X6R8S9_HUMAN Loading...

PITH domain containing 1

AlphaFold DB , UniProt , Accession X6R8S9, Species HUMAN (Homo sapiens, Human), Gene PITHD1, Length 98 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
1M77.8Confident89.6Confident154 Ų154122.5 Ų122.576%0.75961%0.606SS**  0129.10-174.9-178.9-76.400107.6D5 S40M1-D5 HydrophobicContact CG-CB 3.94Å; M1-S40 WeakPolarHBondContact SD-CB 3.36Å
2S89.7Confident90.1Very high58 Ų58115.8 Ų115.841%0.40657%0.571SS.*  trans-102.6173.8171.167.90000110.2D4 D5S2-D4 VanDerWaalsContact C-N 3.31Å; S2-D5 PolarHBondContact N-OD2 3.34Å; S2-D5 WeakPolarHBondContact O-CB 3.47Å; S2-D5 PolarHBondContact O-N 2.77Å; S2-D5 PolarHBondContact OG-OD2 2.8Å
3F89.3Confident90.5Very high169 Ų169115.2 Ų115.274%0.74158%0.578SS**SBendtrans-68.1-31.5175.7-72.6-69.7000112.8D5 T6F3-D5 PolarHBondContact O-N 3.25Å; F3-T6 VanDerWaalsContact O-CB 3.31Å; F3-T6 WeakPolarHBondContact O-CB 3.38Å; F3-T6 WeakPolarHBondContact O-CG2 3.31Å; F3-T6 PolarHBondContact O-N 2.77Å; F3-T6 PolarHBondContact O-OG1 3.42Å
4D90.8Very high90.8Very high137 Ų137112.4 Ų112.473%0.73356%0.561SS**G310 helixtrans-64.3-29176.4-57.9-21.3000111.5S2 T6S2-D4 VanDerWaalsContact C-N 3.31Å; D4-T6 PolarHBondContact O-N 3.04Å
5D89Confident91Very high61 Ų61112.4 Ų112.433%0.32658%0.576SS.*G310 helixtrans-69.2-15.2175.7-62.7-55.5000113.1M1 S2 F3 E7 R8M1-D5 HydrophobicContact CG-CB 3.94Å; S2-D5 PolarHBondContact N-OD2 3.34Å; S2-D5 WeakPolarHBondContact O-CB 3.47Å; S2-D5 PolarHBondContact O-N 2.77Å; S2-D5 PolarHBondContact OG-OD2 2.8Å; F3-D5 PolarHBondContact O-N 3.25Å; D5-E7 PolarHBondContact O-N 3.02Å; D5-R8 WeakPolarHBondContact O-CB 3.31Å; D5-R8 WeakPolarHBondContact O-CG 3.44Å; D5-R8 PolarHBondContact O-N 3.29Å
6T89.6Confident91Very high45 Ų45110.8 Ų110.828%0.27657%0.568SS.*G310 helixtrans-75.7-10.8-175.369.60000114.1F3 D4 R8 H42F3-T6 VanDerWaalsContact O-CB 3.31Å; F3-T6 WeakPolarHBondContact O-CB 3.38Å; F3-T6 WeakPolarHBondContact O-CG2 3.31Å; F3-T6 PolarHBondContact O-N 2.77Å; F3-T6 PolarHBondContact O-OG1 3.42Å; D4-T6 PolarHBondContact O-N 3.04Å; T6-R8 VanDerWaalsContact C-N 3.27Å; T6-H42 HydrophobicContact CG2-CB 4.29Å
7E88.4Confident91.1Very high178 Ų178110.5 Ų110.583%0.83257%0.568SS**G310 helixtrans-78.7-12.9173.9-60.4-171.4164.600112.7D5D5-E7 PolarHBondContact O-N 3.02Å
8R90.1Very high90.9Very high183 Ų183114.5 Ų114.569%0.69158%0.575SS**SBendtrans-76.8159.3178.7-55.9178.280.2149.14.1110.5D5 T6 P10D5-R8 WeakPolarHBondContact O-CB 3.31Å; D5-R8 WeakPolarHBondContact O-CG 3.44Å; D5-R8 PolarHBondContact O-N 3.29Å; T6-R8 VanDerWaalsContact C-N 3.27Å; R8-P10 WeakPolarHBondContact O-CD 3.47Å
9E92.4Very high90.8Very high189 Ų189111.5 Ų111.588%0.88356%0.561SS**PPolyproline II helixtrans-60.9121.1175.9-168.5-172.3176.600110.1
10P93.9Very high90.5Very high74 Ų74115 Ų11548%0.48158%0.58SS.*PPolyproline II helixtrans-76.2150.9176.231.9-34.9000110.8R8 Q12 T13R8-P10 WeakPolarHBondContact O-CD 3.47Å; P10-Q12 PolarHBondContact O-N 3.33Å; P10-T13 VanDerWaalsContact CG-OG1 3.22Å; P10-T13 WeakPolarHBondContact CG-OG1 3.34Å
11D94.5Very high90.4Very high100 Ų100114.3 Ų114.354%0.53558%0.582SS.*SBendtrans-58.2-33.2175.8-68.6-64.8000112.9F33D11-F33 HydrophobicContact CB-CE2 4.29Å; D11-F33 HydrophobicContact CB-CZ 3.97Å
