X2JEK2_DROME Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession X2JEK2, Species DROME (Drosophila melanogaster, Fruit fly), Gene CG15366, Length 127 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
1M42.8Very low62.4Low238 Ų238117.5 Ų117.5100%1.17256%0.561SS**  0103.30-72.5176.7175.400106.9F3M1-F3 PolarHBondContact O-N 2.92Å
2E49Very low63.3Low190 Ų190116.6 Ų116.689%0.88856%0.56SS**  trans-71.596.1179.3-152.4165.5115.500106.9N4E2-N4 PolarHBondContact O-N 2.71Å
3F52.7Low63.7Low132 Ų132110.7 Ų110.758%0.57953%0.531SS*.  trans-68.588.8176.6-147.5-92.3000106.3M1 N5 L8M1-F3 PolarHBondContact O-N 2.92Å; F3-N5 PolarHBondContact O-N 3.34Å; F3-L8 HydrophobicContact CD1-CD1 3.9Å; F3-L8 HydrophobicContact CD1-CD2 4.28Å; F3-L8 HydrophobicContact CD1-CG 3.69Å; F3-L8 HydrophobicContact CE1-CD1 4.4Å; F3-L8 HydrophobicContact CE1-CD2 3.95Å; F3-L8 HydrophobicContact CE1-CG 3.74Å
4N67.8Low64.2Low76 Ų76105.2 Ų105.241%0.40651%0.506SS..  trans-59124-167.3-163.36.6000108.7E2 R6 L7E2-N4 PolarHBondContact O-N 2.71Å; N4-R6 PolarHBondContact O-N 3.23Å; N4-L7 PolarHBondContact O-N 3.2Å
5N64.4Low65Low131 Ų131103.5 Ų103.570%0.70151%0.505SS*.Hα-helixtrans-48.8-25.1-179.7-79.7-3.2000113.2F3 L9F3-N5 PolarHBondContact O-N 3.34Å; N5-L9 PolarHBondContact O-N 3.42Å; N5-L9 VanDerWaalsContact O-N 3.11Å
6R65.1Low65.4Low186 Ų186101.4 Ų101.470%0.70249%0.492SS*.Hα-helixtrans-64.2-38172.6-83.7-158.3-95.3-111.41115.1N4 K10N4-R6 PolarHBondContact O-N 3.23Å; R6-K10 PolarHBondContact O-N 2.98Å
7L68.3Low65.7Low58 Ų5895.5 Ų95.530%0.30446%0.463SS..Hα-helixtrans-72-42.4177.7-89.5166.3000110.9N4 L9 K10 I11 H57 V58N4-L7 PolarHBondContact O-N 3.2Å; L7-L9 VanDerWaalsContact C-N 3.28Å; L7-L9 PolarHBondContact O-N 2.96Å; L7-K10 PolarHBondContact O-N 3.44Å; L7-I11 WeakPolarHBondContact O-CG1 3.4Å; L7-I11 PolarHBondContact O-N 2.77Å; L7-H57 HydrophobicContact CD2-CB 4.44Å; L7-V58 HydrophobicContact CD2-CG2 4.42Å
8L66.9Low66.3Low74 Ų7493.1 Ų93.139%0.38746%0.455SS..Hα-helixtrans-57-43.9174.1-88.6166.2000111.7F3 K10 I11 I12F3-L8 HydrophobicContact CD1-CD1 3.9Å; F3-L8 HydrophobicContact CD1-CD2 4.28Å; F3-L8 HydrophobicContact CD1-CG 3.69Å; F3-L8 HydrophobicContact CE1-CD1 4.4Å; F3-L8 HydrophobicContact CE1-CD2 3.95Å; F3-L8 HydrophobicContact CE1-CG 3.74Å; L8-K10 PolarHBondContact O-N 3.27Å; L8-I11 PolarHBondContact O-N 3.49Å; L8-I12 WeakPolarHBondContact O-CB 3.38Å; L8-I12 WeakPolarHBondContact O-CD1 3.33Å; L8-I12 VanDerWaalsContact O-CG1 3.23Å; L8-I12 WeakPolarHBondContact O-CG1 3.29Å; L8-I12 PolarHBondContact O-N 3.06Å
9L67.4Low66.6Low77 Ų7792.1 Ų92.140%0.40346%0.455SS..Hα-helixtrans-60.6-44.9178.8-153.1101.2000112N5 L7 I11 I12 E13N5-L9 PolarHBondContact O-N 3.42Å; N5-L9 VanDerWaalsContact O-N 3.11Å; L7-L9 VanDerWaalsContact C-N 3.28Å; L7-L9 PolarHBondContact O-N 2.96Å; L9-I11 PolarHBondContact O-N 3.41Å; L9-I12 PolarHBondContact O-N 3.45Å; L9-E13 WeakPolarHBondContact O-CG 3.47Å; L9-E13 PolarHBondContact O-N 2.96Å
10K68.4Low66.6Low45 Ų4587.7 Ų87.720%0.19643%0.434CS..Hα-helixtrans-64.2-39.2177.8-80.1-178.9166.3173.40112.9R6 L7 L8 L14 H57 D68R6-K10 PolarHBondContact O-N 2.98Å; L7-K10 PolarHBondContact O-N 3.44Å; L8-K10 PolarHBondContact O-N 3.27Å; K10-L14 WeakPolarHBondContact O-CB 3.43Å; K10-L14 PolarHBondContact O-N 3.14Å; K10-H57 PolarHBondContact NZ-CD2 2.9Å; K10-H57 PolarHBondContact NZ-CE1 3.46Å; K10-H57 PolarHBondContact NZ-NE2 2.95Å; K10-D68 VanDerWaalsContact CE-OD2 3.23Å; K10-D68 WeakPolarHBondContact CE-OD2 3.47Å; K10-D68 IonicContact NZ-OD1 3.95Å; K10-D68 IonicContact NZ-OD2 2.64Å; K10-D68 PolarHBondContact NZ-OD2 2.77Å
11I73.2Confident66.8Low85 Ų8584.1 Ų84.144%0.43642%0.417SS..Hα-helixtrans-66.5-44.1176.8-66.5168.9000110.2L7 L8 L9 E13 L14 V15L7-I11 WeakPolarHBondContact O-CG1 3.4Å; L7-I11 PolarHBondContact O-N 2.77Å; L8-I11 PolarHBondContact O-N 3.49Å; L9-I11 PolarHBondContact O-N 3.41Å; I11-E13 PolarHBondContact O-N 3.06Å; I11-L14 PolarHBondContact O-N 3.46Å; I11-V15 HydrophobicContact CG2-CG2 4.46Å; I11-V15 WeakPolarHBondContact O-CG2 3.42Å; I11-V15 PolarHBondContact O-N 3.47Å
12I73.4Confident68.2Low107 Ų10777.7 Ų77.755%0.54939%0.386SS..Hα-helixtrans-61.4-44.5177.1-69.5165000110.7L8 L9 L14 V15 F16L8-I12 WeakPolarHBondContact O-CB 3.38Å; L8-I12 WeakPolarHBondContact O-CD1 3.33Å; L8-I12 VanDerWaalsContact O-CG1 3.23Å; L8-I12 WeakPolarHBondContact O-CG1 3.29Å; L8-I12 PolarHBondContact O-N 3.06Å; L9-I12 PolarHBondContact O-N 3.45Å; I12-L14 VanDerWaalsContact C-N 3.33Å; I12-L14 PolarHBondContact O-N 3.23Å; I12-V15 PolarHBondContact O-N 3.46Å; I12-F16 WeakPolarHBondContact O-CB 3.47Å; I12-F16 PolarHBondContact O-N 2.86Å
13E68.7Low69.1Low40 Ų4070.7 Ų70.719%0.18735%0.354CS..Hα-helixtrans-61.1-42175.6-76.8-175.5149.100112L9 I11 F16 I17L9-E13 WeakPolarHBondContact O-CG 3.47Å; L9-E13 PolarHBondContact O-N 2.96Å; I11-E13 PolarHBondContact O-N 3.06Å; E13-F16 PolarHBondContact O-N 3.16Å; E13-I17 VanDerWaalsContact O-CG1 3.26Å; E13-I17 WeakPolarHBondContact O-CG1 3.42Å; E13-I17 PolarHBondContact O-N 2.96Å; E13-I17 VanDerWaalsContact O-N 3.11Å
14L71.3Confident69.7Low34 Ų3465.5 Ų65.518%0.17833%0.332CS..Hα-helixtrans-65.8-45.4-179.9-165.6123.7000111.8K10 I11 I12 F16 I17 V18 C50K10-L14 WeakPolarHBondContact O-CB 3.43Å; K10-L14 PolarHBondContact O-N 3.14Å; I11-L14 PolarHBondContact O-N 3.46Å; I12-L14 VanDerWaalsContact C-N 3.33Å; I12-L14 PolarHBondContact O-N 3.23Å; L14-F16 VanDerWaalsContact C-N 3.28Å; L14-F16 PolarHBondContact O-N 3.43Å; L14-I17 PolarHBondContact O-N 3.21Å; L14-V18 VanDerWaalsContact O-CG2 3.28Å; L14-V18 WeakPolarHBondContact O-CG2 3.36Å; L14-V18 PolarHBondContact O-N 2.93Å; L14-V18 VanDerWaalsContact O-N 3.09Å; L14-C50 HydrophobicContact CD1-CB 4.22Å
15V76.1Confident69.8Low80 Ų8067.4 Ų67.449%0.48534%0.339SS..Hα-helixtrans-58.2-42.9175.61690000110.7I11 I12 I17 V18 T19I11-V15 HydrophobicContact CG2-CG2 4.46Å; I11-V15 WeakPolarHBondContact O-CG2 3.42Å; I11-V15 PolarHBondContact O-N 3.47Å; I12-V15 PolarHBondContact O-N 3.46Å; V15-I17 PolarHBondContact O-N 3.17Å; V15-V18 PolarHBondContact O-N 3.36Å; V15-T19 PolarHBondContact O-N 3.45Å; V15-T19 PolarHBondContact O-OG1 3.45Å; V15-T19 VanDerWaalsContact O-OG1 3.08Å
16F70.6Confident69.7Low70 Ų7064.8 Ų64.831%0.30733%0.331SS..Hα-helixtrans-68.2-35.5-177.9-156.6-75.4000112.8I12 E13 L14 S20 L109 N113I12-F16 WeakPolarHBondContact O-CB 3.47Å; I12-F16 PolarHBondContact O-N 2.86Å; E13-F16 PolarHBondContact O-N 3.16Å; L14-F16 VanDerWaalsContact C-N 3.28Å; L14-F16 PolarHBondContact O-N 3.43Å; F16-S20 PolarHBondContact O-N 3.19Å; F16-S20 VanDerWaalsContact O-N 3.09Å; F16-S20 PolarHBondContact O-OG 3.2Å; F16-L109 HydrophobicContact CD1-CD2 4.47Å; F16-L109 HydrophobicContact CE1-CD1 4.46Å; F16-L109 HydrophobicContact CE1-CD2 3.66Å; F16-L109 HydrophobicContact CE1-CG 3.62Å; F16-L109 HydrophobicContact CZ-CD1 3.95Å; F16-L109 HydrophobicContact CZ-CD2 3.87Å; F16-L109 HydrophobicContact CZ-CG 3.59Å; F16-N113 WeakPolarHBondContact CD1-ND2 3.36Å; F16-N113 WeakPolarHBondContact CD1-OD1 3.35Å; F16-N113 WeakPolarHBondContact CE1-ND2 3.43Å; F16-N113 WeakPolarHBondContact CE1-OD1 3.49Å
17I71.4Confident69.6Low0 Ų057.2 Ų57.20%030%0.304CS..Hα-helixtrans-62.7-48.5171.8-60.5159.7000110.1E13 L14 V15 T19 S20 I21 Y46 L47 F79 R117E13-I17 VanDerWaalsContact O-CG1 3.26Å; E13-I17 WeakPolarHBondContact O-CG1 3.42Å; E13-I17 PolarHBondContact O-N 2.96Å; E13-I17 VanDerWaalsContact O-N 3.11Å; L14-I17 PolarHBondContact O-N 3.21Å; V15-I17 PolarHBondContact O-N 3.17Å; I17-T19 VanDerWaalsContact C-N 3.33Å; I17-T19 PolarHBondContact O-N 3.04Å; I17-S20 WeakPolarHBondContact O-CB 3.47Å; I17-S20 PolarHBondContact O-N 3.42Å; I17-S20 VanDerWaalsContact O-N 3.1Å; I17-I21 HydrophobicContact CG2-CD1 4.05Å; I17-I21 HydrophobicContact CG2-CG1 4.36Å; I17-I21 WeakPolarHBondContact O-CG1 3.44Å; I17-I21 PolarHBondContact O-N 3.38Å; I17-Y46 HydrophobicContact CD1-CE1 4.27Å; I17-L47 HydrophobicContact CG2-CD1 4.05Å; I17-L47 HydrophobicContact CG2-CG 4.36Å; I17-F79 HydrophobicContact CG1-CE2 4.17Å; I17-F79 HydrophobicContact CG2-CE2 4.21Å; I17-R117 VanDerWaalsContact CG1-NH2 3.33Å
