C1M002_SCHMA Loading...

Vesicle transport protein GOT1B

AlphaFold DB , UniProt , Accession C1M002, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 141 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
1M34.9Very low60.4Low245 Ų245118.5 Ų118.5100%1.20763%0.633SS**  041.90-96.1176.2169.100112.5
2L38.4Very low62.7Low183 Ų183119.4 Ų119.496%0.95863%0.627SS**  trans-14037.9179.2-73.2174.9000112.8
3G49.9Very low64.7Low70 Ų70118 Ų11872%0.72262%0.619SS**  trans-1190.4-179.100000115.4
4Y44.7Very low66.6Low214 Ų214109.6 Ų109.684%0.83958%0.575SS**SBendtrans-91.3-18.9-161-166.1-120.2000116
5N53.6Low68.2Low97 Ų97105.3 Ų105.352%0.51955%0.552SS.*SBendtrans-118.7-29.3-166.8-63.6-25.8000116.6S7 S8 D9N5-S7 VanDerWaalsContact C-N 3.33Å; N5-S7 PolarHBondContact O-N 3.32Å; N5-S8 PolarHBondContact O-N 3.13Å; N5-D9 PolarHBondContact O-N 3.39Å
6N53.6Low69.7Low136 Ų136100.4 Ų100.473%0.72754%0.535SS*.Hα-helixtrans-62.4-37.7-173.8-74.7-15.5000113.5S8 D9 F10N6-S8 VanDerWaalsContact C-N 3.29Å; N6-S8 PolarHBondContact O-N 3.02Å; N6-D9 PolarHBondContact O-N 3.48Å; N6-F10 WeakPolarHBondContact O-CB 3.12Å; N6-F10 PolarHBondContact O-N 3.43Å
7S58.7Low71.2Confident84 Ų8497.5 Ų97.559%0.58752%0.519SS*.Hα-helixtrans-61.4-37.9-178.4-54.30000112.1N5 Q11N5-S7 VanDerWaalsContact C-N 3.33Å; N5-S7 PolarHBondContact O-N 3.32Å; S7-Q11 WeakPolarHBondContact O-CB 3.12Å; S7-Q11 VanDerWaalsContact O-CD 3.29Å; S7-Q11 WeakPolarHBondContact O-CG 3.47Å; S7-Q11 PolarHBondContact O-N 2.97Å; S7-Q11 PolarHBondContact O-OE1 3.4Å
8S75.6Confident72.4Confident47 Ų4794.2 Ų94.233%0.32950%0.501SS..Hα-helixtrans-75.1-38.3-179.4103.40000112.1N5 N6 Q11 K12N5-S8 PolarHBondContact O-N 3.13Å; N6-S8 VanDerWaalsContact C-N 3.29Å; N6-S8 PolarHBondContact O-N 3.02Å; S8-Q11 WeakPolarHBondContact O-CB 3.43Å; S8-Q11 PolarHBondContact O-N 3.11Å; S8-K12 WeakPolarHBondContact O-CG 3.3Å; S8-K12 PolarHBondContact O-N 3.23Å
9D84.1Confident73.6Confident69 Ų6992.5 Ų92.537%0.36950%0.502SS..Hα-helixtrans-71.2-38.9-177.9-63.6-36.7000111N5 N6 Q11 K12 I13N5-D9 PolarHBondContact O-N 3.39Å; N6-D9 PolarHBondContact O-N 3.48Å; D9-Q11 VanDerWaalsContact C-N 3.26Å; D9-Q11 PolarHBondContact O-N 3.25Å; D9-K12 PolarHBondContact O-N 3.3Å; D9-K12 IonicContact OD1-NZ 2.8Å; D9-K12 PolarHBondContact OD1-NZ 3.43Å; D9-I13 WeakPolarHBondContact O-CG1 3.42Å; D9-I13 PolarHBondContact O-N 2.82Å
10F85.3Confident74.7Confident112 Ų11294.9 Ų94.949%0.49151%0.508SS..Hα-helixtrans-61.7-36.6171.7-146.1-97.2000111.9N6 G14 C51N6-F10 WeakPolarHBondContact O-CB 3.12Å; N6-F10 PolarHBondContact O-N 3.43Å; F10-G14 PolarHBondContact O-N 2.83Å; F10-C51 HydrophobicContact CD1-CB 3.7Å; F10-C51 HydrophobicContact CE1-CB 3.73Å; F10-C51 WeakPolarHBondContact CE1-SG 3.21Å
11Q85.9Confident75.8Confident47 Ų4790.3 Ų90.322%0.2248%0.484CS..Hα-helixtrans-68.5-38174-76.2169.9-21.200112.9S7 S8 D9 G14 L15 L52 F111S7-Q11 WeakPolarHBondContact O-CB 3.12Å; S7-Q11 VanDerWaalsContact O-CD 3.29Å; S7-Q11 WeakPolarHBondContact O-CG 3.47Å; S7-Q11 PolarHBondContact O-N 2.97Å; S7-Q11 PolarHBondContact O-OE1 3.4Å; S8-Q11 WeakPolarHBondContact O-CB 3.43Å; S8-Q11 PolarHBondContact O-N 3.11Å; D9-Q11 VanDerWaalsContact C-N 3.26Å; D9-Q11 PolarHBondContact O-N 3.25Å; Q11-G14 CarbonylContact O-C 2.97Å; Q11-G14 PolarHBondContact O-N 2.8Å; Q11-L15 WeakPolarHBondContact O-CB 3.43Å; Q11-L15 PolarHBondContact O-N 3.17Å; Q11-L52 HydrophobicContact CB-CD2 4.17Å; Q11-L52 HydrophobicContact CG-CD2 4.49Å; Q11-L52 WeakPolarHBondContact CG-O 3.27Å; Q11-L52 PolarHBondContact NE2-O 3.44Å; Q11-L52 VanDerWaalsContact O-CD2 3.32Å; Q11-L52 WeakPolarHBondContact O-CD2 3.49Å; Q11-F111 HydrophobicContact CB-CE1 4.5Å; Q11-F111 VanDerWaalsContact CD-CE1 3.45Å; Q11-F111 HydrophobicContact CG-CE1 4.33Å; Q11-F111 HydrophobicContact CG-CZ 4.4Å
12K87.3Confident78.7Confident129 Ų12981.6 Ų81.656%0.56144%0.444SS*.Hα-helixtrans-63.2-45.5173.6-69169-162.4160.40111.2S8 D9 G14 L15 G16S8-K12 WeakPolarHBondContact O-CG 3.3Å; S8-K12 PolarHBondContact O-N 3.23Å; D9-K12 PolarHBondContact O-N 3.3Å; D9-K12 IonicContact OD1-NZ 2.8Å; D9-K12 PolarHBondContact OD1-NZ 3.43Å; K12-G14 VanDerWaalsContact C-N 3.31Å; K12-L15 WeakPolarHBondContact O-CB 3.26Å; K12-L15 PolarHBondContact O-N 3.21Å; K12-G16 PolarHBondContact O-N 2.95Å; K12-G16 VanDerWaalsContact O-N 3.09Å
13I89.7Confident81.5Confident101 Ų10174.8 Ų74.852%0.51842%0.418SS..Hα-helixtrans-60.1-46.5173.5-67.2167.1000109.3D9 L15 G16 L17D9-I13 WeakPolarHBondContact O-CG1 3.42Å; D9-I13 PolarHBondContact O-N 2.82Å; I13-L15 VanDerWaalsContact C-N 3.31Å; I13-L15 PolarHBondContact O-N 3.45Å; I13-G16 WeakPolarHBondContact O-CA 3.42Å; I13-G16 PolarHBondContact O-N 3.06Å; I13-L17 HydrophobicContact CG2-CD1 3.46Å; I13-L17 VanDerWaalsContact CG2-CD1 3.46Å; I13-L17 WeakPolarHBondContact O-CD1 3.46Å; I13-L17 PolarHBondContact O-N 2.9Å
14G91.4Very high83.8Confident0 Ų074.5 Ų74.50%040%0.397CS..Hα-helixtrans-57.6-39.8176.400000113.9F10 Q11 K12 G16 L17 L18 G48F10-G14 PolarHBondContact O-N 2.83Å; Q11-G14 CarbonylContact O-C 2.97Å; Q11-G14 PolarHBondContact O-N 2.8Å; K12-G14 VanDerWaalsContact C-N 3.31Å; G14-G16 VanDerWaalsContact C-N 3.35Å; G14-L17 PolarHBondContact O-N 3.37Å; G14-L18 WeakPolarHBondContact O-CB 3.08Å; G14-L18 PolarHBondContact O-N 3.04Å; G14-G48 VanDerWaalsContact O-CA 3.24Å; G14-G48 WeakPolarHBondContact O-CA 3.34Å
15L89.8Confident86.2Confident45 Ų4565.7 Ų65.724%0.23636%0.364CS..Hα-helixtrans-62.7-42.7174-175.768.7000111.3Q11 K12 I13 L18 A19 L52 L112 V115Q11-L15 WeakPolarHBondContact O-CB 3.43Å; Q11-L15 PolarHBondContact O-N 3.17Å; K12-L15 WeakPolarHBondContact O-CB 3.26Å; K12-L15 PolarHBondContact O-N 3.21Å; I13-L15 VanDerWaalsContact C-N 3.31Å; I13-L15 PolarHBondContact O-N 3.45Å; L15-L18 PolarHBondContact O-N 3.35Å; L15-A19 WeakPolarHBondContact O-CB 3.44Å; L15-A19 PolarHBondContact O-N 3.34Å; L15-L52 HydrophobicContact CB-CD2 4.3Å; L15-L112 HydrophobicContact CD1-CD1 4.2Å; L15-V115 HydrophobicContact CD2-CG2 3.46Å; L15-V115 VanDerWaalsContact CD2-CG2 3.46Å
16G92.5Very high88.3Confident27 Ų2764.9 Ų64.928%0.27837%0.365SS..Hα-helixtrans-60-50.2173.400000112.1K12 I13 G14 L18 A19 F20K12-G16 PolarHBondContact O-N 2.95Å; K12-G16 VanDerWaalsContact O-N 3.09Å; I13-G16 WeakPolarHBondContact O-CA 3.42Å; I13-G16 PolarHBondContact O-N 3.06Å; G14-G16 VanDerWaalsContact C-N 3.35Å; G16-L18 VanDerWaalsContact C-N 3.29Å; G16-L18 PolarHBondContact O-N 3.28Å; G16-A19 PolarHBondContact O-N 3.01Å; G16-F20 WeakPolarHBondContact O-CD2 3.32Å; G16-F20 PolarHBondContact O-N 3.28Å
17L95.5Very high90.4Very high51 Ų5161.9 Ų61.927%0.26735%0.349SS..Hα-helixtrans-58.9-40.5176.1-87.486.9000112.2I13 G14 F20 G21 L44I13-L17 HydrophobicContact CG2-CD1 3.46Å; I13-L17 VanDerWaalsContact CG2-CD1 3.46Å; I13-L17 WeakPolarHBondContact O-CD1 3.46Å; I13-L17 PolarHBondContact O-N 2.9Å; G14-L17 PolarHBondContact O-N 3.37Å; L17-F20 PolarHBondContact O-N 2.98Å; L17-G21 PolarHBondContact O-N 3.11Å; L17-L44 HydrophobicContact CD2-CD2 4.44Å
18L93.4Very high92.1Very high38 Ų3857.9 Ų57.920%0.19932%0.321CS..Hα-helixtrans-66.3-43.5179-162.1152.6000110.7G14 L15 G16 G21 V22 F45 I49 L52G14-L18 WeakPolarHBondContact O-CB 3.08Å; G14-L18 PolarHBondContact O-N 3.04Å; L15-L18 PolarHBondContact O-N 3.35Å; G16-L18 VanDerWaalsContact C-N 3.29Å; G16-L18 PolarHBondContact O-N 3.28Å; L18-G21 PolarHBondContact O-N 3.33Å; L18-V22 HydrophobicContact CD2-CG2 4.09Å; L18-V22 WeakPolarHBondContact O-CG2 3.49Å; L18-V22 PolarHBondContact O-N 3.03Å; L18-F45 HydrophobicContact CD1-CE2 4.44Å; L18-F45 HydrophobicContact CD2-CD2 4.27Å; L18-F45 HydrophobicContact CD2-CE2 4.1Å; L18-F45 HydrophobicContact CG-CD2 3.97Å; L18-F45 HydrophobicContact CG-CE2 4.07Å; L18-I49 HydrophobicContact CD1-CD1 4.33Å; L18-I49 HydrophobicContact CD1-CG1 3.41Å; L18-I49 VanDerWaalsContact CD1-CG1 3.41Å; L18-I49 HydrophobicContact CG-CG1 4.37Å; L18-L52 HydrophobicContact CB-CD1 4.3Å; L18-L52 HydrophobicContact CD1-CD1 3.48Å; L18-L52 VanDerWaalsContact CD1-CD1 3.48Å
19A94Very high93.1Very high63 Ų6358.7 Ų58.752%0.52132%0.324SS..Hα-helixtrans-61.6-45.3174.800000111.9L15 G16 V22 G23L15-A19 WeakPolarHBondContact O-CB 3.44Å; L15-A19 PolarHBondContact O-N 3.34Å; G16-A19 PolarHBondContact O-N 3.01Å; A19-V22 PolarHBondContact O-N 2.95Å; A19-G23 PolarHBondContact O-N 3.23Å
20F96.9Very high93.7Very high139 Ų13961.6 Ų61.661%0.6134%0.338SS*.Hα-helixtrans-63.4-42.2174.1-76.7-61.6000112G16 L17 G23 F24 L44G16-F20 WeakPolarHBondContact O-CD2 3.32Å; G16-F20 PolarHBondContact O-N 3.28Å; L17-F20 PolarHBondContact O-N 2.98Å; F20-G23 CarbonylContact O-C 3.57Å; F20-G23 WeakPolarHBondContact O-CA 3.4Å; F20-G23 PolarHBondContact O-N 2.83Å; F20-G23 VanDerWaalsContact O-N 3.15Å; F20-F24 HydrophobicContact CB-CD2 4.45Å; F20-F24 WeakPolarHBondContact O-CD2 3.26Å; F20-F24 PolarHBondContact O-N 3.36Å; F20-L44 HydrophobicContact CB-CD1 4.33Å
21G97.3Very high94.1Very high0 Ų062.5 Ų62.50%034%0.343CS..Hα-helixtrans-59.1-49.1177.200000112L17 L18 G23 F24 L25 G41L17-G21 PolarHBondContact O-N 3.11Å; L18-G21 PolarHBondContact O-N 3.33Å; G21-G23 VanDerWaalsContact C-N 3.32Å; G21-G23 PolarHBondContact O-N 3.47Å; G21-F24 PolarHBondContact O-N 3.22Å; G21-L25 VanDerWaalsContact O-CG 3.32Å; G21-L25 WeakPolarHBondContact O-CG 3.36Å; G21-L25 PolarHBondContact O-N 2.93Å; G21-G41 WeakPolarHBondContact CA-O 3.45Å; G21-G41 WeakPolarHBondContact O-CA 3.3Å
22V95.6Very high94.4Very high62 Ų6269.6 Ų69.638%0.37637%0.373SS..Hα-helixtrans-60-43.3173.1174.40000110.9L18 A19 F24 L25 C26 F45L18-V22 HydrophobicContact CD2-CG2 4.09Å; L18-V22 WeakPolarHBondContact O-CG2 3.49Å; L18-V22 PolarHBondContact O-N 3.03Å; A19-V22 PolarHBondContact O-N 2.95Å; V22-F24 PolarHBondContact O-N 3.03Å; V22-L25 PolarHBondContact O-N 3.26Å; V22-C26 PolarHBondContact O-N 2.79Å; V22-C26 PolarHBondContact O-SG 2.83Å; V22-C26 VanDerWaalsContact O-SG 3.35Å; V22-F45 HydrophobicContact CG2-CD2 4Å; V22-F45 HydrophobicContact CG2-CE2 4.17Å
23G97.5Very high94.6Very high40 Ų4066.8 Ų66.841%0.41236%0.361SS..Hα-helixtrans-57.7-46.3175.900000113A19 F20 G21 C26 L27A19-G23 PolarHBondContact O-N 3.23Å; F20-G23 CarbonylContact O-C 3.57Å; F20-G23 WeakPolarHBondContact O-CA 3.4Å; F20-G23 PolarHBondContact O-N 2.83Å; F20-G23 VanDerWaalsContact O-N 3.15Å; G21-G23 VanDerWaalsContact C-N 3.32Å; G21-G23 PolarHBondContact O-N 3.47Å; G23-C26 PolarHBondContact O-N 2.9Å; G23-L27 VanDerWaalsContact O-CB 3.32Å; G23-L27 WeakPolarHBondContact O-CB 3.34Å; G23-L27 PolarHBondContact O-N 3.36Å