12Q95.4Very high90.8Very high41 Ų41109.4 Ų109.419%0.19257%0.571CS.*  trans-157.4144.7175-170.9163.4-400111.8P10 F14 A27 T28 F33P10-Q12 PolarHBondContact O-N 3.33Å; Q12-F14 HydrophobicContact CG-CE1 3.96Å; Q12-F14 HydrophobicContact CG-CE2 4.08Å; Q12-F14 HydrophobicContact CG-CZ 3.68Å; Q12-F14 VanDerWaalsContact NE2-CZ 3.27Å; Q12-A27 PolarHBondContact NE2-O 2.64Å; Q12-T28 VanDerWaalsContact OE1-CA 3.28Å; Q12-F33 HydrophobicContact CB-CE2 3.87Å; Q12-F33 HydrophobicContact CB-CZ 4.13Å
13T95.4Very high90.8Very high108 Ų108114.4 Ų114.466%0.66359%0.588SS**  trans-121.7143.1174-54.70000110.2P10P10-T13 VanDerWaalsContact CG-OG1 3.22Å; P10-T13 WeakPolarHBondContact CG-OG1 3.34Å
14F94.6Very high90.9Very high76 Ų76110.3 Ų110.333%0.33357%0.573SS.*  trans-122.3136178.2-59.2-72.8000110.5Q12 L16 Y26 A27 T28Q12-F14 HydrophobicContact CG-CE1 3.96Å; Q12-F14 HydrophobicContact CG-CE2 4.08Å; Q12-F14 HydrophobicContact CG-CZ 3.68Å; Q12-F14 VanDerWaalsContact NE2-CZ 3.27Å; F14-L16 HydrophobicContact CB-CD2 3.89Å; F14-L16 PolarHBondContact O-N 3.05Å; F14-Y26 HydrophobicContact CB-CD1 4.33Å; F14-Y26 HydrophobicContact CD1-CD1 4.17Å; F14-Y26 HydrophobicContact CD1-CG 4.29Å; F14-Y26 HydrophobicContact CG-CD1 4.48Å; F14-Y26 HydrophobicContact CG-CG 4.48Å; F14-A27 WeakPolarHBondContact CE1-O 3.35Å; F14-T28 HydrophobicContact CZ-CG2 4.24Å
15S93.4Very high91Very high113 Ų113109.6 Ų109.679%0.7957%0.565SS**  trans-87.6102.1163.7-64.30000107.9
16L92Very high91.3Very high87 Ų87110 Ų11046%0.45556%0.563SS.*PPolyproline II helixtrans-76.2146-177.4-56.5-179.5000111F14 Y26 F47F14-L16 HydrophobicContact CB-CD2 3.89Å; F14-L16 PolarHBondContact O-N 3.05Å; L16-Y26 WeakPolarHBondContact CA-OH 3.22Å; L16-Y26 HydrophobicContact CD2-CD1 4.27Å; L16-Y26 HydrophobicContact CD2-CD2 3.88Å; L16-Y26 HydrophobicContact CD2-CE1 3.94Å; L16-Y26 HydrophobicContact CD2-CE2 3.55Å; L16-Y26 HydrophobicContact CD2-CG 4.25Å; L16-F47 HydrophobicContact CB-CZ 4.23Å; L16-F47 WeakPolarHBondContact O-CE1 3.19Å; L16-F47 WeakPolarHBondContact O-CZ 3.2Å
17N91.6Very high91.5Very high106 Ų106111.6 Ų111.657%0.56758%0.581SS**PPolyproline II helixtrans-101.6157.9166.5-71.1-44.5000110.6D19 L24 Y26 F47N17-D19 PolarHBondContact O-N 3.05Å; N17-L24 HydrophobicContact CB-CD1 3.95Å; N17-Y26 PolarHBondContact N-OH 3.01Å; N17-F47 VanDerWaalsContact C-CZ 3.41Å
18R88.6Confident91.7Very high182 Ų182106.6 Ų106.669%0.68756%0.562SS**PPolyproline II helixtrans-65.7121.8175.1-69.1-177.7177.6-176.8-1.1109F47R18-F47 HydrophobicContact CG-CB 4.41Å; R18-F47 HydrophobicContact CG-CD1 3.79Å; R18-F47 HydrophobicContact CG-CD2 3.81Å; R18-F47 HydrophobicContact CG-CE1 3.92Å; R18-F47 HydrophobicContact CG-CE2 3.94Å; R18-F47 HydrophobicContact CG-CG 3.73Å; R18-F47 HydrophobicContact CG-CZ 4Å; R18-F47 PolarHBondContact NH2-O 3.01Å
19D88.1Confident91.9Very high57 Ų57103.7 Ų103.731%0.30556%0.555SS.*  trans-125.5113.3178-167.8-3.1000109.8N17 T21 G22 E23 L24N17-D19 PolarHBondContact O-N 3.05Å; D19-T21 PolarHBondContact OD1-N 3.07Å; D19-T21 VanDerWaalsContact OD1-N 3.08Å; D19-T21 PolarHBondContact OD1-OG1 3.29Å; D19-G22 VanDerWaalsContact CG-N 3.26Å; D19-G22 PolarHBondContact OD1-N 3.07Å; D19-G22 WeakPolarHBondContact OD2-CA 3.49Å; D19-G22 PolarHBondContact OD2-N 3.19Å; D19-E23 PolarHBondContact OD2-N 3.48Å; D19-L24 HydrophobicContact CB-CB 4.27Å; D19-L24 HydrophobicContact CB-CD1 3.81Å; D19-L24 HydrophobicContact CB-CG 4.37Å; D19-L24 WeakPolarHBondContact OD2-CB 3.07Å; D19-L24 PolarHBondContact OD2-N 3.26Å