18V75Confident69.2Low52 Ų5256.8 Ų56.832%0.31531%0.306SS..Hα-helixtrans-57.1-48-178.71730000110.3L14 V15 S20 I21 I22 L47L14-V18 VanDerWaalsContact O-CG2 3.28Å; L14-V18 WeakPolarHBondContact O-CG2 3.36Å; L14-V18 PolarHBondContact O-N 2.93Å; L14-V18 VanDerWaalsContact O-N 3.09Å; V15-V18 PolarHBondContact O-N 3.36Å; V18-S20 VanDerWaalsContact C-N 3.31Å; V18-S20 PolarHBondContact O-N 3.05Å; V18-I21 PolarHBondContact O-N 2.92Å; V18-I22 HydrophobicContact CG1-CD1 3.76Å; V18-I22 HydrophobicContact CG1-CG1 4.49Å; V18-I22 WeakPolarHBondContact O-CG1 3.25Å; V18-I22 PolarHBondContact O-N 3.22Å; V18-L47 HydrophobicContact CG2-CD1 3.8Å; V18-L47 HydrophobicContact CG2-CD2 4.44Å; V18-L47 HydrophobicContact CG2-CG 4.45Å
19T71.9Confident68.6Low74 Ų7459.1 Ų59.145%0.45432%0.318SS..Hα-helixtrans-60.8-39.9177-52.20000112.2V15 I17 I21 I22 L23V15-T19 PolarHBondContact O-N 3.45Å; V15-T19 PolarHBondContact O-OG1 3.45Å; V15-T19 VanDerWaalsContact O-OG1 3.08Å; I17-T19 VanDerWaalsContact C-N 3.33Å; I17-T19 PolarHBondContact O-N 3.04Å; T19-I21 VanDerWaalsContact C-N 3.35Å; T19-I21 PolarHBondContact O-N 3.01Å; T19-I22 PolarHBondContact O-N 3.05Å; T19-L23 WeakPolarHBondContact O-CB 3.23Å; T19-L23 PolarHBondContact O-N 3.46Å
20S67.8Low67.8Low5 Ų563.6 Ų63.64%0.03534%0.339CS..Hα-helixtrans-64.6-39177.9-54.70000111.9F16 I17 V18 I24 N113F16-S20 PolarHBondContact O-N 3.19Å; F16-S20 VanDerWaalsContact O-N 3.09Å; F16-S20 PolarHBondContact O-OG 3.2Å; I17-S20 WeakPolarHBondContact O-CB 3.47Å; I17-S20 PolarHBondContact O-N 3.42Å; I17-S20 VanDerWaalsContact O-N 3.1Å; V18-S20 VanDerWaalsContact C-N 3.31Å; V18-S20 PolarHBondContact O-N 3.05Å; S20-I24 WeakPolarHBondContact O-CD1 3.5Å; S20-I24 WeakPolarHBondContact O-CG1 3.44Å; S20-I24 PolarHBondContact O-N 2.87Å; S20-N113 PolarHBondContact OG-ND2 2.93Å; S20-N113 VanDerWaalsContact OG-ND2 3.11Å
21I71.4Confident67Low13 Ų1363.7 Ų63.77%0.06734%0.344CS..Hα-helixtrans-67.7-47177.5-67.2-177.2000111I17 V18 T19 L23 I24 E25 L43 L47I17-I21 HydrophobicContact CG2-CD1 4.05Å; I17-I21 HydrophobicContact CG2-CG1 4.36Å; I17-I21 WeakPolarHBondContact O-CG1 3.44Å; I17-I21 PolarHBondContact O-N 3.38Å; V18-I21 PolarHBondContact O-N 2.92Å; T19-I21 VanDerWaalsContact C-N 3.35Å; T19-I21 PolarHBondContact O-N 3.01Å; I21-L23 PolarHBondContact O-N 3.42Å; I21-I24 PolarHBondContact O-N 3.41Å; I21-I24 VanDerWaalsContact O-N 3.13Å; I21-E25 WeakPolarHBondContact O-CB 3.45Å; I21-E25 PolarHBondContact O-N 3.37Å; I21-L43 HydrophobicContact CD1-CB 4.05Å; I21-L43 HydrophobicContact CG1-CB 4.3Å; I21-L47 HydrophobicContact CD1-CB 4.3Å; I21-L47 HydrophobicContact CD1-CD1 3.42Å; I21-L47 VanDerWaalsContact CD1-CD1 3.42Å; I21-L47 HydrophobicContact CD1-CG 4.49Å
22I71.9Confident66.1Low102 Ų10266.6 Ų66.652%0.52335%0.354SS..Hα-helixtrans-59.2-40.8178.1-65165.4000110.3V18 T19 E25 S26V18-I22 HydrophobicContact CG1-CD1 3.76Å; V18-I22 HydrophobicContact CG1-CG1 4.49Å; V18-I22 WeakPolarHBondContact O-CG1 3.25Å; V18-I22 PolarHBondContact O-N 3.22Å; T19-I22 PolarHBondContact O-N 3.05Å; I22-E25 PolarHBondContact O-N 2.92Å; I22-S26 WeakPolarHBondContact O-CB 3.41Å; I22-S26 PolarHBondContact O-N 2.63Å
23L67.4Low65.2Low44 Ų4468.3 Ų68.323%0.2336%0.363CS..Hα-helixtrans-66.2-38.7177.6-170.765.3000112.2T19 I21 I27 L102T19-L23 WeakPolarHBondContact O-CB 3.23Å; T19-L23 PolarHBondContact O-N 3.46Å; I21-L23 PolarHBondContact O-N 3.42Å; L23-I27 WeakPolarHBondContact O-CD1 3.46Å; L23-I27 WeakPolarHBondContact O-CG1 3.38Å; L23-L102 HydrophobicContact CD1-CD1 4.07Å; L23-L102 HydrophobicContact CD1-CG 4.35Å
24I66.1Low64.4Low23 Ų2376.5 Ų76.512%0.11839%0.392CS..Hα-helixtrans-67.6-42.6175-71.5162.3000110.9S20 I21 I27 S28 L43 I86S20-I24 WeakPolarHBondContact O-CD1 3.5Å; S20-I24 WeakPolarHBondContact O-CG1 3.44Å; S20-I24 PolarHBondContact O-N 2.87Å; I21-I24 PolarHBondContact O-N 3.41Å; I21-I24 VanDerWaalsContact O-N 3.13Å; I24-I27 PolarHBondContact O-N 2.97Å; I24-S28 WeakPolarHBondContact O-CB 3.23Å; I24-S28 PolarHBondContact O-N 3.49Å; I24-S28 VanDerWaalsContact O-N 3.16Å; I24-L43 HydrophobicContact CD1-CD1 4.08Å; I24-I86 HydrophobicContact CD1-CD1 3.72Å; I24-I86 HydrophobicContact CG1-CD1 3.85Å
25E68.2Low63.7Low116 Ų11679.6 Ų79.654%0.54241%0.405SS..Hα-helixtrans-62.3-44.5178.5-165.3-174.1146.600111I21 I22 I27 S28I21-E25 WeakPolarHBondContact O-CB 3.45Å; I21-E25 PolarHBondContact O-N 3.37Å; I22-E25 PolarHBondContact O-N 2.92Å; E25-I27 PolarHBondContact O-N 3.47Å; E25-S28 PolarHBondContact O-N 3Å
26S64.1Low62.9Low75 Ų7577.1 Ų77.152%0.52439%0.393SS..THydrogen-bonded Turntrans-60.9-16.2177.2-177.50000114.4I22I22-S26 WeakPolarHBondContact O-CB 3.41Å; I22-S26 PolarHBondContact O-N 2.63Å
27I61Low62.4Low28 Ų2879.6 Ų79.614%0.14441%0.409CS..THydrogen-bonded Turntrans-101.9-19.6177.3-60.2163.8000111.1L23 I24 E25 D29 W90 L102 L103L23-I27 WeakPolarHBondContact O-CD1 3.46Å; L23-I27 WeakPolarHBondContact O-CG1 3.38Å; I24-I27 PolarHBondContact O-N 2.97Å; E25-I27 PolarHBondContact O-N 3.47Å; I27-D29 PolarHBondContact O-N 3.46Å; I27-D29 VanDerWaalsContact O-N 3.13Å; I27-W90 HydrophobicContact CG2-CH2 3.9Å; I27-W90 HydrophobicContact CG2-CZ2 4.1Å; I27-W90 HydrophobicContact CG2-CZ3 4.18Å; I27-W90 WeakPolarHBondContact O-CH2 3.33Å; I27-L102 HydrophobicContact CD1-CD2 4.09Å; I27-L102 HydrophobicContact CD1-CG 4.08Å; I27-L102 HydrophobicContact CG1-CD2 3.78Å; I27-L102 HydrophobicContact CG1-CG 4.34Å; I27-L103 HydrophobicContact CD1-CD2 4.17Å; I27-L103 HydrophobicContact CD1-CG 4.27Å; I27-L103 HydrophobicContact CG2-CD1 4.23Å; I27-L103 HydrophobicContact CG2-CD2 3.57Å; I27-L103 HydrophobicContact CG2-CG 3.88Å
28S60.1Low62.1Low49 Ų4985.4 Ų85.434%0.34344%0.439SS..THydrogen-bonded Turntrans-79.99.6-170.4-165.70000114.2I24 E25 M30I24-S28 WeakPolarHBondContact O-CB 3.23Å; I24-S28 PolarHBondContact O-N 3.49Å; I24-S28 VanDerWaalsContact O-N 3.16Å; E25-S28 PolarHBondContact O-N 3Å; S28-M30 VanDerWaalsContact C-N 3.26Å; S28-M30 PolarHBondContact O-N 3.34Å; S28-M30 VanDerWaalsContact O-N 3.11Å
29D54.4Low61.8Low122 Ų12284 Ų8465%0.65243%0.431SS*.THydrogen-bonded Turntrans-62-22-169.3-95.9-58.5000115I27I27-D29 PolarHBondContact O-N 3.46Å; I27-D29 VanDerWaalsContact O-N 3.13Å
30M50.6Low61.6Low171 Ų17182.5 Ų82.584%0.84242%0.419SS*.SBendtrans-142.9-1.3-170.9-80.2-62.1153.200120.4S28S28-M30 VanDerWaalsContact C-N 3.26Å; S28-M30 PolarHBondContact O-N 3.34Å; S28-M30 VanDerWaalsContact O-N 3.11Å
31T51.4Low61.6Low47 Ų4784.2 Ų84.229%0.28844%0.437SS..SBendtrans-144.9119.6-17333.10000115.7W90 Y93T31-W90 WeakPolarHBondContact OG1-CH2 3.41Å; T31-Y93 HydrophobicContact CG2-CD1 4.49Å; T31-Y93 HydrophobicContact CG2-CE1 3.77Å
32F54.7Low61.6Low146 Ų14686.8 Ų86.864%0.6445%0.453SS*.  trans78.362.4168.7-118.3-90.2000117.8R34 H35 A36F32-R34 PolarHBondContact O-N 3.06Å; F32-H35 AromaticContact CD1-CD2 3.8Å; F32-H35 AromaticContact CE1-CD2 3.83Å; F32-H35 PolarHBondContact O-N 2.99Å; F32-A36 PolarHBondContact O-N 3.34Å
33I55Low61.5Low144 Ų14482 Ų8274%0.73843%0.429SS*.Hα-helixtrans-42.9-33.7179.6-61.5165000114.7L37I33-L37 WeakPolarHBondContact O-CB 3.36Å; I33-L37 PolarHBondContact O-N 3.31Å
34R52.8Low61.8Low212 Ų21283.2 Ų83.280%0.844%0.435SS*.Hα-helixtrans-80-43.8-173.5-82.2-178.1151.6-148-4.6115.1F32F32-R34 PolarHBondContact O-N 3.06Å
35H54.8Low62.1Low98 Ų9883.8 Ų83.845%0.45445%0.446SS..Hα-helixtrans-82-36.3-178.7-72.8-79.8000111.4F32 V39F32-H35 AromaticContact CD1-CD2 3.8Å; F32-H35 AromaticContact CE1-CD2 3.83Å; F32-H35 PolarHBondContact O-N 2.99Å; H35-V39 WeakPolarHBondContact O-CG2 3.44Å; H35-V39 PolarHBondContact O-N 2.94Å
