1176.100000114.5S91 L92 Q98 Y99 T100S91-G96 PolarHBondContact O-N 3.43Å; L92-G96 VanDerWaalsContact O-CA 3.31Å; L92-G96 WeakPolarHBondContact O-CA 3.25Å; L92-G96 PolarHBondContact O-N 2.71Å; G96-Q98 PolarHBondContact O-N 3.32Å; G96-Y99 WeakPolarHBondContact O-CB 3.38Å; G96-Y99 PolarHBondContact O-N 3.18Å; G96-T100 PolarHBondContact O-N 2.99Å
97F94.2Very high92.9Very high65 Ų6541 Ų4129%0.28521%0.207SC..Hα-helixtrans-59.7-45.5-171.4-176.1-105.6000113.4L92 Y99 T100 V101 W167 F213 V214 T217L92-F97 HydrophobicContact CD1-CB 4.33Å; L92-F97 HydrophobicContact CD1-CD2 4.14Å; F97-Y99 VanDerWaalsContact C-N 3.27Å; F97-Y99 PolarHBondContact O-N 3.41Å; F97-T100 PolarHBondContact O-N 3.47Å; F97-T100 PolarHBondContact O-OG1 3.01Å; F97-V101 HydrophobicContact CD1-CG2 4.17Å; F97-V101 HydrophobicContact CD2-CG2 4.28Å; F97-V101 HydrophobicContact CE1-CG2 3.76Å; F97-V101 HydrophobicContact CE2-CG2 3.88Å; F97-V101 HydrophobicContact CG-CG2 4.42Å; F97-V101 HydrophobicContact CZ-CG2 3.59Å; F97-V101 WeakPolarHBondContact O-CG2 3.16Å; F97-V101 PolarHBondContact O-N 3.24Å; F97-W167 AromaticContact CD2-CZ2 3.8Å; F97-W167 HydrophobicContact CD2-CZ2 3.8Å; F97-W167 AromaticContact CE2-CE2 3.88Å; F97-W167 HydrophobicContact CE2-CH2 4.09Å; F97-W167 AromaticContact CE2-CZ2 3.48Å; F97-W167 HydrophobicContact CE2-CZ2 3.48Å; F97-W167 VanDerWaalsContact CE2-CZ2 3.48Å; F97-F213 AromaticContact CE1-CE1 3.96Å; F97-F213 HydrophobicContact CE1-CE1 3.96Å; F97-F213 HydrophobicContact CE2-CE1 4.36Å; F97-F213 HydrophobicContact CZ-CD1 4.15Å; F97-F213 AromaticContact CZ-CE1 3.55Å; F97-F213 HydrophobicContact CZ-CE1 3.55Å; F97-F213 HydrophobicContact CZ-CZ 4.48Å; F97-V214 HydrophobicContact CZ-CG2 4.45Å; F97-T217 HydrophobicContact CD1-CG2 4.41Å; F97-T217 HydrophobicContact CE1-CG2 3.76Å
98Q93.1Very high92.6Very high101 Ų10143.5 Ų43.547%0.47222%0.218SC..Hα-helixtrans-56.3-42.1179172166.8-12.600111.8G96 T100 V101 C102 I221G96-Q98 PolarHBondContact O-N 3.32Å; Q98-T100 VanDerWaalsContact C-N 3.35Å; Q98-T100 PolarHBondContact O-N 2.94Å; Q98-V101 PolarHBondContact O-N 3.13Å; Q98-C102 VanDerWaalsContact O-CB 3.29Å; Q98-C102 WeakPolarHBondContact O-CB 3.41Å; Q98-C102 PolarHBondContact O-N 3.08Å; Q98-I221 HydrophobicContact CB-CD1 4.34Å; Q98-I221 HydrophobicContact CG-CD1 4.01Å; Q98-I221 HydrophobicContact CG-CG2 4.35Å
99Y93.4Very high92.2Very high50 Ų5044.1 Ų44.120%0.19623%0.226CC..Hα-helixtrans-60.9-45175.8-178.1-89.8000111.5L7 F95 G96 F97 V101 C102 N103 S105L7-Y99 HydrophobicContact CD1-CE1 4.31Å; L7-Y99 WeakPolarHBondContact CD1-OH 2.97Å; F95-Y99 HydrophobicContact CB-CD1 3.45Å; F95-Y99 VanDerWaalsContact CB-CD1 3.45Å; F95-Y99 HydrophobicContact CB-CD2 3.89Å; F95-Y99 HydrophobicContact CB-CE1 4.11Å; F95-Y99 HydrophobicContact CB-CE2 4.47Å; F95-Y99 HydrophobicContact CB-CG 3.33Å; F95-Y99 HydrophobicContact CD1-CD2 4.39Å; F95-Y99 HydrophobicContact CD1-CE2 4.32Å; F95-Y99 HydrophobicContact CD2-CD1 4.18Å; F95-Y99 HydrophobicContact CD2-CE1 4.03Å; F95-Y99 AromaticContact CG-CD1 3.91Å; F95-Y99 HydrophobicContact CG-CD1 3.91Å; F95-Y99 HydrophobicContact CG-CD2 4.26Å; F95-Y99 HydrophobicContact CG-CE1 4.04Å; F95-Y99 HydrophobicContact CG-CE2 4.36Å; F95-Y99 HydrophobicContact CG-CG 4.03Å; F95-Y99 WeakPolarHBondContact O-CB 3.39Å; G96-Y99 WeakPolarHBondContact O-CB 3.38Å; G96-Y99 PolarHBondContact O-N 3.18Å; F97-Y99 VanDerWaalsContact C-N 3.27Å; F97-Y99 PolarHBondContact O-N 3.41Å; Y99-V101 PolarHBondContact O-N 3.12Å; Y99-V101 VanDerWaalsContact O-N 3.13Å; Y99-C102 PolarHBondContact O-N 3.31Å; Y99-N103 HydrophobicContact CD1-CB 4.34Å; Y99-N103 HydrophobicContact CD2-CB 3.81Å; Y99-N103 HydrophobicContact CE1-CB 4.17Å; Y99-N103 HydrophobicContact CE2-CB 3.63Å; Y99-N103 WeakPolarHBondContact CE2-ND2 3.28Å; Y99-N103 HydrophobicContact CG-CB 4.16Å; Y99-N103 WeakPolarHBondContact O-CB 3.29Å; Y99-N103 PolarHBondContact O-N 3.48Å; Y99-S105 WeakPolarHBondContact CE1-OG 3.22Å; Y99-S105 WeakPolarHBondContact OH-CB 3.28Å; Y99-S105 PolarHBondContact OH-OG 3.42Å
100T94.2Very high92.1Very high0 Ų039.5 Ų39.50%021%0.206CC..Hα-helixtrans-61.7-25.4-178.368.20000113.9L92 G96 F97 Q98 R166 W167L92-T100 VanDerWaalsContact CA-CG2 3.49Å; L92-T100 HydrophobicContact CB-CG2 4Å; L92-T100 HydrophobicContact CD1-CG2 4.01Å; G96-T100 PolarHBondContact O-N 2.99Å; F97-T100 PolarHBondContact O-N 3.47Å; F97-T100 PolarHBondContact O-OG1 3.01Å; Q98-T100 VanDerWaalsContact C-N 3.35Å; Q98-T100 PolarHBondContact O-N 2.94Å; T100-R166 VanDerWaalsContact CA-NH1 3.32Å; T100-R166 PolarHBondContact O-NH1 3.29Å; T100-W167 PolarHBondContact OG1-NE1 3.17Å
101V94.8Very high92.1Very high0 Ų037 Ų370%020%0.195CC..Hα-helixtrans-98-27.9-175.1179.80000112F97 Q98 Y99 A163 A164 V214 S218F97-V101 HydrophobicContact CD1-CG2 4.17Å; F97-V101 HydrophobicContact CD2-CG2 4.28Å; F97-V101 HydrophobicContact CE1-CG2 3.76Å; F97-V101 HydrophobicContact CE2-CG2 3.88Å; F97-V101 HydrophobicContact CG-CG2 4.42Å; F97-V101 HydrophobicContact CZ-CG2 3.59Å; F97-V101 WeakPolarHBondContact O-CG2 3.16Å; F97-V101 PolarHBondContact O-N 3.24Å; Q98-V101 PolarHBondContact O-N 3.13Å; Y99-V101 PolarHBondContact O-N 3.12Å; Y99-V101 VanDerWaalsContact O-N 3.13Å; V101-A163 CarbonylContact O-C 3.5Å; V101-A163 WeakPolarHBondContact O-CB 3.29Å; V101-A164 PolarHBondContact O-N 3.09Å; V101-V214 HydrophobicContact CG1-CG1 3.93Å; V101-V214 HydrophobicContact CG2-CG1 4.26Å; V101-S218 WeakPolarHBondContact CG1-OG 3.31Å
102C94.5Very high92.1Very high4 Ų437 Ų373%0.02720%0.195CC..Hα-helixtrans-113.6-9.3-171.9-77.90000115.6Q98 Y99 A163 C228 Q229Q98-C102 VanDerWaalsContact O-CB 3.29Å; Q98-C102 WeakPolarHBondContact O-CB 3.41Å; Q98-C102 PolarHBondContact O-N 3.08Å; Y99-C102 PolarHBondContact O-N 3.31Å; C102-A163 WeakPolarHBondContact O-CB 3.22Å; C102-C228 WeakPolarHBondContact CA-SG 3.31Å; C102-C228 HydrophobicContact CB-CB 3.74Å; C102-C228 WeakPolarHBondContact CB-SG 3.37Å; C102-C228 WeakPolarHBondContact SG-CB 3.43Å; C102-C228 CovalentContact SG-SG 2.06Å; C102-C228 PolarHBondContact SG-SG 2.88Å; C102-Q229 WeakPolarHBondContact O-CB 3.45Å; C102-Q229 PolarHBondContact O-N 3.28Å
103N92.7Very high92.1Very high41 Ų4136 Ų3622%0.21919%0.188CC..  trans-115.3127.7175.3-167-54.9000112Y99 S105 R166Y99-N103 HydrophobicContact CD1-CB 4.34Å; Y99-N103 HydrophobicContact CD2-CB 3.81Å; Y99-N103 HydrophobicContact CE1-CB 4.17Å; Y99-N103 HydrophobicContact CE2-CB 3.63Å; Y99-N103 WeakPolarHBondContact CE2-ND2 3.28Å; Y99-N103 HydrophobicContact CG-CB 4.16Å; Y99-N103 WeakPolarHBondContact O-CB 3.29Å; Y99-N103 PolarHBondContact O-N 3.48Å; N103-S105 VanDerWaalsContact C-N 3.29Å; N103-S105 PolarHBondContact O-N 2.66Å; N103-S105 WeakPolarHBondContact OD1-CB 3.5Å; N103-S105 PolarHBondContact OD1-N 2.82Å; N103-S105 PolarHBondContact OD1-OG 2.92Å; N103-R166 PolarHBondContact O-NH1 3.02Å
104A92Very high92.2Very high4 Ų432.1 Ų32.13%0.03316%0.163CC..  trans-88.926.5-177.600000114.4Y106 A107 H161 A163 Q229A104-Y106 HydrophobicContact CB-CD1 4.49Å; A104-Y106 HydrophobicContact CB-CE1 4.14Å; A104-Y106 PolarHBondContact O-N 3.33Å; A104-A107 VanDerWaalsContact O-CB 3.3Å; A104-A107 WeakPolarHBondContact O-CB 3.22Å; A104-A107 PolarHBondContact O-N 3.38Å; A104-H161 HydrophobicContact CB-CB 4.31Å; A104-H161 VanDerWaalsContact CB-O 3.29Å; A104-H161 WeakPolarHBondContact CB-O 3.22Å; A104-A163 HydrophobicContact CB-CB 4.33Å; A104-Q229 HydrophobicContact CB-CG 4.47Å; A104-Q229 VanDerWaalsContact CB-NE2 3.32Å
105S89.3Confident92.3Very high17 Ų1726.3 Ų26.312%0.11914%0.136CC..G310 helixtrans-57.1-20.3-18050.90000115L7 Y99 N103 A107 R166L7-S105 VanDerWaalsContact CD1-CB 3.47Å; L7-S105 VanDerWaalsContact CD1-OG 3.23Å; L7-S105 WeakPolarHBondContact CD1-OG 3.32Å; Y99-S105 WeakPolarHBondContact CE1-OG 3.22Å; Y99-S105 WeakPolarHBondContact OH-CB 3.28Å; Y99-S105 PolarHBondContact OH-OG 3.42Å; N103-S105 VanDerWaalsContact C-N 3.29Å; N103-S105 PolarHBondContact O-N 2.66Å; N103-S105 WeakPolarHBondContact OD1-CB 3.5Å; N103-S105 PolarHBondContact OD1-N 2.82Å; N103-S105 PolarHBondContact OD1-OG 2.92Å; S105-A107 PolarHBondContact O-N 3.01Å; S105-R166 PolarHBondContact OG-NH2 2.94Å
106Y89.4Confident92.4Very high6 Ų623.2 Ų23.22%0.02412%0.123CC..G310 helixtrans-64.3-16.6172.279.3-80.3000113.8M84 E87 A104 H108 T111 G112 T115 T162 G165 R166M84-Y106 HydrophobicContact CE-CD2 4.05Å; E87-Y106 WeakPolarHBondContact OE2-CB 3.39Å; A104-Y106 HydrophobicContact CB-CD1 4.49Å; A104-Y106 HydrophobicContact CB-CE1 4.14Å; A104-Y106 PolarHBondContact O-N 3.33Å; Y106-H108 PolarHBondContact O-N 2.98Å; Y106-H108 VanDerWaalsContact O-N 3.16Å; Y106-T111 CarbonylContact O-C 3.16Å; Y106-T111 WeakPolarHBondContact O-CB 3.34Å; Y106-T111 PolarHBondContact O-OG1 3.37Å; Y106-G112 PolarHBondContact O-N 3.36Å; Y106-T115 HydrophobicContact CD2-CG2 4.32Å; Y106-T115 WeakPolarHBondContact CD2-OG1 3.45Å; Y106-T115 HydrophobicContact CE2-CG2 3.59Å; Y106-T115 WeakPolarHBondContact CE2-OG1 3.47Å; Y106-T162 WeakPolarHBondContact CE1-O 3.48Å; Y106-T162 PolarHBondContact OH-O 3.36Å; Y106-G165 VanDerWaalsContact OH-CA 3.26Å; Y106-G165 WeakPolarHBondContact OH-CA 3.49Å; Y106-R166 HydrophobicContact CD1-CB 3.63Å; Y106-R166 HydrophobicContact CD1-CG 4.45Å; Y106-R166 HydrophobicContact CD2-CB 4.36Å; Y106-R166 HydrophobicContact CE1-CB 3.98Å; Y106-R166 HydrophobicContact CG-CB 3.85Å; Y106-R166 HydrophobicContact CG-CG 4.31Å; Y106-R166 VanDerWaalsContact CZ-N 3.32Å
107A88.6Confident92.5Very high5 Ų524 Ų244%0.04112%0.12CC..G310 helixtrans-741.6-17900000114A104 S105 G112A104-A107 VanDerWaalsContact O-CB 3.3Å; A104-A107 WeakPolarHBondContact O-CB 3.22Å; A104-A107 PolarHBondContact O-N 3.38Å; S105-A107 PolarHBondContact O-N 3.01Å; A107-G112 VanDerWaalsContact O-CA 3.28Å; A107-G112 WeakPolarHBondContact O-CA 3.42Å
108H86Confident92.7Very high55 Ų5521.5 Ų21.526%0.25511%0.109SC..SBendtrans-113.1157.1-178.1-59-81.1000112.9Y106 T111 G112Y106-H108 PolarHBondContact O-N 2.98Å; Y106-H108 VanDerWaalsContact O-N 3.16Å; H108-T111 PolarHBondContact O-OG1 2.91Å; H108-T111 VanDerWaalsContact O-OG1 3.08Å; H108-G112 PolarHBondContact O-N 2.92Å; H108-G112 VanDerWaalsContact O-N 3.09Å
109G87.6Confident92.8Very high19 Ų1916.7 Ų16.720%0.1969%0.086CC..Hα-helixtrans58.5-138.8175.700000113.6F20 T111 G112 F113F20-G109 WeakPolarHBondContact CD1-O 2.73Å; G109-T111 PolarHBondContact O-N 2.9Å; G109-G112 PolarHBondContact O-N 3.42Å; G109-F113 PolarHBondContact O-N 3.43Å
110V91.8Very high92.9Very high4 Ų416.9 Ų16.92%0.0249%0.09CC..Hα-helixtrans-55.8-51.3-178.3174.90000111.5Y10 V13 E17 R83 G112 F113 W114Y10-V110 HydrophobicContact CD1-CG1 4.27Å; Y10-V110 HydrophobicContact CD1-CG2 4.47Å; Y10-V110 HydrophobicContact CD2-CB 4.08Å; Y10-V110 HydrophobicContact CD2-CG2 3.8Å; Y10-V110 HydrophobicContact CE1-CB 4.25Å; Y10-V110 HydrophobicContact CE1-CG1 3.81Å; Y10-V110 HydrophobicContact CE2-CB 3.71Å; Y10-V110 HydrophobicContact CE2-CG1 4.19Å; Y10-V110 HydrophobicContact CE2-CG2 3.98Å; Y10-V110 HydrophobicContact CG-CG2 4.07Å; V13-V110 HydrophobicContact CG1-CG2 3.85Å; V13-V110 HydrophobicContact CG2-CG2 4.3Å; E17-V110 HydrophobicContact CB-CG2 4.23Å; R83-V110 HydrophobicContact CB-CG1 4.14Å; V110-G112 VanDerWaalsContact C-N 3.28Å; V110-G112 PolarHBondContact O-N 3.43Å; V110-F113 WeakPolarHBondContact O-CB 3.44Å; V110-F113 PolarHBondContact O-N 3.43Å; V110-W114 PolarHBondContact O-N 2.79Å; V110-W114 VanDerWaalsContact O-N 3.12Å
111T93.2Very high93.1Very high1 Ų117.3 Ų17.31%0.0069%0.093CC..Hα-helixtrans-65.8-32.9-179.747.60000112.4Y10 M84 E87 Y106 H108 G109 W114 T115Y10-T111 WeakPolarHBondContact OH-CG2 3.36Å; M84-T111 HydrophobicContact CE-CG2 4.25Å; M84-T111 VanDerWaalsContact SD-CA 3.59Å; M84-T111 VanDerWaalsContact SD-CB 3.6Å; M84-T111 HydrophobicContact SD-CG2 3.64Å; E87-T111 HydrophobicContact CB-CG2 3.44Å; E87-T111 VanDerWaalsContact CB-CG2 3.44Å; E87-T111 HydrophobicContact CG-CG2 3.85Å; Y106-T111 CarbonylContact O-C 3.16Å; Y106-T111 WeakPolarHBondContact O-CB 3.34Å; Y106-T111 PolarHBondContact O-OG1 3.37Å; H108-T111 PolarHBondContact O-OG1 2.91Å; H108-T111 VanDerWaalsContact O-OG1 3.08Å; G109-T111 PolarHBondContact O-N 2.9Å; T111-W114 PolarHBondContact O-N 3.42Å; T111-T115 VanDerWaalsContact O-CB 3.32Å; T111-T115 WeakPolarHBondContact O-CB 3.35Å; T111-T115 PolarHBondContact O-N 3.1Å; T111-T115 PolarHBondContact O-OG1 3.15Å
112G92.9Very high93.2Very high0 Ų017.4 Ų17.40%09%0.094CC..Hα-helixtrans-60.3-47.5173.700000111.9F20 Y106 A107 H108 G109 V110 W114 T115 Q116F20-G112 VanDerWaalsContact CZ-C 3.41Å; F20-G112 WeakPolarHBondContact CZ-O 3.38Å; Y106-G112 PolarHBondContact O-N 3.36Å; A107-G112 VanDerWaalsContact O-CA 3.28Å; A107-G112 WeakPolarHBondContact O-CA 3.42Å; H108-G112 PolarHBondContact O-N 2.92Å; H108-G112 VanDerWaalsContact O-N 3.09Å; G109-G112 PolarHBondContact O-N 3.42Å; V110-G112 VanDerWaalsContact C-N 3.28Å; V110-G112 PolarHBondContact O-N 3.43Å; G112-W114 PolarHBondContact O-N 2.96Å; G112-T115 WeakPolarHBondContact O-CB 3.42Å; G112-T115 PolarHBondContact O-N 3.27Å; G112-Q116 PolarHBondContact O-N 2.61Å
113F94.2Very high93.3Very high31 Ų3118.7 Ų18.714%0.13610%0.104CC..Hα-helixtrans-57.6-49.9175.3175.3-96.9000111.4F16 E17 F20 G109 V110 T115 Q116 M117F16-F113 HydrophobicContact CD2-CD1 4.25Å; F16-F113 AromaticContact CD2-CE1 3.62Å; F16-F113 HydrophobicContact CD2-CE1 3.62Å; F16-F113 HydrophobicContact CD2-CE2 4.17Å; F16-F113 AromaticContact CD2-CZ 3.58Å; F16-F113 HydrophobicContact CD2-CZ 3.58Å; F16-F113 HydrophobicContact CE2-CD1 4.29Å; F16-F113 AromaticContact CE2-CE1 3.63Å; F16-F113 HydrophobicContact CE2-CE1 3.63Å; F16-F113 HydrophobicContact CE2-CZ 4.01Å; E17-F113 HydrophobicContact CG-CD1 4.13Å; F20-F113 HydrophobicContact CB-CB 3.88Å; F20-F113 HydrophobicContact CB-CD2 4.12Å; F20-F113 HydrophobicContact CB-CG 4.43Å; F20-F113 HydrophobicContact CD1-CB 4.05Å; F20-F113 HydrophobicContact CD2-CB 3.95Å; F20-F113 AromaticContact CD2-CD2 3.89Å; F20-F113 HydrophobicContact CD2-CD2 3.89Å; F20-F113 HydrophobicContact CD2-CG 4.43Å; F20-F113 VanDerWaalsContact CE1-N 3.3Å; F20-F113 HydrophobicContact CG-CB 3.67Å; F20-F113 HydrophobicContact CG-CD2 4.2Å; F20-F113 HydrophobicContact CG-CG 4.45Å; G109-F113 PolarHBondContact O-N 3.43Å; V110-F113 WeakPolarHBondContact O-CB 3.44Å; V110-F113 PolarHBondContact O-N 3.43Å; F113-T115 VanDerWaalsContact C-N 3.25Å; F113-T115 PolarHBondContact O-N 3.38Å; F113-Q116 WeakPolarHBondContact O-CB 3.31Å; F113-Q116 PolarHBondContact O-N 2.95Å; F113-Q116 VanDerWaalsContact O-N 3.12Å; F113-M117 HydrophobicContact CD1-CG 4.12Å; F113-M117 HydrophobicContact CD2-CE 4.49Å; F113-M117 HydrophobicContact CE1-CG 3.62Å; F113-M117 HydrophobicContact CE2-CE 3.98Å; F113-M117 HydrophobicContact CE2-CG 4.1Å; F113-M117 HydrophobicContact CE2-SD 4.23Å; F113-M117 HydrophobicContact CZ-CE 4.29Å; F113-M117 HydrophobicContact CZ-CG 3.61Å; F113-M117 HydrophobicContact CZ-SD 3.93Å; F113-M117 WeakPolarHBondContact O-CG 3.36Å; F113-M117 PolarHBondContact O-N 3.39Å
114W95.5Very high93.5Very high18 Ų1821.6 Ų21.67%0.06812%0.115CC..Hα-helixtrans-68.3-24.5-179.6-75.3100.5000113.5E17 F76 F79 G80 R83 M84 V110 T111 G112 F118 Y173E17-W114 PolarHBondContact OE1-NE1 3.36Å; F76-W114 HydrophobicContact CD2-CZ3 4.07Å; F76-W114 HydrophobicContact CE2-CE3 4.36Å; F76-W114 AromaticContact CE2-CZ3 3.88Å; F76-W114 HydrophobicContact CE2-CZ3 3.88Å; F79-W114 HydrophobicContact CB-CH2 3.53Å; F79-W114 HydrophobicContact CB-CZ2 4.16Å; F79-W114 HydrophobicContact CB-CZ3 4.1Å; G80-W114 VanDerWaalsContact CA-CE3 3.41Å; R83-W114 VanDerWaalsContact CB-CD1 3.41Å; R83-W114 HydrophobicContact CB-CD2 4.22Å; R83-W114 HydrophobicContact CB-CG 3.96Å; R83-W114 HydrophobicContact CG-CD2 4.43Å; R83-W114 HydrophobicContact CG-CZ2 3.96Å; M84-W114 HydrophobicContact CG-CB 4.21Å; M84-W114 HydrophobicContact SD-CB 3.86Å; V110-W114 PolarHBondContact O-N 2.79Å; V110-W114 VanDerWaalsContact O-N 3.12Å; T111-W114 PolarHBondContact O-N 3.42Å; G112-W114 PolarHBondContact O-N 2.96Å; W114-F118 WeakPolarHBondContact O-CB 3.39Å; W114-F118 PolarHBondContact O-N 3.22Å; W114-Y173 PolarHBondContact O-OH 2.97Å
115T95.6Very high93.7Very high6 Ų621.5 Ų21.54%0.03711%0.114CC..Hα-helixtrans-72.7-39.5170.7-57.50000111.1Y106 T111 G112 F113 F118 A119 Y158 V169Y106-T115 HydrophobicContact CD2-CG2 4.32Å; Y106-T115 WeakPolarHBondContact CD2-OG1 3.45Å; Y106-T115 HydrophobicContact CE2-CG2 3.59Å; Y106-T115 WeakPolarHBondContact CE2-OG1 3.47Å; T111-T115 VanDerWaalsContact O-CB 3.32Å; T111-T115 WeakPolarHBondContact O-CB 3.35Å; T111-T115 PolarHBondContact O-N 3.1Å; T111-T115 PolarHBondContact O-OG1 3.15Å; G112-T115 WeakPolarHBondContact O-CB 3.42Å; G112-T115 PolarHBondContact O-N 3.27Å; F113-T115 VanDerWaalsContact C-N 3.25Å; F113-T115 PolarHBondContact O-N 3.38Å; T115-F118 WeakPolarHBondContact O-CB 3.44Å; T115-F118 PolarHBondContact O-N 2.95Å; T115-A119 PolarHBondContact O-N 3.02Å; T115-Y158 HydrophobicContact CG2-CD2 3.87Å; T115-Y158 HydrophobicContact CG2-CE2 3.77Å; T115-V169 HydrophobicContact CG2-CG2 4.4Å
