A0A077ZLE7_TRITR Loading...

ShK domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZLE7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 64 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
1M46.1Very low55.2Low231 Ų231152 Ų152100%1.13880%0.797SS**  094.80-57.7-92.891.700105.3P3M1-P3 WeakPolarHBondContact O-CD 3.02Å
2D56.4Low55.7Low146 Ų146153.7 Ų153.778%0.78179%0.793SS**  trans-86.9117.6169.6-167.7-78.5000107.7N4D2-N4 PolarHBondContact O-N 3.37Å; D2-N4 PolarHBondContact OD1-N 2.03Å
3P60.1Low55.7Low114 Ų114150.2 Ų150.274%0.7479%0.787SS**  trans-91.327.4-166.535.3-35.7000114.5M1M1-P3 WeakPolarHBondContact O-CD 3.02Å
4N51.2Low55.2Low118 Ų118154.8 Ų154.863%0.63180%0.797SS**  trans-135.3114.2175.8-92.9-84.1000114.7D2D2-N4 PolarHBondContact O-N 3.37Å; D2-N4 PolarHBondContact OD1-N 2.03Å
5K53.2Low55.4Low173 Ų173148.2 Ų148.275%0.75278%0.783SS**  trans8595.6166.2-45.7-171.4-153.7-59.60112.2L7K5-L7 PolarHBondContact O-N 2.99Å
6L54Low55.8Low176 Ų176144.5 Ų144.592%0.92178%0.78SS**  37.447.553.8-133.1133000110.4A8L6-A8 VanDerWaalsContact C-N 3.28Å; L6-A8 PolarHBondContact O-N 2.72Å
7L59.2Low55.9Low146 Ų146142.4 Ų142.476%0.76478%0.779SS**  trans-60.799163.2-171.276.5000105.3K5 E9K5-L7 PolarHBondContact O-N 2.99Å; L7-E9 VanDerWaalsContact C-N 3.29Å; L7-E9 PolarHBondContact O-N 3.25Å
8A56.5Low56.2Low81 Ų81140.4 Ų140.467%0.66978%0.777SS**  trans-57.897.7173.700000108.2L6 R10L6-A8 VanDerWaalsContact C-N 3.28Å; L6-A8 PolarHBondContact O-N 2.72Å; A8-R10 PolarHBondContact O-N 2.81Å
9E55.3Low56.5Low181 Ų181144.7 Ų144.785%0.84678%0.78SS**  trans-64.266155.2-67.7156.578.700107.3L7 A11L7-E9 VanDerWaalsContact C-N 3.29Å; L7-E9 PolarHBondContact O-N 3.25Å; E9-A11 PolarHBondContact O-N 3.21Å
10R58.6Low56.8Low223 Ų223143.5 Ų143.584%0.84278%0.78SS**  trans-69.780.4160.9-175.472.4166.8-173-1.9104.7A8 K12A8-R10 PolarHBondContact O-N 2.81Å; R10-K12 VanDerWaalsContact C-N 3.3Å; R10-K12 PolarHBondContact O-N 3.32Å
11A56.5Low56.9Low83 Ų83145.7 Ų145.769%0.68678%0.782SS**  trans-47102.5160.800000106.6E9 P13E9-A11 PolarHBondContact O-N 3.21Å; A11-P13 WeakPolarHBondContact O-CD 2.77Å
12K61.1Low57.4Low172 Ų172141 Ų14175%0.74876%0.76SS**  trans-64.3118.7163.2-171.576.9170.4-151.60103.8R10 F14R10-K12 VanDerWaalsContact C-N 3.3Å; R10-K12 PolarHBondContact O-N 3.32Å; K12-F14 PolarHBondContact O-N 3.21Å
13P56.1Low57.6Low109 Ų109141.2 Ų141.271%0.70876%0.759SS**  trans-63.1116.3178.525.3-31.1000106.5A11 G15A11-P13 WeakPolarHBondContact O-CD 2.77Å; P13-G15 PolarHBondContact O-N 3.04Å
14F49Very low57.4Low214 Ų214137 Ų13794%0.93973%0.732SS**  trans-68.761163.4-85.1-89.9000108.3K12 A16K12-F14 PolarHBondContact O-N 3.21Å; F14-A16 PolarHBondContact O-N 3.07Å
15G57.7Low57.8Low56 Ų56139.9 Ų139.958%0.57774%0.742SS**  trans-71.9103156.900000106.3P13 S17P13-G15 PolarHBondContact O-N 3.04Å; G15-S17 PolarHBondContact O-N 3.26Å
16A62.3Low58.1Low89 Ų89133.2 Ų133.274%0.73672%0.716SS**  trans-59.170.4179.600000113F14 S18F14-A16 PolarHBondContact O-N 3.07Å; A16-S18 PolarHBondContact O-N 3.3Å
17S57.5Low58.6Low109 Ų109130.3 Ų130.376%0.76271%0.708SS**  trans-77.778.1163-63.60000107.4G15 R19G15-S17 PolarHBondContact O-N 3.26Å; S17-R19 PolarHBondContact O-N 3.11Å
18S61.6Low58.6Low107 Ų107129.1 Ų129.175%0.74870%0.698SS**  trans-53.184.8162.4-54.50000107.4A16A16-S18 PolarHBondContact O-N 3.3Å
19R61.4Low58.7Low221 Ų221128.2 Ų128.283%0.83469%0.687SS**  trans-50.6129.6160.9-74.5-174-76.4-127.41.7104.5S17 K21S17-R19 PolarHBondContact O-N 3.11Å; R19-K21 PolarHBondContact O-N 3.19Å
20P61.8Low59.1Low121 Ų121125.4 Ų125.479%0.78668%0.678SS**  trans-46.9124170.5-19.929.1000105.5M22P20-M22 VanDerWaalsContact C-N 3.31Å; P20-M22 PolarHBondContact O-N 3.47Å
