A0A077Z7Y4_TRITR Loading...

DUF4512 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7Y4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 72 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
1M76.6Confident88.2Confident239 Ų239107.8 Ų107.8100%1.17760%0.603SS**  0103.20-67.5-178.3177.800107.5
2V81.7Confident88.6Confident117 Ų117103.6 Ų103.671%0.70959%0.592SS**  trans-77.6125.3172.7-179.70000106.6L4 I7V2-L4 PolarHBondContact O-N 2.95Å; V2-I7 HydrophobicContact CG1-CD1 3.62Å; V2-I7 HydrophobicContact CG1-CG1 4.14Å
3C83.7Confident88.9Confident71 Ų71102.8 Ų102.848%0.4858%0.584SS.*  trans-64.1103.8176-65.50000108P5 C6 I7C3-P5 HydrophobicContact CB-CG 4.27Å; C3-C6 HydrophobicContact CB-CB 3.64Å; C3-C6 WeakPolarHBondContact CB-SG 3.1Å; C3-C6 WeakPolarHBondContact O-CA 3.44Å; C3-C6 VanDerWaalsContact O-CB 3.3Å; C3-C6 WeakPolarHBondContact O-CB 3.25Å; C3-C6 PolarHBondContact O-N 3.11Å; C3-I7 PolarHBondContact O-N 3.27Å
4L85.8Confident89.2Confident128 Ų128103.1 Ų103.167%0.6758%0.581SS**Hα-helixtrans-46.1-44.1169.2-148.877000112.3V2 C6 I7 L8V2-L4 PolarHBondContact O-N 2.95Å; L4-C6 VanDerWaalsContact C-N 3.26Å; L4-C6 PolarHBondContact O-N 2.83Å; L4-I7 PolarHBondContact O-N 2.92Å; L4-L8 HydrophobicContact CG-CD1 4.37Å; L4-L8 WeakPolarHBondContact O-CG 2.71Å; L4-L8 PolarHBondContact O-N 3.41Å
5P87.1Confident89.4Confident85 Ų85100.7 Ų100.755%0.55257%0.57SS**Hα-helixtrans-63.4-27.4173.923.7-34.7000113.8C3 I7 L8 L9C3-P5 HydrophobicContact CB-CG 4.27Å; P5-I7 VanDerWaalsContact C-N 3.34Å; P5-I7 PolarHBondContact O-N 3.15Å; P5-L8 PolarHBondContact O-N 3.23Å; P5-L9 WeakPolarHBondContact O-CB 3.29Å; P5-L9 PolarHBondContact O-N 3.07Å
6C90.8Very high89.4Confident84 Ų84101.9 Ų101.957%0.56856%0.564SS**Hα-helixtrans-72.1-25.3177.9-67.10000113.5C3 L4 P10C3-C6 HydrophobicContact CB-CB 3.64Å; C3-C6 WeakPolarHBondContact CB-SG 3.1Å; C3-C6 WeakPolarHBondContact O-CA 3.44Å; C3-C6 VanDerWaalsContact O-CB 3.3Å; C3-C6 WeakPolarHBondContact O-CB 3.25Å; C3-C6 PolarHBondContact O-N 3.11Å; L4-C6 VanDerWaalsContact C-N 3.26Å; L4-C6 PolarHBondContact O-N 2.83Å; C6-P10 WeakPolarHBondContact O-CD 3.2Å; C6-P10 WeakPolarHBondContact O-CG 3.13Å
7I90.4Very high89.3Confident92 Ų92101 Ų10147%0.47256%0.557SS.*Hα-helixtrans-86.9-35.6171.9-60176.8000110.2V2 C3 L4 P5 P10 I11V2-I7 HydrophobicContact CG1-CD1 3.62Å; V2-I7 HydrophobicContact CG1-CG1 4.14Å; C3-I7 PolarHBondContact O-N 3.27Å; L4-I7 PolarHBondContact O-N 2.92Å; P5-I7 VanDerWaalsContact C-N 3.34Å; P5-I7 PolarHBondContact O-N 3.15Å; I7-P10 VanDerWaalsContact O-CD 3.22Å; I7-P10 WeakPolarHBondContact O-CD 3.47Å; I7-P10 VanDerWaalsContact O-CG 3.26Å; I7-P10 WeakPolarHBondContact O-CG 3.31Å; I7-I11 HydrophobicContact CG2-CD1 3.68Å; I7-I11 WeakPolarHBondContact O-CD1 3.35Å; I7-I11 VanDerWaalsContact O-CG1 3.27Å; I7-I11 WeakPolarHBondContact O-CG1 3.5Å; I7-I11 PolarHBondContact O-N 3.02Å
