A0A087XI32_POEFO Loading...

Clarin 3

AlphaFold DB , UniProt , Accession A0A087XI32, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 233 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
1M52.2Low81.7Confident205 Ų20571.3 Ų71.3100%1.0140%0.4SS*.  0133.30-86.4179.6163.400108N121M1-N121 PolarHBondContact N-OD1 2.94Å
2P63.9Low82.7Confident40 Ų4071.2 Ų71.226%0.2640%0.397SS..  trans-62.2143.1171.827.4-32.4000109.6K6P2-K6 HydrophobicContact CB-CD 4.29Å
3S80.9Confident83.5Confident62 Ų6265.7 Ų65.743%0.43437%0.366SS..  trans-67.1143.1175.168.10000109.7T5 K6 T7S3-T5 PolarHBondContact O-N 2.74Å; S3-T5 VanDerWaalsContact O-N 3.11Å; S3-K6 WeakPolarHBondContact O-CB 3.43Å; S3-K6 PolarHBondContact O-N 3.39Å; S3-K6 WeakPolarHBondContact OG-CB 3.48Å; S3-K6 PolarHBondContact OG-N 3.49Å; S3-T7 PolarHBondContact O-N 3.42Å; S3-T7 VanDerWaalsContact O-N 3.14Å
4S83.2Confident84.3Confident108 Ų10861.4 Ų61.476%0.75534%0.344SS*.Hα-helixtrans-54.3-34.1178.1-54.50000112.1L8S4-L8 WeakPolarHBondContact O-CB 3.3Å; S4-L8 PolarHBondContact O-N 2.97Å
5T84.6Confident85Confident77 Ų7764.1 Ų64.147%0.47236%0.356SS..Hα-helixtrans-61.5-49.1174-450000111.9S3 T7 L8 Y9S3-T5 PolarHBondContact O-N 2.74Å; S3-T5 VanDerWaalsContact O-N 3.11Å; T5-T7 PolarHBondContact O-N 3.37Å; T5-L8 PolarHBondContact O-N 3.32Å; T5-Y9 HydrophobicContact CG2-CD2 3.86Å; T5-Y9 HydrophobicContact CG2-CE2 3.65Å; T5-Y9 VanDerWaalsContact O-CD2 3.27Å; T5-Y9 WeakPolarHBondContact O-CD2 3.33Å; T5-Y9 PolarHBondContact O-N 2.95Å; T5-Y9 VanDerWaalsContact O-N 3.14Å
6K84Confident85.7Confident4 Ų462.6 Ų62.62%0.01735%0.347CS..Hα-helixtrans-56.5-52.1177179.4-173.5-178-154.30110.6P2 S3 L8 Y9 F10 N117 S120 Y208P2-K6 HydrophobicContact CB-CD 4.29Å; S3-K6 WeakPolarHBondContact O-CB 3.43Å; S3-K6 PolarHBondContact O-N 3.39Å; S3-K6 WeakPolarHBondContact OG-CB 3.48Å; S3-K6 PolarHBondContact OG-N 3.49Å; K6-L8 VanDerWaalsContact C-N 3.29Å; K6-L8 PolarHBondContact O-N 3.02Å; K6-Y9 PolarHBondContact O-N 3.47Å; K6-F10 HydrophobicContact CG-CD2 3.75Å; K6-F10 HydrophobicContact CG-CE2 3.97Å; K6-F10 WeakPolarHBondContact O-CD2 3.32Å; K6-F10 PolarHBondContact O-N 3.42Å; K6-F10 VanDerWaalsContact O-N 3.12Å; K6-N117 WeakPolarHBondContact CE-O 3.39Å; K6-N117 PolarHBondContact NZ-O 2.87Å; K6-S120 PolarHBondContact NZ-O 3.23Å; K6-Y208 HydrophobicContact CB-CE2 3.57Å; K6-Y208 HydrophobicContact CG-CE1 4.42Å; K6-Y208 HydrophobicContact CG-CE2 3.96Å; K6-Y208 WeakPolarHBondContact CG-OH 3.5Å
7T86.6Confident86.2Confident36 Ų3659.1 Ų59.122%0.22133%0.328CS..Hα-helixtrans-59.9-41.3-178.1-57.30000111.1S3 T5 L11 S118S3-T7 PolarHBondContact O-N 3.42Å; S3-T7 VanDerWaalsContact O-N 3.14Å; T5-T7 PolarHBondContact O-N 3.37Å; T7-L11 HydrophobicContact CG2-CD1 3.66Å; T7-L11 HydrophobicContact CG2-CG 4.2Å; T7-L11 VanDerWaalsContact O-CB 3.27Å; T7-L11 WeakPolarHBondContact O-CB 3.42Å; T7-L11 WeakPolarHBondContact O-CG 3.38Å; T7-L11 PolarHBondContact O-N 2.93Å; T7-S118 PolarHBondContact OG1-O 3.37Å
8L90.1Very high86.8Confident101 Ų10158.3 Ų58.353%0.52933%0.33SS..Hα-helixtrans-60.9-53.2178.1-176.468.2000112.7S4 T5 K6 F10 L11 L12S4-L8 WeakPolarHBondContact O-CB 3.3Å; S4-L8 PolarHBondContact O-N 2.97Å; T5-L8 PolarHBondContact O-N 3.32Å; K6-L8 VanDerWaalsContact C-N 3.29Å; K6-L8 PolarHBondContact O-N 3.02Å; L8-F10 PolarHBondContact O-N 2.88Å; L8-L11 PolarHBondContact O-N 3.18Å; L8-L12 HydrophobicContact CD1-CD1 4.13Å; L8-L12 HydrophobicContact CD1-CG 4.35Å; L8-L12 HydrophobicContact CG-CD1 3.95Å; L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 VanDerWaalsContact O-CG 3.26Å; L8-L12 WeakPolarHBondContact O-CG 3.28Å; L8-L12 PolarHBondContact O-N 3.05Å
9Y91.2Very high87.3Confident69 Ų6959.8 Ų59.827%0.27134%0.336SS..Hα-helixtrans-64.4-41.2-177.2-80.5-82.7000112.5T5 K6 L12 S13 L204 L207 Y208T5-Y9 HydrophobicContact CG2-CD2 3.86Å; T5-Y9 HydrophobicContact CG2-CE2 3.65Å; T5-Y9 VanDerWaalsContact O-CD2 3.27Å; T5-Y9 WeakPolarHBondContact O-CD2 3.33Å; T5-Y9 PolarHBondContact O-N 2.95Å; T5-Y9 VanDerWaalsContact O-N 3.14Å; K6-Y9 PolarHBondContact O-N 3.47Å; Y9-L12 PolarHBondContact O-N 2.84Å; Y9-S13 WeakPolarHBondContact O-CB 3.35Å; Y9-S13 PolarHBondContact O-N 3.12Å; Y9-L204 HydrophobicContact CD1-CB 4.48Å; Y9-L204 HydrophobicContact CD1-CD2 4.43Å; Y9-L204 WeakPolarHBondContact CD1-O 2.98Å; Y9-L207 HydrophobicContact CE1-CB 4.3Å; Y9-Y208 HydrophobicContact CD2-CD2 4.14Å
10F89.9Confident87.8Confident2 Ų256.9 Ų56.91%0.00932%0.32CS..Hα-helixtrans-69.4-37.1177.5-84.4-74.1000112.7K6 L8 S13 A14 N117 P129 V132 V205 Y208K6-F10 HydrophobicContact CG-CD2 3.75Å; K6-F10 HydrophobicContact CG-CE2 3.97Å; K6-F10 WeakPolarHBondContact O-CD2 3.32Å; K6-F10 PolarHBondContact O-N 3.42Å; K6-F10 VanDerWaalsContact O-N 3.12Å; L8-F10 PolarHBondContact O-N 2.88Å; F10-S13 PolarHBondContact O-N 3.27Å; F10-A14 WeakPolarHBondContact O-CB 3.24Å; F10-A14 PolarHBondContact O-N 2.93Å; F10-N117 HydrophobicContact CD1-CB 3.7Å; F10-N117 HydrophobicContact CD2-CB 4.22Å; F10-N117 HydrophobicContact CE1-CB 3.61Å; F10-N117 HydrophobicContact CE2-CB 4.16Å; F10-N117 HydrophobicContact CG-CB 4Å; F10-N117 HydrophobicContact CZ-CB 3.85Å; F10-P129 HydrophobicContact CZ-CG 4.43Å; F10-V132 HydrophobicContact CE1-CG2 4.24Å; F10-V205 HydrophobicContact CE1-CG1 4.36Å; F10-V205 HydrophobicContact CE1-CG2 4.39Å; F10-V205 HydrophobicContact CZ-CG1 4.42Å; F10-Y208 AromaticContact CE2-CD1 3.83Å; F10-Y208 HydrophobicContact CE2-CD1 3.83Å; F10-Y208 AromaticContact CE2-CE1 3.64Å; F10-Y208 HydrophobicContact CE2-CE1 3.64Å; F10-Y208 HydrophobicContact CZ-CD1 4.43Å; F10-Y208 HydrophobicContact CZ-CE1 4.37Å