116Q94.8Very high94.1Very high31 Ų3121.7 Ų21.715%0.14511%0.114CC..Hα-helixtrans-63-48173.1-170-172.319.600110.7F20 S25 G112 F113 F118 A119 L120 Y158F20-Q116 HydrophobicContact CE2-CB 4.1Å; F20-Q116 VanDerWaalsContact CE2-OE1 3.25Å; F20-Q116 HydrophobicContact CZ-CB 4.48Å; S25-Q116 WeakPolarHBondContact OG-CG 3.41Å; S25-Q116 PolarHBondContact OG-NE2 3.26Å; G112-Q116 PolarHBondContact O-N 2.61Å; F113-Q116 WeakPolarHBondContact O-CB 3.31Å; F113-Q116 PolarHBondContact O-N 2.95Å; F113-Q116 VanDerWaalsContact O-N 3.12Å; Q116-F118 PolarHBondContact O-N 3.35Å; Q116-A119 PolarHBondContact O-N 3.26Å; Q116-A119 VanDerWaalsContact O-N 3.09Å; Q116-L120 HydrophobicContact CG-CD1 4.31Å; Q116-L120 WeakPolarHBondContact O-CG 3.42Å; Q116-L120 PolarHBondContact O-N 3.29Å; Q116-Y158 HydrophobicContact CB-CE2 4.1Å; Q116-Y158 WeakPolarHBondContact CB-OH 3.32Å
117M95.9Very high94.4Very high47 Ų4722.1 Ų22.123%0.23212%0.119CC..Hα-helixtrans-61.2-37178.6-66.5-56104.900111.3F76 F113 L120 S121F76-M117 HydrophobicContact CE2-CB 3.89Å; F76-M117 HydrophobicContact CZ-CB 3.89Å; F113-M117 HydrophobicContact CD1-CG 4.12Å; F113-M117 HydrophobicContact CD2-CE 4.49Å; F113-M117 HydrophobicContact CE1-CG 3.62Å; F113-M117 HydrophobicContact CE2-CE 3.98Å; F113-M117 HydrophobicContact CE2-CG 4.1Å; F113-M117 HydrophobicContact CE2-SD 4.23Å; F113-M117 HydrophobicContact CZ-CE 4.29Å; F113-M117 HydrophobicContact CZ-CG 3.61Å; F113-M117 HydrophobicContact CZ-SD 3.93Å; F113-M117 WeakPolarHBondContact O-CG 3.36Å; F113-M117 PolarHBondContact O-N 3.39Å; M117-L120 HydrophobicContact CE-CD1 3.88Å; M117-L120 PolarHBondContact O-N 2.92Å; M117-S121 WeakPolarHBondContact O-CB 3.22Å; M117-S121 PolarHBondContact O-N 3.46Å
118F97.1Very high94.8Very high12 Ų1222.7 Ų22.75%0.05312%0.122CC..Hα-helixtrans-58.5-46.5172.3-179.9-93.2000112.2W114 T115 Q116 L120 S121 T154 V169 N172 Y173W114-F118 WeakPolarHBondContact O-CB 3.39Å; W114-F118 PolarHBondContact O-N 3.22Å; T115-F118 WeakPolarHBondContact O-CB 3.44Å; T115-F118 PolarHBondContact O-N 2.95Å; Q116-F118 PolarHBondContact O-N 3.35Å; F118-L120 PolarHBondContact O-N 2.76Å; F118-S121 PolarHBondContact O-N 3.33Å; F118-S121 PolarHBondContact O-OG 2.8Å; F118-T154 HydrophobicContact CD1-CG2 3.71Å; F118-T154 HydrophobicContact CE1-CG2 3.66Å; F118-V169 HydrophobicContact CB-CG1 4.08Å; F118-V169 HydrophobicContact CD1-CB 4.5Å; F118-V169 HydrophobicContact CD1-CG1 4.37Å; F118-V169 HydrophobicContact CD1-CG2 3.69Å; F118-V169 HydrophobicContact CD2-CG1 3.88Å; F118-V169 HydrophobicContact CE1-CG2 3.87Å; F118-V169 HydrophobicContact CE2-CG1 4.37Å; F118-V169 HydrophobicContact CG-CB 4.44Å; F118-V169 HydrophobicContact CG-CG1 3.86Å; F118-V169 HydrophobicContact CG-CG2 4.04Å; F118-V169 HydrophobicContact CZ-CG2 4.36Å; F118-N172 HydrophobicContact CE2-CB 3.65Å; F118-N172 WeakPolarHBondContact CE2-OD1 3.36Å; F118-N172 HydrophobicContact CZ-CB 3.76Å; F118-Y173 WeakPolarHBondContact CA-OH 3.23Å; F118-Y173 HydrophobicContact CB-CE2 4.04Å; F118-Y173 WeakPolarHBondContact CB-OH 3.41Å; F118-Y173 HydrophobicContact CD2-CD1 4.29Å; F118-Y173 HydrophobicContact CD2-CD2 4.21Å; F118-Y173 AromaticContact CD2-CE1 3.95Å; F118-Y173 HydrophobicContact CD2-CE1 3.95Å; F118-Y173 AromaticContact CD2-CE2 3.85Å; F118-Y173 HydrophobicContact CD2-CE2 3.85Å; F118-Y173 HydrophobicContact CD2-CG 4.42Å; F118-Y173 AromaticContact CD2-CZ 3.72Å; F118-Y173 HydrophobicContact CG-CE2 4.37Å; F118-Y173 PolarHBondContact N-OH 3.36Å
119A96Very high95.3Very high0 Ų020 Ų200%011%0.11CC..Hα-helixtrans-62.7-45.2179.500000111.3M29 T115 Q116 S121 K122 T154 W155 Y158M29-A119 HydrophobicContact CE-CB 4.03Å; T115-A119 PolarHBondContact O-N 3.02Å; Q116-A119 PolarHBondContact O-N 3.26Å; Q116-A119 VanDerWaalsContact O-N 3.09Å; A119-S121 VanDerWaalsContact C-N 3.33Å; A119-S121 PolarHBondContact O-N 3.12Å; A119-K122 PolarHBondContact O-N 3.25Å; A119-T154 HydrophobicContact CB-CG2 3.9Å; A119-W155 PolarHBondContact O-NE1 3.38Å; A119-Y158 HydrophobicContact CB-CD2 4.02Å; A119-Y158 HydrophobicContact CB-CG 4.3Å
120L95.6Very high95.7Very high54 Ų5421.7 Ų21.728%0.28312%0.116SC..Hα-helixtrans-67.2-33178.1-63.6177.3000112.5W28 Q116 M117 F118 K122 A123 F124 W155W28-L120 HydrophobicContact CH2-CD2 4.01Å; W28-L120 HydrophobicContact CZ3-CD2 3.93Å; Q116-L120 HydrophobicContact CG-CD1 4.31Å; Q116-L120 WeakPolarHBondContact O-CG 3.42Å; Q116-L120 PolarHBondContact O-N 3.29Å; M117-L120 HydrophobicContact CE-CD1 3.88Å; M117-L120 PolarHBondContact O-N 2.92Å; F118-L120 PolarHBondContact O-N 2.76Å; L120-K122 PolarHBondContact O-N 3.09Å; L120-K122 VanDerWaalsContact O-N 3.16Å; L120-A123 PolarHBondContact O-N 3.36Å; L120-A123 VanDerWaalsContact O-N 3.13Å; L120-F124 PolarHBondContact O-N 2.96Å; L120-W155 HydrophobicContact CD2-CZ2 4.13Å
121S97.2Very high96Very high8 Ų822.9 Ų22.96%0.05612%0.121CC..Hα-helixtrans-59.6-29.8-179.787.10000112.2F76 M117 F118 A119 A123 F124 E125F76-S121 VanDerWaalsContact CE1-CB 3.45Å; M117-S121 WeakPolarHBondContact O-CB 3.22Å; M117-S121 PolarHBondContact O-N 3.46Å; F118-S121 PolarHBondContact O-N 3.33Å; F118-S121 PolarHBondContact O-OG 2.8Å; A119-S121 VanDerWaalsContact C-N 3.33Å; A119-S121 PolarHBondContact O-N 3.12Å; S121-A123 VanDerWaalsContact C-N 3.26Å; S121-A123 PolarHBondContact O-N 3.41Å; S121-F124 CarbonylContact O-C 3.56Å; S121-F124 WeakPolarHBondContact O-CA 3.26Å; S121-F124 WeakPolarHBondContact O-CB 3.27Å; S121-F124 PolarHBondContact O-N 3.07Å; S121-E125 WeakPolarHBondContact O-CB 3.15Å; S121-E125 VanDerWaalsContact O-CG 3.25Å; S121-E125 WeakPolarHBondContact O-CG 3.44Å; S121-E125 PolarHBondContact O-N 2.91Å; S121-E125 PolarHBondContact OG-OE1 3.42Å
122K97.2Very high96.1Very high3 Ų324.6 Ų24.61%0.01313%0.13CC..Hα-helixtrans-62.8-32.1179.4-56.3-47.3173.4-165.30113.4A119 L120 E125 V150 L151 T154 N172A119-K122 PolarHBondContact O-N 3.25Å; L120-K122 PolarHBondContact O-N 3.09Å; L120-K122 VanDerWaalsContact O-N 3.16Å; K122-E125 WeakPolarHBondContact CD-OE2 3.35Å; K122-E125 IonicContact NZ-OE1 3.45Å; K122-E125 PolarHBondContact NZ-OE1 3.31Å; K122-E125 IonicContact NZ-OE2 2.86Å; K122-E125 PolarHBondContact NZ-OE2 2.89Å; K122-V150 HydrophobicContact CD-CG2 4.33Å; K122-L151 HydrophobicContact CB-CB 4.39Å; K122-L151 HydrophobicContact CB-CD1 3.96Å; K122-T154 HydrophobicContact CG-CG2 4.31Å; K122-N172 PolarHBondContact NZ-OD1 3.37Å
123A96.5Very high96.3Very high30 Ų3024.8 Ų24.825%0.24813%0.13CC..Hα-helixtrans-72.5-37.8172.300000111L39 L120 S121 L126 L151 W155L39-A123 HydrophobicContact CD1-CB 4.28Å; L120-A123 PolarHBondContact O-N 3.36Å; L120-A123 VanDerWaalsContact O-N 3.13Å; S121-A123 VanDerWaalsContact C-N 3.26Å; S121-A123 PolarHBondContact O-N 3.41Å; A123-L126 WeakPolarHBondContact O-CB 3.36Å; A123-L126 WeakPolarHBondContact O-CG 3.46Å; A123-L126 PolarHBondContact O-N 3.13Å; A123-L151 HydrophobicContact CB-CD1 4.07Å; A123-W155 HydrophobicContact CB-CZ2 4.09Å
124F96.6Very high96.3Very high102 Ų10225.1 Ų25.145%0.44713%0.134SC..Hα-helixtrans-68.2-40.2178.1-163.9-100.3000112.2W69 L72 L73 L120 S121 L126 G127W69-F124 HydrophobicContact CE3-CE1 4.1Å; W69-F124 HydrophobicContact CE3-CZ 4.21Å; W69-F124 AromaticContact CH2-CD1 3.52Å; W69-F124 HydrophobicContact CH2-CD1 3.52Å; W69-F124 HydrophobicContact CH2-CD2 4.24Å; W69-F124 AromaticContact CH2-CE1 3.18Å; W69-F124 HydrophobicContact CH2-CE1 3.18Å; W69-F124 AromaticContact CH2-CE2 3.96Å; W69-F124 HydrophobicContact CH2-CE2 3.96Å; W69-F124 HydrophobicContact CH2-CG 4.05Å; W69-F124 AromaticContact CH2-CZ 3.43Å; W69-F124 HydrophobicContact CH2-CZ 3.43Å; W69-F124 VanDerWaalsContact CH2-CZ 3.43Å; W69-F124 WeakPolarHBondContact CH2-O 3.34Å; W69-F124 AromaticContact CZ2-CD1 3.88Å; W69-F124 HydrophobicContact CZ2-CD1 3.88Å; W69-F124 AromaticContact CZ2-CE1 3.78Å; W69-F124 HydrophobicContact CZ2-CE1 3.78Å; W69-F124 HydrophobicContact CZ2-CZ 4.44Å; W69-F124 WeakPolarHBondContact CZ2-O 3.4Å; W69-F124 HydrophobicContact CZ3-CD1 4.2Å; W69-F124 AromaticContact CZ3-CE1 3.38Å; W69-F124 HydrophobicContact CZ3-CE1 3.38Å; W69-F124 HydrophobicContact CZ3-CE2 4.04Å; W69-F124 AromaticContact CZ3-CZ 3.29Å; W69-F124 HydrophobicContact CZ3-CZ 3.29Å; L72-F124 HydrophobicContact CD2-CE1 3.92Å; L72-F124 HydrophobicContact CD2-CZ 4.02Å; L73-F124 HydrophobicContact CD2-CD1 3.92Å; L73-F124 HydrophobicContact CD2-CE1 4.26Å; L120-F124 PolarHBondContact O-N 2.96Å; S121-F124 CarbonylContact O-C 3.56Å; S121-F124 WeakPolarHBondContact O-CA 3.26Å; S121-F124 WeakPolarHBondContact O-CB 3.27Å; S121-F124 PolarHBondContact O-N 3.07Å; F124-L126 PolarHBondContact O-N 3.33Å; F124-L126 VanDerWaalsContact O-N 3.09Å; F124-G127 PolarHBondContact O-N 3.02Å
125E97.7Very high96.3Very high2 Ų226.9 Ų26.91%0.00914%0.14CC..THydrogen-bonded Turntrans-59.5-18.8176.8-72.8169.2-150.300112.9L73 S121 K122 G127 D128 H176L73-E125 HydrophobicContact CD2-CG 4.41Å; S121-E125 WeakPolarHBondContact O-CB 3.15Å; S121-E125 VanDerWaalsContact O-CG 3.25Å; S121-E125 WeakPolarHBondContact O-CG 3.44Å; S121-E125 PolarHBondContact O-N 2.91Å; S121-E125 PolarHBondContact OG-OE1 3.42Å; K122-E125 WeakPolarHBondContact CD-OE2 3.35Å; K122-E125 IonicContact NZ-OE1 3.45Å; K122-E125 PolarHBondContact NZ-OE1 3.31Å; K122-E125 IonicContact NZ-OE2 2.86Å; K122-E125 PolarHBondContact NZ-OE2 2.89Å; E125-G127 PolarHBondContact O-N 3.49Å; E125-G127 VanDerWaalsContact O-N 3.1Å; E125-D128 WeakPolarHBondContact O-CB 3.42Å; E125-D128 PolarHBondContact O-N 3.06Å; E125-H176 IonicContact OE1-CE1 3.32Å; E125-H176 IonicContact OE1-ND1 2.66Å; E125-H176 IonicContact OE2-CE1 3.93Å; E125-H176 PolarHBondContact OE2-CE1 2.76Å; E125-H176 IonicContact OE2-ND1 3.46Å
126L96.6Very high96.2Very high22 Ų2230.9 Ų30.912%0.11516%0.157CC..THydrogen-bonded Turntrans-58.5-22.1170.9-59.9-176.7000112.8Y43 A123 F124 D128 T129 H147 L151Y43-L126 HydrophobicContact CD1-CD2 4.48Å; Y43-L126 HydrophobicContact CD2-CB 4.01Å; Y43-L126 HydrophobicContact CD2-CD1 4.18Å; Y43-L126 HydrophobicContact CD2-CD2 3.76Å; Y43-L126 HydrophobicContact CD2-CG 4.2Å; Y43-L126 HydrophobicContact CE2-CB 4.19Å; Y43-L126 HydrophobicContact CE2-CD2 3.81Å; Y43-L126 HydrophobicContact CG-CD1 4.39Å; Y43-L126 HydrophobicContact CG-CD2 4.08Å; A123-L126 WeakPolarHBondContact O-CB 3.36Å; A123-L126 WeakPolarHBondContact O-CG 3.46Å; A123-L126 PolarHBondContact O-N 3.13Å; F124-L126 PolarHBondContact O-N 3.33Å; F124-L126 VanDerWaalsContact O-N 3.09Å; L126-D128 PolarHBondContact O-N 2.99Å; L126-T129 PolarHBondContact O-N 3.07Å; L126-H147 HydrophobicContact CD2-CB 3.87Å; L126-L151 HydrophobicContact CD1-CD2 3.91Å; L126-L151 HydrophobicContact CD2-CD2 4.44Å; L126-L151 HydrophobicContact CG-CD2 4.46Å
127G96.4Very high96.2Very high14 Ų1432.9 Ų32.914%0.14416%0.163CC..Hα-helixtrans-58-26.9172.600000113.7F124 E125 T129 V130 F131F124-G127 PolarHBondContact O-N 3.02Å; E125-G127 PolarHBondContact O-N 3.49Å; E125-G127 VanDerWaalsContact O-N 3.1Å; G127-T129 PolarHBondContact O-N 3.39Å; G127-V130 VanDerWaalsContact O-CB 3.3Å; G127-V130 WeakPolarHBondContact O-CB 3.37Å; G127-V130 PolarHBondContact O-N 3.09Å; G127-F131 WeakPolarHBondContact O-CD2 3.27Å; G127-F131 PolarHBondContact O-N 3.45Å
128D96.6Very high96Very high17 Ų1735.4 Ų35.49%0.09118%0.183CC..Hα-helixtrans-54.9-42.6175.6-69.8-14000110.9W69 E125 L126 V130 F131 I132 H147 Y180W69-D128 PolarHBondContact NE1-OD1 2.65Å; E125-D128 WeakPolarHBondContact O-CB 3.42Å; E125-D128 PolarHBondContact O-N 3.06Å; L126-D128 PolarHBondContact O-N 2.99Å; D128-V130 VanDerWaalsContact C-N 3.34Å; D128-V130 PolarHBondContact O-N 2.85Å; D128-F131 PolarHBondContact O-N 2.83Å; D128-I132 WeakPolarHBondContact O-CG1 3.18Å; D128-I132 PolarHBondContact O-N 3.15Å; D128-I132 VanDerWaalsContact O-N 3.09Å; D128-H147 IonicContact OD2-CE1 2.79Å; D128-Y180 WeakPolarHBondContact OD2-CE1 3.16Å; D128-Y180 PolarHBondContact OD2-OH 2.82Å
129T97.2Very high95.9Very high0 Ų035.7 Ų35.70%019%0.186CC..Hα-helixtrans-70.3-31.9-179.4-48.50000112.3Y43 I47 L126 G127 F131 I132 V133 V139 H143Y43-T129 VanDerWaalsContact CE2-CB 3.49Å; Y43-T129 HydrophobicContact CE2-CG2 3.78Å; Y43-T129 VanDerWaalsContact CE2-OG1 3.27Å; Y43-T129 WeakPolarHBondContact CE2-OG1 3.36Å; Y43-T129 PolarHBondContact OH-OG1 3.35Å; I47-T129 HydrophobicContact CD1-CG2 3.96Å; I47-T129 HydrophobicContact CG1-CG2 3.63Å; L126-T129 PolarHBondContact O-N 3.07Å; G127-T129 PolarHBondContact O-N 3.39Å; T129-F131 VanDerWaalsContact C-N 3.3Å; T129-F131 PolarHBondContact O-N 3.46Å; T129-I132 PolarHBondContact O-N 2.89Å; T129-V133 HydrophobicContact CG2-CG2 4.3Å; T129-V133 WeakPolarHBondContact O-CG2 3.48Å; T129-V133 PolarHBondContact O-N 3.43Å; T129-V139 HydrophobicContact CG2-CG1 4.18Å; T129-V139 HydrophobicContact CG2-CG2 4.37Å; T129-H143 PolarHBondContact OG1-CD2 2.86Å; T129-H143 PolarHBondContact OG1-NE2 3.27Å
130V96.2Very high95.8Very high54 Ų5439.6 Ų39.633%0.32721%0.206SC..Hα-helixtrans-58.3-47.4173.2-1790000109.5F46 G127 D128 I132 V133 L134F46-V130 HydrophobicContact CE1-CB 4.27Å; F46-V130 HydrophobicContact CE1-CG2 3.79Å; F46-V130 HydrophobicContact CE2-CG2 4.48Å; F46-V130 HydrophobicContact CZ-CB 4.05Å; F46-V130 HydrophobicContact CZ-CG1 4Å; F46-V130 HydrophobicContact CZ-CG2 3.73Å; G127-V130 VanDerWaalsContact O-CB 3.3Å; G127-V130 WeakPolarHBondContact O-CB 3.37Å; G127-V130 PolarHBondContact O-N 3.09Å; D128-V130 VanDerWaalsContact C-N 3.34Å; D128-V130 PolarHBondContact O-N 2.85Å; V130-I132 PolarHBondContact O-N 3.49Å; V130-V133 PolarHBondContact O-N 3.17Å; V130-L134 HydrophobicContact CG1-CD1 3.8Å; V130-L134 HydrophobicContact CG1-CG 4.29Å; V130-L134 WeakPolarHBondContact O-CB 3.02Å; V130-L134 VanDerWaalsContact O-CG 3.25Å; V130-L134 WeakPolarHBondContact O-CG 3.27Å; V130-L134 PolarHBondContact O-N 3.26Å
131F96.2Very high95.8Very high28 Ų2841.9 Ų41.912%0.12321%0.214CC..Hα-helixtrans-63.8-39.3176.1-69.3-75.1000112.9L62 L65 L66 W69 G127 D128 T129 R135L62-F131 HydrophobicContact CB-CD1 4.22Å; L62-F131 HydrophobicContact CB-CE1 4.42Å; L62-F131 HydrophobicContact CD1-CD1 4.06Å; L62-F131 HydrophobicContact CD1-CE1 4.46Å; L65-F131 HydrophobicContact CB-CE1 4.01Å; L65-F131 HydrophobicContact CB-CZ 4.45Å; L66-F131 HydrophobicContact CB-CD1 4.17Å; L66-F131 HydrophobicContact CB-CE1 4.37Å; L66-F131 HydrophobicContact CD1-CB 3.95Å; L66-F131 HydrophobicContact CD1-CD1 4.21Å; L66-F131 HydrophobicContact CD1-CD2 4.04Å; L66-F131 HydrophobicContact CD1-CG 3.81Å; W69-F131 HydrophobicContact CB-CE2 3.87Å; W69-F131 HydrophobicContact CB-CZ 4.04Å; W69-F131 AromaticContact CD1-CE2 3.86Å; W69-F131 AromaticContact CD2-CE2 3.64Å; W69-F131 HydrophobicContact CD2-CE2 3.64Å; W69-F131 HydrophobicContact CD2-CZ 4.38Å; W69-F131 HydrophobicContact CE3-CE2 4.1Å; W69-F131 HydrophobicContact CG-CD2 4.27Å; W69-F131 AromaticContact CG-CE2 3.51Å; W69-F131 HydrophobicContact CG-CE2 3.51Å; W69-F131 HydrophobicContact CG-CZ 4.16Å; G127-F131 WeakPolarHBondContact O-CD2 3.27Å; G127-F131 PolarHBondContact O-N 3.45Å; D128-F131 PolarHBondContact O-N 2.83Å; T129-F131 VanDerWaalsContact C-N 3.3Å; T129-F131 PolarHBondContact O-N 3.46Å; F131-R135 VanDerWaalsContact O-CB 3.23Å; F131-R135 WeakPolarHBondContact O-CB 3.21Å; F131-R135 WeakPolarHBondContact O-CG 3.49Å; F131-R135 PolarHBondContact O-N 3.4Å
132I95.7Very high95.7Very high38 Ų3842.6 Ų42.620%0.19522%0.217CC..Hα-helixtrans-61.6-48.6177.7-66.5169.9000110.5D128 T129 V130 R135 K136 R137 V139D128-I132 WeakPolarHBondContact O-CG1 3.18Å; D128-I132 PolarHBondContact O-N 3.15Å; D128-I132 VanDerWaalsContact O-N 3.09Å; T129-I132 PolarHBondContact O-N 2.89Å; V130-I132 PolarHBondContact O-N 3.49Å; I132-R135 PolarHBondContact O-N 2.78Å; I132-K136 PolarHBondContact O-N 3.36Å; I132-R137 HydrophobicContact CG2-CB 3.86Å; I132-R137 WeakPolarHBondContact CG2-O 3.16Å; I132-R137 PolarHBondContact O-N 2.98Å; I132-V139 HydrophobicContact CB-CG2 4.41Å; I132-V139 HydrophobicContact CG2-CB 4.4Å; I132-V139 HydrophobicContact CG2-CG2 3.53Å
133V96.7Very high95.7Very high3 Ų344.2 Ų44.22%0.01822%0.224CC..Hα-helixtrans-63.7-49.4179.9172.10000111.1F46 G50 Q51 M54 T129 V130 R135 K136 V139F46-V133 HydrophobicContact CE1-CB 4.38Å; F46-V133 HydrophobicContact CE1-CG2 4.18Å; G50-V133 VanDerWaalsContact C-CG1 3.41Å; Q51-V133 HydrophobicContact CG-CG1 4.42Å; Q51-V133 HydrophobicContact CG-CG2 4.28Å; M54-V133 HydrophobicContact CG-CG1 4.24Å; T129-V133 HydrophobicContact CG2-CG2 4.3Å; T129-V133 WeakPolarHBondContact O-CG2 3.48Å; T129-V133 PolarHBondContact O-N 3.43Å; V130-V133 PolarHBondContact O-N 3.17Å; V133-R135 VanDerWaalsContact C-N 3.25Å; V133-R135 PolarHBondContact O-N 3.26Å; V133-K136 PolarHBondContact O-N 2.99Å; V133-V139 HydrophobicContact CG2-CG2 3.95Å
134L96.2Very high95.7Very high39 Ų3947.2 Ų47.220%0.20423%0.229CC..Hα-helixtrans-65.3-26.9-179.2-68.6179.9000113.4W53 M54 L60 L62 V130 K136W53-L134 HydrophobicContact CZ3-CD2 4.21Å; M54-L134 WeakPolarHBondContact CE-O 3.45Å; M54-L134 HydrophobicContact CG-CD2 4.49Å; M54-L134 HydrophobicContact SD-CD2 4.01Å; L60-L134 HydrophobicContact CD1-CB 4.29Å; L60-L134 HydrophobicContact CD1-CD2 4.18Å; L60-L134 PolarHBondContact N-O 2.81Å; L62-L134 HydrophobicContact CD1-CB 3.77Å; L62-L134 HydrophobicContact CD1-CD1 3.82Å; L62-L134 HydrophobicContact CD1-CG 4.48Å; V130-L134 HydrophobicContact CG1-CD1 3.8Å; V130-L134 HydrophobicContact CG1-CG 4.29Å; V130-L134 WeakPolarHBondContact O-CB 3.02Å; V130-L134 VanDerWaalsContact O-CG 3.25Å; V130-L134 WeakPolarHBondContact O-CG 3.27Å; V130-L134 PolarHBondContact O-N 3.26Å; L134-K136 VanDerWaalsContact C-N 3.32Å