8L92.1Very high89.1Confident101 Ų101104.4 Ų104.453%0.52957%0.566SS.*Hα-helixtrans-65.7-38.5177.3-76.4167000112.5L4 P5 I11 A12L4-L8 HydrophobicContact CG-CD1 4.37Å; L4-L8 WeakPolarHBondContact O-CG 2.71Å; L4-L8 PolarHBondContact O-N 3.41Å; P5-L8 PolarHBondContact O-N 3.23Å; L8-I11 PolarHBondContact O-N 2.77Å; L8-A12 WeakPolarHBondContact O-CB 3.44Å; L8-A12 PolarHBondContact O-N 3.28Å
9L93.3Very high88.9Confident117 Ų117103.5 Ų103.561%0.61356%0.559SS**Hα-helixtrans-56.4-54.4-179.8-140.791.7000113.3P5 I11 A12 L13P5-L9 WeakPolarHBondContact O-CB 3.29Å; P5-L9 PolarHBondContact O-N 3.07Å; L9-I11 PolarHBondContact O-N 3.41Å; L9-A12 PolarHBondContact O-N 2.99Å; L9-L13 WeakPolarHBondContact O-CB 3.25Å; L9-L13 PolarHBondContact O-N 2.78Å
10P94.3Very high88.7Confident62 Ų62101.5 Ų101.540%0.40355%0.547SS..Hα-helixtrans-66.1-37.4-179.925.3-34.5000112C6 I7 L13 I14C6-P10 WeakPolarHBondContact O-CD 3.2Å; C6-P10 WeakPolarHBondContact O-CG 3.13Å; I7-P10 VanDerWaalsContact O-CD 3.22Å; I7-P10 WeakPolarHBondContact O-CD 3.47Å; I7-P10 VanDerWaalsContact O-CG 3.26Å; I7-P10 WeakPolarHBondContact O-CG 3.31Å; P10-L13 PolarHBondContact O-N 3.34Å; P10-I14 WeakPolarHBondContact O-CD1 3.24Å; P10-I14 VanDerWaalsContact O-CG1 3.25Å; P10-I14 WeakPolarHBondContact O-CG1 3.42Å; P10-I14 PolarHBondContact O-N 3.15Å
11I94.5Very high88.4Confident90 Ų90101.8 Ų101.846%0.46255%0.546SS..Hα-helixtrans-64.8-46.6177.4-64.2173.6000110.3I7 L8 L9 L13 I14 V15I7-I11 HydrophobicContact CG2-CD1 3.68Å; I7-I11 WeakPolarHBondContact O-CD1 3.35Å; I7-I11 VanDerWaalsContact O-CG1 3.27Å; I7-I11 WeakPolarHBondContact O-CG1 3.5Å; I7-I11 PolarHBondContact O-N 3.02Å; L8-I11 PolarHBondContact O-N 2.77Å; L9-I11 PolarHBondContact O-N 3.41Å; I11-L13 VanDerWaalsContact C-N 3.32Å; I11-L13 PolarHBondContact O-N 2.9Å; I11-I14 PolarHBondContact O-N 3.4Å; I11-V15 HydrophobicContact CG2-CG2 4.41Å; I11-V15 WeakPolarHBondContact O-CB 3.38Å; I11-V15 VanDerWaalsContact O-CG2 3.3Å; I11-V15 WeakPolarHBondContact O-CG2 3.46Å; I11-V15 PolarHBondContact O-N 2.78Å
12A92.8Very high88.6Confident57 Ų5793.9 Ų93.947%0.47151%0.512SS..Hα-helixtrans-61.9-39.9177.400000111.6L8 L9 V15 Y16L8-A12 WeakPolarHBondContact O-CB 3.44Å; L8-A12 PolarHBondContact O-N 3.28Å; L9-A12 PolarHBondContact O-N 2.99Å; A12-V15 PolarHBondContact O-N 3.42Å; A12-Y16 WeakPolarHBondContact O-CB 3.3Å; A12-Y16 PolarHBondContact O-N 3.34Å
13L92Very high88.6Confident93 Ų9392.8 Ų92.849%0.48750%0.501SS..Hα-helixtrans-61.5-45.5174-92.1157.8000112.2L9 P10 I11 Y16 L17L9-L13 WeakPolarHBondContact O-CB 3.25Å; L9-L13 PolarHBondContact O-N 2.78Å; P10-L13 PolarHBondContact O-N 3.34Å; I11-L13 VanDerWaalsContact C-N 3.32Å; I11-L13 PolarHBondContact O-N 2.9Å; L13-Y16 PolarHBondContact O-N 3.12Å; L13-L17 WeakPolarHBondContact O-CG 2.92Å; L13-L17 PolarHBondContact O-N 2.97Å
14I93.4Very high88.2Confident107 Ų10792.9 Ų92.955%0.54950%0.497SS..Hα-helixtrans-63.6-45.9178-68.5164.4000110.5P10 I11 Y16 L17 K18P10-I14 WeakPolarHBondContact O-CD1 3.24Å; P10-I14 VanDerWaalsContact O-CG1 3.25Å; P10-I14 WeakPolarHBondContact O-CG1 3.42Å; P10-I14 PolarHBondContact O-N 3.15Å; I11-I14 PolarHBondContact O-N 3.4Å; I14-Y16 VanDerWaalsContact C-N 3.32Å; I14-Y16 PolarHBondContact O-N 2.88Å; I14-L17 PolarHBondContact O-N 2.94Å; I14-K18 WeakPolarHBondContact O-CB 3.27Å; I14-K18 PolarHBondContact O-N 2.74Å