20L85.4Confident91.7Very high181 Ų181101.4 Ų101.495%0.94855%0.547SS*.SBendtrans-94.5-20.2178.8-66.6167.8000111.9
21T89.3Confident91.6Very high102 Ų102102.7 Ų102.763%0.62656%0.558SS**SBendtrans-102.5-18.8-175520000112.4D19D19-T21 PolarHBondContact OD1-N 3.07Å; D19-T21 VanDerWaalsContact OD1-N 3.08Å; D19-T21 PolarHBondContact OD1-OG1 3.29Å
22G85.5Confident91.4Very high50 Ų50105.5 Ų105.552%0.51556%0.561SS.*SBendtrans79.225-179.900000113D19D19-G22 VanDerWaalsContact CG-N 3.26Å; D19-G22 PolarHBondContact OD1-N 3.07Å; D19-G22 WeakPolarHBondContact OD2-CA 3.49Å; D19-G22 PolarHBondContact OD2-N 3.19Å
23E88.8Confident91.3Very high163 Ų163106 Ų10676%0.76256%0.563SS**  trans-93.7-14.9-177-65.9-179.9163.200113.1D19 E25D19-E23 PolarHBondContact OD2-N 3.48Å; E23-E25 PolarHBondContact O-N 2.88Å
24L92.7Very high91Very high84 Ų84105.4 Ų105.444%0.4456%0.563SS.*  trans-77.4118-178.4-76.5168.5000111.3N17 D19 Y26N17-L24 HydrophobicContact CB-CD1 3.95Å; D19-L24 HydrophobicContact CB-CB 4.27Å; D19-L24 HydrophobicContact CB-CD1 3.81Å; D19-L24 HydrophobicContact CB-CG 4.37Å; D19-L24 WeakPolarHBondContact OD2-CB 3.07Å; D19-L24 PolarHBondContact OD2-N 3.26Å; L24-Y26 HydrophobicContact CB-CE2 4.22Å
25E92.8Very high90.7Very high121 Ų121106.5 Ų106.557%0.56557%0.573SS**  trans-105.2138.8176-172.6170.7171.200111.3E23 R60E23-E25 PolarHBondContact O-N 2.88Å; E25-R60 IonicContact OE2-CZ 3.66Å; E25-R60 IonicContact OE2-NH1 2.67Å; E25-R60 PolarHBondContact OE2-NH1 2.67Å
26Y94Very high90.5Very high69 Ų69104.2 Ų104.227%0.27155%0.553SS.*  trans-116.7114176.7-61.1-90000109.6F14 L16 N17 L24 T28F14-Y26 HydrophobicContact CB-CD1 4.33Å; F14-Y26 HydrophobicContact CD1-CD1 4.17Å; F14-Y26 HydrophobicContact CD1-CG 4.29Å; F14-Y26 HydrophobicContact CG-CD1 4.48Å; F14-Y26 HydrophobicContact CG-CG 4.48Å; L16-Y26 WeakPolarHBondContact CA-OH 3.22Å; L16-Y26 HydrophobicContact CD2-CD1 4.27Å; L16-Y26 HydrophobicContact CD2-CD2 3.88Å; L16-Y26 HydrophobicContact CD2-CE1 3.94Å; L16-Y26 HydrophobicContact CD2-CE2 3.55Å; L16-Y26 HydrophobicContact CD2-CG 4.25Å; N17-Y26 PolarHBondContact N-OH 3.01Å; L24-Y26 HydrophobicContact CB-CE2 4.22Å; Y26-T28 PolarHBondContact O-N 2.81Å
27A94Very high90.3Very high80 Ų80105.9 Ų105.966%0.66156%0.555SS**  trans-70129.4-177.800000112Q12 F14Q12-A27 PolarHBondContact NE2-O 2.64Å; F14-A27 WeakPolarHBondContact CE1-O 3.35Å
28T93.9Very high90.3Very high72 Ų72109.3 Ų109.344%0.44257%0.567SS.*  trans-83.8155.6172.962.60000111.2Q12 F14 Y26 I30 F33Q12-T28 VanDerWaalsContact OE1-CA 3.28Å; F14-T28 HydrophobicContact CZ-CG2 4.24Å; Y26-T28 PolarHBondContact O-N 2.81Å; T28-I30 PolarHBondContact O-N 3.3Å; T28-F33 HydrophobicContact CG2-CD2 4.36Å
29K93.2Very high90.5Very high122 Ų122104.4 Ų104.453%0.5355%0.554SS.*  trans-77109.3172.6-69.6177.1-177174.30109.2S31 R32 F33K29-S31 PolarHBondContact O-N 2.92Å; K29-S31 VanDerWaalsContact O-N 3.07Å; K29-R32 HydrophobicContact CB-CB 4.4Å; K29-R32 HydrophobicContact CB-CG 4.27Å; K29-R32 PolarHBondContact O-N 3.28Å; K29-F33 WeakPolarHBondContact O-CD2 3.4Å; K29-F33 PolarHBondContact O-N 3.22Å