24F97.3Very high94.9Very high64 Ų6464.8 Ų64.828%0.28135%0.351SS..Hα-helixtrans-69.3-34177.3-83.5-69000112.8F20 G21 V22 L27 G28 L37 L40 L44F20-F24 HydrophobicContact CB-CD2 4.45Å; F20-F24 WeakPolarHBondContact O-CD2 3.26Å; F20-F24 PolarHBondContact O-N 3.36Å; G21-F24 PolarHBondContact O-N 3.22Å; V22-F24 PolarHBondContact O-N 3.03Å; F24-L27 PolarHBondContact O-N 2.98Å; F24-G28 PolarHBondContact O-N 2.9Å; F24-L37 HydrophobicContact CD1-CD2 3.68Å; F24-L37 HydrophobicContact CE1-CD2 4.02Å; F24-L40 HydrophobicContact CD1-CD2 3.84Å; F24-L40 HydrophobicContact CD2-CD2 4.27Å; F24-L40 HydrophobicContact CD2-CG 4.49Å; F24-L40 HydrophobicContact CE1-CD2 3.7Å; F24-L40 HydrophobicContact CE2-CD2 4.15Å; F24-L40 HydrophobicContact CG-CD2 4.13Å; F24-L40 HydrophobicContact CG-CG 4.4Å; F24-L40 HydrophobicContact CZ-CD2 3.87Å; F24-L44 HydrophobicContact CD2-CD1 3.36Å; F24-L44 HydrophobicContact CE2-CD1 3.7Å; F24-L44 HydrophobicContact CG-CD1 4.32Å
25L96.3Very high94.9Very high28 Ų2866 Ų6615%0.14736%0.363CS..Hα-helixtrans-62.7-47.7170.9-71172.7000111G21 V22 L27 G28 V29 L38G21-L25 VanDerWaalsContact O-CG 3.32Å; G21-L25 WeakPolarHBondContact O-CG 3.36Å; G21-L25 PolarHBondContact O-N 2.93Å; V22-L25 PolarHBondContact O-N 3.26Å; L25-L27 VanDerWaalsContact C-N 3.32Å; L25-L27 PolarHBondContact O-N 3.33Å; L25-G28 PolarHBondContact O-N 2.97Å; L25-V29 WeakPolarHBondContact O-CG2 3.41Å; L25-V29 PolarHBondContact O-N 3.18Å; L25-L38 HydrophobicContact CD2-CD2 4.2Å; L25-L38 WeakPolarHBondContact CD2-O 3.39Å
26C96.6Very high95.1Very high81 Ų8167.2 Ų67.255%0.54738%0.381SS..Hα-helixtrans-60.7-42.6175-69.50000111.8V22 G23 V29 L30V22-C26 PolarHBondContact O-N 2.79Å; V22-C26 PolarHBondContact O-SG 2.83Å; V22-C26 VanDerWaalsContact O-SG 3.35Å; G23-C26 PolarHBondContact O-N 2.9Å; C26-V29 PolarHBondContact O-N 3.33Å; C26-L30 WeakPolarHBondContact O-CB 3.22Å; C26-L30 PolarHBondContact O-N 2.98Å
27L97Very high95.2Very high72 Ų7267.3 Ų67.338%0.37738%0.375SS..Hα-helixtrans-67.5-38.4179.4-161.6130.3000111.4G23 F24 L25 L30 F31 L37G23-L27 VanDerWaalsContact O-CB 3.32Å; G23-L27 WeakPolarHBondContact O-CB 3.34Å; G23-L27 PolarHBondContact O-N 3.36Å; F24-L27 PolarHBondContact O-N 2.98Å; L25-L27 VanDerWaalsContact C-N 3.32Å; L25-L27 PolarHBondContact O-N 3.33Å; L27-L30 PolarHBondContact O-N 3.47Å; L27-F31 HydrophobicContact CD2-CD2 4.49Å; L27-F31 WeakPolarHBondContact O-CB 3.47Å; L27-F31 PolarHBondContact O-N 2.96Å; L27-L37 HydrophobicContact CD2-CD1 3.52Å; L27-L37 HydrophobicContact CD2-CD2 3.45Å; L27-L37 VanDerWaalsContact CD2-CD2 3.45Å; L27-L37 HydrophobicContact CD2-CG 4.08Å
28G96.1Very high95.3Very high0 Ų065 Ų650%036%0.362CS..Hα-helixtrans-61.9-42173.500000112.5F24 L25 F33 D34 L37F24-G28 PolarHBondContact O-N 2.9Å; L25-G28 PolarHBondContact O-N 2.97Å; G28-F33 CarbonylContact O-C 3.56Å; G28-F33 WeakPolarHBondContact O-CA 3.43Å; G28-F33 PolarHBondContact O-N 2.8Å; G28-D34 PolarHBondContact O-N 2.9Å; G28-L37 VanDerWaalsContact CA-CB 3.5Å
29V95.7Very high95.3Very high64 Ų6464.3 Ų64.339%0.38836%0.362SS..Hα-helixtrans-63.8-44.7171.9175.60000111.4L25 C26 F31 F32 F33 L38 I90L25-V29 WeakPolarHBondContact O-CG2 3.41Å; L25-V29 PolarHBondContact O-N 3.18Å; C26-V29 PolarHBondContact O-N 3.33Å; V29-F31 PolarHBondContact O-N 3.41Å; V29-F32 PolarHBondContact O-N 3.48Å; V29-F33 HydrophobicContact CG1-CE1 4.03Å; V29-F33 HydrophobicContact CG1-CZ 4.42Å; V29-F33 HydrophobicContact CG2-CD1 4.39Å; V29-F33 HydrophobicContact CG2-CE1 4.28Å; V29-F33 PolarHBondContact O-N 3.42Å; V29-L38 HydrophobicContact CG2-CD2 4.09Å; V29-I90 HydrophobicContact CG2-CD1 3.93Å
30L96Very high95.4Very high130 Ų13065 Ų6568%0.68136%0.357SS*.Hα-helixtrans-64-38.4-179.1-174.468000112.5C26 L27 F32C26-L30 WeakPolarHBondContact O-CB 3.22Å; C26-L30 PolarHBondContact O-N 2.98Å; L27-L30 PolarHBondContact O-N 3.47Å; L30-F32 PolarHBondContact O-N 3.18Å
31F94.6Very high95.5Very high132 Ų13258.3 Ų58.358%0.57933%0.328SS*.THydrogen-bonded Turntrans-80.339.9176.6-101.4-120.4000112.5L27 V29 F33 D34 L37L27-F31 HydrophobicContact CD2-CD2 4.49Å; L27-F31 WeakPolarHBondContact O-CB 3.47Å; L27-F31 PolarHBondContact O-N 2.96Å; V29-F31 PolarHBondContact O-N 3.41Å; F31-F33 PolarHBondContact O-N 2.72Å; F31-D34 HydrophobicContact CB-CB 4.18Å; F31-L37 HydrophobicContact CB-CD1 3.92Å; F31-L37 HydrophobicContact CD1-CD1 4.39Å; F31-L37 HydrophobicContact CG-CD1 4.24Å
32F92.4Very high95.4Very high195 Ų19558.4 Ų58.486%0.85533%0.328SS*.THydrogen-bonded Turntrans5649179.9-63.9-81.3000113.8V29 L30V29-F32 PolarHBondContact O-N 3.48Å; L30-F32 PolarHBondContact O-N 3.18Å
33F92Very high95.4Very high70 Ų7060.3 Ų60.331%0.30734%0.34SS..SBendtrans60.744.8177.3-61.7-73.6000114.1G28 V29 F31 G35 P86 F87 I90G28-F33 CarbonylContact O-C 3.56Å; G28-F33 WeakPolarHBondContact O-CA 3.43Å; G28-F33 PolarHBondContact O-N 2.8Å; V29-F33 HydrophobicContact CG1-CE1 4.03Å; V29-F33 HydrophobicContact CG1-CZ 4.42Å; V29-F33 HydrophobicContact CG2-CD1 4.39Å; V29-F33 HydrophobicContact CG2-CE1 4.28Å; V29-F33 PolarHBondContact O-N 3.42Å; F31-F33 PolarHBondContact O-N 2.72Å; F33-G35 PolarHBondContact O-N 3.48Å; F33-G35 VanDerWaalsContact O-N 3.11Å; F33-P86 HydrophobicContact CB-CB 3.73Å; F33-P86 HydrophobicContact CB-CG 3.51Å; F33-P86 HydrophobicContact CG-CB 4.43Å; F33-P86 HydrophobicContact CG-CG 4.28Å; F33-F87 HydrophobicContact CE1-CD2 4.26Å; F33-F87 HydrophobicContact CE2-CD2 4.22Å; F33-F87 AromaticContact CZ-CD2 3.72Å; F33-F87 HydrophobicContact CZ-CD2 3.72Å; F33-F87 HydrophobicContact CZ-CE2 4.34Å; F33-I90 HydrophobicContact CD1-CD1 3.34Å; F33-I90 HydrophobicContact CE1-CD1 3.58Å
34D94.3Very high95.3Very high59 Ų5960.3 Ų60.332%0.31633%0.33SS..  trans-61.6112.9176.9-175.7-54.5000110.8G28 F31 A36 L37 L38G28-D34 PolarHBondContact O-N 2.9Å; F31-D34 HydrophobicContact CB-CB 4.18Å; D34-A36 VanDerWaalsContact C-N 3.29Å; D34-A36 PolarHBondContact O-N 2.86Å; D34-A36 WeakPolarHBondContact OD1-CA 3.17Å; D34-A36 WeakPolarHBondContact OD1-CB 3.07Å; D34-A36 PolarHBondContact OD1-N 2.99Å; D34-L37 HydrophobicContact CB-CB 4.1Å; D34-L37 HydrophobicContact CB-CD1 3.66Å; D34-L37 HydrophobicContact CB-CG 4.24Å; D34-L37 PolarHBondContact O-N 2.99Å; D34-L37 PolarHBondContact OD1-N 3.18Å; D34-L38 WeakPolarHBondContact O-CB 3.2Å; D34-L38 WeakPolarHBondContact O-CG 3.44Å; D34-L38 PolarHBondContact O-N 3.44Å
35G91.7Very high95.2Very high25 Ų2558.3 Ų58.326%0.25832%0.321SS..Hα-helixtrans-63.3-30-17700000114F33 A39F33-G35 PolarHBondContact O-N 3.48Å; F33-G35 VanDerWaalsContact O-N 3.11Å; G35-A39 WeakPolarHBondContact O-CB 3.44Å; G35-A39 PolarHBondContact O-N 2.82Å
36A93.9Very high95Very high72 Ų7258.9 Ų58.960%0.59532%0.324SS*.Hα-helixtrans-73.6-42.4179.100000111.1D34 A39 L40D34-A36 VanDerWaalsContact C-N 3.29Å; D34-A36 PolarHBondContact O-N 2.86Å; D34-A36 WeakPolarHBondContact OD1-CA 3.17Å; D34-A36 WeakPolarHBondContact OD1-CB 3.07Å; D34-A36 PolarHBondContact OD1-N 2.99Å; A36-A39 PolarHBondContact O-N 3.08Å; A36-L40 WeakPolarHBondContact O-CB 3.5Å; A36-L40 PolarHBondContact O-N 2.8Å
37L95.9Very high94.9Very high29 Ų2956.4 Ų56.415%0.15231%0.312CS..Hα-helixtrans-65.4-41.4174.6-74.7162.2000111.7F24 L27 G28 F31 D34 L40 G41F24-L37 HydrophobicContact CD1-CD2 3.68Å; F24-L37 HydrophobicContact CE1-CD2 4.02Å; L27-L37 HydrophobicContact CD2-CD1 3.52Å; L27-L37 HydrophobicContact CD2-CD2 3.45Å; L27-L37 VanDerWaalsContact CD2-CD2 3.45Å; L27-L37 HydrophobicContact CD2-CG 4.08Å; G28-L37 VanDerWaalsContact CA-CB 3.5Å; F31-L37 HydrophobicContact CB-CD1 3.92Å; F31-L37 HydrophobicContact CD1-CD1 4.39Å; F31-L37 HydrophobicContact CG-CD1 4.24Å; D34-L37 HydrophobicContact CB-CB 4.1Å; D34-L37 HydrophobicContact CB-CD1 3.66Å; D34-L37 HydrophobicContact CB-CG 4.24Å; D34-L37 PolarHBondContact O-N 2.99Å; D34-L37 PolarHBondContact OD1-N 3.18Å; L37-L40 PolarHBondContact O-N 2.89Å; L37-G41 PolarHBondContact O-N 3.47Å
38L96Very high94.7Very high1 Ų153 Ų531%0.00529%0.294CS..Hα-helixtrans-63.5-46174.5-69.3168.1000111.6L25 V29 D34 L40 G41 N42 V81 P86 I90L25-L38 HydrophobicContact CD2-CD2 4.2Å; L25-L38 WeakPolarHBondContact CD2-O 3.39Å; V29-L38 HydrophobicContact CG2-CD2 4.09Å; D34-L38 WeakPolarHBondContact O-CB 3.2Å; D34-L38 WeakPolarHBondContact O-CG 3.44Å; D34-L38 PolarHBondContact O-N 3.44Å; L38-L40 PolarHBondContact O-N 3.5Å; L38-G41 PolarHBondContact O-N 3.37Å; L38-N42 WeakPolarHBondContact O-CB 3.33Å; L38-N42 PolarHBondContact O-N 3.47Å; L38-N42 PolarHBondContact O-ND2 3.36Å; L38-V81 HydrophobicContact CB-CG1 4.11Å; L38-V81 HydrophobicContact CD1-CG1 3.82Å; L38-P86 HydrophobicContact CD1-CB 4.09Å; L38-I90 HydrophobicContact CD1-CD1 3.76Å; L38-I90 HydrophobicContact CD1-CG1 4.23Å; L38-I90 HydrophobicContact CD2-CD1 3.91Å; L38-I90 HydrophobicContact CD2-CG1 4.25Å
39A95.2Very high94.4Very high25 Ų2553.7 Ų53.721%0.20730%0.298CS..Hα-helixtrans-61.8-45177.400000111.7G35 A36 G41 N42 V43 L82G35-A39 WeakPolarHBondContact O-CB 3.44Å; G35-A39 PolarHBondContact O-N 2.82Å; A36-A39 PolarHBondContact O-N 3.08Å; A39-G41 VanDerWaalsContact C-N 3.34Å; A39-G41 PolarHBondContact O-N 2.83Å; A39-N42 PolarHBondContact O-N 2.86Å; A39-V43 WeakPolarHBondContact O-CG2 3.29Å; A39-V43 PolarHBondContact O-N 3.49Å; A39-L82 HydrophobicContact CB-CD2 4.11Å
40L96.3Very high94.1Very high76 Ų7650.9 Ų50.940%0.39828%0.282SS..Hα-helixtrans-61-44.8175.4-179.363.3000111.2F24 A36 L37 L38 N42 V43 L44F24-L40 HydrophobicContact CD1-CD2 3.84Å; F24-L40 HydrophobicContact CD2-CD2 4.27Å; F24-L40 HydrophobicContact CD2-CG 4.49Å; F24-L40 HydrophobicContact CE1-CD2 3.7Å; F24-L40 HydrophobicContact CE2-CD2 4.15Å; F24-L40 HydrophobicContact CG-CD2 4.13Å; F24-L40 HydrophobicContact CG-CG 4.4Å; F24-L40 HydrophobicContact CZ-CD2 3.87Å; A36-L40 WeakPolarHBondContact O-CB 3.5Å; A36-L40 PolarHBondContact O-N 2.8Å; L37-L40 PolarHBondContact O-N 2.89Å; L38-L40 PolarHBondContact O-N 3.5Å; L40-N42 VanDerWaalsContact C-N 3.34Å; L40-N42 PolarHBondContact O-N 3.28Å; L40-V43 PolarHBondContact O-N 3.34Å; L40-L44 HydrophobicContact CD1-CD1 4.13Å; L40-L44 HydrophobicContact CD1-CG 4.25Å; L40-L44 HydrophobicContact CG-CD1 3.95Å; L40-L44 HydrophobicContact CG-CG 4.47Å; L40-L44 WeakPolarHBondContact O-CB 3.49Å; L40-L44 WeakPolarHBondContact O-CG 3.46Å; L40-L44 PolarHBondContact O-N 3.15Å