15V92.2Very high87.6Confident68 Ų6892 Ų9241%0.41249%0.493SS..Hα-helixtrans-61.2-43.6175.9167.50000110.3I11 A12 K18 I19I11-V15 HydrophobicContact CG2-CG2 4.41Å; I11-V15 WeakPolarHBondContact O-CB 3.38Å; I11-V15 VanDerWaalsContact O-CG2 3.3Å; I11-V15 WeakPolarHBondContact O-CG2 3.46Å; I11-V15 PolarHBondContact O-N 2.78Å; A12-V15 PolarHBondContact O-N 3.42Å; V15-K18 PolarHBondContact O-N 3.15Å; V15-I19 HydrophobicContact CG1-CD1 3.82Å; V15-I19 WeakPolarHBondContact O-CA 3.22Å; V15-I19 WeakPolarHBondContact O-CB 3.38Å; V15-I19 PolarHBondContact O-N 2.7Å
16Y89.1Confident87Confident119 Ų11995.7 Ų95.747%0.46750%0.504SS..Iπ-helixtrans-60.9-51177.8180-86.3000111.4A12 L13 I14 K18 I20 Q21A12-Y16 WeakPolarHBondContact O-CB 3.3Å; A12-Y16 PolarHBondContact O-N 3.34Å; L13-Y16 PolarHBondContact O-N 3.12Å; I14-Y16 VanDerWaalsContact C-N 3.32Å; I14-Y16 PolarHBondContact O-N 2.88Å; Y16-K18 PolarHBondContact O-N 2.72Å; Y16-I20 HydrophobicContact CD2-CB 4.03Å; Y16-I20 HydrophobicContact CD2-CD1 3.2Å; Y16-I20 HydrophobicContact CD2-CG1 4.15Å; Y16-I20 HydrophobicContact CD2-CG2 4.19Å; Y16-I20 HydrophobicContact CE2-CB 4.18Å; Y16-I20 HydrophobicContact CE2-CD1 3.76Å; Y16-I20 HydrophobicContact CE2-CG2 3.83Å; Y16-I20 HydrophobicContact CG-CB 4.3Å; Y16-I20 HydrophobicContact CG-CD1 3.98Å; Y16-I20 VanDerWaalsContact O-CA 3.27Å; Y16-I20 WeakPolarHBondContact O-CA 3.34Å; Y16-I20 WeakPolarHBondContact O-CB 3.35Å; Y16-I20 PolarHBondContact O-N 3.19Å; Y16-Q21 PolarHBondContact O-N 3.23Å
17L88Confident86Confident87 Ų8796.9 Ų96.946%0.45550%0.504SS..Iπ-helixtrans-66.1-41.1180-66.8173.7000111.8L13 I14 Q21L13-L17 WeakPolarHBondContact O-CG 2.92Å; L13-L17 PolarHBondContact O-N 2.97Å; I14-L17 PolarHBondContact O-N 2.94Å; L17-Q21 VanDerWaalsContact O-CB 3.24Å; L17-Q21 WeakPolarHBondContact O-CB 3.28Å; L17-Q21 WeakPolarHBondContact O-CG 3.35Å; L17-Q21 PolarHBondContact O-OE1 2.82Å
18K86.4Confident84.8Confident163 Ų16394.1 Ų94.171%0.70949%0.49SS*.Iπ-helixtrans-83.3-29.8-172.7-160.3175.8175.375.20113.9I14 V15 Y16 P22I14-K18 WeakPolarHBondContact O-CB 3.27Å; I14-K18 PolarHBondContact O-N 2.74Å; V15-K18 PolarHBondContact O-N 3.15Å; Y16-K18 PolarHBondContact O-N 2.72Å; K18-P22 VanDerWaalsContact O-CD 3.28Å; K18-P22 WeakPolarHBondContact O-CD 3.44Å; K18-P22 WeakPolarHBondContact O-CG 3.24Å
19I85.2Confident83.3Confident86 Ų8692.7 Ų92.744%0.44149%0.486SS..Iπ-helixtrans-107.1-48.5-177-64.3167.2000110.2V15 P22 L23V15-I19 HydrophobicContact CG1-CD1 3.82Å; V15-I19 WeakPolarHBondContact O-CA 3.22Å; V15-I19 WeakPolarHBondContact O-CB 3.38Å; V15-I19 PolarHBondContact O-N 2.7Å; I19-P22 VanDerWaalsContact O-CD 3.25Å; I19-P22 WeakPolarHBondContact O-CD 3.33Å; I19-P22 WeakPolarHBondContact O-CG 3.21Å; I19-L23 HydrophobicContact CG2-CD1 3.4Å; I19-L23 VanDerWaalsContact CG2-CD1 3.4Å; I19-L23 WeakPolarHBondContact O-CB 3.19Å; I19-L23 WeakPolarHBondContact O-CD1 3.44Å; I19-L23 PolarHBondContact O-N 2.9Å; I19-L23 VanDerWaalsContact O-N 3.09Å