11L92.3Very high88.1Confident80 Ų8055.2 Ų55.242%0.41931%0.31SS..Hα-helixtrans-67.9-39.8173.9-73.8176.1000112.2T7 L8 A14 L15 L115T7-L11 HydrophobicContact CG2-CD1 3.66Å; T7-L11 HydrophobicContact CG2-CG 4.2Å; T7-L11 VanDerWaalsContact O-CB 3.27Å; T7-L11 WeakPolarHBondContact O-CB 3.42Å; T7-L11 WeakPolarHBondContact O-CG 3.38Å; T7-L11 PolarHBondContact O-N 2.93Å; L8-L11 PolarHBondContact O-N 3.18Å; L11-A14 PolarHBondContact O-N 3.4Å; L11-L15 WeakPolarHBondContact O-CB 3.28Å; L11-L15 PolarHBondContact O-N 3.34Å; L11-L115 HydrophobicContact CD2-CD2 4.01Å
12L93.4Very high90.2Very high70 Ų7047.8 Ų47.837%0.36629%0.285SS..Hα-helixtrans-64.3-41.2175.1-72.1172.2000111.6L8 Y9 L15 L16 L204L8-L12 HydrophobicContact CD1-CD1 4.13Å; L8-L12 HydrophobicContact CD1-CG 4.35Å; L8-L12 HydrophobicContact CG-CD1 3.95Å; L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 VanDerWaalsContact O-CG 3.26Å; L8-L12 WeakPolarHBondContact O-CG 3.28Å; L8-L12 PolarHBondContact O-N 3.05Å; Y9-L12 PolarHBondContact O-N 2.84Å; L12-L15 PolarHBondContact O-N 3.1Å; L12-L16 WeakPolarHBondContact O-CG 3.43Å; L12-L16 PolarHBondContact O-N 3.35Å; L12-L204 HydrophobicContact CB-CD1 3.76Å
13S93.1Very high91.8Very high0 Ų047.8 Ų47.80%028%0.283CS..Hα-helixtrans-59.6-46.2171.9177.80000111.7Y9 F10 L15 L16 T17 S114Y9-S13 WeakPolarHBondContact O-CB 3.35Å; Y9-S13 PolarHBondContact O-N 3.12Å; F10-S13 PolarHBondContact O-N 3.27Å; S13-L15 VanDerWaalsContact C-N 3.32Å; S13-L15 PolarHBondContact O-N 3.48Å; S13-L16 PolarHBondContact O-N 3.42Å; S13-T17 WeakPolarHBondContact O-CB 3.33Å; S13-T17 WeakPolarHBondContact O-CG2 3.47Å; S13-T17 PolarHBondContact O-N 3.27Å; S13-T17 PolarHBondContact O-OG1 3.4Å; S13-S114 PolarHBondContact OG-OG 3.29Å
14A94.5Very high92.5Very high6 Ų644.8 Ų44.85%0.0526%0.262CS..Hα-helixtrans-61-39.817600000112.2F10 L11 T17 A18 L115F10-A14 WeakPolarHBondContact O-CB 3.24Å; F10-A14 PolarHBondContact O-N 2.93Å; L11-A14 PolarHBondContact O-N 3.4Å; A14-T17 WeakPolarHBondContact CA-OG1 3.36Å; A14-T17 PolarHBondContact O-OG1 2.84Å; A14-A18 VanDerWaalsContact O-CB 3.31Å; A14-A18 WeakPolarHBondContact O-CB 3.39Å; A14-A18 PolarHBondContact O-N 2.85Å; A14-L115 HydrophobicContact CB-CD2 3.82Å; A14-L115 HydrophobicContact CB-CG 4.05Å
15L95.9Very high93.1Very high101 Ų10141.1 Ų41.153%0.52924%0.241SC..Hα-helixtrans-66.4-47177.7-178.264.5000111.9L11 L12 S13 T17 A18 I19L11-L15 WeakPolarHBondContact O-CB 3.28Å; L11-L15 PolarHBondContact O-N 3.34Å; L12-L15 PolarHBondContact O-N 3.1Å; S13-L15 VanDerWaalsContact C-N 3.32Å; S13-L15 PolarHBondContact O-N 3.48Å; L15-T17 VanDerWaalsContact C-N 3.34Å; L15-T17 PolarHBondContact O-N 3.42Å; L15-A18 PolarHBondContact O-N 2.89Å; L15-I19 HydrophobicContact CD1-CD1 4.5Å; L15-I19 HydrophobicContact CG-CD1 4.23Å; L15-I19 WeakPolarHBondContact O-CG1 3.23Å; L15-I19 PolarHBondContact O-N 3.12Å
16L95.4Very high93.6Very high41 Ų4143.1 Ų43.122%0.21524%0.244CC..Hα-helixtrans-62.5-42.4178.1-72.7176.6000111.8L12 S13 I19 S20 L197 L200 L204L12-L16 WeakPolarHBondContact O-CG 3.43Å; L12-L16 PolarHBondContact O-N 3.35Å; S13-L16 PolarHBondContact O-N 3.42Å; L16-I19 PolarHBondContact O-N 2.95Å; L16-S20 WeakPolarHBondContact O-CB 3.32Å; L16-S20 PolarHBondContact O-N 2.86Å; L16-L197 HydrophobicContact CD2-CD2 3.89Å; L16-L200 HydrophobicContact CD1-CB 4.1Å; L16-L204 HydrophobicContact CD1-CD1 3.47Å; L16-L204 VanDerWaalsContact CD1-CD1 3.47Å; L16-L204 HydrophobicContact CD1-CG 4.31Å; L16-L204 HydrophobicContact CG-CD1 4.49Å
17T94.9Very high94.2Very high2 Ų242.9 Ų42.91%0.01224%0.243CC..Hα-helixtrans-66.7-35.9176.747.40000111.9S13 A14 L15 S20 I21 I111 A201S13-T17 WeakPolarHBondContact O-CB 3.33Å; S13-T17 WeakPolarHBondContact O-CG2 3.47Å; S13-T17 PolarHBondContact O-N 3.27Å; S13-T17 PolarHBondContact O-OG1 3.4Å; A14-T17 WeakPolarHBondContact CA-OG1 3.36Å; A14-T17 PolarHBondContact O-OG1 2.84Å; L15-T17 VanDerWaalsContact C-N 3.34Å; L15-T17 PolarHBondContact O-N 3.42Å; T17-S20 WeakPolarHBondContact O-CB 3.27Å; T17-S20 PolarHBondContact O-N 2.98Å; T17-I21 WeakPolarHBondContact O-CG1 3.37Å; T17-I21 PolarHBondContact O-N 3.49Å; T17-I111 WeakPolarHBondContact OG1-CG1 3.49Å; T17-A201 HydrophobicContact CG2-CB 3.6Å
18A96.6Very high94.6Very high45 Ų4543 Ų4337%0.37224%0.241SC..Hα-helixtrans-63.8-44.4172.700000112.8A14 L15 S20 I21 G22 I111A14-A18 VanDerWaalsContact O-CB 3.31Å; A14-A18 WeakPolarHBondContact O-CB 3.39Å; A14-A18 PolarHBondContact O-N 2.85Å; L15-A18 PolarHBondContact O-N 2.89Å; A18-S20 VanDerWaalsContact C-N 3.29Å; A18-S20 PolarHBondContact O-N 3.44Å; A18-I21 PolarHBondContact O-N 3.23Å; A18-G22 PolarHBondContact O-N 3.28Å; A18-I111 HydrophobicContact CB-CD1 4.02Å
