A0A3Q0KUN1_SCHMA Loading...

Smp_201290

AlphaFold DB , UniProt , Accession A0A3Q0KUN1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 61 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
1M45Very low58.3Low220 Ų220132.4 Ų132.4100%1.08465%0.649SS**  0-31.50-142.2165.5-177.700114.1R3M1-R3 PolarHBondContact O-N 3.45Å
2L44.6Very low59.6Low158 Ų158126.7 Ų126.783%0.82762%0.623SS**Hα-helixtrans-71-21.1-179.7-89.8142.6000117
3R49.9Very low61Low233 Ų233128.1 Ų128.188%0.87962%0.623SS**Hα-helixtrans-77.9-24.5-179.2-89.4-176172.7175.1-1.4114.4M1M1-R3 PolarHBondContact O-N 3.45Å
4F52.3Low62.2Low162 Ų162124.9 Ų124.971%0.71161%0.609SS**Hα-helixtrans-67.5-51.7179-96.8-91.9000110.6C6 G7 D8F4-C6 VanDerWaalsContact C-N 3.3Å; F4-C6 PolarHBondContact O-N 3.29Å; F4-C6 VanDerWaalsContact O-N 3.11Å; F4-G7 PolarHBondContact O-N 2.96Å; F4-D8 VanDerWaalsContact C-OD2 3.23Å; F4-D8 VanDerWaalsContact O-CG 3.24Å; F4-D8 PolarHBondContact O-N 3.33Å
5I56.9Low63.1Low109 Ų109120.9 Ų120.956%0.55959%0.592SS**Hα-helixtrans-56.4-38.9-177.3-52.6173.8000113.1D8 V9I5-D8 PolarHBondContact O-N 3.25Å; I5-V9 HydrophobicContact CG2-CG2 4.2Å; I5-V9 WeakPolarHBondContact O-CB 3.3Å; I5-V9 VanDerWaalsContact O-CG2 3.22Å; I5-V9 WeakPolarHBondContact O-CG2 3.46Å; I5-V9 PolarHBondContact O-N 3.49Å
6C53.2Low64Low88 Ų88123.7 Ų123.760%0.59559%0.594SS**Hα-helixtrans-75-31.3-177.5-161.60000112.8F4 R10F4-C6 VanDerWaalsContact C-N 3.3Å; F4-C6 PolarHBondContact O-N 3.29Å; F4-C6 VanDerWaalsContact O-N 3.11Å; C6-R10 PolarHBondContact O-N 3.15Å
7G59.6Low64.8Low42 Ų42126 Ų12643%0.43360%0.595SS.*Hα-helixtrans-65.4-48.4170.200000110.7F4 V9 R10 E11F4-G7 PolarHBondContact O-N 2.96Å; G7-V9 PolarHBondContact O-N 2.91Å; G7-R10 PolarHBondContact O-N 3.47Å; G7-E11 PolarHBondContact O-N 3.05Å
8D64.4Low65.6Low76 Ų76124.8 Ų124.841%0.40659%0.587SS.*Hα-helixtrans-61.5-46.5-179.8-59.7-33.8000111.5F4 I5 R10 E11 I12F4-D8 VanDerWaalsContact C-OD2 3.23Å; F4-D8 VanDerWaalsContact O-CG 3.24Å; F4-D8 PolarHBondContact O-N 3.33Å; I5-D8 PolarHBondContact O-N 3.25Å; D8-R10 VanDerWaalsContact C-N 3.32Å; D8-R10 PolarHBondContact O-N 3Å; D8-E11 PolarHBondContact O-N 3.11Å; D8-E11 VanDerWaalsContact O-N 3.15Å; D8-I12 WeakPolarHBondContact O-CB 3.28Å; D8-I12 WeakPolarHBondContact O-CG1 3.37Å; D8-I12 PolarHBondContact O-N 3.43Å
9V71Confident66.3Low65 Ų65119.8 Ų119.839%0.39456%0.563SS.*Hα-helixtrans-63.5-37.2178.8172.40000112I5 G7 K13I5-V9 HydrophobicContact CG2-CG2 4.2Å; I5-V9 WeakPolarHBondContact O-CB 3.3Å; I5-V9 VanDerWaalsContact O-CG2 3.22Å; I5-V9 WeakPolarHBondContact O-CG2 3.46Å; I5-V9 PolarHBondContact O-N 3.49Å; G7-V9 PolarHBondContact O-N 2.91Å; V9-K13 HydrophobicContact CG1-CD 4.42Å; V9-K13 WeakPolarHBondContact O-CB 3.34Å; V9-K13 VanDerWaalsContact O-CG 3.3Å; V9-K13 WeakPolarHBondContact O-CG 3.46Å; V9-K13 PolarHBondContact O-N 2.81Å
10R73.3Confident66.9Low177 Ų177117.7 Ų117.767%0.66856%0.555SS**Hα-helixtrans-67.6-41.8175.7-175.1179.9-66.8-172.3-1.2110.6C6 G7 D8 K13 I14C6-R10 PolarHBondContact O-N 3.15Å; G7-R10 PolarHBondContact O-N 3.47Å; D8-R10 VanDerWaalsContact C-N 3.32Å; D8-R10 PolarHBondContact O-N 3Å; R10-K13 PolarHBondContact O-N 2.88Å; R10-I14 HydrophobicContact CG-CD1 3.97Å; R10-I14 VanDerWaalsContact O-CG1 3.28Å; R10-I14 WeakPolarHBondContact O-CG1 3.48Å; R10-I14 PolarHBondContact O-N 3.09Å
11E70.9Confident67.7Low126 Ų126114.9 Ų114.959%0.58954%0.543SS*.Hα-helixtrans-62.9-45.9176.6-168.8167.5105.800111.5G7 D8 K13 I14 L15G7-E11 PolarHBondContact O-N 3.05Å; D8-E11 PolarHBondContact O-N 3.11Å; D8-E11 VanDerWaalsContact O-N 3.15Å; E11-K13 VanDerWaalsContact C-N 3.31Å; E11-K13 PolarHBondContact O-N 3.31Å; E11-I14 PolarHBondContact O-N 2.95Å; E11-I14 VanDerWaalsContact O-N 3.09Å; E11-L15 HydrophobicContact CG-CD1 4.02Å; E11-L15 HydrophobicContact CG-CG 4.46Å; E11-L15 WeakPolarHBondContact O-CB 3.22Å; E11-L15 WeakPolarHBondContact O-CG 3.47Å; E11-L15 PolarHBondContact O-N 2.99Å
12I73.8Confident69.4Low64 Ų64111.4 Ų111.433%0.32852%0.519SS..Hα-helixtrans-57.9-42.8174.2-66.7163000110.9D8 L15 R16D8-I12 WeakPolarHBondContact O-CB 3.28Å; D8-I12 WeakPolarHBondContact O-CG1 3.37Å; D8-I12 PolarHBondContact O-N 3.43Å; I12-L15 PolarHBondContact O-N 2.81Å; I12-R16 VanDerWaalsContact O-CB 3.29Å; I12-R16 WeakPolarHBondContact O-CB 3.41Å; I12-R16 PolarHBondContact O-N 3.05Å