20I84.3Confident81.9Confident63 Ų6390.1 Ų90.132%0.32348%0.482SS..Iπ-helixtrans-69.2-38.7-177.2-65.3166.8000110.2Y16 L23 L24Y16-I20 HydrophobicContact CD2-CB 4.03Å; Y16-I20 HydrophobicContact CD2-CD1 3.2Å; Y16-I20 HydrophobicContact CD2-CG1 4.15Å; Y16-I20 HydrophobicContact CD2-CG2 4.19Å; Y16-I20 HydrophobicContact CE2-CB 4.18Å; Y16-I20 HydrophobicContact CE2-CD1 3.76Å; Y16-I20 HydrophobicContact CE2-CG2 3.83Å; Y16-I20 HydrophobicContact CG-CB 4.3Å; Y16-I20 HydrophobicContact CG-CD1 3.98Å; Y16-I20 VanDerWaalsContact O-CA 3.27Å; Y16-I20 WeakPolarHBondContact O-CA 3.34Å; Y16-I20 WeakPolarHBondContact O-CB 3.35Å; Y16-I20 PolarHBondContact O-N 3.19Å; I20-L23 PolarHBondContact O-N 3.49Å; I20-L24 HydrophobicContact CG2-CB 4.13Å; I20-L24 HydrophobicContact CG2-CD1 4.27Å; I20-L24 HydrophobicContact CG2-CD2 4.41Å; I20-L24 WeakPolarHBondContact O-CA 3.13Å; I20-L24 WeakPolarHBondContact O-CB 3.25Å; I20-L24 PolarHBondContact O-N 2.99Å
21Q81.8Confident80.6Confident109 Ų10990.3 Ų90.351%0.50949%0.485SS..Hα-helixtrans-58.4-53.2176.6-68.8-174.4-35.500114.6Y16 L17 L24 L25Y16-Q21 PolarHBondContact O-N 3.23Å; L17-Q21 VanDerWaalsContact O-CB 3.24Å; L17-Q21 WeakPolarHBondContact O-CB 3.28Å; L17-Q21 WeakPolarHBondContact O-CG 3.35Å; L17-Q21 PolarHBondContact O-OE1 2.82Å; Q21-L24 PolarHBondContact O-N 2.68Å; Q21-L25 WeakPolarHBondContact O-CB 3.14Å; Q21-L25 VanDerWaalsContact O-CG 3.22Å; Q21-L25 WeakPolarHBondContact O-CG 3.13Å; Q21-L25 PolarHBondContact O-N 3.45Å
22P82.3Confident79.3Confident72 Ų7293.3 Ų93.347%0.46849%0.491SS..Hα-helixtrans-67.2-38.5179.525-33.5000112.5K18 I19 L25 M26K18-P22 VanDerWaalsContact O-CD 3.28Å; K18-P22 WeakPolarHBondContact O-CD 3.44Å; K18-P22 WeakPolarHBondContact O-CG 3.24Å; I19-P22 VanDerWaalsContact O-CD 3.25Å; I19-P22 WeakPolarHBondContact O-CD 3.33Å; I19-P22 WeakPolarHBondContact O-CG 3.21Å; P22-L25 PolarHBondContact O-N 3.09Å; P22-M26 VanDerWaalsContact O-CB 3.3Å; P22-M26 WeakPolarHBondContact O-CB 3.17Å; P22-M26 PolarHBondContact O-N 2.9Å
23L81.1Confident78.1Confident94 Ų9495.9 Ų95.949%0.49249%0.488SS..Hα-helixtrans-66.4-42.3174.9-94118.4000111.8I19 I20 L25 M26 I27I19-L23 HydrophobicContact CG2-CD1 3.4Å; I19-L23 VanDerWaalsContact CG2-CD1 3.4Å; I19-L23 WeakPolarHBondContact O-CB 3.19Å; I19-L23 WeakPolarHBondContact O-CD1 3.44Å; I19-L23 PolarHBondContact O-N 2.9Å; I19-L23 VanDerWaalsContact O-N 3.09Å; I20-L23 PolarHBondContact O-N 3.49Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.49Å; L23-M26 CarbonylContact O-C 3.46Å; L23-M26 PolarHBondContact O-N 3.47Å; L23-I27 WeakPolarHBondContact O-CA 3.3Å; L23-I27 WeakPolarHBondContact O-CB 3.37Å; L23-I27 PolarHBondContact O-N 3.45Å