135R94.9Very high95.7Very high54 Ų5445 Ų4520%0.20422%0.218CC..THydrogen-bonded Turntrans-87.41.5174.5-67.1176.471.8-148.91113.3P59 F131 I132 V133 R137P59-R135 WeakPolarHBondContact CB-O 3.38Å; F131-R135 VanDerWaalsContact O-CB 3.23Å; F131-R135 WeakPolarHBondContact O-CB 3.21Å; F131-R135 WeakPolarHBondContact O-CG 3.49Å; F131-R135 PolarHBondContact O-N 3.4Å; I132-R135 PolarHBondContact O-N 2.78Å; V133-R135 VanDerWaalsContact C-N 3.25Å; V133-R135 PolarHBondContact O-N 3.26Å; R135-R137 VanDerWaalsContact C-N 3.25Å; R135-R137 HydrophobicContact CB-CG 4.08Å; R135-R137 PolarHBondContact O-N 3.32Å
136K93.8Very high95.7Very high91 Ų9146 Ų4640%0.39622%0.223SC..THydrogen-bonded Turntrans5339.1-173.1-63.1-173.3145.6-1750113.6M54 E55 R57 P59 I132 V133 L134M54-K136 VanDerWaalsContact C-CE 3.47Å; M54-K136 HydrophobicContact CB-CG 4.38Å; M54-K136 HydrophobicContact CE-CG 4.07Å; M54-K136 WeakPolarHBondContact O-CE 3.19Å; M54-K136 PolarHBondContact O-NZ 3.37Å; E55-K136 PolarHBondContact O-NZ 2.72Å; R57-K136 WeakPolarHBondContact O-CE 3.2Å; R57-K136 PolarHBondContact O-NZ 2.66Å; P59-K136 HydrophobicContact CB-CB 4.12Å; P59-K136 HydrophobicContact CB-CD 4.18Å; P59-K136 HydrophobicContact CB-CG 4.1Å; I132-K136 PolarHBondContact O-N 3.36Å; V133-K136 PolarHBondContact O-N 2.99Å; L134-K136 VanDerWaalsContact C-N 3.32Å
137R93.1Very high95.7Very high72 Ų7245.4 Ų45.427%0.27222%0.22SC..  trans-88.9147.6171.9-64.2-64.2-179.3176.8-0.9109.4I132 R135 V139 D278I132-R137 HydrophobicContact CG2-CB 3.86Å; I132-R137 WeakPolarHBondContact CG2-O 3.16Å; I132-R137 PolarHBondContact O-N 2.98Å; R135-R137 VanDerWaalsContact C-N 3.25Å; R135-R137 HydrophobicContact CB-CG 4.08Å; R135-R137 PolarHBondContact O-N 3.32Å; R137-V139 PolarHBondContact O-N 3.47Å; R137-D278 PolarHBondContact NH1-O 2.89Å; R137-D278 VanDerWaalsContact NH2-CB 3.28Å; R137-D278 IonicContact NH2-OD2 3.9Å; R137-D278 PolarHBondContact NH2-OD2 3.14Å
138P92.2Very high95.8Very high100 Ų10046.3 Ų46.365%0.64922%0.221SC*.  trans-66.9123.7-179.726.9-33.4000110.4I140P138-I140 PolarHBondContact O-N 2.86Å
139V94.9Very high95.8Very high19 Ų1946.9 Ų46.912%0.11523%0.225CC..  trans-82.395.7173-172.40000107.8I47 T129 I132 V133 R137 W144I47-V139 HydrophobicContact CD1-CG1 4.35Å; I47-V139 HydrophobicContact CG2-CG1 4.48Å; I47-V139 HydrophobicContact CG2-CG2 4.45Å; T129-V139 HydrophobicContact CG2-CG1 4.18Å; T129-V139 HydrophobicContact CG2-CG2 4.37Å; I132-V139 HydrophobicContact CB-CG2 4.41Å; I132-V139 HydrophobicContact CG2-CB 4.4Å; I132-V139 HydrophobicContact CG2-CG2 3.53Å; V133-V139 HydrophobicContact CG2-CG2 3.95Å; R137-V139 PolarHBondContact O-N 3.47Å; V139-W144 HydrophobicContact CG1-CB 4.12Å
140I94.7Very high95.7Very high82 Ų8247.6 Ų47.642%0.42123%0.229SC..  trans-67.9154.6-177.961.9173.2000112P138 L142 H143 W144P138-I140 PolarHBondContact O-N 2.86Å; I140-L142 VanDerWaalsContact C-N 3.32Å; I140-L142 HydrophobicContact CD1-CB 4.15Å; I140-L142 HydrophobicContact CG1-CB 4.41Å; I140-L142 PolarHBondContact O-N 3.21Å; I140-H143 HydrophobicContact CG1-CB 3.8Å; I140-H143 WeakPolarHBondContact O-CB 3.49Å; I140-H143 PolarHBondContact O-N 3.19Å; I140-W144 VanDerWaalsContact O-CD1 3.31Å; I140-W144 PolarHBondContact O-N 3.04Å
141F95.5Very high95.8Very high102 Ų10245 Ų4545%0.44721%0.214SC..Hα-helixtrans-50.9-50178.6176.4-105.3000112.9H143 W144 Y145 L248F141-H143 PolarHBondContact O-N 3.3Å; F141-H143 VanDerWaalsContact O-N 3.15Å; F141-W144 AromaticContact CD2-CE2 3.7Å; F141-W144 HydrophobicContact CD2-CH2 4.08Å; F141-W144 AromaticContact CD2-CZ2 3.34Å; F141-W144 HydrophobicContact CD2-CZ2 3.34Å; F141-W144 AromaticContact CD2-NE1 3.96Å; F141-W144 AromaticContact CE2-CH2 3.76Å; F141-W144 HydrophobicContact CE2-CH2 3.76Å; F141-W144 AromaticContact CE2-CZ2 3.5Å; F141-W144 HydrophobicContact CE2-CZ2 3.5Å; F141-W144 PolarHBondContact O-N 3.2Å; F141-Y145 HydrophobicContact CE1-CD1 4.4Å; F141-Y145 HydrophobicContact CE1-CG 4.16Å; F141-Y145 HydrophobicContact CE2-CD2 4.49Å; F141-Y145 HydrophobicContact CE2-CG 4.43Å; F141-Y145 HydrophobicContact CZ-CD1 4.49Å; F141-Y145 AromaticContact CZ-CD2 3.97Å; F141-Y145 HydrophobicContact CZ-CD2 3.97Å; F141-Y145 AromaticContact CZ-CG 3.87Å; F141-Y145 HydrophobicContact CZ-CG 3.87Å; F141-Y145 WeakPolarHBondContact O-CB 3.45Å; F141-Y145 PolarHBondContact O-N 3.19Å; F141-L248 HydrophobicContact CD1-CD2 3.88Å; F141-L248 HydrophobicContact CE1-CD1 4.09Å; F141-L248 HydrophobicContact CE1-CD2 3.88Å
142L94.7Very high95.8Very high22 Ų2245.5 Ų45.512%0.11522%0.219CC..Hα-helixtrans-51.9-40.5179.2171.464.1000112.1I140 H146 L248 F249 F252I140-L142 VanDerWaalsContact C-N 3.32Å; I140-L142 HydrophobicContact CD1-CB 4.15Å; I140-L142 HydrophobicContact CG1-CB 4.41Å; I140-L142 PolarHBondContact O-N 3.21Å; L142-H146 WeakPolarHBondContact O-CB 3.37Å; L142-H146 PolarHBondContact O-N 3.37Å; L142-L248 HydrophobicContact CD1-CB 3.62Å; L142-L248 HydrophobicContact CD1-CD1 4.06Å; L142-L248 HydrophobicContact CD1-CG 4.45Å; L142-F249 HydrophobicContact CD1-CD2 3.98Å; L142-F249 HydrophobicContact CD1-CE2 3.78Å; L142-F249 HydrophobicContact CD1-CZ 4.32Å; L142-F249 HydrophobicContact CD2-CD1 4.31Å; L142-F249 HydrophobicContact CD2-CD2 4.47Å; L142-F249 HydrophobicContact CD2-CE1 4.13Å; L142-F249 HydrophobicContact CD2-CE2 4.32Å; L142-F249 HydrophobicContact CD2-CG 4.48Å; L142-F249 HydrophobicContact CD2-CZ 4.14Å; L142-F249 HydrophobicContact CG-CE2 4.5Å; L142-F252 HydrophobicContact CD2-CB 4.31Å; L142-F252 HydrophobicContact CD2-CG 4.47Å
143H96.5Very high95.8Very high37 Ų3744.8 Ų44.817%0.17121%0.214CC..Hα-helixtrans-66.8-59.5-175.8-176.187.7000111.5T129 I140 F141 H146 H147T129-H143 PolarHBondContact OG1-CD2 2.86Å; T129-H143 PolarHBondContact OG1-NE2 3.27Å; I140-H143 HydrophobicContact CG1-CB 3.8Å; I140-H143 WeakPolarHBondContact O-CB 3.49Å; I140-H143 PolarHBondContact O-N 3.19Å; F141-H143 PolarHBondContact O-N 3.3Å; F141-H143 VanDerWaalsContact O-N 3.15Å; H143-H146 PolarHBondContact O-N 3.15Å; H143-H147 AromaticContact CD2-CD2 3.68Å; H143-H147 AromaticContact CE1-CD2 3.42Å; H143-H147 PolarHBondContact CE1-CD2 3.13Å; H143-H147 VanDerWaalsContact CE1-CD2 3.42Å; H143-H147 AromaticContact CE1-NE2 3.17Å; H143-H147 PolarHBondContact CE1-NE2 2.68Å; H143-H147 AromaticContact ND1-CD2 3.9Å; H143-H147 AromaticContact ND1-NE2 3.84Å; H143-H147 AromaticContact NE2-CD2 3.27Å; H143-H147 PolarHBondContact NE2-CD2 3.03Å; H143-H147 VanDerWaalsContact NE2-CD2 3.27Å; H143-H147 AromaticContact NE2-NE2 3.46Å; H143-H147 PolarHBondContact NE2-NE2 2.99Å; H143-H147 PolarHBondContact O-CD2 2.8Å; H143-H147 PolarHBondContact O-N 3.03Å
144W96.5Very high95.8Very high93 Ų9345.6 Ų45.635%0.35222%0.219SC..Hα-helixtrans-71.6-35.1-174.770.1-103.6000112.3Y43 I47 V139 I140 F141 H147 I148Y43-W144 HydrophobicContact CE1-CB 4.06Å; I47-W144 HydrophobicContact CD1-CB 3.57Å; I47-W144 HydrophobicContact CD1-CG 4.37Å; V139-W144 HydrophobicContact CG1-CB 4.12Å; I140-W144 VanDerWaalsContact O-CD1 3.31Å; I140-W144 PolarHBondContact O-N 3.04Å; F141-W144 AromaticContact CD2-CE2 3.7Å; F141-W144 HydrophobicContact CD2-CH2 4.08Å; F141-W144 AromaticContact CD2-CZ2 3.34Å; F141-W144 HydrophobicContact CD2-CZ2 3.34Å; F141-W144 AromaticContact CD2-NE1 3.96Å; F141-W144 AromaticContact CE2-CH2 3.76Å; F141-W144 HydrophobicContact CE2-CH2 3.76Å; F141-W144 AromaticContact CE2-CZ2 3.5Å; F141-W144 HydrophobicContact CE2-CZ2 3.5Å; F141-W144 PolarHBondContact O-N 3.2Å; W144-H147 PolarHBondContact O-N 3.14Å; W144-I148 HydrophobicContact CE3-CD1 3.82Å; W144-I148 HydrophobicContact CZ3-CD1 4.17Å; W144-I148 WeakPolarHBondContact O-CG1 3.48Å; W144-I148 PolarHBondContact O-N 3.11Å; W144-I148 VanDerWaalsContact O-N 3.12Å
145Y97.2Very high95.8Very high55 Ų5544.3 Ų44.322%0.21621%0.211CC..Hα-helixtrans-60.7-47.3174.5172.1-105.4000110.6F141 T149 S244 Y245 L248F141-Y145 HydrophobicContact CE1-CD1 4.4Å; F141-Y145 HydrophobicContact CE1-CG 4.16Å; F141-Y145 HydrophobicContact CE2-CD2 4.49Å; F141-Y145 HydrophobicContact CE2-CG 4.43Å; F141-Y145 HydrophobicContact CZ-CD1 4.49Å; F141-Y145 AromaticContact CZ-CD2 3.97Å; F141-Y145 HydrophobicContact CZ-CD2 3.97Å; F141-Y145 AromaticContact CZ-CG 3.87Å; F141-Y145 HydrophobicContact CZ-CG 3.87Å; F141-Y145 WeakPolarHBondContact O-CB 3.45Å; F141-Y145 PolarHBondContact O-N 3.19Å; Y145-T149 HydrophobicContact CD2-CG2 4.08Å; Y145-T149 HydrophobicContact CE2-CG2 3.71Å; Y145-T149 WeakPolarHBondContact O-CB 3.48Å; Y145-T149 PolarHBondContact O-N 3.4Å; Y145-T149 PolarHBondContact O-OG1 3.21Å; Y145-S244 PolarHBondContact OH-OG 2.92Å; Y145-S244 VanDerWaalsContact OH-OG 3.07Å; Y145-Y245 HydrophobicContact CD1-CD1 4.39Å; Y145-Y245 AromaticContact CD1-CE1 3.91Å; Y145-Y245 HydrophobicContact CD1-CE1 3.91Å; Y145-Y245 AromaticContact CE1-CD1 3.96Å; Y145-Y245 HydrophobicContact CE1-CD1 3.96Å; Y145-Y245 AromaticContact CE1-CE1 3.59Å; Y145-Y245 HydrophobicContact CE1-CE1 3.59Å; Y145-L248 HydrophobicContact CD1-CD1 3.64Å; Y145-L248 HydrophobicContact CE1-CD1 3.79Å
146H97Very high95.7Very high24 Ų2442.7 Ų42.711%0.11121%0.206CC..Hα-helixtrans-57.8-54.9176.5168.8-91.8000111.5L142 H143 I148 T149 V150 Y245L142-H146 WeakPolarHBondContact O-CB 3.37Å; L142-H146 PolarHBondContact O-N 3.37Å; H143-H146 PolarHBondContact O-N 3.15Å; H146-I148 VanDerWaalsContact C-N 3.32Å; H146-I148 PolarHBondContact O-N 3.28Å; H146-T149 PolarHBondContact O-N 3.24Å; H146-T149 PolarHBondContact O-OG1 3.43Å; H146-V150 WeakPolarHBondContact NE2-CG1 3.14Å; H146-V150 WeakPolarHBondContact O-CG1 3.3Å; H146-V150 VanDerWaalsContact O-CG2 3.27Å; H146-V150 WeakPolarHBondContact O-CG2 3.45Å; H146-V150 PolarHBondContact O-N 2.8Å; H146-Y245 WeakPolarHBondContact CA-OH 3.15Å; H146-Y245 HydrophobicContact CB-CE1 4.3Å; H146-Y245 AromaticContact CD2-CE2 3.53Å; H146-Y245 AromaticContact CD2-CZ 3.56Å; H146-Y245 PolarHBondContact O-OH 2.8Å
147H97.6Very high95.7Very high9 Ų938.7 Ų38.74%0.04219%0.19CC..Hα-helixtrans-60.7-38.1-175.3-83.2-73.6000113.4Y43 L126 D128 H143 W144 L151Y43-H147 HydrophobicContact CE1-CB 4.25Å; L126-H147 HydrophobicContact CD2-CB 3.87Å; D128-H147 IonicContact OD2-CE1 2.79Å; H143-H147 AromaticContact CD2-CD2 3.68Å; H143-H147 AromaticContact CE1-CD2 3.42Å; H143-H147 PolarHBondContact CE1-CD2 3.13Å; H143-H147 VanDerWaalsContact CE1-CD2 3.42Å; H143-H147 AromaticContact CE1-NE2 3.17Å; H143-H147 PolarHBondContact CE1-NE2 2.68Å; H143-H147 AromaticContact ND1-CD2 3.9Å; H143-H147 AromaticContact ND1-NE2 3.84Å; H143-H147 AromaticContact NE2-CD2 3.27Å; H143-H147 PolarHBondContact NE2-CD2 3.03Å; H143-H147 VanDerWaalsContact NE2-CD2 3.27Å; H143-H147 AromaticContact NE2-NE2 3.46Å; H143-H147 PolarHBondContact NE2-NE2 2.99Å; H143-H147 PolarHBondContact O-CD2 2.8Å; H143-H147 PolarHBondContact O-N 3.03Å; W144-H147 PolarHBondContact O-N 3.14Å; H147-L151 WeakPolarHBondContact O-CB 3.29Å; H147-L151 PolarHBondContact O-N 3.28Å
148I97.5Very high95.7Very high33 Ų3335.9 Ų35.917%0.16918%0.179CC..Hα-helixtrans-65.3-53.3174.2-71.7177.6000110.5Y43 A44 W144 H146 L151 V152Y43-I148 HydrophobicContact CD1-CD1 3.95Å; Y43-I148 HydrophobicContact CD1-CG1 3.56Å; Y43-I148 HydrophobicContact CE1-CD1 4.24Å; Y43-I148 HydrophobicContact CE1-CG1 3.8Å; A44-I148 HydrophobicContact CB-CD1 4.32Å; W144-I148 HydrophobicContact CE3-CD1 3.82Å; W144-I148 HydrophobicContact CZ3-CD1 4.17Å; W144-I148 WeakPolarHBondContact O-CG1 3.48Å; W144-I148 PolarHBondContact O-N 3.11Å; W144-I148 VanDerWaalsContact O-N 3.12Å; H146-I148 VanDerWaalsContact C-N 3.32Å; H146-I148 PolarHBondContact O-N 3.28Å; I148-L151 PolarHBondContact O-N 3.34Å; I148-V152 WeakPolarHBondContact O-CG2 3.41Å; I148-V152 PolarHBondContact O-N 2.95Å; I148-V152 VanDerWaalsContact O-N 3.13Å
149T97Very high95.5Very high30 Ų3032.7 Ų32.718%0.18416%0.155CC..Hα-helixtrans-72.1-36.9-170.549.20000112.5Y145 H146 Y153 Y245Y145-T149 HydrophobicContact CD2-CG2 4.08Å; Y145-T149 HydrophobicContact CE2-CG2 3.71Å; Y145-T149 WeakPolarHBondContact O-CB 3.48Å; Y145-T149 PolarHBondContact O-N 3.4Å; Y145-T149 PolarHBondContact O-OG1 3.21Å; H146-T149 PolarHBondContact O-N 3.24Å; H146-T149 PolarHBondContact O-OG1 3.43Å; T149-Y153 WeakPolarHBondContact O-CB 3.44Å; T149-Y153 PolarHBondContact O-N 3.2Å; T149-Y245 PolarHBondContact OG1-OH 3.32Å
150V96.7Very high95.1Very high14 Ų1434.3 Ų34.39%0.08516%0.164CC..Hα-helixtrans-67.3-36.3173.6-60.10000112.9K122 H146 T154 Y245K122-V150 HydrophobicContact CD-CG2 4.33Å; H146-V150 WeakPolarHBondContact NE2-CG1 3.14Å; H146-V150 WeakPolarHBondContact O-CG1 3.3Å; H146-V150 VanDerWaalsContact O-CG2 3.27Å; H146-V150 WeakPolarHBondContact O-CG2 3.45Å; H146-V150 PolarHBondContact O-N 2.8Å; V150-T154 WeakPolarHBondContact O-CB 3.17Å; V150-T154 PolarHBondContact O-N 3.32Å; V150-T154 PolarHBondContact O-OG1 2.82Å; V150-Y245 HydrophobicContact CG1-CE2 3.73Å; V150-Y245 WeakPolarHBondContact CG1-OH 3.36Å
151L97.2Very high94.6Very high0 Ų032 Ų320%015%0.151CC..Hα-helixtrans-62.4-52178173.558000110.1L39 K122 A123 L126 H147 I148 W155L39-L151 HydrophobicContact CB-CD2 4.05Å; K122-L151 HydrophobicContact CB-CB 4.39Å; K122-L151 HydrophobicContact CB-CD1 3.96Å; A123-L151 HydrophobicContact CB-CD1 4.07Å; L126-L151 HydrophobicContact CD1-CD2 3.91Å; L126-L151 HydrophobicContact CD2-CD2 4.44Å; L126-L151 HydrophobicContact CG-CD2 4.46Å; H147-L151 WeakPolarHBondContact O-CB 3.29Å; H147-L151 PolarHBondContact O-N 3.28Å; I148-L151 PolarHBondContact O-N 3.34Å; L151-W155 HydrophobicContact CD1-CD2 4.36Å; L151-W155 HydrophobicContact CD1-CG 4.4Å; L151-W155 HydrophobicContact CD1-CZ2 4.36Å; L151-W155 VanDerWaalsContact O-CD1 3.28Å; L151-W155 PolarHBondContact O-N 3.26Å
152V96.7Very high94.3Very high39 Ų3927.3 Ų27.324%0.23613%0.13CC..Hα-helixtrans-62.6-48178.4177.80000111.3S36 I37 I148 T154 H156S36-V152 WeakPolarHBondContact OG-CA 3.47Å; I37-V152 HydrophobicContact CG1-CG1 4.27Å; I37-V152 HydrophobicContact CG1-CG2 4.29Å; I148-V152 WeakPolarHBondContact O-CG2 3.41Å; I148-V152 PolarHBondContact O-N 2.95Å; I148-V152 VanDerWaalsContact O-N 3.13Å; V152-T154 PolarHBondContact O-N 3.2Å; V152-H156 VanDerWaalsContact O-CB 3.32Å; V152-H156 WeakPolarHBondContact O-CB 3.49Å; V152-H156 PolarHBondContact O-N 3.12Å
153Y96Very high94.1Very high23 Ų2326.2 Ų26.29%0.0913%0.125CC..Hα-helixtrans-64.3-42.9-176.9176.7-108000112.5T149 H156 A157 F168 F237 S238 I241T149-Y153 WeakPolarHBondContact O-CB 3.44Å; T149-Y153 PolarHBondContact O-N 3.2Å; Y153-H156 PolarHBondContact O-N 3.33Å; Y153-A157 HydrophobicContact CE1-CB 4.35Å; Y153-A157 HydrophobicContact CE2-CB 4.39Å; Y153-A157 WeakPolarHBondContact O-CB 3.46Å; Y153-A157 PolarHBondContact O-N 2.74Å; Y153-F168 HydrophobicContact CE1-CD2 4.47Å; Y153-F237 HydrophobicContact CD2-CB 4.04Å; Y153-F237 HydrophobicContact CE2-CB 3.99Å; Y153-S238 WeakPolarHBondContact OH-CB 3.37Å; Y153-I241 HydrophobicContact CD1-CD1 4.3Å; Y153-I241 HydrophobicContact CD2-CD1 3.76Å; Y153-I241 HydrophobicContact CG-CD1 3.57Å
154T95.7Very high93.9Very high19 Ų1924.5 Ų24.512%0.11712%0.117CC..Hα-helixtrans-68.9-39.4-175.8-57.90000111.2F118 A119 K122 V150 V152 A157 Y158F118-T154 HydrophobicContact CD1-CG2 3.71Å; F118-T154 HydrophobicContact CE1-CG2 3.66Å; A119-T154 HydrophobicContact CB-CG2 3.9Å; K122-T154 HydrophobicContact CG-CG2 4.31Å; V150-T154 WeakPolarHBondContact O-CB 3.17Å; V150-T154 PolarHBondContact O-N 3.32Å; V150-T154 PolarHBondContact O-OG1 2.82Å; V152-T154 PolarHBondContact O-N 3.2Å; T154-A157 PolarHBondContact O-N 3.45Å; T154-Y158 VanDerWaalsContact O-CB 3.29Å; T154-Y158 WeakPolarHBondContact O-CB 3.28Å; T154-Y158 PolarHBondContact O-N 3.03Å
155W95.3Very high93.8Very high13 Ų1320.3 Ų20.35%0.04910%0.102CC..Hα-helixtrans-68.4-40.2176.8-74.637.7000111.1W28 M29 W33 H35 L39 A119 L120 A123 L151 K159W28-W155 HydrophobicContact CH2-CH2 4.21Å; W28-W155 HydrophobicContact CH2-CZ3 4.39Å; M29-W155 HydrophobicContact SD-CB 4.02Å; M29-W155 HydrophobicContact SD-CD2 4.04Å; M29-W155 HydrophobicContact SD-CE3 4.08Å; M29-W155 HydrophobicContact SD-CG 4.06Å; W33-W155 HydrophobicContact CB-CB 4.29Å; H35-W155 HydrophobicContact CB-CZ3 4.15Å; L39-W155 HydrophobicContact CD1-CH2 4.28Å; A119-W155 PolarHBondContact O-NE1 3.38Å; L120-W155 HydrophobicContact CD2-CZ2 4.13Å; A123-W155 HydrophobicContact CB-CZ2 4.09Å; L151-W155 HydrophobicContact CD1-CD2 4.36Å; L151-W155 HydrophobicContact CD1-CG 4.4Å; L151-W155 HydrophobicContact CD1-CZ2 4.36Å; L151-W155 VanDerWaalsContact O-CD1 3.28Å; L151-W155 PolarHBondContact O-N 3.26Å; W155-K159 PolarHBondContact O-N 3.46Å