13K78.1Confident71.3Confident145 Ų145108 Ų10863%0.6350%0.497SS*.Hα-helixtrans-63.8-40.8175.6-76.9179.7-177-174.80112.4V9 R10 E11 W17V9-K13 HydrophobicContact CG1-CD 4.42Å; V9-K13 WeakPolarHBondContact O-CB 3.34Å; V9-K13 VanDerWaalsContact O-CG 3.3Å; V9-K13 WeakPolarHBondContact O-CG 3.46Å; V9-K13 PolarHBondContact O-N 2.81Å; R10-K13 PolarHBondContact O-N 2.88Å; E11-K13 VanDerWaalsContact C-N 3.31Å; E11-K13 PolarHBondContact O-N 3.31Å; K13-W17 WeakPolarHBondContact O-CB 3.35Å; K13-W17 PolarHBondContact O-N 2.9Å
14I78.4Confident72.9Confident83 Ų83102.8 Ų102.843%0.42649%0.486SS..Hα-helixtrans-67.9-42.5177.7-68.6165.1000110.5R10 E11 W17 K18R10-I14 HydrophobicContact CG-CD1 3.97Å; R10-I14 VanDerWaalsContact O-CG1 3.28Å; R10-I14 WeakPolarHBondContact O-CG1 3.48Å; R10-I14 PolarHBondContact O-N 3.09Å; E11-I14 PolarHBondContact O-N 2.95Å; E11-I14 VanDerWaalsContact O-N 3.09Å; I14-W17 PolarHBondContact O-N 3.36Å; I14-K18 HydrophobicContact CG2-CD 4.42Å; I14-K18 WeakPolarHBondContact O-CG 3.22Å; I14-K18 PolarHBondContact O-N 3.3Å
15L75.3Confident74.3Confident66 Ų66100.2 Ų100.235%0.34648%0.479SS..Hα-helixtrans-62.2-45175.9-73.3167000110.9E11 I12 W17 K18 Y19 L58E11-L15 HydrophobicContact CG-CD1 4.02Å; E11-L15 HydrophobicContact CG-CG 4.46Å; E11-L15 WeakPolarHBondContact O-CB 3.22Å; E11-L15 WeakPolarHBondContact O-CG 3.47Å; E11-L15 PolarHBondContact O-N 2.99Å; I12-L15 PolarHBondContact O-N 2.81Å; L15-W17 PolarHBondContact O-N 3.35Å; L15-K18 PolarHBondContact O-N 2.85Å; L15-Y19 WeakPolarHBondContact O-CB 3.48Å; L15-Y19 PolarHBondContact O-N 2.9Å; L15-L58 HydrophobicContact CB-CD1 4.45Å; L15-L58 HydrophobicContact CB-CD2 3.81Å; L15-L58 HydrophobicContact CD1-CD2 3.64Å; L15-L58 HydrophobicContact CG-CD2 4.3Å
16R76.7Confident75.4Confident165 Ų16596.5 Ų96.562%0.62346%0.459SS*.Hα-helixtrans-60.3-44.8173.7-174.1175-177.9167.93.8112I12 Y19 D20I12-R16 VanDerWaalsContact O-CB 3.29Å; I12-R16 WeakPolarHBondContact O-CB 3.41Å; I12-R16 PolarHBondContact O-N 3.05Å; R16-Y19 WeakPolarHBondContact O-CB 3.29Å; R16-Y19 PolarHBondContact O-N 3.34Å; R16-D20 PolarHBondContact O-N 3.47Å
17W78Confident76.8Confident163 Ų16395.7 Ų95.762%0.61745%0.451SS*.Hα-helixtrans-63.7-42.5178.2179.778000112.5K13 I14 L15 Y19 D20 I21K13-W17 WeakPolarHBondContact O-CB 3.35Å; K13-W17 PolarHBondContact O-N 2.9Å; I14-W17 PolarHBondContact O-N 3.36Å; L15-W17 PolarHBondContact O-N 3.35Å; W17-Y19 VanDerWaalsContact C-N 3.31Å; W17-Y19 PolarHBondContact O-N 3.49Å; W17-D20 PolarHBondContact O-N 2.82Å; W17-I21 HydrophobicContact CD2-CD1 3.67Å; W17-I21 HydrophobicContact CE3-CD1 3.91Å; W17-I21 HydrophobicContact CG-CD1 4.46Å; W17-I21 HydrophobicContact CH2-CD1 3.43Å; W17-I21 VanDerWaalsContact CH2-CD1 3.43Å; W17-I21 HydrophobicContact CZ2-CD1 3.14Å; W17-I21 HydrophobicContact CZ2-CG1 4.5Å; W17-I21 HydrophobicContact CZ3-CD1 3.79Å; W17-I21 WeakPolarHBondContact O-CG1 3.32Å; W17-I21 PolarHBondContact O-N 3.22Å
18K79.1Confident77.9Confident104 Ų10495.9 Ų95.945%0.45245%0.448SS..Hα-helixtrans-57.5-48.5172.3-75.8178.1179.1-179.20110.3I14 L15 D20 I21 Y22I14-K18 HydrophobicContact CG2-CD 4.42Å; I14-K18 WeakPolarHBondContact O-CG 3.22Å; I14-K18 PolarHBondContact O-N 3.3Å; L15-K18 PolarHBondContact O-N 2.85Å; K18-D20 PolarHBondContact O-N 3.29Å; K18-I21 PolarHBondContact O-N 2.89Å; K18-Y22 HydrophobicContact CB-CD2 4.39Å; K18-Y22 HydrophobicContact CB-CE2 4.21Å; K18-Y22 WeakPolarHBondContact O-CD2 3.41Å; K18-Y22 PolarHBondContact O-N 2.93Å
19Y78.3Confident78.7Confident31 Ų3198.9 Ų98.912%0.12245%0.454CS..Hα-helixtrans-58.6-46.1178.1170.8-84.2000112.2L15 R16 W17 I21 Y22 K23 F51 P54L15-Y19 WeakPolarHBondContact O-CB 3.48Å; L15-Y19 PolarHBondContact O-N 2.9Å; R16-Y19 WeakPolarHBondContact O-CB 3.29Å; R16-Y19 PolarHBondContact O-N 3.34Å; W17-Y19 VanDerWaalsContact C-N 3.31Å; W17-Y19 PolarHBondContact O-N 3.49Å; Y19-I21 VanDerWaalsContact C-N 3.32Å; Y19-I21 PolarHBondContact O-N 3.14Å; Y19-Y22 PolarHBondContact O-N 3.09Å; Y19-K23 HydrophobicContact CE1-CD 4.1Å; Y19-K23 WeakPolarHBondContact O-CB 3.5Å; Y19-K23 PolarHBondContact O-N 2.89Å; Y19-F51 HydrophobicContact CD2-CD1 4.19Å; Y19-F51 HydrophobicContact CE2-CB 4.18Å; Y19-F51 AromaticContact CE2-CD1 3.58Å; Y19-F51 HydrophobicContact CE2-CD1 3.58Å; Y19-F51 HydrophobicContact CE2-CG 4.36Å; Y19-F51 WeakPolarHBondContact CE2-O 2.98Å; Y19-F51 VanDerWaalsContact OH-C 3.25Å; Y19-F51 PolarHBondContact OH-O 3.42Å; Y19-P54 HydrophobicContact CD2-CB 4.43Å; Y19-P54 HydrophobicContact CD2-CG 3.57Å; Y19-P54 HydrophobicContact CE2-CB 4.46Å; Y19-P54 HydrophobicContact CE2-CG 3.22Å