21K60Low59.4Low189 Ų189116.1 Ų116.182%0.82265%0.645SS**  trans-51.1111.3166.9-71.6179.1173.6125.30103.4R19 I23R19-K21 PolarHBondContact O-N 3.19Å; K21-I23 PolarHBondContact O-N 3.39Å
22M55.3Low59.8Low134 Ų134118.4 Ų118.466%0.6665%0.646SS**  trans-52.6121.9165.7-100.9-170.6-170.500103P20 C24 C64P20-M22 VanDerWaalsContact C-N 3.31Å; P20-M22 PolarHBondContact O-N 3.47Å; M22-C24 PolarHBondContact O-N 3.2Å; M22-C64 HydrophobicContact CB-CB 4.49Å; M22-C64 HydrophobicContact SD-CB 3.6Å; M22-C64 VanDerWaalsContact SD-CB 3.6Å
23I60.5Low60.4Low150 Ų150113.2 Ų113.277%0.76963%0.626SS**  trans-70.277.5170.2-56.2-70.2000103.5K21 Q25K21-I23 PolarHBondContact O-N 3.39Å; I23-Q25 PolarHBondContact O-N 2.76Å
24C56.1Low61.8Low24 Ų24112.7 Ų112.716%0.16263%0.625CS.*  trans-73128175.1-169.40000106.7M22 C26 C63 C64M22-C24 PolarHBondContact O-N 3.2Å; C24-C26 PolarHBondContact O-N 2.73Å; C24-C26 PolarHBondContact SG-SG 2.92Å; C24-C63 PolarHBondContact SG-SG 2.89Å; C24-C64 VanDerWaalsContact CB-C 3.48Å; C24-C64 HydrophobicContact CB-CB 4.36Å; C24-C64 WeakPolarHBondContact CB-O 3.41Å; C24-C64 VanDerWaalsContact CB-SG 3.56Å; C24-C64 PolarHBondContact SG-N 3.31Å; C24-C64 PolarHBondContact SG-SG 3.42Å
25Q61.3Low63.8Low180 Ų180107.2 Ų107.284%0.84160%0.601SS**  trans-70.521.6-175.1-154.373.872.700112.5I23I23-Q25 PolarHBondContact O-N 2.76Å
26C59.1Low65.4Low33 Ų33104.8 Ų104.822%0.22358%0.575CS.*  trans-77.8129.3176.5-57.70000109.2C24 H28 C63C24-C26 PolarHBondContact O-N 2.73Å; C24-C26 PolarHBondContact SG-SG 2.92Å; C26-H28 PolarHBondContact O-N 3.36Å; C26-C63 HydrophobicContact CB-CB 4.25Å; C26-C63 WeakPolarHBondContact CB-SG 3.35Å; C26-C63 WeakPolarHBondContact SG-CB 2.93Å; C26-C63 CovalentContact SG-SG 2.03Å; C26-C63 PolarHBondContact SG-SG 3.1Å
27P63.1Low66.7Low115 Ų115103.3 Ų103.375%0.74756%0.559SS**THydrogen-bonded Turntrans-63.6-11.9178.322.4-30.8000114
28H60.7Low68.5Low121 Ų121103.9 Ų103.956%0.5655%0.548SS*.THydrogen-bonded Turntrans-133.449.7-175.7-53.8108.5000111.6C26 D30 P57C26-H28 PolarHBondContact O-N 3.36Å; H28-D30 PolarHBondContact O-N 3.29Å; H28-D30 VanDerWaalsContact O-N 3.07Å; H28-P57 WeakPolarHBondContact O-CG 3.27Å
29S58Low70.1Confident61 Ų61102 Ų10243%0.42752%0.524SS..  trans-70.27.6-179.356.90000115.2D31S29-D31 PolarHBondContact O-N 2.99Å
30D62.9Low71.6Confident123 Ų12392.8 Ų92.866%0.65850%0.495SS*.  trans-95.971.2-179.2-82-26.8000111H28 N32H28-D30 PolarHBondContact O-N 3.29Å; H28-D30 VanDerWaalsContact O-N 3.07Å; D30-N32 WeakPolarHBondContact CB-ND2 3.45Å; D30-N32 PolarHBondContact O-N 3.3Å; D30-N32 PolarHBondContact OD1-ND2 3.25Å
31D66.3Low73.2Confident27 Ų2795.1 Ų95.114%0.14450%0.495CS..  trans-69.246.9157.3-81.557000110.2S29 D33 C36 C56 P57 V58 S59S29-D31 PolarHBondContact O-N 2.99Å; D31-D33 PolarHBondContact O-N 2.82Å; D31-C36 HydrophobicContact CB-CB 4.45Å; D31-C56 WeakPolarHBondContact OD1-CA 3.16Å; D31-C56 VanDerWaalsContact OD2-C 3.27Å; D31-C56 VanDerWaalsContact OD2-CA 3.27Å; D31-C56 WeakPolarHBondContact OD2-CA 3.14Å; D31-P57 WeakPolarHBondContact OD1-CD 3.48Å; D31-V58 HydrophobicContact CB-CB 3.95Å; D31-V58 HydrophobicContact CB-CG2 4.42Å; D31-V58 PolarHBondContact OD1-N 2.8Å; D31-V58 VanDerWaalsContact OD1-N 3.13Å; D31-S59 WeakPolarHBondContact OD2-CA 3.39Å; D31-S59 WeakPolarHBondContact OD2-CB 3.28Å; D31-S59 PolarHBondContact OD2-N 2.81Å; D31-S59 PolarHBondContact OD2-OG 3.13Å
32N63.9Low74.9Confident132 Ų13289.9 Ų89.971%0.70648%0.476SS*.  trans-79.4-3178.7-78.1-59000112.6D30D30-N32 WeakPolarHBondContact CB-ND2 3.45Å; D30-N32 PolarHBondContact O-N 3.3Å; D30-N32 PolarHBondContact OD1-ND2 3.25Å