24L75.3Confident77Confident73 Ų7393.5 Ų93.538%0.38248%0.479SS..Hα-helixtrans-66.4-38.9179.6-157.578.4000109.7I20 Q21 M26 L28I20-L24 HydrophobicContact CG2-CB 4.13Å; I20-L24 HydrophobicContact CG2-CD1 4.27Å; I20-L24 HydrophobicContact CG2-CD2 4.41Å; I20-L24 WeakPolarHBondContact O-CA 3.13Å; I20-L24 WeakPolarHBondContact O-CB 3.25Å; I20-L24 PolarHBondContact O-N 2.99Å; Q21-L24 PolarHBondContact O-N 2.68Å; L24-M26 VanDerWaalsContact C-N 3.33Å; L24-M26 PolarHBondContact O-N 3.41Å; L24-L28 HydrophobicContact CB-CD1 4.42Å; L24-L28 HydrophobicContact CD1-CD1 3.32Å; L24-L28 HydrophobicContact CD1-CD2 4.25Å; L24-L28 HydrophobicContact CD1-CG 4.39Å; L24-L28 HydrophobicContact CD2-CD2 4.35Å; L24-L28 HydrophobicContact CG-CD1 3.56Å; L24-L28 HydrophobicContact CG-CD2 3.86Å; L24-L28 HydrophobicContact CG-CG 4.25Å; L24-L28 WeakPolarHBondContact O-CA 3.42Å; L24-L28 WeakPolarHBondContact O-CB 3.22Å; L24-L28 PolarHBondContact O-N 3.28Å
25L73.5Confident76.1Confident111 Ų11195.8 Ų95.858%0.58149%0.485SS*.Hα-helixtrans-66.5-32.6173.5-70.8173.7000113Q21 P22 L23Q21-L25 WeakPolarHBondContact O-CB 3.14Å; Q21-L25 VanDerWaalsContact O-CG 3.22Å; Q21-L25 WeakPolarHBondContact O-CG 3.13Å; Q21-L25 PolarHBondContact O-N 3.45Å; P22-L25 PolarHBondContact O-N 3.09Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.49Å
26M74.4Confident75.4Confident162 Ų16295.7 Ų95.780%0.79849%0.485SS*.Hα-helixtrans-82.4-38.3178.4-173.6172.517200113P22 L23 L24P22-M26 VanDerWaalsContact O-CB 3.3Å; P22-M26 WeakPolarHBondContact O-CB 3.17Å; P22-M26 PolarHBondContact O-N 2.9Å; L23-M26 CarbonylContact O-C 3.46Å; L23-M26 PolarHBondContact O-N 3.47Å; L24-M26 VanDerWaalsContact C-N 3.33Å; L24-M26 PolarHBondContact O-N 3.41Å
27I69.6Low74.6Confident109 Ų10992 Ų9256%0.55947%0.473SS*.Hα-helixtrans-96.8-16.6-173.7-123.791.5000113.4L23 P29L23-I27 WeakPolarHBondContact O-CA 3.3Å; L23-I27 WeakPolarHBondContact O-CB 3.37Å; L23-I27 PolarHBondContact O-N 3.45Å; I27-P29 WeakPolarHBondContact O-CD 3.4Å
28L65Low74Confident34 Ų3489.8 Ų89.818%0.17847%0.471CS..SBendtrans-88.682.1161.6-81.254.1000107.3L24 W32L24-L28 HydrophobicContact CB-CD1 4.42Å; L24-L28 HydrophobicContact CD1-CD1 3.32Å; L24-L28 HydrophobicContact CD1-CD2 4.25Å; L24-L28 HydrophobicContact CD1-CG 4.39Å; L24-L28 HydrophobicContact CD2-CD2 4.35Å; L24-L28 HydrophobicContact CG-CD1 3.56Å; L24-L28 HydrophobicContact CG-CD2 3.86Å; L24-L28 HydrophobicContact CG-CG 4.25Å; L24-L28 WeakPolarHBondContact O-CA 3.42Å; L24-L28 WeakPolarHBondContact O-CB 3.22Å; L24-L28 PolarHBondContact O-N 3.28Å; L28-W32 HydrophobicContact CB-CB 4.22Å; L28-W32 HydrophobicContact CG-CB 3.9Å
29P61.1Low73.6Confident70 Ų7092 Ų9246%0.45548%0.476SS..  trans-56155.5159.628.7-33.2000107.9I27 S31 W32I27-P29 WeakPolarHBondContact O-CD 3.4Å; P29-S31 PolarHBondContact O-N 2.81Å; P29-W32 PolarHBondContact O-N 2.9Å
30A64.6Low73.2Confident63 Ų6392.8 Ų92.852%0.52148%0.48SS..Hα-helixtrans-45.4-27.3-17600000114W32 R33 S34A30-W32 PolarHBondContact O-N 3.27Å; A30-R33 PolarHBondContact O-N 2.76Å; A30-S34 PolarHBondContact O-N 3.4Å; A30-S34 VanDerWaalsContact O-N 3.07Å; A30-S34 PolarHBondContact O-OG 2.8Å; A30-S34 VanDerWaalsContact O-OG 3.11Å
31S66.7Low72.6Confident67 Ų6795.8 Ų95.847%0.46949%0.488SS..Hα-helixtrans-59.4-36175.963.20000115.1P29 K35P29-S31 PolarHBondContact O-N 2.81Å; S31-K35 WeakPolarHBondContact O-CG 3.26Å; S31-K35 PolarHBondContact O-N 3.45Å