20D80Confident79Confident77 Ų7799.7 Ų99.741%0.41245%0.45SS..Hα-helixtrans-61.7-39.6178.8-74-25.1000111.6R16 W17 K18 K23 L24R16-D20 PolarHBondContact O-N 3.47Å; W17-D20 PolarHBondContact O-N 2.82Å; K18-D20 PolarHBondContact O-N 3.29Å; D20-K23 PolarHBondContact O-N 3.21Å; D20-L24 WeakPolarHBondContact O-CB 3.11Å; D20-L24 PolarHBondContact O-N 3.44Å
21I83.3Confident79.2Confident58 Ų5895.1 Ų95.130%0.29744%0.441SS..Hα-helixtrans-67.9-44175.1-71.3173.4000111.6W17 K18 Y19 K23 L24 L25W17-I21 HydrophobicContact CD2-CD1 3.67Å; W17-I21 HydrophobicContact CE3-CD1 3.91Å; W17-I21 HydrophobicContact CG-CD1 4.46Å; W17-I21 HydrophobicContact CH2-CD1 3.43Å; W17-I21 VanDerWaalsContact CH2-CD1 3.43Å; W17-I21 HydrophobicContact CZ2-CD1 3.14Å; W17-I21 HydrophobicContact CZ2-CG1 4.5Å; W17-I21 HydrophobicContact CZ3-CD1 3.79Å; W17-I21 WeakPolarHBondContact O-CG1 3.32Å; W17-I21 PolarHBondContact O-N 3.22Å; K18-I21 PolarHBondContact O-N 2.89Å; Y19-I21 VanDerWaalsContact C-N 3.32Å; Y19-I21 PolarHBondContact O-N 3.14Å; I21-K23 VanDerWaalsContact C-N 3.29Å; I21-K23 PolarHBondContact O-N 3.26Å; I21-L24 PolarHBondContact O-N 3.29Å; I21-L25 HydrophobicContact CG2-CD1 3.92Å; I21-L25 HydrophobicContact CG2-CG 4.3Å; I21-L25 WeakPolarHBondContact O-CB 3.34Å; I21-L25 WeakPolarHBondContact O-CG 3.36Å; I21-L25 PolarHBondContact O-N 3.49Å
22Y81.1Confident79.5Confident147 Ų14794 Ų9458%0.57644%0.438SS*.Hα-helixtrans-61-41.7176.7-76.6-62.8000111.1K18 Y19 L25 Y26K18-Y22 HydrophobicContact CB-CD2 4.39Å; K18-Y22 HydrophobicContact CB-CE2 4.21Å; K18-Y22 WeakPolarHBondContact O-CD2 3.41Å; K18-Y22 PolarHBondContact O-N 2.93Å; Y19-Y22 PolarHBondContact O-N 3.09Å; Y22-L25 PolarHBondContact O-N 2.87Å; Y22-Y26 WeakPolarHBondContact O-CB 3.45Å; Y22-Y26 PolarHBondContact O-N 3.45Å
23K83.2Confident79.4Confident86 Ų8693.4 Ų93.437%0.37444%0.436SS..Hα-helixtrans-61-44.4174.6-170.8170.1-170.7159.70111.5Y19 D20 I21 Y26 T27 F51Y19-K23 HydrophobicContact CE1-CD 4.1Å; Y19-K23 WeakPolarHBondContact O-CB 3.5Å; Y19-K23 PolarHBondContact O-N 2.89Å; D20-K23 PolarHBondContact O-N 3.21Å; I21-K23 VanDerWaalsContact C-N 3.29Å; I21-K23 PolarHBondContact O-N 3.26Å; K23-Y26 WeakPolarHBondContact O-CB 3.34Å; K23-Y26 PolarHBondContact O-N 3.22Å; K23-T27 PolarHBondContact O-N 2.96Å; K23-T27 PolarHBondContact O-OG1 3.35Å; K23-F51 HydrophobicContact CB-CD1 4.3Å; K23-F51 HydrophobicContact CB-CE1 4.44Å
24L83.7Confident79.1Confident124 Ų12495.2 Ų95.265%0.64944%0.438SS*.Hα-helixtrans-62.8-49.1177.5-176.667.4000112.4D20 I21 Y26 T27 A28D20-L24 WeakPolarHBondContact O-CB 3.11Å; D20-L24 PolarHBondContact O-N 3.44Å; I21-L24 PolarHBondContact O-N 3.29Å; L24-Y26 PolarHBondContact O-N 3.39Å; L24-T27 PolarHBondContact O-N 3.48Å; L24-A28 WeakPolarHBondContact O-CB 3.44Å; L24-A28 PolarHBondContact O-N 3.48Å
25L82.7Confident78.9Confident109 Ų10997.3 Ų97.357%0.57145%0.451SS*.Hα-helixtrans-60.5-39177.4-73.8172.9000111.3I21 Y22 A28 R29I21-L25 HydrophobicContact CG2-CD1 3.92Å; I21-L25 HydrophobicContact CG2-CG 4.3Å; I21-L25 WeakPolarHBondContact O-CB 3.34Å; I21-L25 WeakPolarHBondContact O-CG 3.36Å; I21-L25 PolarHBondContact O-N 3.49Å; Y22-L25 PolarHBondContact O-N 2.87Å; L25-A28 PolarHBondContact O-N 3.41Å; L25-R29 WeakPolarHBondContact O-CB 3.35Å; L25-R29 PolarHBondContact O-N 3.44Å