36A60.4Low62.3Low28 Ų2879 Ų7923%0.23142%0.423CS..Hα-helixtrans-65.4-43.8175.400000111.9F32 L38 V39 H40F32-A36 PolarHBondContact O-N 3.34Å; A36-L38 PolarHBondContact O-N 3.2Å; A36-V39 PolarHBondContact O-N 3.2Å; A36-H40 WeakPolarHBondContact O-CB 3.31Å; A36-H40 PolarHBondContact O-N 3.37Å
37L60.5Low62.7Low123 Ų12377.4 Ų77.464%0.64441%0.408SS*.Hα-helixtrans-64.8-38.7179.6-172.899000112.7I33 G41I33-L37 WeakPolarHBondContact O-CB 3.36Å; I33-L37 PolarHBondContact O-N 3.31Å; L37-G41 PolarHBondContact O-N 2.64Å
38L65.2Low63.4Low121 Ų12180.9 Ų80.963%0.63443%0.426SS*.Hα-helixtrans-64.2-47.7177.1-109.8164.1000111.4A36 T42A36-L38 PolarHBondContact O-N 3.2Å; L38-T42 PolarHBondContact O-N 3Å; L38-T42 PolarHBondContact O-OG1 2.89Å
39V66.9Low64.2Low23 Ų2381.7 Ų81.714%0.13943%0.429CS..Hα-helixtrans-63.4-45.5177.9172.50000110.6H35 A36 T42 L43 A82 I85H35-V39 WeakPolarHBondContact O-CG2 3.44Å; H35-V39 PolarHBondContact O-N 2.94Å; A36-V39 PolarHBondContact O-N 3.2Å; V39-T42 WeakPolarHBondContact CA-OG1 3.48Å; V39-T42 PolarHBondContact O-N 3.05Å; V39-T42 PolarHBondContact O-OG1 3.24Å; V39-L43 HydrophobicContact CG1-CD1 3.83Å; V39-L43 WeakPolarHBondContact O-CB 3.4Å; V39-L43 PolarHBondContact O-N 3.4Å; V39-A82 HydrophobicContact CG1-CB 3.82Å; V39-I85 HydrophobicContact CG2-CD1 4.25Å
40H68.8Low65Low43 Ų4376.8 Ų76.820%0.19940%0.404CS..Hα-helixtrans-64.8-43.4-179.9-164.278.9000112.1A36 T42 L43 I44A36-H40 WeakPolarHBondContact O-CB 3.31Å; A36-H40 PolarHBondContact O-N 3.37Å; H40-T42 PolarHBondContact O-N 2.96Å; H40-L43 PolarHBondContact O-N 3.15Å; H40-I44 WeakPolarHBondContact CD2-CD1 3.47Å; H40-I44 WeakPolarHBondContact NE2-CD1 3.22Å; H40-I44 WeakPolarHBondContact O-CG1 3.36Å; H40-I44 PolarHBondContact O-N 2.95Å
41G67.7Low66.1Low41 Ų4174.3 Ų74.342%0.42339%0.389SS..Hα-helixtrans-61.8-41.1175.100000112.9L37 G45L37-G41 PolarHBondContact O-N 2.64Å; G41-G45 PolarHBondContact O-N 3.15Å
42T72.1Confident67.2Low67 Ų6776.6 Ų76.641%0.41140%0.403SS..Hα-helixtrans-68.5-36.8175480000113.1L38 V39 H40 G45 Y46 L78L38-T42 PolarHBondContact O-N 3Å; L38-T42 PolarHBondContact O-OG1 2.89Å; V39-T42 WeakPolarHBondContact CA-OG1 3.48Å; V39-T42 PolarHBondContact O-N 3.05Å; V39-T42 PolarHBondContact O-OG1 3.24Å; H40-T42 PolarHBondContact O-N 2.96Å; T42-G45 PolarHBondContact O-N 3.26Å; T42-Y46 WeakPolarHBondContact O-CB 3.48Å; T42-Y46 PolarHBondContact O-N 3.17Å; T42-L78 WeakPolarHBondContact O-CD2 3.09Å
43L68.4Low67.9Low2 Ų271.1 Ų71.11%0.0138%0.38CS..Hα-helixtrans-65.9-42.7175.4-84.5161.5000112.1I21 I24 V39 H40 Y46 L47 F79 A82I21-L43 HydrophobicContact CD1-CB 4.05Å; I21-L43 HydrophobicContact CG1-CB 4.3Å; I24-L43 HydrophobicContact CD1-CD1 4.08Å; V39-L43 HydrophobicContact CG1-CD1 3.83Å; V39-L43 WeakPolarHBondContact O-CB 3.4Å; V39-L43 PolarHBondContact O-N 3.4Å; H40-L43 PolarHBondContact O-N 3.15Å; L43-Y46 WeakPolarHBondContact O-CB 3.11Å; L43-Y46 PolarHBondContact O-N 3.29Å; L43-L47 PolarHBondContact O-N 3.35Å; L43-F79 HydrophobicContact CD2-CD2 4.41Å; L43-F79 HydrophobicContact CD2-CE2 4.08Å; L43-F79 HydrophobicContact CD2-CZ 4.41Å; L43-A82 HydrophobicContact CD1-CB 4.36Å
44I73.8Confident68.5Low69 Ų6965.6 Ų65.635%0.35436%0.355SS..Hα-helixtrans-63.7-46.1175.1-73.4164.6000111H40 Y46 L47 I48H40-I44 WeakPolarHBondContact CD2-CD1 3.47Å; H40-I44 WeakPolarHBondContact NE2-CD1 3.22Å; H40-I44 WeakPolarHBondContact O-CG1 3.36Å; H40-I44 PolarHBondContact O-N 2.95Å; I44-Y46 PolarHBondContact O-N 3.42Å; I44-L47 WeakPolarHBondContact O-CB 3.15Å; I44-L47 PolarHBondContact O-N 3.02Å; I44-I48 HydrophobicContact CG2-CD1 3.88Å; I44-I48 HydrophobicContact CG2-CG1 4.48Å; I44-I48 WeakPolarHBondContact O-CG1 3.26Å; I44-I48 PolarHBondContact O-N 3.38Å
45G73.1Confident69.5Low34 Ų3458.8 Ų58.835%0.35134%0.337SS..Hα-helixtrans-59.8-36.3176.900000112.7G41 T42 T49G41-G45 PolarHBondContact O-N 3.15Å; T42-G45 PolarHBondContact O-N 3.26Å; G45-T49 PolarHBondContact O-N 3.35Å; G45-T49 PolarHBondContact O-OG1 3.03Å
46Y71.9Confident70.3Confident16 Ų1654.8 Ų54.86%0.06332%0.323CS..Hα-helixtrans-65.1-45.5171.9-167.2-99.9000111.5I17 T42 L43 I44 I48 T49 C50 F71 G75 L78 R117I17-Y46 HydrophobicContact CD1-CE1 4.27Å; T42-Y46 WeakPolarHBondContact O-CB 3.48Å; T42-Y46 PolarHBondContact O-N 3.17Å; L43-Y46 WeakPolarHBondContact O-CB 3.11Å; L43-Y46 PolarHBondContact O-N 3.29Å; I44-Y46 PolarHBondContact O-N 3.42Å; Y46-I48 VanDerWaalsContact C-N 3.34Å; Y46-I48 PolarHBondContact O-N 3.5Å; Y46-T49 PolarHBondContact O-N 3.05Å; Y46-C50 PolarHBondContact O-N 3.18Å; Y46-F71 HydrophobicContact CD1-CE1 4.2Å; Y46-F71 AromaticContact CD1-CZ 3.86Å; Y46-F71 HydrophobicContact CD1-CZ 3.86Å; Y46-F71 HydrophobicContact CD2-CD2 4.4Å; Y46-F71 HydrophobicContact CD2-CE1 4.13Å; Y46-F71 AromaticContact CD2-CE2 3.5Å; Y46-F71 HydrophobicContact CD2-CE2 3.5Å; Y46-F71 VanDerWaalsContact CD2-CE2 3.5Å; Y46-F71 AromaticContact CD2-CZ 3.34Å; Y46-F71 HydrophobicContact CD2-CZ 3.34Å; Y46-F71 HydrophobicContact CE1-CD1 4.45Å; Y46-F71 AromaticContact CE1-CE1 3.54Å; Y46-F71 HydrophobicContact CE1-CE1 3.54Å; Y46-F71 AromaticContact CE1-CZ 3.64Å; Y46-F71 HydrophobicContact CE1-CZ 3.64Å; Y46-F71 AromaticContact CE2-CD1 3.95Å; Y46-F71 HydrophobicContact CE2-CD1 3.95Å; Y46-F71 AromaticContact CE2-CD2 3.84Å; Y46-F71 HydrophobicContact CE2-CD2 3.84Å; Y46-F71 AromaticContact CE2-CE1 3.46Å; Y46-F71 HydrophobicContact CE2-CE1 3.46Å; Y46-F71 VanDerWaalsContact CE2-CE1 3.46Å; Y46-F71 AromaticContact CE2-CE2 3.3Å; Y46-F71 HydrophobicContact CE2-CE2 3.3Å; Y46-F71 HydrophobicContact CE2-CG 4.11Å; Y46-F71 AromaticContact CE2-CZ 3.09Å; Y46-F71 HydrophobicContact CE2-CZ 3.09Å; Y46-F71 WeakPolarHBondContact CE2-O 3.05Å; Y46-F71 HydrophobicContact CG-CE1 4.45Å; Y46-F71 HydrophobicContact CG-CE2 4.25Å; Y46-F71 AromaticContact CG-CZ 3.7Å; Y46-F71 HydrophobicContact CG-CZ 3.7Å; Y46-F71 AromaticContact CZ-CD1 3.65Å; Y46-F71 AromaticContact CZ-CE1 3.09Å; Y46-F71 AromaticContact CZ-CE2 3.9Å; Y46-F71 AromaticContact CZ-CZ 3.22Å; Y46-F71 VanDerWaalsContact O-CZ 3.25Å; Y46-F71 WeakPolarHBondContact O-CZ 3.48Å; Y46-F71 WeakPolarHBondContact OH-CD1 3.21Å; Y46-F71 WeakPolarHBondContact OH-CE1 2.95Å; Y46-F71 PolarHBondContact OH-O 2.98Å; Y46-G75 WeakPolarHBondContact OH-CA 3.24Å; Y46-G75 PolarHBondContact OH-N 3.38Å; Y46-L78 HydrophobicContact CD2-CD2 4.26Å; Y46-L78 HydrophobicContact CG-CD2 4.15Å; Y46-R117 PolarHBondContact OH-NH1 3.41Å
47L72.6Confident70.5Confident41 Ų4156.5 Ų56.522%0.21533%0.326CS..Hα-helixtrans-59.7-44179.8-158.2156.6000112.1I17 V18 I21 L43 I44 T49 C50 F51I17-L47 HydrophobicContact CG2-CD1 4.05Å; I17-L47 HydrophobicContact CG2-CG 4.36Å; V18-L47 HydrophobicContact CG2-CD1 3.8Å; V18-L47 HydrophobicContact CG2-CD2 4.44Å; V18-L47 HydrophobicContact CG2-CG 4.45Å; I21-L47 HydrophobicContact CD1-CB 4.3Å; I21-L47 HydrophobicContact CD1-CD1 3.42Å; I21-L47 VanDerWaalsContact CD1-CD1 3.42Å; I21-L47 HydrophobicContact CD1-CG 4.49Å; L43-L47 PolarHBondContact O-N 3.35Å; I44-L47 WeakPolarHBondContact O-CB 3.15Å; I44-L47 PolarHBondContact O-N 3.02Å; L47-T49 PolarHBondContact O-N 2.98Å; L47-C50 WeakPolarHBondContact O-CB 3.34Å; L47-C50 PolarHBondContact O-N 2.94Å; L47-F51 PolarHBondContact O-N 3.32Å
48I76.3Confident70.8Confident102 Ų10256 Ų5652%0.52333%0.328SS..Hα-helixtrans-59.8-46.2176.8-64.3165.1000110.8I44 Y46 C50 F51 V52I44-I48 HydrophobicContact CG2-CD1 3.88Å; I44-I48 HydrophobicContact CG2-CG1 4.48Å; I44-I48 WeakPolarHBondContact O-CG1 3.26Å; I44-I48 PolarHBondContact O-N 3.38Å; Y46-I48 VanDerWaalsContact C-N 3.34Å; Y46-I48 PolarHBondContact O-N 3.5Å; I48-C50 VanDerWaalsContact C-N 3.32Å; I48-C50 PolarHBondContact O-N 2.83Å; I48-F51 WeakPolarHBondContact O-CB 3.47Å; I48-F51 PolarHBondContact O-N 3Å; I48-V52 WeakPolarHBondContact O-CG2 3.37Å; I48-V52 PolarHBondContact O-N 2.68Å