19I96.9Very high94.8Very high88 Ų8842.4 Ų42.445%0.45125%0.246SC..Hα-helixtrans-60.2-43.7173.5-65.8165.8000109.9L15 L16 I21 G22 L23 L197L15-I19 HydrophobicContact CD1-CD1 4.5Å; L15-I19 HydrophobicContact CG-CD1 4.23Å; L15-I19 WeakPolarHBondContact O-CG1 3.23Å; L15-I19 PolarHBondContact O-N 3.12Å; L16-I19 PolarHBondContact O-N 2.95Å; I19-I21 PolarHBondContact O-N 2.97Å; I19-G22 PolarHBondContact O-N 3.44Å; I19-L23 WeakPolarHBondContact O-CB 3.17Å; I19-L23 PolarHBondContact O-N 2.91Å; I19-L197 HydrophobicContact CG2-CD1 4.02Å
20S95.6Very high94.9Very high0 Ų040.3 Ų40.30%024%0.24CC..Hα-helixtrans-59.2-47.7178.4-162.60000111.8L16 T17 A18 G22 L23 L24 Y194L16-S20 WeakPolarHBondContact O-CB 3.32Å; L16-S20 PolarHBondContact O-N 2.86Å; T17-S20 WeakPolarHBondContact O-CB 3.27Å; T17-S20 PolarHBondContact O-N 2.98Å; A18-S20 VanDerWaalsContact C-N 3.29Å; A18-S20 PolarHBondContact O-N 3.44Å; S20-G22 PolarHBondContact O-N 2.95Å; S20-L23 WeakPolarHBondContact O-CB 3.37Å; S20-L23 PolarHBondContact O-N 3.41Å; S20-L24 PolarHBondContact O-N 3.3Å; S20-Y194 WeakPolarHBondContact O-CD2 3.35Å; S20-Y194 WeakPolarHBondContact OG-CD2 3.44Å; S20-Y194 WeakPolarHBondContact OG-CE2 3.43Å; S20-Y194 PolarHBondContact OG-O 2.94Å
21I95.6Very high95.1Very high23 Ų2343.1 Ų43.112%0.11826%0.257CS..Hα-helixtrans-62.4-42.1176.6-68.2177.5000112T17 A18 I19 L23 L24 G25 F104 S107 A108 I111T17-I21 WeakPolarHBondContact O-CG1 3.37Å; T17-I21 PolarHBondContact O-N 3.49Å; A18-I21 PolarHBondContact O-N 3.23Å; I19-I21 PolarHBondContact O-N 2.97Å; I21-L23 VanDerWaalsContact C-N 3.27Å; I21-L23 PolarHBondContact O-N 3.28Å; I21-L24 PolarHBondContact O-N 3.45Å; I21-G25 PolarHBondContact O-N 3.14Å; I21-F104 HydrophobicContact CG2-CD2 4.02Å; I21-F104 HydrophobicContact CG2-CE2 3.54Å; I21-F104 HydrophobicContact CG2-CZ 3.94Å; I21-S107 VanDerWaalsContact CD1-C 3.45Å; I21-S107 VanDerWaalsContact CD1-CB 3.44Å; I21-A108 HydrophobicContact CD1-CB 4.19Å; I21-I111 HydrophobicContact CD1-CD1 3.35Å; I21-I111 HydrophobicContact CD1-CG1 4.34Å; I21-I111 HydrophobicContact CG1-CD1 4.35Å
22G96.1Very high95.3Very high48 Ų4839.3 Ų39.350%0.49524%0.238SC..Hα-helixtrans-58.8-42.3175.300000111.6A18 I19 S20 G25 F26A18-G22 PolarHBondContact O-N 3.28Å; I19-G22 PolarHBondContact O-N 3.44Å; S20-G22 PolarHBondContact O-N 2.95Å; G22-G25 PolarHBondContact O-N 3.11Å; G22-F26 WeakPolarHBondContact O-CB 3.43Å; G22-F26 PolarHBondContact O-N 3.14Å
23L96.1Very high95.4Very high40 Ų4036 Ų3621%0.20922%0.22CC..Hα-helixtrans-64.1-42.9176.1-159.167.3000112.2I19 S20 I21 F26 A27 L190 P193 L197I19-L23 WeakPolarHBondContact O-CB 3.17Å; I19-L23 PolarHBondContact O-N 2.91Å; S20-L23 WeakPolarHBondContact O-CB 3.37Å; S20-L23 PolarHBondContact O-N 3.41Å; I21-L23 VanDerWaalsContact C-N 3.27Å; I21-L23 PolarHBondContact O-N 3.28Å; L23-F26 PolarHBondContact O-N 2.85Å; L23-A27 VanDerWaalsContact O-CB 3.27Å; L23-A27 WeakPolarHBondContact O-CB 3.26Å; L23-A27 PolarHBondContact O-N 3.33Å; L23-L190 HydrophobicContact CD1-CD2 3.75Å; L23-L190 HydrophobicContact CG-CD2 4.22Å; L23-P193 HydrophobicContact CD2-CB 3.83Å; L23-P193 HydrophobicContact CD2-CG 3.67Å; L23-L197 HydrophobicContact CD2-CD1 4.31Å
24L96.5Very high95.5Very high0 Ų038 Ų380%023%0.229CC..Hα-helixtrans-62-46.9175.9-178.464000111.3S20 I21 F26 A27 M28 L100 C103 F104 L191 Y194S20-L24 PolarHBondContact O-N 3.3Å; I21-L24 PolarHBondContact O-N 3.45Å; L24-F26 VanDerWaalsContact C-N 3.34Å; L24-F26 PolarHBondContact O-N 3.28Å; L24-A27 WeakPolarHBondContact O-CB 3.43Å; L24-A27 PolarHBondContact O-N 3.39Å; L24-M28 HydrophobicContact CG-SD 4.31Å; L24-M28 VanDerWaalsContact O-CG 3.27Å; L24-M28 WeakPolarHBondContact O-CG 3.48Å; L24-M28 PolarHBondContact O-N 3.2Å; L24-L100 HydrophobicContact CD1-CD2 3.74Å; L24-C103 HydrophobicContact CD2-CB 3.75Å; L24-F104 HydrophobicContact CD2-CB 4.14Å; L24-F104 HydrophobicContact CD2-CD2 4.3Å; L24-L191 HydrophobicContact CD1-CD1 4.3Å; L24-Y194 HydrophobicContact CB-CD2 3.71Å; L24-Y194 HydrophobicContact CB-CE2 3.9Å; L24-Y194 HydrophobicContact CB-CG 4.47Å; L24-Y194 HydrophobicContact CD1-CD2 4.42Å; L24-Y194 HydrophobicContact CD2-CD2 4.4Å; L24-Y194 HydrophobicContact CD2-CE2 3.83Å; L24-Y194 HydrophobicContact CG-CD2 4.4Å; L24-Y194 HydrophobicContact CG-CE2 4.31Å
25G95.6Very high95.4Very high30 Ų3037.7 Ų37.731%0.30923%0.226SC..Hα-helixtrans-61.1-42.4177.700000112.2I21 G22 M28 S29I21-G25 PolarHBondContact O-N 3.14Å; G22-G25 PolarHBondContact O-N 3.11Å; G25-M28 PolarHBondContact O-N 3.02Å; G25-S29 PolarHBondContact O-N 3.36Å
26F96.3Very high95.2Very high119 Ų11936.9 Ų36.952%0.52222%0.218SC..Hα-helixtrans-67.2-41.4174.1-176.2-109.8000112.2G22 L23 L24 M28 S29 T30 L190G22-F26 WeakPolarHBondContact O-CB 3.43Å; G22-F26 PolarHBondContact O-N 3.14Å; L23-F26 PolarHBondContact O-N 2.85Å; L24-F26 VanDerWaalsContact C-N 3.34Å; L24-F26 PolarHBondContact O-N 3.28Å; F26-M28 VanDerWaalsContact C-N 3.26Å; F26-M28 PolarHBondContact O-N 2.92Å; F26-S29 PolarHBondContact O-N 3.46Å; F26-S29 PolarHBondContact O-OG 3.45Å; F26-T30 HydrophobicContact CD1-CG2 4.27Å; F26-T30 HydrophobicContact CD2-CG2 4.33Å; F26-T30 HydrophobicContact CE1-CG2 3.87Å; F26-T30 HydrophobicContact CE2-CG2 3.95Å; F26-T30 HydrophobicContact CG-CG2 4.48Å; F26-T30 HydrophobicContact CZ-CG2 3.7Å; F26-T30 VanDerWaalsContact O-CG2 3.27Å; F26-T30 WeakPolarHBondContact O-CG2 3.44Å; F26-T30 PolarHBondContact O-N 3.18Å; F26-T30 PolarHBondContact O-OG1 2.88Å; F26-L190 HydrophobicContact CD1-CD1 3.58Å; F26-L190 HydrophobicContact CE1-CD1 3.91Å