30I89.4Confident90.8Very high141 Ų141104.8 Ų104.872%0.72356%0.561SS**Hα-helixtrans-50.3-40.6-178.3-60173.1000111.9T28 R32 F33 S34T28-I30 PolarHBondContact O-N 3.3Å; I30-R32 PolarHBondContact O-N 3.08Å; I30-R32 VanDerWaalsContact O-N 3.16Å; I30-F33 PolarHBondContact O-N 3.18Å; I30-S34 WeakPolarHBondContact O-CB 3.39Å; I30-S34 PolarHBondContact O-N 2.84Å
31S90.6Very high91.2Very high102 Ų102100.8 Ų100.871%0.71354%0.54SS*.Hα-helixtrans-62.9-20.6179.656.80000115.1K29K29-S31 PolarHBondContact O-N 2.92Å; K29-S31 VanDerWaalsContact O-N 3.07Å
32R90.9Very high91.4Very high158 Ų158100.3 Ų100.360%0.59653%0.53SS*.Hα-helixtrans-98.4-27.4177.2-63.6-64.8-178.1156.90.1112.4K29 I30K29-R32 HydrophobicContact CB-CB 4.4Å; K29-R32 HydrophobicContact CB-CG 4.27Å; K29-R32 PolarHBondContact O-N 3.28Å; I30-R32 PolarHBondContact O-N 3.08Å; I30-R32 VanDerWaalsContact O-N 3.16Å
33F92.8Very high91.8Very high52 Ų52101.5 Ų101.523%0.22852%0.524CS..Hα-helixtrans-114.221.2-172.3-65-89.9000113.8D11 Q12 T28 K29 I30 N35 V36 L39D11-F33 HydrophobicContact CB-CE2 4.29Å; D11-F33 HydrophobicContact CB-CZ 3.97Å; Q12-F33 HydrophobicContact CB-CE2 3.87Å; Q12-F33 HydrophobicContact CB-CZ 4.13Å; T28-F33 HydrophobicContact CG2-CD2 4.36Å; K29-F33 WeakPolarHBondContact O-CD2 3.4Å; K29-F33 PolarHBondContact O-N 3.22Å; I30-F33 PolarHBondContact O-N 3.18Å; F33-N35 PolarHBondContact O-N 3.16Å; F33-V36 HydrophobicContact CB-CG2 3.92Å; F33-V36 HydrophobicContact CD1-CG2 3.9Å; F33-V36 HydrophobicContact CG-CG2 4.37Å; F33-V36 WeakPolarHBondContact O-CG2 3.32Å; F33-L39 HydrophobicContact CE1-CD1 4.13Å
34S89.1Confident92Very high96 Ų9698.2 Ų98.267%0.67152%0.519SS*.THydrogen-bonded Turntrans-75.8-18-177.359.70000115I30I30-S34 WeakPolarHBondContact O-CB 3.39Å; I30-S34 PolarHBondContact O-N 2.84Å
35N87.9Confident92Very high99 Ų99102.9 Ų102.953%0.52954%0.536SS..THydrogen-bonded Turntrans-142.363.1-176.8-168.224.4000111.6F33 Y37F33-N35 PolarHBondContact O-N 3.16Å; N35-Y37 WeakPolarHBondContact OD1-CE2 3.11Å
36V89.6Confident92Very high64 Ų6499.8 Ų99.839%0.38852%0.523SS..  trans-95.9113.7-171.9-177.50000110.4F33 L39F33-V36 HydrophobicContact CB-CG2 3.92Å; F33-V36 HydrophobicContact CD1-CG2 3.9Å; F33-V36 HydrophobicContact CG-CG2 4.37Å; F33-V36 WeakPolarHBondContact O-CG2 3.32Å; V36-L39 HydrophobicContact CG1-CB 4.18Å
37Y89.2Confident92Very high123 Ų123101.4 Ų101.448%0.48253%0.531SS..SBendtrans-100.8-25.9170-68.6-84.9000112.7N35N35-Y37 WeakPolarHBondContact OD1-CE2 3.11Å
38H91.1Very high91.9Very high178 Ų178101.3 Ų101.382%0.82454%0.539SS*.  trans-134.5125.7179.5-58.5-68.8000108.5
39L92.3Very high91.8Very high79 Ų79100.7 Ų100.741%0.41454%0.54SS..  trans-116.1135.1176.1-179.864000108.9F33 V36 I41 L59F33-L39 HydrophobicContact CE1-CD1 4.13Å; V36-L39 HydrophobicContact CG1-CB 4.18Å; L39-I41 HydrophobicContact CD2-CD1 4.21Å; L39-I41 HydrophobicContact CD2-CG1 4.37Å; L39-I41 HydrophobicContact CG-CG1 4.23Å; L39-L59 HydrophobicContact CD2-CD1 3.68Å; L39-L59 HydrophobicContact CD2-CD2 3.8Å; L39-L59 HydrophobicContact CD2-CG 4.42Å