26Y79.9Confident78.6Confident31 Ų3198.2 Ų98.212%0.12246%0.459CS..Hα-helixtrans-64.1-48.7176.5-179.6-94.6000112.1Y22 K23 L24 A28 R29 R30 D44 S47 E48 F51Y22-Y26 WeakPolarHBondContact O-CB 3.45Å; Y22-Y26 PolarHBondContact O-N 3.45Å; K23-Y26 WeakPolarHBondContact O-CB 3.34Å; K23-Y26 PolarHBondContact O-N 3.22Å; L24-Y26 PolarHBondContact O-N 3.39Å; Y26-A28 VanDerWaalsContact C-N 3.32Å; Y26-A28 PolarHBondContact O-N 3.21Å; Y26-R29 PolarHBondContact O-N 3.3Å; Y26-R30 WeakPolarHBondContact O-CB 3.18Å; Y26-R30 PolarHBondContact O-N 2.89Å; Y26-D44 WeakPolarHBondContact CE1-OD1 2.99Å; Y26-D44 VanDerWaalsContact CZ-OD1 3.28Å; Y26-D44 WeakPolarHBondContact OH-CA 3.41Å; Y26-D44 PolarHBondContact OH-O 3.49Å; Y26-D44 VanDerWaalsContact OH-O 3.09Å; Y26-D44 PolarHBondContact OH-OD1 3.41Å; Y26-S47 VanDerWaalsContact CZ-CB 3.45Å; Y26-S47 VanDerWaalsContact OH-CB 3.31Å; Y26-S47 WeakPolarHBondContact OH-CB 3.32Å; Y26-E48 HydrophobicContact CE1-CG 4.29Å; Y26-F51 HydrophobicContact CD1-CD2 4.21Å; Y26-F51 AromaticContact CD1-CE2 3.9Å; Y26-F51 HydrophobicContact CD1-CE2 3.9Å; Y26-F51 AromaticContact CD2-CE2 3.7Å; Y26-F51 HydrophobicContact CD2-CE2 3.7Å; Y26-F51 HydrophobicContact CD2-CZ 4.37Å; Y26-F51 HydrophobicContact CE1-CE2 4.42Å; Y26-F51 HydrophobicContact CE2-CE2 4.22Å; Y26-F51 HydrophobicContact CG-CD2 4.28Å; Y26-F51 AromaticContact CG-CE2 3.51Å; Y26-F51 HydrophobicContact CG-CE2 3.51Å; Y26-F51 HydrophobicContact CG-CZ 4.12Å
27T82.2Confident77.9Confident71 Ų7198.5 Ų98.544%0.43646%0.461SS..Hα-helixtrans-59.6-42.8174.4-57.70000111.5K23 L24 R30 V31K23-T27 PolarHBondContact O-N 2.96Å; K23-T27 PolarHBondContact O-OG1 3.35Å; L24-T27 PolarHBondContact O-N 3.48Å; T27-R30 WeakPolarHBondContact O-CB 3.14Å; T27-R30 PolarHBondContact O-N 3.22Å; T27-V31 WeakPolarHBondContact O-CG2 3.45Å; T27-V31 PolarHBondContact O-N 3.33Å
28A83.3Confident77.3Confident46 Ų4697 Ų9738%0.3848%0.475SS..Hα-helixtrans-61.9-45.8176.500000111.5L24 L25 Y26 R30 V31 I32L24-A28 WeakPolarHBondContact O-CB 3.44Å; L24-A28 PolarHBondContact O-N 3.48Å; L25-A28 PolarHBondContact O-N 3.41Å; Y26-A28 VanDerWaalsContact C-N 3.32Å; Y26-A28 PolarHBondContact O-N 3.21Å; A28-R30 VanDerWaalsContact C-N 3.32Å; A28-R30 PolarHBondContact O-N 2.9Å; A28-V31 PolarHBondContact O-N 3.42Å; A28-I32 VanDerWaalsContact O-CG1 3.32Å; A28-I32 WeakPolarHBondContact O-CG1 3.41Å; A28-I32 PolarHBondContact O-N 2.88Å
29R79.8Confident76.3Confident139 Ų13994.8 Ų94.853%0.52547%0.465SS..Hα-helixtrans-58.8-43.2175.1-178.5-179.7179.7-167.7-2.6111.4L25 Y26 I32 L33L25-R29 WeakPolarHBondContact O-CB 3.35Å; L25-R29 PolarHBondContact O-N 3.44Å; Y26-R29 PolarHBondContact O-N 3.3Å; R29-I32 PolarHBondContact O-N 2.89Å; R29-L33 HydrophobicContact CG-CD1 3.71Å; R29-L33 HydrophobicContact CG-CG 4.08Å; R29-L33 WeakPolarHBondContact O-CB 3.22Å; R29-L33 WeakPolarHBondContact O-CG 3.45Å; R29-L33 PolarHBondContact O-N 2.87Å
30R77.3Confident75.6Confident82 Ų8298.8 Ų98.831%0.30949%0.488SS..Hα-helixtrans-59.8-47176.6170.1170.1-166.9-171.217.5111.9Y26 T27 A28 I32 R34 Y39 D44 E48Y26-R30 WeakPolarHBondContact O-CB 3.18Å; Y26-R30 PolarHBondContact O-N 2.89Å; T27-R30 WeakPolarHBondContact O-CB 3.14Å; T27-R30 PolarHBondContact O-N 3.22Å; A28-R30 VanDerWaalsContact C-N 3.32Å; A28-R30 PolarHBondContact O-N 2.9Å; R30-I32 PolarHBondContact O-N 2.46Å; R30-R34 WeakPolarHBondContact O-CB 3.45Å; R30-R34 PolarHBondContact O-N 3.38Å; R30-Y39 HydrophobicContact CB-CE2 4.47Å; R30-Y39 WeakPolarHBondContact CD-OH 3.37Å; R30-Y39 HydrophobicContact CG-CE2 4.18Å; R30-Y39 WeakPolarHBondContact CG-OH 3.44Å; R30-D44 WeakPolarHBondContact CD-OD1 3.5Å; R30-D44 IonicContact CZ-OD1 3.72Å; R30-D44 IonicContact CZ-OD2 3.99Å; R30-D44 IonicContact NE-OD1 3.78Å; R30-D44 IonicContact NE-OD2 2.85Å; R30-D44 PolarHBondContact NE-OD2 3.03Å; R30-D44 IonicContact NH1-OD2 3.7Å; R30-D44 IonicContact NH2-OD2 3.95Å; R30-D44 PolarHBondContact NH2-OD2 3.35Å; R30-E48 IonicContact CZ-OE1 2.83Å; R30-E48 IonicContact NH1-OE1 2.77Å; R30-E48 PolarHBondContact NH1-OE1 2.9Å; R30-E48 IonicContact NH1-OE2 3.95Å; R30-E48 IonicContact NH2-OE1 3.57Å; R30-E48 IonicContact NH2-OE2 2.72Å
31V77.1Confident75Confident80 Ų8098.3 Ų98.349%0.48549%0.486SS..Hα-helixtrans-61.7-44177.3172.60000111.3T27 A28 N35T27-V31 WeakPolarHBondContact O-CG2 3.45Å; T27-V31 PolarHBondContact O-N 3.33Å; A28-V31 PolarHBondContact O-N 3.42Å; V31-N35 WeakPolarHBondContact O-CB 2.99Å; V31-N35 VanDerWaalsContact O-CG 3.29Å; V31-N35 PolarHBondContact O-N 3.23Å; V31-N35 PolarHBondContact O-ND2 2.98Å; V31-N35 VanDerWaalsContact O-ND2 3.14Å