49T76.9Confident71.2Confident66 Ų6654.6 Ų54.641%0.40533%0.328SS..Hα-helixtrans-64.4-39.5179.7-53.80000111.5G45 Y46 L47 F51 V52 I53 F71G45-T49 PolarHBondContact O-N 3.35Å; G45-T49 PolarHBondContact O-OG1 3.03Å; Y46-T49 PolarHBondContact O-N 3.05Å; L47-T49 PolarHBondContact O-N 2.98Å; T49-F51 VanDerWaalsContact C-N 3.32Å; T49-F51 PolarHBondContact O-N 3.44Å; T49-V52 PolarHBondContact O-N 3.25Å; T49-I53 HydrophobicContact CG2-CD1 4.16Å; T49-I53 WeakPolarHBondContact O-CG1 3.41Å; T49-I53 PolarHBondContact O-N 3.46Å; T49-I53 VanDerWaalsContact O-N 3.14Å; T49-F71 HydrophobicContact CG2-CD2 3.63Å; T49-F71 HydrophobicContact CG2-CE2 3.22Å; T49-F71 HydrophobicContact CG2-CZ 4.02Å
50C70.9Confident70.8Confident18 Ų1856.5 Ų56.512%0.12235%0.353CS..Hα-helixtrans-64-39.1176.6-154.70000111.8L14 Y46 L47 I48 I53 A54 F71L14-C50 HydrophobicContact CD1-CB 4.22Å; Y46-C50 PolarHBondContact O-N 3.18Å; L47-C50 WeakPolarHBondContact O-CB 3.34Å; L47-C50 PolarHBondContact O-N 2.94Å; I48-C50 VanDerWaalsContact C-N 3.32Å; I48-C50 PolarHBondContact O-N 2.83Å; C50-I53 PolarHBondContact O-N 2.96Å; C50-A54 WeakPolarHBondContact O-CB 3.28Å; C50-A54 PolarHBondContact O-N 3.24Å; C50-F71 HydrophobicContact CB-CE1 3.5Å; C50-F71 VanDerWaalsContact CB-CE1 3.5Å; C50-F71 HydrophobicContact CB-CZ 3.75Å; C50-F71 VanDerWaalsContact SG-CE1 3.59Å
51F73.4Confident70.6Confident120 Ų12058.3 Ų58.353%0.52637%0.367SS..Hα-helixtrans-63.9-46.8176.9-173-95.7000111.6L47 I48 T49 I53 A54 T55L47-F51 PolarHBondContact O-N 3.32Å; I48-F51 WeakPolarHBondContact O-CB 3.47Å; I48-F51 PolarHBondContact O-N 3Å; T49-F51 VanDerWaalsContact C-N 3.32Å; T49-F51 PolarHBondContact O-N 3.44Å; F51-I53 VanDerWaalsContact C-N 3.31Å; F51-I53 PolarHBondContact O-N 2.84Å; F51-A54 PolarHBondContact O-N 3.45Å; F51-A54 VanDerWaalsContact O-N 3.16Å; F51-T55 PolarHBondContact O-N 3.26Å; F51-T55 PolarHBondContact O-OG1 3.41Å; F51-T55 VanDerWaalsContact O-OG1 3.05Å
52V73.9Confident70.1Confident95 Ų9563.4 Ų63.458%0.57639%0.389SS*.Hα-helixtrans-58-43.4176.9172.70000111.5I48 T49 T55 G56I48-V52 WeakPolarHBondContact O-CG2 3.37Å; I48-V52 PolarHBondContact O-N 2.68Å; T49-V52 PolarHBondContact O-N 3.25Å; V52-T55 PolarHBondContact O-N 2.97Å; V52-G56 PolarHBondContact O-N 2.92Å
53I71Confident69.6Low30 Ų3061.9 Ų61.915%0.15438%0.38CS..Hα-helixtrans-65.4-43.6177.3-64.9165.7000110.7T49 C50 F51 G56 H57 V63 F71T49-I53 HydrophobicContact CG2-CD1 4.16Å; T49-I53 WeakPolarHBondContact O-CG1 3.41Å; T49-I53 PolarHBondContact O-N 3.46Å; T49-I53 VanDerWaalsContact O-N 3.14Å; C50-I53 PolarHBondContact O-N 2.96Å; F51-I53 VanDerWaalsContact C-N 3.31Å; F51-I53 PolarHBondContact O-N 2.84Å; I53-G56 PolarHBondContact O-N 3.09Å; I53-H57 PolarHBondContact O-CD2 3.38Å; I53-H57 PolarHBondContact O-N 2.85Å; I53-V63 HydrophobicContact CG2-CG1 4.38Å; I53-F71 HydrophobicContact CD1-CB 4.13Å; I53-F71 HydrophobicContact CD1-CD1 4.12Å; I53-F71 HydrophobicContact CD1-CD2 4.06Å; I53-F71 HydrophobicContact CD1-CG 3.8Å
54A67.5Low69.6Low28 Ų2866.9 Ų66.923%0.23141%0.407CS..Hα-helixtrans-61-44.717700000111.9C50 F51 G56 H57 V58C50-A54 WeakPolarHBondContact O-CB 3.28Å; C50-A54 PolarHBondContact O-N 3.24Å; F51-A54 PolarHBondContact O-N 3.45Å; F51-A54 VanDerWaalsContact O-N 3.16Å; A54-G56 VanDerWaalsContact C-N 3.32Å; A54-G56 PolarHBondContact O-N 3.29Å; A54-H57 PolarHBondContact O-N 3.38Å; A54-V58 WeakPolarHBondContact O-CG2 3.38Å; A54-V58 PolarHBondContact O-N 2.95Å
55T73.1Confident69.3Low69 Ų6970.7 Ų70.742%0.42342%0.421SS..Hα-helixtrans-62.8-38.1174.6-54.40000111.8F51 V52 H57 V58 S59F51-T55 PolarHBondContact O-N 3.26Å; F51-T55 PolarHBondContact O-OG1 3.41Å; F51-T55 VanDerWaalsContact O-OG1 3.05Å; V52-T55 PolarHBondContact O-N 2.97Å; T55-H57 VanDerWaalsContact C-N 3.31Å; T55-H57 PolarHBondContact O-N 3.23Å; T55-V58 PolarHBondContact O-N 3.49Å; T55-S59 WeakPolarHBondContact O-CB 3.36Å; T55-S59 PolarHBondContact O-N 3.48Å
56G70.9Confident69.2Low14 Ų1478.7 Ų78.714%0.14444%0.44CS..Hα-helixtrans-60.9-36.9173.600000113.3V52 I53 A54 T61V52-G56 PolarHBondContact O-N 2.92Å; I53-G56 PolarHBondContact O-N 3.09Å; A54-G56 VanDerWaalsContact C-N 3.32Å; A54-G56 PolarHBondContact O-N 3.29Å; G56-T61 PolarHBondContact O-N 3.01Å; G56-T61 PolarHBondContact O-OG1 3.24Å
57H66.3Low69.1Low64 Ų6482.5 Ų82.530%0.29646%0.461SS..Hα-helixtrans-70.9-37.3173.1-79.2-70.7000113.2L7 K10 I53 A54 T55 G60 D68L7-H57 HydrophobicContact CD2-CB 4.44Å; K10-H57 PolarHBondContact NZ-CD2 2.9Å; K10-H57 PolarHBondContact NZ-CE1 3.46Å; K10-H57 PolarHBondContact NZ-NE2 2.95Å; I53-H57 PolarHBondContact O-CD2 3.38Å; I53-H57 PolarHBondContact O-N 2.85Å; A54-H57 PolarHBondContact O-N 3.38Å; T55-H57 VanDerWaalsContact C-N 3.31Å; T55-H57 PolarHBondContact O-N 3.23Å; H57-G60 PolarHBondContact O-N 2.99Å; H57-D68 IonicContact NE2-OD2 3.85Å
58V67Low69.1Low113 Ų11382.8 Ų82.869%0.68546%0.463SS*.Hα-helixtrans-69-35.6176.9173.70000111.5L7 A54 T55 G60L7-V58 HydrophobicContact CD2-CG2 4.42Å; A54-V58 WeakPolarHBondContact O-CG2 3.38Å; A54-V58 PolarHBondContact O-N 2.95Å; T55-V58 PolarHBondContact O-N 3.49Å; V58-G60 PolarHBondContact O-N 3.3Å
59S71.8Confident68.8Low91 Ų9180.9 Ų80.964%0.63645%0.453SS*.THydrogen-bonded Turntrans-74.90.8179.2-159.90000114.2T55 T61T55-S59 WeakPolarHBondContact O-CB 3.36Å; T55-S59 PolarHBondContact O-N 3.48Å; S59-T61 PolarHBondContact O-N 3.45Å
60G60.2Low68.6Low64 Ų6483.3 Ų83.366%0.6646%0.463SS*.THydrogen-bonded Turntrans72.45.2-179.800000114.7H57 V58H57-G60 PolarHBondContact O-N 2.99Å; V58-G60 PolarHBondContact O-N 3.3Å
61T63.6Low68.7Low81 Ų8184 Ų8450%0.49746%0.464SS..  trans-69.9135.3173.628.70000110.7G56 S59 V63G56-T61 PolarHBondContact O-N 3.01Å; G56-T61 PolarHBondContact O-OG1 3.24Å; S59-T61 PolarHBondContact O-N 3.45Å; T61-V63 PolarHBondContact O-N 3.29Å
62V57.7Low68.7Low147 Ų14779.1 Ų79.189%0.89145%0.445SS*.  trans-71.294.5178.8-164.50000108.3
63V62.3Low68.8Low36 Ų3677.4 Ų77.422%0.21843%0.432CS..  trans-74.7125171.6178.40000108.2I53 T61 K65I53-V63 HydrophobicContact CG2-CG1 4.38Å; T61-V63 PolarHBondContact O-N 3.29Å; V63-K65 PolarHBondContact O-N 3.33Å
64D68.6Low69.1Low107 Ų10777.5 Ų77.557%0.57244%0.44SS*.  trans-55.8125.5176.1-82.1-67.1000111.3R66 L67D64-R66 PolarHBondContact O-N 3.38Å; D64-L67 HydrophobicContact CB-CD1 4.26Å; D64-L67 HydrophobicContact CB-CG 4.46Å; D64-L67 PolarHBondContact O-N 2.8Å
65K66.9Low69.2Low148 Ų14876.1 Ų76.164%0.64343%0.429SS*.Hα-helixtrans-55.9-23.8179.6-156171-178.9-175.30112.9V63 I69V63-K65 PolarHBondContact O-N 3.33Å; K65-I69 WeakPolarHBondContact O-CG1 3.36Å; K65-I69 PolarHBondContact O-N 2.93Å
66R69.9Low69.4Low203 Ų20377 Ų7777%0.76643%0.427SS*.Hα-helixtrans-70-37.6176.7-64.4-179.2-178.3-107.60.6112.9D64 D68 I69 L70D64-R66 PolarHBondContact O-N 3.38Å; R66-D68 VanDerWaalsContact C-N 3.34Å; R66-I69 PolarHBondContact O-N 3.11Å; R66-L70 WeakPolarHBondContact O-CG 3.41Å; R66-L70 PolarHBondContact O-N 2.92Å
67L71.2Confident69.8Low96 Ų9682.8 Ų82.850%0.50345%0.448SS..Hα-helixtrans-67.2-38.9179-76.4167.5000111.1D64 I69 L70 F71D64-L67 HydrophobicContact CB-CD1 4.26Å; D64-L67 HydrophobicContact CB-CG 4.46Å; D64-L67 PolarHBondContact O-N 2.8Å; L67-I69 VanDerWaalsContact C-N 3.34Å; L67-I69 PolarHBondContact O-N 2.84Å; L67-L70 PolarHBondContact O-N 3.06Å; L67-F71 VanDerWaalsContact O-CB 3.29Å; L67-F71 WeakPolarHBondContact O-CB 3.47Å; L67-F71 PolarHBondContact O-N 3.28Å
68D71.8Confident70.2Confident47 Ų4782.2 Ų82.225%0.25145%0.447SS..Hα-helixtrans-60.9-43.3177.1-153.1-100.5000111.8K10 H57 R66 F71 S72K10-D68 VanDerWaalsContact CE-OD2 3.23Å; K10-D68 WeakPolarHBondContact CE-OD2 3.47Å; K10-D68 IonicContact NZ-OD1 3.95Å; K10-D68 IonicContact NZ-OD2 2.64Å; K10-D68 PolarHBondContact NZ-OD2 2.77Å; H57-D68 IonicContact NE2-OD2 3.85Å; R66-D68 VanDerWaalsContact C-N 3.34Å; D68-F71 PolarHBondContact O-N 3.43Å; D68-S72 WeakPolarHBondContact O-CB 3.23Å; D68-S72 PolarHBondContact O-N 3.48Å