41G97.4Very high93.8Very high0 Ų045.7 Ų45.70%026%0.257CS..Hα-helixtrans-57.5-45.8175.500000112.3G21 L37 L38 A39 L44 F45G21-G41 WeakPolarHBondContact CA-O 3.45Å; G21-G41 WeakPolarHBondContact O-CA 3.3Å; L37-G41 PolarHBondContact O-N 3.47Å; L38-G41 PolarHBondContact O-N 3.37Å; A39-G41 VanDerWaalsContact C-N 3.34Å; A39-G41 PolarHBondContact O-N 2.83Å; G41-L44 PolarHBondContact O-N 2.81Å; G41-F45 WeakPolarHBondContact O-CB 3.44Å; G41-F45 PolarHBondContact O-N 3.46Å
42N95.7Very high93.4Very high2 Ų240.1 Ų40.11%0.01123%0.233CC..Hα-helixtrans-62.9-42.3176.7-80.1-42.6000112.8L38 A39 L40 L46 F74 I78 E93L38-N42 WeakPolarHBondContact O-CB 3.33Å; L38-N42 PolarHBondContact O-N 3.47Å; L38-N42 PolarHBondContact O-ND2 3.36Å; A39-N42 PolarHBondContact O-N 2.86Å; L40-N42 VanDerWaalsContact C-N 3.34Å; L40-N42 PolarHBondContact O-N 3.28Å; N42-L46 WeakPolarHBondContact O-CB 3.4Å; N42-L46 WeakPolarHBondContact O-CG 3.33Å; N42-L46 PolarHBondContact O-N 3.39Å; N42-F74 HydrophobicContact CB-CZ 4.37Å; N42-I78 HydrophobicContact CB-CD1 3.97Å; N42-I78 HydrophobicContact CB-CG1 4.24Å; N42-E93 PolarHBondContact ND2-OE1 3.26Å; N42-E93 PolarHBondContact ND2-OE2 3.14Å
43V95.3Very high93.1Very high102 Ų10232.6 Ų32.662%0.61820%0.201SC*.Hα-helixtrans-64.4-47.6176.6171.60000111.1A39 L40 L46 G47A39-V43 WeakPolarHBondContact O-CG2 3.29Å; A39-V43 PolarHBondContact O-N 3.49Å; L40-V43 PolarHBondContact O-N 3.34Å; V43-L46 PolarHBondContact O-N 2.84Å; V43-G47 PolarHBondContact O-N 3.32Å
44L96.8Very high92.7Very high39 Ų3930.5 Ų30.520%0.20420%0.199CC..Hα-helixtrans-64.9-39.8178.7-73.2172.5000112L17 F20 F24 L40 G41 G47 G48L17-L44 HydrophobicContact CD2-CD2 4.44Å; F20-L44 HydrophobicContact CB-CD1 4.33Å; F24-L44 HydrophobicContact CD2-CD1 3.36Å; F24-L44 HydrophobicContact CE2-CD1 3.7Å; F24-L44 HydrophobicContact CG-CD1 4.32Å; L40-L44 HydrophobicContact CD1-CD1 4.13Å; L40-L44 HydrophobicContact CD1-CG 4.25Å; L40-L44 HydrophobicContact CG-CD1 3.95Å; L40-L44 HydrophobicContact CG-CG 4.47Å; L40-L44 WeakPolarHBondContact O-CB 3.49Å; L40-L44 WeakPolarHBondContact O-CG 3.46Å; L40-L44 PolarHBondContact O-N 3.15Å; G41-L44 PolarHBondContact O-N 2.81Å; L44-G47 PolarHBondContact O-N 3.45Å; L44-G48 PolarHBondContact O-N 2.79Å
45F94.5Very high92Very high23 Ų2333.4 Ų33.410%0.10121%0.214CC..Hα-helixtrans-63-49.1177179.3-100.9000111.7L18 V22 G41 G47 G48 I49 M97 F101L18-F45 HydrophobicContact CD1-CE2 4.44Å; L18-F45 HydrophobicContact CD2-CD2 4.27Å; L18-F45 HydrophobicContact CD2-CE2 4.1Å; L18-F45 HydrophobicContact CG-CD2 3.97Å; L18-F45 HydrophobicContact CG-CE2 4.07Å; V22-F45 HydrophobicContact CG2-CD2 4Å; V22-F45 HydrophobicContact CG2-CE2 4.17Å; G41-F45 WeakPolarHBondContact O-CB 3.44Å; G41-F45 PolarHBondContact O-N 3.46Å; F45-G47 PolarHBondContact O-N 3.07Å; F45-G48 PolarHBondContact O-N 3.21Å; F45-I49 HydrophobicContact CD1-CD1 3.99Å; F45-I49 HydrophobicContact CE1-CD1 3.31Å; F45-I49 HydrophobicContact CE1-CG1 4.33Å; F45-I49 HydrophobicContact CE2-CD1 3.97Å; F45-I49 HydrophobicContact CE2-CG1 4.48Å; F45-I49 HydrophobicContact CZ-CD1 3.32Å; F45-I49 HydrophobicContact CZ-CG1 4.28Å; F45-I49 WeakPolarHBondContact O-CG1 3.01Å; F45-I49 PolarHBondContact O-N 3.35Å; F45-M97 HydrophobicContact CD1-SD 3.8Å; F45-M97 HydrophobicContact CE1-CG 4.23Å; F45-M97 HydrophobicContact CE1-SD 3.27Å; F45-M97 WeakPolarHBondContact CE1-SD 3.47Å; F45-M97 HydrophobicContact CZ-CE 4.49Å; F45-M97 HydrophobicContact CZ-SD 3.72Å; F45-F101 HydrophobicContact CE1-CD2 4.05Å; F45-F101 AromaticContact CE1-CE2 3.72Å; F45-F101 HydrophobicContact CE1-CE2 3.72Å; F45-F101 HydrophobicContact CE1-CZ 4.45Å
46L92.4Very high91.4Very high39 Ų3939.9 Ų39.920%0.20424%0.238CC..Hα-helixtrans-61.9-43.5175.9-75.6-175.9000112.3N42 V43 I49 G50 F62 F74 F75 F101N42-L46 WeakPolarHBondContact O-CB 3.4Å; N42-L46 WeakPolarHBondContact O-CG 3.33Å; N42-L46 PolarHBondContact O-N 3.39Å; V43-L46 PolarHBondContact O-N 2.84Å; L46-I49 PolarHBondContact O-N 2.92Å; L46-G50 PolarHBondContact O-N 2.86Å; L46-F62 HydrophobicContact CD2-CZ 3.88Å; L46-F74 HydrophobicContact CD1-CE1 3.57Å; L46-F74 HydrophobicContact CD1-CZ 4.29Å; L46-F74 HydrophobicContact CD2-CD1 4.39Å; L46-F74 HydrophobicContact CD2-CE1 3.63Å; L46-F74 HydrophobicContact CD2-CZ 4.03Å; L46-F74 HydrophobicContact CG-CE1 3.71Å; L46-F74 HydrophobicContact CG-CZ 4.02Å; L46-F75 HydrophobicContact CD1-CE1 3.83Å; L46-F75 HydrophobicContact CD1-CZ 4Å; L46-F101 HydrophobicContact CD2-CE2 4.31Å; L46-F101 HydrophobicContact CD2-CZ 3.67Å
47G93.4Very high90.7Very high29 Ų2943.5 Ų43.530%0.29924%0.24SC..Hα-helixtrans-59.5-47.4175.100000111.6V43 L44 F45 G50 C51V43-G47 PolarHBondContact O-N 3.32Å; L44-G47 PolarHBondContact O-N 3.45Å; F45-G47 PolarHBondContact O-N 3.07Å; G47-G50 PolarHBondContact O-N 3.49Å; G47-C51 PolarHBondContact O-N 3.29Å; G47-C51 PolarHBondContact O-SG 2.91Å
48G93Very high89.9Confident0 Ų042.5 Ų42.50%024%0.236CC..Hα-helixtrans-61.4-44.917800000113.1G14 L44 F45 C51 L52G14-G48 VanDerWaalsContact O-CA 3.24Å; G14-G48 WeakPolarHBondContact O-CA 3.34Å; L44-G48 PolarHBondContact O-N 2.79Å; F45-G48 PolarHBondContact O-N 3.21Å; G48-C51 PolarHBondContact O-N 3.46Å; G48-L52 PolarHBondContact O-N 3.36Å
49I89.7Confident89.1Confident15 Ų1545.5 Ų45.58%0.07726%0.256CS..Hα-helixtrans-62-43.9173.4-73.9-172.7000111.2L18 F45 L46 C51 L52 I53 F101L18-I49 HydrophobicContact CD1-CD1 4.33Å; L18-I49 HydrophobicContact CD1-CG1 3.41Å; L18-I49 VanDerWaalsContact CD1-CG1 3.41Å; L18-I49 HydrophobicContact CG-CG1 4.37Å; F45-I49 HydrophobicContact CD1-CD1 3.99Å; F45-I49 HydrophobicContact CE1-CD1 3.31Å; F45-I49 HydrophobicContact CE1-CG1 4.33Å; F45-I49 HydrophobicContact CE2-CD1 3.97Å; F45-I49 HydrophobicContact CE2-CG1 4.48Å; F45-I49 HydrophobicContact CZ-CD1 3.32Å; F45-I49 HydrophobicContact CZ-CG1 4.28Å; F45-I49 WeakPolarHBondContact O-CG1 3.01Å; F45-I49 PolarHBondContact O-N 3.35Å; L46-I49 PolarHBondContact O-N 2.92Å; I49-C51 VanDerWaalsContact C-N 3.27Å; I49-C51 PolarHBondContact O-N 3.28Å; I49-L52 PolarHBondContact O-N 2.91Å; I49-I53 HydrophobicContact CG2-CD1 3.41Å; I49-I53 VanDerWaalsContact CG2-CD1 3.41Å; I49-I53 HydrophobicContact CG2-CG1 4.19Å; I49-I53 WeakPolarHBondContact O-CG1 3.33Å; I49-I53 PolarHBondContact O-N 3.27Å; I49-F101 HydrophobicContact CD1-CD1 3.85Å; I49-F101 HydrophobicContact CD1-CD2 3.97Å; I49-F101 HydrophobicContact CD1-CE1 3.85Å; I49-F101 HydrophobicContact CD1-CE2 3.95Å; I49-F101 HydrophobicContact CD1-CG 3.93Å; I49-F101 HydrophobicContact CD1-CZ 3.89Å; I49-F101 HydrophobicContact CG2-CD1 4.04Å; I49-F101 HydrophobicContact CG2-CE1 3.72Å; I49-F101 HydrophobicContact CG2-CZ 4.46Å
50G89.6Confident88.4Confident6 Ų648.9 Ų48.96%0.06228%0.275CS..Hα-helixtrans-57.9-41.4175.900000111.9L46 G47 G54 L55L46-G50 PolarHBondContact O-N 2.86Å; G47-G50 PolarHBondContact O-N 3.49Å; G50-G54 CarbonylContact O-C 3.55Å; G50-G54 WeakPolarHBondContact O-CA 3.27Å; G50-G54 PolarHBondContact O-N 3.49Å; G50-L55 PolarHBondContact O-N 3.48Å
51C88.9Confident87.4Confident21 Ų2146.3 Ų46.314%0.14226%0.26CS..Hα-helixtrans-68.6-39174.8-66.40000112.9F10 G47 G48 I49F10-C51 HydrophobicContact CD1-CB 3.7Å; F10-C51 HydrophobicContact CE1-CB 3.73Å; F10-C51 WeakPolarHBondContact CE1-SG 3.21Å; G47-C51 PolarHBondContact O-N 3.29Å; G47-C51 PolarHBondContact O-SG 2.91Å; G48-C51 PolarHBondContact O-N 3.46Å; I49-C51 VanDerWaalsContact C-N 3.27Å; I49-C51 PolarHBondContact O-N 3.28Å
52L87.2Confident86.4Confident14 Ų1448.2 Ų48.27%0.07327%0.269CS..Hα-helixtrans-69.3-47-179.8-82.7167.7000113.2Q11 L15 L18 G48 I49 F111Q11-L52 HydrophobicContact CB-CD2 4.17Å; Q11-L52 HydrophobicContact CG-CD2 4.49Å; Q11-L52 WeakPolarHBondContact CG-O 3.27Å; Q11-L52 PolarHBondContact NE2-O 3.44Å; Q11-L52 VanDerWaalsContact O-CD2 3.32Å; Q11-L52 WeakPolarHBondContact O-CD2 3.49Å; L15-L52 HydrophobicContact CB-CD2 4.3Å; L18-L52 HydrophobicContact CB-CD1 4.3Å; L18-L52 HydrophobicContact CD1-CD1 3.48Å; L18-L52 VanDerWaalsContact CD1-CD1 3.48Å; G48-L52 PolarHBondContact O-N 3.36Å; I49-L52 PolarHBondContact O-N 2.91Å; L52-F111 HydrophobicContact CD2-CG 4.45Å
53I85Confident85.6Confident37 Ų3756.6 Ų56.619%0.1931%0.305CS..Hα-helixtrans-83.3-24.6-177.8-57.5172.6000110.9I49 K57 F104I49-I53 HydrophobicContact CG2-CD1 3.41Å; I49-I53 VanDerWaalsContact CG2-CD1 3.41Å; I49-I53 HydrophobicContact CG2-CG1 4.19Å; I49-I53 WeakPolarHBondContact O-CG1 3.33Å; I49-I53 PolarHBondContact O-N 3.27Å; I53-K57 HydrophobicContact CG2-CB 3.98Å; I53-F104 HydrophobicContact CD1-CB 3.77Å; I53-F104 HydrophobicContact CD1-CD1 3.59Å; I53-F104 HydrophobicContact CD1-CD2 3.63Å; I53-F104 HydrophobicContact CD1-CE1 3.94Å; I53-F104 HydrophobicContact CD1-CE2 3.93Å; I53-F104 HydrophobicContact CD1-CG 3.4Å; I53-F104 VanDerWaalsContact CD1-CG 3.4Å; I53-F104 HydrophobicContact CD1-CZ 4.07Å; I53-F104 HydrophobicContact CG1-CD1 4.25Å; I53-F104 HydrophobicContact CG1-CG 4.41Å; I53-F104 HydrophobicContact CG2-CD1 4.08Å; I53-F104 HydrophobicContact CG2-CE1 3.72Å; I53-F104 HydrophobicContact CG2-CZ 4.24Å
54G84.3Confident84.8Confident27 Ų2759.1 Ų59.128%0.27830%0.304SS..  trans97.2128.9-170.400000111.1G50 Q56 K57 A58G50-G54 CarbonylContact O-C 3.55Å; G50-G54 WeakPolarHBondContact O-CA 3.27Å; G50-G54 PolarHBondContact O-N 3.49Å; G54-Q56 VanDerWaalsContact C-N 3.31Å; G54-Q56 PolarHBondContact O-N 2.97Å; G54-K57 PolarHBondContact O-N 3.18Å; G54-A58 PolarHBondContact O-N 3.19Å
55L79.3Confident83.7Confident119 Ų11967.9 Ų67.962%0.62333%0.334SS*.Hα-helixtrans-56.9-42.7-170.9-17265.7000112.6G50 K57 A58 C59G50-L55 PolarHBondContact O-N 3.48Å; L55-K57 PolarHBondContact O-N 2.87Å; L55-A58 PolarHBondContact O-N 2.56Å; L55-C59 WeakPolarHBondContact O-CB 3.32Å; L55-C59 PolarHBondContact O-N 3.1Å; L55-C59 PolarHBondContact O-SG 3.3Å
56Q79.3Confident83Confident162 Ų16270.1 Ų70.176%0.75735%0.35SS*.Hα-helixtrans-63.4-42.5178.8-170.11783.700111.9G54 C59 T60G54-Q56 VanDerWaalsContact C-N 3.31Å; G54-Q56 PolarHBondContact O-N 2.97Å; Q56-C59 PolarHBondContact O-N 2.91Å; Q56-T60 PolarHBondContact O-N 3.4Å; Q56-T60 PolarHBondContact O-OG1 3.23Å
57K79.4Confident82.5Confident147 Ų14768.4 Ų68.464%0.63934%0.341SS*.Hα-helixtrans-68.1-40.4178.7-63.2-67.8-176.71760111I53 G54 L55 F61I53-K57 HydrophobicContact CG2-CB 3.98Å; G54-K57 PolarHBondContact O-N 3.18Å; L55-K57 PolarHBondContact O-N 2.87Å; K57-F61 WeakPolarHBondContact O-CB 3.41Å; K57-F61 PolarHBondContact O-N 3.37Å
58A79.6Confident82.1Confident8 Ų870.5 Ų70.57%0.06635%0.345CS..Hα-helixtrans-61.5-50.8174.700000110.9G54 L55 T60 F61 F62G54-A58 PolarHBondContact O-N 3.19Å; L55-A58 PolarHBondContact O-N 2.56Å; A58-T60 PolarHBondContact O-N 2.8Å; A58-F61 WeakPolarHBondContact O-CB 3.47Å; A58-F61 PolarHBondContact O-N 3.01Å; A58-F61 VanDerWaalsContact O-N 3.13Å; A58-F62 WeakPolarHBondContact O-CD2 3.46Å; A58-F62 PolarHBondContact O-N 3.12Å