27A95.9Very high94.9Very high0 Ų035 Ų350%021%0.209CC..Hα-helixtrans-56-44.817400000110.7L23 L24 S29 T30 W32 L190 L191L23-A27 VanDerWaalsContact O-CB 3.27Å; L23-A27 WeakPolarHBondContact O-CB 3.26Å; L23-A27 PolarHBondContact O-N 3.33Å; L24-A27 WeakPolarHBondContact O-CB 3.43Å; L24-A27 PolarHBondContact O-N 3.39Å; A27-S29 VanDerWaalsContact C-N 3.31Å; A27-S29 PolarHBondContact O-N 3.24Å; A27-T30 PolarHBondContact O-N 3.38Å; A27-T30 PolarHBondContact O-OG1 3.35Å; A27-W32 PolarHBondContact O-NE1 3.31Å; A27-L190 HydrophobicContact CB-CB 3.64Å; A27-L190 HydrophobicContact CB-CD1 4.15Å; A27-L191 HydrophobicContact CB-CD1 4.17Å
28M94.9Very high94.6Very high37 Ų3738.2 Ų38.218%0.18223%0.226CC..Hα-helixtrans-65.4-28.3-179.9-70.3176.771.600114.2L24 G25 F26 L57 F58 L100L24-M28 HydrophobicContact CG-SD 4.31Å; L24-M28 VanDerWaalsContact O-CG 3.27Å; L24-M28 WeakPolarHBondContact O-CG 3.48Å; L24-M28 PolarHBondContact O-N 3.2Å; G25-M28 PolarHBondContact O-N 3.02Å; F26-M28 VanDerWaalsContact C-N 3.26Å; F26-M28 PolarHBondContact O-N 2.92Å; M28-L57 HydrophobicContact CB-CD1 3.84Å; M28-L57 HydrophobicContact CE-CD1 4.41Å; M28-L57 HydrophobicContact CG-CD1 3.73Å; M28-F58 HydrophobicContact CE-CE2 4.26Å; M28-F58 HydrophobicContact CE-CZ 4.19Å; M28-L100 HydrophobicContact CE-CB 4.38Å; M28-L100 HydrophobicContact CG-CD1 4.49Å; M28-L100 HydrophobicContact SD-CB 4.39Å
29S93.6Very high93.9Very high90 Ų9036.3 Ų36.363%0.62921%0.209SC*.Hα-helixtrans-86.1-12.8179.969.90000114.1G25 F26 A27G25-S29 PolarHBondContact O-N 3.36Å; F26-S29 PolarHBondContact O-N 3.46Å; F26-S29 PolarHBondContact O-OG 3.45Å; A27-S29 VanDerWaalsContact C-N 3.31Å; A27-S29 PolarHBondContact O-N 3.24Å
30T94.1Very high93.2Very high25 Ų2537.2 Ų37.215%0.15321%0.212CC..SBendtrans-93.9-178.2-176.759.70000112.8F26 A27 I186 G187F26-T30 HydrophobicContact CD1-CG2 4.27Å; F26-T30 HydrophobicContact CD2-CG2 4.33Å; F26-T30 HydrophobicContact CE1-CG2 3.87Å; F26-T30 HydrophobicContact CE2-CG2 3.95Å; F26-T30 HydrophobicContact CG-CG2 4.48Å; F26-T30 HydrophobicContact CZ-CG2 3.7Å; F26-T30 VanDerWaalsContact O-CG2 3.27Å; F26-T30 WeakPolarHBondContact O-CG2 3.44Å; F26-T30 PolarHBondContact O-N 3.18Å; F26-T30 PolarHBondContact O-OG1 2.88Å; A27-T30 PolarHBondContact O-N 3.38Å; A27-T30 PolarHBondContact O-OG1 3.35Å; T30-I186 HydrophobicContact CG2-CG2 4.44Å; T30-G187 WeakPolarHBondContact OG1-CA 3.38Å; T30-G187 PolarHBondContact OG1-N 2.83Å
31T94.9Very high92.1Very high61 Ų6137.6 Ų37.637%0.37422%0.216SC..EExtended strand (participates in β ladder)trans-82.2139.5175.252.60000111T54 K185 G187T31-T54 HydrophobicContact CG2-CG2 3.76Å; T31-K185 WeakPolarHBondContact O-CB 3.29Å; T31-G187 WeakPolarHBondContact O-CA 3.47Å; T31-G187 PolarHBondContact O-N 2.85Å
32W95.8Very high90.5Very high0 Ų040.8 Ų40.80%024%0.24CC..EExtended strand (participates in β ladder)trans-108.2-36.6-172.8-81.656.1000112.6A27 M55 L57 L100 V146 Y150 K185 Y188 L191A27-W32 PolarHBondContact O-NE1 3.31Å; W32-M55 PolarHBondContact N-O 3.47Å; W32-L57 HydrophobicContact CD2-CD2 3.93Å; W32-L57 HydrophobicContact CD2-CG 4.04Å; W32-L57 HydrophobicContact CE3-CD2 4.18Å; W32-L57 HydrophobicContact CG-CD2 4.43Å; W32-L57 HydrophobicContact CG-CG 4.29Å; W32-L57 HydrophobicContact CH2-CD1 4.41Å; W32-L57 HydrophobicContact CH2-CD2 4.32Å; W32-L57 HydrophobicContact CZ2-CD1 3.66Å; W32-L57 HydrophobicContact CZ2-CD2 4.12Å; W32-L57 HydrophobicContact CZ2-CG 4.01Å; W32-L57 HydrophobicContact CZ3-CD2 4.36Å; W32-L100 HydrophobicContact CH2-CD1 3.79Å; W32-L100 HydrophobicContact CH2-CD2 4.16Å; W32-L100 HydrophobicContact CZ2-CD1 4.13Å; W32-V146 HydrophobicContact CH2-CG1 4.14Å; W32-V146 HydrophobicContact CZ3-CG1 4.04Å; W32-Y150 HydrophobicContact CB-CE1 4.09Å; W32-Y150 HydrophobicContact CB-CE2 4.32Å; W32-Y150 VanDerWaalsContact CB-OH 3.22Å; W32-Y150 WeakPolarHBondContact CB-OH 3.38Å; W32-Y150 HydrophobicContact CE3-CD1 4.22Å; W32-Y150 HydrophobicContact CE3-CD2 4.01Å; W32-Y150 HydrophobicContact CE3-CE1 4.21Å; W32-Y150 HydrophobicContact CE3-CE2 4.01Å; W32-Y150 HydrophobicContact CE3-CG 4.12Å; W32-Y150 HydrophobicContact CZ3-CD2 4.43Å; W32-Y150 HydrophobicContact CZ3-CG 4.45Å; W32-K185 PolarHBondContact O-N 2.9Å; W32-Y188 HydrophobicContact CE3-CD2 4.43Å; W32-L191 HydrophobicContact CH2-CD1 3.31Å; W32-L191 HydrophobicContact CH2-CD2 4.15Å; W32-L191 HydrophobicContact CH2-CG 4.36Å; W32-L191 HydrophobicContact CZ2-CD1 3.66Å; W32-L191 HydrophobicContact CZ3-CD1 4.24Å
33S95.1Very high88.7Confident0 Ų041 Ų410%024%0.242CC..EExtended strand (participates in β ladder)trans-149.3159.7177.361.70000112.3T54 M55 Y150 H154 E183S33-T54 CarbonylContact O-C 3.59Å; S33-T54 WeakPolarHBondContact O-CA 3.48Å; S33-M55 PolarHBondContact N-O 3.04Å; S33-M55 PolarHBondContact O-N 3.45Å; S33-Y150 WeakPolarHBondContact CB-OH 3.4Å; S33-Y150 PolarHBondContact OG-OH 3.48Å; S33-H154 PolarHBondContact OG-CE1 3Å; S33-H154 PolarHBondContact OG-NE2 3.48Å; S33-E183 CarbonylContact C-O 3.54Å; S33-E183 WeakPolarHBondContact CA-O 3.49Å