69I70.8Confident70.4Confident61 Ų6176.9 Ų76.931%0.31342%0.415SS..Hα-helixtrans-67.3-47178.1-66.8166000111.3K65 R66 L67 F71 S72 I73 V124K65-I69 WeakPolarHBondContact O-CG1 3.36Å; K65-I69 PolarHBondContact O-N 2.93Å; R66-I69 PolarHBondContact O-N 3.11Å; L67-I69 VanDerWaalsContact C-N 3.34Å; L67-I69 PolarHBondContact O-N 2.84Å; I69-F71 VanDerWaalsContact C-N 3.26Å; I69-F71 PolarHBondContact O-N 2.97Å; I69-S72 WeakPolarHBondContact O-CB 3.32Å; I69-S72 PolarHBondContact O-N 3.29Å; I69-I73 HydrophobicContact CG2-CD1 3.94Å; I69-I73 WeakPolarHBondContact O-CG1 3.49Å; I69-I73 PolarHBondContact O-N 3.22Å; I69-V124 HydrophobicContact CD1-CG1 4.19Å; I69-V124 HydrophobicContact CG1-CG1 4.23Å
70L73.1Confident70.6Confident118 Ų11873.5 Ų73.562%0.61840%0.395SS*.Hα-helixtrans-59.5-41.1178-74.1172.1000111.3R66 L67 I73 G74R66-L70 WeakPolarHBondContact O-CG 3.41Å; R66-L70 PolarHBondContact O-N 2.92Å; L67-L70 PolarHBondContact O-N 3.06Å; L70-I73 PolarHBondContact O-N 3.33Å; L70-G74 PolarHBondContact O-N 2.89Å
71F72.1Confident71.3Confident33 Ų3372.7 Ų72.715%0.14538%0.381CS..Hα-helixtrans-67.7-39.1178.7-162.8-102.7000112Y46 T49 C50 I53 L67 D68 I69 G74 G75Y46-F71 HydrophobicContact CD1-CE1 4.2Å; Y46-F71 AromaticContact CD1-CZ 3.86Å; Y46-F71 HydrophobicContact CD1-CZ 3.86Å; Y46-F71 HydrophobicContact CD2-CD2 4.4Å; Y46-F71 HydrophobicContact CD2-CE1 4.13Å; Y46-F71 AromaticContact CD2-CE2 3.5Å; Y46-F71 HydrophobicContact CD2-CE2 3.5Å; Y46-F71 VanDerWaalsContact CD2-CE2 3.5Å; Y46-F71 AromaticContact CD2-CZ 3.34Å; Y46-F71 HydrophobicContact CD2-CZ 3.34Å; Y46-F71 HydrophobicContact CE1-CD1 4.45Å; Y46-F71 AromaticContact CE1-CE1 3.54Å; Y46-F71 HydrophobicContact CE1-CE1 3.54Å; Y46-F71 AromaticContact CE1-CZ 3.64Å; Y46-F71 HydrophobicContact CE1-CZ 3.64Å; Y46-F71 AromaticContact CE2-CD1 3.95Å; Y46-F71 HydrophobicContact CE2-CD1 3.95Å; Y46-F71 AromaticContact CE2-CD2 3.84Å; Y46-F71 HydrophobicContact CE2-CD2 3.84Å; Y46-F71 AromaticContact CE2-CE1 3.46Å; Y46-F71 HydrophobicContact CE2-CE1 3.46Å; Y46-F71 VanDerWaalsContact CE2-CE1 3.46Å; Y46-F71 AromaticContact CE2-CE2 3.3Å; Y46-F71 HydrophobicContact CE2-CE2 3.3Å; Y46-F71 HydrophobicContact CE2-CG 4.11Å; Y46-F71 AromaticContact CE2-CZ 3.09Å; Y46-F71 HydrophobicContact CE2-CZ 3.09Å; Y46-F71 WeakPolarHBondContact CE2-O 3.05Å; Y46-F71 HydrophobicContact CG-CE1 4.45Å; Y46-F71 HydrophobicContact CG-CE2 4.25Å; Y46-F71 AromaticContact CG-CZ 3.7Å; Y46-F71 HydrophobicContact CG-CZ 3.7Å; Y46-F71 AromaticContact CZ-CD1 3.65Å; Y46-F71 AromaticContact CZ-CE1 3.09Å; Y46-F71 AromaticContact CZ-CE2 3.9Å; Y46-F71 AromaticContact CZ-CZ 3.22Å; Y46-F71 VanDerWaalsContact O-CZ 3.25Å; Y46-F71 WeakPolarHBondContact O-CZ 3.48Å; Y46-F71 WeakPolarHBondContact OH-CD1 3.21Å; Y46-F71 WeakPolarHBondContact OH-CE1 2.95Å; Y46-F71 PolarHBondContact OH-O 2.98Å; T49-F71 HydrophobicContact CG2-CD2 3.63Å; T49-F71 HydrophobicContact CG2-CE2 3.22Å; T49-F71 HydrophobicContact CG2-CZ 4.02Å; C50-F71 HydrophobicContact CB-CE1 3.5Å; C50-F71 VanDerWaalsContact CB-CE1 3.5Å; C50-F71 HydrophobicContact CB-CZ 3.75Å; C50-F71 VanDerWaalsContact SG-CE1 3.59Å; I53-F71 HydrophobicContact CD1-CB 4.13Å; I53-F71 HydrophobicContact CD1-CD1 4.12Å; I53-F71 HydrophobicContact CD1-CD2 4.06Å; I53-F71 HydrophobicContact CD1-CG 3.8Å; L67-F71 VanDerWaalsContact O-CB 3.29Å; L67-F71 WeakPolarHBondContact O-CB 3.47Å; L67-F71 PolarHBondContact O-N 3.28Å; D68-F71 PolarHBondContact O-N 3.43Å; I69-F71 VanDerWaalsContact C-N 3.26Å; I69-F71 PolarHBondContact O-N 2.97Å; F71-G74 PolarHBondContact O-N 3.24Å; F71-G75 PolarHBondContact O-N 2.88Å
72S73.2Confident71.8Confident17 Ų1769 Ų6912%0.11936%0.359CS..Hα-helixtrans-61.1-45174.5-1680000112.2D68 I69 G75 F76D68-S72 WeakPolarHBondContact O-CB 3.23Å; D68-S72 PolarHBondContact O-N 3.48Å; I69-S72 WeakPolarHBondContact O-CB 3.32Å; I69-S72 PolarHBondContact O-N 3.29Å; S72-G75 PolarHBondContact O-N 3.22Å; S72-F76 PolarHBondContact O-N 2.97Å
73I76.6Confident72.3Confident59 Ų5962 Ų6230%0.30332%0.317SS..Hα-helixtrans-63.3-46.9175.7-64.9165.5000110.6I69 L70 G75 F76 F77 F121I69-I73 HydrophobicContact CG2-CD1 3.94Å; I69-I73 WeakPolarHBondContact O-CG1 3.49Å; I69-I73 PolarHBondContact O-N 3.22Å; L70-I73 PolarHBondContact O-N 3.33Å; I73-G75 VanDerWaalsContact C-N 3.27Å; I73-G75 PolarHBondContact O-N 3.38Å; I73-F76 WeakPolarHBondContact O-CB 3.39Å; I73-F76 PolarHBondContact O-N 3.46Å; I73-F76 VanDerWaalsContact O-N 3.15Å; I73-F77 HydrophobicContact CG2-CD2 3.9Å; I73-F77 HydrophobicContact CG2-CE2 3.71Å; I73-F77 VanDerWaalsContact O-CD2 3.31Å; I73-F77 WeakPolarHBondContact O-CD2 3.36Å; I73-F77 PolarHBondContact O-N 3.46Å; I73-F121 HydrophobicContact CD1-CD2 4.41Å; I73-F121 HydrophobicContact CD1-CE2 3.9Å; I73-F121 HydrophobicContact CG1-CD2 4.07Å; I73-F121 HydrophobicContact CG1-CE2 4.03Å
74G76.9Confident72.9Confident31 Ų3163.9 Ų63.932%0.3233%0.328SS..Hα-helixtrans-56.3-44.1176.500000111.8L70 F71 F76 F77 L78L70-G74 PolarHBondContact O-N 2.89Å; F71-G74 PolarHBondContact O-N 3.24Å; G74-F76 PolarHBondContact O-N 3.1Å; G74-F77 PolarHBondContact O-N 2.89Å; G74-L78 WeakPolarHBondContact O-CB 3.25Å; G74-L78 PolarHBondContact O-N 3.25Å
75G70Confident73.1Confident0 Ų061.7 Ų61.70%032%0.316CS..Hα-helixtrans-62.7-39.3176.600000113.5Y46 F71 S72 I73 L78 F79Y46-G75 WeakPolarHBondContact OH-CA 3.24Å; Y46-G75 PolarHBondContact OH-N 3.38Å; F71-G75 PolarHBondContact O-N 2.88Å; S72-G75 PolarHBondContact O-N 3.22Å; I73-G75 VanDerWaalsContact C-N 3.27Å; I73-G75 PolarHBondContact O-N 3.38Å; G75-L78 PolarHBondContact O-N 3.03Å; G75-F79 WeakPolarHBondContact O-CB 3.36Å; G75-F79 PolarHBondContact O-N 2.95Å
76F77.1Confident73.1Confident86 Ų8655.5 Ų55.538%0.37729%0.29SS..Hα-helixtrans-57.1-51.3175.9177.4-97.7000112S72 I73 G74 G80 G114S72-F76 PolarHBondContact O-N 2.97Å; I73-F76 WeakPolarHBondContact O-CB 3.39Å; I73-F76 PolarHBondContact O-N 3.46Å; I73-F76 VanDerWaalsContact O-N 3.15Å; G74-F76 PolarHBondContact O-N 3.1Å; F76-G80 PolarHBondContact O-N 3.31Å; F76-G114 WeakPolarHBondContact CD2-O 3.22Å; F76-G114 WeakPolarHBondContact CE2-O 3.22Å
77F80Confident73.1Confident136 Ų13648.3 Ų48.360%0.59627%0.266SS*.Hα-helixtrans-67.9-41.1180-75.1-74.3000112.1I73 G74 A81I73-F77 HydrophobicContact CG2-CD2 3.9Å; I73-F77 HydrophobicContact CG2-CE2 3.71Å; I73-F77 VanDerWaalsContact O-CD2 3.31Å; I73-F77 WeakPolarHBondContact O-CD2 3.36Å; I73-F77 PolarHBondContact O-N 3.46Å; G74-F77 PolarHBondContact O-N 2.89Å; F77-A81 VanDerWaalsContact O-CB 3.23Å; F77-A81 WeakPolarHBondContact O-CB 3.49Å; F77-A81 PolarHBondContact O-N 2.96Å
78L73.2Confident73Confident52 Ų5247.5 Ų47.527%0.27227%0.274SS..Hα-helixtrans-64-48.4-179.8-130.379.1000111.7T42 Y46 G74 G75 A82T42-L78 WeakPolarHBondContact O-CD2 3.09Å; Y46-L78 HydrophobicContact CD2-CD2 4.26Å; Y46-L78 HydrophobicContact CG-CD2 4.15Å; G74-L78 WeakPolarHBondContact O-CB 3.25Å; G74-L78 PolarHBondContact O-N 3.25Å; G75-L78 PolarHBondContact O-N 3.03Å; L78-A82 VanDerWaalsContact O-CB 3.22Å; L78-A82 WeakPolarHBondContact O-CB 3.13Å; L78-A82 PolarHBondContact O-N 3.27Å
79F71.2Confident72.7Confident1 Ų149.1 Ų49.10%0.00428%0.279CS..Hα-helixtrans-71-35.4-179.6-113.3-77.8000112.5I17 L43 G75 G83 S110 N113I17-F79 HydrophobicContact CG1-CE2 4.17Å; I17-F79 HydrophobicContact CG2-CE2 4.21Å; L43-F79 HydrophobicContact CD2-CD2 4.41Å; L43-F79 HydrophobicContact CD2-CE2 4.08Å; L43-F79 HydrophobicContact CD2-CZ 4.41Å; G75-F79 WeakPolarHBondContact O-CB 3.36Å; G75-F79 PolarHBondContact O-N 2.95Å; F79-G83 PolarHBondContact O-N 3.11Å; F79-S110 VanDerWaalsContact CD1-CA 3.43Å; F79-S110 WeakPolarHBondContact CD1-O 3.32Å; F79-S110 WeakPolarHBondContact CD1-OG 3.35Å; F79-S110 WeakPolarHBondContact CE1-OG 3.35Å; F79-S110 PolarHBondContact O-OG 3.34Å; F79-N113 HydrophobicContact CB-CB 4.42Å; F79-N113 HydrophobicContact CD1-CB 3.48Å; F79-N113 VanDerWaalsContact CD1-CB 3.48Å; F79-N113 HydrophobicContact CD2-CB 4.26Å; F79-N113 HydrophobicContact CE1-CB 3.7Å; F79-N113 WeakPolarHBondContact CE1-ND2 2.86Å; F79-N113 HydrophobicContact CE2-CB 4.41Å; F79-N113 HydrophobicContact CG-CB 3.78Å; F79-N113 HydrophobicContact CZ-CB 4.14Å; F79-N113 WeakPolarHBondContact CZ-ND2 2.76Å