32W65.7Low71.9Confident153 Ų15395.4 Ų95.458%0.5850%0.495SS*.Hα-helixtrans-77-36.4176.4-88.971.6000111.9L28 P29 A30 K35 V36L28-W32 HydrophobicContact CB-CB 4.22Å; L28-W32 HydrophobicContact CG-CB 3.9Å; P29-W32 PolarHBondContact O-N 2.9Å; A30-W32 PolarHBondContact O-N 3.27Å; W32-K35 PolarHBondContact O-N 3.25Å; W32-V36 WeakPolarHBondContact O-CG2 3.45Å; W32-V36 PolarHBondContact O-N 3.44Å
33R69.6Low71.2Confident110 Ų11097.9 Ų97.942%0.41551%0.509SS..Hα-helixtrans-57.8-51173.2-81.1-167.4176.595-9.2110.9A30 K35 V36 D37A30-R33 PolarHBondContact O-N 2.76Å; R33-K35 PolarHBondContact O-N 3.44Å; R33-K35 VanDerWaalsContact O-N 3.15Å; R33-V36 PolarHBondContact O-N 2.87Å; R33-V36 VanDerWaalsContact O-N 3.15Å; R33-D37 VanDerWaalsContact O-CB 3.24Å; R33-D37 WeakPolarHBondContact O-CB 3.49Å; R33-D37 PolarHBondContact O-N 3.45Å
34S68.3Low70.1Confident43 Ų4396.7 Ų96.730%0.30151%0.508SS..Hα-helixtrans-56.7-36.3177.9-500000113.4A30 G38 Q48A30-S34 PolarHBondContact O-N 3.4Å; A30-S34 VanDerWaalsContact O-N 3.07Å; A30-S34 PolarHBondContact O-OG 2.8Å; A30-S34 VanDerWaalsContact O-OG 3.11Å; S34-G38 PolarHBondContact O-N 3.49Å; S34-Q48 PolarHBondContact OG-NE2 2.91Å
35K74.9Confident69.2Low155 Ų15598.4 Ų98.467%0.67452%0.523SS*.Hα-helixtrans-71.3-46.2177.7-74.7-177.5176.5-173.30112.4S31 W32 R33 W39S31-K35 WeakPolarHBondContact O-CG 3.26Å; S31-K35 PolarHBondContact O-N 3.45Å; W32-K35 PolarHBondContact O-N 3.25Å; R33-K35 PolarHBondContact O-N 3.44Å; R33-K35 VanDerWaalsContact O-N 3.15Å; K35-W39 WeakPolarHBondContact O-CB 3.3Å; K35-W39 PolarHBondContact O-N 2.97Å; K35-W39 VanDerWaalsContact O-N 3.12Å
36V76.5Confident68.5Low67 Ų6797.4 Ų97.441%0.40652%0.518SS..Hα-helixtrans-67.9-44.8178.8174.10000110.1W32 R33 W39 L40W32-V36 WeakPolarHBondContact O-CG2 3.45Å; W32-V36 PolarHBondContact O-N 3.44Å; R33-V36 PolarHBondContact O-N 2.87Å; R33-V36 VanDerWaalsContact O-N 3.15Å; V36-W39 CarbonylContact O-C 3.6Å; V36-W39 PolarHBondContact O-N 3.39Å; V36-W39 VanDerWaalsContact O-N 3.15Å; V36-L40 VanDerWaalsContact O-CB 3.25Å; V36-L40 WeakPolarHBondContact O-CB 3.27Å; V36-L40 PolarHBondContact O-N 2.9Å
37D71.9Confident67.6Low40 Ų4095.4 Ų95.421%0.21451%0.506CS..Hα-helixtrans-66.9-37.8178.3-65.1-42.5000111.4R33 W39 L40 Y41 L46R33-D37 VanDerWaalsContact O-CB 3.24Å; R33-D37 WeakPolarHBondContact O-CB 3.49Å; R33-D37 PolarHBondContact O-N 3.45Å; D37-W39 PolarHBondContact O-N 2.93Å; D37-L40 PolarHBondContact O-N 3.47Å; D37-Y41 CarbonylContact O-C 3.58Å; D37-Y41 VanDerWaalsContact O-CA 3.29Å; D37-Y41 WeakPolarHBondContact O-CA 3.25Å; D37-Y41 WeakPolarHBondContact O-CB 3.44Å; D37-Y41 PolarHBondContact O-N 3.3Å; D37-L46 HydrophobicContact CB-CD1 3.3Å; D37-L46 HydrophobicContact CB-CD2 4.18Å; D37-L46 HydrophobicContact CB-CG 4.37Å
38G75.5Confident66.8Low41 Ų4195.6 Ų95.642%0.42351%0.505SS..Hα-helixtrans-64.2-29.3172.700000113.2S34 P42S34-G38 PolarHBondContact O-N 3.49Å; G38-P42 WeakPolarHBondContact O-CA 3.4Å