40S94.1Very high91.8Very high64 Ų64103 Ų10345%0.44856%0.559SS.*  trans-129131.9172.4-63.10000108.9M1M1-S40 WeakPolarHBondContact SD-CB 3.36Å
41I94.1Very high91.9Very high98 Ų98101 Ų10150%0.50355%0.553SS.*  trans-118.6119.4-177.4-59.9173.1000107.3L39 I43 I57L39-I41 HydrophobicContact CD2-CD1 4.21Å; L39-I41 HydrophobicContact CD2-CG1 4.37Å; L39-I41 HydrophobicContact CG-CG1 4.23Å; I41-I43 HydrophobicContact CG2-CG1 4.42Å; I41-I57 HydrophobicContact CD1-CD1 4.25Å; I41-I57 HydrophobicContact CD1-CG2 4.1Å
42H94.6Very high92Very high92 Ų9299.5 Ų99.543%0.42654%0.54SS..  trans-108123.7176.5179.4-136.7000110.3T6T6-H42 HydrophobicContact CG2-CB 4.29Å
43I93.4Very high92Very high74 Ų7499.6 Ų99.638%0.37955%0.545SS..  trans-105.798.1177.1-56.3171.9000108.2I41 T52 V54I41-I43 HydrophobicContact CG2-CG1 4.42Å; I43-T52 HydrophobicContact CG2-CG2 4.2Å; I43-V54 HydrophobicContact CD1-CG2 3.6Å
44S92.4Very high91.9Very high94 Ų94100.9 Ų100.966%0.65756%0.557SS**  trans-82.6-27.4-172.758.60000114.1
45K92.5Very high91.9Very high183 Ų183105.5 Ų105.580%0.79657%0.565SS**  trans-147.1161.5-177-66.7-174.6-178.9177.90111.1
46N93.6Very high92Very high56 Ų56109.3 Ų109.330%0.29957%0.573SS.*  trans-132.1-172.5175.970.228.3000111.2G48 A49 T52N46-G48 PolarHBondContact O-N 2.88Å; N46-G48 VanDerWaalsContact O-N 3.07Å; N46-G48 PolarHBondContact OD1-N 3.05Å; N46-A49 VanDerWaalsContact CG-O 3.31Å; N46-A49 PolarHBondContact ND2-O 2.86Å; N46-A49 PolarHBondContact OD1-N 3.07Å; N46-A49 PolarHBondContact OD1-O 3.48Å; N46-T52 HydrophobicContact CB-CG2 4.37Å; N46-T52 VanDerWaalsContact CB-OG1 3.31Å; N46-T52 WeakPolarHBondContact CB-OG1 3.41Å; N46-T52 PolarHBondContact ND2-OG1 3.16Å
47F92.9Very high92.1Very high102 Ų102110.7 Ų110.745%0.44758%0.577SS.*SBendtrans-83.837.4-175-55.6-84.4000114.7L16 N17 R18L16-F47 HydrophobicContact CB-CZ 4.23Å; L16-F47 WeakPolarHBondContact O-CE1 3.19Å; L16-F47 WeakPolarHBondContact O-CZ 3.2Å; N17-F47 VanDerWaalsContact C-CZ 3.41Å; R18-F47 HydrophobicContact CG-CB 4.41Å; R18-F47 HydrophobicContact CG-CD1 3.79Å; R18-F47 HydrophobicContact CG-CD2 3.81Å; R18-F47 HydrophobicContact CG-CE1 3.92Å; R18-F47 HydrophobicContact CG-CE2 3.94Å; R18-F47 HydrophobicContact CG-CG 3.73Å; R18-F47 HydrophobicContact CG-CZ 4Å; R18-F47 PolarHBondContact NH2-O 3.01Å
48G91.4Very high92.3Very high79 Ų79106.8 Ų106.881%0.81458%0.575SS**SBendtrans88.322.3174.900000115.2N46N46-G48 PolarHBondContact O-N 2.88Å; N46-G48 VanDerWaalsContact O-N 3.07Å; N46-G48 PolarHBondContact OD1-N 3.05Å
49A91.8Very high92.3Very high58 Ų58104.3 Ų104.348%0.47957%0.567SS.*  trans-106.6157.6176.700000111N46 T51N46-A49 VanDerWaalsContact CG-O 3.31Å; N46-A49 PolarHBondContact ND2-O 2.86Å; N46-A49 PolarHBondContact OD1-N 3.07Å; N46-A49 PolarHBondContact OD1-O 3.48Å; A49-T51 VanDerWaalsContact C-N 3.3Å; A49-T51 PolarHBondContact O-N 3.47Å
50D93.4Very high92.2Very high172 Ų172110.3 Ų110.392%0.9258%0.584SS**SBendtrans-69.2-30.8179.3-60.1-32.9000112.7
51T92.4Very high92Very high97 Ų97110.6 Ų110.660%0.59560%0.597SS**SBendtrans-128.5134-177.462.30000111.3A49A49-T51 VanDerWaalsContact C-N 3.3Å; A49-T51 PolarHBondContact O-N 3.47Å