32I78.7Confident74.2Confident102 Ų10299.7 Ų99.752%0.52350%0.501SS..Hα-helixtrans-65.5-53.7178.8-65.1165.7000110.3A28 R29 R30 R34 N35 T36A28-I32 VanDerWaalsContact O-CG1 3.32Å; A28-I32 WeakPolarHBondContact O-CG1 3.41Å; A28-I32 PolarHBondContact O-N 2.88Å; R29-I32 PolarHBondContact O-N 2.89Å; R30-I32 PolarHBondContact O-N 2.46Å; I32-R34 VanDerWaalsContact C-N 3.34Å; I32-R34 PolarHBondContact O-N 3.24Å; I32-N35 PolarHBondContact O-N 2.89Å; I32-N35 VanDerWaalsContact O-N 3.08Å; I32-T36 HydrophobicContact CG2-CG2 4.3Å; I32-T36 WeakPolarHBondContact O-CG2 3.31Å; I32-T36 PolarHBondContact O-N 3.3Å; I32-T36 PolarHBondContact O-OG1 3.44Å
33L71.8Confident73.5Confident52 Ų5298 Ų9827%0.27250%0.497SS..Hα-helixtrans-63-38.4-177-73179.9000112.8R29 N35 T36 Y37 Y39R29-L33 HydrophobicContact CG-CD1 3.71Å; R29-L33 HydrophobicContact CG-CG 4.08Å; R29-L33 WeakPolarHBondContact O-CB 3.22Å; R29-L33 WeakPolarHBondContact O-CG 3.45Å; R29-L33 PolarHBondContact O-N 2.87Å; L33-N35 PolarHBondContact O-N 3Å; L33-T36 PolarHBondContact O-N 3.29Å; L33-Y37 HydrophobicContact CD2-CD2 3.9Å; L33-Y37 PolarHBondContact O-N 3.16Å; L33-Y37 VanDerWaalsContact O-O 3.06Å; L33-Y39 HydrophobicContact CB-CD2 3.83Å; L33-Y39 HydrophobicContact CB-CE2 4.06Å
34R72.1Confident72.6Confident183 Ų18394 Ų9469%0.69148%0.479SS*.Hα-helixtrans-61.7-33.8175.9-176.1179.1179.3-174.70.7112R30 I32 Y39R30-R34 WeakPolarHBondContact O-CB 3.45Å; R30-R34 PolarHBondContact O-N 3.38Å; I32-R34 VanDerWaalsContact C-N 3.34Å; I32-R34 PolarHBondContact O-N 3.24Å; R34-Y39 HydrophobicContact CB-CD2 4.17Å; R34-Y39 HydrophobicContact CB-CG 4.49Å
35N72.5Confident71.8Confident128 Ų12895.7 Ų95.768%0.68448%0.477SS*.Hα-helixtrans-85.7-26.6-179.8-70.5-23000112.9V31 I32 L33V31-N35 WeakPolarHBondContact O-CB 2.99Å; V31-N35 VanDerWaalsContact O-CG 3.29Å; V31-N35 PolarHBondContact O-N 3.23Å; V31-N35 PolarHBondContact O-ND2 2.98Å; V31-N35 VanDerWaalsContact O-ND2 3.14Å; I32-N35 PolarHBondContact O-N 2.89Å; I32-N35 VanDerWaalsContact O-N 3.08Å; L33-N35 PolarHBondContact O-N 3Å
36T70.6Confident71.1Confident85 Ų8596 Ų9652%0.52147%0.474SS..Hα-helixtrans-105.4-26.8-173.261.50000115.2I32 L33I32-T36 HydrophobicContact CG2-CG2 4.3Å; I32-T36 WeakPolarHBondContact O-CG2 3.31Å; I32-T36 PolarHBondContact O-N 3.3Å; I32-T36 PolarHBondContact O-OG1 3.44Å; L33-T36 PolarHBondContact O-N 3.29Å
37Y61.7Low70.4Confident170 Ų17095.2 Ų95.267%0.66747%0.473SS*.SBendtrans-133.3160.1-175-70.5-76.1000112.2L33 Y39L33-Y37 HydrophobicContact CD2-CD2 3.9Å; L33-Y37 PolarHBondContact O-N 3.16Å; L33-Y37 VanDerWaalsContact O-O 3.06Å; Y37-Y39 VanDerWaalsContact C-N 3.28Å; Y37-Y39 PolarHBondContact O-N 3.29Å
38S65.9Low69.6Low131 Ų13195.2 Ų95.292%0.91647%0.468SS*.  trans-62.394.9164.3-171.30000108.2
39Y58.1Low68.7Low59 Ų5998.7 Ų98.723%0.23148%0.476CS..  trans-63.4127.5-169.1-174.6-102.4000111.9R30 L33 R34 Y37 D41 D44R30-Y39 HydrophobicContact CB-CE2 4.47Å; R30-Y39 WeakPolarHBondContact CD-OH 3.37Å; R30-Y39 HydrophobicContact CG-CE2 4.18Å; R30-Y39 WeakPolarHBondContact CG-OH 3.44Å; L33-Y39 HydrophobicContact CB-CD2 3.83Å; L33-Y39 HydrophobicContact CB-CE2 4.06Å; R34-Y39 HydrophobicContact CB-CD2 4.17Å; R34-Y39 HydrophobicContact CB-CG 4.49Å; Y37-Y39 VanDerWaalsContact C-N 3.28Å; Y37-Y39 PolarHBondContact O-N 3.29Å; Y39-D41 PolarHBondContact O-N 3.28Å; Y39-D44 HydrophobicContact CE1-CB 3.93Å; Y39-D44 VanDerWaalsContact OH-CB 3.24Å; Y39-D44 WeakPolarHBondContact OH-CB 3.07Å; Y39-D44 PolarHBondContact OH-OD1 3.41Å; Y39-D44 PolarHBondContact OH-OD2 3.15Å
40N63.1Low67.9Low114 Ų11497.8 Ų97.861%0.6148%0.476SS*.  trans-85.789.1177.1-161.67.7000110.5S42 F43N40-S42 PolarHBondContact O-N 2.99Å; N40-S42 VanDerWaalsContact O-N 3.08Å; N40-F43 PolarHBondContact O-N 3.38Å
41D67Low67Low68 Ų6895.5 Ų95.536%0.36447%0.469SS..Hα-helixtrans-53-28.2-177.4-165.267.1000113.4Y39 F43 D44 R45Y39-D41 PolarHBondContact O-N 3.28Å; D41-F43 PolarHBondContact O-N 2.94Å; D41-D44 WeakPolarHBondContact O-CB 3.49Å; D41-D44 PolarHBondContact O-N 3.36Å; D41-R45 PolarHBondContact O-N 2.9Å; D41-R45 IonicContact OD2-CZ 3.26Å; D41-R45 VanDerWaalsContact OD2-CZ 3.26Å; D41-R45 IonicContact OD2-NE 2.91Å; D41-R45 PolarHBondContact OD2-NE 3.03Å; D41-R45 IonicContact OD2-NH2 2.82Å; D41-R45 PolarHBondContact OD2-NH2 2.82Å