59C77.9Confident81.9Confident64 Ų6477.8 Ų77.843%0.43238%0.377SS..Hα-helixtrans-58.2-51.4177.6-71.30000112.1L55 Q56 F61 F62 F63L55-C59 WeakPolarHBondContact O-CB 3.32Å; L55-C59 PolarHBondContact O-N 3.1Å; L55-C59 PolarHBondContact O-SG 3.3Å; Q56-C59 PolarHBondContact O-N 2.91Å; C59-F61 PolarHBondContact O-N 3.47Å; C59-F62 PolarHBondContact O-N 2.84Å; C59-F62 VanDerWaalsContact O-N 3.17Å; C59-F63 WeakPolarHBondContact O-CD2 3.33Å; C59-F63 PolarHBondContact O-N 2.83Å; C59-F63 VanDerWaalsContact O-N 3.09Å
60T80.8Confident82Confident97 Ų9777.1 Ų77.160%0.59537%0.373SS*.Hα-helixtrans-59.8-33.1177.8-55.90000112.2Q56 A58 R64Q56-T60 PolarHBondContact O-N 3.4Å; Q56-T60 PolarHBondContact O-OG1 3.23Å; A58-T60 PolarHBondContact O-N 2.8Å; T60-R64 PolarHBondContact O-N 2.76Å
61F76.7Confident82.1Confident21 Ų2177.1 Ų77.19%0.09237%0.373CS..Hα-helixtrans-71.8-42.1176.1-179.8-88.1000113K57 A58 C59 F63 R64 S67 L100 K103 F104K57-F61 WeakPolarHBondContact O-CB 3.41Å; K57-F61 PolarHBondContact O-N 3.37Å; A58-F61 WeakPolarHBondContact O-CB 3.47Å; A58-F61 PolarHBondContact O-N 3.01Å; A58-F61 VanDerWaalsContact O-N 3.13Å; C59-F61 PolarHBondContact O-N 3.47Å; F61-F63 VanDerWaalsContact C-N 3.31Å; F61-F63 PolarHBondContact O-N 2.99Å; F61-R64 VanDerWaalsContact O-CB 3.25Å; F61-R64 WeakPolarHBondContact O-CB 3.32Å; F61-R64 PolarHBondContact O-N 3.22Å; F61-R64 VanDerWaalsContact O-N 3.1Å; F61-S67 VanDerWaalsContact CE1-CB 3.49Å; F61-S67 WeakPolarHBondContact CE1-OG 3.35Å; F61-S67 WeakPolarHBondContact CE2-OG 3.4Å; F61-S67 WeakPolarHBondContact CZ-OG 3.28Å; F61-S67 VanDerWaalsContact O-CB 3.31Å; F61-S67 WeakPolarHBondContact O-CB 3.27Å; F61-S67 PolarHBondContact O-OG 3.44Å; F61-L100 HydrophobicContact CE1-CD1 4.02Å; F61-L100 WeakPolarHBondContact CE1-O 3.17Å; F61-L100 WeakPolarHBondContact CZ-O 3.29Å; F61-K103 HydrophobicContact CE2-CB 4.14Å; F61-K103 HydrophobicContact CE2-CD 3.74Å; F61-K103 HydrophobicContact CZ-CB 4.28Å; F61-K103 HydrophobicContact CZ-CD 4.01Å; F61-F104 HydrophobicContact CB-CE2 4.28Å; F61-F104 HydrophobicContact CB-CZ 3.75Å; F61-F104 AromaticContact CD1-CE2 3.35Å; F61-F104 HydrophobicContact CD1-CE2 3.35Å; F61-F104 AromaticContact CD1-CZ 3.7Å; F61-F104 HydrophobicContact CD1-CZ 3.7Å; F61-F104 HydrophobicContact CD2-CE1 4.22Å; F61-F104 AromaticContact CD2-CE2 3.65Å; F61-F104 HydrophobicContact CD2-CE2 3.65Å; F61-F104 AromaticContact CD2-CZ 3.28Å; F61-F104 HydrophobicContact CD2-CZ 3.28Å; F61-F104 HydrophobicContact CE1-CD2 4.21Å; F61-F104 AromaticContact CE1-CE2 3.34Å; F61-F104 HydrophobicContact CE1-CE2 3.34Å; F61-F104 HydrophobicContact CE1-CZ 4.03Å; F61-F104 HydrophobicContact CE2-CD2 4.45Å; F61-F104 HydrophobicContact CE2-CE1 4.47Å; F61-F104 AromaticContact CE2-CE2 3.62Å; F61-F104 HydrophobicContact CE2-CE2 3.62Å; F61-F104 AromaticContact CE2-CZ 3.63Å; F61-F104 HydrophobicContact CE2-CZ 3.63Å; F61-F104 AromaticContact CG-CE2 3.49Å; F61-F104 HydrophobicContact CG-CE2 3.49Å; F61-F104 VanDerWaalsContact CG-CE2 3.49Å; F61-F104 AromaticContact CG-CZ 3.29Å; F61-F104 HydrophobicContact CG-CZ 3.29Å; F61-F104 HydrophobicContact CZ-CD2 4.14Å; F61-F104 AromaticContact CZ-CE2 3.45Å; F61-F104 HydrophobicContact CZ-CE2 3.45Å; F61-F104 VanDerWaalsContact CZ-CE2 3.45Å; F61-F104 AromaticContact CZ-CZ 3.99Å; F61-F104 HydrophobicContact CZ-CZ 3.99Å
62F76.6Confident82.3Confident40 Ų4080.9 Ų80.918%0.17540%0.395CS..Hα-helixtrans-61.6-38.4176.8-96.2-86.3000112.1L46 A58 C59 R64 L68 A71 F75 L100 F101L46-F62 HydrophobicContact CD2-CZ 3.88Å; A58-F62 WeakPolarHBondContact O-CD2 3.46Å; A58-F62 PolarHBondContact O-N 3.12Å; C59-F62 PolarHBondContact O-N 2.84Å; C59-F62 VanDerWaalsContact O-N 3.17Å; F62-R64 PolarHBondContact O-N 3.43Å; F62-L68 VanDerWaalsContact O-CD2 3.29Å; F62-L68 WeakPolarHBondContact O-CD2 3.13Å; F62-A71 HydrophobicContact CD1-CB 3.82Å; F62-A71 HydrophobicContact CE1-CB 4.02Å; F62-F75 AromaticContact CD1-CE2 3.93Å; F62-F75 HydrophobicContact CD1-CE2 3.93Å; F62-F75 HydrophobicContact CE1-CD2 4.48Å; F62-F75 AromaticContact CE1-CE2 3.45Å; F62-F75 HydrophobicContact CE1-CE2 3.45Å; F62-F75 VanDerWaalsContact CE1-CE2 3.45Å; F62-F75 AromaticContact CE1-CZ 3.92Å; F62-F75 HydrophobicContact CE1-CZ 3.92Å; F62-F75 HydrophobicContact CZ-CE2 4.38Å; F62-F75 HydrophobicContact CZ-CZ 4.44Å; F62-L100 HydrophobicContact CD1-CD1 4.13Å; F62-L100 HydrophobicContact CD1-CD2 4.43Å; F62-L100 HydrophobicContact CE1-CD1 3.93Å; F62-L100 HydrophobicContact CE1-CD2 3.45Å; F62-L100 VanDerWaalsContact CE1-CD2 3.45Å; F62-L100 HydrophobicContact CE1-CG 4.24Å; F62-L100 HydrophobicContact CE2-CD2 4.35Å; F62-L100 HydrophobicContact CZ-CD1 4.33Å; F62-L100 HydrophobicContact CZ-CD2 3.44Å; F62-L100 VanDerWaalsContact CZ-CD2 3.44Å; F62-L100 HydrophobicContact CZ-CG 4.26Å; F62-F101 HydrophobicContact CE2-CE1 4.15Å; F62-F101 HydrophobicContact CE2-CZ 4.3Å; F62-F101 HydrophobicContact CZ-CE1 4.27Å; F62-F101 AromaticContact CZ-CZ 4Å; F62-F101 HydrophobicContact CZ-CZ 4Å
63F77Confident82.7Confident178 Ų17884.3 Ų84.378%0.78141%0.409SS*.THydrogen-bonded Turntrans-75.6-4176.3-81-78000114.3C59 F61C59-F63 WeakPolarHBondContact O-CD2 3.33Å; C59-F63 PolarHBondContact O-N 2.83Å; C59-F63 VanDerWaalsContact O-N 3.09Å; F61-F63 VanDerWaalsContact C-N 3.31Å; F61-F63 PolarHBondContact O-N 2.99Å
64R79.4Confident83.1Confident155 Ų15582.6 Ų82.659%0.58540%0.4SS*.SBendtrans-81127.4-178.9-154.1179169.7-178-3.6110.1T60 F61 F62 T66 S67 L68T60-R64 PolarHBondContact O-N 2.76Å; F61-R64 VanDerWaalsContact O-CB 3.25Å; F61-R64 WeakPolarHBondContact O-CB 3.32Å; F61-R64 PolarHBondContact O-N 3.22Å; F61-R64 VanDerWaalsContact O-N 3.1Å; F62-R64 PolarHBondContact O-N 3.43Å; R64-T66 HydrophobicContact CB-CG2 4.28Å; R64-T66 HydrophobicContact CG-CG2 3.89Å; R64-T66 PolarHBondContact O-N 3.31Å; R64-S67 PolarHBondContact O-N 3.34Å; R64-L68 PolarHBondContact O-N 3.15Å; R64-L68 VanDerWaalsContact O-N 3.12Å
65R74.6Confident83.6Confident224 Ų22485.8 Ų85.885%0.84541%0.407SS*.Hα-helixtrans-49.8-34.3-177.9-77.4-162.4-179.9-166.62.1115.2S67 L68R65-S67 VanDerWaalsContact C-N 3.28Å; R65-S67 PolarHBondContact O-N 2.89Å; R65-L68 HydrophobicContact CG-CD1 4.23Å
66T78.6Confident84.4Confident70 Ų7081.4 Ų81.443%0.42939%0.391SS..Hα-helixtrans-65.4-31177.5177.90000113.2R64 K103R64-T66 HydrophobicContact CB-CG2 4.28Å; R64-T66 HydrophobicContact CG-CG2 3.89Å; R64-T66 PolarHBondContact O-N 3.31Å; T66-K103 VanDerWaalsContact CG2-NZ 3.26Å; T66-K103 PolarHBondContact OG1-NZ 3.09Å
67S81.4Confident85.2Confident2 Ų273.7 Ų73.71%0.01436%0.355CS..Hα-helixtrans-95.9-18.8-176.5-52.90000112F61 R64 R65 K69 G70 A71F61-S67 VanDerWaalsContact CE1-CB 3.49Å; F61-S67 WeakPolarHBondContact CE1-OG 3.35Å; F61-S67 WeakPolarHBondContact CE2-OG 3.4Å; F61-S67 WeakPolarHBondContact CZ-OG 3.28Å; F61-S67 VanDerWaalsContact O-CB 3.31Å; F61-S67 WeakPolarHBondContact O-CB 3.27Å; F61-S67 PolarHBondContact O-OG 3.44Å; R64-S67 PolarHBondContact O-N 3.34Å; R65-S67 VanDerWaalsContact C-N 3.28Å; R65-S67 PolarHBondContact O-N 2.89Å; S67-K69 VanDerWaalsContact C-N 3.25Å; S67-K69 PolarHBondContact O-N 3.5Å; S67-G70 PolarHBondContact O-N 2.92Å; S67-G70 VanDerWaalsContact O-N 3.07Å; S67-A71 PolarHBondContact O-N 2.77Å
68L85Confident86Confident73 Ų7368 Ų6838%0.38233%0.331SS..Hα-helixtrans-54.9-37.2179.2-76.1179.4000113.2F62 R64 R65 G70 A71 V72F62-L68 VanDerWaalsContact O-CD2 3.29Å; F62-L68 WeakPolarHBondContact O-CD2 3.13Å; R64-L68 PolarHBondContact O-N 3.15Å; R64-L68 VanDerWaalsContact O-N 3.12Å; R65-L68 HydrophobicContact CG-CD1 4.23Å; L68-G70 PolarHBondContact O-N 3.3Å; L68-A71 PolarHBondContact O-N 2.92Å; L68-V72 WeakPolarHBondContact O-CB 3.21Å; L68-V72 VanDerWaalsContact O-CG2 3.27Å; L68-V72 WeakPolarHBondContact O-CG2 3.46Å; L68-V72 PolarHBondContact O-N 3.46Å
69K90.2Very high86.7Confident154 Ų15470.8 Ų70.867%0.6735%0.347SS*.Hα-helixtrans-57.3-50.9176.3-69.6-179.9179.2177.10110.9S67 A71 V72 F73S67-K69 VanDerWaalsContact C-N 3.25Å; S67-K69 PolarHBondContact O-N 3.5Å; K69-A71 VanDerWaalsContact C-N 3.34Å; K69-A71 PolarHBondContact O-N 3.29Å; K69-V72 PolarHBondContact O-N 3.19Å; K69-F73 VanDerWaalsContact O-CD2 3.26Å; K69-F73 WeakPolarHBondContact O-CD2 3.42Å; K69-F73 PolarHBondContact O-N 3Å; K69-F73 VanDerWaalsContact O-N 3.15Å
70G91.3Very high87.6Confident0 Ų069.7 Ų69.70%034%0.338CS..Hα-helixtrans-61.6-41.8176.400000112.3S67 L68 V72 F73 F74 G96 N99S67-G70 PolarHBondContact O-N 2.92Å; S67-G70 VanDerWaalsContact O-N 3.07Å; L68-G70 PolarHBondContact O-N 3.3Å; G70-V72 PolarHBondContact O-N 3.03Å; G70-F73 PolarHBondContact O-N 3.47Å; G70-F74 WeakPolarHBondContact O-CB 3.31Å; G70-F74 PolarHBondContact O-N 3.5Å; G70-G96 WeakPolarHBondContact O-CA 3.18Å; G70-N99 PolarHBondContact N-ND2 2.9Å
71A91.2Very high88.2Confident7 Ų765.4 Ų65.46%0.05831%0.312CS..Hα-helixtrans-62-42.8177.900000112.3F62 S67 L68 K69 F74 F75 L100F62-A71 HydrophobicContact CD1-CB 3.82Å; F62-A71 HydrophobicContact CE1-CB 4.02Å; S67-A71 PolarHBondContact O-N 2.77Å; L68-A71 PolarHBondContact O-N 2.92Å; K69-A71 VanDerWaalsContact C-N 3.34Å; K69-A71 PolarHBondContact O-N 3.29Å; A71-F74 PolarHBondContact O-N 2.9Å; A71-F75 HydrophobicContact CB-CD2 4.31Å; A71-F75 HydrophobicContact CB-CE2 4.43Å; A71-F75 WeakPolarHBondContact O-CD2 3.05Å; A71-F75 PolarHBondContact O-N 2.91Å; A71-L100 HydrophobicContact CB-CD1 3.98Å
72V93.6Very high89Confident99 Ų9969.8 Ų69.860%0.634%0.336SS*.Hα-helixtrans-63.3-44.5177.61700000111L68 K69 G70 F74 G76L68-V72 WeakPolarHBondContact O-CB 3.21Å; L68-V72 VanDerWaalsContact O-CG2 3.27Å; L68-V72 WeakPolarHBondContact O-CG2 3.46Å; L68-V72 PolarHBondContact O-N 3.46Å; K69-V72 PolarHBondContact O-N 3.19Å; G70-V72 PolarHBondContact O-N 3.03Å; V72-F74 VanDerWaalsContact C-N 3.33Å; V72-F74 PolarHBondContact O-N 2.84Å; V72-G76 VanDerWaalsContact O-CA 3.27Å; V72-G76 WeakPolarHBondContact O-CA 3.23Å; V72-G76 PolarHBondContact O-N 3.37Å