33D74.1Confident76.9Confident62 Ų6284.5 Ų84.533%0.33246%0.455SS..SBendtrans-92.4126-179.8-158.9-52.8000110.4D31 K35 C36D31-D33 PolarHBondContact O-N 2.82Å; D33-K35 HydrophobicContact CB-CB 4.5Å; D33-K35 PolarHBondContact O-N 3.31Å; D33-K35 WeakPolarHBondContact OD1-CB 3.18Å; D33-K35 VanDerWaalsContact OD1-CD 3.28Å; D33-K35 WeakPolarHBondContact OD1-CD 3.43Å; D33-K35 WeakPolarHBondContact OD1-CE 3Å; D33-K35 WeakPolarHBondContact OD1-CG 3.32Å; D33-K35 PolarHBondContact OD1-N 2.72Å; D33-K35 IonicContact OD1-NZ 2.79Å; D33-K35 IonicContact OD2-NZ 3.84Å; D33-K35 PolarHBondContact OD2-NZ 3.27Å; D33-C36 WeakPolarHBondContact O-CB 3.46Å; D33-C36 PolarHBondContact O-N 3.11Å
34S85.6Confident78.6Confident98 Ų9878.8 Ų78.869%0.68543%0.425SS*.Hα-helixtrans-55.3-21.4172.9530000112.8F38S34-F38 WeakPolarHBondContact O-CB 3.21Å; S34-F38 PolarHBondContact O-N 2.03Å
35K89.9Confident80.5Confident100 Ų10078.6 Ų78.644%0.43542%0.424SS..Hα-helixtrans-64.1-38.7171.2-66.5167.4-151.2137.30113D33 S37 F38 W39D33-K35 HydrophobicContact CB-CB 4.5Å; D33-K35 PolarHBondContact O-N 3.31Å; D33-K35 WeakPolarHBondContact OD1-CB 3.18Å; D33-K35 VanDerWaalsContact OD1-CD 3.28Å; D33-K35 WeakPolarHBondContact OD1-CD 3.43Å; D33-K35 WeakPolarHBondContact OD1-CE 3Å; D33-K35 WeakPolarHBondContact OD1-CG 3.32Å; D33-K35 PolarHBondContact OD1-N 2.72Å; D33-K35 IonicContact OD1-NZ 2.79Å; D33-K35 IonicContact OD2-NZ 3.84Å; D33-K35 PolarHBondContact OD2-NZ 3.27Å; K35-S37 VanDerWaalsContact C-N 3.32Å; K35-S37 PolarHBondContact O-N 2.04Å; K35-F38 CarbonylContact O-C 3.4Å; K35-F38 WeakPolarHBondContact O-CB 3.39Å; K35-F38 PolarHBondContact O-N 3.31Å; K35-F38 VanDerWaalsContact O-N 3.14Å; K35-W39 HydrophobicContact CB-CD2 4.06Å; K35-W39 HydrophobicContact CB-CE3 3.93Å; K35-W39 HydrophobicContact CB-CH2 3.83Å; K35-W39 HydrophobicContact CB-CZ2 3.95Å; K35-W39 HydrophobicContact CB-CZ3 3.81Å; K35-W39 HydrophobicContact CD-CH2 3.81Å; K35-W39 HydrophobicContact CD-CZ2 3.99Å; K35-W39 HydrophobicContact CD-CZ3 4.49Å; K35-W39 HydrophobicContact CG-CH2 4.31Å; K35-W39 HydrophobicContact CG-CZ2 4.23Å; K35-W39 WeakPolarHBondContact O-CB 3.39Å; K35-W39 VanDerWaalsContact O-CG 3.26Å; K35-W39 PolarHBondContact O-N 2.93Å
36C92.1Very high82.1Confident5 Ų578.5 Ų78.53%0.03442%0.423CS..Hα-helixtrans-62.7-44-179.5-76.10000110.9D31 D33 A40 M55 C56 S59D31-C36 HydrophobicContact CB-CB 4.45Å; D33-C36 WeakPolarHBondContact O-CB 3.46Å; D33-C36 PolarHBondContact O-N 3.11Å; C36-A40 WeakPolarHBondContact O-CB 3.36Å; C36-A40 PolarHBondContact O-N 2.58Å; C36-M55 PolarHBondContact SG-O 2.93Å; C36-C56 WeakPolarHBondContact CA-SG 3.48Å; C36-C56 HydrophobicContact CB-CB 3.5Å; C36-C56 VanDerWaalsContact CB-CB 3.5Å; C36-C56 WeakPolarHBondContact CB-SG 3.34Å; C36-C56 VanDerWaalsContact SG-CA 3.54Å; C36-C56 WeakPolarHBondContact SG-CB 3.47Å; C36-C56 CovalentContact SG-SG 2.04Å; C36-C56 PolarHBondContact SG-SG 3.46Å; C36-S59 WeakPolarHBondContact CB-OG 3.01Å
37S90.7Very high84Confident58 Ų5884.3 Ų84.341%0.40644%0.44SS..Hα-helixtrans-60.8-46.3171.4-540000111.6K35 A40 H41K35-S37 VanDerWaalsContact C-N 3.32Å; K35-S37 PolarHBondContact O-N 2.04Å; S37-A40 PolarHBondContact O-N 3.18Å; S37-H41 WeakPolarHBondContact O-CB 3.36Å; S37-H41 PolarHBondContact O-CD2 3.29Å; S37-H41 VanDerWaalsContact O-CG 3.28Å; S37-H41 PolarHBondContact O-N 2.94Å