34K94.7Very high86.6Confident41 Ų4147.6 Ų47.618%0.17828%0.275CS..EExtended strand (participates in β ladder)trans-134.2123170.2173166.3150.8150.60107.1K36 E52 I53 E183 K185K34-K36 VanDerWaalsContact CE-CE 3.43Å; K34-E52 HydrophobicContact CD-CG 4.21Å; K34-E52 WeakPolarHBondContact CD-OE1 3.43Å; K34-E52 WeakPolarHBondContact CE-OE1 3.42Å; K34-E52 WeakPolarHBondContact CE-OE2 3.19Å; K34-E52 HydrophobicContact CG-CG 3.99Å; K34-E52 IonicContact NZ-OE1 2.59Å; K34-E52 PolarHBondContact NZ-OE1 3.49Å; K34-E52 IonicContact NZ-OE2 2.76Å; K34-E52 PolarHBondContact NZ-OE2 3.23Å; K34-I53 CarbonylContact C-O 3.56Å; K34-I53 WeakPolarHBondContact CA-O 3.3Å; K34-E183 HydrophobicContact CB-CB 4.43Å; K34-E183 PolarHBondContact N-O 2.82Å; K34-E183 PolarHBondContact O-N 3.36Å; K34-K185 HydrophobicContact CB-CG 4.35Å
35T92.9Very high84.6Confident0 Ų054.5 Ų54.50%031%0.312CS..EExtended strand (participates in β ladder)trans-112.9127.2177-49.60000108.4M37 E52 I53 Q160 K180 R181T35-M37 HydrophobicContact CG2-CE 4.47Å; T35-M37 HydrophobicContact CG2-CG 4.17Å; T35-M37 HydrophobicContact CG2-SD 4.42Å; T35-E52 WeakPolarHBondContact O-CA 3.27Å; T35-I53 PolarHBondContact N-O 2.89Å; T35-I53 WeakPolarHBondContact O-CG2 3.36Å; T35-I53 PolarHBondContact O-N 3.31Å; T35-Q160 HydrophobicContact CG2-CB 4.32Å; T35-Q160 HydrophobicContact CG2-CG 4.08Å; T35-K180 HydrophobicContact CG2-CG 3.64Å; T35-R181 CarbonylContact C-O 3.6Å; T35-R181 WeakPolarHBondContact CA-O 3.47Å
36K91.5Very high82.8Confident84 Ų8454.6 Ų54.637%0.36531%0.313SS..EExtended strand (participates in β ladder)trans-104.2135.9169.9-67-179.5179.7177.70108.9K34 E52 R181K34-K36 VanDerWaalsContact CE-CE 3.43Å; K36-E52 WeakPolarHBondContact CE-OE2 3.29Å; K36-E52 HydrophobicContact CG-CB 4.33Å; K36-E52 HydrophobicContact CG-CG 3.99Å; K36-R181 HydrophobicContact CB-CB 4.5Å; K36-R181 PolarHBondContact N-O 3.3Å; K36-R181 PolarHBondContact O-N 3.24Å
37M89.8Confident81.3Confident2 Ų252.3 Ų52.31%0.0131%0.31CS..EExtended strand (participates in β ladder)trans-135.2141177.3-68.2172-70.300108.5T35 S50 A51 I53 Q160 E161 V164 L177 K180T35-M37 HydrophobicContact CG2-CE 4.47Å; T35-M37 HydrophobicContact CG2-CG 4.17Å; T35-M37 HydrophobicContact CG2-SD 4.42Å; M37-S50 WeakPolarHBondContact O-CA 3.35Å; M37-A51 PolarHBondContact N-O 3.25Å; M37-A51 PolarHBondContact O-N 3.17Å; M37-I53 HydrophobicContact CE-CG2 3.84Å; M37-Q160 HydrophobicContact CE-CB 3.77Å; M37-Q160 HydrophobicContact SD-CB 3.89Å; M37-E161 HydrophobicContact SD-CG 4.1Å; M37-V164 HydrophobicContact CE-CG2 3.52Å; M37-L177 HydrophobicContact CB-CD2 4.3Å; M37-L177 HydrophobicContact CE-CD1 4.47Å; M37-L177 HydrophobicContact SD-CB 4.46Å; M37-L177 HydrophobicContact SD-CD1 4.44Å; M37-K180 HydrophobicContact CG-CB 4.23Å; M37-K180 HydrophobicContact CG-CG 4.34Å
38D87.8Confident80.4Confident70 Ų7056.5 Ų56.537%0.37434%0.344SS..EExtended strand (participates in β ladder)trans-81141.4172-62.8-28.5000108.4L177 T178 H179D38-L177 CarbonylContact O-C 3.48Å; D38-L177 WeakPolarHBondContact O-CA 3.5Å; D38-T178 PolarHBondContact N-O 3Å; D38-T178 PolarHBondContact O-N 2.97Å; D38-H179 HydrophobicContact CB-CB 4.44Å; D38-H179 WeakPolarHBondContact OD2-CB 3.5Å; D38-H179 IonicContact OD2-CG 3.69Å; D38-H179 IonicContact OD2-ND1 3.72Å
39C82.9Confident79.8Confident4 Ų455.4 Ų55.43%0.02734%0.342CS..EExtended strand (participates in β ladder)trans-123.4124-169.4-178.80000108.6G49 C67 V175 L177C39-G49 PolarHBondContact N-O 3.35Å; C39-G49 PolarHBondContact O-N 3.35Å; C39-C67 HydrophobicContact CB-CB 4.31Å; C39-C67 WeakPolarHBondContact CB-SG 3.49Å; C39-C67 VanDerWaalsContact SG-CA 3.59Å; C39-C67 WeakPolarHBondContact SG-CB 3.38Å; C39-C67 CovalentContact SG-SG 2.04Å; C39-C67 PolarHBondContact SG-SG 3.05Å; C39-V175 WeakPolarHBondContact SG-CG1 3.17Å; C39-L177 HydrophobicContact CB-CD2 4.04Å
40E81.3Confident79.4Confident108 Ų10853.4 Ų53.451%0.50533%0.328SS..EExtended strand (participates in β ladder)trans-124.9128177.5-173.2174.4-166.600109.1T176E40-T176 PolarHBondContact N-O 3.49Å; E40-T176 PolarHBondContact O-N 3.49Å; E40-T176 PolarHBondContact O-OG1 2.91Å
41G71.9Confident79.1Confident8 Ų852.2 Ų52.28%0.08232%0.321CS..EExtended strand (participates in β ladder)trans-76.3136.6176.800000111.1G43 G46G41-G43 PolarHBondContact O-N 2.95Å; G41-G46 WeakPolarHBondContact O-CA 3.43Å
42S63Low79Confident90 Ų9051 Ų5163%0.62931%0.311SS*.SBendtrans-73.738.6-177-1580000114.1S174S42-S174 WeakPolarHBondContact CB-O 3.43Å; S42-S174 PolarHBondContact N-O 3.47Å
43G58.7Low78.8Confident51 Ų5151 Ų5153%0.52631%0.311SS..SBendtrans-125.7164.9-176.500000114G41 N45 G46G41-G43 PolarHBondContact O-N 2.95Å; G43-N45 PolarHBondContact O-N 3.46Å; G43-G46 PolarHBondContact O-N 2.95Å
44I51Low78.8Confident179 Ų17952.1 Ų52.192%0.91832%0.318SS*.THydrogen-bonded Turntrans-58.2-20.6-174.2-61.3169.8000113.4
45N55.5Low78.7Confident145 Ų14550.2 Ų50.278%0.77531%0.31SS*.THydrogen-bonded Turntrans-120.442.2176.1-62.6-26.3000111.8G43 T47G43-N45 PolarHBondContact O-N 3.46Å; N45-T47 PolarHBondContact O-N 3.12Å
46G58Low78.7Confident32 Ų3250.5 Ų50.533%0.3331%0.313SS..  trans-37.3107.4-174.100000113.1G41 G43 A48G41-G46 WeakPolarHBondContact O-CA 3.43Å; G43-G46 PolarHBondContact O-N 2.95Å; G46-A48 PolarHBondContact O-N 3.4Å
47T64.6Low78.8Confident72 Ų7246.6 Ų46.644%0.44230%0.296SS..  trans-73.8112.4176.949.60000107.7N45 G49N45-T47 PolarHBondContact O-N 3.12Å; T47-G49 PolarHBondContact O-N 3Å