73F95.4Very high89.8Confident87 Ų8775.5 Ų75.538%0.38236%0.361SS..Hα-helixtrans-65.1-38175.4-83.4-76.2000112.2K69 G70 G77 L92 Y95K69-F73 VanDerWaalsContact O-CD2 3.26Å; K69-F73 WeakPolarHBondContact O-CD2 3.42Å; K69-F73 PolarHBondContact O-N 3Å; K69-F73 VanDerWaalsContact O-N 3.15Å; G70-F73 PolarHBondContact O-N 3.47Å; F73-G77 PolarHBondContact O-N 3.31Å; F73-L92 HydrophobicContact CD1-CD2 3.83Å; F73-L92 HydrophobicContact CE1-CD2 4.1Å; F73-Y95 HydrophobicContact CB-CD1 4Å; F73-Y95 HydrophobicContact CB-CE1 4.5Å; F73-Y95 AromaticContact CD1-CD1 3.82Å; F73-Y95 HydrophobicContact CD1-CD1 3.82Å; F73-Y95 HydrophobicContact CD1-CE1 4.1Å; F73-Y95 AromaticContact CD2-CD1 3.99Å; F73-Y95 HydrophobicContact CD2-CD1 3.99Å; F73-Y95 AromaticContact CD2-CE1 3.65Å; F73-Y95 HydrophobicContact CD2-CE1 3.65Å; F73-Y95 HydrophobicContact CE1-CD1 4.29Å; F73-Y95 HydrophobicContact CE1-CE1 4.23Å; F73-Y95 HydrophobicContact CE2-CD1 4.46Å; F73-Y95 AromaticContact CE2-CE1 3.81Å; F73-Y95 HydrophobicContact CE2-CE1 3.81Å; F73-Y95 AromaticContact CG-CD1 3.67Å; F73-Y95 HydrophobicContact CG-CD1 3.67Å; F73-Y95 AromaticContact CG-CE1 3.82Å; F73-Y95 HydrophobicContact CG-CE1 3.82Å; F73-Y95 HydrophobicContact CZ-CE1 4.1Å
74F93.7Very high90.5Very high0 Ų069.7 Ų69.70%035%0.351CS..Hα-helixtrans-67.4-57.6178.7-178.4-103.7000112.4N42 L46 G70 A71 V72 G76 G77 I78 E93 M97 L100N42-F74 HydrophobicContact CB-CZ 4.37Å; L46-F74 HydrophobicContact CD1-CE1 3.57Å; L46-F74 HydrophobicContact CD1-CZ 4.29Å; L46-F74 HydrophobicContact CD2-CD1 4.39Å; L46-F74 HydrophobicContact CD2-CE1 3.63Å; L46-F74 HydrophobicContact CD2-CZ 4.03Å; L46-F74 HydrophobicContact CG-CE1 3.71Å; L46-F74 HydrophobicContact CG-CZ 4.02Å; G70-F74 WeakPolarHBondContact O-CB 3.31Å; G70-F74 PolarHBondContact O-N 3.5Å; A71-F74 PolarHBondContact O-N 2.9Å; V72-F74 VanDerWaalsContact C-N 3.33Å; V72-F74 PolarHBondContact O-N 2.84Å; F74-G76 VanDerWaalsContact C-N 3.33Å; F74-G76 PolarHBondContact O-N 3.42Å; F74-G77 PolarHBondContact O-N 2.98Å; F74-I78 HydrophobicContact CD1-CD1 3.97Å; F74-I78 HydrophobicContact CE1-CD1 3.41Å; F74-I78 VanDerWaalsContact CE1-CD1 3.41Å; F74-I78 HydrophobicContact CE1-CG1 4.45Å; F74-I78 HydrophobicContact CZ-CD1 3.75Å; F74-I78 HydrophobicContact CZ-CG1 4.5Å; F74-I78 WeakPolarHBondContact O-CG1 3.37Å; F74-I78 PolarHBondContact O-N 2.91Å; F74-E93 HydrophobicContact CD2-CB 4.33Å; F74-E93 HydrophobicContact CD2-CG 4.48Å; F74-E93 HydrophobicContact CE2-CB 4.48Å; F74-M97 HydrophobicContact CD2-CB 4.34Å; F74-M97 HydrophobicContact CD2-CG 3.24Å; F74-M97 HydrophobicContact CD2-SD 4.38Å; F74-M97 HydrophobicContact CE2-CG 3.2Å; F74-M97 HydrophobicContact CE2-SD 3.75Å; F74-M97 HydrophobicContact CG-CG 4.38Å; F74-M97 HydrophobicContact CZ-CG 4.32Å; F74-L100 HydrophobicContact CB-CD2 4.41Å; F74-L100 HydrophobicContact CG-CD2 4.48Å
75F94.5Very high91.2Very high94 Ų9468.5 Ų68.541%0.41235%0.35SS..Hα-helixtrans-69.2-32.1179.2-70.8-67.5000112.8L46 F62 A71 G77 I78 T79L46-F75 HydrophobicContact CD1-CE1 3.83Å; L46-F75 HydrophobicContact CD1-CZ 4Å; F62-F75 AromaticContact CD1-CE2 3.93Å; F62-F75 HydrophobicContact CD1-CE2 3.93Å; F62-F75 HydrophobicContact CE1-CD2 4.48Å; F62-F75 AromaticContact CE1-CE2 3.45Å; F62-F75 HydrophobicContact CE1-CE2 3.45Å; F62-F75 VanDerWaalsContact CE1-CE2 3.45Å; F62-F75 AromaticContact CE1-CZ 3.92Å; F62-F75 HydrophobicContact CE1-CZ 3.92Å; F62-F75 HydrophobicContact CZ-CE2 4.38Å; F62-F75 HydrophobicContact CZ-CZ 4.44Å; A71-F75 HydrophobicContact CB-CD2 4.31Å; A71-F75 HydrophobicContact CB-CE2 4.43Å; A71-F75 WeakPolarHBondContact O-CD2 3.05Å; A71-F75 PolarHBondContact O-N 2.91Å; F75-G77 VanDerWaalsContact C-N 3.35Å; F75-I78 HydrophobicContact CD1-CD1 4.06Å; F75-I78 PolarHBondContact O-N 3.27Å; F75-T79 WeakPolarHBondContact O-CB 3.29Å; F75-T79 PolarHBondContact O-N 2.91Å; F75-T79 PolarHBondContact O-OG1 3.24Å
76G96.3Very high92.1Very high28 Ų2859.1 Ų59.129%0.28932%0.319SS..Hα-helixtrans-63.4-42.1170.500000111.3V72 F74 T79 V80V72-G76 VanDerWaalsContact O-CA 3.27Å; V72-G76 WeakPolarHBondContact O-CA 3.23Å; V72-G76 PolarHBondContact O-N 3.37Å; F74-G76 VanDerWaalsContact C-N 3.33Å; F74-G76 PolarHBondContact O-N 3.42Å; G76-T79 WeakPolarHBondContact O-CB 3.47Å; G76-T79 PolarHBondContact O-N 2.97Å; G76-V80 WeakPolarHBondContact O-CG2 3.45Å; G76-V80 PolarHBondContact O-N 3.29Å
77G96.1Very high92.8Very high0 Ų061.8 Ų61.80%032%0.324CS..Hα-helixtrans-58.1-49.6172.100000112.5F73 F74 F75 T79 V80 V81 G89F73-G77 PolarHBondContact O-N 3.31Å; F74-G77 PolarHBondContact O-N 2.98Å; F75-G77 VanDerWaalsContact C-N 3.35Å; G77-T79 PolarHBondContact O-N 3.21Å; G77-V80 WeakPolarHBondContact O-CA 3.42Å; G77-V80 WeakPolarHBondContact O-CB 3.38Å; G77-V80 PolarHBondContact O-N 3.25Å; G77-V81 WeakPolarHBondContact O-CG2 3.36Å; G77-V81 PolarHBondContact O-N 3.15Å; G77-G89 WeakPolarHBondContact O-CA 3.28Å
78I95.1Very high93.5Very high26 Ų2666.2 Ų66.213%0.13335%0.347CS..Hα-helixtrans-53.9-44.6174.5-66.6169.8000111N42 F74 F75 V80 V81 L82 E93N42-I78 HydrophobicContact CB-CD1 3.97Å; N42-I78 HydrophobicContact CB-CG1 4.24Å; F74-I78 HydrophobicContact CD1-CD1 3.97Å; F74-I78 HydrophobicContact CE1-CD1 3.41Å; F74-I78 VanDerWaalsContact CE1-CD1 3.41Å; F74-I78 HydrophobicContact CE1-CG1 4.45Å; F74-I78 HydrophobicContact CZ-CD1 3.75Å; F74-I78 HydrophobicContact CZ-CG1 4.5Å; F74-I78 WeakPolarHBondContact O-CG1 3.37Å; F74-I78 PolarHBondContact O-N 2.91Å; F75-I78 HydrophobicContact CD1-CD1 4.06Å; F75-I78 PolarHBondContact O-N 3.27Å; I78-V80 VanDerWaalsContact C-N 3.35Å; I78-V80 PolarHBondContact O-N 3.23Å; I78-V81 WeakPolarHBondContact O-CB 3.16Å; I78-V81 PolarHBondContact O-N 3.46Å; I78-L82 HydrophobicContact CG2-CD1 4.09Å; I78-L82 HydrophobicContact CG2-CG 4.46Å; I78-L82 WeakPolarHBondContact O-CG 3.21Å; I78-L82 PolarHBondContact O-N 3.25Å; I78-E93 WeakPolarHBondContact CA-OE1 3.32Å; I78-E93 HydrophobicContact CG1-CG 4.19Å; I78-E93 WeakPolarHBondContact CG1-OE1 3.11Å; I78-E93 PolarHBondContact N-OE1 3.4Å
79T95.6Very high94Very high68 Ų6862.8 Ų62.842%0.41733%0.329SS..Hα-helixtrans-63.2-42.8179.6-59.20000110.9F75 G76 G77 L82 F83F75-T79 WeakPolarHBondContact O-CB 3.29Å; F75-T79 PolarHBondContact O-N 2.91Å; F75-T79 PolarHBondContact O-OG1 3.24Å; G76-T79 WeakPolarHBondContact O-CB 3.47Å; G76-T79 PolarHBondContact O-N 2.97Å; G77-T79 PolarHBondContact O-N 3.21Å; T79-L82 PolarHBondContact O-N 3.35Å; T79-F83 HydrophobicContact CG2-CD2 3.65Å; T79-F83 HydrophobicContact CG2-CE2 3.39Å; T79-F83 WeakPolarHBondContact O-CD2 3.44Å; T79-F83 PolarHBondContact O-N 2.83Å
80V96.2Very high94.3Very high40 Ų4056.5 Ų56.524%0.24230%0.302CS..Hα-helixtrans-64.5-38.5176173.20000112G76 G77 I78 F83 F85 I88 L92G76-V80 WeakPolarHBondContact O-CG2 3.45Å; G76-V80 PolarHBondContact O-N 3.29Å; G77-V80 WeakPolarHBondContact O-CA 3.42Å; G77-V80 WeakPolarHBondContact O-CB 3.38Å; G77-V80 PolarHBondContact O-N 3.25Å; I78-V80 VanDerWaalsContact C-N 3.35Å; I78-V80 PolarHBondContact O-N 3.23Å; V80-F83 PolarHBondContact O-N 3.03Å; V80-F85 HydrophobicContact CG1-CB 3.74Å; V80-F85 PolarHBondContact O-N 3.17Å; V80-F85 VanDerWaalsContact O-N 3.13Å; V80-I88 HydrophobicContact CG1-CB 4.28Å; V80-I88 HydrophobicContact CG1-CG2 4.3Å; V80-L92 HydrophobicContact CB-CD1 4.48Å; V80-L92 HydrophobicContact CG2-CD1 4.07Å
81V94.7Very high94.5Very high7 Ų761.2 Ų61.24%0.04233%0.327CS..Hα-helixtrans-59.6-48.6172.6174.70000110.4L38 G77 I78 F83 G84 P86 I90 E93L38-V81 HydrophobicContact CB-CG1 4.11Å; L38-V81 HydrophobicContact CD1-CG1 3.82Å; G77-V81 WeakPolarHBondContact O-CG2 3.36Å; G77-V81 PolarHBondContact O-N 3.15Å; I78-V81 WeakPolarHBondContact O-CB 3.16Å; I78-V81 PolarHBondContact O-N 3.46Å; V81-F83 VanDerWaalsContact C-N 3.26Å; V81-F83 PolarHBondContact O-N 3.16Å; V81-G84 PolarHBondContact O-N 3.44Å; V81-P86 HydrophobicContact CG1-CB 4.13Å; V81-I90 HydrophobicContact CG2-CG1 4.44Å; V81-E93 WeakPolarHBondContact CG2-OE1 3.43Å
82L92.5Very high94.8Very high114 Ų11463.3 Ų63.360%0.59734%0.337SS*.Hα-helixtrans-65.2-27.8-179.7-68.7175.8000113.2A39 I78 T79 G84A39-L82 HydrophobicContact CB-CD2 4.11Å; I78-L82 HydrophobicContact CG2-CD1 4.09Å; I78-L82 HydrophobicContact CG2-CG 4.46Å; I78-L82 WeakPolarHBondContact O-CG 3.21Å; I78-L82 PolarHBondContact O-N 3.25Å; T79-L82 PolarHBondContact O-N 3.35Å; L82-G84 PolarHBondContact O-N 3.21Å
83F94Very high94.9Very high160 Ų16059 Ų5970%0.70231%0.31SS*.THydrogen-bonded Turntrans-79.85.3173.5-78.8-61.6000114.3T79 V80 V81T79-F83 HydrophobicContact CG2-CD2 3.65Å; T79-F83 HydrophobicContact CG2-CE2 3.39Å; T79-F83 WeakPolarHBondContact O-CD2 3.44Å; T79-F83 PolarHBondContact O-N 2.83Å; V80-F83 PolarHBondContact O-N 3.03Å; V81-F83 VanDerWaalsContact C-N 3.26Å; V81-F83 PolarHBondContact O-N 3.16Å
84G91.8Very high94.8Very high55 Ų5558.5 Ų58.557%0.56731%0.311SS*.THydrogen-bonded Turntrans92.112.7173.500000114.9V81 L82 P86V81-G84 PolarHBondContact O-N 3.44Å; L82-G84 PolarHBondContact O-N 3.21Å; G84-P86 WeakPolarHBondContact O-CD 3.44Å
85F93.9Very high94.9Very high130 Ų13064.9 Ų64.957%0.5734%0.336SS*.  trans-111.961.3173-62.4-80.1000111.3V80 F87 I88 G89V80-F85 HydrophobicContact CG1-CB 3.74Å; V80-F85 PolarHBondContact O-N 3.17Å; V80-F85 VanDerWaalsContact O-N 3.13Å; F85-F87 VanDerWaalsContact C-N 3.31Å; F85-F87 PolarHBondContact O-N 3.45Å; F85-I88 PolarHBondContact O-N 3.22Å; F85-G89 PolarHBondContact O-N 3.43Å
86P93.2Very high94.9Very high28 Ų2860.4 Ų60.418%0.18232%0.316CS..Hα-helixtrans-65.3-33.2-168.129.3-38000113.2F33 L38 V81 G84 G89 I90F33-P86 HydrophobicContact CB-CB 3.73Å; F33-P86 HydrophobicContact CB-CG 3.51Å; F33-P86 HydrophobicContact CG-CB 4.43Å; F33-P86 HydrophobicContact CG-CG 4.28Å; L38-P86 HydrophobicContact CD1-CB 4.09Å; V81-P86 HydrophobicContact CG1-CB 4.13Å; G84-P86 WeakPolarHBondContact O-CD 3.44Å; P86-G89 PolarHBondContact O-N 3.44Å; P86-I90 WeakPolarHBondContact O-CB 3.37Å; P86-I90 WeakPolarHBondContact O-CD1 3.14Å; P86-I90 VanDerWaalsContact O-CG1 3.26Å; P86-I90 WeakPolarHBondContact O-CG1 3.35Å; P86-I90 PolarHBondContact O-N 2.88Å
87F92.9Very high94.7Very high126 Ų12660.9 Ų60.955%0.55331%0.312SS*.Hα-helixtrans-61.1-49.6178.5-172-98.9000112.2F33 F85 L91F33-F87 HydrophobicContact CE1-CD2 4.26Å; F33-F87 HydrophobicContact CE2-CD2 4.22Å; F33-F87 AromaticContact CZ-CD2 3.72Å; F33-F87 HydrophobicContact CZ-CD2 3.72Å; F33-F87 HydrophobicContact CZ-CE2 4.34Å; F85-F87 VanDerWaalsContact C-N 3.31Å; F85-F87 PolarHBondContact O-N 3.45Å; F87-L91 HydrophobicContact CD1-CD1 4.27Å; F87-L91 HydrophobicContact CE1-CD1 3.91Å; F87-L91 WeakPolarHBondContact O-CG 3.25Å; F87-L91 PolarHBondContact O-N 3.37Å
88I95.5Very high94.4Very high95 Ų9565.8 Ų65.849%0.48734%0.336SS..Hα-helixtrans-68.1-41.8177.6-59.7173000109.9V80 F85 I90 L91 L92V80-I88 HydrophobicContact CG1-CB 4.28Å; V80-I88 HydrophobicContact CG1-CG2 4.3Å; F85-I88 PolarHBondContact O-N 3.22Å; I88-I90 PolarHBondContact O-N 3.17Å; I88-L91 PolarHBondContact O-N 3.2Å; I88-L92 HydrophobicContact CG2-CD1 4.2Å; I88-L92 WeakPolarHBondContact O-CG 3.28Å; I88-L92 PolarHBondContact O-N 3.43Å