156H93.6Very high93.7Very high19 Ų1917.7 Ų17.79%0.0889%0.092CC..Hα-helixtrans-62.6-48172.6-177.4-83.9000112.2W33 V152 Y153 Y158 K159 D160 N234W33-H156 HydrophobicContact CE3-CB 4.31Å; W33-H156 AromaticContact CZ3-CD2 3.96Å; V152-H156 VanDerWaalsContact O-CB 3.32Å; V152-H156 WeakPolarHBondContact O-CB 3.49Å; V152-H156 PolarHBondContact O-N 3.12Å; Y153-H156 PolarHBondContact O-N 3.33Å; H156-Y158 PolarHBondContact O-N 3.37Å; H156-K159 WeakPolarHBondContact CD2-CE 3.47Å; H156-K159 WeakPolarHBondContact NE2-CE 3.32Å; H156-K159 PolarHBondContact NE2-NZ 2.97Å; H156-K159 VanDerWaalsContact O-CG 3.23Å; H156-K159 WeakPolarHBondContact O-CG 3.39Å; H156-K159 PolarHBondContact O-N 3.28Å; H156-D160 IonicContact CE1-OD2 3.38Å; H156-D160 PolarHBondContact CE1-OD2 3.18Å; H156-D160 IonicContact ND1-OD2 3.91Å; H156-D160 IonicContact NE2-OD2 3.96Å; H156-N234 PolarHBondContact CE1-OD1 2.94Å; H156-N234 PolarHBondContact ND1-OD1 3.01Å
157A93.8Very high93.7Very high7 Ų718.3 Ų18.36%0.0589%0.094CC..Hα-helixtrans-66.8-36.5-17800000112.3Y153 T154 D160 H161 T162Y153-A157 HydrophobicContact CE1-CB 4.35Å; Y153-A157 HydrophobicContact CE2-CB 4.39Å; Y153-A157 WeakPolarHBondContact O-CB 3.46Å; Y153-A157 PolarHBondContact O-N 2.74Å; T154-A157 PolarHBondContact O-N 3.45Å; A157-D160 PolarHBondContact O-N 2.98Å; A157-H161 PolarHBondContact O-N 2.82Å; A157-T162 HydrophobicContact CB-CG2 4.07Å; A157-T162 PolarHBondContact O-N 3.35Å
158Y92.7Very high93.6Very high13 Ų1318.5 Ų18.55%0.0519%0.094CC..Hα-helixtrans-63.6-40.5176.4-171.5-81.3000111.7S25 M29 T115 Q116 A119 T154 H156 D160 H161S25-Y158 PolarHBondContact OG-OH 2.88Å; M29-Y158 HydrophobicContact CB-CD1 3.6Å; M29-Y158 HydrophobicContact CB-CE1 3.99Å; M29-Y158 HydrophobicContact CE-CD1 3.92Å; M29-Y158 HydrophobicContact CE-CE1 4.4Å; M29-Y158 HydrophobicContact CE-CG 4.19Å; M29-Y158 HydrophobicContact CG-CD1 3.56Å; M29-Y158 HydrophobicContact CG-CE1 4.41Å; M29-Y158 HydrophobicContact CG-CG 4.26Å; T115-Y158 HydrophobicContact CG2-CD2 3.87Å; T115-Y158 HydrophobicContact CG2-CE2 3.77Å; Q116-Y158 HydrophobicContact CB-CE2 4.1Å; Q116-Y158 WeakPolarHBondContact CB-OH 3.32Å; A119-Y158 HydrophobicContact CB-CD2 4.02Å; A119-Y158 HydrophobicContact CB-CG 4.3Å; T154-Y158 VanDerWaalsContact O-CB 3.29Å; T154-Y158 WeakPolarHBondContact O-CB 3.28Å; T154-Y158 PolarHBondContact O-N 3.03Å; H156-Y158 PolarHBondContact O-N 3.37Å; Y158-D160 PolarHBondContact O-N 3.31Å; Y158-H161 PolarHBondContact O-N 3.4Å; Y158-H161 VanDerWaalsContact O-N 3.15Å
159K88.6Confident93.6Very high34 Ų3417.2 Ų17.215%0.1489%0.088CC..Hα-helixtrans-59.3-31179.899.5-16815362.40112.6M29 K30 W33 W155 H156M29-K159 HydrophobicContact CG-CB 4.14Å; K30-K159 WeakPolarHBondContact CE-O 3.49Å; K30-K159 HydrophobicContact CG-CB 4.13Å; W33-K159 HydrophobicContact CB-CD 4.43Å; W33-K159 HydrophobicContact CD2-CD 4.04Å; W33-K159 HydrophobicContact CG-CD 3.77Å; W155-K159 PolarHBondContact O-N 3.46Å; H156-K159 WeakPolarHBondContact CD2-CE 3.47Å; H156-K159 WeakPolarHBondContact NE2-CE 3.32Å; H156-K159 PolarHBondContact NE2-NZ 2.97Å; H156-K159 VanDerWaalsContact O-CG 3.23Å; H156-K159 WeakPolarHBondContact O-CG 3.39Å; H156-K159 PolarHBondContact O-N 3.28Å
160D85.8Confident93.6Very high53 Ų5317.6 Ų17.628%0.2839%0.086SC..THydrogen-bonded Turntrans-97.3-2.1-175.9-66.5-22.5000112.8H156 A157 Y158 T162 N234H156-D160 IonicContact CE1-OD2 3.38Å; H156-D160 PolarHBondContact CE1-OD2 3.18Å; H156-D160 IonicContact ND1-OD2 3.91Å; H156-D160 IonicContact NE2-OD2 3.96Å; A157-D160 PolarHBondContact O-N 2.98Å; Y158-D160 PolarHBondContact O-N 3.31Å; D160-T162 HydrophobicContact CB-CG2 4.36Å; D160-T162 PolarHBondContact O-N 3.48Å; D160-N234 PolarHBondContact OD2-ND2 3.3Å
161H84.7Confident93.7Very high33 Ų3317.5 Ų17.515%0.1539%0.085CC..THydrogen-bonded Turntrans47.258.8-174.5-71.1-63.3000112.4T26 A104 A157 Y158 A163 Q229T26-H161 WeakPolarHBondContact CG2-NE2 3.39Å; T26-H161 PolarHBondContact OG1-CE1 2.84Å; T26-H161 PolarHBondContact OG1-NE2 2.79Å; A104-H161 HydrophobicContact CB-CB 4.31Å; A104-H161 VanDerWaalsContact CB-O 3.29Å; A104-H161 WeakPolarHBondContact CB-O 3.22Å; A157-H161 PolarHBondContact O-N 2.82Å; Y158-H161 PolarHBondContact O-N 3.4Å; Y158-H161 VanDerWaalsContact O-N 3.15Å; H161-A163 PolarHBondContact O-N 3.2Å; H161-Q229 PolarHBondContact O-NE2 2.84Å
162T88.9Confident93.7Very high3 Ų318.1 Ų18.12%0.0189%0.088CC..  trans-63.5123.8-179.955.80000110.8Y106 A157 D160 A164 G165 Q230 N234Y106-T162 WeakPolarHBondContact CE1-O 3.48Å; Y106-T162 PolarHBondContact OH-O 3.36Å; A157-T162 HydrophobicContact CB-CG2 4.07Å; A157-T162 PolarHBondContact O-N 3.35Å; D160-T162 HydrophobicContact CB-CG2 4.36Å; D160-T162 PolarHBondContact O-N 3.48Å; T162-A164 PolarHBondContact O-N 3.05Å; T162-G165 PolarHBondContact O-N 2.93Å; T162-Q230 HydrophobicContact CG2-CG 4.38Å; T162-Q230 VanDerWaalsContact CG2-NE2 3.33Å; T162-N234 HydrophobicContact CG2-CB 3.87Å
163A91.2Very high93.8Very high0 Ų016.3 Ų16.30%08%0.077CC..THydrogen-bonded Turntrans-60.7-42.9-178.900000113V101 C102 A104 H161 G165 R166 Q229V101-A163 CarbonylContact O-C 3.5Å; V101-A163 WeakPolarHBondContact O-CB 3.29Å; C102-A163 WeakPolarHBondContact O-CB 3.22Å; A104-A163 HydrophobicContact CB-CB 4.33Å; H161-A163 PolarHBondContact O-N 3.2Å; A163-G165 PolarHBondContact O-N 3.02Å; A163-R166 PolarHBondContact O-N 2.84Å; A163-R166 VanDerWaalsContact O-N 3.16Å; A163-Q229 HydrophobicContact CB-CB 4.26Å; A163-Q229 PolarHBondContact N-O 3.18Å
164A93Very high93.9Very high0 Ų017.6 Ų17.60%09%0.085CC..THydrogen-bonded Turntrans-59.3-17.6174.700000113.6V101 T162 R166 W167 F168 V214V101-A164 PolarHBondContact O-N 3.09Å; T162-A164 PolarHBondContact O-N 3.05Å; A164-R166 PolarHBondContact O-N 2.92Å; A164-R166 VanDerWaalsContact O-N 3.17Å; A164-W167 PolarHBondContact O-N 3.48Å; A164-W167 VanDerWaalsContact O-N 3.07Å; A164-F168 HydrophobicContact CB-CE2 3.8Å; A164-F168 HydrophobicContact CB-CZ 3.85Å; A164-F168 PolarHBondContact O-N 3.37Å; A164-V214 HydrophobicContact CB-CG1 3.87Å
165G93.7Very high94Very high5 Ų517 Ų175%0.0528%0.082CC..Hα-helixtrans-57.2-27.3174.500000113.2Y106 T162 A163 W167 F168 V169Y106-G165 VanDerWaalsContact OH-CA 3.26Å; Y106-G165 WeakPolarHBondContact OH-CA 3.49Å; T162-G165 PolarHBondContact O-N 2.93Å; A163-G165 PolarHBondContact O-N 3.02Å; G165-W167 VanDerWaalsContact C-N 3.32Å; G165-W167 PolarHBondContact O-N 2.95Å; G165-F168 PolarHBondContact O-N 2.7Å; G165-V169 VanDerWaalsContact O-CB 3.29Å; G165-V169 WeakPolarHBondContact O-CB 3.45Å; G165-V169 WeakPolarHBondContact O-CG2 3.46Å; G165-V169 PolarHBondContact O-N 3.01Å
166R94.9Very high94.1Very high0 Ų016.8 Ų16.80%08%0.081CC..Hα-helixtrans-51.3-51.7171.6179.9-174-77.4111.8-4.2111.5E87 F88 T100 N103 S105 Y106 A163 A164 W170E87-R166 IonicContact OE1-CZ 3.25Å; E87-R166 VanDerWaalsContact OE1-CZ 3.25Å; E87-R166 IonicContact OE1-NE 2.96Å; E87-R166 PolarHBondContact OE1-NE 3.47Å; E87-R166 IonicContact OE1-NH2 2.73Å; E87-R166 PolarHBondContact OE1-NH2 3.13Å; E87-R166 IonicContact OE2-CZ 3.95Å; E87-R166 IonicContact OE2-NE 2.99Å; E87-R166 PolarHBondContact OE2-NE 2.63Å; E87-R166 IonicContact OE2-NH2 3.99Å; F88-R166 HydrophobicContact CD2-CG 3.88Å; F88-R166 HydrophobicContact CE2-CG 4.42Å; T100-R166 VanDerWaalsContact CA-NH1 3.32Å; T100-R166 PolarHBondContact O-NH1 3.29Å; N103-R166 PolarHBondContact O-NH1 3.02Å; S105-R166 PolarHBondContact OG-NH2 2.94Å; Y106-R166 HydrophobicContact CD1-CB 3.63Å; Y106-R166 HydrophobicContact CD1-CG 4.45Å; Y106-R166 HydrophobicContact CD2-CB 4.36Å; Y106-R166 HydrophobicContact CE1-CB 3.98Å; Y106-R166 HydrophobicContact CG-CB 3.85Å; Y106-R166 HydrophobicContact CG-CG 4.31Å; Y106-R166 VanDerWaalsContact CZ-N 3.32Å; A163-R166 PolarHBondContact O-N 2.84Å; A163-R166 VanDerWaalsContact O-N 3.16Å; A164-R166 PolarHBondContact O-N 2.92Å; A164-R166 VanDerWaalsContact O-N 3.17Å; R166-W170 VanDerWaalsContact O-CB 3.27Å; R166-W170 WeakPolarHBondContact O-CB 3.35Å; R166-W170 PolarHBondContact O-N 3.22Å; R166-W170 VanDerWaalsContact O-N 3.1Å
167W96.6Very high94.4Very high38 Ų3816.2 Ų16.214%0.1448%0.079CC..Hα-helixtrans-67.8-46.2-179.5-82.791.3000111.2F88 L92 F97 T100 A164 G165 V169 W170 M171 V214F88-W167 HydrophobicContact CE1-CH2 4.28Å; F88-W167 HydrophobicContact CE1-CZ2 4.5Å; F88-W167 HydrophobicContact CE1-CZ3 4.47Å; F88-W167 AromaticContact CE2-CD2 3.64Å; F88-W167 HydrophobicContact CE2-CD2 3.64Å; F88-W167 AromaticContact CE2-CE2 3.77Å; F88-W167 AromaticContact CE2-CE3 3.9Å; F88-W167 HydrophobicContact CE2-CE3 3.9Å; F88-W167 HydrophobicContact CE2-CG 4.05Å; F88-W167 HydrophobicContact CE2-CH2 4.37Å; F88-W167 HydrophobicContact CE2-CZ2 4.12Å; F88-W167 HydrophobicContact CE2-CZ3 4.27Å; F88-W167 AromaticContact CZ-CD2 3.73Å; F88-W167 HydrophobicContact CZ-CD2 3.73Å; F88-W167 AromaticContact CZ-CE2 3.72Å; F88-W167 AromaticContact CZ-CE3 3.6Å; F88-W167 HydrophobicContact CZ-CE3 3.6Å; F88-W167 AromaticContact CZ-CH2 3.5Å; F88-W167 HydrophobicContact CZ-CH2 3.5Å; F88-W167 AromaticContact CZ-CZ2 3.6Å; F88-W167 HydrophobicContact CZ-CZ2 3.6Å; F88-W167 AromaticContact CZ-CZ3 3.51Å; F88-W167 HydrophobicContact CZ-CZ3 3.51Å; L92-W167 HydrophobicContact CD1-CZ2 4.34Å; F97-W167 AromaticContact CD2-CZ2 3.8Å; F97-W167 HydrophobicContact CD2-CZ2 3.8Å; F97-W167 AromaticContact CE2-CE2 3.88Å; F97-W167 HydrophobicContact CE2-CH2 4.09Å; F97-W167 AromaticContact CE2-CZ2 3.48Å; F97-W167 HydrophobicContact CE2-CZ2 3.48Å; F97-W167 VanDerWaalsContact CE2-CZ2 3.48Å; T100-W167 PolarHBondContact OG1-NE1 3.17Å; A164-W167 PolarHBondContact O-N 3.48Å; A164-W167 VanDerWaalsContact O-N 3.07Å; G165-W167 VanDerWaalsContact C-N 3.32Å; G165-W167 PolarHBondContact O-N 2.95Å; W167-V169 PolarHBondContact O-N 3.41Å; W167-W170 PolarHBondContact O-N 2.95Å; W167-M171 HydrophobicContact CB-CE 4.05Å; W167-M171 HydrophobicContact CE3-CE 4.42Å; W167-M171 HydrophobicContact CE3-SD 4.26Å; W167-M171 WeakPolarHBondContact O-CB 3.37Å; W167-M171 VanDerWaalsContact O-CE 3.29Å; W167-M171 WeakPolarHBondContact O-CE 3.38Å; W167-M171 VanDerWaalsContact O-CG 3.27Å; W167-M171 WeakPolarHBondContact O-CG 3.15Å; W167-M171 PolarHBondContact O-N 2.63Å; W167-V214 HydrophobicContact CB-CG1 4.14Å; W167-V214 HydrophobicContact CB-CG2 4.09Å; W167-V214 HydrophobicContact CD2-CG2 3.92Å; W167-V214 HydrophobicContact CE3-CG2 4.21Å; W167-V214 HydrophobicContact CG-CG1 4.24Å; W167-V214 HydrophobicContact CG-CG2 3.86Å
168F96.2Very high94.6Very high12 Ų1220.7 Ų20.75%0.05310%0.098CC..Hα-helixtrans-62.8-44.5-177.4-56.5-26.6000112.2Y153 A164 G165 M171 N172 V214 S215 Y242Y153-F168 HydrophobicContact CE1-CD2 4.47Å; A164-F168 HydrophobicContact CB-CE2 3.8Å; A164-F168 HydrophobicContact CB-CZ 3.85Å; A164-F168 PolarHBondContact O-N 3.37Å; G165-F168 PolarHBondContact O-N 2.7Å; F168-M171 HydrophobicContact CD1-CE 4.14Å; F168-N172 VanDerWaalsContact O-CB 3.22Å; F168-N172 WeakPolarHBondContact O-CB 3.29Å; F168-N172 PolarHBondContact O-N 2.9Å; F168-V214 HydrophobicContact CE1-CB 4.25Å; F168-V214 HydrophobicContact CE1-CG1 4.1Å; F168-V214 HydrophobicContact CZ-CG1 4.37Å; F168-S215 WeakPolarHBondContact CZ-OG 3.34Å; F168-Y242 WeakPolarHBondContact CB-OH 3.36Å; F168-Y242 AromaticContact CD1-CE2 3.45Å; F168-Y242 HydrophobicContact CD1-CE2 3.45Å; F168-Y242 VanDerWaalsContact CD1-CE2 3.45Å; F168-Y242 AromaticContact CD1-CZ 3.58Å; F168-Y242 WeakPolarHBondContact CD1-OH 3.18Å; F168-Y242 HydrophobicContact CD2-CE2 4.19Å; F168-Y242 HydrophobicContact CE1-CD2 4.18Å; F168-Y242 AromaticContact CE1-CE2 3.5Å; F168-Y242 HydrophobicContact CE1-CE2 3.5Å; F168-Y242 VanDerWaalsContact CE1-CE2 3.5Å; F168-Y242 HydrophobicContact CE2-CE2 4.22Å; F168-Y242 AromaticContact CG-CE2 3.83Å; F168-Y242 HydrophobicContact CG-CE2 3.83Å; F168-Y242 WeakPolarHBondContact CG-OH 3.32Å; F168-Y242 HydrophobicContact CZ-CD2 4.4Å; F168-Y242 AromaticContact CZ-CE2 3.9Å; F168-Y242 HydrophobicContact CZ-CE2 3.9Å
169V97.1Very high94.8Very high7 Ų720.8 Ų20.84%0.04210%0.099CC..Hα-helixtrans-65.5-50.2178.1173.80000110.6M84 T115 F118 G165 W167 M171 N172 Y173M84-V169 HydrophobicContact CE-CG1 3.99Å; T115-V169 HydrophobicContact CG2-CG2 4.4Å; F118-V169 HydrophobicContact CB-CG1 4.08Å; F118-V169 HydrophobicContact CD1-CB 4.5Å; F118-V169 HydrophobicContact CD1-CG1 4.37Å; F118-V169 HydrophobicContact CD1-CG2 3.69Å; F118-V169 HydrophobicContact CD2-CG1 3.88Å; F118-V169 HydrophobicContact CE1-CG2 3.87Å; F118-V169 HydrophobicContact CE2-CG1 4.37Å; F118-V169 HydrophobicContact CG-CB 4.44Å; F118-V169 HydrophobicContact CG-CG1 3.86Å; F118-V169 HydrophobicContact CG-CG2 4.04Å; F118-V169 HydrophobicContact CZ-CG2 4.36Å; G165-V169 VanDerWaalsContact O-CB 3.29Å; G165-V169 WeakPolarHBondContact O-CB 3.45Å; G165-V169 WeakPolarHBondContact O-CG2 3.46Å; G165-V169 PolarHBondContact O-N 3.01Å; W167-V169 PolarHBondContact O-N 3.41Å; V169-M171 PolarHBondContact O-N 3Å; V169-N172 PolarHBondContact O-N 3.35Å; V169-Y173 HydrophobicContact CG1-CD2 3.61Å; V169-Y173 HydrophobicContact CG1-CE2 3.5Å; V169-Y173 WeakPolarHBondContact O-CD2 3.38Å; V169-Y173 PolarHBondContact O-N 2.79Å
170W97.7Very high95.2Very high37 Ų3719.2 Ų19.214%0.149%0.092CC..Hα-helixtrans-61-47.9-178.2-176.688.8000112.1L81 T85 F88 F89 R166 W167 N172 Y173 L174L81-W170 HydrophobicContact CD1-CZ2 4.34Å; T85-W170 PolarHBondContact OG1-NE1 3.29Å; F88-W170 HydrophobicContact CB-CG 4.32Å; F88-W170 HydrophobicContact CD1-CD2 4.18Å; F88-W170 HydrophobicContact CD1-CG 4.42Å; F88-W170 HydrophobicContact CD2-CB 3.91Å; F88-W170 HydrophobicContact CD2-CD2 4.22Å; F88-W170 AromaticContact CD2-CG 3.82Å; F88-W170 HydrophobicContact CD2-CG 3.82Å; F88-W170 HydrophobicContact CE1-CD2 4.25Å; F88-W170 HydrophobicContact CE1-CE3 4.28Å; F88-W170 HydrophobicContact CE1-CZ3 4.49Å; F88-W170 HydrophobicContact CE2-CB 4.23Å; F88-W170 HydrophobicContact CE2-CD2 4.3Å; F88-W170 HydrophobicContact CE2-CE3 4.38Å; F88-W170 HydrophobicContact CE2-CG 4.23Å; F88-W170 HydrophobicContact CG-CB 4.48Å; F88-W170 AromaticContact CG-CD1 3.89Å; F88-W170 HydrophobicContact CG-CD2 4.16Å; F88-W170 AromaticContact CG-CG 3.92Å; F88-W170 HydrophobicContact CG-CG 3.92Å; F88-W170 HydrophobicContact CZ-CD2 4.29Å; F88-W170 HydrophobicContact CZ-CE3 4.12Å; F89-W170 HydrophobicContact CE2-CZ2 4.28Å; R166-W170 VanDerWaalsContact O-CB 3.27Å; R166-W170 WeakPolarHBondContact O-CB 3.35Å; R166-W170 PolarHBondContact O-N 3.22Å; R166-W170 VanDerWaalsContact O-N 3.1Å; W167-W170 PolarHBondContact O-N 2.95Å; W170-N172 PolarHBondContact O-N 2.9Å; W170-Y173 PolarHBondContact O-N 2.91Å; W170-L174 HydrophobicContact CH2-CD2 3.87Å; W170-L174 HydrophobicContact CZ3-CD2 3.97Å; W170-L174 PolarHBondContact O-N 3.48Å
171M97.8Very high95.8Very high13 Ų1320 Ų206%0.06410%0.098CC..Hα-helixtrans-64.6-39.6178.1-67.3-175.8-70.200111.9W167 F168 V169 L174 V175 Q207 A210W167-M171 HydrophobicContact CB-CE 4.05Å; W167-M171 HydrophobicContact CE3-CE 4.42Å; W167-M171 HydrophobicContact CE3-SD 4.26Å; W167-M171 WeakPolarHBondContact O-CB 3.37Å; W167-M171 VanDerWaalsContact O-CE 3.29Å; W167-M171 WeakPolarHBondContact O-CE 3.38Å; W167-M171 VanDerWaalsContact O-CG 3.27Å; W167-M171 WeakPolarHBondContact O-CG 3.15Å; W167-M171 PolarHBondContact O-N 2.63Å; F168-M171 HydrophobicContact CD1-CE 4.14Å; V169-M171 PolarHBondContact O-N 3Å; M171-L174 WeakPolarHBondContact O-CB 3.29Å; M171-L174 PolarHBondContact O-N 2.9Å; M171-V175 WeakPolarHBondContact O-CG2 3.32Å; M171-V175 PolarHBondContact O-N 3.31Å; M171-Q207 HydrophobicContact CB-CG 3.99Å; M171-A210 HydrophobicContact CE-CB 4.22Å; M171-A210 HydrophobicContact SD-CB 3.48Å; M171-A210 WeakPolarHBondContact SD-CB 3.38Å
172N98Very high96.4Very high12 Ų1220 Ų206%0.06410%0.098CC..Hα-helixtrans-66.2-44178.5-174-93.8000111.3F118 K122 F168 V169 W170 L174 V175 H176F118-N172 HydrophobicContact CE2-CB 3.65Å; F118-N172 WeakPolarHBondContact CE2-OD1 3.36Å; F118-N172 HydrophobicContact CZ-CB 3.76Å; K122-N172 PolarHBondContact NZ-OD1 3.37Å; F168-N172 VanDerWaalsContact O-CB 3.22Å; F168-N172 WeakPolarHBondContact O-CB 3.29Å; F168-N172 PolarHBondContact O-N 2.9Å; V169-N172 PolarHBondContact O-N 3.35Å; W170-N172 PolarHBondContact O-N 2.9Å; N172-L174 VanDerWaalsContact C-N 3.28Å; N172-L174 PolarHBondContact O-N 3.46Å; N172-V175 PolarHBondContact O-N 3.3Å; N172-H176 PolarHBondContact ND2-NE2 3.43Å; N172-H176 WeakPolarHBondContact O-CB 3.46Å; N172-H176 PolarHBondContact O-N 2.81Å; N172-H176 PolarHBondContact OD1-ND1 2.98Å
173Y98.2Very high96.7Very high2 Ų224.6 Ų24.61%0.00812%0.115CC..Hα-helixtrans-57.8-42.1173.8-84.5-47.3000112F76 M84 W114 F118 V169 W170 S177F76-Y173 HydrophobicContact CD1-CE1 4.28Å; F76-Y173 AromaticContact CE1-CE1 3.69Å; F76-Y173 HydrophobicContact CE1-CE1 3.69Å; F76-Y173 HydrophobicContact CZ-CE1 4.11Å; M84-Y173 HydrophobicContact CG-CD2 4.09Å; M84-Y173 HydrophobicContact CG-CE2 4.11Å; W114-Y173 PolarHBondContact O-OH 2.97Å; F118-Y173 WeakPolarHBondContact CA-OH 3.23Å; F118-Y173 HydrophobicContact CB-CE2 4.04Å; F118-Y173 WeakPolarHBondContact CB-OH 3.41Å; F118-Y173 HydrophobicContact CD2-CD1 4.29Å; F118-Y173 HydrophobicContact CD2-CD2 4.21Å; F118-Y173 AromaticContact CD2-CE1 3.95Å; F118-Y173 HydrophobicContact CD2-CE1 3.95Å; F118-Y173 AromaticContact CD2-CE2 3.85Å; F118-Y173 HydrophobicContact CD2-CE2 3.85Å; F118-Y173 HydrophobicContact CD2-CG 4.42Å; F118-Y173 AromaticContact CD2-CZ 3.72Å; F118-Y173 HydrophobicContact CG-CE2 4.37Å; F118-Y173 PolarHBondContact N-OH 3.36Å; V169-Y173 HydrophobicContact CG1-CD2 3.61Å; V169-Y173 HydrophobicContact CG1-CE2 3.5Å; V169-Y173 WeakPolarHBondContact O-CD2 3.38Å; V169-Y173 PolarHBondContact O-N 2.79Å; W170-Y173 PolarHBondContact O-N 2.91Å; Y173-S177 WeakPolarHBondContact O-CB 3.39Å; Y173-S177 PolarHBondContact O-N 2.75Å