52T92.5Very high91.7Very high72 Ų72115 Ų11544%0.44262%0.616SS.*  trans-88.2126.8171.3-50.60000109.9I43 N46 V54I43-T52 HydrophobicContact CG2-CG2 4.2Å; N46-T52 HydrophobicContact CB-CG2 4.37Å; N46-T52 VanDerWaalsContact CB-OG1 3.31Å; N46-T52 WeakPolarHBondContact CB-OG1 3.41Å; N46-T52 PolarHBondContact ND2-OG1 3.16Å; T52-V54 HydrophobicContact CG2-CG2 4.24Å
53K90.5Very high91.2Very high160 Ų160119.3 Ų119.370%0.69663%0.628SS**  trans-112.5122.7172.5-65.9-178.8-177.9177.90109F55K53-F55 HydrophobicContact CB-CE2 4.21Å; K53-F55 HydrophobicContact CB-CZ 4.43Å
54V90.1Very high90.6Very high79 Ų79121.5 Ų121.548%0.47965%0.645SS.*  trans-110.9116.2176.2-176.40000107.6I43 T52 I57I43-V54 HydrophobicContact CD1-CG2 3.6Å; T52-V54 HydrophobicContact CG2-CG2 4.24Å; V54-I57 HydrophobicContact CG1-CD1 4.01Å; V54-I57 HydrophobicContact CG1-CG1 3.68Å
55F90.6Very high89.9Confident193 Ų193123.3 Ų123.385%0.84664%0.643SS**  trans-88.2-37.1-179.4-66.3-84.1000112K53K53-F55 HydrophobicContact CB-CE2 4.21Å; K53-F55 HydrophobicContact CB-CZ 4.43Å
56Y89.9Confident88.7Confident178 Ų178119.5 Ų119.570%0.69863%0.631SS**  trans-150.9142.7-175-178.4-108.1000111.5
57I91.9Very high87.4Confident93 Ų93126.3 Ų126.348%0.47765%0.653SS.*  trans-130.5111.7168.8-60.9178000106.8I41 V54 L59I41-I57 HydrophobicContact CD1-CD1 4.25Å; I41-I57 HydrophobicContact CD1-CG2 4.1Å; V54-I57 HydrophobicContact CG1-CD1 4.01Å; V54-I57 HydrophobicContact CG1-CG1 3.68Å; I57-L59 HydrophobicContact CG2-CD2 4.07Å
58G92Very high85.9Confident42 Ų42131.5 Ų131.543%0.43367%0.669SS.*  trans-92.7124.3173.200000110.7
59L92.7Very high84.3Confident126 Ų126134.5 Ų134.566%0.6666%0.662SS**  trans-103.8120.6170.9-57.4179.6000108.6L39 I57L39-L59 HydrophobicContact CD2-CD1 3.68Å; L39-L59 HydrophobicContact CD2-CD2 3.8Å; L39-L59 HydrophobicContact CD2-CG 4.42Å; I57-L59 HydrophobicContact CG2-CD2 4.07Å
60R90.3Very high82.4Confident205 Ų205140.6 Ų140.677%0.77468%0.68SS**  trans-109.4133.2175.7-72.3-173.1171.9165.5-1.2110E25E25-R60 IonicContact OE2-CZ 3.66Å; E25-R60 IonicContact OE2-NH1 2.67Å; E25-R60 PolarHBondContact OE2-NH1 2.67Å
61G88.8Confident80.4Confident70 Ų70138.1 Ų138.172%0.72267%0.671SS**  trans169.7165.9178.300000110.8
62E87.6Confident78.4Confident191 Ų191138.2 Ų138.289%0.89367%0.671SS**  trans-96.3136.2171.9-63.4-61145.300108.6
63W83.5Confident76.7Confident182 Ų182140.8 Ų140.869%0.68968%0.681SS**  trans-110.4130.8171.4-179.386.9000109.4E65W63-E65 HydrophobicContact CH2-CB 3.52Å; W63-E65 HydrophobicContact CH2-CG 4Å; W63-E65 HydrophobicContact CZ2-CB 4.1Å; W63-E65 HydrophobicContact CZ2-CG 4.41Å; W63-E65 HydrophobicContact CZ3-CB 3.98Å
64T81.4Confident74.8Confident119 Ų119138.2 Ų138.273%0.7368%0.682SS**  trans-126.1132.3172.8-56.60000108.3L66T64-L66 PolarHBondContact O-N 3.38Å; T64-L66 VanDerWaalsContact O-N 3.16Å
65E78.9Confident73.3Confident133 Ų133140.2 Ų140.262%0.62169%0.69SS**  trans-63.1118173.1-168.9172.8-161.700109.7W63 R67W63-E65 HydrophobicContact CH2-CB 3.52Å; W63-E65 HydrophobicContact CH2-CG 4Å; W63-E65 HydrophobicContact CZ2-CB 4.1Å; W63-E65 HydrophobicContact CZ2-CG 4.41Å; W63-E65 HydrophobicContact CZ3-CB 3.98Å; E65-R67 VanDerWaalsContact C-N 3.34Å; E65-R67 PolarHBondContact O-N 2.75Å
66L66.4Low71.3Confident102 Ų102141.1 Ų141.153%0.53469%0.69SS.*  trans-70.895.4172.1-163.377.7000107.7T64 R68T64-L66 PolarHBondContact O-N 3.38Å; T64-L66 VanDerWaalsContact O-N 3.16Å; L66-R68 VanDerWaalsContact C-N 3.28Å; L66-R68 PolarHBondContact O-N 3.39Å