38F94.3Very high85.5Confident120 Ų12082.8 Ų82.853%0.52643%0.425SS..Hα-helixtrans-59.8-48.7178.5176.4-104.2000112.8S34 K35 H41 L42S34-F38 WeakPolarHBondContact O-CB 3.21Å; S34-F38 PolarHBondContact O-N 2.03Å; K35-F38 CarbonylContact O-C 3.4Å; K35-F38 WeakPolarHBondContact O-CB 3.39Å; K35-F38 PolarHBondContact O-N 3.31Å; K35-F38 VanDerWaalsContact O-N 3.14Å; F38-H41 WeakPolarHBondContact O-CB 3.27Å; F38-H41 PolarHBondContact O-N 3.13Å; F38-L42 HydrophobicContact CD1-CD1 3.96Å; F38-L42 HydrophobicContact CE1-CD1 3.35Å; F38-L42 HydrophobicContact CE1-CG 4.31Å; F38-L42 HydrophobicContact CE2-CD1 4.24Å; F38-L42 HydrophobicContact CE2-CG 4.49Å; F38-L42 HydrophobicContact CZ-CD1 3.52Å; F38-L42 HydrophobicContact CZ-CG 4.24Å; F38-L42 WeakPolarHBondContact O-CG 3.41Å; F38-L42 PolarHBondContact O-N 2.94Å
39W95Very high87Confident68 Ų6879.5 Ų79.526%0.25842%0.415SS..Hα-helixtrans-67.5-40.8179.5-68.1-32.4000112.2K35 H41 L42 G43 E44 F51 M52K35-W39 HydrophobicContact CB-CD2 4.06Å; K35-W39 HydrophobicContact CB-CE3 3.93Å; K35-W39 HydrophobicContact CB-CH2 3.83Å; K35-W39 HydrophobicContact CB-CZ2 3.95Å; K35-W39 HydrophobicContact CB-CZ3 3.81Å; K35-W39 HydrophobicContact CD-CH2 3.81Å; K35-W39 HydrophobicContact CD-CZ2 3.99Å; K35-W39 HydrophobicContact CD-CZ3 4.49Å; K35-W39 HydrophobicContact CG-CH2 4.31Å; K35-W39 HydrophobicContact CG-CZ2 4.23Å; K35-W39 WeakPolarHBondContact O-CB 3.39Å; K35-W39 VanDerWaalsContact O-CG 3.26Å; K35-W39 PolarHBondContact O-N 2.93Å; W39-H41 VanDerWaalsContact C-N 3.32Å; W39-H41 PolarHBondContact O-N 2.77Å; W39-L42 CarbonylContact O-C 3.59Å; W39-L42 PolarHBondContact O-N 2.72Å; W39-L42 VanDerWaalsContact O-N 3.09Å; W39-G43 PolarHBondContact O-N 3.26Å; W39-E44 HydrophobicContact CB-CB 3.92Å; W39-E44 HydrophobicContact CB-CG 3.74Å; W39-E44 HydrophobicContact CG-CG 4.22Å; W39-E44 VanDerWaalsContact O-CB 3.27Å; W39-E44 WeakPolarHBondContact O-CB 3.11Å; W39-E44 VanDerWaalsContact O-CG 3.32Å; W39-E44 WeakPolarHBondContact O-CG 3.46Å; W39-E44 PolarHBondContact O-N 2.88Å; W39-F51 AromaticContact CE3-CE1 3.96Å; W39-F51 HydrophobicContact CE3-CE1 3.96Å; W39-F51 HydrophobicContact CH2-CE1 4.09Å; W39-F51 HydrophobicContact CH2-CZ 4.07Å; W39-F51 AromaticContact CZ3-CE1 3.66Å; W39-F51 HydrophobicContact CZ3-CE1 3.66Å; W39-F51 AromaticContact CZ3-CZ 3.95Å; W39-F51 HydrophobicContact CZ3-CZ 3.95Å; W39-M52 HydrophobicContact CB-CE 3.62Å; W39-M52 HydrophobicContact CB-SD 3.67Å; W39-M52 HydrophobicContact CD2-SD 4.49Å; W39-M52 HydrophobicContact CE3-SD 4.11Å; W39-M52 HydrophobicContact CG-SD 4.38Å
40A93.3Very high88.7Confident27 Ų2779.1 Ų79.122%0.22342%0.42CS..Hα-helixtrans-61-42.3172.900000111.3C36 S37 L42 G43 M52 S59C36-A40 WeakPolarHBondContact O-CB 3.36Å; C36-A40 PolarHBondContact O-N 2.58Å; S37-A40 PolarHBondContact O-N 3.18Å; A40-L42 VanDerWaalsContact C-N 3.26Å; A40-L42 PolarHBondContact O-N 2.83Å; A40-G43 PolarHBondContact O-N 3.26Å; A40-M52 HydrophobicContact CB-CE 4.24Å; A40-S59 WeakPolarHBondContact CB-O 3.5Å
41H94.5Very high90Very high170 Ų17077.8 Ų77.879%0.78741%0.408SS*.Hα-helixtrans-62.4-30.5173-75.3-52.7000113.6S37 F38 W39 G43S37-H41 WeakPolarHBondContact O-CB 3.36Å; S37-H41 PolarHBondContact O-CD2 3.29Å; S37-H41 VanDerWaalsContact O-CG 3.28Å; S37-H41 PolarHBondContact O-N 2.94Å; F38-H41 WeakPolarHBondContact O-CB 3.27Å; F38-H41 PolarHBondContact O-N 3.13Å; W39-H41 VanDerWaalsContact C-N 3.32Å; W39-H41 PolarHBondContact O-N 2.77Å; H41-G43 PolarHBondContact O-N 2.91Å
42L96.2Very high91.2Very high80 Ų8076.5 Ų76.542%0.41940%0.402SS..THydrogen-bonded Turntrans-78.7-1.2173.8-71.7-179.1000114F38 W39 A40 E44 R47F38-L42 HydrophobicContact CD1-CD1 3.96Å; F38-L42 HydrophobicContact CE1-CD1 3.35Å; F38-L42 HydrophobicContact CE1-CG 4.31Å; F38-L42 HydrophobicContact CE2-CD1 4.24Å; F38-L42 HydrophobicContact CE2-CG 4.49Å; F38-L42 HydrophobicContact CZ-CD1 3.52Å; F38-L42 HydrophobicContact CZ-CG 4.24Å; F38-L42 WeakPolarHBondContact O-CG 3.41Å; F38-L42 PolarHBondContact O-N 2.94Å; W39-L42 CarbonylContact O-C 3.59Å; W39-L42 PolarHBondContact O-N 2.72Å; W39-L42 VanDerWaalsContact O-N 3.09Å; A40-L42 VanDerWaalsContact C-N 3.26Å; A40-L42 PolarHBondContact O-N 2.83Å; L42-E44 HydrophobicContact CB-CG 4.29Å; L42-R47 PolarHBondContact O-NH1 3.4Å; L42-R47 PolarHBondContact O-NH2 3.03Å