174L98.3Very high96.9Very high50 Ų5025 Ų2526%0.26212%0.118SC..Hα-helixtrans-58.8-53.9175.7-17965.2000111.3L81 W170 M171 N172 S177 F178L81-L174 HydrophobicContact CD1-CB 3.84Å; L81-L174 HydrophobicContact CD1-CD1 4.15Å; L81-L174 HydrophobicContact CD2-CB 4.43Å; L81-L174 HydrophobicContact CD2-CD1 3.59Å; W170-L174 HydrophobicContact CH2-CD2 3.87Å; W170-L174 HydrophobicContact CZ3-CD2 3.97Å; W170-L174 PolarHBondContact O-N 3.48Å; M171-L174 WeakPolarHBondContact O-CB 3.29Å; M171-L174 PolarHBondContact O-N 2.9Å; N172-L174 VanDerWaalsContact C-N 3.28Å; N172-L174 PolarHBondContact O-N 3.46Å; L174-S177 PolarHBondContact O-N 3.15Å; L174-S177 PolarHBondContact O-OG 2.88Å; L174-F178 HydrophobicContact CD1-CE2 3.87Å; L174-F178 HydrophobicContact CG-CE2 4.44Å; L174-F178 VanDerWaalsContact O-CD2 3.29Å; L174-F178 WeakPolarHBondContact O-CD2 3.36Å
175V98.2Very high97Very high6 Ų626.1 Ų26.14%0.03613%0.128CC..Hα-helixtrans-68.7-40.3-176.8175.20000111.9M171 N172 S177 F178 M179 M203 Q204 Q207M171-V175 WeakPolarHBondContact O-CG2 3.32Å; M171-V175 PolarHBondContact O-N 3.31Å; N172-V175 PolarHBondContact O-N 3.3Å; V175-S177 VanDerWaalsContact C-N 3.3Å; V175-S177 PolarHBondContact O-N 3.17Å; V175-F178 PolarHBondContact O-N 3.35Å; V175-M179 WeakPolarHBondContact O-CB 3.05Å; V175-M179 PolarHBondContact O-N 3.47Å; V175-M203 HydrophobicContact CG2-CB 4.17Å; V175-Q204 HydrophobicContact CG1-CB 4.46Å; V175-Q204 HydrophobicContact CG1-CG 3.41Å; V175-Q204 VanDerWaalsContact CG1-CG 3.41Å; V175-Q207 HydrophobicContact CG2-CB 4.22Å; V175-Q207 VanDerWaalsContact CG2-OE1 3.25Å
176H98.1Very high97Very high8 Ų828.5 Ų28.54%0.03714%0.135CC..Hα-helixtrans-65.1-33.5177.7-82.8-148.5000112.1E125 N172 F178 M179 Y180E125-H176 IonicContact OE1-CE1 3.32Å; E125-H176 IonicContact OE1-ND1 2.66Å; E125-H176 IonicContact OE2-CE1 3.93Å; E125-H176 PolarHBondContact OE2-CE1 2.76Å; E125-H176 IonicContact OE2-ND1 3.46Å; N172-H176 PolarHBondContact ND2-NE2 3.43Å; N172-H176 WeakPolarHBondContact O-CB 3.46Å; N172-H176 PolarHBondContact O-N 2.81Å; N172-H176 PolarHBondContact OD1-ND1 2.98Å; H176-F178 VanDerWaalsContact C-N 3.33Å; H176-F178 PolarHBondContact O-N 3.29Å; H176-M179 PolarHBondContact O-N 2.92Å; H176-Y180 HydrophobicContact CB-CD2 4.04Å; H176-Y180 HydrophobicContact CB-CE2 4.2Å; H176-Y180 AromaticContact CG-CE2 3.99Å; H176-Y180 AromaticContact ND1-CE2 3.55Å; H176-Y180 WeakPolarHBondContact O-CB 3.18Å; H176-Y180 WeakPolarHBondContact O-CD2 3.36Å; H176-Y180 PolarHBondContact O-N 3.46Å
177S98.2Very high96.9Very high8 Ų829.2 Ų29.26%0.05614%0.14CC..Hα-helixtrans-57.1-46.5174.276.60000111.6Y173 L174 V175 T181Y173-S177 WeakPolarHBondContact O-CB 3.39Å; Y173-S177 PolarHBondContact O-N 2.75Å; L174-S177 PolarHBondContact O-N 3.15Å; L174-S177 PolarHBondContact O-OG 2.88Å; V175-S177 VanDerWaalsContact C-N 3.3Å; V175-S177 PolarHBondContact O-N 3.17Å; S177-T181 VanDerWaalsContact O-CB 3.26Å; S177-T181 WeakPolarHBondContact O-CB 3.23Å; S177-T181 PolarHBondContact O-N 2.91Å; S177-T181 PolarHBondContact O-OG1 3.25Å
178F98Very high96.7Very high101 Ų10132.9 Ų32.944%0.44316%0.162SC..Hα-helixtrans-72.7-42.7177.1-70.3-71.6000112.7L174 V175 H176 T181 Y182 I200 M203L174-F178 HydrophobicContact CD1-CE2 3.87Å; L174-F178 HydrophobicContact CG-CE2 4.44Å; L174-F178 VanDerWaalsContact O-CD2 3.29Å; L174-F178 WeakPolarHBondContact O-CD2 3.36Å; V175-F178 PolarHBondContact O-N 3.35Å; H176-F178 VanDerWaalsContact C-N 3.33Å; H176-F178 PolarHBondContact O-N 3.29Å; F178-T181 PolarHBondContact O-N 3.49Å; F178-Y182 WeakPolarHBondContact O-CB 3.32Å; F178-Y182 PolarHBondContact O-N 3.06Å; F178-I200 HydrophobicContact CB-CG1 4.32Å; F178-M203 HydrophobicContact CB-CE 3.72Å; F178-M203 HydrophobicContact CD1-CE 4.4Å; F178-M203 HydrophobicContact CD2-CE 3.67Å; F178-M203 HydrophobicContact CD2-SD 3.86Å; F178-M203 HydrophobicContact CE2-CE 4.39Å; F178-M203 HydrophobicContact CE2-SD 4.13Å; F178-M203 HydrophobicContact CG-CE 3.68Å; F178-M203 HydrophobicContact CG-SD 4.45Å
179M97.6Very high96.3Very high15 Ų1535.1 Ų35.17%0.07419%0.188CC..Hα-helixtrans-62.9-51.1-177.1-174.8-173.473.700112V175 H176 Y182 Y183 I200 Q204V175-M179 WeakPolarHBondContact O-CB 3.05Å; V175-M179 PolarHBondContact O-N 3.47Å; H176-M179 PolarHBondContact O-N 2.92Å; M179-Y182 WeakPolarHBondContact O-CB 3.16Å; M179-Y182 PolarHBondContact O-N 2.9Å; M179-Y183 HydrophobicContact CE-CE2 4Å; M179-Y183 HydrophobicContact CG-CD2 4.02Å; M179-Y183 HydrophobicContact CG-CE2 3.42Å; M179-Y183 VanDerWaalsContact CG-CE2 3.42Å; M179-Y183 PolarHBondContact O-N 2.77Å; M179-Y183 HydrophobicContact SD-CE2 3.79Å; M179-I200 HydrophobicContact CB-CG2 4.16Å; M179-I200 HydrophobicContact CG-CG2 4.47Å; M179-Q204 PolarHBondContact SD-NE2 3.05Å; M179-Q204 VanDerWaalsContact SD-NE2 3.42Å
180Y97.9Very high96.1Very high1 Ų139.2 Ų39.20%0.00421%0.209CC..Hα-helixtrans-70.3-32.8-179.8-76.9-64.8000112.4L73 D128 H176 Y182 Y183 A184L73-Y180 HydrophobicContact CB-CD1 3.77Å; L73-Y180 HydrophobicContact CB-CD2 3.79Å; L73-Y180 HydrophobicContact CB-CE1 4.03Å; L73-Y180 HydrophobicContact CB-CE2 4.02Å; L73-Y180 HydrophobicContact CB-CG 3.66Å; L73-Y180 HydrophobicContact CD1-CD1 3.9Å; L73-Y180 HydrophobicContact CD1-CE1 3.34Å; L73-Y180 HydrophobicContact CD1-CE2 4.13Å; L73-Y180 VanDerWaalsContact CD1-CZ 3.48Å; L73-Y180 HydrophobicContact CG-CD1 4.49Å; L73-Y180 HydrophobicContact CG-CE1 4.33Å; D128-Y180 WeakPolarHBondContact OD2-CE1 3.16Å; D128-Y180 PolarHBondContact OD2-OH 2.82Å; H176-Y180 HydrophobicContact CB-CD2 4.04Å; H176-Y180 HydrophobicContact CB-CE2 4.2Å; H176-Y180 AromaticContact CG-CE2 3.99Å; H176-Y180 AromaticContact ND1-CE2 3.55Å; H176-Y180 WeakPolarHBondContact O-CB 3.18Å; H176-Y180 WeakPolarHBondContact O-CD2 3.36Å; H176-Y180 PolarHBondContact O-N 3.46Å; Y180-Y182 VanDerWaalsContact C-N 3.32Å; Y180-Y182 PolarHBondContact O-N 3.47Å; Y180-Y183 HydrophobicContact CD1-CD2 4.13Å; Y180-Y183 HydrophobicContact CE1-CD2 4.42Å; Y180-Y183 PolarHBondContact O-N 2.7Å; Y180-A184 WeakPolarHBondContact O-CB 3.49Å; Y180-A184 PolarHBondContact O-N 2.91Å
181T97.4Very high95.6Very high68 Ų6840.9 Ų40.942%0.41723%0.226SC..Hα-helixtrans-60.9-43.6171.2-60.30000110.9S177 F178 A184 A185S177-T181 VanDerWaalsContact O-CB 3.26Å; S177-T181 WeakPolarHBondContact O-CB 3.23Å; S177-T181 PolarHBondContact O-N 2.91Å; S177-T181 PolarHBondContact O-OG1 3.25Å; F178-T181 PolarHBondContact O-N 3.49Å; T181-A184 PolarHBondContact O-N 3.07Å; T181-A185 PolarHBondContact O-N 2.96Å
182Y97Very high95.1Very high35 Ų3541.5 Ų41.514%0.13723%0.232CC..Hα-helixtrans-62.7-42.9174.1167.9-96.2000112.2F178 M179 Y180 A185 R186 P192 I196 P197 I200F178-Y182 WeakPolarHBondContact O-CB 3.32Å; F178-Y182 PolarHBondContact O-N 3.06Å; M179-Y182 WeakPolarHBondContact O-CB 3.16Å; M179-Y182 PolarHBondContact O-N 2.9Å; Y180-Y182 VanDerWaalsContact C-N 3.32Å; Y180-Y182 PolarHBondContact O-N 3.47Å; Y182-A185 PolarHBondContact O-N 3.49Å; Y182-R186 HydrophobicContact CD1-CG 4.3Å; Y182-R186 HydrophobicContact CD2-CG 4.36Å; Y182-R186 HydrophobicContact CE1-CG 3.78Å; Y182-R186 HydrophobicContact CE2-CG 3.87Å; Y182-R186 WeakPolarHBondContact O-CG 3.42Å; Y182-R186 PolarHBondContact O-N 2.61Å; Y182-P192 HydrophobicContact CD2-CB 4.4Å; Y182-P192 HydrophobicContact CD2-CG 3.94Å; Y182-P192 HydrophobicContact CE2-CB 4.16Å; Y182-P192 HydrophobicContact CE2-CG 3.78Å; Y182-I196 HydrophobicContact CD2-CG2 3.93Å; Y182-I196 HydrophobicContact CE2-CG2 4.5Å; Y182-P197 HydrophobicContact CE1-CB 4.35Å; Y182-P197 HydrophobicContact CE2-CB 3.95Å; Y182-P197 HydrophobicContact CE2-CG 4.14Å; Y182-I200 VanDerWaalsContact CB-CD1 3.4Å; Y182-I200 HydrophobicContact CD1-CD1 4.32Å; Y182-I200 HydrophobicContact CD2-CD1 4.14Å; Y182-I200 HydrophobicContact CG-CD1 3.7Å
183Y95.4Very high94.8Very high98 Ų9844.3 Ų44.338%0.38425%0.25SS..Hα-helixtrans-66.2-36.5177.3-66.1-27.8000113.1N70 M179 Y180 R186 S187N70-Y183 PolarHBondContact ND2-O 3.37Å; M179-Y183 HydrophobicContact CE-CE2 4Å; M179-Y183 HydrophobicContact CG-CD2 4.02Å; M179-Y183 HydrophobicContact CG-CE2 3.42Å; M179-Y183 VanDerWaalsContact CG-CE2 3.42Å; M179-Y183 PolarHBondContact O-N 2.77Å; M179-Y183 HydrophobicContact SD-CE2 3.79Å; Y180-Y183 HydrophobicContact CD1-CD2 4.13Å; Y180-Y183 HydrophobicContact CE1-CD2 4.42Å; Y180-Y183 PolarHBondContact O-N 2.7Å; Y183-R186 PolarHBondContact O-N 3.02Å; Y183-S187 WeakPolarHBondContact O-CB 3.15Å; Y183-S187 PolarHBondContact O-N 3.27Å; Y183-S187 PolarHBondContact O-OG 3.36Å
184A95.9Very high94.3Very high8 Ų848 Ų487%0.06627%0.266CS..Hα-helixtrans-62.2-45.5172.300000111.5N70 Y180 T181 R186 S187 L188N70-A184 HydrophobicContact CB-CB 3.71Å; Y180-A184 WeakPolarHBondContact O-CB 3.49Å; Y180-A184 PolarHBondContact O-N 2.91Å; T181-A184 PolarHBondContact O-N 3.07Å; A184-R186 PolarHBondContact O-N 3.25Å; A184-S187 WeakPolarHBondContact CA-OG 3.12Å; A184-S187 PolarHBondContact O-N 2.73Å; A184-S187 PolarHBondContact O-OG 3.08Å; A184-L188 PolarHBondContact O-N 2.66Å; A184-L188 VanDerWaalsContact O-N 3.15Å
185A95.5Very high94.1Very high24 Ų2453.4 Ų53.420%0.19828%0.283CS..Hα-helixtrans-61.1-44.3175.400000111.5T181 Y182 S187 L188 I190T181-A185 PolarHBondContact O-N 2.96Å; Y182-A185 PolarHBondContact O-N 3.49Å; A185-S187 PolarHBondContact O-N 3.46Å; A185-L188 WeakPolarHBondContact O-CB 3.43Å; A185-L188 PolarHBondContact O-N 2.97Å; A185-I190 HydrophobicContact CB-CB 4.42Å; A185-I190 HydrophobicContact CB-CD1 4.36Å; A185-I190 VanDerWaalsContact O-CB 3.27Å; A185-I190 WeakPolarHBondContact O-CB 3.43Å; A185-I190 PolarHBondContact O-N 3.05Å; A185-I190 VanDerWaalsContact O-N 3.13Å
186R93.1Very high93.9Very high56 Ų5655.4 Ų55.421%0.21129%0.293CS..Hα-helixtrans-62.1-40.5176.1-73.7-65.1-59.8160.3-9.3112.6Y182 Y183 A184 L188 G189 I190 S191 D278Y182-R186 HydrophobicContact CD1-CG 4.3Å; Y182-R186 HydrophobicContact CD2-CG 4.36Å; Y182-R186 HydrophobicContact CE1-CG 3.78Å; Y182-R186 HydrophobicContact CE2-CG 3.87Å; Y182-R186 WeakPolarHBondContact O-CG 3.42Å; Y182-R186 PolarHBondContact O-N 2.61Å; Y183-R186 PolarHBondContact O-N 3.02Å; A184-R186 PolarHBondContact O-N 3.25Å; R186-L188 VanDerWaalsContact C-N 3.25Å; R186-L188 PolarHBondContact O-N 3.08Å; R186-G189 PolarHBondContact O-N 2.99Å; R186-I190 WeakPolarHBondContact CD-O 3.27Å; R186-I190 PolarHBondContact NH1-O 3.16Å; R186-S191 VanDerWaalsContact NH1-CA 3.29Å; R186-S191 PolarHBondContact NH1-OG 3.24Å; R186-D278 IonicContact CZ-OD1 3.26Å; R186-D278 IonicContact NH2-OD1 3.83Å; R186-D278 PolarHBondContact NH2-OD1 3.04Å
187S92.4Very high93.8Very high14 Ų1455.3 Ų55.310%0.09829%0.294CS..Hα-helixtrans-70.7-21.4179.859.50000113.5T67 Y183 A184 A185 G189T67-S187 WeakPolarHBondContact CA-OG 3.33Å; T67-S187 WeakPolarHBondContact CB-OG 3.34Å; T67-S187 VanDerWaalsContact OG1-CB 3.29Å; T67-S187 WeakPolarHBondContact OG1-CB 3.28Å; T67-S187 PolarHBondContact OG1-OG 3.24Å; Y183-S187 WeakPolarHBondContact O-CB 3.15Å; Y183-S187 PolarHBondContact O-N 3.27Å; Y183-S187 PolarHBondContact O-OG 3.36Å; A184-S187 WeakPolarHBondContact CA-OG 3.12Å; A184-S187 PolarHBondContact O-N 2.73Å; A184-S187 PolarHBondContact O-OG 3.08Å; A185-S187 PolarHBondContact O-N 3.46Å; S187-G189 PolarHBondContact O-N 3.29Å
188L92.5Very high93.6Very high115 Ų11557.4 Ų57.460%0.60230%0.303SS*.THydrogen-bonded Turntrans-75.4-4.3167.6-72.9170000113.7T67 A184 A185 R186 I190T67-L188 HydrophobicContact CG2-CD1 4.2Å; T67-L188 HydrophobicContact CG2-CD2 3.71Å; T67-L188 HydrophobicContact CG2-CG 3.65Å; A184-L188 PolarHBondContact O-N 2.66Å; A184-L188 VanDerWaalsContact O-N 3.15Å; A185-L188 WeakPolarHBondContact O-CB 3.43Å; A185-L188 PolarHBondContact O-N 2.97Å; R186-L188 VanDerWaalsContact C-N 3.25Å; R186-L188 PolarHBondContact O-N 3.08Å; L188-I190 VanDerWaalsContact C-N 3.33Å; L188-I190 HydrophobicContact CB-CD1 4.38Å; L188-I190 HydrophobicContact CB-CG1 4.26Å
189G89Confident93.5Very high59 Ų5955.9 Ų55.961%0.60830%0.304SS*.THydrogen-bonded Turntrans85.24.4-176.600000113.9R186 S187R186-G189 PolarHBondContact O-N 2.99Å; S187-G189 PolarHBondContact O-N 3.29Å
190I91.1Very high93.5Very high93 Ų9355.8 Ų55.848%0.47730%0.304SS..  trans-68.1138.7172.7-53.8173.2000107.7A185 R186 L188 P192A185-I190 HydrophobicContact CB-CB 4.42Å; A185-I190 HydrophobicContact CB-CD1 4.36Å; A185-I190 VanDerWaalsContact O-CB 3.27Å; A185-I190 WeakPolarHBondContact O-CB 3.43Å; A185-I190 PolarHBondContact O-N 3.05Å; A185-I190 VanDerWaalsContact O-N 3.13Å; R186-I190 WeakPolarHBondContact CD-O 3.27Å; R186-I190 PolarHBondContact NH1-O 3.16Å; L188-I190 VanDerWaalsContact C-N 3.33Å; L188-I190 HydrophobicContact CB-CD1 4.38Å; L188-I190 HydrophobicContact CB-CG1 4.26Å; I190-P192 HydrophobicContact CG2-CG 4.46Å; I190-P192 VanDerWaalsContact O-CD 3.3Å; I190-P192 WeakPolarHBondContact O-CD 3.29Å
191S87.3Confident93.4Very high72 Ų7256 Ų5650%0.50331%0.305SS..  trans-114.384.3176.4-63.90000110.1R186R186-S191 VanDerWaalsContact NH1-CA 3.29Å; R186-S191 PolarHBondContact NH1-OG 3.24Å
192P88.5Confident93.4Very high27 Ų2754.2 Ų54.218%0.17530%0.3CS..  trans-61146.5-179.9-16.930.3000110.5Y182 I190 I196Y182-P192 HydrophobicContact CD2-CB 4.4Å; Y182-P192 HydrophobicContact CD2-CG 3.94Å; Y182-P192 HydrophobicContact CE2-CB 4.16Å; Y182-P192 HydrophobicContact CE2-CG 3.78Å; I190-P192 HydrophobicContact CG2-CG 4.46Å; I190-P192 VanDerWaalsContact O-CD 3.3Å; I190-P192 WeakPolarHBondContact O-CD 3.29Å; P192-I196 HydrophobicContact CB-CB 4.28Å; P192-I196 HydrophobicContact CB-CD1 3.84Å; P192-I196 HydrophobicContact CB-CG2 4.39Å
193P90.7Very high93.4Very high70 Ų7055.3 Ų55.346%0.45531%0.307SS..  trans-59150.7178.325.5-37.6000112W195 I196 P197P193-W195 PolarHBondContact O-N 3.02Å; P193-I196 HydrophobicContact CG-CD1 3.94Å; P193-I196 HydrophobicContact CG-CG1 4.23Å; P193-I196 PolarHBondContact O-N 3.1Å; P193-P197 VanDerWaalsContact O-CD 3.22Å; P193-P197 WeakPolarHBondContact O-CD 3.48Å
194K89.3Confident93.5Very high79 Ų7951.5 Ų51.534%0.34329%0.293SS..THydrogen-bonded Turntrans-47.4-34.5-175.5179.4-171.3-179-1670114.5I196 P197 M198 Y264K194-I196 VanDerWaalsContact C-N 3.27Å; K194-I196 PolarHBondContact O-N 3.46Å; K194-P197 VanDerWaalsContact O-CD 3.31Å; K194-P197 WeakPolarHBondContact O-CD 3.44Å; K194-P197 WeakPolarHBondContact O-CG 3.38Å; K194-M198 HydrophobicContact CD-CE 4.29Å; K194-M198 HydrophobicContact CG-CE 4.33Å; K194-M198 WeakPolarHBondContact O-CB 3.27Å; K194-M198 PolarHBondContact O-N 2.94Å; K194-Y264 HydrophobicContact CB-CD1 3.93Å; K194-Y264 HydrophobicContact CB-CE1 4.06Å; K194-Y264 HydrophobicContact CB-CG 4.44Å; K194-Y264 HydrophobicContact CD-CD1 4.15Å; K194-Y264 HydrophobicContact CD-CD2 4.13Å; K194-Y264 HydrophobicContact CD-CG 3.78Å; K194-Y264 HydrophobicContact CG-CD1 3.73Å; K194-Y264 HydrophobicContact CG-CD2 4.03Å; K194-Y264 HydrophobicContact CG-CE1 3.9Å; K194-Y264 HydrophobicContact CG-CE2 4.18Å; K194-Y264 HydrophobicContact CG-CG 3.77Å
195W93.3Very high93.5Very high164 Ų16452.4 Ų52.462%0.62130%0.297SS*.Hα-helixtrans-64.9-31.4-176.969.3-98.3000112.3P193 M198 C199P193-W195 PolarHBondContact O-N 3.02Å; W195-M198 PolarHBondContact O-N 3.35Å; W195-C199 WeakPolarHBondContact O-CB 3.5Å; W195-C199 PolarHBondContact O-N 3.27Å; W195-C199 PolarHBondContact O-SG 2.99Å
196I94.7Very high93.6Very high48 Ų4854.1 Ų54.125%0.24631%0.31CS..Hα-helixtrans-63.3-59.3179.6-67.1177.2000112.1Y182 P192 P193 K194 M198 C199 I200Y182-I196 HydrophobicContact CD2-CG2 3.93Å; Y182-I196 HydrophobicContact CE2-CG2 4.5Å; P192-I196 HydrophobicContact CB-CB 4.28Å; P192-I196 HydrophobicContact CB-CD1 3.84Å; P192-I196 HydrophobicContact CB-CG2 4.39Å; P193-I196 HydrophobicContact CG-CD1 3.94Å; P193-I196 HydrophobicContact CG-CG1 4.23Å; P193-I196 PolarHBondContact O-N 3.1Å; K194-I196 VanDerWaalsContact C-N 3.27Å; K194-I196 PolarHBondContact O-N 3.46Å; I196-M198 PolarHBondContact O-N 3.07Å; I196-C199 PolarHBondContact O-N 3.34Å; I196-C199 VanDerWaalsContact O-N 3.15Å; I196-I200 HydrophobicContact CG2-CD1 4.08Å; I196-I200 WeakPolarHBondContact O-CG1 3.26Å; I196-I200 PolarHBondContact O-N 2.96Å
197P94.5Very high93.9Very high7 Ų752.1 Ų52.15%0.04530%0.304CS..Hα-helixtrans-63.4-28.6177.525.2-33.7000112.2Y182 P193 K194 I200 T201 Y257 Y264Y182-P197 HydrophobicContact CE1-CB 4.35Å; Y182-P197 HydrophobicContact CE2-CB 3.95Å; Y182-P197 HydrophobicContact CE2-CG 4.14Å; P193-P197 VanDerWaalsContact O-CD 3.22Å; P193-P197 WeakPolarHBondContact O-CD 3.48Å; K194-P197 VanDerWaalsContact O-CD 3.31Å; K194-P197 WeakPolarHBondContact O-CD 3.44Å; K194-P197 WeakPolarHBondContact O-CG 3.38Å; P197-I200 PolarHBondContact O-N 3.47Å; P197-T201 PolarHBondContact O-N 2.88Å; P197-T201 PolarHBondContact O-OG1 3.43Å; P197-Y257 VanDerWaalsContact C-OH 3.22Å; P197-Y257 PolarHBondContact O-OH 3.36Å; P197-Y257 VanDerWaalsContact O-OH 3.1Å; P197-Y264 WeakPolarHBondContact CG-OH 3.42Å