48A76Confident79Confident88 Ų8850.5 Ų50.573%0.72731%0.313SS*.EExtended strand (participates in β ladder)trans-68122.317100000109.1G46G46-A48 PolarHBondContact O-N 3.4Å
49G82.6Confident79.3Confident13 Ų1352.4 Ų52.413%0.13432%0.323CS..EExtended strand (participates in β ladder)trans-135.9-176177.800000111.6C39 T47 V65C39-G49 PolarHBondContact N-O 3.35Å; C39-G49 PolarHBondContact O-N 3.35Å; T47-G49 PolarHBondContact O-N 3Å; G49-V65 CarbonylContact C-O 3.6Å; G49-V65 WeakPolarHBondContact CA-O 3Å
50S86.2Confident79.8Confident48 Ų4852.7 Ų52.734%0.33633%0.326SS..EExtended strand (participates in β ladder)trans-133.7135.8174.966.40000110.4M37 V65M37-S50 WeakPolarHBondContact O-CA 3.35Å; S50-V65 PolarHBondContact N-O 3.44Å; S50-V65 PolarHBondContact O-N 3.27Å
51A87.8Confident80.4Confident1 Ų151 Ų511%0.00832%0.317CS..EExtended strand (participates in β ladder)trans-108.7128.3169.300000109.3M37 V164 L177M37-A51 PolarHBondContact N-O 3.25Å; M37-A51 PolarHBondContact O-N 3.17Å; A51-V164 HydrophobicContact CB-CG1 4.09Å; A51-L177 HydrophobicContact CB-CD2 4.21Å
52E91.3Very high81.3Confident35 Ų3550.6 Ų50.616%0.16431%0.313CS..EExtended strand (participates in β ladder)trans-119.7119.9176.1-178.3-175.1126.300109.5K34 T35 K36 L62 I63K34-E52 HydrophobicContact CD-CG 4.21Å; K34-E52 WeakPolarHBondContact CD-OE1 3.43Å; K34-E52 WeakPolarHBondContact CE-OE1 3.42Å; K34-E52 WeakPolarHBondContact CE-OE2 3.19Å; K34-E52 HydrophobicContact CG-CG 3.99Å; K34-E52 IonicContact NZ-OE1 2.59Å; K34-E52 PolarHBondContact NZ-OE1 3.49Å; K34-E52 IonicContact NZ-OE2 2.76Å; K34-E52 PolarHBondContact NZ-OE2 3.23Å; T35-E52 WeakPolarHBondContact O-CA 3.27Å; K36-E52 WeakPolarHBondContact CE-OE2 3.29Å; K36-E52 HydrophobicContact CG-CB 4.33Å; K36-E52 HydrophobicContact CG-CG 3.99Å; E52-L62 CarbonylContact O-C 3.59Å; E52-I63 HydrophobicContact CB-CB 4.4Å; E52-I63 PolarHBondContact N-O 3.01Å; E52-I63 PolarHBondContact O-N 3Å
53I92.1Very high82.6Confident0 Ų048.7 Ų48.70%030%0.296CS..EExtended strand (participates in β ladder)trans-115.9115.2179-178.6160.7000109.3K34 T35 M37 M55 K61 L62 F76 L163 V164 I167K34-I53 CarbonylContact C-O 3.56Å; K34-I53 WeakPolarHBondContact CA-O 3.3Å; T35-I53 PolarHBondContact N-O 2.89Å; T35-I53 WeakPolarHBondContact O-CG2 3.36Å; T35-I53 PolarHBondContact O-N 3.31Å; M37-I53 HydrophobicContact CE-CG2 3.84Å; I53-M55 HydrophobicContact CG1-CG 4.11Å; I53-K61 WeakPolarHBondContact CA-O 3.31Å; I53-L62 HydrophobicContact CB-CD1 4.15Å; I53-F76 HydrophobicContact CD1-CE1 4.16Å; I53-F76 HydrophobicContact CD1-CZ 3.82Å; I53-F76 HydrophobicContact CG1-CE1 4.27Å; I53-F76 HydrophobicContact CG1-CZ 4.12Å; I53-L163 HydrophobicContact CD1-CB 4.02Å; I53-V164 HydrophobicContact CD1-CG2 4.4Å; I53-V164 HydrophobicContact CG2-CG2 4.47Å; I53-I167 HydrophobicContact CD1-CD1 4.13Å
54T94.5Very high84Confident24 Ų2447.1 Ų47.115%0.14727%0.274CS..EExtended strand (participates in β ladder)trans-99.2123.4173.9-59.80000108.6T31 S33 G60 K61T31-T54 HydrophobicContact CG2-CG2 3.76Å; S33-T54 CarbonylContact O-C 3.59Å; S33-T54 WeakPolarHBondContact O-CA 3.48Å; T54-G60 CarbonylContact O-C 3.5Å; T54-G60 WeakPolarHBondContact O-CA 3.32Å; T54-K61 PolarHBondContact N-O 3Å; T54-K61 PolarHBondContact O-N 3.49Å
55M93.2Very high85.5Confident0 Ų042.2 Ų42.20%025%0.252CS..EExtended strand (participates in β ladder)trans-116.2128-178.5-75-168.155.100111.6W32 S33 I53 F76 V78 M159 Q160 L163W32-M55 PolarHBondContact N-O 3.47Å; S33-M55 PolarHBondContact N-O 3.04Å; S33-M55 PolarHBondContact O-N 3.45Å; I53-M55 HydrophobicContact CG1-CG 4.11Å; M55-F76 HydrophobicContact CG-CZ 4.46Å; M55-V78 HydrophobicContact CE-CG1 3.87Å; M55-V78 HydrophobicContact CE-CG2 4.29Å; M55-M159 HydrophobicContact CE-CE 4.09Å; M55-M159 HydrophobicContact SD-CE 3.97Å; M55-Q160 PolarHBondContact SD-NE2 3.39Å; M55-L163 HydrophobicContact SD-CD1 4.18Å
56G93.8Very high86.4Confident7 Ų738.1 Ų38.17%0.07224%0.235CC..EExtended strand (participates in β ladder)trans-91-168.5153.100000110.8N59G56-N59 VanDerWaalsContact CA-O 3.31Å; G56-N59 WeakPolarHBondContact CA-O 3.09Å; G56-N59 PolarHBondContact N-O 2.93Å
57L93.4Very high87.1Confident1 Ų136.9 Ų36.91%0.00522%0.221CC..SBendtrans-73.1-36.8175.2-73.9178.8000113.1M28 W32 H93 L97 L100M28-L57 HydrophobicContact CB-CD1 3.84Å; M28-L57 HydrophobicContact CE-CD1 4.41Å; M28-L57 HydrophobicContact CG-CD1 3.73Å; W32-L57 HydrophobicContact CD2-CD2 3.93Å; W32-L57 HydrophobicContact CD2-CG 4.04Å; W32-L57 HydrophobicContact CE3-CD2 4.18Å; W32-L57 HydrophobicContact CG-CD2 4.43Å; W32-L57 HydrophobicContact CG-CG 4.29Å; W32-L57 HydrophobicContact CH2-CD1 4.41Å; W32-L57 HydrophobicContact CH2-CD2 4.32Å; W32-L57 HydrophobicContact CZ2-CD1 3.66Å; W32-L57 HydrophobicContact CZ2-CD2 4.12Å; W32-L57 HydrophobicContact CZ2-CG 4.01Å; W32-L57 HydrophobicContact CZ3-CD2 4.36Å; L57-H93 PolarHBondContact O-NE2 2.63Å; L57-L97 HydrophobicContact CB-CD2 3.97Å; L57-L97 HydrophobicContact CD1-CD2 4.01Å; L57-L97 HydrophobicContact CD2-CD2 3.86Å; L57-L97 HydrophobicContact CG-CD2 4.16Å; L57-L100 HydrophobicContact CD1-CD1 3.65Å; L57-L100 HydrophobicContact CD2-CD1 4.12Å