42S67Low66.2Low87 Ų8796.9 Ų96.961%0.60847%0.473SS*.Hα-helixtrans-67.2-37-177.8-54.60000113.9N40 D44 F46N40-S42 PolarHBondContact O-N 2.99Å; N40-S42 VanDerWaalsContact O-N 3.08Å; S42-D44 PolarHBondContact O-N 2.98Å; S42-F46 PolarHBondContact O-N 3.08Å
43F65.1Low65.2Low112 Ų11298.3 Ų98.349%0.49148%0.478SS..Hα-helixtrans-69.3-26.1176.5-171.1-96000111.1N40 D41 S47N40-F43 PolarHBondContact O-N 3.38Å; D41-F43 PolarHBondContact O-N 2.94Å; F43-S47 WeakPolarHBondContact CE1-OG 3.5Å; F43-S47 PolarHBondContact O-N 2.77Å; F43-S47 VanDerWaalsContact O-N 3.14Å; F43-S47 PolarHBondContact O-OG 3.2Å
44D65Low64.3Low1 Ų197.4 Ų97.41%0.00548%0.475CS..Hα-helixtrans-71.1-49.9-176.8-167.240.9000111.9Y26 R30 Y39 D41 S42 F46 S47 E48Y26-D44 WeakPolarHBondContact CE1-OD1 2.99Å; Y26-D44 VanDerWaalsContact CZ-OD1 3.28Å; Y26-D44 WeakPolarHBondContact OH-CA 3.41Å; Y26-D44 PolarHBondContact OH-O 3.49Å; Y26-D44 VanDerWaalsContact OH-O 3.09Å; Y26-D44 PolarHBondContact OH-OD1 3.41Å; R30-D44 WeakPolarHBondContact CD-OD1 3.5Å; R30-D44 IonicContact CZ-OD1 3.72Å; R30-D44 IonicContact CZ-OD2 3.99Å; R30-D44 IonicContact NE-OD1 3.78Å; R30-D44 IonicContact NE-OD2 2.85Å; R30-D44 PolarHBondContact NE-OD2 3.03Å; R30-D44 IonicContact NH1-OD2 3.7Å; R30-D44 IonicContact NH2-OD2 3.95Å; R30-D44 PolarHBondContact NH2-OD2 3.35Å; Y39-D44 HydrophobicContact CE1-CB 3.93Å; Y39-D44 VanDerWaalsContact OH-CB 3.24Å; Y39-D44 WeakPolarHBondContact OH-CB 3.07Å; Y39-D44 PolarHBondContact OH-OD1 3.41Å; Y39-D44 PolarHBondContact OH-OD2 3.15Å; D41-D44 WeakPolarHBondContact O-CB 3.49Å; D41-D44 PolarHBondContact O-N 3.36Å; S42-D44 PolarHBondContact O-N 2.98Å; D44-F46 VanDerWaalsContact C-N 3.31Å; D44-F46 PolarHBondContact O-N 3.32Å; D44-S47 PolarHBondContact O-N 2.91Å; D44-E48 PolarHBondContact O-N 3.27Å
45R67.3Low63.4Low160 Ų16092.2 Ų92.260%0.60446%0.463SS*.Hα-helixtrans-60.5-40.4177.8-63.9-176.1-166.5-164.71.8112.5D41 Q49D41-R45 PolarHBondContact O-N 2.9Å; D41-R45 IonicContact OD2-CZ 3.26Å; D41-R45 VanDerWaalsContact OD2-CZ 3.26Å; D41-R45 IonicContact OD2-NE 2.91Å; D41-R45 PolarHBondContact OD2-NE 3.03Å; D41-R45 IonicContact OD2-NH2 2.82Å; D41-R45 PolarHBondContact OD2-NH2 2.82Å; R45-Q49 WeakPolarHBondContact O-CG 3.44Å; R45-Q49 PolarHBondContact O-N 3.31Å
46F66.8Low62.4Low116 Ų11690.2 Ų90.251%0.50946%0.456SS..Hα-helixtrans-61-52.1176.2-175.1-102.8000109.7S42 D44 E48 Q49 F50S42-F46 PolarHBondContact O-N 3.08Å; D44-F46 VanDerWaalsContact C-N 3.31Å; D44-F46 PolarHBondContact O-N 3.32Å; F46-E48 PolarHBondContact O-N 3.14Å; F46-Q49 WeakPolarHBondContact O-CB 3.33Å; F46-Q49 PolarHBondContact O-N 2.49Å; F46-F50 AromaticContact CD1-CD2 3.84Å; F46-F50 HydrophobicContact CD1-CD2 3.84Å; F46-F50 AromaticContact CD1-CE2 3.46Å; F46-F50 HydrophobicContact CD1-CE2 3.46Å; F46-F50 VanDerWaalsContact CD1-CE2 3.46Å; F46-F50 AromaticContact CD2-CE2 3.7Å; F46-F50 HydrophobicContact CD2-CE2 3.7Å; F46-F50 AromaticContact CE1-CD2 3.78Å; F46-F50 HydrophobicContact CE1-CD2 3.78Å; F46-F50 AromaticContact CE1-CE2 3.1Å; F46-F50 HydrophobicContact CE1-CE2 3.1Å; F46-F50 AromaticContact CE1-CZ 3.77Å; F46-F50 HydrophobicContact CE1-CZ 3.77Å; F46-F50 AromaticContact CE2-CE2 3.38Å; F46-F50 HydrophobicContact CE2-CE2 3.38Å; F46-F50 AromaticContact CE2-CZ 3.8Å; F46-F50 HydrophobicContact CE2-CZ 3.8Å; F46-F50 HydrophobicContact CG-CD2 4.28Å; F46-F50 AromaticContact CG-CE2 3.76Å; F46-F50 HydrophobicContact CG-CE2 3.76Å; F46-F50 HydrophobicContact CZ-CD2 4.18Å; F46-F50 AromaticContact CZ-CE2 3.08Å; F46-F50 HydrophobicContact CZ-CE2 3.08Å; F46-F50 AromaticContact CZ-CZ 3.37Å; F46-F50 HydrophobicContact CZ-CZ 3.37Å; F46-F50 WeakPolarHBondContact O-CD2 3.32Å; F46-F50 PolarHBondContact O-N 3.09Å
47S65.2Low61.4Low14 Ų1492.6 Ų92.610%0.09846%0.459CS..Hα-helixtrans-65.7-39.5-177.7-52.60000112.8Y26 F43 D44 Q49 F50 F51Y26-S47 VanDerWaalsContact CZ-CB 3.45Å; Y26-S47 VanDerWaalsContact OH-CB 3.31Å; Y26-S47 WeakPolarHBondContact OH-CB 3.32Å; F43-S47 WeakPolarHBondContact CE1-OG 3.5Å; F43-S47 PolarHBondContact O-N 2.77Å; F43-S47 VanDerWaalsContact O-N 3.14Å; F43-S47 PolarHBondContact O-OG 3.2Å; D44-S47 PolarHBondContact O-N 2.91Å; S47-Q49 VanDerWaalsContact C-N 3.31Å; S47-Q49 PolarHBondContact O-N 2.96Å; S47-F50 PolarHBondContact O-N 3.37Å; S47-F50 VanDerWaalsContact O-N 3.16Å; S47-F51 WeakPolarHBondContact O-CD2 3.38Å; S47-F51 PolarHBondContact O-N 3.17Å