198M94.2Very high94.1Very high52 Ų5251.6 Ų51.626%0.25630%0.3SS..Hα-helixtrans-64.5-45.5173.1-173.6-178.2-63.200111.8K194 W195 I196 I200 T201 G202 F253 Y257K194-M198 HydrophobicContact CD-CE 4.29Å; K194-M198 HydrophobicContact CG-CE 4.33Å; K194-M198 WeakPolarHBondContact O-CB 3.27Å; K194-M198 PolarHBondContact O-N 2.94Å; W195-M198 PolarHBondContact O-N 3.35Å; I196-M198 PolarHBondContact O-N 3.07Å; M198-I200 VanDerWaalsContact C-N 3.33Å; M198-I200 PolarHBondContact O-N 2.86Å; M198-T201 PolarHBondContact O-N 2.91Å; M198-G202 PolarHBondContact O-N 3.5Å; M198-F253 HydrophobicContact CG-CE2 3.65Å; M198-F253 HydrophobicContact CG-CZ 3.72Å; M198-F253 HydrophobicContact SD-CZ 4.23Å; M198-Y257 HydrophobicContact CB-CD1 4.24Å; M198-Y257 HydrophobicContact CB-CE1 4Å; M198-Y257 HydrophobicContact CE-CD1 3.71Å; M198-Y257 HydrophobicContact CE-CG 3.93Å; M198-Y257 HydrophobicContact CG-CD1 4.42Å; M198-Y257 HydrophobicContact CG-CG 4.4Å
199C96.9Very high94.3Very high68 Ų6850 Ų5046%0.45929%0.294SS..Hα-helixtrans-61.2-41.5174.8-71.70000111.5W195 I196 G202 M203W195-C199 WeakPolarHBondContact O-CB 3.5Å; W195-C199 PolarHBondContact O-N 3.27Å; W195-C199 PolarHBondContact O-SG 2.99Å; I196-C199 PolarHBondContact O-N 3.34Å; I196-C199 VanDerWaalsContact O-N 3.15Å; C199-G202 CarbonylContact O-C 3.53Å; C199-G202 WeakPolarHBondContact O-CA 3.3Å; C199-G202 PolarHBondContact O-N 2.74Å; C199-M203 WeakPolarHBondContact O-CG 3.43Å; C199-M203 PolarHBondContact O-N 3.41Å
200I97.1Very high94.7Very high13 Ų1348.5 Ų48.57%0.06728%0.277CS..Hα-helixtrans-61.9-47.7176.6-64.2168000111F178 M179 Y182 I196 P197 M198 G202 M203 Q204F178-I200 HydrophobicContact CB-CG1 4.32Å; M179-I200 HydrophobicContact CB-CG2 4.16Å; M179-I200 HydrophobicContact CG-CG2 4.47Å; Y182-I200 VanDerWaalsContact CB-CD1 3.4Å; Y182-I200 HydrophobicContact CD1-CD1 4.32Å; Y182-I200 HydrophobicContact CD2-CD1 4.14Å; Y182-I200 HydrophobicContact CG-CD1 3.7Å; I196-I200 HydrophobicContact CG2-CD1 4.08Å; I196-I200 WeakPolarHBondContact O-CG1 3.26Å; I196-I200 PolarHBondContact O-N 2.96Å; P197-I200 PolarHBondContact O-N 3.47Å; M198-I200 VanDerWaalsContact C-N 3.33Å; M198-I200 PolarHBondContact O-N 2.86Å; I200-G202 PolarHBondContact O-N 3.17Å; I200-M203 HydrophobicContact CB-CE 4.34Å; I200-M203 HydrophobicContact CG1-CE 3.95Å; I200-M203 PolarHBondContact O-N 3.16Å; I200-M203 VanDerWaalsContact O-N 3.17Å; I200-Q204 WeakPolarHBondContact O-CG 3.19Å; I200-Q204 PolarHBondContact O-N 3.05Å
201T95.4Very high95Very high7 Ų744.1 Ų44.14%0.04325%0.254CS..Hα-helixtrans-64.6-32.5175.8-47.20000111.7P197 M198 Q204 L205 F249 F252 F253 Y257P197-T201 PolarHBondContact O-N 2.88Å; P197-T201 PolarHBondContact O-OG1 3.43Å; M198-T201 PolarHBondContact O-N 2.91Å; T201-Q204 PolarHBondContact O-N 3.25Å; T201-L205 PolarHBondContact O-N 3.26Å; T201-F249 HydrophobicContact CG2-CD1 4.23Å; T201-F252 HydrophobicContact CG2-CD1 3.86Å; T201-F252 HydrophobicContact CG2-CE1 4.11Å; T201-F253 HydrophobicContact CG2-CB 4.18Å; T201-F253 HydrophobicContact CG2-CD2 3.71Å; T201-F253 HydrophobicContact CG2-CG 4.46Å; T201-Y257 HydrophobicContact CG2-CE2 4.25Å; T201-Y257 PolarHBondContact OG1-OH 2.94Å
202G97Very high95.4Very high30 Ų3041.9 Ų41.931%0.30924%0.238SC..Hα-helixtrans-62.9-43.8171.200000112.8M198 C199 I200 L205 A206M198-G202 PolarHBondContact O-N 3.5Å; C199-G202 CarbonylContact O-C 3.53Å; C199-G202 WeakPolarHBondContact O-CA 3.3Å; C199-G202 PolarHBondContact O-N 2.74Å; I200-G202 PolarHBondContact O-N 3.17Å; G202-L205 PolarHBondContact O-N 3.12Å; G202-A206 WeakPolarHBondContact O-CB 3.41Å; G202-A206 PolarHBondContact O-N 3.09Å
203M97.5Very high95.8Very high58 Ų5846 Ų4629%0.28625%0.254SS..Hα-helixtrans-63.7-39.8174.5-70.5-172.8-69.400111.9V175 F178 C199 I200 L205 A206 Q207V175-M203 HydrophobicContact CG2-CB 4.17Å; F178-M203 HydrophobicContact CB-CE 3.72Å; F178-M203 HydrophobicContact CD1-CE 4.4Å; F178-M203 HydrophobicContact CD2-CE 3.67Å; F178-M203 HydrophobicContact CD2-SD 3.86Å; F178-M203 HydrophobicContact CE2-CE 4.39Å; F178-M203 HydrophobicContact CE2-SD 4.13Å; F178-M203 HydrophobicContact CG-CE 3.68Å; F178-M203 HydrophobicContact CG-SD 4.45Å; C199-M203 WeakPolarHBondContact O-CG 3.43Å; C199-M203 PolarHBondContact O-N 3.41Å; I200-M203 HydrophobicContact CB-CE 4.34Å; I200-M203 HydrophobicContact CG1-CE 3.95Å; I200-M203 PolarHBondContact O-N 3.16Å; I200-M203 VanDerWaalsContact O-N 3.17Å; M203-L205 PolarHBondContact O-N 2.85Å; M203-A206 PolarHBondContact O-N 3.37Å; M203-Q207 WeakPolarHBondContact O-CB 3.38Å; M203-Q207 PolarHBondContact O-N 3.46Å
204Q97.6Very high96.1Very high17 Ų1742.8 Ų42.88%0.07923%0.232CC..Hα-helixtrans-60.1-44.8173.6-72.8171.3-42.900111.5V175 M179 I200 T201 Q207 M208 F249V175-Q204 HydrophobicContact CG1-CB 4.46Å; V175-Q204 HydrophobicContact CG1-CG 3.41Å; V175-Q204 VanDerWaalsContact CG1-CG 3.41Å; M179-Q204 PolarHBondContact SD-NE2 3.05Å; M179-Q204 VanDerWaalsContact SD-NE2 3.42Å; I200-Q204 WeakPolarHBondContact O-CG 3.19Å; I200-Q204 PolarHBondContact O-N 3.05Å; T201-Q204 PolarHBondContact O-N 3.25Å; Q204-Q207 WeakPolarHBondContact O-CB 3.34Å; Q204-Q207 PolarHBondContact O-N 3.35Å; Q204-M208 WeakPolarHBondContact O-CG 3.42Å; Q204-M208 PolarHBondContact O-N 3.42Å; Q204-M208 VanDerWaalsContact O-N 3.12Å; Q204-F249 HydrophobicContact CB-CD1 4.05Å; Q204-F249 HydrophobicContact CB-CE1 4Å; Q204-F249 HydrophobicContact CB-CZ 4.47Å; Q204-F249 VanDerWaalsContact CD-CE1 3.42Å; Q204-F249 HydrophobicContact CG-CE1 4.2Å
205L97Very high96.4Very high28 Ų2839.1 Ų39.115%0.14722%0.217CC..Hα-helixtrans-63-45.2175.7-81.7168.2000112.4T201 G202 M203 Q207 M208 V209 F246 F249 A250 F253T201-L205 PolarHBondContact O-N 3.26Å; G202-L205 PolarHBondContact O-N 3.12Å; M203-L205 PolarHBondContact O-N 2.85Å; L205-Q207 VanDerWaalsContact C-N 3.3Å; L205-Q207 PolarHBondContact O-N 3.04Å; L205-M208 PolarHBondContact O-N 2.97Å; L205-V209 PolarHBondContact O-N 3.47Å; L205-V209 VanDerWaalsContact O-N 3.09Å; L205-F246 HydrophobicContact CD2-CD2 3.95Å; L205-F246 HydrophobicContact CD2-CE2 4.1Å; L205-F249 HydrophobicContact CD2-CB 3.73Å; L205-F249 HydrophobicContact CG-CB 4.12Å; L205-A250 HydrophobicContact CD2-CB 4.08Å; L205-F253 HydrophobicContact CD1-CB 3.97Å; L205-F253 HydrophobicContact CD1-CD2 4.07Å; L205-F253 HydrophobicContact CD1-CG 4.04Å
206A97.6Very high96.4Very high59 Ų5938.1 Ų38.149%0.48821%0.213SC..Hα-helixtrans-60.2-41.1176.500000111.6G202 M203 M208 V209 A210G202-A206 WeakPolarHBondContact O-CB 3.41Å; G202-A206 PolarHBondContact O-N 3.09Å; M203-A206 PolarHBondContact O-N 3.37Å; A206-M208 VanDerWaalsContact C-N 3.28Å; A206-M208 PolarHBondContact O-N 2.85Å; A206-V209 PolarHBondContact O-N 3.5Å; A206-A210 WeakPolarHBondContact O-CB 3.14Å; A206-A210 PolarHBondContact O-N 3.22Å
207Q97.8Very high96.5Very high14 Ų1437.1 Ų37.17%0.06521%0.209CC..Hα-helixtrans-57.3-41.1172.5174.9-167.2-50.800111.3M171 V175 M203 Q204 L205 A210 G211 Y242M171-Q207 HydrophobicContact CB-CG 3.99Å; V175-Q207 HydrophobicContact CG2-CB 4.22Å; V175-Q207 VanDerWaalsContact CG2-OE1 3.25Å; M203-Q207 WeakPolarHBondContact O-CB 3.38Å; M203-Q207 PolarHBondContact O-N 3.46Å; Q204-Q207 WeakPolarHBondContact O-CB 3.34Å; Q204-Q207 PolarHBondContact O-N 3.35Å; L205-Q207 VanDerWaalsContact C-N 3.3Å; L205-Q207 PolarHBondContact O-N 3.04Å; Q207-A210 PolarHBondContact O-N 3.33Å; Q207-G211 PolarHBondContact O-N 3.47Å; Q207-Y242 HydrophobicContact CG-CE1 4.4Å
208M97.2Very high96.5Very high4 Ų436.8 Ų36.82%0.0221%0.207CC..Hα-helixtrans-68-41.1179.9-55-46.9151.800112.6Q204 L205 A206 G211 C212 Y242 Y245 F246 F249Q204-M208 WeakPolarHBondContact O-CG 3.42Å; Q204-M208 PolarHBondContact O-N 3.42Å; Q204-M208 VanDerWaalsContact O-N 3.12Å; L205-M208 PolarHBondContact O-N 2.97Å; A206-M208 VanDerWaalsContact C-N 3.28Å; A206-M208 PolarHBondContact O-N 2.85Å; M208-G211 PolarHBondContact O-N 3.34Å; M208-C212 PolarHBondContact O-N 3.39Å; M208-C212 PolarHBondContact O-SG 3.46Å; M208-Y242 HydrophobicContact CB-CD1 4.39Å; M208-Y242 HydrophobicContact SD-CD1 3.56Å; M208-Y242 VanDerWaalsContact SD-CD1 3.56Å; M208-Y242 HydrophobicContact SD-CE1 3.82Å; M208-Y245 HydrophobicContact CE-CD2 4.16Å; M208-Y245 VanDerWaalsContact SD-CB 3.58Å; M208-Y245 HydrophobicContact SD-CD2 3.84Å; M208-Y245 HydrophobicContact SD-CG 4.25Å; M208-F246 HydrophobicContact CB-CB 3.87Å; M208-F246 HydrophobicContact CB-CD2 4.34Å; M208-F249 HydrophobicContact CE-CD2 4.29Å; M208-F249 HydrophobicContact CE-CE2 4.14Å
209V97.4Very high96.5Very high80 Ų8037.3 Ų37.349%0.48521%0.207SC..Hα-helixtrans-62.2-46.8175176.40000110.8L205 A206 G211 C212 F213 F246L205-V209 PolarHBondContact O-N 3.47Å; L205-V209 VanDerWaalsContact O-N 3.09Å; A206-V209 PolarHBondContact O-N 3.5Å; V209-G211 VanDerWaalsContact C-N 3.33Å; V209-G211 PolarHBondContact O-N 2.97Å; V209-C212 PolarHBondContact O-N 3.47Å; V209-F213 WeakPolarHBondContact O-CB 3.19Å; V209-F213 PolarHBondContact O-N 2.89Å; V209-F246 HydrophobicContact CG2-CD2 3.77Å; V209-F246 HydrophobicContact CG2-CE2 3.57Å
210A97.2Very high96.4Very high29 Ų2936.1 Ų36.124%0.2420%0.196CC..Hα-helixtrans-62.2-39.6176.700000111.9M171 A206 Q207 F213 V214M171-A210 HydrophobicContact CE-CB 4.22Å; M171-A210 HydrophobicContact SD-CB 3.48Å; M171-A210 WeakPolarHBondContact SD-CB 3.38Å; A206-A210 WeakPolarHBondContact O-CB 3.14Å; A206-A210 PolarHBondContact O-N 3.22Å; Q207-A210 PolarHBondContact O-N 3.33Å; A210-F213 PolarHBondContact O-N 3.48Å; A210-V214 WeakPolarHBondContact O-CG2 3.22Å; A210-V214 PolarHBondContact O-N 3Å
211G96.7Very high96.3Very high0 Ų036.5 Ų36.50%020%0.198CC..Hα-helixtrans-61.9-43.3175.600000113.2Q207 M208 V209 S215Q207-G211 PolarHBondContact O-N 3.47Å; M208-G211 PolarHBondContact O-N 3.34Å; V209-G211 VanDerWaalsContact C-N 3.33Å; V209-G211 PolarHBondContact O-N 2.97Å; G211-S215 WeakPolarHBondContact O-CB 3.3Å; G211-S215 PolarHBondContact O-N 3.32Å; G211-S215 PolarHBondContact O-OG 2.95Å
212C96.7Very high96.2Very high26 Ų2638.2 Ų38.218%0.17620%0.204CC..Hα-helixtrans-62.2-44.7172.2-72.20000111.8M208 V209 S215 W216 F239M208-C212 PolarHBondContact O-N 3.39Å; M208-C212 PolarHBondContact O-SG 3.46Å; V209-C212 PolarHBondContact O-N 3.47Å; C212-S215 PolarHBondContact O-N 3.38Å; C212-W216 VanDerWaalsContact O-CB 3.29Å; C212-W216 WeakPolarHBondContact O-CB 3.14Å; C212-W216 PolarHBondContact O-N 3.49Å; C212-F239 HydrophobicContact CB-CE2 4.41Å
213F96.6Very high96.1Very high114 Ų11444.3 Ų44.350%0.522%0.218SC..Hα-helixtrans-62.2-46.4179.7175.8-102.6000112.5F97 V209 A210 W216 T217F97-F213 AromaticContact CE1-CE1 3.96Å; F97-F213 HydrophobicContact CE1-CE1 3.96Å; F97-F213 HydrophobicContact CE2-CE1 4.36Å; F97-F213 HydrophobicContact CZ-CD1 4.15Å; F97-F213 AromaticContact CZ-CE1 3.55Å; F97-F213 HydrophobicContact CZ-CE1 3.55Å; F97-F213 HydrophobicContact CZ-CZ 4.48Å; V209-F213 WeakPolarHBondContact O-CB 3.19Å; V209-F213 PolarHBondContact O-N 2.89Å; A210-F213 PolarHBondContact O-N 3.48Å; F213-W216 PolarHBondContact O-N 3.37Å; F213-T217 WeakPolarHBondContact O-CB 3.27Å; F213-T217 PolarHBondContact O-N 3.2Å; F213-T217 PolarHBondContact O-OG1 3.43Å
214V96.2Very high95.9Very high1 Ų147.1 Ų47.11%0.00623%0.234CC..Hα-helixtrans-61.8-44.8176.1170.50000110.6F97 V101 A164 W167 F168 A210 T217 S218F97-V214 HydrophobicContact CZ-CG2 4.45Å; V101-V214 HydrophobicContact CG1-CG1 3.93Å; V101-V214 HydrophobicContact CG2-CG1 4.26Å; A164-V214 HydrophobicContact CB-CG1 3.87Å; W167-V214 HydrophobicContact CB-CG1 4.14Å; W167-V214 HydrophobicContact CB-CG2 4.09Å; W167-V214 HydrophobicContact CD2-CG2 3.92Å; W167-V214 HydrophobicContact CE3-CG2 4.21Å; W167-V214 HydrophobicContact CG-CG1 4.24Å; W167-V214 HydrophobicContact CG-CG2 3.86Å; F168-V214 HydrophobicContact CE1-CB 4.25Å; F168-V214 HydrophobicContact CE1-CG1 4.1Å; F168-V214 HydrophobicContact CZ-CG1 4.37Å; A210-V214 WeakPolarHBondContact O-CG2 3.22Å; A210-V214 PolarHBondContact O-N 3Å; V214-T217 PolarHBondContact O-N 2.94Å; V214-S218 WeakPolarHBondContact O-CB 3.42Å; V214-S218 PolarHBondContact O-N 2.78Å; V214-S218 PolarHBondContact O-OG 2.92Å
215S95.3Very high95.4Very high2 Ų253.7 Ų53.71%0.01427%0.27CS..Hα-helixtrans-62.6-45.9178.2-58.20000111.9F168 G211 C212 T217 S218 Y219 S238F168-S215 WeakPolarHBondContact CZ-OG 3.34Å; G211-S215 WeakPolarHBondContact O-CB 3.3Å; G211-S215 PolarHBondContact O-N 3.32Å; G211-S215 PolarHBondContact O-OG 2.95Å; C212-S215 PolarHBondContact O-N 3.38Å; S215-T217 PolarHBondContact O-N 2.99Å; S215-S218 WeakPolarHBondContact O-CB 3.4Å; S215-S218 PolarHBondContact O-N 2.99Å; S215-Y219 WeakPolarHBondContact O-CB 3.46Å; S215-Y219 PolarHBondContact O-N 2.91Å; S215-S238 WeakPolarHBondContact CB-OG 3.37Å; S215-S238 PolarHBondContact OG-OG 3.46Å
216W94.6Very high95.1Very high143 Ų14354.8 Ų54.854%0.54228%0.28SS..Hα-helixtrans-62.7-42.2177.8177.9-103000112.1C212 F213 Y219 N220C212-W216 VanDerWaalsContact O-CB 3.29Å; C212-W216 WeakPolarHBondContact O-CB 3.14Å; C212-W216 PolarHBondContact O-N 3.49Å; F213-W216 PolarHBondContact O-N 3.37Å; W216-Y219 WeakPolarHBondContact O-CB 3.48Å; W216-Y219 PolarHBondContact O-N 3.44Å; W216-N220 VanDerWaalsContact CD1-ND2 3.33Å; W216-N220 PolarHBondContact NE1-ND2 3.04Å; W216-N220 PolarHBondContact O-N 3.46Å; W216-N220 PolarHBondContact O-ND2 3.41Å
217T95.2Very high94.8Very high27 Ų2759.4 Ų59.417%0.16629%0.286CS..Hα-helixtrans-67.6-44.7179.4-54.30000111F97 F213 V214 S215 Y219 N220 I221F97-T217 HydrophobicContact CD1-CG2 4.41Å; F97-T217 HydrophobicContact CE1-CG2 3.76Å; F213-T217 WeakPolarHBondContact O-CB 3.27Å; F213-T217 PolarHBondContact O-N 3.2Å; F213-T217 PolarHBondContact O-OG1 3.43Å; V214-T217 PolarHBondContact O-N 2.94Å; S215-T217 PolarHBondContact O-N 2.99Å; T217-Y219 VanDerWaalsContact C-N 3.27Å; T217-Y219 PolarHBondContact O-N 3.27Å; T217-N220 PolarHBondContact O-N 2.85Å; T217-I221 HydrophobicContact CG2-CD1 3.68Å; T217-I221 HydrophobicContact CG2-CG1 4.35Å; T217-I221 WeakPolarHBondContact O-CD1 3.4Å; T217-I221 VanDerWaalsContact O-CG1 3.29Å; T217-I221 WeakPolarHBondContact O-CG1 3.16Å; T217-I221 PolarHBondContact O-N 2.87Å
218S94.5Very high94.5Very high0 Ų059.3 Ų59.30%029%0.287CS..Hα-helixtrans-54.3-44.8173-53.10000111.7V101 V214 S215 I221 K222 L235V101-S218 WeakPolarHBondContact CG1-OG 3.31Å; V214-S218 WeakPolarHBondContact O-CB 3.42Å; V214-S218 PolarHBondContact O-N 2.78Å; V214-S218 PolarHBondContact O-OG 2.92Å; S215-S218 WeakPolarHBondContact O-CB 3.4Å; S215-S218 PolarHBondContact O-N 2.99Å; S218-I221 PolarHBondContact O-N 3.48Å; S218-K222 WeakPolarHBondContact O-CB 3.37Å; S218-K222 PolarHBondContact O-N 3.43Å; S218-L235 VanDerWaalsContact CB-CD2 3.44Å
219Y95Very high94.2Very high63 Ų6362.1 Ų62.125%0.24730%0.3CS..Hα-helixtrans-61.7-47.4178.2174.4-97.4000112S215 W216 T217 K222 R223 Y232 L235 Y236S215-Y219 WeakPolarHBondContact O-CB 3.46Å; S215-Y219 PolarHBondContact O-N 2.91Å; W216-Y219 WeakPolarHBondContact O-CB 3.48Å; W216-Y219 PolarHBondContact O-N 3.44Å; T217-Y219 VanDerWaalsContact C-N 3.27Å; T217-Y219 PolarHBondContact O-N 3.27Å; Y219-K222 PolarHBondContact O-N 3.21Å; Y219-R223 VanDerWaalsContact O-CB 3.25Å; Y219-R223 WeakPolarHBondContact O-CB 3.46Å; Y219-R223 PolarHBondContact O-N 3.45Å; Y219-Y232 HydrophobicContact CD2-CD1 4.36Å; Y219-Y232 HydrophobicContact CD2-CE1 4.36Å; Y219-Y232 HydrophobicContact CE2-CD1 4.27Å; Y219-Y232 HydrophobicContact CE2-CE1 4.19Å; Y219-L235 HydrophobicContact CD2-CD1 4.4Å; Y219-Y236 HydrophobicContact CE2-CE1 4.22Å
220N95.1Very high93.8Very high44 Ų4458.9 Ų58.924%0.23528%0.279CS..Hα-helixtrans-65.6-41.5179.3-74.2-56.6000112.7W216 T217 K222 R223 N224W216-N220 VanDerWaalsContact CD1-ND2 3.33Å; W216-N220 PolarHBondContact NE1-ND2 3.04Å; W216-N220 PolarHBondContact O-N 3.46Å; W216-N220 PolarHBondContact O-ND2 3.41Å; T217-N220 PolarHBondContact O-N 2.85Å; N220-K222 VanDerWaalsContact C-N 3.35Å; N220-K222 PolarHBondContact O-N 2.83Å; N220-R223 PolarHBondContact O-N 3.1Å; N220-N224 WeakPolarHBondContact O-CB 3.27Å; N220-N224 VanDerWaalsContact O-CG 3.26Å; N220-N224 PolarHBondContact O-N 3Å; N220-N224 PolarHBondContact O-ND2 2.96Å
221I94.5Very high93.5Very high20 Ų2059.2 Ų59.210%0.10328%0.28CS..Hα-helixtrans-60.4-48.2176.5-67.3160.9000109.9Q98 T217 S218 R223 N224 S226 C228Q98-I221 HydrophobicContact CB-CD1 4.34Å; Q98-I221 HydrophobicContact CG-CD1 4.01Å; Q98-I221 HydrophobicContact CG-CG2 4.35Å; T217-I221 HydrophobicContact CG2-CD1 3.68Å; T217-I221 HydrophobicContact CG2-CG1 4.35Å; T217-I221 WeakPolarHBondContact O-CD1 3.4Å; T217-I221 VanDerWaalsContact O-CG1 3.29Å; T217-I221 WeakPolarHBondContact O-CG1 3.16Å; T217-I221 PolarHBondContact O-N 2.87Å; S218-I221 PolarHBondContact O-N 3.48Å; I221-R223 PolarHBondContact O-N 3.17Å; I221-N224 PolarHBondContact O-N 3.43Å; I221-S226 WeakPolarHBondContact O-CB 3.23Å; I221-S226 PolarHBondContact O-N 2.62Å; I221-C228 HydrophobicContact CG2-CB 4.47Å