89G96.4Very high94.2Very high0 Ų067.6 Ų67.60%035%0.346CS..Hα-helixtrans-56.6-47.8177.800000112.4G77 F85 P86 L91 L92 E93G77-G89 WeakPolarHBondContact O-CA 3.28Å; F85-G89 PolarHBondContact O-N 3.43Å; P86-G89 PolarHBondContact O-N 3.44Å; G89-L91 VanDerWaalsContact C-N 3.35Å; G89-L91 PolarHBondContact O-N 3.26Å; G89-L92 CarbonylContact O-C 3.45Å; G89-L92 WeakPolarHBondContact O-CB 3.31Å; G89-L92 PolarHBondContact O-N 3.09Å; G89-L92 VanDerWaalsContact O-N 3.17Å; G89-E93 WeakPolarHBondContact O-CG 3.49Å; G89-E93 PolarHBondContact O-N 3.29Å
90I95.8Very high93.8Very high22 Ų2264.3 Ų64.311%0.11333%0.327CS..Hα-helixtrans-61.5-41177.3-72.5163000111.8V29 F33 L38 V81 P86 I88 L92 E93 I94V29-I90 HydrophobicContact CG2-CD1 3.93Å; F33-I90 HydrophobicContact CD1-CD1 3.34Å; F33-I90 HydrophobicContact CE1-CD1 3.58Å; L38-I90 HydrophobicContact CD1-CD1 3.76Å; L38-I90 HydrophobicContact CD1-CG1 4.23Å; L38-I90 HydrophobicContact CD2-CD1 3.91Å; L38-I90 HydrophobicContact CD2-CG1 4.25Å; V81-I90 HydrophobicContact CG2-CG1 4.44Å; P86-I90 WeakPolarHBondContact O-CB 3.37Å; P86-I90 WeakPolarHBondContact O-CD1 3.14Å; P86-I90 VanDerWaalsContact O-CG1 3.26Å; P86-I90 WeakPolarHBondContact O-CG1 3.35Å; P86-I90 PolarHBondContact O-N 2.88Å; I88-I90 PolarHBondContact O-N 3.17Å; I90-L92 VanDerWaalsContact C-N 3.3Å; I90-L92 PolarHBondContact O-N 3.1Å; I90-E93 PolarHBondContact O-N 3.49Å; I90-I94 HydrophobicContact CG2-CD1 3.77Å; I90-I94 HydrophobicContact CG2-CG1 4.17Å; I90-I94 VanDerWaalsContact O-CG1 3.3Å; I90-I94 WeakPolarHBondContact O-CG1 3.02Å; I90-I94 PolarHBondContact O-N 3.42Å
91L96.2Very high93.3Very high99 Ų9963.3 Ų63.352%0.51832%0.319SS..Hα-helixtrans-61.7-42177-67.5175.8000111.4F87 I88 G89 Y95F87-L91 HydrophobicContact CD1-CD1 4.27Å; F87-L91 HydrophobicContact CE1-CD1 3.91Å; F87-L91 WeakPolarHBondContact O-CG 3.25Å; F87-L91 PolarHBondContact O-N 3.37Å; I88-L91 PolarHBondContact O-N 3.2Å; G89-L91 VanDerWaalsContact C-N 3.35Å; G89-L91 PolarHBondContact O-N 3.26Å; L91-Y95 WeakPolarHBondContact O-CB 3.34Å; L91-Y95 PolarHBondContact O-N 3.04Å; L91-Y95 VanDerWaalsContact O-N 3.11Å
92L97Very high92.9Very high52 Ų5265.6 Ų65.627%0.27234%0.335SS..Hα-helixtrans-65.3-41.2174.1-66.2171.7000111.6F73 V80 I88 G89 I90 Y95 G96F73-L92 HydrophobicContact CD1-CD2 3.83Å; F73-L92 HydrophobicContact CE1-CD2 4.1Å; V80-L92 HydrophobicContact CB-CD1 4.48Å; V80-L92 HydrophobicContact CG2-CD1 4.07Å; I88-L92 HydrophobicContact CG2-CD1 4.2Å; I88-L92 WeakPolarHBondContact O-CG 3.28Å; I88-L92 PolarHBondContact O-N 3.43Å; G89-L92 CarbonylContact O-C 3.45Å; G89-L92 WeakPolarHBondContact O-CB 3.31Å; G89-L92 PolarHBondContact O-N 3.09Å; G89-L92 VanDerWaalsContact O-N 3.17Å; I90-L92 VanDerWaalsContact C-N 3.3Å; I90-L92 PolarHBondContact O-N 3.1Å; L92-Y95 PolarHBondContact O-N 3.07Å; L92-G96 PolarHBondContact O-N 2.88Å
93E95.5Very high92.4Very high7 Ų765.1 Ų65.13%0.03333%0.328CS..Hα-helixtrans-62-49.4176.6-75177.6-179.900111.6N42 F74 I78 V81 G89 I90 Y95 G96 M97N42-E93 PolarHBondContact ND2-OE1 3.26Å; N42-E93 PolarHBondContact ND2-OE2 3.14Å; F74-E93 HydrophobicContact CD2-CB 4.33Å; F74-E93 HydrophobicContact CD2-CG 4.48Å; F74-E93 HydrophobicContact CE2-CB 4.48Å; I78-E93 WeakPolarHBondContact CA-OE1 3.32Å; I78-E93 HydrophobicContact CG1-CG 4.19Å; I78-E93 WeakPolarHBondContact CG1-OE1 3.11Å; I78-E93 PolarHBondContact N-OE1 3.4Å; V81-E93 WeakPolarHBondContact CG2-OE1 3.43Å; G89-E93 WeakPolarHBondContact O-CG 3.49Å; G89-E93 PolarHBondContact O-N 3.29Å; I90-E93 PolarHBondContact O-N 3.49Å; E93-Y95 VanDerWaalsContact C-N 3.34Å; E93-Y95 PolarHBondContact O-N 3.36Å; E93-G96 CarbonylContact O-C 3.59Å; E93-G96 PolarHBondContact O-N 3.43Å; E93-M97 WeakPolarHBondContact O-CB 3.44Å; E93-M97 VanDerWaalsContact O-CG 3.3Å; E93-M97 WeakPolarHBondContact O-CG 3.21Å; E93-M97 PolarHBondContact O-N 3.36Å
94I94.6Very high91.9Very high78 Ų7859.1 Ų59.140%0.430%0.302SS..Hα-helixtrans-59.9-46.9179.2-68174.3000110.1I90 G96 M97 I98I90-I94 HydrophobicContact CG2-CD1 3.77Å; I90-I94 HydrophobicContact CG2-CG1 4.17Å; I90-I94 VanDerWaalsContact O-CG1 3.3Å; I90-I94 WeakPolarHBondContact O-CG1 3.02Å; I90-I94 PolarHBondContact O-N 3.42Å; I94-G96 VanDerWaalsContact C-N 3.35Å; I94-G96 PolarHBondContact O-N 3.24Å; I94-M97 PolarHBondContact O-N 3.37Å; I94-I98 HydrophobicContact CG2-CD1 3.8Å; I94-I98 HydrophobicContact CG2-CG1 4.49Å; I94-I98 VanDerWaalsContact O-CG1 3.29Å; I94-I98 WeakPolarHBondContact O-CG1 3.34Å; I94-I98 PolarHBondContact O-N 2.9Å
95Y94.8Very high91.5Very high133 Ų13360.5 Ų60.552%0.52230%0.296SS..Hα-helixtrans-60.8-45.2176.2178.2-102.5000111.8F73 L91 L92 E93 N99F73-Y95 HydrophobicContact CB-CD1 4Å; F73-Y95 HydrophobicContact CB-CE1 4.5Å; F73-Y95 AromaticContact CD1-CD1 3.82Å; F73-Y95 HydrophobicContact CD1-CD1 3.82Å; F73-Y95 HydrophobicContact CD1-CE1 4.1Å; F73-Y95 AromaticContact CD2-CD1 3.99Å; F73-Y95 HydrophobicContact CD2-CD1 3.99Å; F73-Y95 AromaticContact CD2-CE1 3.65Å; F73-Y95 HydrophobicContact CD2-CE1 3.65Å; F73-Y95 HydrophobicContact CE1-CD1 4.29Å; F73-Y95 HydrophobicContact CE1-CE1 4.23Å; F73-Y95 HydrophobicContact CE2-CD1 4.46Å; F73-Y95 AromaticContact CE2-CE1 3.81Å; F73-Y95 HydrophobicContact CE2-CE1 3.81Å; F73-Y95 AromaticContact CG-CD1 3.67Å; F73-Y95 HydrophobicContact CG-CD1 3.67Å; F73-Y95 AromaticContact CG-CE1 3.82Å; F73-Y95 HydrophobicContact CG-CE1 3.82Å; F73-Y95 HydrophobicContact CZ-CE1 4.1Å; L91-Y95 WeakPolarHBondContact O-CB 3.34Å; L91-Y95 PolarHBondContact O-N 3.04Å; L91-Y95 VanDerWaalsContact O-N 3.11Å; L92-Y95 PolarHBondContact O-N 3.07Å; E93-Y95 VanDerWaalsContact C-N 3.34Å; E93-Y95 PolarHBondContact O-N 3.36Å; Y95-N99 WeakPolarHBondContact O-CB 3.24Å; Y95-N99 PolarHBondContact O-N 3.38Å; Y95-N99 VanDerWaalsContact O-N 3.08Å
96G94.3Very high90.9Very high0 Ų057.9 Ų57.90%029%0.291CS..Hα-helixtrans-59.1-50.4175.800000112.4G70 L92 E93 I94 N99 L100G70-G96 WeakPolarHBondContact O-CA 3.18Å; L92-G96 PolarHBondContact O-N 2.88Å; E93-G96 CarbonylContact O-C 3.59Å; E93-G96 PolarHBondContact O-N 3.43Å; I94-G96 VanDerWaalsContact C-N 3.35Å; I94-G96 PolarHBondContact O-N 3.24Å; G96-N99 PolarHBondContact O-N 2.98Å; G96-L100 WeakPolarHBondContact O-CB 3.31Å; G96-L100 PolarHBondContact O-N 2.93Å
97M91.9Very high90.3Very high39 Ų3959.4 Ų59.419%0.19230%0.3CS..Hα-helixtrans-60-47.3178.6-74.7-158.7-42.600111.9F45 F74 E93 I94 N99 L100 F101F45-M97 HydrophobicContact CD1-SD 3.8Å; F45-M97 HydrophobicContact CE1-CG 4.23Å; F45-M97 HydrophobicContact CE1-SD 3.27Å; F45-M97 WeakPolarHBondContact CE1-SD 3.47Å; F45-M97 HydrophobicContact CZ-CE 4.49Å; F45-M97 HydrophobicContact CZ-SD 3.72Å; F74-M97 HydrophobicContact CD2-CB 4.34Å; F74-M97 HydrophobicContact CD2-CG 3.24Å; F74-M97 HydrophobicContact CD2-SD 4.38Å; F74-M97 HydrophobicContact CE2-CG 3.2Å; F74-M97 HydrophobicContact CE2-SD 3.75Å; F74-M97 HydrophobicContact CG-CG 4.38Å; F74-M97 HydrophobicContact CZ-CG 4.32Å; E93-M97 WeakPolarHBondContact O-CB 3.44Å; E93-M97 VanDerWaalsContact O-CG 3.3Å; E93-M97 WeakPolarHBondContact O-CG 3.21Å; E93-M97 PolarHBondContact O-N 3.36Å; I94-M97 PolarHBondContact O-N 3.37Å; M97-N99 PolarHBondContact O-N 3.12Å; M97-L100 PolarHBondContact O-N 2.87Å; M97-F101 HydrophobicContact CB-CD2 4.11Å; M97-F101 HydrophobicContact CB-CE2 4.44Å; M97-F101 HydrophobicContact CG-CD2 4.39Å; M97-F101 HydrophobicContact CG-CE2 4.26Å; M97-F101 WeakPolarHBondContact O-CB 3.42Å; M97-F101 VanDerWaalsContact O-CD2 3.28Å; M97-F101 WeakPolarHBondContact O-CD2 3.18Å; M97-F101 PolarHBondContact O-N 2.8Å
98I91.7Very high89.6Confident102 Ų10255.7 Ų55.752%0.52329%0.293SS..Hα-helixtrans-60.1-51179.4-69.1168.7000108.9I94 L100 S102I94-I98 HydrophobicContact CG2-CD1 3.8Å; I94-I98 HydrophobicContact CG2-CG1 4.49Å; I94-I98 VanDerWaalsContact O-CG1 3.29Å; I94-I98 WeakPolarHBondContact O-CG1 3.34Å; I94-I98 PolarHBondContact O-N 2.9Å; I98-L100 VanDerWaalsContact C-N 3.33Å; I98-L100 PolarHBondContact O-N 3.38Å; I98-S102 WeakPolarHBondContact O-CA 3.47Å; I98-S102 WeakPolarHBondContact O-CB 3.47Å; I98-S102 PolarHBondContact O-N 3.44Å; I98-S102 PolarHBondContact O-OG 3.49Å
99N89.4Confident88.7Confident64 Ų6454.1 Ų54.134%0.34229%0.285SS..Hα-helixtrans-66.4-35.6-178.4-17133000112.9G70 Y95 G96 M97G70-N99 PolarHBondContact N-ND2 2.9Å; Y95-N99 WeakPolarHBondContact O-CB 3.24Å; Y95-N99 PolarHBondContact O-N 3.38Å; Y95-N99 VanDerWaalsContact O-N 3.08Å; G96-N99 PolarHBondContact O-N 2.98Å; M97-N99 PolarHBondContact O-N 3.12Å
100L87.8Confident87.8Confident0 Ų061.8 Ų61.80%032%0.318CS..Hα-helixtrans-71.8-48179.6-177.466000111.4F61 F62 A71 F74 G96 M97 I98F61-L100 HydrophobicContact CE1-CD1 4.02Å; F61-L100 WeakPolarHBondContact CE1-O 3.17Å; F61-L100 WeakPolarHBondContact CZ-O 3.29Å; F62-L100 HydrophobicContact CD1-CD1 4.13Å; F62-L100 HydrophobicContact CD1-CD2 4.43Å; F62-L100 HydrophobicContact CE1-CD1 3.93Å; F62-L100 HydrophobicContact CE1-CD2 3.45Å; F62-L100 VanDerWaalsContact CE1-CD2 3.45Å; F62-L100 HydrophobicContact CE1-CG 4.24Å; F62-L100 HydrophobicContact CE2-CD2 4.35Å; F62-L100 HydrophobicContact CZ-CD1 4.33Å; F62-L100 HydrophobicContact CZ-CD2 3.44Å; F62-L100 VanDerWaalsContact CZ-CD2 3.44Å; F62-L100 HydrophobicContact CZ-CG 4.26Å; A71-L100 HydrophobicContact CB-CD1 3.98Å; F74-L100 HydrophobicContact CB-CD2 4.41Å; F74-L100 HydrophobicContact CG-CD2 4.48Å; G96-L100 WeakPolarHBondContact O-CB 3.31Å; G96-L100 PolarHBondContact O-N 2.93Å; M97-L100 PolarHBondContact O-N 2.87Å; I98-L100 VanDerWaalsContact C-N 3.33Å; I98-L100 PolarHBondContact O-N 3.38Å
101F85Confident86.9Confident18 Ų1864 Ų648%0.07933%0.327CS..Hα-helixtrans-100-2.1-171.2-56.9-64.5000114.8F45 L46 I49 F62 M97 K103 F104 I105F45-F101 HydrophobicContact CE1-CD2 4.05Å; F45-F101 AromaticContact CE1-CE2 3.72Å; F45-F101 HydrophobicContact CE1-CE2 3.72Å; F45-F101 HydrophobicContact CE1-CZ 4.45Å; L46-F101 HydrophobicContact CD2-CE2 4.31Å; L46-F101 HydrophobicContact CD2-CZ 3.67Å; I49-F101 HydrophobicContact CD1-CD1 3.85Å; I49-F101 HydrophobicContact CD1-CD2 3.97Å; I49-F101 HydrophobicContact CD1-CE1 3.85Å; I49-F101 HydrophobicContact CD1-CE2 3.95Å; I49-F101 HydrophobicContact CD1-CG 3.93Å; I49-F101 HydrophobicContact CD1-CZ 3.89Å; I49-F101 HydrophobicContact CG2-CD1 4.04Å; I49-F101 HydrophobicContact CG2-CE1 3.72Å; I49-F101 HydrophobicContact CG2-CZ 4.46Å; F62-F101 HydrophobicContact CE2-CE1 4.15Å; F62-F101 HydrophobicContact CE2-CZ 4.3Å; F62-F101 HydrophobicContact CZ-CE1 4.27Å; F62-F101 AromaticContact CZ-CZ 4Å; F62-F101 HydrophobicContact CZ-CZ 4Å; M97-F101 HydrophobicContact CB-CD2 4.11Å; M97-F101 HydrophobicContact CB-CE2 4.44Å; M97-F101 HydrophobicContact CG-CD2 4.39Å; M97-F101 HydrophobicContact CG-CE2 4.26Å; M97-F101 WeakPolarHBondContact O-CB 3.42Å; M97-F101 VanDerWaalsContact O-CD2 3.28Å; M97-F101 WeakPolarHBondContact O-CD2 3.18Å; M97-F101 PolarHBondContact O-N 2.8Å; F101-K103 PolarHBondContact O-N 3.22Å; F101-F104 HydrophobicContact CD1-CD2 4.05Å; F101-F104 HydrophobicContact CD1-CE2 4.5Å; F101-F104 WeakPolarHBondContact O-CA 3.36Å; F101-F104 PolarHBondContact O-N 3.39Å; F101-I105 PolarHBondContact O-N 3.24Å