43G96.6Very high92.5Very high20 Ų2074.5 Ų74.521%0.20639%0.387CS..THydrogen-bonded Turntrans76.521.8-177.100000113.7W39 A40 H41 C45 E46 R47W39-G43 PolarHBondContact O-N 3.26Å; A40-G43 PolarHBondContact O-N 3.26Å; H41-G43 PolarHBondContact O-N 2.91Å; G43-C45 PolarHBondContact O-N 3.09Å; G43-E46 PolarHBondContact O-N 2.99Å; G43-R47 PolarHBondContact O-N 3.45Å; G43-R47 VanDerWaalsContact O-N 3.13Å
44E96.6Very high93.1Very high30 Ų3075.8 Ų75.814%0.1440%0.397CS..Hα-helixtrans-64.4-24.7179.9-66.4-60.7153.900112.6W39 L42 E46 R47 I48 M52W39-E44 HydrophobicContact CB-CB 3.92Å; W39-E44 HydrophobicContact CB-CG 3.74Å; W39-E44 HydrophobicContact CG-CG 4.22Å; W39-E44 VanDerWaalsContact O-CB 3.27Å; W39-E44 WeakPolarHBondContact O-CB 3.11Å; W39-E44 VanDerWaalsContact O-CG 3.32Å; W39-E44 WeakPolarHBondContact O-CG 3.46Å; W39-E44 PolarHBondContact O-N 2.88Å; L42-E44 HydrophobicContact CB-CG 4.29Å; E44-E46 PolarHBondContact O-N 3.45Å; E44-R47 VanDerWaalsContact CD-NH1 3.32Å; E44-R47 PolarHBondContact O-N 3.14Å; E44-R47 IonicContact OE1-CZ 3.71Å; E44-R47 IonicContact OE1-NH1 2.6Å; E44-R47 PolarHBondContact OE1-NH1 3.35Å; E44-R47 IonicContact OE2-NH1 3.64Å; E44-I48 CarbonylContact O-C 3.57Å; E44-I48 WeakPolarHBondContact O-CA 2.98Å; E44-I48 PolarHBondContact O-N 2.76Å; E44-I48 WeakPolarHBondContact OE2-CD1 3.25Å; E44-I48 WeakPolarHBondContact OE2-CG1 3.03Å; E44-M52 HydrophobicContact CB-CE 3.99Å; E44-M52 HydrophobicContact CB-CG 3.69Å; E44-M52 HydrophobicContact CB-SD 3.71Å; E44-M52 WeakPolarHBondContact O-CG 3.35Å
45C95.5Very high93.1Very high21 Ų2176 Ų7614%0.14239%0.388CS..Hα-helixtrans-58.3-33.9175.4-60.90000112.6G43 P49 C60G43-C45 PolarHBondContact O-N 3.09Å; C45-P49 WeakPolarHBondContact O-CA 3.48Å; C45-P49 WeakPolarHBondContact O-CB 3.03Å; C45-C60 VanDerWaalsContact CA-SG 3.57Å; C45-C60 HydrophobicContact CB-CB 3.69Å; C45-C60 WeakPolarHBondContact CB-SG 3.47Å; C45-C60 WeakPolarHBondContact SG-CA 3.1Å; C45-C60 WeakPolarHBondContact SG-CB 3.48Å; C45-C60 CovalentContact SG-SG 2.03Å; C45-C60 PolarHBondContact SG-SG 2.95Å
46E96.6Very high93.2Very high177 Ų17771.2 Ų71.283%0.82737%0.368SS*.Hα-helixtrans-91.2-34.5177.1-62.5-179.998.400111.6G43 E44G43-E46 PolarHBondContact O-N 2.99Å; E44-E46 PolarHBondContact O-N 3.45Å
47R97.6Very high93Very high155 Ų15571.2 Ų71.259%0.58537%0.368SS*.Hα-helixtrans-73.7-41.4-177.9-169.3-179.3-65.1124.213.1112.7L42 G43 E44L42-R47 PolarHBondContact O-NH1 3.4Å; L42-R47 PolarHBondContact O-NH2 3.03Å; G43-R47 PolarHBondContact O-N 3.45Å; G43-R47 VanDerWaalsContact O-N 3.13Å; E44-R47 VanDerWaalsContact CD-NH1 3.32Å; E44-R47 PolarHBondContact O-N 3.14Å; E44-R47 IonicContact OE1-CZ 3.71Å; E44-R47 IonicContact OE1-NH1 2.6Å; E44-R47 PolarHBondContact OE1-NH1 3.35Å; E44-R47 IonicContact OE2-NH1 3.64Å
48I94.9Very high92.9Very high83 Ų8370.9 Ų70.943%0.42636%0.363SS..SBendtrans-138.762.1-174.7-42179000110.3E44 G50 F51 M52E44-I48 CarbonylContact O-C 3.57Å; E44-I48 WeakPolarHBondContact O-CA 2.98Å; E44-I48 PolarHBondContact O-N 2.76Å; E44-I48 WeakPolarHBondContact OE2-CD1 3.25Å; E44-I48 WeakPolarHBondContact OE2-CG1 3.03Å; I48-G50 VanDerWaalsContact C-N 3.33Å; I48-G50 PolarHBondContact O-N 2.92Å; I48-F51 HydrophobicContact CG2-CB 3.69Å; I48-F51 PolarHBondContact O-N 3.3Å; I48-M52 PolarHBondContact O-N 3.48Å; I48-M52 VanDerWaalsContact O-N 3.1Å