222K93.6Very high93.3Very high43 Ų4363.8 Ų63.819%0.18730%0.298CS..Hα-helixtrans-64.5-40.2179.1-168.9177.3-179.6-170.90112.3S218 Y219 N220 N224 N225 C228 Q230 Y232 L235S218-K222 WeakPolarHBondContact O-CB 3.37Å; S218-K222 PolarHBondContact O-N 3.43Å; Y219-K222 PolarHBondContact O-N 3.21Å; N220-K222 VanDerWaalsContact C-N 3.35Å; N220-K222 PolarHBondContact O-N 2.83Å; K222-N224 VanDerWaalsContact C-N 3.26Å; K222-N224 PolarHBondContact O-N 2.73Å; K222-N225 PolarHBondContact O-N 2.96Å; K222-N225 VanDerWaalsContact O-N 3.11Å; K222-C228 HydrophobicContact CB-CB 4.04Å; K222-C228 HydrophobicContact CG-CB 4.4Å; K222-Q230 WeakPolarHBondContact CE-O 3.21Å; K222-Q230 PolarHBondContact NZ-O 3.32Å; K222-Y232 HydrophobicContact CD-CD1 4.47Å; K222-Y232 HydrophobicContact CD-CE1 4.08Å; K222-Y232 HydrophobicContact CD-CE2 4.24Å; K222-Y232 HydrophobicContact CG-CE1 4.39Å; K222-L235 HydrophobicContact CD-CD1 4.18Å
223R94.2Very high93Very high158 Ų15868.2 Ų68.260%0.59632%0.316SS*.Hα-helixtrans-62-34176.5-174.3-175.5-177.8-140.7-0.1112.1Y219 N220 I221 N225Y219-R223 VanDerWaalsContact O-CB 3.25Å; Y219-R223 WeakPolarHBondContact O-CB 3.46Å; Y219-R223 PolarHBondContact O-N 3.45Å; N220-R223 PolarHBondContact O-N 3.1Å; I221-R223 PolarHBondContact O-N 3.17Å; R223-N225 PolarHBondContact O-N 3.08Å; R223-N225 VanDerWaalsContact O-N 3.14Å
224N93.3Very high92.8Very high117 Ų11762.8 Ų62.863%0.62629%0.292SS*.THydrogen-bonded Turntrans-78.719.9175.5-67.7-15.6000113.1N220 I221 K222 S226N220-N224 WeakPolarHBondContact O-CB 3.27Å; N220-N224 VanDerWaalsContact O-CG 3.26Å; N220-N224 PolarHBondContact O-N 3Å; N220-N224 PolarHBondContact O-ND2 2.96Å; I221-N224 PolarHBondContact O-N 3.43Å; K222-N224 VanDerWaalsContact C-N 3.26Å; K222-N224 PolarHBondContact O-N 2.73Å; N224-S226 PolarHBondContact O-N 2.88Å
225N88.7Confident92.7Very high156 Ų15662.9 Ų62.983%0.83429%0.293SS*.THydrogen-bonded Turntrans56.120.5-178.7-69.7-31.9000115K222 R223K222-N225 PolarHBondContact O-N 2.96Å; K222-N225 VanDerWaalsContact O-N 3.11Å; R223-N225 PolarHBondContact O-N 3.08Å; R223-N225 VanDerWaalsContact O-N 3.14Å
226S90.4Very high92.6Very high50 Ų5069.2 Ų69.235%0.3532%0.318SS..  trans-82149.1170.7-66.10000110.5I221 N224 C228I221-S226 WeakPolarHBondContact O-CB 3.23Å; I221-S226 PolarHBondContact O-N 2.62Å; N224-S226 PolarHBondContact O-N 2.88Å; S226-C228 PolarHBondContact O-N 3.4Å
227Y90.6Very high92.6Very high156 Ų15667 Ų6761%0.61231%0.312SS*.  trans-58.1124.1176.9174.4-93.6000110.8Q229Y227-Q229 PolarHBondContact OH-OE1 2.79Å
228C91.8Very high92.6Very high13 Ų1365.8 Ų65.89%0.08830%0.304CS..  trans-150.3115.3173.3-156.60000110.7C102 I221 K222 S226 Q230C102-C228 WeakPolarHBondContact CA-SG 3.31Å; C102-C228 HydrophobicContact CB-CB 3.74Å; C102-C228 WeakPolarHBondContact CB-SG 3.37Å; C102-C228 WeakPolarHBondContact SG-CB 3.43Å; C102-C228 CovalentContact SG-SG 2.06Å; C102-C228 PolarHBondContact SG-SG 2.88Å; I221-C228 HydrophobicContact CG2-CB 4.47Å; K222-C228 HydrophobicContact CB-CB 4.04Å; K222-C228 HydrophobicContact CG-CB 4.4Å; S226-C228 PolarHBondContact O-N 3.4Å; C228-Q230 PolarHBondContact O-N 2.95Å
229Q90.7Very high92.6Very high63 Ų6370.2 Ų70.229%0.29432%0.324SS..  trans-7771.9-178.6-170.8-178.4-30.800111.3C102 A104 H161 A163 Y227C102-Q229 WeakPolarHBondContact O-CB 3.45Å; C102-Q229 PolarHBondContact O-N 3.28Å; A104-Q229 HydrophobicContact CB-CG 4.47Å; A104-Q229 VanDerWaalsContact CB-NE2 3.32Å; H161-Q229 PolarHBondContact O-NE2 2.84Å; A163-Q229 HydrophobicContact CB-CB 4.26Å; A163-Q229 PolarHBondContact N-O 3.18Å; Y227-Q229 PolarHBondContact OH-OE1 2.79Å
230Q88.5Confident92.7Very high11 Ų1172.5 Ų72.55%0.05134%0.34CS..  trans-150.2145.3169.8-84.6-136.8-86.300110.4T162 K222 C228 L235T162-Q230 HydrophobicContact CG2-CG 4.38Å; T162-Q230 VanDerWaalsContact CG2-NE2 3.33Å; K222-Q230 WeakPolarHBondContact CE-O 3.21Å; K222-Q230 PolarHBondContact NZ-O 3.32Å; C228-Q230 PolarHBondContact O-N 2.95Å; Q230-L235 HydrophobicContact CB-CG 4.27Å
231S91.4Very high92.7Very high37 Ų3771.4 Ų71.426%0.25933%0.334SS..  trans-78.8154.8167.466.70000111.1E233 N234 L235S231-E233 VanDerWaalsContact C-N 3.25Å; S231-E233 PolarHBondContact O-N 2.8Å; S231-N234 PolarHBondContact O-N 3.38Å; S231-N234 WeakPolarHBondContact OG-CB 3.32Å; S231-N234 PolarHBondContact OG-N 2.86Å; S231-N234 PolarHBondContact OG-ND2 3.41Å; S231-L235 WeakPolarHBondContact O-CG 3.47Å; S231-L235 PolarHBondContact O-N 3.27Å
232Y91.5Very high92.8Very high95 Ų9571.3 Ų71.337%0.37333%0.332SS..Hα-helixtrans-63.4-35.6174.5-76.7-71.4000111.5Y219 K222 L235 Y236Y219-Y232 HydrophobicContact CD2-CD1 4.36Å; Y219-Y232 HydrophobicContact CD2-CE1 4.36Å; Y219-Y232 HydrophobicContact CE2-CD1 4.27Å; Y219-Y232 HydrophobicContact CE2-CE1 4.19Å; K222-Y232 HydrophobicContact CD-CD1 4.47Å; K222-Y232 HydrophobicContact CD-CE1 4.08Å; K222-Y232 HydrophobicContact CD-CE2 4.24Å; K222-Y232 HydrophobicContact CG-CE1 4.39Å; Y232-L235 HydrophobicContact CD1-CD1 4.34Å; Y232-L235 WeakPolarHBondContact O-CB 3.39Å; Y232-L235 PolarHBondContact O-N 3.22Å; Y232-Y236 WeakPolarHBondContact O-CD2 3.4Å; Y232-Y236 PolarHBondContact O-N 3.03Å
233E91.7Very high92.9Very high119 Ų11970.8 Ų70.856%0.55634%0.335SS*.Hα-helixtrans-58.5-48.8174.6-63.5175.3-176.400112.1S231 L235 Y236 F237S231-E233 VanDerWaalsContact C-N 3.25Å; S231-E233 PolarHBondContact O-N 2.8Å; E233-L235 VanDerWaalsContact C-N 3.27Å; E233-L235 PolarHBondContact O-N 2.8Å; E233-Y236 PolarHBondContact O-N 2.96Å; E233-F237 HydrophobicContact CB-CE2 4.27Å; E233-F237 VanDerWaalsContact O-CD2 3.26Å; E233-F237 WeakPolarHBondContact O-CD2 3.33Å; E233-F237 WeakPolarHBondContact O-CG 3.43Å; E233-F237 PolarHBondContact O-N 2.9Å
234N92.2Very high93.1Very high0 Ų064.5 Ų64.50%032%0.316CS..Hα-helixtrans-63.9-33177.8-86-66000112.5H156 D160 T162 S231 S238H156-N234 PolarHBondContact CE1-OD1 2.94Å; H156-N234 PolarHBondContact ND1-OD1 3.01Å; D160-N234 PolarHBondContact OD2-ND2 3.3Å; T162-N234 HydrophobicContact CG2-CB 3.87Å; S231-N234 PolarHBondContact O-N 3.38Å; S231-N234 WeakPolarHBondContact OG-CB 3.32Å; S231-N234 PolarHBondContact OG-N 2.86Å; S231-N234 PolarHBondContact OG-ND2 3.41Å; N234-S238 VanDerWaalsContact O-CB 3.22Å; N234-S238 WeakPolarHBondContact O-CB 3.38Å; N234-S238 PolarHBondContact O-N 3.31Å; N234-S238 PolarHBondContact O-OG 2.87Å
235L93.2Very high93.2Very high4 Ų459.2 Ų59.22%0.02129%0.287CS..Hα-helixtrans-66.6-43.2175.1-73.9167.6000111.7S218 Y219 K222 Q230 S231 Y232 E233 S238 F239S218-L235 VanDerWaalsContact CB-CD2 3.44Å; Y219-L235 HydrophobicContact CD2-CD1 4.4Å; K222-L235 HydrophobicContact CD-CD1 4.18Å; Q230-L235 HydrophobicContact CB-CG 4.27Å; S231-L235 WeakPolarHBondContact O-CG 3.47Å; S231-L235 PolarHBondContact O-N 3.27Å; Y232-L235 HydrophobicContact CD1-CD1 4.34Å; Y232-L235 WeakPolarHBondContact O-CB 3.39Å; Y232-L235 PolarHBondContact O-N 3.22Å; E233-L235 VanDerWaalsContact C-N 3.27Å; E233-L235 PolarHBondContact O-N 2.8Å; L235-S238 PolarHBondContact O-OG 2.82Å; L235-F239 WeakPolarHBondContact O-CB 3.29Å; L235-F239 PolarHBondContact O-N 3.04Å
236Y94Very high93.6Very high135 Ų13555.9 Ų55.953%0.52927%0.266SS..Hα-helixtrans-65.8-44.4176.2-63.4-41.7000111.5Y219 Y232 E233 L240Y219-Y236 HydrophobicContact CE2-CE1 4.22Å; Y232-Y236 WeakPolarHBondContact O-CD2 3.4Å; Y232-Y236 PolarHBondContact O-N 3.03Å; E233-Y236 PolarHBondContact O-N 2.96Å; Y236-L240 VanDerWaalsContact O-CB 3.27Å; Y236-L240 WeakPolarHBondContact O-CB 3.5Å; Y236-L240 PolarHBondContact O-N 3.32Å
237F94.1Very high93.9Very high97 Ų9758.1 Ų58.143%0.42528%0.277SS..Hα-helixtrans-64.3-43.6176.7-66.3-36.8000112.4Y153 E233 L240 I241Y153-F237 HydrophobicContact CD2-CB 4.04Å; Y153-F237 HydrophobicContact CE2-CB 3.99Å; E233-F237 HydrophobicContact CB-CE2 4.27Å; E233-F237 VanDerWaalsContact O-CD2 3.26Å; E233-F237 WeakPolarHBondContact O-CD2 3.33Å; E233-F237 WeakPolarHBondContact O-CG 3.43Å; E233-F237 PolarHBondContact O-N 2.9Å; F237-L240 PolarHBondContact O-N 3Å; F237-I241 WeakPolarHBondContact O-CB 3.16Å; F237-I241 VanDerWaalsContact O-CG1 3.27Å; F237-I241 WeakPolarHBondContact O-CG1 3.33Å; F237-I241 PolarHBondContact O-N 3.45Å
238S95.1Very high94.2Very high0 Ų052.4 Ų52.40%026%0.257CS..Hα-helixtrans-61.6-48.8178.774.40000110.8Y153 S215 N234 L235 L240 I241 Y242Y153-S238 WeakPolarHBondContact OH-CB 3.37Å; S215-S238 WeakPolarHBondContact CB-OG 3.37Å; S215-S238 PolarHBondContact OG-OG 3.46Å; N234-S238 VanDerWaalsContact O-CB 3.22Å; N234-S238 WeakPolarHBondContact O-CB 3.38Å; N234-S238 PolarHBondContact O-N 3.31Å; N234-S238 PolarHBondContact O-OG 2.87Å; L235-S238 PolarHBondContact O-OG 2.82Å; S238-L240 PolarHBondContact O-N 3.25Å; S238-I241 PolarHBondContact O-N 2.89Å; S238-Y242 WeakPolarHBondContact O-CB 3.49Å; S238-Y242 VanDerWaalsContact O-CD2 3.3Å; S238-Y242 WeakPolarHBondContact O-CD2 3.26Å; S238-Y242 PolarHBondContact O-N 2.94Å
239F95.2Very high94.2Very high94 Ų9452.6 Ų52.641%0.41226%0.256SS..Hα-helixtrans-61.4-46.1179.8-172.8-93.4000111.6C212 L235 I241 Y242 A243C212-F239 HydrophobicContact CB-CE2 4.41Å; L235-F239 WeakPolarHBondContact O-CB 3.29Å; L235-F239 PolarHBondContact O-N 3.04Å; F239-I241 PolarHBondContact O-N 3.18Å; F239-Y242 PolarHBondContact O-N 3.38Å; F239-A243 WeakPolarHBondContact O-CB 3.49Å; F239-A243 PolarHBondContact O-N 2.91Å
240L96Very high94.5Very high111 Ų11151.2 Ų51.258%0.58126%0.255SS*.Hα-helixtrans-62-44.9-179.8-176.866.3000112.2Y236 F237 S238 S244Y236-L240 VanDerWaalsContact O-CB 3.27Å; Y236-L240 WeakPolarHBondContact O-CB 3.5Å; Y236-L240 PolarHBondContact O-N 3.32Å; F237-L240 PolarHBondContact O-N 3Å; S238-L240 PolarHBondContact O-N 3.25Å; L240-S244 WeakPolarHBondContact O-CB 3.45Å; L240-S244 PolarHBondContact O-N 3.3Å; L240-S244 PolarHBondContact O-OG 3.34Å
241I96.2Very high94.8Very high21 Ų2156.7 Ų56.711%0.10828%0.28CS..Hα-helixtrans-66.2-47.5179.9-71.1171.4000110.7Y153 F237 S238 F239 A243 S244 Y245Y153-I241 HydrophobicContact CD1-CD1 4.3Å; Y153-I241 HydrophobicContact CD2-CD1 3.76Å; Y153-I241 HydrophobicContact CG-CD1 3.57Å; F237-I241 WeakPolarHBondContact O-CB 3.16Å; F237-I241 VanDerWaalsContact O-CG1 3.27Å; F237-I241 WeakPolarHBondContact O-CG1 3.33Å; F237-I241 PolarHBondContact O-N 3.45Å; S238-I241 PolarHBondContact O-N 2.89Å; F239-I241 PolarHBondContact O-N 3.18Å; I241-A243 VanDerWaalsContact C-N 3.34Å; I241-A243 PolarHBondContact O-N 3.22Å; I241-S244 PolarHBondContact O-N 3.34Å; I241-S244 PolarHBondContact O-OG 3.21Å; I241-Y245 HydrophobicContact CG2-CD2 3.93Å; I241-Y245 HydrophobicContact CG2-CE1 4.16Å; I241-Y245 HydrophobicContact CG2-CE2 3.42Å; I241-Y245 VanDerWaalsContact CG2-CE2 3.42Å; I241-Y245 HydrophobicContact CG2-CG 4.48Å; I241-Y245 WeakPolarHBondContact O-CB 3.39Å; I241-Y245 VanDerWaalsContact O-CG 3.24Å; I241-Y245 PolarHBondContact O-N 3.22Å
242Y96.5Very high94.9Very high18 Ų1857.7 Ų57.77%0.07128%0.28CS..Hα-helixtrans-65.5-38.4179.6-86.5-71.3000112.3F168 Q207 M208 S238 F239 F246F168-Y242 WeakPolarHBondContact CB-OH 3.36Å; F168-Y242 AromaticContact CD1-CE2 3.45Å; F168-Y242 HydrophobicContact CD1-CE2 3.45Å; F168-Y242 VanDerWaalsContact CD1-CE2 3.45Å; F168-Y242 AromaticContact CD1-CZ 3.58Å; F168-Y242 WeakPolarHBondContact CD1-OH 3.18Å; F168-Y242 HydrophobicContact CD2-CE2 4.19Å; F168-Y242 HydrophobicContact CE1-CD2 4.18Å; F168-Y242 AromaticContact CE1-CE2 3.5Å; F168-Y242 HydrophobicContact CE1-CE2 3.5Å; F168-Y242 VanDerWaalsContact CE1-CE2 3.5Å; F168-Y242 HydrophobicContact CE2-CE2 4.22Å; F168-Y242 AromaticContact CG-CE2 3.83Å; F168-Y242 HydrophobicContact CG-CE2 3.83Å; F168-Y242 WeakPolarHBondContact CG-OH 3.32Å; F168-Y242 HydrophobicContact CZ-CD2 4.4Å; F168-Y242 AromaticContact CZ-CE2 3.9Å; F168-Y242 HydrophobicContact CZ-CE2 3.9Å; Q207-Y242 HydrophobicContact CG-CE1 4.4Å; M208-Y242 HydrophobicContact CB-CD1 4.39Å; M208-Y242 HydrophobicContact SD-CD1 3.56Å; M208-Y242 VanDerWaalsContact SD-CD1 3.56Å; M208-Y242 HydrophobicContact SD-CE1 3.82Å; S238-Y242 WeakPolarHBondContact O-CB 3.49Å; S238-Y242 VanDerWaalsContact O-CD2 3.3Å; S238-Y242 WeakPolarHBondContact O-CD2 3.26Å; S238-Y242 PolarHBondContact O-N 2.94Å; F239-Y242 PolarHBondContact O-N 3.38Å; Y242-F246 WeakPolarHBondContact O-CB 3.31Å; Y242-F246 PolarHBondContact O-N 2.96Å
243A96.1Very high95Very high31 Ų3155 Ų5526%0.25627%0.271SS..Hα-helixtrans-65.7-43.7174.600000112.1F239 I241 Y245 F246 V247F239-A243 WeakPolarHBondContact O-CB 3.49Å; F239-A243 PolarHBondContact O-N 2.91Å; I241-A243 VanDerWaalsContact C-N 3.34Å; I241-A243 PolarHBondContact O-N 3.22Å; A243-Y245 VanDerWaalsContact C-N 3.34Å; A243-Y245 PolarHBondContact O-N 2.96Å; A243-F246 PolarHBondContact O-N 3.38Å; A243-V247 PolarHBondContact O-N 3.45Å
244S97.2Very high95.2Very high27 Ų2755.5 Ų55.519%0.18927%0.268CS..Hα-helixtrans-64.2-41178.576.50000111.5Y145 L240 I241 V247 L248Y145-S244 PolarHBondContact OH-OG 2.92Å; Y145-S244 VanDerWaalsContact OH-OG 3.07Å; L240-S244 WeakPolarHBondContact O-CB 3.45Å; L240-S244 PolarHBondContact O-N 3.3Å; L240-S244 PolarHBondContact O-OG 3.34Å; I241-S244 PolarHBondContact O-N 3.34Å; I241-S244 PolarHBondContact O-OG 3.21Å; S244-V247 PolarHBondContact O-N 3.02Å; S244-L248 WeakPolarHBondContact O-CG 3.18Å; S244-L248 PolarHBondContact O-N 3.41Å
245Y96.7Very high95.2Very high6 Ų657.9 Ų57.92%0.02428%0.283CS..Hα-helixtrans-66-40.4175.7-69-6.2000112.5Y145 H146 T149 V150 M208 I241 A243 V247 L248 F249Y145-Y245 HydrophobicContact CD1-CD1 4.39Å; Y145-Y245 AromaticContact CD1-CE1 3.91Å; Y145-Y245 HydrophobicContact CD1-CE1 3.91Å; Y145-Y245 AromaticContact CE1-CD1 3.96Å; Y145-Y245 HydrophobicContact CE1-CD1 3.96Å; Y145-Y245 AromaticContact CE1-CE1 3.59Å; Y145-Y245 HydrophobicContact CE1-CE1 3.59Å; H146-Y245 WeakPolarHBondContact CA-OH 3.15Å; H146-Y245 HydrophobicContact CB-CE1 4.3Å; H146-Y245 AromaticContact CD2-CE2 3.53Å; H146-Y245 AromaticContact CD2-CZ 3.56Å; H146-Y245 PolarHBondContact O-OH 2.8Å; T149-Y245 PolarHBondContact OG1-OH 3.32Å; V150-Y245 HydrophobicContact CG1-CE2 3.73Å; V150-Y245 WeakPolarHBondContact CG1-OH 3.36Å; M208-Y245 HydrophobicContact CE-CD2 4.16Å; M208-Y245 VanDerWaalsContact SD-CB 3.58Å; M208-Y245 HydrophobicContact SD-CD2 3.84Å; M208-Y245 HydrophobicContact SD-CG 4.25Å; I241-Y245 HydrophobicContact CG2-CD2 3.93Å; I241-Y245 HydrophobicContact CG2-CE1 4.16Å; I241-Y245 HydrophobicContact CG2-CE2 3.42Å; I241-Y245 VanDerWaalsContact CG2-CE2 3.42Å; I241-Y245 HydrophobicContact CG2-CG 4.48Å; I241-Y245 WeakPolarHBondContact O-CB 3.39Å; I241-Y245 VanDerWaalsContact O-CG 3.24Å; I241-Y245 PolarHBondContact O-N 3.22Å; A243-Y245 VanDerWaalsContact C-N 3.34Å; A243-Y245 PolarHBondContact O-N 2.96Å; Y245-V247 VanDerWaalsContact C-N 3.3Å; Y245-V247 PolarHBondContact O-N 2.98Å; Y245-L248 PolarHBondContact O-N 3.25Å; Y245-F249 WeakPolarHBondContact O-CB 3.38Å; Y245-F249 WeakPolarHBondContact O-CD2 3.46Å; Y245-F249 PolarHBondContact O-N 3.26Å
246F96.8Very high95Very high86 Ų8658.2 Ų58.238%0.37729%0.286SS..Hα-helixtrans-54.9-48.8175176.7-99.6000111.1L205 M208 V209 Y242 A243 L248 A250L205-F246 HydrophobicContact CD2-CD2 3.95Å; L205-F246 HydrophobicContact CD2-CE2 4.1Å; M208-F246 HydrophobicContact CB-CB 3.87Å; M208-F246 HydrophobicContact CB-CD2 4.34Å; V209-F246 HydrophobicContact CG2-CD2 3.77Å; V209-F246 HydrophobicContact CG2-CE2 3.57Å; Y242-F246 WeakPolarHBondContact O-CB 3.31Å; Y242-F246 PolarHBondContact O-N 2.96Å; A243-F246 PolarHBondContact O-N 3.38Å; F246-L248 PolarHBondContact O-N 3.38Å; F246-A250 WeakPolarHBondContact O-CB 3.38Å; F246-A250 PolarHBondContact O-N 2.93Å
247V97Very high94.9Very high96 Ų9652.1 Ų52.158%0.58226%0.262SS*.Hα-helixtrans-61-47.3178.31750000111.3A243 S244 Y245 A250 H251A243-V247 PolarHBondContact O-N 3.45Å; S244-V247 PolarHBondContact O-N 3.02Å; Y245-V247 VanDerWaalsContact C-N 3.3Å; Y245-V247 PolarHBondContact O-N 2.98Å; V247-A250 PolarHBondContact O-N 3.32Å; V247-H251 WeakPolarHBondContact O-CB 3.05Å; V247-H251 PolarHBondContact O-N 3.4Å
248L95.6Very high94.8Very high37 Ų3752.6 Ų52.619%0.19427%0.268CS..Hα-helixtrans-66.8-42.7-177.6-68.6167.5000112.5F141 L142 Y145 S244 Y245 F246 F252F141-L248 HydrophobicContact CD1-CD2 3.88Å; F141-L248 HydrophobicContact CE1-CD1 4.09Å; F141-L248 HydrophobicContact CE1-CD2 3.88Å; L142-L248 HydrophobicContact CD1-CB 3.62Å; L142-L248 HydrophobicContact CD1-CD1 4.06Å; L142-L248 HydrophobicContact CD1-CG 4.45Å; Y145-L248 HydrophobicContact CD1-CD1 3.64Å; Y145-L248 HydrophobicContact CE1-CD1 3.79Å; S244-L248 WeakPolarHBondContact O-CG 3.18Å; S244-L248 PolarHBondContact O-N 3.41Å; Y245-L248 PolarHBondContact O-N 3.25Å; F246-L248 PolarHBondContact O-N 3.38Å; L248-F252 WeakPolarHBondContact O-CB 3.29Å; L248-F252 PolarHBondContact O-N 3.3Å
249F93.5Very high94.6Very high17 Ų1759.3 Ų59.38%0.07529%0.294CS..Hα-helixtrans-69.6-34.5176-87.6-81.2000111.9L142 T201 Q204 L205 M208 Y245 F252 F253L142-F249 HydrophobicContact CD1-CD2 3.98Å; L142-F249 HydrophobicContact CD1-CE2 3.78Å; L142-F249 HydrophobicContact CD1-CZ 4.32Å; L142-F249 HydrophobicContact CD2-CD1 4.31Å; L142-F249 HydrophobicContact CD2-CD2 4.47Å; L142-F249 HydrophobicContact CD2-CE1 4.13Å; L142-F249 HydrophobicContact CD2-CE2 4.32Å; L142-F249 HydrophobicContact CD2-CG 4.48Å; L142-F249 HydrophobicContact CD2-CZ 4.14Å; L142-F249 HydrophobicContact CG-CE2 4.5Å; T201-F249 HydrophobicContact CG2-CD1 4.23Å; Q204-F249 HydrophobicContact CB-CD1 4.05Å; Q204-F249 HydrophobicContact CB-CE1 4Å; Q204-F249 HydrophobicContact CB-CZ 4.47Å; Q204-F249 VanDerWaalsContact CD-CE1 3.42Å; Q204-F249 HydrophobicContact CG-CE1 4.2Å; L205-F249 HydrophobicContact CD2-CB 3.73Å; L205-F249 HydrophobicContact CG-CB 4.12Å; M208-F249 HydrophobicContact CE-CD2 4.29Å; M208-F249 HydrophobicContact CE-CE2 4.14Å; Y245-F249 WeakPolarHBondContact O-CB 3.38Å; Y245-F249 WeakPolarHBondContact O-CD2 3.46Å; Y245-F249 PolarHBondContact O-N 3.26Å; F249-F252 PolarHBondContact O-N 3.47Å; F249-F253 VanDerWaalsContact O-CB 3.29Å; F249-F253 WeakPolarHBondContact O-CB 3.39Å; F249-F253 PolarHBondContact O-N 3.01Å