102S86.9Confident86Confident55 Ų5562.5 Ų62.539%0.38532%0.319SS..G310 helixtrans-48.7-37.6178.1-81.30000113.7I98 F104 I105I98-S102 WeakPolarHBondContact O-CA 3.47Å; I98-S102 WeakPolarHBondContact O-CB 3.47Å; I98-S102 PolarHBondContact O-N 3.44Å; I98-S102 PolarHBondContact O-OG 3.49Å; S102-F104 VanDerWaalsContact C-N 3.26Å; S102-F104 PolarHBondContact O-N 3.42Å; S102-I105 PolarHBondContact O-N 3Å
103K82.4Confident84.9Confident105 Ų10564 Ų6446%0.45732%0.322SS..G310 helixtrans-71.3-18.8-179.8-64.4175.7-177.2172.70113.6F61 T66 F101F61-K103 HydrophobicContact CE2-CB 4.14Å; F61-K103 HydrophobicContact CE2-CD 3.74Å; F61-K103 HydrophobicContact CZ-CB 4.28Å; F61-K103 HydrophobicContact CZ-CD 4.01Å; T66-K103 VanDerWaalsContact CG2-NZ 3.26Å; T66-K103 PolarHBondContact OG1-NZ 3.09Å; F101-K103 PolarHBondContact O-N 3.22Å
104F82.9Confident83.7Confident34 Ų3466.8 Ų66.815%0.14935%0.352CS..G310 helixtrans-102.3-9.2-179.6-58.7-66.6000113.6I53 F61 F101 S102 P106 V107 A108I53-F104 HydrophobicContact CD1-CB 3.77Å; I53-F104 HydrophobicContact CD1-CD1 3.59Å; I53-F104 HydrophobicContact CD1-CD2 3.63Å; I53-F104 HydrophobicContact CD1-CE1 3.94Å; I53-F104 HydrophobicContact CD1-CE2 3.93Å; I53-F104 HydrophobicContact CD1-CG 3.4Å; I53-F104 VanDerWaalsContact CD1-CG 3.4Å; I53-F104 HydrophobicContact CD1-CZ 4.07Å; I53-F104 HydrophobicContact CG1-CD1 4.25Å; I53-F104 HydrophobicContact CG1-CG 4.41Å; I53-F104 HydrophobicContact CG2-CD1 4.08Å; I53-F104 HydrophobicContact CG2-CE1 3.72Å; I53-F104 HydrophobicContact CG2-CZ 4.24Å; F61-F104 HydrophobicContact CB-CE2 4.28Å; F61-F104 HydrophobicContact CB-CZ 3.75Å; F61-F104 AromaticContact CD1-CE2 3.35Å; F61-F104 HydrophobicContact CD1-CE2 3.35Å; F61-F104 AromaticContact CD1-CZ 3.7Å; F61-F104 HydrophobicContact CD1-CZ 3.7Å; F61-F104 HydrophobicContact CD2-CE1 4.22Å; F61-F104 AromaticContact CD2-CE2 3.65Å; F61-F104 HydrophobicContact CD2-CE2 3.65Å; F61-F104 AromaticContact CD2-CZ 3.28Å; F61-F104 HydrophobicContact CD2-CZ 3.28Å; F61-F104 HydrophobicContact CE1-CD2 4.21Å; F61-F104 AromaticContact CE1-CE2 3.34Å; F61-F104 HydrophobicContact CE1-CE2 3.34Å; F61-F104 HydrophobicContact CE1-CZ 4.03Å; F61-F104 HydrophobicContact CE2-CD2 4.45Å; F61-F104 HydrophobicContact CE2-CE1 4.47Å; F61-F104 AromaticContact CE2-CE2 3.62Å; F61-F104 HydrophobicContact CE2-CE2 3.62Å; F61-F104 AromaticContact CE2-CZ 3.63Å; F61-F104 HydrophobicContact CE2-CZ 3.63Å; F61-F104 AromaticContact CG-CE2 3.49Å; F61-F104 HydrophobicContact CG-CE2 3.49Å; F61-F104 VanDerWaalsContact CG-CE2 3.49Å; F61-F104 AromaticContact CG-CZ 3.29Å; F61-F104 HydrophobicContact CG-CZ 3.29Å; F61-F104 HydrophobicContact CZ-CD2 4.14Å; F61-F104 AromaticContact CZ-CE2 3.45Å; F61-F104 HydrophobicContact CZ-CE2 3.45Å; F61-F104 VanDerWaalsContact CZ-CE2 3.45Å; F61-F104 AromaticContact CZ-CZ 3.99Å; F61-F104 HydrophobicContact CZ-CZ 3.99Å; F101-F104 HydrophobicContact CD1-CD2 4.05Å; F101-F104 HydrophobicContact CD1-CE2 4.5Å; F101-F104 WeakPolarHBondContact O-CA 3.36Å; F101-F104 PolarHBondContact O-N 3.39Å; S102-F104 VanDerWaalsContact C-N 3.26Å; S102-F104 PolarHBondContact O-N 3.42Å; F104-P106 VanDerWaalsContact C-CD 3.46Å; F104-P106 VanDerWaalsContact C-N 3.33Å; F104-V107 WeakPolarHBondContact O-CA 3.45Å; F104-V107 WeakPolarHBondContact O-CB 3.5Å; F104-V107 PolarHBondContact O-N 3.4Å; F104-A108 PolarHBondContact O-N 3.27Å
105I82.9Confident82.6Confident84 Ų8464.7 Ų64.743%0.43134%0.343SS..Hα-helixtrans-50.4-46.2177.4-67.8177.5000112.3F101 S102 V107 A108 I109F101-I105 PolarHBondContact O-N 3.24Å; S102-I105 PolarHBondContact O-N 3Å; I105-V107 VanDerWaalsContact C-N 3.25Å; I105-V107 PolarHBondContact O-N 2.97Å; I105-A108 PolarHBondContact O-N 2.91Å; I105-I109 HydrophobicContact CG2-CD1 3.6Å; I105-I109 HydrophobicContact CG2-CG1 4.21Å; I105-I109 VanDerWaalsContact O-CG1 3.31Å; I105-I109 WeakPolarHBondContact O-CG1 3.44Å; I105-I109 PolarHBondContact O-N 3.18Å
106P82.3Confident81.2Confident74 Ų7462.7 Ų62.748%0.48135%0.346SS..Hα-helixtrans-62.3-33178.6-23.134.4000113.4F104 K110F104-P106 VanDerWaalsContact C-CD 3.46Å; F104-P106 VanDerWaalsContact C-N 3.33Å; P106-K110 VanDerWaalsContact O-CG 3.29Å; P106-K110 WeakPolarHBondContact O-CG 3.45Å; P106-K110 PolarHBondContact O-N 2.88Å; P106-K110 VanDerWaalsContact O-N 3.09Å
107V79.7Confident80Confident61 Ų6167.8 Ų67.837%0.3738%0.377SS..Hα-helixtrans-70-48.1177178.10000109.6F104 I105 I109 K110 F111F104-V107 WeakPolarHBondContact O-CA 3.45Å; F104-V107 WeakPolarHBondContact O-CB 3.5Å; F104-V107 PolarHBondContact O-N 3.4Å; I105-V107 VanDerWaalsContact C-N 3.25Å; I105-V107 PolarHBondContact O-N 2.97Å; V107-I109 VanDerWaalsContact C-N 3.34Å; V107-I109 PolarHBondContact O-N 2.87Å; V107-K110 PolarHBondContact O-N 2.97Å; V107-F111 HydrophobicContact CG1-CD2 3.75Å; V107-F111 HydrophobicContact CG1-CE2 3.5Å; V107-F111 VanDerWaalsContact CG1-CE2 3.5Å; V107-F111 WeakPolarHBondContact O-CD2 3.49Å; V107-F111 PolarHBondContact O-N 2.89Å
108A79Confident78.7Confident48 Ų4868.3 Ų68.340%0.39738%0.38SS..Hα-helixtrans-58.3-44.4176.600000112F104 I105 K110 F111 L112F104-A108 PolarHBondContact O-N 3.27Å; I105-A108 PolarHBondContact O-N 2.91Å; A108-K110 PolarHBondContact O-N 3.35Å; A108-F111 PolarHBondContact O-N 3.2Å; A108-L112 WeakPolarHBondContact O-CB 3.09Å; A108-L112 PolarHBondContact O-N 2.92Å
109I77.3Confident77.2Confident62 Ų6264 Ų6432%0.31836%0.361SS..Hα-helixtrans-60.6-46.3176.5-70.2170.8000111I105 V107 F111 L112 Y113I105-I109 HydrophobicContact CG2-CD1 3.6Å; I105-I109 HydrophobicContact CG2-CG1 4.21Å; I105-I109 VanDerWaalsContact O-CG1 3.31Å; I105-I109 WeakPolarHBondContact O-CG1 3.44Å; I105-I109 PolarHBondContact O-N 3.18Å; V107-I109 VanDerWaalsContact C-N 3.34Å; V107-I109 PolarHBondContact O-N 2.87Å; I109-F111 VanDerWaalsContact C-N 3.3Å; I109-F111 PolarHBondContact O-N 3.47Å; I109-L112 WeakPolarHBondContact O-CB 3.49Å; I109-L112 PolarHBondContact O-N 3.46Å; I109-L112 VanDerWaalsContact O-N 3.12Å; I109-Y113 HydrophobicContact CG2-CD2 3.67Å; I109-Y113 HydrophobicContact CG2-CE2 3.34Å; I109-Y113 WeakPolarHBondContact O-CD2 3.32Å; I109-Y113 PolarHBondContact O-N 2.88Å
110K76.9Confident76.1Confident161 Ų16171 Ų7170%0.738%0.383SS*.Hα-helixtrans-59.2-40.3176.4-76.8177.6-178.8-173.90112.2P106 V107 A108 G114P106-K110 VanDerWaalsContact O-CG 3.29Å; P106-K110 WeakPolarHBondContact O-CG 3.45Å; P106-K110 PolarHBondContact O-N 2.88Å; P106-K110 VanDerWaalsContact O-N 3.09Å; V107-K110 PolarHBondContact O-N 2.97Å; A108-K110 PolarHBondContact O-N 3.35Å; K110-G114 PolarHBondContact O-N 2.97Å
111F77.2Confident74.9Confident68 Ų6876.1 Ų76.130%0.29841%0.409SS..Hα-helixtrans-64.3-43.1173.6-82.7-67.2000112.1Q11 L52 V107 A108 I109 Y113 G114 V115Q11-F111 HydrophobicContact CB-CE1 4.5Å; Q11-F111 VanDerWaalsContact CD-CE1 3.45Å; Q11-F111 HydrophobicContact CG-CE1 4.33Å; Q11-F111 HydrophobicContact CG-CZ 4.4Å; L52-F111 HydrophobicContact CD2-CG 4.45Å; V107-F111 HydrophobicContact CG1-CD2 3.75Å; V107-F111 HydrophobicContact CG1-CE2 3.5Å; V107-F111 VanDerWaalsContact CG1-CE2 3.5Å; V107-F111 WeakPolarHBondContact O-CD2 3.49Å; V107-F111 PolarHBondContact O-N 2.89Å; A108-F111 PolarHBondContact O-N 3.2Å; I109-F111 VanDerWaalsContact C-N 3.3Å; I109-F111 PolarHBondContact O-N 3.47Å; F111-Y113 VanDerWaalsContact C-N 3.3Å; F111-Y113 PolarHBondContact O-N 3.32Å; F111-G114 WeakPolarHBondContact O-CA 3.14Å; F111-G114 PolarHBondContact O-N 3.22Å; F111-V115 PolarHBondContact O-N 2.98Å
112L76.1Confident73.6Confident67 Ų6776.2 Ų76.235%0.35141%0.411SS..Hα-helixtrans-61.2-37.8179.5-141.474.1000112.3L15 A108 I109 G114 V115 I118L15-L112 HydrophobicContact CD1-CD1 4.2Å; A108-L112 WeakPolarHBondContact O-CB 3.09Å; A108-L112 PolarHBondContact O-N 2.92Å; I109-L112 WeakPolarHBondContact O-CB 3.49Å; I109-L112 PolarHBondContact O-N 3.46Å; I109-L112 VanDerWaalsContact O-N 3.12Å; L112-G114 VanDerWaalsContact C-N 3.25Å; L112-G114 PolarHBondContact O-N 3.48Å; L112-V115 WeakPolarHBondContact O-CB 3.45Å; L112-V115 PolarHBondContact O-N 3.49Å; L112-V115 VanDerWaalsContact O-N 3.15Å; L112-I118 HydrophobicContact CD1-CD1 3.4Å; L112-I118 HydrophobicContact CD2-CD1 4.2Å; L112-I118 HydrophobicContact CD2-CG2 3.92Å; L112-I118 HydrophobicContact CG-CB 4.38Å; L112-I118 HydrophobicContact CG-CD1 3.48Å; L112-I118 VanDerWaalsContact CG-CD1 3.48Å; L112-I118 HydrophobicContact CG-CG2 3.89Å
113Y73.6Confident72.2Confident85 Ų8583.8 Ų83.833%0.33343%0.431SS..Hα-helixtrans-63.3-28.5172.7-82.9-66.5000113.7I109 F111 V115 L122 V131I109-Y113 HydrophobicContact CG2-CD2 3.67Å; I109-Y113 HydrophobicContact CG2-CE2 3.34Å; I109-Y113 WeakPolarHBondContact O-CD2 3.32Å; I109-Y113 PolarHBondContact O-N 2.88Å; F111-Y113 VanDerWaalsContact C-N 3.3Å; F111-Y113 PolarHBondContact O-N 3.32Å; Y113-V115 VanDerWaalsContact C-N 3.25Å; Y113-V115 PolarHBondContact O-N 3.13Å; Y113-L122 HydrophobicContact CD1-CD1 3.83Å; Y113-L122 HydrophobicContact CE1-CB 4.27Å; Y113-L122 HydrophobicContact CE1-CD1 3.67Å; Y113-L122 HydrophobicContact CE1-CG 4.38Å; Y113-V131 HydrophobicContact CE2-CG1 4.06Å; Y113-V131 VanDerWaalsContact OH-CB 3.31Å; Y113-V131 WeakPolarHBondContact OH-CB 3.45Å; Y113-V131 WeakPolarHBondContact OH-CG1 3.26Å; Y113-V131 WeakPolarHBondContact OH-CG2 3.48Å
114G71.7Confident71.3Confident65 Ų6584 Ų8467%0.6744%0.436SS*.THydrogen-bonded Turntrans-75.3-13.5175.900000113.7K110 F111 L112 P116K110-G114 PolarHBondContact O-N 2.97Å; F111-G114 WeakPolarHBondContact O-CA 3.14Å; F111-G114 PolarHBondContact O-N 3.22Å; L112-G114 VanDerWaalsContact C-N 3.25Å; L112-G114 PolarHBondContact O-N 3.48Å; G114-P116 WeakPolarHBondContact O-CD 3.1Å