39W78.3Confident66Low211 Ų21199.6 Ų99.680%0.79953%0.533SS*.Hα-helixtrans-80.7-38.9174.2-178.665.7000112.8K35 V36 D37K35-W39 WeakPolarHBondContact O-CB 3.3Å; K35-W39 PolarHBondContact O-N 2.97Å; K35-W39 VanDerWaalsContact O-N 3.12Å; V36-W39 CarbonylContact O-C 3.6Å; V36-W39 PolarHBondContact O-N 3.39Å; V36-W39 VanDerWaalsContact O-N 3.15Å; D37-W39 PolarHBondContact O-N 2.93Å
40L76.2Confident65.5Low101 Ų101101 Ų10153%0.52954%0.542SS..Hα-helixtrans-83.6-35.8-175.1-163.271.2000112.5V36 D37 P42V36-L40 VanDerWaalsContact O-CB 3.25Å; V36-L40 WeakPolarHBondContact O-CB 3.27Å; V36-L40 PolarHBondContact O-N 2.9Å; D37-L40 PolarHBondContact O-N 3.47Å; L40-P42 VanDerWaalsContact O-CD 3.31Å; L40-P42 WeakPolarHBondContact O-CD 2.93Å
41Y71.8Confident64.7Low127 Ų127106.3 Ų106.350%0.49856%0.561SS.*  trans-120.363.8178.4-63.3-74000110.6D37 T43 C44D37-Y41 CarbonylContact O-C 3.58Å; D37-Y41 VanDerWaalsContact O-CA 3.29Å; D37-Y41 WeakPolarHBondContact O-CA 3.25Å; D37-Y41 WeakPolarHBondContact O-CB 3.44Å; D37-Y41 PolarHBondContact O-N 3.3Å; Y41-T43 PolarHBondContact O-N 3.45Å; Y41-C44 PolarHBondContact O-N 3.37Å
42P67.5Low63.9Low100 Ų100107.9 Ų107.965%0.64958%0.578SS**THydrogen-bonded Turntrans-61.1-16.5-178.226-35.1000113.5G38 L40G38-P42 WeakPolarHBondContact O-CA 3.4Å; L40-P42 VanDerWaalsContact O-CD 3.31Å; L40-P42 WeakPolarHBondContact O-CD 2.93Å
43T67.4Low62.8Low124 Ų124108.6 Ų108.676%0.76159%0.585SS**THydrogen-bonded Turntrans-103.20.7-175.755.10000114.8Y41Y41-T43 PolarHBondContact O-N 3.45Å
44C58.4Low61.5Low70 Ų70111.9 Ų111.947%0.47361%0.605SS.*  trans-122.3108.5-177.3-67.60000110.6Y41 L46Y41-C44 PolarHBondContact O-N 3.37Å; C44-L46 PolarHBondContact O-N 3.31Å
45P57.3Low60.4Low109 Ų109115.8 Ų115.871%0.70863%0.627SS**  trans-66.4104.6172.327.2-31.4000108.4Q47P45-Q47 PolarHBondContact O-N 3.26Å
46L57.9Low58.8Low89 Ų89116.9 Ų116.947%0.46664%0.635SS.*  trans-64.8109.4175.8-66.7121000108.3D37 C44 Q48D37-L46 HydrophobicContact CB-CD1 3.3Å; D37-L46 HydrophobicContact CB-CD2 4.18Å; D37-L46 HydrophobicContact CB-CG 4.37Å; C44-L46 PolarHBondContact O-N 3.31Å; L46-Q48 PolarHBondContact O-N 2.81Å
47Q55.4Low57.2Low120 Ų120122.7 Ų122.756%0.56166%0.657SS**  trans-61.185.9161.3-75.8170.922.700107.2P45 P49 H61P45-Q47 PolarHBondContact O-N 3.26Å; Q47-P49 VanDerWaalsContact O-CD 3.25Å; Q47-P49 WeakPolarHBondContact O-CD 3.38Å; Q47-H61 PolarHBondContact NE2-CE1 3.49Å
48Q52.5Low55.7Low114 Ų114126.3 Ų126.353%0.53368%0.681SS.*  trans-63117.9166.3-57.1-171.9-8600105.8S34 L46 P50S34-Q48 PolarHBondContact OG-NE2 2.91Å; L46-Q48 PolarHBondContact O-N 2.81Å; Q48-P50 WeakPolarHBondContact O-CD 3.21Å
49P48.4Very low54.2Low117 Ų117132.7 Ų132.776%0.7670%0.7SS**  trans-64.2113.317324.2-29.7000107.4Q47 L51Q47-P49 VanDerWaalsContact O-CD 3.25Å; Q47-P49 WeakPolarHBondContact O-CD 3.38Å; P49-L51 VanDerWaalsContact C-N 3.29Å; P49-L51 PolarHBondContact O-N 3.02Å
50P50.6Low52.6Low100 Ų100129.4 Ų129.465%0.64970%0.698SS**  trans-8083.9-177.331.9-28.8000107.9Q48 A52Q48-P50 WeakPolarHBondContact O-CD 3.21Å; P50-A52 VanDerWaalsContact C-N 3.32Å; P50-A52 PolarHBondContact O-N 2.93Å