80G76Confident72.3Confident21 Ų2148.5 Ų48.522%0.21627%0.273CS..Hα-helixtrans-62.5-51.6172.900000111.6F76 G83 T84F76-G80 PolarHBondContact O-N 3.31Å; G80-G83 PolarHBondContact O-N 3.29Å; G80-T84 WeakPolarHBondContact O-CG2 3.14Å; G80-T84 PolarHBondContact O-N 3.27Å; G80-T84 PolarHBondContact O-OG1 3.13Å
81A75.5Confident71.7Confident46 Ų4647.8 Ų47.838%0.3827%0.27SS..Hα-helixtrans-61.9-49.5177.900000111.5F77 G83 T84 I85F77-A81 VanDerWaalsContact O-CB 3.23Å; F77-A81 WeakPolarHBondContact O-CB 3.49Å; F77-A81 PolarHBondContact O-N 2.96Å; A81-G83 VanDerWaalsContact C-N 3.35Å; A81-G83 PolarHBondContact O-N 3.11Å; A81-T84 PolarHBondContact O-N 3.43Å; A81-T84 PolarHBondContact O-OG1 3.34Å; A81-I85 WeakPolarHBondContact O-CD1 3.42Å; A81-I85 VanDerWaalsContact O-CG1 3.24Å; A81-I85 WeakPolarHBondContact O-CG1 3.22Å; A81-I85 PolarHBondContact O-N 3.12Å
82A73.5Confident71.1Confident4 Ų449.9 Ų49.93%0.03330%0.3CS..Hα-helixtrans-57.3-46178.200000112V39 L43 L78 T84 I85 I86V39-A82 HydrophobicContact CG1-CB 3.82Å; L43-A82 HydrophobicContact CD1-CB 4.36Å; L78-A82 VanDerWaalsContact O-CB 3.22Å; L78-A82 WeakPolarHBondContact O-CB 3.13Å; L78-A82 PolarHBondContact O-N 3.27Å; A82-T84 PolarHBondContact O-N 2.97Å; A82-I85 PolarHBondContact O-N 3.31Å; A82-I86 WeakPolarHBondContact O-CD1 3.49Å; A82-I86 VanDerWaalsContact O-CG1 3.22Å; A82-I86 WeakPolarHBondContact O-CG1 3.44Å; A82-I86 PolarHBondContact O-N 3.35Å
83G69.1Low70.3Confident0 Ų057 Ų570%033%0.326CS..Hα-helixtrans-61.1-44.4178.400000112.6F79 G80 A81 L87 S110F79-G83 PolarHBondContact O-N 3.11Å; G80-G83 PolarHBondContact O-N 3.29Å; A81-G83 VanDerWaalsContact C-N 3.35Å; A81-G83 PolarHBondContact O-N 3.11Å; G83-L87 WeakPolarHBondContact O-CB 3.45Å; G83-L87 PolarHBondContact O-N 3.03Å; G83-S110 VanDerWaalsContact CA-OG 3.32Å; G83-S110 WeakPolarHBondContact CA-OG 3.45Å; G83-S110 PolarHBondContact N-OG 2.84Å
84T74.9Confident69.3Low76 Ų7655.8 Ų55.847%0.46632%0.322SS..Hα-helixtrans-66.5-38.5177.359.20000113.2G80 A81 A82 L87 A88 L111G80-T84 WeakPolarHBondContact O-CG2 3.14Å; G80-T84 PolarHBondContact O-N 3.27Å; G80-T84 PolarHBondContact O-OG1 3.13Å; A81-T84 PolarHBondContact O-N 3.43Å; A81-T84 PolarHBondContact O-OG1 3.34Å; A82-T84 PolarHBondContact O-N 2.97Å; T84-L87 PolarHBondContact O-N 3.39Å; T84-A88 WeakPolarHBondContact O-CB 3.45Å; T84-A88 PolarHBondContact O-N 3.13Å; T84-L111 HydrophobicContact CG2-CD2 4.21Å
85I71.9Confident68.4Low61 Ų6164.3 Ų64.331%0.31335%0.35SS..Hα-helixtrans-68-45179.6-67.6165.1000110.5V39 A81 A82 L87 A88 Q89V39-I85 HydrophobicContact CG2-CD1 4.25Å; A81-I85 WeakPolarHBondContact O-CD1 3.42Å; A81-I85 VanDerWaalsContact O-CG1 3.24Å; A81-I85 WeakPolarHBondContact O-CG1 3.22Å; A81-I85 PolarHBondContact O-N 3.12Å; A82-I85 PolarHBondContact O-N 3.31Å; I85-L87 VanDerWaalsContact C-N 3.33Å; I85-L87 PolarHBondContact O-N 2.95Å; I85-A88 PolarHBondContact O-N 3.49Å; I85-Q89 HydrophobicContact CG2-CG 4.35Å; I85-Q89 WeakPolarHBondContact O-CB 3.44Å; I85-Q89 WeakPolarHBondContact O-CG 3.4Å; I85-Q89 PolarHBondContact O-N 3.1Å
86I68.1Low68.1Low17 Ų1767 Ų679%0.08737%0.369CS..Hα-helixtrans-58.9-47.9175.7-66.5161.2000109.6I24 A82 A88 W90 L103I24-I86 HydrophobicContact CD1-CD1 3.72Å; I24-I86 HydrophobicContact CG1-CD1 3.85Å; A82-I86 WeakPolarHBondContact O-CD1 3.49Å; A82-I86 VanDerWaalsContact O-CG1 3.22Å; A82-I86 WeakPolarHBondContact O-CG1 3.44Å; A82-I86 PolarHBondContact O-N 3.35Å; I86-A88 PolarHBondContact O-N 3.21Å; I86-W90 WeakPolarHBondContact O-CB 3.42Å; I86-W90 VanDerWaalsContact O-CD1 3.26Å; I86-W90 PolarHBondContact O-N 2.76Å; I86-L103 HydrophobicContact CG2-CD2 4.13Å
87L68.9Low67.6Low53 Ų5369.3 Ų69.328%0.27738%0.381SS..Hα-helixtrans-63.6-43.9-179.6-140.174.9000112.2G83 T84 I85 L91 L104G83-L87 WeakPolarHBondContact O-CB 3.45Å; G83-L87 PolarHBondContact O-N 3.03Å; T84-L87 PolarHBondContact O-N 3.39Å; I85-L87 VanDerWaalsContact C-N 3.33Å; I85-L87 PolarHBondContact O-N 2.95Å; L87-L91 HydrophobicContact CD1-CD1 4.47Å; L87-L91 HydrophobicContact CG-CD1 4.01Å; L87-L91 WeakPolarHBondContact O-CB 3.33Å; L87-L91 WeakPolarHBondContact O-CD1 3.2Å; L87-L91 PolarHBondContact O-N 3.09Å; L87-L104 HydrophobicContact CD1-CD2 4.21Å
88A68.8Low67Low79 Ų7970.6 Ų70.665%0.65339%0.389SS*.Hα-helixtrans-71.2-39-176.100000113.3T84 I85 I86T84-A88 WeakPolarHBondContact O-CB 3.45Å; T84-A88 PolarHBondContact O-N 3.13Å; I85-A88 PolarHBondContact O-N 3.49Å; I86-A88 PolarHBondContact O-N 3.21Å
89Q64.9Low66.6Low80 Ų8073.3 Ų73.337%0.37440%0.4SS..Hα-helixtrans-77.1-36.1-178.2-71.6-172.8-14.800112.4I85I85-Q89 HydrophobicContact CG2-CG 4.35Å; I85-Q89 WeakPolarHBondContact O-CB 3.44Å; I85-Q89 WeakPolarHBondContact O-CG 3.4Å; I85-Q89 PolarHBondContact O-N 3.1Å
90W62.8Low66.3Low49 Ų4979.1 Ų79.119%0.18642%0.422CS..Hα-helixtrans-93.3-23.4-170.1-72.888.8000114.5I27 T31 I86 G92 Y93 C94 L103I27-W90 HydrophobicContact CG2-CH2 3.9Å; I27-W90 HydrophobicContact CG2-CZ2 4.1Å; I27-W90 HydrophobicContact CG2-CZ3 4.18Å; I27-W90 WeakPolarHBondContact O-CH2 3.33Å; T31-W90 WeakPolarHBondContact OG1-CH2 3.41Å; I86-W90 WeakPolarHBondContact O-CB 3.42Å; I86-W90 VanDerWaalsContact O-CD1 3.26Å; I86-W90 PolarHBondContact O-N 2.76Å; W90-G92 PolarHBondContact O-N 3.4Å; W90-Y93 PolarHBondContact O-N 3.25Å; W90-C94 PolarHBondContact O-N 3.38Å; W90-L103 HydrophobicContact CB-CD1 3.91Å; W90-L103 HydrophobicContact CB-CD2 3.65Å; W90-L103 HydrophobicContact CB-CG 4.24Å; W90-L103 HydrophobicContact CD2-CD1 3.83Å; W90-L103 HydrophobicContact CD2-CD2 3.53Å; W90-L103 HydrophobicContact CD2-CG 4.33Å; W90-L103 HydrophobicContact CE3-CD1 3.35Å; W90-L103 HydrophobicContact CE3-CD2 3.93Å; W90-L103 HydrophobicContact CE3-CG 4.26Å; W90-L103 HydrophobicContact CG-CD1 4.11Å; W90-L103 HydrophobicContact CG-CD2 3.42Å; W90-L103 VanDerWaalsContact CG-CD2 3.42Å; W90-L103 HydrophobicContact CG-CG 4.36Å; W90-L103 HydrophobicContact CZ3-CD1 4.03Å
91L61.5Low66Low103 Ų10383.4 Ų83.454%0.53944%0.436SS..THydrogen-bonded Turntrans-59.7-28.5172.1-111.487000112.8L87L87-L91 HydrophobicContact CD1-CD1 4.47Å; L87-L91 HydrophobicContact CG-CD1 4.01Å; L87-L91 WeakPolarHBondContact O-CB 3.33Å; L87-L91 WeakPolarHBondContact O-CD1 3.2Å; L87-L91 PolarHBondContact O-N 3.09Å
92G58.9Low65.7Low77 Ų7785 Ų8579%0.79444%0.438SS*.THydrogen-bonded Turntrans-85.8-15.8-179.300000115W90W90-G92 PolarHBondContact O-N 3.4Å
93Y57.2Low65.5Low167 Ų16785.1 Ų85.166%0.65544%0.438SS*.THydrogen-bonded Turntrans-117.1-13.9-168.5-153.1-95.3000114.3T31 W90 K95T31-Y93 HydrophobicContact CG2-CD1 4.49Å; T31-Y93 HydrophobicContact CG2-CE1 3.77Å; W90-Y93 PolarHBondContact O-N 3.25Å; Y93-K95 PolarHBondContact O-N 3.46Å
94C55.8Low65.5Low33 Ų3387.4 Ų87.422%0.22345%0.45CS..  trans-69.5117-179.9-96.30000113.1W90 R100 L103W90-C94 PolarHBondContact O-N 3.38Å; C94-R100 HydrophobicContact CB-CB 4.03Å; C94-R100 HydrophobicContact CB-CG 4.41Å; C94-L103 WeakPolarHBondContact SG-CD1 3.14Å
95K56.2Low65.5Low210 Ų21086.1 Ų86.191%0.91345%0.448SS*.  trans-96.1-21174.4-156.1171.6-178171.70112.8Y93Y93-K95 PolarHBondContact O-N 3.46Å
96S64.3Low65.5Low56 Ų5683.5 Ų83.539%0.39243%0.434SS..SBendtrans-107.3141.4178.9-161.10000112.6R100S96-R100 PolarHBondContact O-N 3.37Å
97Q66.4Low65.7Low134 Ų13482.7 Ų82.763%0.62643%0.43SS*.Hα-helixtrans-66.4-37-177.2-107.9-99-27.100112.6R100 Q101Q97-R100 PolarHBondContact O-N 3.06Å; Q97-Q101 WeakPolarHBondContact O-CG 3.32Å; Q97-Q101 PolarHBondContact O-N 3.02Å