58F93.7Very high86.9Confident84 Ų8436 Ų3637%0.36822%0.216SC..SBendtrans-117.2-33.9-170.9-58.8-67.6000113.4M28 V78 F79 L97M28-F58 HydrophobicContact CE-CE2 4.26Å; M28-F58 HydrophobicContact CE-CZ 4.19Å; F58-V78 WeakPolarHBondContact O-CB 3.25Å; F58-V78 PolarHBondContact O-N 2.82Å; F58-F79 HydrophobicContact CD1-CD2 4.36Å; F58-F79 AromaticContact CD1-CE2 3.49Å; F58-F79 HydrophobicContact CD1-CE2 3.49Å; F58-F79 VanDerWaalsContact CD1-CE2 3.49Å; F58-F79 HydrophobicContact CD1-CZ 4.11Å; F58-F79 AromaticContact CE1-CE2 3.81Å; F58-F79 HydrophobicContact CE1-CE2 3.81Å; F58-F79 HydrophobicContact CE1-CZ 4.04Å; F58-L97 HydrophobicContact CE1-CD1 4.27Å; F58-L97 HydrophobicContact CE1-CD2 4.05Å; F58-L97 HydrophobicContact CZ-CD2 3.98Å
59N93.4Very high86.2Confident111 Ų11136.4 Ų36.459%0.59421%0.206SC*.EExtended strand (participates in β ladder)trans-124.6151-178.8-61.8-40.6000109.9G56G56-N59 VanDerWaalsContact CA-O 3.31Å; G56-N59 WeakPolarHBondContact CA-O 3.09Å; G56-N59 PolarHBondContact N-O 2.93Å
60G93.6Very high84.8Confident9 Ų944.7 Ų44.79%0.09324%0.239CC..EExtended strand (participates in β ladder)trans-141.1168.7177.600000111.7T54 F76T54-G60 CarbonylContact O-C 3.5Å; T54-G60 WeakPolarHBondContact O-CA 3.32Å; G60-F76 VanDerWaalsContact C-CE1 3.41Å; G60-F76 PolarHBondContact N-O 3.4Å; G60-F76 PolarHBondContact O-N 2.91Å
61K93.5Very high83.6Confident72 Ų7244.8 Ų44.831%0.31325%0.248SC..EExtended strand (participates in β ladder)trans-139127.4179.8-177.7177.7172.4168.50108.9I53 T54 I63 E73 D74I53-K61 WeakPolarHBondContact CA-O 3.31Å; T54-K61 PolarHBondContact N-O 3Å; T54-K61 PolarHBondContact O-N 3.49Å; K61-I63 HydrophobicContact CG-CG1 4.33Å; K61-E73 HydrophobicContact CD-CG 4.44Å; K61-E73 WeakPolarHBondContact CE-OE1 3.5Å; K61-E73 WeakPolarHBondContact CE-OE2 3.36Å; K61-E73 HydrophobicContact CG-CG 4.39Å; K61-E73 IonicContact NZ-OE1 2.76Å; K61-E73 PolarHBondContact NZ-OE1 3.41Å; K61-E73 IonicContact NZ-OE2 3.68Å; K61-E73 PolarHBondContact NZ-OE2 3.5Å; K61-D74 WeakPolarHBondContact CA-O 3.02Å
62L91.1Very high83.1Confident0 Ų046.4 Ų46.40%026%0.259CS..EExtended strand (participates in β ladder)trans-108.3126.217517561.8000108.6E52 I53 R64 E73 D74 F76 V164 I167E52-L62 CarbonylContact O-C 3.59Å; I53-L62 HydrophobicContact CB-CD1 4.15Å; L62-R64 HydrophobicContact CD1-CG 4.12Å; L62-R64 HydrophobicContact CD2-CG 4.29Å; L62-R64 HydrophobicContact CG-CG 4.01Å; L62-E73 WeakPolarHBondContact O-CA 3.34Å; L62-D74 HydrophobicContact CB-CB 4.41Å; L62-D74 PolarHBondContact N-O 2.99Å; L62-D74 PolarHBondContact O-N 3.03Å; L62-F76 HydrophobicContact CB-CE1 4.32Å; L62-V164 HydrophobicContact CD1-CG1 4.35Å; L62-V164 HydrophobicContact CD1-CG2 3.9Å; L62-V164 HydrophobicContact CD2-CG1 4.49Å; L62-I167 HydrophobicContact CB-CG2 4.41Å; L62-I167 HydrophobicContact CD2-CB 3.96Å; L62-I167 HydrophobicContact CD2-CG2 3.78Å
63I90.5Very high82.9Confident50 Ų5050.8 Ų50.826%0.25628%0.28SS..EExtended strand (participates in β ladder)trans-118123.3173.8-57.8172.9000106.9E52 K61 V65E52-I63 HydrophobicContact CB-CB 4.4Å; E52-I63 PolarHBondContact N-O 3.01Å; E52-I63 PolarHBondContact O-N 3Å; K61-I63 HydrophobicContact CG-CG1 4.33Å; I63-V65 HydrophobicContact CG2-CG2 4.48Å
64R87.8Confident82.7Confident19 Ų1953.2 Ų53.27%0.07229%0.292CS..EExtended strand (participates in β ladder)trans-114.7135.5177.3-64.5178-73.1154.3-18.8109.3L62 C67 G71 S72 D74 A168L62-R64 HydrophobicContact CD1-CG 4.12Å; L62-R64 HydrophobicContact CD2-CG 4.29Å; L62-R64 HydrophobicContact CG-CG 4.01Å; R64-C67 HydrophobicContact CB-CB 4.49Å; R64-G71 WeakPolarHBondContact O-CA 3.37Å; R64-S72 PolarHBondContact N-O 3.45Å; R64-S72 PolarHBondContact NE-OG 2.97Å; R64-S72 PolarHBondContact NH2-OG 3.28Å; R64-D74 IonicContact CZ-OD2 2.61Å; R64-D74 IonicContact NE-OD2 2.79Å; R64-D74 IonicContact NH2-OD2 3.68Å; R64-D74 PolarHBondContact NH2-OD2 3.09Å; R64-A168 VanDerWaalsContact CZ-CB 3.47Å
65V83.1Confident82.6Confident76 Ų7657.3 Ų57.346%0.46132%0.322SS..EExtended strand (participates in β ladder)trans-126.6117174.8-175.70000107.8G49 S50 I63 C67G49-V65 CarbonylContact C-O 3.6Å; G49-V65 WeakPolarHBondContact CA-O 3Å; S50-V65 PolarHBondContact N-O 3.44Å; S50-V65 PolarHBondContact O-N 3.27Å; I63-V65 HydrophobicContact CG2-CG2 4.48Å; V65-C67 PolarHBondContact O-N 3.15Å
66S75.1Confident82.5Confident59 Ų5958 Ų5841%0.41333%0.325SS..SBendtrans56.622.3175.6-51.80000116.3
67C71.8Confident82.4Confident5 Ų560.6 Ų60.63%0.03434%0.342CS..SBendtrans-67.7159.3160.7-82.50000110.1C39 R64 V65 N69C39-C67 HydrophobicContact CB-CB 4.31Å; C39-C67 WeakPolarHBondContact CB-SG 3.49Å; C39-C67 VanDerWaalsContact SG-CA 3.59Å; C39-C67 WeakPolarHBondContact SG-CB 3.38Å; C39-C67 CovalentContact SG-SG 2.04Å; C39-C67 PolarHBondContact SG-SG 3.05Å; R64-C67 HydrophobicContact CB-CB 4.49Å; V65-C67 PolarHBondContact O-N 3.15Å; C67-N69 CarbonylContact O-C 3.04Å; C67-N69 PolarHBondContact O-N 3.13Å
68P61.3Low82.3Confident53 Ų5360.6 Ų60.634%0.34434%0.342SS..SBendtrans-58.5-11-169.817.3-30000116.4V175P68-V175 HydrophobicContact CG-CG2 3.42Å; P68-V175 VanDerWaalsContact CG-CG2 3.42Å
69N59.7Low82.1Confident97 Ų9761.3 Ų61.352%0.51935%0.345SS..SBendtrans-106.9116.2154.3-106.1-0.5000108.8C67 I170C67-N69 CarbonylContact O-C 3.04Å; C67-N69 PolarHBondContact O-N 3.13Å; N69-I170 HydrophobicContact CB-CD1 4.22Å
70F53.1Low81.9Confident187 Ų18759.1 Ų59.182%0.8234%0.337SS*.  trans-47.9143.6-175.7-80.5-89.8000113.1