49P93.5Very high92.6Very high53 Ų5367 Ų6734%0.34435%0.351SS..Hα-helixtrans-58.9-39.5-172.921.6-33.1000112.9C45 F51 M52 F53C45-P49 WeakPolarHBondContact O-CA 3.48Å; C45-P49 WeakPolarHBondContact O-CB 3.03Å; P49-F51 PolarHBondContact O-N 3.01Å; P49-M52 PolarHBondContact O-N 3.24Å; P49-F53 HydrophobicContact CB-CD1 4.46Å; P49-F53 HydrophobicContact CB-CD2 4.2Å; P49-F53 HydrophobicContact CB-CE1 4.04Å; P49-F53 HydrophobicContact CB-CE2 3.78Å; P49-F53 HydrophobicContact CB-CZ 3.68Å; P49-F53 WeakPolarHBondContact O-CB 3.34Å; P49-F53 VanDerWaalsContact O-CD1 3.32Å; P49-F53 WeakPolarHBondContact O-CD1 3.2Å; P49-F53 WeakPolarHBondContact O-CG 3.49Å; P49-F53 PolarHBondContact O-N 2.98Å
50G92.2Very high92.4Very high52 Ų5265 Ų6554%0.53635%0.347SS..Hα-helixtrans-60.9-41.6-17800000113.8I48 T54I48-G50 VanDerWaalsContact C-N 3.33Å; I48-G50 PolarHBondContact O-N 2.92Å; G50-T54 PolarHBondContact O-OG1 3.24Å
51F91.4Very high92.1Very high95 Ų9566.7 Ų66.742%0.41737%0.367SS..Hα-helixtrans-69.7-50.8175.6175.9-97.9000110.3W39 I48 P49 F53 T54 M55W39-F51 AromaticContact CE3-CE1 3.96Å; W39-F51 HydrophobicContact CE3-CE1 3.96Å; W39-F51 HydrophobicContact CH2-CE1 4.09Å; W39-F51 HydrophobicContact CH2-CZ 4.07Å; W39-F51 AromaticContact CZ3-CE1 3.66Å; W39-F51 HydrophobicContact CZ3-CE1 3.66Å; W39-F51 AromaticContact CZ3-CZ 3.95Å; W39-F51 HydrophobicContact CZ3-CZ 3.95Å; I48-F51 HydrophobicContact CG2-CB 3.69Å; I48-F51 PolarHBondContact O-N 3.3Å; P49-F51 PolarHBondContact O-N 3.01Å; F51-F53 VanDerWaalsContact C-N 3.34Å; F51-F53 PolarHBondContact O-N 3.05Å; F51-T54 PolarHBondContact O-N 2.79Å; F51-M55 HydrophobicContact CD1-CG 4.47Å; F51-M55 HydrophobicContact CD2-CG 4.01Å; F51-M55 HydrophobicContact CE1-CB 4.32Å; F51-M55 HydrophobicContact CE1-CG 4.16Å; F51-M55 HydrophobicContact CE2-CG 3.67Å; F51-M55 HydrophobicContact CG-CG 4.4Å; F51-M55 HydrophobicContact CZ-CB 4.33Å; F51-M55 HydrophobicContact CZ-CG 3.76Å; F51-M55 WeakPolarHBondContact O-CB 3.33Å; F51-M55 WeakPolarHBondContact O-CG 3Å; F51-M55 PolarHBondContact O-N 2.76Å
52M91.4Very high91.7Very high1 Ų162.9 Ų62.91%0.00535%0.352CS..Hα-helixtrans-66.9-33.3-175-72-66.4-70.900113W39 A40 E44 I48 P49 T54 C56 C60W39-M52 HydrophobicContact CB-CE 3.62Å; W39-M52 HydrophobicContact CB-SD 3.67Å; W39-M52 HydrophobicContact CD2-SD 4.49Å; W39-M52 HydrophobicContact CE3-SD 4.11Å; W39-M52 HydrophobicContact CG-SD 4.38Å; A40-M52 HydrophobicContact CB-CE 4.24Å; E44-M52 HydrophobicContact CB-CE 3.99Å; E44-M52 HydrophobicContact CB-CG 3.69Å; E44-M52 HydrophobicContact CB-SD 3.71Å; E44-M52 WeakPolarHBondContact O-CG 3.35Å; I48-M52 PolarHBondContact O-N 3.48Å; I48-M52 VanDerWaalsContact O-N 3.1Å; P49-M52 PolarHBondContact O-N 3.24Å; M52-T54 VanDerWaalsContact C-N 3.29Å; M52-T54 PolarHBondContact O-N 2.6Å; M52-C56 HydrophobicContact CE-CB 3.89Å; M52-C56 CarbonylContact O-C 3.02Å; M52-C56 WeakPolarHBondContact O-CA 3.41Å; M52-C56 WeakPolarHBondContact O-CB 3.21Å; M52-C56 PolarHBondContact O-N 3.43Å; M52-C56 HydrophobicContact SD-CB 4.28Å; M52-C60 VanDerWaalsContact CB-SG 3.51Å
53F89.9Confident90.9Very high89 Ų8959.7 Ų59.739%0.3934%0.336SS..Hα-helixtrans-73-26.3178-67.7-1.3000112.5P49 F51 P57 C60 I62P49-F53 HydrophobicContact CB-CD1 4.46Å; P49-F53 HydrophobicContact CB-CD2 4.2Å; P49-F53 HydrophobicContact CB-CE1 4.04Å; P49-F53 HydrophobicContact CB-CE2 3.78Å; P49-F53 HydrophobicContact CB-CZ 3.68Å; P49-F53 WeakPolarHBondContact O-CB 3.34Å; P49-F53 VanDerWaalsContact O-CD1 3.32Å; P49-F53 WeakPolarHBondContact O-CD1 3.2Å; P49-F53 WeakPolarHBondContact O-CG 3.49Å; P49-F53 PolarHBondContact O-N 2.98Å; F51-F53 VanDerWaalsContact C-N 3.34Å; F51-F53 PolarHBondContact O-N 3.05Å; F53-P57 