115V71.1Confident70.3Confident33 Ų3388.6 Ų88.620%0.247%0.47CS..  trans-86.3112.7179-174.80000108.4L15 F111 L112 Y113 V117 I118 G119L15-V115 HydrophobicContact CD2-CG2 3.46Å; L15-V115 VanDerWaalsContact CD2-CG2 3.46Å; F111-V115 PolarHBondContact O-N 2.98Å; L112-V115 WeakPolarHBondContact O-CB 3.45Å; L112-V115 PolarHBondContact O-N 3.49Å; L112-V115 VanDerWaalsContact O-N 3.15Å; Y113-V115 VanDerWaalsContact C-N 3.25Å; Y113-V115 PolarHBondContact O-N 3.13Å; V115-V117 HydrophobicContact CG1-CB 4.32Å; V115-V117 PolarHBondContact O-N 3.17Å; V115-V117 VanDerWaalsContact O-N 3.17Å; V115-I118 HydrophobicContact CB-CB 4.41Å; V115-I118 HydrophobicContact CB-CD1 4.21Å; V115-I118 HydrophobicContact CB-CG1 4.29Å; V115-I118 HydrophobicContact CG1-CD1 4.24Å; V115-I118 HydrophobicContact CG1-CG1 4.15Å; V115-I118 PolarHBondContact O-N 3.27Å; V115-G119 PolarHBondContact O-N 2.97Å
116P65.8Low69.5Low91 Ų9187.4 Ų87.459%0.59148%0.478SS*.Hα-helixtrans-57.8-38.7-173.421.2-32.1000112G114 I118 G119 W120G114-P116 WeakPolarHBondContact O-CD 3.1Å; P116-I118 VanDerWaalsContact C-N 3.32Å; P116-I118 PolarHBondContact O-N 3.01Å; P116-G119 WeakPolarHBondContact O-CA 3.42Å; P116-G119 PolarHBondContact O-N 3.35Å; P116-G119 VanDerWaalsContact O-N 3.16Å; P116-W120 PolarHBondContact O-N 3.07Å
117V68Low68.5Low108 Ų10887.3 Ų87.366%0.65547%0.473SS*.Hα-helixtrans-57.9-41.8179.2-176.70000112.1V115V115-V117 HydrophobicContact CG1-CB 4.32Å; V115-V117 PolarHBondContact O-N 3.17Å; V115-V117 VanDerWaalsContact O-N 3.17Å
118I64.1Low67.7Low49 Ų4987.2 Ų87.225%0.25147%0.47SS..Hα-helixtrans-81.7-29.2-179.6-55174.9000110.5L112 V115 P116 W120 I121 L122L112-I118 HydrophobicContact CD1-CD1 3.4Å; L112-I118 HydrophobicContact CD2-CD1 4.2Å; L112-I118 HydrophobicContact CD2-CG2 3.92Å; L112-I118 HydrophobicContact CG-CB 4.38Å; L112-I118 HydrophobicContact CG-CD1 3.48Å; L112-I118 VanDerWaalsContact CG-CD1 3.48Å; L112-I118 HydrophobicContact CG-CG2 3.89Å; V115-I118 HydrophobicContact CB-CB 4.41Å; V115-I118 HydrophobicContact CB-CD1 4.21Å; V115-I118 HydrophobicContact CB-CG1 4.29Å; V115-I118 HydrophobicContact CG1-CD1 4.24Å; V115-I118 HydrophobicContact CG1-CG1 4.15Å; V115-I118 PolarHBondContact O-N 3.27Å; P116-I118 VanDerWaalsContact C-N 3.32Å; P116-I118 PolarHBondContact O-N 3.01Å; I118-W120 VanDerWaalsContact C-N 3.32Å; I118-W120 PolarHBondContact O-N 3.16Å; I118-I121 PolarHBondContact O-N 3.05Å; I118-L122 HydrophobicContact CG2-CD1 3.85Å; I118-L122 HydrophobicContact CG2-CG 4.37Å; I118-L122 PolarHBondContact O-N 3.48Å
119G60.8Low67.2Low13 Ų1386.6 Ų86.613%0.13447%0.469CS..Hα-helixtrans-51-46.7171.300000112.9V115 P116 I121 L122 W123V115-G119 PolarHBondContact O-N 2.97Å; P116-G119 WeakPolarHBondContact O-CA 3.42Å; P116-G119 PolarHBondContact O-N 3.35Å; P116-G119 VanDerWaalsContact O-N 3.16Å; G119-I121 PolarHBondContact O-N 3.29Å; G119-L122 PolarHBondContact O-N 3.15Å; G119-L122 VanDerWaalsContact O-N 3.14Å; G119-W123 PolarHBondContact O-N 3Å
120W65.8Low66.8Low210 Ų21090.3 Ų90.380%0.79548%0.483SS*.Hα-helixtrans-59.8-41.3179-65.896.9000113.3P116 I118 L122 W123P116-W120 PolarHBondContact O-N 3.07Å; I118-W120 VanDerWaalsContact C-N 3.32Å; I118-W120 PolarHBondContact O-N 3.16Å; W120-L122 VanDerWaalsContact C-N 3.35Å; W120-W123 PolarHBondContact O-N 3.09Å
121I64.1Low66.3Low108 Ų10884.2 Ų84.255%0.55446%0.459SS*.Hα-helixtrans-67.4-36.4176.9-78.9169.4000111.2I118 G119 W123 L124I118-I121 PolarHBondContact O-N 3.05Å; G119-I121 PolarHBondContact O-N 3.29Å; I121-W123 VanDerWaalsContact C-N 3.34Å; I121-L124 VanDerWaalsContact O-CD1 3.23Å; I121-L124 WeakPolarHBondContact O-CD1 3.4Å; I121-L124 PolarHBondContact O-N 3.35Å
122L56.1Low65.8Low20 Ų2089.7 Ų89.711%0.10548%0.478CS..Hα-helixtrans-74.6-20.8179.4-75.6164.1000113.8Y113 I118 G119 W120 L124 I127 N128Y113-L122 HydrophobicContact CD1-CD1 3.83Å; Y113-L122 HydrophobicContact CE1-CB 4.27Å; Y113-L122 HydrophobicContact CE1-CD1 3.67Å; Y113-L122 HydrophobicContact CE1-CG 4.38Å; I118-L122 HydrophobicContact CG2-CD1 3.85Å; I118-L122 HydrophobicContact CG2-CG 4.37Å; I118-L122 PolarHBondContact O-N 3.48Å; G119-L122 PolarHBondContact O-N 3.15Å; G119-L122 VanDerWaalsContact O-N 3.14Å; W120-L122 VanDerWaalsContact C-N 3.35Å; L122-L124 PolarHBondContact O-N 3.43Å; L122-I127 HydrophobicContact CD2-CB 3.95Å; L122-I127 HydrophobicContact CD2-CD1 4.12Å; L122-I127 HydrophobicContact CD2-CG2 3.31Å; L122-N128 PolarHBondContact O-ND2 3.49Å; L122-N128 PolarHBondContact O-OD1 3.38Å
123W59.4Low65.5Low214 Ų21495.8 Ų95.881%0.81150%0.496SS*.THydrogen-bonded Turntrans-69.5-7.7172.1-86.157.8000113.6G119 W120 I121G119-W123 PolarHBondContact O-N 3Å; W120-W123 PolarHBondContact O-N 3.09Å; I121-W123 VanDerWaalsContact C-N 3.34Å
124L63.4Low65.2Low108 Ų10896 Ų9657%0.56550%0.502SS*.SBendtrans-62.4127.3167.8-8595.7000110I121 L122 G126 I127I121-L124 VanDerWaalsContact O-CD1 3.23Å; I121-L124 WeakPolarHBondContact O-CD1 3.4Å; I121-L124 PolarHBondContact O-N 3.35Å; L122-L124 PolarHBondContact O-N 3.43Å; L124-G126 PolarHBondContact O-N 2.79Å; L124-I127 PolarHBondContact O-N 3.28Å
125P60.9Low64.7Low131 Ų13196.7 Ų96.785%0.85150%0.497SS*.THydrogen-bonded Turntrans-638.6-168.520.5-31.5000117.4
126G65.9Low64.3Low59 Ų59100.8 Ų100.861%0.60851%0.514SS*.THydrogen-bonded Turntrans-94.9-39173.300000114.8L124L124-G126 PolarHBondContact O-N 2.79Å
127I62.5Low64.2Low72 Ų72100.5 Ų100.537%0.36952%0.515SS..Hα-helixtrans-80.5-38.5-169.3-53.7170.5000111.4L122 L124 G129 F130 V131L122-I127 HydrophobicContact CD2-CB 3.95Å; L122-I127 HydrophobicContact CD2-CD1 4.12Å; L122-I127 HydrophobicContact CD2-CG2 3.31Å; L124-I127 PolarHBondContact O-N 3.28Å; I127-G129 PolarHBondContact O-N 2.96Å; I127-F130 PolarHBondContact O-N 3.04Å; I127-F130 VanDerWaalsContact O-N 3.1Å; I127-V131 HydrophobicContact CG2-CG2 4.2Å; I127-V131 PolarHBondContact O-N 2.81Å
128N61.3Low63.8Low59 Ų59102 Ų10232%0.31652%0.519SS..Hα-helixtrans-57.9-31.8176.1-78.8-16.5000112.6L122 R132L122-N128 PolarHBondContact O-ND2 3.49Å; L122-N128 PolarHBondContact O-OD1 3.38Å; N128-R132 VanDerWaalsContact O-CB 3.28Å; N128-R132 WeakPolarHBondContact O-CB 3.4Å; N128-R132 VanDerWaalsContact O-CG 3.28Å; N128-R132 WeakPolarHBondContact O-CG 3.35Å; N128-R132 PolarHBondContact O-N 3.19Å
129G69.1Low63.3Low36 Ų36103.6 Ų103.637%0.37153%0.534SS..Hα-helixtrans-65.2-45.7175.500000112.6I127 R133I127-G129 PolarHBondContact O-N 2.96Å; G129-R133 WeakPolarHBondContact O-CG 3.43Å; G129-R133 PolarHBondContact O-N 3.23Å
130F69.2Low62.7Low140 Ų140110.5 Ų110.561%0.61457%0.565SS**Hα-helixtrans-67.7-43.9179-170.7-104000111.8I127 R133 L134I127-F130 PolarHBondContact O-N 3.04Å; I127-F130 VanDerWaalsContact O-N 3.1Å; F130-R133 PolarHBondContact O-N 3.04Å; F130-L134 HydrophobicContact CD1-CD1 4.01Å; F130-L134 HydrophobicContact CE1-CD1 3.65Å; F130-L134 HydrophobicContact CE1-CG 4.3Å; F130-L134 HydrophobicContact CZ-CD1 4.37Å; F130-L134 PolarHBondContact O-N 2.88Å
131V65.6Low61.8Low33 Ų33109.8 Ų109.820%0.258%0.583CS.*Hα-helixtrans-68.2-37.5179.5-179.10000112Y113 I127 R133 L134 S135Y113-V131 HydrophobicContact CE2-CG1 4.06Å; Y113-V131 VanDerWaalsContact OH-CB 3.31Å; Y113-V131 WeakPolarHBondContact OH-CB 3.45Å; Y113-V131 WeakPolarHBondContact OH-CG1 3.26Å; Y113-V131 WeakPolarHBondContact OH-CG2 3.48Å; I127-V131 HydrophobicContact CG2-CG2 4.2Å; I127-V131 PolarHBondContact O-N 2.81Å; V131-R133 VanDerWaalsContact C-N 3.29Å; V131-R133 PolarHBondContact O-N 2.88Å; V131-L134 PolarHBondContact O-N 3.23Å; V131-S135 PolarHBondContact O-N 3.04Å
132R66.7Low61.6Low182 Ų182109.9 Ų109.969%0.68759%0.585SS**Hα-helixtrans-59.3-39.6173-8217967.7-176.71.3112.1N128 S135 Q136N128-R132 VanDerWaalsContact O-CB 3.28Å; N128-R132 WeakPolarHBondContact O-CB 3.4Å; N128-R132 VanDerWaalsContact O-CG 3.28Å; N128-R132 WeakPolarHBondContact O-CG 3.35Å; N128-R132 PolarHBondContact O-N 3.19Å; R132-S135 PolarHBondContact O-N 3.22Å; R132-Q136 PolarHBondContact O-N 3.05Å
133R70.7Confident61.9Low196 Ų196114.6 Ų114.674%0.7461%0.61SS**Hα-helixtrans-64-39.8176.7-71.9177.7-179.8-169.50.8112.3G129 F130 V131 S137G129-R133 WeakPolarHBondContact O-CG 3.43Å; G129-R133 PolarHBondContact O-N 3.23Å; F130-R133 PolarHBondContact O-N 3.04Å; V131-R133 VanDerWaalsContact C-N 3.29Å; V131-R133 PolarHBondContact O-N 2.88Å; R133-S137 PolarHBondContact O-N 3.38Å; R133-S137 VanDerWaalsContact O-N 3.15Å
134L66.3Low62.1Low88 Ų88109.1 Ų109.146%0.46160%0.599SS.*Hα-helixtrans-67.7-35.8175.5-67.1176.5000112.7F130 V131 N138F130-L134 HydrophobicContact CD1-CD1 4.01Å; F130-L134 HydrophobicContact CE1-CD1 3.65Å; F130-L134 HydrophobicContact CE1-CG 4.3Å; F130-L134 HydrophobicContact CZ-CD1 4.37Å; F130-L134 PolarHBondContact O-N 2.88Å; V131-L134 PolarHBondContact O-N 3.23Å; L134-N138 PolarHBondContact O-ND2 3.22Å
135S62.9Low62Low81 Ų81109.1 Ų109.157%0.56660%0.601SS**Hα-helixtrans-72.4-40.9177.2-162.10000112.3V131 R132 S137 N138 S139V131-S135 PolarHBondContact O-N 3.04Å; R132-S135 PolarHBondContact O-N 3.22Å; S135-S137 VanDerWaalsContact C-N 3.31Å; S135-S137 PolarHBondContact O-N 3.32Å; S135-N138 PolarHBondContact O-N 3.34Å; S135-N138 VanDerWaalsContact O-N 3.17Å; S135-S139 PolarHBondContact O-N 2.8Å
136Q62.5Low62.1Low118 Ų118107.8 Ų107.855%0.55159%0.585SS**Hα-helixtrans-65-34.6177.1-112.4178.7-3500112.4R132 N138 S139 M140R132-Q136 PolarHBondContact O-N 3.05Å; Q136-N138 PolarHBondContact O-N 3.23Å; Q136-S139 PolarHBondContact O-N 3.26Å; Q136-S139 VanDerWaalsContact O-N 3.16Å; Q136-S139 PolarHBondContact O-OG 3.36Å; Q136-M140 PolarHBondContact O-N 3.36Å
137S63.1Low61.8Low86 Ų86111 Ų11160%0.60158%0.584SS**THydrogen-bonded Turntrans-64.8-18.5176-169.10000113.5R133 S135R133-S137 PolarHBondContact O-N 3.38Å; R133-S137 VanDerWaalsContact O-N 3.15Å; S135-S137 VanDerWaalsContact C-N 3.31Å; S135-S137 PolarHBondContact O-N 3.32Å
138N59Low61.8Low138 Ų138113.8 Ų113.874%0.73860%0.599SS**THydrogen-bonded Turntrans-95.2-14.5175.5-85.4-90.5000113.4L134 S135 Q136L134-N138 PolarHBondContact O-ND2 3.22Å; S135-N138 PolarHBondContact O-N 3.34Å; S135-N138 VanDerWaalsContact O-N 3.17Å; Q136-N138 PolarHBondContact O-N 3.23Å
139S54Low61.8Low83 Ų83118 Ų11858%0.5862%0.621SS**SBendtrans-99.93.7178.861.90000113.9S135 Q136S135-S139 PolarHBondContact O-N 2.8Å; Q136-S139 PolarHBondContact O-N 3.26Å; Q136-S139 VanDerWaalsContact O-N 3.16Å; Q136-S139 PolarHBondContact O-OG 3.36Å
140M48.2Very low61.2Low159 Ų159124.8 Ų124.878%0.78364%0.641SS**  trans-105.153.3168.4-68.9-159.6-65.300110.8Q136Q136-M140 PolarHBondContact O-N 3.36Å
141V46.2Very low60.5Low194 Ų194123.5 Ų123.5100%1.17664%0.644SS**  trans-149.10154.8-174.50000106.3

Retrieved 141 of 141 residues in 67.1 ms (Link to these results)