48E65.1Low60.8Low70 Ų7086.2 Ų86.233%0.32744%0.436SS..Hα-helixtrans-57.7-41.2174.5-80.1-177.8135.200111.8Y26 R30 D44 F46 F50 F51 D52Y26-E48 HydrophobicContact CE1-CG 4.29Å; R30-E48 IonicContact CZ-OE1 2.83Å; R30-E48 IonicContact NH1-OE1 2.77Å; R30-E48 PolarHBondContact NH1-OE1 2.9Å; R30-E48 IonicContact NH1-OE2 3.95Å; R30-E48 IonicContact NH2-OE1 3.57Å; R30-E48 IonicContact NH2-OE2 2.72Å; D44-E48 PolarHBondContact O-N 3.27Å; F46-E48 PolarHBondContact O-N 3.14Å; E48-F50 PolarHBondContact O-N 2.85Å; E48-F51 CarbonylContact O-C 3.54Å; E48-F51 WeakPolarHBondContact O-CA 3.43Å; E48-F51 PolarHBondContact O-N 3.39Å; E48-D52 PolarHBondContact O-N 3.25Å
49Q65.2Low59.9Low119 Ų11987.3 Ų87.356%0.55643%0.427SS*.Hα-helixtrans-59.9-43.9174.2-71.8175.2-25.900112.3R45 F46 S47 F51 D52 E53R45-Q49 WeakPolarHBondContact O-CG 3.44Å; R45-Q49 PolarHBondContact O-N 3.31Å; F46-Q49 WeakPolarHBondContact O-CB 3.33Å; F46-Q49 PolarHBondContact O-N 2.49Å; S47-Q49 VanDerWaalsContact C-N 3.31Å; S47-Q49 PolarHBondContact O-N 2.96Å; Q49-F51 PolarHBondContact O-N 3.2Å; Q49-D52 PolarHBondContact O-N 3.47Å; Q49-E53 PolarHBondContact O-N 3.49Å; Q49-E53 VanDerWaalsContact O-N 3.15Å
50F62.2Low59.5Low120 Ų12090.3 Ų90.353%0.52645%0.451SS..Hα-helixtrans-66-22.9173.6-72.5-80.5000113.5F46 S47 E48 P54F46-F50 AromaticContact CD1-CD2 3.84Å; F46-F50 HydrophobicContact CD1-CD2 3.84Å; F46-F50 AromaticContact CD1-CE2 3.46Å; F46-F50 HydrophobicContact CD1-CE2 3.46Å; F46-F50 VanDerWaalsContact CD1-CE2 3.46Å; F46-F50 AromaticContact CD2-CE2 3.7Å; F46-F50 HydrophobicContact CD2-CE2 3.7Å; F46-F50 AromaticContact CE1-CD2 3.78Å; F46-F50 HydrophobicContact CE1-CD2 3.78Å; F46-F50 AromaticContact CE1-CE2 3.1Å; F46-F50 HydrophobicContact CE1-CE2 3.1Å; F46-F50 AromaticContact CE1-CZ 3.77Å; F46-F50 HydrophobicContact CE1-CZ 3.77Å; F46-F50 AromaticContact CE2-CE2 3.38Å; F46-F50 HydrophobicContact CE2-CE2 3.38Å; F46-F50 AromaticContact CE2-CZ 3.8Å; F46-F50 HydrophobicContact CE2-CZ 3.8Å; F46-F50 HydrophobicContact CG-CD2 4.28Å; F46-F50 AromaticContact CG-CE2 3.76Å; F46-F50 HydrophobicContact CG-CE2 3.76Å; F46-F50 HydrophobicContact CZ-CD2 4.18Å; F46-F50 AromaticContact CZ-CE2 3.08Å; F46-F50 HydrophobicContact CZ-CE2 3.08Å; F46-F50 AromaticContact CZ-CZ 3.37Å; F46-F50 HydrophobicContact CZ-CZ 3.37Å; F46-F50 WeakPolarHBondContact O-CD2 3.32Å; F46-F50 PolarHBondContact O-N 3.09Å; S47-F50 PolarHBondContact O-N 3.37Å; S47-F50 VanDerWaalsContact O-N 3.16Å; E48-F50 PolarHBondContact O-N 2.85Å; F50-P54 WeakPolarHBondContact O-CD 3.44Å; F50-P54 WeakPolarHBondContact O-CG 3.2Å
51F59.9Low58.5Low35 Ų3592.2 Ų92.215%0.15446%0.461CS..Hα-helixtrans-82.5-34.8174.3-73.9-66.4000111.5Y19 K23 Y26 S47 E48 Q49 P54Y19-F51 HydrophobicContact CD2-CD1 4.19Å; Y19-F51 HydrophobicContact CE2-CB 4.18Å; Y19-F51 AromaticContact CE2-CD1 3.58Å; Y19-F51 HydrophobicContact CE2-CD1 3.58Å; Y19-F51 HydrophobicContact CE2-CG 4.36Å; Y19-F51 WeakPolarHBondContact CE2-O 2.98Å; Y19-F51 VanDerWaalsContact OH-C 3.25Å; Y19-F51 PolarHBondContact OH-O 3.42Å; K23-F51 HydrophobicContact CB-CD1 4.3Å; K23-F51 HydrophobicContact CB-CE1 4.44Å; Y26-F51 HydrophobicContact CD1-CD2 4.21Å; Y26-F51 AromaticContact CD1-CE2 3.9Å; Y26-F51 HydrophobicContact CD1-CE2 3.9Å; Y26-F51 AromaticContact CD2-CE2 3.7Å; Y26-F51 HydrophobicContact CD2-CE2 3.7Å; Y26-F51 HydrophobicContact CD2-CZ 4.37Å; Y26-F51 HydrophobicContact CE1-CE2 4.42Å; Y26-F51 HydrophobicContact CE2-CE2 4.22Å; Y26-F51 HydrophobicContact CG-CD2 4.28Å; Y26-F51 AromaticContact CG-CE2 3.51Å; Y26-F51 HydrophobicContact CG-CE2 3.51Å; Y26-F51 HydrophobicContact CG-CZ 4.12Å; S47-F51 WeakPolarHBondContact O-CD2 3.38Å; S47-F51 PolarHBondContact O-N 3.17Å; E48-F51 CarbonylContact O-C 3.54Å; E48-F51 WeakPolarHBondContact O-CA 3.43Å; E48-F51 PolarHBondContact O-N 3.39Å; Q49-F51 PolarHBondContact O-N 3.2Å; F51-P54 VanDerWaalsContact C-CD 3.41Å; F51-P54 WeakPolarHBondContact O-CD 3.24Å; F51-P54 WeakPolarHBondContact O-CG 3.14Å