98E67.5Low66Low163 Ų16385 Ų8576%0.76244%0.442SS*.Hα-helixtrans-71.6-44.5-175.8-61.4-171.913400112.2R100 Q101 L102E98-R100 VanDerWaalsContact C-N 3.27Å; E98-R100 PolarHBondContact O-N 3.47Å; E98-Q101 PolarHBondContact O-N 3.01Å; E98-L102 PolarHBondContact O-N 2.81Å
99E64.9Low66.3Low110 Ų11084 Ų8451%0.51443%0.425SS..Hα-helixtrans-60.2-39.8176-64.7177.4139.600111.2Q101 L102 L103E99-Q101 VanDerWaalsContact C-N 3.33Å; E99-Q101 PolarHBondContact O-N 3.08Å; E99-L102 PolarHBondContact O-N 3.11Å; E99-L103 WeakPolarHBondContact O-CB 3.48Å; E99-L103 WeakPolarHBondContact O-CD1 3.42Å; E99-L103 WeakPolarHBondContact O-CG 3.09Å; E99-L103 PolarHBondContact O-N 3.45Å
100R65.4Low66.6Low122 Ų12280.2 Ų80.246%0.4641%0.408SS..Hα-helixtrans-62.5-38.2178.8-173.7179.1158.3177.4-4.3112.5C94 S96 Q97 E98 L104C94-R100 HydrophobicContact CB-CB 4.03Å; C94-R100 HydrophobicContact CB-CG 4.41Å; S96-R100 PolarHBondContact O-N 3.37Å; Q97-R100 PolarHBondContact O-N 3.06Å; E98-R100 VanDerWaalsContact C-N 3.27Å; E98-R100 PolarHBondContact O-N 3.47Å; R100-L104 HydrophobicContact CG-CD1 4.22Å; R100-L104 WeakPolarHBondContact O-CB 3.44Å; R100-L104 PolarHBondContact O-N 2.96Å
101Q70.4Confident67.3Low111 Ų11181 Ų8152%0.51942%0.415SS..Hα-helixtrans-68.3-41.1176.5-66.5-67.6-21.300111.2Q97 E98 E99 L104 A105Q97-Q101 WeakPolarHBondContact O-CG 3.32Å; Q97-Q101 PolarHBondContact O-N 3.02Å; E98-Q101 PolarHBondContact O-N 3.01Å; E99-Q101 VanDerWaalsContact C-N 3.33Å; E99-Q101 PolarHBondContact O-N 3.08Å; Q101-L104 PolarHBondContact O-N 3.18Å; Q101-A105 VanDerWaalsContact O-CB 3.31Å; Q101-A105 WeakPolarHBondContact O-CB 3.44Å; Q101-A105 PolarHBondContact O-N 3.47Å
102L69.2Low68Low79 Ų7978 Ų7841%0.41441%0.406SS..Hα-helixtrans-65.3-38.8176.8-162.274.1000111.9L23 I27 E98 E99 A105 S106L23-L102 HydrophobicContact CD1-CD1 4.07Å; L23-L102 HydrophobicContact CD1-CG 4.35Å; I27-L102 HydrophobicContact CD1-CD2 4.09Å; I27-L102 HydrophobicContact CD1-CG 4.08Å; I27-L102 HydrophobicContact CG1-CD2 3.78Å; I27-L102 HydrophobicContact CG1-CG 4.34Å; E98-L102 PolarHBondContact O-N 2.81Å; E99-L102 PolarHBondContact O-N 3.11Å; L102-A105 PolarHBondContact O-N 3.38Å; L102-S106 PolarHBondContact O-N 3.47Å; L102-S106 PolarHBondContact O-OG 2.94Å
103L67.4Low68.6Low8 Ų874.9 Ų74.94%0.04237%0.371CS..Hα-helixtrans-68.6-42.2175.6-83.2155.4000113.2I27 I86 W90 C94 E99 A105 S106 G107I27-L103 HydrophobicContact CD1-CD2 4.17Å; I27-L103 HydrophobicContact CD1-CG 4.27Å; I27-L103 HydrophobicContact CG2-CD1 4.23Å; I27-L103 HydrophobicContact CG2-CD2 3.57Å; I27-L103 HydrophobicContact CG2-CG 3.88Å; I86-L103 HydrophobicContact CG2-CD2 4.13Å; W90-L103 HydrophobicContact CB-CD1 3.91Å; W90-L103 HydrophobicContact CB-CD2 3.65Å; W90-L103 HydrophobicContact CB-CG 4.24Å; W90-L103 HydrophobicContact CD2-CD1 3.83Å; W90-L103 HydrophobicContact CD2-CD2 3.53Å; W90-L103 HydrophobicContact CD2-CG 4.33Å; W90-L103 HydrophobicContact CE3-CD1 3.35Å; W90-L103 HydrophobicContact CE3-CD2 3.93Å; W90-L103 HydrophobicContact CE3-CG 4.26Å; W90-L103 HydrophobicContact CG-CD1 4.11Å; W90-L103 HydrophobicContact CG-CD2 3.42Å; W90-L103 VanDerWaalsContact CG-CD2 3.42Å; W90-L103 HydrophobicContact CG-CG 4.36Å; W90-L103 HydrophobicContact CZ3-CD1 4.03Å; C94-L103 WeakPolarHBondContact SG-CD1 3.14Å; E99-L103 WeakPolarHBondContact O-CB 3.48Å; E99-L103 WeakPolarHBondContact O-CD1 3.42Å; E99-L103 WeakPolarHBondContact O-CG 3.09Å; E99-L103 PolarHBondContact O-N 3.45Å; L103-A105 VanDerWaalsContact C-N 3.34Å; L103-S106 WeakPolarHBondContact CA-OG 3.24Å; L103-S106 PolarHBondContact O-N 2.89Å; L103-S106 PolarHBondContact O-OG 3.3Å; L103-G107 PolarHBondContact O-N 3.32Å
104L70.4Confident69.1Low47 Ų4767 Ų6725%0.24634%0.341CS..Hα-helixtrans-61.8-44.6171.5-88.4159.4000110.9L87 R100 Q101 G107 I108L87-L104 HydrophobicContact CD1-CD2 4.21Å; R100-L104 HydrophobicContact CG-CD1 4.22Å; R100-L104 WeakPolarHBondContact O-CB 3.44Å; R100-L104 PolarHBondContact O-N 2.96Å; Q101-L104 PolarHBondContact O-N 3.18Å; L104-G107 PolarHBondContact O-N 3.29Å; L104-I108 HydrophobicContact CD2-CD1 4.45Å; L104-I108 VanDerWaalsContact O-CB 3.31Å; L104-I108 WeakPolarHBondContact O-CB 3.39Å; L104-I108 WeakPolarHBondContact O-CD1 3.33Å; L104-I108 WeakPolarHBondContact O-CG1 3.3Å; L104-I108 PolarHBondContact O-N 2.9Å
105A75.3Confident70Confident50 Ų5068 Ų6841%0.41335%0.35SS..Hα-helixtrans-59.5-49177.800000111.2Q101 L102 L103 I108 L109Q101-A105 VanDerWaalsContact O-CB 3.31Å; Q101-A105 WeakPolarHBondContact O-CB 3.44Å; Q101-A105 PolarHBondContact O-N 3.47Å; L102-A105 PolarHBondContact O-N 3.38Å; L103-A105 VanDerWaalsContact C-N 3.34Å; A105-I108 PolarHBondContact O-N 3.46Å; A105-L109 VanDerWaalsContact O-CB 3.3Å; A105-L109 WeakPolarHBondContact O-CB 3.46Å; A105-L109 PolarHBondContact O-N 2.84Å
106S71.4Confident70.7Confident5 Ų562.4 Ų62.44%0.03533%0.33CS..Hα-helixtrans-64.1-42.5179.264.20000113.2L102 L103 L109 S110L102-S106 PolarHBondContact O-N 3.47Å; L102-S106 PolarHBondContact O-OG 2.94Å; L103-S106 WeakPolarHBondContact CA-OG 3.24Å; L103-S106 PolarHBondContact O-N 2.89Å; L103-S106 PolarHBondContact O-OG 3.3Å; S106-L109 PolarHBondContact O-N 3.06Å; S106-S110 WeakPolarHBondContact O-CB 3.33Å; S106-S110 PolarHBondContact O-N 2.83Å
107G71.1Confident70.8Confident0 Ų060.2 Ų60.20%031%0.313CS..Hα-helixtrans-65.5-42.2176.800000113L103 L104 S110 L111L103-G107 PolarHBondContact O-N 3.32Å; L104-G107 PolarHBondContact O-N 3.29Å; G107-S110 WeakPolarHBondContact O-CB 3.29Å; G107-S110 PolarHBondContact O-N 3.18Å; G107-L111 WeakPolarHBondContact O-CG 3.43Å; G107-L111 PolarHBondContact O-N 2.93Å
108I77.1Confident70.6Confident103 Ų10354.8 Ų54.853%0.52829%0.293SS..Hα-helixtrans-66.3-41.1175.6-67.4165.1000110.5L104 A105 S110 L111 A112L104-I108 HydrophobicContact CD2-CD1 4.45Å; L104-I108 VanDerWaalsContact O-CB 3.31Å; L104-I108 WeakPolarHBondContact O-CB 3.39Å; L104-I108 WeakPolarHBondContact O-CD1 3.33Å; L104-I108 WeakPolarHBondContact O-CG1 3.3Å; L104-I108 PolarHBondContact O-N 2.9Å; A105-I108 PolarHBondContact O-N 3.46Å; I108-S110 VanDerWaalsContact C-N 3.27Å; I108-S110 PolarHBondContact O-N 2.98Å; I108-L111 PolarHBondContact O-N 3.39Å; I108-A112 VanDerWaalsContact O-CB 3.29Å; I108-A112 WeakPolarHBondContact O-CB 3.14Å; I108-A112 PolarHBondContact O-N 3.13Å
109L74Confident70.2Confident56 Ų5656.3 Ų56.329%0.29329%0.292SS..Hα-helixtrans-59.4-41.9174.8-142.589.4000110.9F16 A105 S106 A112 N113F16-L109 HydrophobicContact CD1-CD2 4.47Å; F16-L109 HydrophobicContact CE1-CD1 4.46Å; F16-L109 HydrophobicContact CE1-CD2 3.66Å; F16-L109 HydrophobicContact CE1-CG 3.62Å; F16-L109 HydrophobicContact CZ-CD1 3.95Å; F16-L109 HydrophobicContact CZ-CD2 3.87Å; F16-L109 HydrophobicContact CZ-CG 3.59Å; A105-L109 VanDerWaalsContact O-CB 3.3Å; A105-L109 WeakPolarHBondContact O-CB 3.46Å; A105-L109 PolarHBondContact O-N 2.84Å; S106-L109 PolarHBondContact O-N 3.06Å; L109-A112 PolarHBondContact O-N 3.16Å; L109-N113 PolarHBondContact O-N 3.22Å; L109-N113 PolarHBondContact O-ND2 3.23Å
110S71.2Confident69.7Low1 Ų154.2 Ų54.21%0.00728%0.282CS..Hα-helixtrans-64.3-45.4177-170.40000112.3F79 G83 S106 G107 I108 N113 G114F79-S110 VanDerWaalsContact CD1-CA 3.43Å; F79-S110 WeakPolarHBondContact CD1-O 3.32Å; F79-S110 WeakPolarHBondContact CD1-OG 3.35Å; F79-S110 WeakPolarHBondContact CE1-OG 3.35Å; F79-S110 PolarHBondContact O-OG 3.34Å; G83-S110 VanDerWaalsContact CA-OG 3.32Å; G83-S110 WeakPolarHBondContact CA-OG 3.45Å; G83-S110 PolarHBondContact N-OG 2.84Å; S106-S110 WeakPolarHBondContact O-CB 3.33Å; S106-S110 PolarHBondContact O-N 2.83Å; G107-S110 WeakPolarHBondContact O-CB 3.29Å; G107-S110 PolarHBondContact O-N 3.18Å; I108-S110 VanDerWaalsContact C-N 3.27Å; I108-S110 PolarHBondContact O-N 2.98Å; S110-N113 WeakPolarHBondContact O-CB 3.34Å; S110-N113 PolarHBondContact O-N 3.4Å; S110-G114 PolarHBondContact O-N 3.2Å; S110-G114 VanDerWaalsContact O-N 3.13Å