WeakPolarHBondContact O-CB 3.32Å; F53-C60 HydrophobicContact CD1-CB 4.09Å; F53-C60 HydrophobicContact CE1-CB 4.03Å; F53-I62 HydrophobicContact CB-CD1 3.42Å; F53-I62 VanDerWaalsContact CB-CD1 3.42Å; F53-I62 HydrophobicContact CD1-CD1 3.67Å; F53-I62 HydrophobicContact CD1-CG1 4.06Å; F53-I62 HydrophobicContact CD1-CG2 3.93Å; F53-I62 HydrophobicContact CD2-CD1 4.03Å; F53-I62 HydrophobicContact CE1-CD1 4.45Å; F53-I62 HydrophobicContact CE1-CG2 3.56Å; F53-I62 HydrophobicContact CE2-CG2 4.26Å; F53-I62 HydrophobicContact CG-CD1 3.44Å; F53-I62 VanDerWaalsContact CG-CD1 3.44Å; F53-I62 HydrophobicContact CG-CG1 4.32Å; F53-I62 HydrophobicContact CG-CG2 4.45Å; F53-I62 HydrophobicContact CZ-CG2 3.74Å
54T87.3Confident89.4Confident90 Ų9063.1 Ų63.155%0.55236%0.355SS*.Hα-helixtrans-81.7-41.5175.2-54.20000111.1G50 F51 M52G50-T54 PolarHBondContact O-OG1 3.24Å; F51-T54 PolarHBondContact O-N 2.79Å; M52-T54 VanDerWaalsContact C-N 3.29Å; M52-T54 PolarHBondContact O-N 2.6Å
55M86.3Confident89Confident101 Ų10164.8 Ų64.850%0.49837%0.366SS..Hα-helixtrans-93.7-34.6-171.3-68.9-63.1-59.500114.2C36 F51 P57C36-M55 PolarHBondContact SG-O 2.93Å; F51-M55 HydrophobicContact CD1-CG 4.47Å; F51-M55 HydrophobicContact CD2-CG 4.01Å; F51-M55 HydrophobicContact CE1-CB 4.32Å; F51-M55 HydrophobicContact CE1-CG 4.16Å; F51-M55 HydrophobicContact CE2-CG 3.67Å; F51-M55 HydrophobicContact CG-CG 4.4Å; F51-M55 HydrophobicContact CZ-CB 4.33Å; F51-M55 HydrophobicContact CZ-CG 3.76Å; F51-M55 WeakPolarHBondContact O-CB 3.33Å; F51-M55 WeakPolarHBondContact O-CG 3Å; F51-M55 PolarHBondContact O-N 2.76Å; M55-P57 VanDerWaalsContact C-CD 3.47Å
56C90.6Very high88.7Confident0 Ų067.1 Ų67.10%038%0.378CS..  trans-137.448.6-169.5-54.80000112.3D31 C36 M52 V58 S59 C60D31-C56 WeakPolarHBondContact OD1-CA 3.16Å; D31-C56 VanDerWaalsContact OD2-C 3.27Å; D31-C56 VanDerWaalsContact OD2-CA 3.27Å; D31-C56 WeakPolarHBondContact OD2-CA 3.14Å; C36-C56 WeakPolarHBondContact CA-SG 3.48Å; C36-C56 HydrophobicContact CB-CB 3.5Å; C36-C56 VanDerWaalsContact CB-CB 3.5Å; C36-C56 WeakPolarHBondContact CB-SG 3.34Å; C36-C56 VanDerWaalsContact SG-CA 3.54Å; C36-C56 WeakPolarHBondContact SG-CB 3.47Å; C36-C56 CovalentContact SG-SG 2.04Å; C36-C56 PolarHBondContact SG-SG 3.46Å; M52-C56 HydrophobicContact CE-CB 3.89Å; M52-C56 CarbonylContact O-C 3.02Å; M52-C56 WeakPolarHBondContact O-CA 3.41Å; M52-C56 WeakPolarHBondContact O-CB 3.21Å; M52-C56 PolarHBondContact O-N 3.43Å; M52-C56 HydrophobicContact SD-CB 4.28Å; C56-V58 PolarHBondContact O-N 2.76Å; C56-S59 PolarHBondContact O-N 2.83Å; C56-C60 PolarHBondContact O-N 2.76Å; C56-C60 VanDerWaalsContact O-N 3.11Å
57P87.8Confident88.2Confident6 Ų660.9 Ų60.94%0.03935%0.353CS..THydrogen-bonded Turntrans-60.5-33.7-174.126.1-36.2000112.9H28 D31 F53 M55 G61 I62 C63H28-P57 WeakPolarHBondContact O-CG 3.27Å; D31-P57 WeakPolarHBondContact OD1-CD 3.48Å; F53-P57 WeakPolarHBondContact O-CB 3.32Å; M55-P57 VanDerWaalsContact C-CD 3.47Å; P57-G61 PolarHBondContact O-N 3.06Å; P57-I62 HydrophobicContact CB-CD1 3.84Å; P57-I62 HydrophobicContact CB-CG1 3.81Å; P57-I62 WeakPolarHBondContact O-CG1 3.41Å; P57-I62 PolarHBondContact O-N 2.82Å; P57-I62 VanDerWaalsContact O-N 3.11Å; P57-C63 HydrophobicContact CB-CB 3.71Å; P57-C63 HydrophobicContact CG-CB 4.4Å; P57-C63 PolarHBondContact O-N 3.39Å
58V88.5Confident87.7Confident51 Ų5155.4 Ų55.431%0.30934%0.339SS..THydrogen-bonded Turntrans-74.2-42.6-179.5-1770000110.6D31 C56 C60 G61 C63D31-V58 HydrophobicContact CB-CB 3.95Å; D31-V58 HydrophobicContact CB-CG2 4.42Å; D31-V58 PolarHBondContact OD1-N 2.8Å; D31-V58 VanDerWaalsContact OD1-N 3.13Å; C56-V58 PolarHBondContact O-N 2.76Å; V58-C60 PolarHBondContact O-N 2.81Å; V58-G61 PolarHBondContact O-N 2.99Å; V58-C63 HydrophobicContact CG2-CB 4.25Å