67R66.6Low69.9Low200 Ų200140.8 Ų140.876%0.75569%0.694SS**  trans-62.293.2172.1-64.3-170.4-167.3177.35.3108.3E65 H69E65-R67 VanDerWaalsContact C-N 3.34Å; E65-R67 PolarHBondContact O-N 2.75Å; R67-H69 PolarHBondContact O-N 3.3Å
68R60.7Low68.3Low210 Ų210140.2 Ų140.279%0.79270%0.704SS**  trans-63.292.4160.7-66.4-175.2-178.5-175.61.3105L66 E70L66-R68 VanDerWaalsContact C-N 3.28Å; L66-R68 PolarHBondContact O-N 3.39Å; R68-E70 PolarHBondContact O-N 2.88Å
69H59.1Low66.8Low143 Ų143143.1 Ų143.166%0.66272%0.718SS**  trans-57.1103.7162.2-87.268000104.6R67 V71R67-H69 PolarHBondContact O-N 3.3Å; H69-V71 VanDerWaalsContact C-N 3.33Å; H69-V71 PolarHBondContact O-N 2.83Å
70E50.8Low65.3Low186 Ų186140.8 Ų140.887%0.86972%0.716SS**SBendtrans-50.8108.2165.2-70.7-177.8153.800105.5R68 T72R68-E70 PolarHBondContact O-N 2.88Å; E70-T72 PolarHBondContact O-N 2.91Å
71V52.6Low64.1Low119 Ų119135.3 Ų135.372%0.72170%0.702SS**  trans24.393.7173.3-1730000112.3H69 I73H69-V71 VanDerWaalsContact C-N 3.33Å; H69-V71 PolarHBondContact O-N 2.83Å; V71-I73 VanDerWaalsContact C-N 3.28Å; V71-I73 HydrophobicContact CG1-CG1 4.43Å; V71-I73 PolarHBondContact O-N 2.79Å
72T49.6Very low62.8Low99 Ų99137.3 Ų137.361%0.60770%0.702SS**  trans-51.9104.1159.7-55.30000106.2E70 C74E70-T72 PolarHBondContact O-N 2.91Å; T72-C74 PolarHBondContact O-N 3Å
73I57Low61.7Low126 Ų126132.1 Ų132.165%0.64669%0.692SS**  trans-69.188.3177.9-61.8-179.4000105.4V71 N75V71-I73 VanDerWaalsContact C-N 3.28Å; V71-I73 HydrophobicContact CG1-CG1 4.43Å; V71-I73 PolarHBondContact O-N 2.79Å; I73-N75 HydrophobicContact CG2-CB 3.67Å; I73-N75 PolarHBondContact O-N 2.77Å
74C49.7Very low60.7Low107 Ų107129.6 Ų129.672%0.72369%0.692SS**  trans-77.949.6168.6-61.20000109.2T72 Y76T72-C74 PolarHBondContact O-N 3Å; C74-Y76 PolarHBondContact O-N 2.99Å
75N58.6Low59.9Low121 Ų121130.2 Ų130.265%0.64769%0.687SS**  trans-80.773.5169.5-74.41.6000107.8I73 E77 A78I73-N75 HydrophobicContact CG2-CB 3.67Å; I73-N75 PolarHBondContact O-N 2.77Å; N75-E77 VanDerWaalsContact C-N 3.32Å; N75-A78 HydrophobicContact CB-CB 4.18Å
76Y49.9Very low59Low212 Ų212135.1 Ų135.183%0.83170%0.699SS**SBendtrans-82.2-8.2173.3-168.3-107.5000113.1C74C74-Y76 PolarHBondContact O-N 2.99Å
77E59Low58.8Low170 Ų170136.3 Ų136.379%0.79471%0.711SS**SBendtrans-141.517-174-61-176.8-17400114.8N75 S79N75-E77 VanDerWaalsContact C-N 3.32Å; E77-S79 PolarHBondContact O-N 3.17Å
78A58.6Low58.3Low82 Ų82135 Ų13568%0.67871%0.713SS**SBendtrans-72.9-7-176.200000114.4N75N75-A78 HydrophobicContact CB-CB 4.18Å
79S60.7Low58.1Low103 Ų103133.3 Ų133.372%0.7271%0.714SS**SBendtrans-134.1127.3178.944.10000110.3E77 N81E77-S79 PolarHBondContact O-N 3.17Å; S79-N81 PolarHBondContact O-N 3.31Å
80A60.7Low58Low76 Ų76132.9 Ų132.963%0.62872%0.721SS**  trans-55.1127.8177.500000110.5P82A80-P82 VanDerWaalsContact O-CD 3.28Å; A80-P82 WeakPolarHBondContact O-CD 3.28Å
81N66.9Low57.8Low91 Ų91129.2 Ų129.249%0.48771%0.712SS.*  trans-70.1117174.6-176.22.2000109.3S79 A83 D84S79-N81 PolarHBondContact O-N 3.31Å; N81-A83 PolarHBondContact O-N 3.15Å; N81-A83 WeakPolarHBondContact OD1-CB 3.41Å; N81-A83 PolarHBondContact OD1-N 3.07Å; N81-A83 VanDerWaalsContact OD1-N 3.15Å; N81-D84 PolarHBondContact O-N 3.05Å