250A95.8Very high94.2Very high34 Ų3465.8 Ų65.828%0.28132%0.316SS..Hα-helixtrans-66.8-44.3176.300000110.4L205 F246 V247 F252 F253 Y254L205-A250 HydrophobicContact CD2-CB 4.08Å; F246-A250 WeakPolarHBondContact O-CB 3.38Å; F246-A250 PolarHBondContact O-N 2.93Å; V247-A250 PolarHBondContact O-N 3.32Å; A250-F252 PolarHBondContact O-N 3.13Å; A250-F253 PolarHBondContact O-N 3.38Å; A250-Y254 WeakPolarHBondContact O-CB 3.09Å; A250-Y254 PolarHBondContact O-N 3.29Å
251H95.7Very high93.6Very high125 Ų12562.2 Ų62.258%0.57931%0.306SS*.Hα-helixtrans-61.7-42.8173.6176.8-97.4000112.1V247 T255V247-H251 WeakPolarHBondContact O-CB 3.05Å; V247-H251 PolarHBondContact O-N 3.4Å; H251-T255 WeakPolarHBondContact O-CB 3.46Å; H251-T255 PolarHBondContact O-N 2.06Å; H251-T255 PolarHBondContact O-OG1 3.21Å
252F93.6Very high93.1Very high58 Ų5861.6 Ų61.625%0.25430%0.302SS..Hα-helixtrans-61.4-47.3174.4175.1-98.4000111.5L142 T201 L248 F249 A250 Y254 T255 A256L142-F252 HydrophobicContact CD2-CB 4.31Å; L142-F252 HydrophobicContact CD2-CG 4.47Å; T201-F252 HydrophobicContact CG2-CD1 3.86Å; T201-F252 HydrophobicContact CG2-CE1 4.11Å; L248-F252 WeakPolarHBondContact O-CB 3.29Å; L248-F252 PolarHBondContact O-N 3.3Å; F249-F252 PolarHBondContact O-N 3.47Å; A250-F252 PolarHBondContact O-N 3.13Å; F252-Y254 PolarHBondContact O-N 2.67Å; F252-T255 PolarHBondContact O-N 3.27Å; F252-A256 HydrophobicContact CE1-CB 4.37Å; F252-A256 HydrophobicContact CE2-CB 4.48Å; F252-A256 HydrophobicContact CZ-CB 4.27Å; F252-A256 WeakPolarHBondContact O-CB 3.45Å; F252-A256 PolarHBondContact O-N 2.88Å
253F93.6Very high92.4Very high39 Ų3964.7 Ų64.717%0.17131%0.314CS..Hα-helixtrans-60.2-47.8179.4-172.4-84.8000111.2M198 T201 L205 F249 A250 T255 A256 Y257 L258M198-F253 HydrophobicContact CG-CE2 3.65Å; M198-F253 HydrophobicContact CG-CZ 3.72Å; M198-F253 HydrophobicContact SD-CZ 4.23Å; T201-F253 HydrophobicContact CG2-CB 4.18Å; T201-F253 HydrophobicContact CG2-CD2 3.71Å; T201-F253 HydrophobicContact CG2-CG 4.46Å; L205-F253 HydrophobicContact CD1-CB 3.97Å; L205-F253 HydrophobicContact CD1-CD2 4.07Å; L205-F253 HydrophobicContact CD1-CG 4.04Å; F249-F253 VanDerWaalsContact O-CB 3.29Å; F249-F253 WeakPolarHBondContact O-CB 3.39Å; F249-F253 PolarHBondContact O-N 3.01Å; A250-F253 PolarHBondContact O-N 3.38Å; F253-T255 PolarHBondContact O-N 3.21Å; F253-A256 PolarHBondContact O-N 2.96Å; F253-Y257 HydrophobicContact CB-CD2 4.39Å; F253-Y257 HydrophobicContact CD1-CD2 4.33Å; F253-Y257 AromaticContact CD2-CD2 3.55Å; F253-Y257 HydrophobicContact CD2-CD2 3.55Å; F253-Y257 AromaticContact CD2-CE2 3.85Å; F253-Y257 HydrophobicContact CD2-CE2 3.85Å; F253-Y257 AromaticContact CE2-CD2 3.79Å; F253-Y257 HydrophobicContact CE2-CD2 3.79Å; F253-Y257 HydrophobicContact CE2-CE2 4.17Å; F253-Y257 AromaticContact CG-CD2 3.84Å; F253-Y257 HydrophobicContact CG-CD2 3.84Å; F253-Y257 HydrophobicContact CG-CE2 4.46Å; F253-Y257 HydrophobicContact CZ-CD2 4.27Å; F253-Y257 WeakPolarHBondContact O-CB 2.81Å; F253-Y257 WeakPolarHBondContact O-CD2 3.38Å; F253-Y257 PolarHBondContact O-N 3.39Å; F253-L258 HydrophobicContact CD1-CD1 4.05Å; F253-L258 HydrophobicContact CD1-CG 4.21Å; F253-L258 HydrophobicContact CE1-CD1 3.96Å; F253-L258 HydrophobicContact CE1-CD2 4.29Å; F253-L258 HydrophobicContact CE1-CG 4.01Å
254Y94.4Very high91.8Very high130 Ų13065 Ų6551%0.5131%0.309SS..Iπ-helixtrans-57.4-51.1176.3176.5-102.2000111.2A250 F252 A256 L258 R259A250-Y254 WeakPolarHBondContact O-CB 3.09Å; A250-Y254 PolarHBondContact O-N 3.29Å; F252-Y254 PolarHBondContact O-N 2.67Å; Y254-A256 PolarHBondContact O-N 2.8Å; Y254-L258 HydrophobicContact CD2-CB 3.9Å; Y254-L258 HydrophobicContact CD2-CD1 4.29Å; Y254-L258 HydrophobicContact CE2-CB 4.34Å; Y254-L258 CarbonylContact O-C 3.6Å; Y254-L258 PolarHBondContact O-N 2.91Å; Y254-R259 HydrophobicContact CE1-CB 4.24Å; Y254-R259 HydrophobicContact CE1-CG 4.47Å; Y254-R259 PolarHBondContact O-N 3.43Å
255T92.2Very high91Very high50 Ų5067.7 Ų67.731%0.30732%0.318SS..Iπ-helixtrans-66.5-39.2-176.8-58.30000112.6H251 F252 F253H251-T255 WeakPolarHBondContact O-CB 3.46Å; H251-T255 PolarHBondContact O-N 2.06Å; H251-T255 PolarHBondContact O-OG1 3.21Å; F252-T255 PolarHBondContact O-N 3.27Å; F253-T255 PolarHBondContact O-N 3.21Å
256A90.1Very high90.3Very high10 Ų1072.1 Ų72.18%0.08334%0.338CS..Iπ-helixtrans-79.3-31.8-175.800000113.4F252 F253 Y254 N262 Y264F252-A256 HydrophobicContact CE1-CB 4.37Å; F252-A256 HydrophobicContact CE2-CB 4.48Å; F252-A256 HydrophobicContact CZ-CB 4.27Å; F252-A256 WeakPolarHBondContact O-CB 3.45Å; F252-A256 PolarHBondContact O-N 2.88Å; F253-A256 PolarHBondContact O-N 2.96Å; Y254-A256 PolarHBondContact O-N 2.8Å; A256-N262 WeakPolarHBondContact O-CB 3.42Å; A256-Y264 WeakPolarHBondContact O-CD2 3.45Å
257Y91.8Very high89.4Confident8 Ų870.5 Ų70.53%0.03133%0.333CS..Iπ-helixtrans-123-34.6-167.4-58.6-66.8000115.5P197 M198 T201 F253 N262 Y264P197-Y257 VanDerWaalsContact C-OH 3.22Å; P197-Y257 PolarHBondContact O-OH 3.36Å; P197-Y257 VanDerWaalsContact O-OH 3.1Å; M198-Y257 HydrophobicContact CB-CD1 4.24Å; M198-Y257 HydrophobicContact CB-CE1 4Å; M198-Y257 HydrophobicContact CE-CD1 3.71Å; M198-Y257 HydrophobicContact CE-CG 3.93Å; M198-Y257 HydrophobicContact CG-CD1 4.42Å; M198-Y257 HydrophobicContact CG-CG 4.4Å; T201-Y257 HydrophobicContact CG2-CE2 4.25Å; T201-Y257 PolarHBondContact OG1-OH 2.94Å; F253-Y257 HydrophobicContact CB-CD2 4.39Å; F253-Y257 HydrophobicContact CD1-CD2 4.33Å; F253-Y257 AromaticContact CD2-CD2 3.55Å; F253-Y257 HydrophobicContact CD2-CD2 3.55Å; F253-Y257 AromaticContact CD2-CE2 3.85Å; F253-Y257 HydrophobicContact CD2-CE2 3.85Å; F253-Y257 AromaticContact CE2-CD2 3.79Å; F253-Y257 HydrophobicContact CE2-CD2 3.79Å; F253-Y257 HydrophobicContact CE2-CE2 4.17Å; F253-Y257 AromaticContact CG-CD2 3.84Å; F253-Y257 HydrophobicContact CG-CD2 3.84Å; F253-Y257 HydrophobicContact CG-CE2 4.46Å; F253-Y257 HydrophobicContact CZ-CD2 4.27Å; F253-Y257 WeakPolarHBondContact O-CB 2.81Å; F253-Y257 WeakPolarHBondContact O-CD2 3.38Å; F253-Y257 PolarHBondContact O-N 3.39Å; Y257-N262 PolarHBondContact O-ND2 2.7Å; Y257-Y264 AromaticContact CD1-CD2 3.96Å; Y257-Y264 HydrophobicContact CD1-CD2 3.96Å; Y257-Y264 AromaticContact CD1-CE2 3.44Å; Y257-Y264 HydrophobicContact CD1-CE2 3.44Å; Y257-Y264 VanDerWaalsContact CD1-CE2 3.44Å; Y257-Y264 HydrophobicContact CE1-CD2 4.22Å; Y257-Y264 AromaticContact CE1-CE2 3.27Å; Y257-Y264 HydrophobicContact CE1-CE2 3.27Å; Y257-Y264 AromaticContact CE1-CZ 3.74Å
258L91.4Very high88.7Confident106 Ų10669.9 Ų69.956%0.55534%0.338SS*.Iπ-helixtrans-104.9-33.5-170.3-58.8-177.7000113.2F253 Y254 R260F253-L258 HydrophobicContact CD1-CD1 4.05Å; F253-L258 HydrophobicContact CD1-CG 4.21Å; F253-L258 HydrophobicContact CE1-CD1 3.96Å; F253-L258 HydrophobicContact CE1-CD2 4.29Å; F253-L258 HydrophobicContact CE1-CG 4.01Å; Y254-L258 HydrophobicContact CD2-CB 3.9Å; Y254-L258 HydrophobicContact CD2-CD1 4.29Å; Y254-L258 HydrophobicContact CE2-CB 4.34Å; Y254-L258 CarbonylContact O-C 3.6Å; Y254-L258 PolarHBondContact O-N 2.91Å; L258-R260 PolarHBondContact O-N 3.21Å
259R91.5Very high88Confident141 Ų14174.5 Ų74.553%0.53236%0.363SS..SBendtrans-58.7135.4179.6-172.7177175.4176.4-0110.2Y254 N262Y254-R259 HydrophobicContact CE1-CB 4.24Å; Y254-R259 HydrophobicContact CE1-CG 4.47Å; Y254-R259 PolarHBondContact O-N 3.43Å; R259-N262 VanDerWaalsContact O-CB 3.26Å; R259-N262 WeakPolarHBondContact O-CB 3.34Å; R259-N262 PolarHBondContact O-N 3.35Å; R259-N262 VanDerWaalsContact O-N 3.15Å; R259-N262 PolarHBondContact O-ND2 3.35Å
260R86.3Confident87.1Confident230 Ų23076.8 Ų76.887%0.86839%0.391SS*.THydrogen-bonded Turntrans-59.3137.4172.5-73.8-176.1176173.4-1.2110.3L258 N262L258-R260 PolarHBondContact O-N 3.21Å; R260-N262 VanDerWaalsContact C-N 3.32Å
261G82.9Confident85.8Confident36 Ų3679 Ų7937%0.37141%0.405SS..THydrogen-bonded Turntrans73.123.4-174.500000113.5K266G261-K266 WeakPolarHBondContact O-CE 3.44Å
262N86.6Confident84.2Confident8 Ų875.3 Ų75.34%0.04339%0.391CS..  trans-61.8164.8173.963.467.5000111.9A256 Y257 R259 R260 Y264 Q265 K266A256-N262 WeakPolarHBondContact O-CB 3.42Å; Y257-N262 PolarHBondContact O-ND2 2.7Å; R259-N262 VanDerWaalsContact O-CB 3.26Å; R259-N262 WeakPolarHBondContact O-CB 3.34Å; R259-N262 PolarHBondContact O-N 3.35Å; R259-N262 VanDerWaalsContact O-N 3.15Å; R259-N262 PolarHBondContact O-ND2 3.35Å; R260-N262 VanDerWaalsContact C-N 3.32Å; N262-Y264 PolarHBondContact O-N 3.44Å; N262-Y264 VanDerWaalsContact O-N 3.13Å; N262-Y264 WeakPolarHBondContact OD1-CB 3.49Å; N262-Y264 PolarHBondContact OD1-N 3.49Å; N262-Y264 VanDerWaalsContact OD1-N 3.09Å; N262-Q265 PolarHBondContact O-N 2.85Å; N262-Q265 VanDerWaalsContact O-N 3.07Å; N262-Q265 PolarHBondContact OD1-N 2.99Å; N262-K266 PolarHBondContact O-N 2.69Å
263R82.5Confident82.5Confident83 Ų8376.1 Ų76.131%0.31340%0.404SS..Hα-helixtrans-55.7-34.1-175.873.8-171.3-170.6-173.5-1.9113.5K266 L267 V277R263-K266 PolarHBondContact O-N 2.99Å; R263-L267 WeakPolarHBondContact O-CB 3.46Å; R263-L267 WeakPolarHBondContact O-CD1 3.42Å; R263-L267 WeakPolarHBondContact O-CG 3.29Å; R263-L267 PolarHBondContact O-N 3.5Å; R263-V277 HydrophobicContact CB-CG1 4.16Å; R263-V277 HydrophobicContact CG-CG1 4Å
264Y82.7Confident80.6Confident37 Ų3777.3 Ų77.315%0.14542%0.417CS..Hα-helixtrans-76.1-35.2-180-60.9-79.2000112.4K194 P197 A256 Y257 N262 L267 A268K194-Y264 HydrophobicContact CB-CD1 3.93Å; K194-Y264 HydrophobicContact CB-CE1 4.06Å; K194-Y264 HydrophobicContact CB-CG 4.44Å; K194-Y264 HydrophobicContact CD-CD1 4.15Å; K194-Y264 HydrophobicContact CD-CD2 4.13Å; K194-Y264 HydrophobicContact CD-CG 3.78Å; K194-Y264 HydrophobicContact CG-CD1 3.73Å; K194-Y264 HydrophobicContact CG-CD2 4.03Å; K194-Y264 HydrophobicContact CG-CE1 3.9Å; K194-Y264 HydrophobicContact CG-CE2 4.18Å; K194-Y264 HydrophobicContact CG-CG 3.77Å; P197-Y264 WeakPolarHBondContact CG-OH 3.42Å; A256-Y264 WeakPolarHBondContact O-CD2 3.45Å; Y257-Y264 AromaticContact CD1-CD2 3.96Å; Y257-Y264 HydrophobicContact CD1-CD2 3.96Å; Y257-Y264 AromaticContact CD1-CE2 3.44Å; Y257-Y264 HydrophobicContact CD1-CE2 3.44Å; Y257-Y264 VanDerWaalsContact CD1-CE2 3.44Å; Y257-Y264 HydrophobicContact CE1-CD2 4.22Å; Y257-Y264 AromaticContact CE1-CE2 3.27Å; Y257-Y264 HydrophobicContact CE1-CE2 3.27Å; Y257-Y264 AromaticContact CE1-CZ 3.74Å; N262-Y264 PolarHBondContact O-N 3.44Å; N262-Y264 VanDerWaalsContact O-N 3.13Å; N262-Y264 WeakPolarHBondContact OD1-CB 3.49Å; N262-Y264 PolarHBondContact OD1-N 3.49Å; N262-Y264 VanDerWaalsContact OD1-N 3.09Å; Y264-L267 HydrophobicContact CD1-CD1 4.41Å; Y264-A268 WeakPolarHBondContact O-CB 3.5Å; Y264-A268 PolarHBondContact O-N 3.4Å
265Q80.5Confident78.3Confident84 Ų8476.1 Ų76.139%0.39342%0.423SS..Hα-helixtrans-66.8-41170.1-75.6-179.7-20.500111.3N262 L267 A268 N269N262-Q265 PolarHBondContact O-N 2.85Å; N262-Q265 VanDerWaalsContact O-N 3.07Å; N262-Q265 PolarHBondContact OD1-N 2.99Å; Q265-L267 VanDerWaalsContact C-N 3.32Å; Q265-L267 PolarHBondContact O-N 3.24Å; Q265-A268 PolarHBondContact O-N 2.96Å; Q265-N269 WeakPolarHBondContact O-CB 3.25Å; Q265-N269 VanDerWaalsContact O-CG 3.29Å; Q265-N269 PolarHBondContact O-N 3.42Å; Q265-N269 PolarHBondContact O-OD1 3.35Å
266K81.5Confident75.9Confident100 Ų10081.8 Ų81.844%0.43544%0.444SS..Hα-helixtrans-61.9-40.1176.4-75.2-178.9174.2177.10112.7G261 N262 R263 G270 S271 V272G261-K266 WeakPolarHBondContact O-CE 3.44Å; N262-K266 PolarHBondContact O-N 2.69Å; R263-K266 PolarHBondContact O-N 2.99Å; K266-G270 PolarHBondContact O-N 3.22Å; K266-S271 WeakPolarHBondContact CA-OG 3.29Å; K266-S271 VanDerWaalsContact CB-OG 3.29Å; K266-S271 WeakPolarHBondContact CB-OG 3.39Å; K266-S271 PolarHBondContact O-N 2.98Å; K266-S271 PolarHBondContact O-OG 3.27Å; K266-V272 HydrophobicContact CB-CB 4.45Å; K266-V272 HydrophobicContact CB-CG2 3.93Å; K266-V272 HydrophobicContact CD-CG2 4.25Å
267L78.9Confident73.7Confident52 Ų5282.6 Ų82.627%0.27245%0.448SS..Hα-helixtrans-61.2-49.1171.4-83.8161.1000111.8R263 Y264 Q265 N269 G270 V272 V277R263-L267 WeakPolarHBondContact O-CB 3.46Å; R263-L267 WeakPolarHBondContact O-CD1 3.42Å; R263-L267 WeakPolarHBondContact O-CG 3.29Å; R263-L267 PolarHBondContact O-N 3.5Å; Y264-L267 HydrophobicContact CD1-CD1 4.41Å; Q265-L267 VanDerWaalsContact C-N 3.32Å; Q265-L267 PolarHBondContact O-N 3.24Å; L267-N269 VanDerWaalsContact C-N 3.26Å; L267-N269 PolarHBondContact O-N 3.48Å; L267-G270 PolarHBondContact O-N 3.5Å; L267-G270 VanDerWaalsContact O-N 3.12Å; L267-V272 WeakPolarHBondContact CD2-O 3.48Å; L267-V277 HydrophobicContact CD1-CB 4.24Å; L267-V277 HydrophobicContact CD1-CG1 3.93Å; L267-V277 HydrophobicContact CD1-CG2 3.72Å; L267-V277 HydrophobicContact CD2-CG2 3.77Å; L267-V277 HydrophobicContact CG-CG2 3.77Å
268A81.2Confident71.2Confident83 Ų8387 Ų8769%0.68647%0.472SS*.Hα-helixtrans-61.6-35.2-179.900000112.5Y264 Q265 G270Y264-A268 WeakPolarHBondContact O-CB 3.5Å; Y264-A268 PolarHBondContact O-N 3.4Å; Q265-A268 PolarHBondContact O-N 2.96Å; A268-G270 VanDerWaalsContact C-N 3.29Å; A268-G270 PolarHBondContact O-N 2.92Å
269N81.7Confident70.2Confident133 Ų13386.1 Ų86.171%0.71147%0.468SS*.THydrogen-bonded Turntrans-85.26.3179.2-64.34.7000113.4Q265 L267 S271Q265-N269 WeakPolarHBondContact O-CB 3.25Å; Q265-N269 VanDerWaalsContact O-CG 3.29Å; Q265-N269 PolarHBondContact O-N 3.42Å; Q265-N269 PolarHBondContact O-OD1 3.35Å; L267-N269 VanDerWaalsContact C-N 3.26Å; L267-N269 PolarHBondContact O-N 3.48Å; N269-S271 PolarHBondContact O-N 3.01Å; N269-S271 VanDerWaalsContact O-N 3.11Å
270G75.2Confident69.1Low66 Ų6683.2 Ų83.268%0.6846%0.464SS*.THydrogen-bonded Turntrans71.60.6179.600000115.7K266 L267 A268 V272K266-G270 PolarHBondContact O-N 3.22Å; L267-G270 PolarHBondContact O-N 3.5Å; L267-G270 VanDerWaalsContact O-N 3.12Å; A268-G270 VanDerWaalsContact C-N 3.29Å; A268-G270 PolarHBondContact O-N 2.92Å; G270-V272 PolarHBondContact O-N 3.03Å
271S66.9Low68.1Low80 Ų8075.1 Ų75.156%0.55944%0.442SS*.SBendtrans-72.3-13-177610000114.5K266 N269K266-S271 WeakPolarHBondContact CA-OG 3.29Å; K266-S271 VanDerWaalsContact CB-OG 3.29Å; K266-S271 WeakPolarHBondContact CB-OG 3.39Å; K266-S271 PolarHBondContact O-N 2.98Å; K266-S271 PolarHBondContact O-OG 3.27Å; N269-S271 PolarHBondContact O-N 3.01Å; N269-S271 VanDerWaalsContact O-N 3.11Å
272V63.2Low67.2Low48 Ų4877.4 Ų77.429%0.29145%0.446SS..SBendtrans-143131.2178.2-179.30000109.7K266 L267 G270 K276 V277K266-V272 HydrophobicContact CB-CB 4.45Å; K266-V272 HydrophobicContact CB-CG2 3.93Å; K266-V272 HydrophobicContact CD-CG2 4.25Å; L267-V272 WeakPolarHBondContact CD2-O 3.48Å; G270-V272 PolarHBondContact O-N 3.03Å; V272-K276 HydrophobicContact CG1-CB 4.14Å; V272-V277 HydrophobicContact CG1-CG2 3.88Å
273S56.8Low66Low74 Ų7481.7 Ų81.752%0.51747%0.471SS..  trans-71.1142.2174.1171.30000112T275 K276S273-T275 PolarHBondContact O-N 2.85Å; S273-T275 PolarHBondContact OG-OG1 3.11Å; S273-T275 VanDerWaalsContact OG-OG1 3.1Å; S273-K276 PolarHBondContact O-N 3.06Å
274S54.6Low64.9Low64 Ų6481.6 Ų81.645%0.44848%0.482SS..G310 helixtrans-47.9-34.3179.4-1770000113.9K276S274-K276 VanDerWaalsContact C-N 3.3Å; S274-K276 PolarHBondContact O-N 3.39Å
275T46.6Very low63.7Low105 Ų10584.8 Ų84.864%0.64451%0.506SS*.G310 helixtrans-73.7-12.9-17935.80000115.1S273S273-T275 PolarHBondContact O-N 2.85Å; S273-T275 PolarHBondContact OG-OG1 3.11Å; S273-T275 VanDerWaalsContact OG-OG1 3.1Å
276K41.4Very low62.4Low170 Ų17084.8 Ų84.874%0.73951%0.514SS*.G310 helixtrans-99.42.3179.5-78.6-171.1177.4-179.70114.5V272 S273 S274 D278V272-K276 HydrophobicContact CG1-CB 4.14Å; S273-K276 PolarHBondContact O-N 3.06Å; S274-K276 VanDerWaalsContact C-N 3.3Å; S274-K276 PolarHBondContact O-N 3.39Å; K276-D278 VanDerWaalsContact C-N 3.32Å
277V44.3Very low60.8Low27 Ų2783.6 Ų83.616%0.16452%0.521CS..  trans-90.3-0.9-176.2-173.60000113.4R263 L267 V272R263-V277 HydrophobicContact CB-CG1 4.16Å; R263-V277 HydrophobicContact CG-CG1 4Å; L267-V277 HydrophobicContact CD1-CB 4.24Å; L267-V277 HydrophobicContact CD1-CG1 3.93Å; L267-V277 HydrophobicContact CD1-CG2 3.72Å; L267-V277 HydrophobicContact CD2-CG2 3.77Å; L267-V277 HydrophobicContact CG-CG2 3.77Å; V272-V277 HydrophobicContact CG1-CG2 3.88Å
278D38.3Very low59.1Low101 Ų10186.5 Ų86.554%0.5454%0.544SS..  trans-71.70175.5-72-11.5000114.3R137 R186 K276R137-D278 PolarHBondContact NH1-O 2.89Å; R137-D278 VanDerWaalsContact NH2-CB 3.28Å; R137-D278 IonicContact NH2-OD2 3.9Å; R137-D278 PolarHBondContact NH2-OD2 3.14Å; R186-D278 IonicContact CZ-OD1 3.26Å; R186-D278 IonicContact NH2-OD1 3.83Å; R186-D278 PolarHBondContact NH2-OD1 3.04Å; K276-D278 VanDerWaalsContact C-N 3.32Å

Retrieved 278 of 278 residues in 238.3 ms (Link to these results)

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