51L49.1Very low51.2Low175 Ų175131.3 Ų131.392%0.91670%0.704SS**THydrogen-bonded Turntrans-69.3100.4163.2-140.781.2000106.7P49P49-L51 VanDerWaalsContact C-N 3.29Å; P49-L51 PolarHBondContact O-N 3.02Å
52A48.4Very low50Low99 Ų99129.6 Ų129.682%0.81872%0.716SS**THydrogen-bonded Turntrans90.839.3173.800000118.9P50P50-A52 VanDerWaalsContact C-N 3.32Å; P50-A52 PolarHBondContact O-N 2.93Å
53K42.6Very low49Very low168 Ų168132.9 Ų132.973%0.7372%0.72SS**  trans-132.171.2144.1-144.2-175.5178.1-165.20110.2
54Q42.7Very low47.7Very low179 Ų179131.1 Ų131.184%0.83671%0.712SS**  trans-55.3144159.6-65.3-18014.800108.3
55V46Very low47.2Very low126 Ų126134.4 Ų134.476%0.76472%0.724SS**SBendtrans82.772.5174.8-156.80000115
56E40.1Very low47Very low178 Ų178137 Ų13783%0.83273%0.727SS**  trans-176.355.2131.7-98.8175.1129.100108.2T58E56-T58 PolarHBondContact O-N 3.38Å
57E43.5Very low46.7Very low189 Ų189139.9 Ų139.988%0.88374%0.743SS**  trans-87.682.7173.6-145.8176.2128.800107.2
58T40.4Very low46.5Very low115 Ų115140 Ų14071%0.70675%0.752SS**  trans-144.1115.1166.3-58.20000106.3E56E56-T58 PolarHBondContact O-N 3.38Å
59E44.3Very low46.4Very low176 Ų176143.2 Ų143.282%0.82276%0.764SS**SBendtrans95.831.8158.5-67.6176.5106.500123.2
60D44.6Very low46.5Very low141 Ų141147.2 Ų147.275%0.75477%0.77SS**  trans-147.923.9162.5-124.3-66.5000118.1A62D60-A62 VanDerWaalsContact C-N 3.33Å
61H46.8Very low46.4Very low142 Ų142150 Ų15066%0.65778%0.779SS**SBendtrans-88.76.2171.8-117.8-87.7000114.4Q47Q47-H61 PolarHBondContact NE2-CE1 3.49Å
62A46.3Very low46.4Very low91 Ų91152.1 Ų152.175%0.75279%0.789SS**SBendtrans-88-3.8-175.500000115.1D60D60-A62 VanDerWaalsContact C-N 3.33Å
63K46.4Very low46.3Very low169 Ų169154.8 Ų154.874%0.73579%0.788SS**SBendtrans-102.1-12.8-169.9-149.1169.1-174.3177.90116.3
64C39.6Very low46.5Very low87 Ų87154.1 Ų154.159%0.58879%0.791SS**THydrogen-bonded Turntrans-84.2-8.9-175.7-72.10000115.2
65D48.9Very low46.7Very low139 Ų139152.7 Ų152.774%0.74379%0.788SS**THydrogen-bonded Turntrans-98-2.5178.1-103-74.8000114.3N67D65-N67 PolarHBondContact O-N 3.42Å
66E52.9Low46.8Very low162 Ų162154.2 Ų154.276%0.75779%0.79SS**THydrogen-bonded Turntrans-100.739.9-173.8-146.8-179.7115.700114
67N51.7Low47.2Very low150 Ų150152.8 Ų152.880%0.80279%0.787SS**THydrogen-bonded Turntrans-124.2-12.7161.9-125.7-101.5000114.6D65D65-N67 PolarHBondContact O-N 3.42Å
68T51.9Low47.4Very low124 Ų124150.3 Ų150.376%0.76178%0.78SS**THydrogen-bonded Turntrans-80-17.7177.4-48.70000112.8
69K50.3Low47.9Very low180 Ų180152.9 Ų152.978%0.78379%0.786SS**THydrogen-bonded Turntrans-97.40.9-175.1-74.7-166.3-178.9-171.90116.9
70K50.8Low48.2Very low201 Ų201151.1 Ų151.187%0.87478%0.783SS**SBendtrans-102.727.4178.9-143.5176-175.7175.30114.8
71N48.3Very low48.5Very low158 Ų158151.9 Ų151.985%0.84579%0.785SS**  trans-121.169.8163.3-152.6-8.8000108.9
72I48.7Very low48.7Very low220 Ų220152.8 Ų152.8100%1.12880%0.797SS**  trans-1240160.3-65.8171.5000105.7

Retrieved 72 of 72 residues in 35.3 ms (Link to these results)