82P61Low57.8Low111 Ų111128.5 Ų128.572%0.72171%0.71SS**THydrogen-bonded Turntrans-60.4-19.7179.1-21.332.8000113.5A80A80-P82 VanDerWaalsContact O-CD 3.28Å; A80-P82 WeakPolarHBondContact O-CD 3.28Å
83A64Low57.7Low82 Ų82131.6 Ų131.668%0.67872%0.717SS**THydrogen-bonded Turntrans-73.8-22.7176.800000113.8N81N81-A83 PolarHBondContact O-N 3.15Å; N81-A83 WeakPolarHBondContact OD1-CB 3.41Å; N81-A83 PolarHBondContact OD1-N 3.07Å; N81-A83 VanDerWaalsContact OD1-N 3.15Å
84D63.1Low57.6Low129 Ų129130.8 Ų130.869%0.6972%0.718SS**THydrogen-bonded Turntrans-84.7-16.7-179.7-89.3-20.6000113.4N81 R86N81-D84 PolarHBondContact O-N 3.05Å; D84-R86 PolarHBondContact O-N 3.17Å
85H63.5Low57.5Low133 Ų133133.3 Ų133.362%0.61672%0.719SS**SBendtrans-96.199.9176.8-71.2145.2000111V87H85-V87 PolarHBondContact O-N 2.95Å
86R60.1Low57Low235 Ų235136.7 Ų136.789%0.88773%0.728SS**  trans-64.8103.4171.3-66.3-176.2-178.5-179.71110.2D84 H88D84-R86 PolarHBondContact O-N 3.17Å; R86-H88 PolarHBondContact O-N 3.01Å; R86-H88 VanDerWaalsContact O-N 3.17Å
87V63Low56.6Low128 Ų128134.6 Ų134.678%0.77673%0.73SS**  trans-68.5110.2168.6-170.90000107.6H85 Q89H85-V87 PolarHBondContact O-N 2.95Å; V87-Q89 PolarHBondContact O-N 3.5Å
88H55.8Low55.8Low172 Ų172135.2 Ų135.280%0.79675%0.753SS**  trans-64.4100.3168.2-95.366.1000108.1R86 V90R86-H88 PolarHBondContact O-N 3.01Å; R86-H88 VanDerWaalsContact O-N 3.17Å; H88-V90 PolarHBondContact O-N 3.37Å
89Q55.4Low55.7Low174 Ų174137.9 Ų137.981%0.81376%0.756SS**  trans-67.6102.7168.7-77.8-174.7-26.200108.3V87 T91V87-Q89 PolarHBondContact O-N 3.5Å; Q89-T91 PolarHBondContact O-N 3.05Å
90V57.2Low55.4Low134 Ų134139.7 Ų139.781%0.81276%0.758SS**  trans-76.2100.6164.6-179.60000106.8H88H88-V90 PolarHBondContact O-N 3.37Å
91T48.4Very low55.1Low110 Ų110143.2 Ų143.268%0.67577%0.766SS**  trans-78.8122170.4-37.90000108.5Q89 Q93Q89-T91 PolarHBondContact O-N 3.05Å; T91-Q93 PolarHBondContact O-N 3.32Å
92P51.8Low54.5Low104 Ų104146.3 Ų146.368%0.67578%0.782SS**  trans-73119.4171.522.9-18.7000108.5T94P92-T94 PolarHBondContact O-N 3.15Å; P92-T94 VanDerWaalsContact O-N 3.15Å
93Q48.2Very low54Low163 Ų163148.5 Ų148.576%0.76279%0.786SS**  trans-73.1102.9172.7-71.3-164.4-12.200109.4T91 H95T91-Q93 PolarHBondContact O-N 3.32Å; Q93-H95 PolarHBondContact O-N 3.22Å
94T54.6Low53.4Low110 Ų110152.9 Ų152.968%0.67579%0.793SS**  trans-83.9100.4170.2-26.40000108.5P92 F96P92-T94 PolarHBondContact O-N 3.15Å; P92-T94 VanDerWaalsContact O-N 3.15Å; T94-F96 HydrophobicContact CG2-CD2 4.13Å; T94-F96 HydrophobicContact CG2-CE2 3.81Å; T94-F96 PolarHBondContact O-N 3.29Å
95H47Very low52.7Low159 Ų159154.6 Ų154.674%0.73680%0.8SS**  trans-72.9108.8167.9-74.7-73.8000109.3Q93Q93-H95 PolarHBondContact O-N 3.22Å
96F47.1Very low51.9Low193 Ų193156.3 Ų156.385%0.84682%0.815SS**  trans-93.5121.5162.1-88.5-86.6000108.8T94T94-F96 HydrophobicContact CG2-CD2 4.13Å; T94-F96 HydrophobicContact CG2-CE2 3.81Å; T94-F96 PolarHBondContact O-N 3.29Å
97I42.3Very low51.2Low167 Ų167149.8 Ų149.886%0.85681%0.809SS**  trans-100.5123.8170.3-59.9171000107.3
98S43.2Very low50.1Low183 Ų183151.7 Ų151.7100%1.2881%0.812SS**  trans-1590141.3-179.90000109.7

Retrieved 98 of 98 residues in 43.9 ms (Link to these results)