52D60.1Low58.1Low109 Ų10993.5 Ų93.558%0.58347%0.466SS*.Hα-helixtrans-79.9-26.7-178.5-69.4-39000113.5E48 Q49 P54E48-D52 PolarHBondContact O-N 3.25Å; Q49-D52 PolarHBondContact O-N 3.47Å; D52-P54 VanDerWaalsContact C-CD 3.4Å
53E57Low57.6Low132 Ų13293.8 Ų93.862%0.61746%0.458SS*.SBendtrans-78.5-25.8-179.4-76.7-177.175.900119.5Q49 V55 T56 F57Q49-E53 PolarHBondContact O-N 3.49Å; Q49-E53 VanDerWaalsContact O-N 3.15Å; E53-V55 VanDerWaalsContact C-N 3.29Å; E53-V55 PolarHBondContact O-N 3.14Å; E53-T56 PolarHBondContact O-N 3.37Å; E53-T56 PolarHBondContact O-OG1 3.37Å; E53-F57 PolarHBondContact O-N 2.72Å
54P54.2Low57.2Low32 Ų3292.8 Ų92.821%0.20846%0.456CS..Hα-helixtrans-77-15.1-172.832-30000112.6Y19 F50 F51 D52 T56 F57 L58Y19-P54 HydrophobicContact CD2-CB 4.43Å; Y19-P54 HydrophobicContact CD2-CG 3.57Å; Y19-P54 HydrophobicContact CE2-CB 4.46Å; Y19-P54 HydrophobicContact CE2-CG 3.22Å; F50-P54 WeakPolarHBondContact O-CD 3.44Å; F50-P54 WeakPolarHBondContact O-CG 3.2Å; F51-P54 VanDerWaalsContact C-CD 3.41Å; F51-P54 WeakPolarHBondContact O-CD 3.24Å; F51-P54 WeakPolarHBondContact O-CG 3.14Å; D52-P54 VanDerWaalsContact C-CD 3.4Å; P54-T56 PolarHBondContact O-N 3.24Å; P54-F57 PolarHBondContact O-N 3.45Å; P54-L58 VanDerWaalsContact O-CB 3.32Å; P54-L58 WeakPolarHBondContact O-CB 3.06Å; P54-L58 WeakPolarHBondContact O-CG 3.38Å; P54-L58 PolarHBondContact O-N 2.84Å
55V52.4Low56.7Low74 Ų7498.2 Ų98.245%0.44848%0.483SS..Hα-helixtrans-63.7-38.1171.3-178.60000109.8E53 Q59E53-V55 VanDerWaalsContact C-N 3.29Å; E53-V55 PolarHBondContact O-N 3.14Å; V55-Q59 WeakPolarHBondContact O-CG 3.47Å; V55-Q59 PolarHBondContact O-N 2.82Å
56T52.4Low56.1Low87 Ų8794.3 Ų94.353%0.53448%0.475SS..Hα-helixtrans-69.7-42.4175.9-26.60000110.7E53 P54 Q59 V60E53-T56 PolarHBondContact O-N 3.37Å; E53-T56 PolarHBondContact O-OG1 3.37Å; P54-T56 PolarHBondContact O-N 3.24Å; T56-Q59 PolarHBondContact O-N 2.91Å; T56-V60 VanDerWaalsContact O-CG2 3.22Å; T56-V60 WeakPolarHBondContact O-CG2 3.36Å; T56-V60 PolarHBondContact O-N 3.08Å; T56-V60 VanDerWaalsContact O-N 3.09Å
57F49.1Very low55.4Low135 Ų13592.9 Ų92.959%0.59247%0.473SS*.Hα-helixtrans-66.4-39.8179.1-169.8-104.5000112.9E53 P54 Q59 V60 L61E53-F57 PolarHBondContact O-N 2.72Å; P54-F57 PolarHBondContact O-N 3.45Å; F57-Q59 VanDerWaalsContact C-N 3.29Å; F57-Q59 PolarHBondContact O-N 3.18Å; F57-V60 PolarHBondContact O-N 2.83Å; F57-L61 HydrophobicContact CD1-CD1 3.83Å; F57-L61 HydrophobicContact CE1-CD1 3.29Å; F57-L61 HydrophobicContact CE1-CG 4.19Å; F57-L61 HydrophobicContact CZ-CD1 3.77Å; F57-L61 HydrophobicContact CZ-CG 4.29Å; F57-L61 PolarHBondContact O-N 2.91Å; F57-L61 VanDerWaalsContact O-N 3.14Å
58L47.7Very low54.7Low35 Ų3598.5 Ų98.518%0.18350%0.5CS..Hα-helixtrans-71.4-19.8176.4-76.7165.1000113.8L15 P54L15-L58 HydrophobicContact CB-CD1 4.45Å; L15-L58 HydrophobicContact CB-CD2 3.81Å; L15-L58 HydrophobicContact CD1-CD2 3.64Å; L15-L58 HydrophobicContact CG-CD2 4.3Å; P54-L58 VanDerWaalsContact O-CB 3.32Å; P54-L58 WeakPolarHBondContact O-CB 3.06Å; P54-L58 WeakPolarHBondContact O-CG 3.38Å; P54-L58 PolarHBondContact O-N 2.84Å
59Q47.5Very low53.9Low155 Ų155100.7 Ų100.772%0.72451%0.513SS*.Hα-helixtrans-86.9-22.1171.9-76.7-179-25.500112.9V55 T56 F57V55-Q59 WeakPolarHBondContact O-CG 3.47Å; V55-Q59 PolarHBondContact O-N 2.82Å; T56-Q59 PolarHBondContact O-N 2.91Å; F57-Q59 VanDerWaalsContact C-N 3.29Å; F57-Q59 PolarHBondContact O-N 3.18Å
60V49.4Very low52.9Low122 Ų12299.2 Ų99.274%0.73951%0.51SS*.Hα-helixtrans-85.2-28.7179.31700000112.2T56 F57T56-V60 VanDerWaalsContact O-CG2 3.22Å; T56-V60 WeakPolarHBondContact O-CG2 3.36Å; T56-V60 PolarHBondContact O-N 3.08Å; T56-V60 VanDerWaalsContact O-N 3.09Å; F57-V60 PolarHBondContact O-N 2.83Å
61L43.2Very low52.1Low154 Ų15497.3 Ų97.381%0.80651%0.508SS*.  trans-77.60169.9-78.1170.2000111.7F57F57-L61 HydrophobicContact CD1-CD1 3.83Å; F57-L61 HydrophobicContact CE1-CD1 3.29Å; F57-L61 HydrophobicContact CE1-CG 4.19Å; F57-L61 HydrophobicContact CZ-CD1 3.77Å; F57-L61 HydrophobicContact CZ-CG 4.29Å; F57-L61 PolarHBondContact O-N 2.91Å; F57-L61 VanDerWaalsContact O-N 3.14Å

Retrieved 61 of 61 residues in 17.5 ms (Link to these results)

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