59S89.5Confident87.2Confident38 Ų3853.7 Ų53.727%0.26633%0.334SS..THydrogen-bonded Turntrans-65.7-28.5179-60.40000112D31 C36 A40 C56 G61D31-S59 WeakPolarHBondContact OD2-CA 3.39Å; D31-S59 WeakPolarHBondContact OD2-CB 3.28Å; D31-S59 PolarHBondContact OD2-N 2.81Å; D31-S59 PolarHBondContact OD2-OG 3.13Å; C36-S59 WeakPolarHBondContact CB-OG 3.01Å; A40-S59 WeakPolarHBondContact CB-O 3.5Å; C56-S59 PolarHBondContact O-N 2.83Å; S59-G61 VanDerWaalsContact C-N 3.32Å
60C91Very high86.8Confident26 Ų2653.7 Ų53.718%0.17633%0.333CS..THydrogen-bonded Turntrans-84.6-2.8171.6-64.20000114.7C45 M52 F53 C56 V58 I62C45-C60 VanDerWaalsContact CA-SG 3.57Å; C45-C60 HydrophobicContact CB-CB 3.69Å; C45-C60 WeakPolarHBondContact CB-SG 3.47Å; C45-C60 WeakPolarHBondContact SG-CA 3.1Å; C45-C60 WeakPolarHBondContact SG-CB 3.48Å; C45-C60 CovalentContact SG-SG 2.03Å; C45-C60 PolarHBondContact SG-SG 2.95Å; M52-C60 VanDerWaalsContact CB-SG 3.51Å; F53-C60 HydrophobicContact CD1-CB 4.09Å; F53-C60 HydrophobicContact CE1-CB 4.03Å; C56-C60 PolarHBondContact O-N 2.76Å; C56-C60 VanDerWaalsContact O-N 3.11Å; V58-C60 PolarHBondContact O-N 2.81Å; C60-I62 HydrophobicContact CB-CG1 4.45Å; C60-I62 HydrophobicContact CB-CG2 4.41Å; C60-I62 PolarHBondContact O-N 3.3Å
61G86.5Confident86.4Confident63 Ų6353.9 Ų53.965%0.64932%0.319SS*.THydrogen-bonded Turntrans65.516.4179.900000114.2P57 V58 S59P57-G61 PolarHBondContact O-N 3.06Å; V58-G61 PolarHBondContact O-N 2.99Å; S59-G61 VanDerWaalsContact C-N 3.32Å
62I85.5Confident86Confident90 Ų9050.7 Ų50.746%0.46231%0.311SS..SBendtrans-83.8-9.4172.762.9148.5000112F53 P57 C60F53-I62 HydrophobicContact CB-CD1 3.42Å; F53-I62 VanDerWaalsContact CB-CD1 3.42Å; F53-I62 HydrophobicContact CD1-CD1 3.67Å; F53-I62 HydrophobicContact CD1-CG1 4.06Å; F53-I62 HydrophobicContact CD1-CG2 3.93Å; F53-I62 HydrophobicContact CD2-CD1 4.03Å; F53-I62 HydrophobicContact CE1-CD1 4.45Å; F53-I62 HydrophobicContact CE1-CG2 3.56Å; F53-I62 HydrophobicContact CE2-CG2 4.26Å; F53-I62 HydrophobicContact CG-CD1 3.44Å; F53-I62 VanDerWaalsContact CG-CD1 3.44Å; F53-I62 HydrophobicContact CG-CG1 4.32Å; F53-I62 HydrophobicContact CG-CG2 4.45Å; F53-I62 HydrophobicContact CZ-CG2 3.74Å; P57-I62 HydrophobicContact CB-CD1 3.84Å; P57-I62 HydrophobicContact CB-CG1 3.81Å; P57-I62 WeakPolarHBondContact O-CG1 3.41Å; P57-I62 PolarHBondContact O-N 2.82Å; P57-I62 VanDerWaalsContact O-N 3.11Å; C60-I62 HydrophobicContact CB-CG1 4.45Å; C60-I62 HydrophobicContact CB-CG2 4.41Å; C60-I62 PolarHBondContact O-N 3.3Å
63C78.7Confident85.6Confident12 Ų1254.8 Ų54.88%0.08134%0.337CS..  trans-134.3152.1178.3-175.70000108.3C24 C26 P57 V58C24-C63 PolarHBondContact SG-SG 2.89Å; C26-C63 HydrophobicContact CB-CB 4.25Å; C26-C63 WeakPolarHBondContact CB-SG 3.35Å; C26-C63 WeakPolarHBondContact SG-CB 2.93Å; C26-C63 CovalentContact SG-SG 2.03Å; C26-C63 PolarHBondContact SG-SG 3.1Å; P57-C63 HydrophobicContact CB-CB 3.71Å; P57-C63 HydrophobicContact CG-CB 4.4Å; P57-C63 PolarHBondContact O-N 3.39Å; V58-C63 HydrophobicContact CG2-CB 4.25Å
64C65.2Low85.2Confident92 Ų9251.7 Ų51.762%0.62233%0.332SS*.  trans-102.70179.955.70000114.1M22 C24M22-C64 HydrophobicContact CB-CB 4.49Å; M22-C64 HydrophobicContact SD-CB 3.6Å; M22-C64 VanDerWaalsContact SD-CB 3.6Å; C24-C64 VanDerWaalsContact CB-C 3.48Å; C24-C64 HydrophobicContact CB-CB 4.36Å; C24-C64 WeakPolarHBondContact CB-O 3.41Å; C24-C64 VanDerWaalsContact CB-SG 3.56Å; C24-C64 PolarHBondContact SG-N 3.31Å; C24-C64 PolarHBondContact SG-SG 3.42Å

Retrieved 64 of 64 residues in 17.9 ms (Link to these results)