111L76.6Confident69Low66 Ų6653.6 Ų53.635%0.34628%0.283SS..Hα-helixtrans-66.8-37.8176.1-71.8168.7000112.3T84 G107 I108 N113 G114 A115T84-L111 HydrophobicContact CG2-CD2 4.21Å; G107-L111 WeakPolarHBondContact O-CG 3.43Å; G107-L111 PolarHBondContact O-N 2.93Å; I108-L111 PolarHBondContact O-N 3.39Å; L111-N113 VanDerWaalsContact C-N 3.31Å; L111-N113 PolarHBondContact O-N 3.05Å; L111-G114 PolarHBondContact O-N 3.26Å; L111-A115 PolarHBondContact O-N 2.96Å
112A77.1Confident67.8Low41 Ų4157.6 Ų57.634%0.33929%0.293SS..Hα-helixtrans-61.7-40.117500000111.4I108 L109 A115 I116I108-A112 VanDerWaalsContact O-CB 3.29Å; I108-A112 WeakPolarHBondContact O-CB 3.14Å; I108-A112 PolarHBondContact O-N 3.13Å; L109-A112 PolarHBondContact O-N 3.16Å; A112-A115 PolarHBondContact O-N 3.45Å; A112-I116 VanDerWaalsContact O-CG1 3.24Å; A112-I116 WeakPolarHBondContact O-CG1 3.23Å; A112-I116 PolarHBondContact O-N 2.98Å
113N71.1Confident66.6Low11 Ų1158.5 Ų58.56%0.05931%0.305CS..Hα-helixtrans-61.5-44.6173.4-82.4-31.6000113.6F16 S20 F79 L109 S110 L111 A115 I116 R117F16-N113 WeakPolarHBondContact CD1-ND2 3.36Å; F16-N113 WeakPolarHBondContact CD1-OD1 3.35Å; F16-N113 WeakPolarHBondContact CE1-ND2 3.43Å; F16-N113 WeakPolarHBondContact CE1-OD1 3.49Å; S20-N113 PolarHBondContact OG-ND2 2.93Å; S20-N113 VanDerWaalsContact OG-ND2 3.11Å; F79-N113 HydrophobicContact CB-CB 4.42Å; F79-N113 HydrophobicContact CD1-CB 3.48Å; F79-N113 VanDerWaalsContact CD1-CB 3.48Å; F79-N113 HydrophobicContact CD2-CB 4.26Å; F79-N113 HydrophobicContact CE1-CB 3.7Å; F79-N113 WeakPolarHBondContact CE1-ND2 2.86Å; F79-N113 HydrophobicContact CE2-CB 4.41Å; F79-N113 HydrophobicContact CG-CB 3.78Å; F79-N113 HydrophobicContact CZ-CB 4.14Å; F79-N113 WeakPolarHBondContact CZ-ND2 2.76Å; L109-N113 PolarHBondContact O-N 3.22Å; L109-N113 PolarHBondContact O-ND2 3.23Å; S110-N113 WeakPolarHBondContact O-CB 3.34Å; S110-N113 PolarHBondContact O-N 3.4Å; L111-N113 VanDerWaalsContact C-N 3.31Å; L111-N113 PolarHBondContact O-N 3.05Å; N113-A115 VanDerWaalsContact C-N 3.32Å; N113-I116 PolarHBondContact O-N 3.48Å; N113-R117 PolarHBondContact O-N 3Å; N113-R117 VanDerWaalsContact O-N 3.12Å
114G68.6Low65.6Low2 Ų260.5 Ų60.52%0.02132%0.317CS..Hα-helixtrans-55-52.2170.700000109.9F76 S110 L111 I116 R117 G118F76-G114 WeakPolarHBondContact CD2-O 3.22Å; F76-G114 WeakPolarHBondContact CE2-O 3.22Å; S110-G114 PolarHBondContact O-N 3.2Å; S110-G114 VanDerWaalsContact O-N 3.13Å; L111-G114 PolarHBondContact O-N 3.26Å; G114-I116 PolarHBondContact O-N 3.26Å; G114-R117 PolarHBondContact O-N 3.4Å; G114-G118 PolarHBondContact O-N 3.44Å
115A73.8Confident63.9Low52 Ų5261.1 Ų61.143%0.4334%0.336SS..Hα-helixtrans-61-39.5-178.600000114L111 A112 N113 G118 R119L111-A115 PolarHBondContact O-N 2.96Å; A112-A115 PolarHBondContact O-N 3.45Å; N113-A115 VanDerWaalsContact C-N 3.32Å; A115-G118 PolarHBondContact O-N 2.95Å; A115-R119 WeakPolarHBondContact O-CG 3.36Å; A115-R119 PolarHBondContact O-N 3.44Å
116I72.2Confident61.9Low93 Ų9367.3 Ų67.348%0.47735%0.353SS..Hα-helixtrans-64.2-47.1177.9-68.9162.9000110.5A112 N113 G114 G118 R119 H120A112-I116 VanDerWaalsContact O-CG1 3.24Å; A112-I116 WeakPolarHBondContact O-CG1 3.23Å; A112-I116 PolarHBondContact O-N 2.98Å; N113-I116 PolarHBondContact O-N 3.48Å; G114-I116 PolarHBondContact O-N 3.26Å; I116-G118 VanDerWaalsContact C-N 3.34Å; I116-G118 PolarHBondContact O-N 3.47Å; I116-R119 PolarHBondContact O-N 2.91Å; I116-H120 PolarHBondContact O-N 2.95Å
117R65.6Low60.2Low10 Ų1080.1 Ų80.14%0.03840%0.403CS..Hα-helixtrans-63.4-39.5175.2-71.7174.9-172.8-96.6-8.5112.2I17 Y46 N113 G114 R119 H120 F121I17-R117 VanDerWaalsContact CG1-NH2 3.33Å; Y46-R117 PolarHBondContact OH-NH1 3.41Å; N113-R117 PolarHBondContact O-N 3Å; N113-R117 VanDerWaalsContact O-N 3.12Å; G114-R117 PolarHBondContact O-N 3.4Å; R117-R119 VanDerWaalsContact C-N 3.35Å; R117-R119 PolarHBondContact O-N 2.91Å; R117-H120 WeakPolarHBondContact O-CB 3.31Å; R117-H120 PolarHBondContact O-N 3.27Å; R117-F121 PolarHBondContact O-N 3.25Å
118G62.5Low59.7Low21 Ų2184.2 Ų84.222%0.21642%0.423CS..Hα-helixtrans-65.4-34.1175.100000113.4G114 A115 I116 F121 R122G114-G118 PolarHBondContact O-N 3.44Å; A115-G118 PolarHBondContact O-N 2.95Å; I116-G118 VanDerWaalsContact C-N 3.34Å; I116-G118 PolarHBondContact O-N 3.47Å; G118-F121 WeakPolarHBondContact O-CB 3.31Å; G118-F121 PolarHBondContact O-N 3.2Å; G118-R122 PolarHBondContact O-N 2.88Å
119R59.3Low58.7Low195 Ų19583.2 Ų83.274%0.73642%0.418SS*.Hα-helixtrans-71.7-37.1172.2-77.1-168.9-176.3-173.33.4112.2A115 I116 R117 F121 R122 C123A115-R119 WeakPolarHBondContact O-CG 3.36Å; A115-R119 PolarHBondContact O-N 3.44Å; I116-R119 PolarHBondContact O-N 2.91Å; R117-R119 VanDerWaalsContact C-N 3.35Å; R117-R119 PolarHBondContact O-N 2.91Å; R119-F121 VanDerWaalsContact C-N 3.27Å; R119-F121 PolarHBondContact O-N 3.32Å; R119-R122 WeakPolarHBondContact O-CB 3.46Å; R119-R122 PolarHBondContact O-N 3.5Å; R119-R122 VanDerWaalsContact O-N 3.1Å; R119-C123 PolarHBondContact O-N 3.35Å
120H53.9Low57.9Low66 Ų6684.7 Ų84.731%0.30642%0.424SS..Hα-helixtrans-60.9-38.4173.4-166.6-87.2000111.4I116 R117 R122 C123 V124I116-H120 PolarHBondContact O-N 2.95Å; R117-H120 WeakPolarHBondContact O-CB 3.31Å; R117-H120 PolarHBondContact O-N 3.27Å; H120-R122 VanDerWaalsContact C-N 3.33Å; H120-R122 PolarHBondContact O-N 2.87Å; H120-C123 PolarHBondContact O-N 3.41Å; H120-V124 WeakPolarHBondContact O-CG2 3.38Å; H120-V124 PolarHBondContact O-N 2.88Å
121F50.1Low57.1Low108 Ų10889.6 Ų89.647%0.47445%0.449SS..Hα-helixtrans-58.2-41.4171.4-177-99.3000112.8I73 R117 G118 R119 C123 V124 G125I73-F121 HydrophobicContact CD1-CD2 4.41Å; I73-F121 HydrophobicContact CD1-CE2 3.9Å; I73-F121 HydrophobicContact CG1-CD2 4.07Å; I73-F121 HydrophobicContact CG1-CE2 4.03Å; R117-F121 PolarHBondContact O-N 3.25Å; G118-F121 WeakPolarHBondContact O-CB 3.31Å; G118-F121 PolarHBondContact O-N 3.2Å; R119-F121 VanDerWaalsContact C-N 3.27Å; R119-F121 PolarHBondContact O-N 3.32Å; F121-C123 VanDerWaalsContact C-N 3.28Å; F121-C123 PolarHBondContact O-N 3.4Å; F121-V124 PolarHBondContact O-N 3.43Å; F121-G125 PolarHBondContact O-N 3.24Å
122R45.6Very low55.9Low195 Ų19591.1 Ų91.174%0.73646%0.456SS*.Hα-helixtrans-65.3-29.3178-163.1179.2-69.1-176.1-2112.9G118 R119 H120G118-R122 PolarHBondContact O-N 2.88Å; R119-R122 WeakPolarHBondContact O-CB 3.46Å; R119-R122 PolarHBondContact O-N 3.5Å; R119-R122 VanDerWaalsContact O-N 3.1Å; H120-R122 VanDerWaalsContact C-N 3.33Å; H120-R122 PolarHBondContact O-N 2.87Å
123C45Very low54.5Low98 Ų9894.4 Ų94.466%0.66246%0.463SS*.Hα-helixtrans-81.5-32.4174.5-96.80000113.5R119 H120 F121R119-C123 PolarHBondContact O-N 3.35Å; H120-C123 PolarHBondContact O-N 3.41Å; F121-C123 VanDerWaalsContact C-N 3.28Å; F121-C123 PolarHBondContact O-N 3.4Å
124V46.2Very low53.3Low50 Ų50100.4 Ų100.430%0.30349%0.492SS..Hα-helixtrans-81.8-25.6179.5175.30000112.4I69 H120 F121 F126I69-V124 HydrophobicContact CD1-CG1 4.19Å; I69-V124 HydrophobicContact CG1-CG1 4.23Å; H120-V124 WeakPolarHBondContact O-CG2 3.38Å; H120-V124 PolarHBondContact O-N 2.88Å; F121-V124 PolarHBondContact O-N 3.43Å; V124-F126 PolarHBondContact O-N 3.18Å; V124-F126 VanDerWaalsContact O-N 3.17Å
125G33.5Very low52.1Low61 Ų61107.9 Ų107.963%0.62953%0.528SS*.THydrogen-bonded Turntrans-70.9-0.6177.100000116F121F121-G125 PolarHBondContact O-N 3.24Å
126F34.6Very low50.3Low180 Ų180112.6 Ų112.679%0.78954%0.537SS*.THydrogen-bonded Turntrans-112.712.6179.1-90.8-79.9000114.4V124V124-F126 PolarHBondContact O-N 3.18Å; V124-F126 VanDerWaalsContact O-N 3.17Å
127Y35.4Very low48.3Very low274 Ų274114.4 Ų114.4100%1.07554%0.542SS*.  trans-132.20172.9-88.5-79.9000113.4

Retrieved 127 of 127 residues in 55.3 ms (Link to these results)