71G62.1Low81.6Confident51 Ų5159.8 Ų59.853%0.52634%0.338SS..  trans-47.3132.2-159.600000116.6R64R64-G71 WeakPolarHBondContact O-CA 3.37Å
72S78Confident81.4Confident35 Ų3556.6 Ų56.625%0.24532%0.324CS..  trans-133.3157.8175.969.20000110.6R64 D74R64-S72 PolarHBondContact N-O 3.45Å; R64-S72 PolarHBondContact NE-OG 2.97Å; R64-S72 PolarHBondContact NH2-OG 3.28Å; S72-D74 PolarHBondContact OG-OD2 3.13Å
73E87.3Confident81.3Confident127 Ų12761.9 Ų61.959%0.59335%0.352SS*.EExtended strand (participates in β ladder)trans-112.2112169.4178.5175.7142.800108K61 L62K61-E73 HydrophobicContact CD-CG 4.44Å; K61-E73 WeakPolarHBondContact CE-OE1 3.5Å; K61-E73 WeakPolarHBondContact CE-OE2 3.36Å; K61-E73 HydrophobicContact CG-CG 4.39Å; K61-E73 IonicContact NZ-OE1 2.76Å; K61-E73 PolarHBondContact NZ-OE1 3.41Å; K61-E73 IonicContact NZ-OE2 3.68Å; K61-E73 PolarHBondContact NZ-OE2 3.5Å; L62-E73 WeakPolarHBondContact O-CA 3.34Å
74D87.6Confident81Confident50 Ų5067 Ų6727%0.26737%0.368SS..EExtended strand (participates in β ladder)trans-116.2116-176.7-60.9-52.4000109.3K61 L62 R64 S72 I167K61-D74 WeakPolarHBondContact CA-O 3.02Å; L62-D74 HydrophobicContact CB-CB 4.41Å; L62-D74 PolarHBondContact N-O 2.99Å; L62-D74 PolarHBondContact O-N 3.03Å; R64-D74 IonicContact CZ-OD2 2.61Å; R64-D74 IonicContact NE-OD2 2.79Å; R64-D74 IonicContact NH2-OD2 3.68Å; R64-D74 PolarHBondContact NH2-OD2 3.09Å; S72-D74 PolarHBondContact OG-OD2 3.13Å; D74-I167 HydrophobicContact CB-CG2 4.09Å
75S91.3Very high81Confident110 Ų11066.8 Ų66.877%0.76937%0.368SS*.EExtended strand (participates in β ladder)trans-88.4133.8169.460.60000109.9
76F91.1Very high81Confident16 Ų1668.2 Ų68.27%0.0737%0.37CS..EExtended strand (participates in β ladder)trans-137.9155.3-176.566.9-86000112.3I53 M55 G60 L62 V78 E81 L163 I167I53-F76 HydrophobicContact CD1-CE1 4.16Å; I53-F76 HydrophobicContact CD1-CZ 3.82Å; I53-F76 HydrophobicContact CG1-CE1 4.27Å; I53-F76 HydrophobicContact CG1-CZ 4.12Å; M55-F76 HydrophobicContact CG-CZ 4.46Å; G60-F76 VanDerWaalsContact C-CE1 3.41Å; G60-F76 PolarHBondContact N-O 3.4Å; G60-F76 PolarHBondContact O-N 2.91Å; L62-F76 HydrophobicContact CB-CE1 4.32Å; F76-V78 HydrophobicContact CE2-CG2 4.12Å; F76-E81 HydrophobicContact CB-CG 4.18Å; F76-E81 HydrophobicContact CD2-CB 4.27Å; F76-E81 HydrophobicContact CD2-CG 3.84Å; F76-E81 HydrophobicContact CG-CG 4.34Å; F76-L163 HydrophobicContact CE2-CD2 4.33Å; F76-I167 HydrophobicContact CB-CG2 4.42Å; F76-I167 HydrophobicContact CD1-CD1 3.55Å; F76-I167 HydrophobicContact CD1-CG1 4.25Å; F76-I167 HydrophobicContact CD1-CG2 4.24Å; F76-I167 HydrophobicContact CD2-CD1 3.84Å; F76-I167 HydrophobicContact CD2-CG1 4.32Å; F76-I167 HydrophobicContact CE1-CD1 3.46Å; F76-I167 VanDerWaalsContact CE1-CD1 3.46Å; F76-I167 HydrophobicContact CE2-CD1 3.77Å; F76-I167 HydrophobicContact CG-CD1 3.75Å; F76-I167 HydrophobicContact CG-CG1 4.11Å; F76-I167 HydrophobicContact CG-CG2 4.49Å; F76-I167 HydrophobicContact CZ-CD1 3.58Å
77S92.8Very high81.7Confident61 Ų6170 Ų7043%0.42738%0.378SS..EExtended strand (participates in β ladder)trans-85.8131.2169-620000109.1F79 P80 E81S77-F79 PolarHBondContact O-N 3.11Å; S77-P80 WeakPolarHBondContact O-CD 3.37Å; S77-E81 WeakPolarHBondContact O-CG 3.35Å
78V90.4Very high82.5Confident0 Ų073.7 Ų73.70%040%0.4CS..Hα-helixtrans-65.2-42.8-172.9174.70000111.1M55 F58 F76 E81 L82M55-V78 HydrophobicContact CE-CG1 3.87Å; M55-V78 HydrophobicContact CE-CG2 4.29Å; F58-V78 WeakPolarHBondContact O-CB 3.25Å; F58-V78 PolarHBondContact O-N 2.82Å; F76-V78 HydrophobicContact CE2-CG2 4.12Å; V78-E81 PolarHBondContact O-N 3.48Å; V78-L82 HydrophobicContact CG1-CD1 3.61Å; V78-L82 HydrophobicContact CG1-CD2 4.06Å; V78-L82 HydrophobicContact CG1-CG 4.41Å; V78-L82 WeakPolarHBondContact O-CB 3.25Å; V78-L82 VanDerWaalsContact O-CD1 3.31Å; V78-L82 WeakPolarHBondContact O-CD1 3.43Å; V78-L82 PolarHBondContact O-N 3.47Å
79F89.1Confident83.9Confident99 Ų9971.2 Ų71.243%0.43438%0.384SS..Hα-helixtrans-63.7-51.4-174.5-68.6-72.1000115.3F58 S77 E81 L82 L83 L97F58-F79 HydrophobicContact CD1-CD2 4.36Å; F58-F79 AromaticContact CD1-CE2 3.49Å; F58-F79 HydrophobicContact CD1-CE2 3.49Å; F58-F79 VanDerWaalsContact CD1-CE2 3.49Å; F58-F79 HydrophobicContact CD1-CZ 4.11Å; F58-F79 AromaticContact CE1-CE2 3.81Å; F58-F79 HydrophobicContact CE1-CE2 3.81Å; F58-F79 HydrophobicContact CE1-CZ 4.04Å; S77-F79 PolarHBondContact O-N 3.11Å; F79-E81 PolarHBondContact O-N 2.88Å; F79-L82 PolarHBondContact O-N 2.98Å; F79-L83 WeakPolarHBondContact O-CG 3.47Å; F79-L83 PolarHBondContact O-N 3.34Å; F79-L83 VanDerWaalsContact O-N 3.1Å; F79-L97 HydrophobicContact CE1-CD1 3.47Å; F79-L97 VanDerWaalsContact CE1-CD1 3.47Å; F79-L97 HydrophobicContact CE2-CD1 4.34Å; F79-L97 HydrophobicContact CZ-CD1 3.27Å
80P89.6Confident85.4Confident66 Ų6670.2 Ų70.243%0.42937%0.373SS..Hα-helixtrans-59.3-36.8178.8-24.835.6000112.8S77 L83S77-P80 WeakPolarHBondContact O-CD 3.37Å; P80-L83 WeakPolarHBondContact O-CB 3.4Å; P80-L83 PolarHBondContact O-N 3.48Å
81E88.4Confident87.3Confident23 Ų2365.4 Ų65.411%0.10736%0.359CS..Hα-helixtrans-73.9-37.7179.1-58.9-55.1148.200111.7F76 S77 V78 F79 L83 R84 L163 I167F76-E81 HydrophobicContact CB-CG 4.18Å; F76-E81 HydrophobicContact CD2-CB 4.27Å; F76-E81 HydrophobicContact CD2-CG 3.84Å; F76-E81 HydrophobicContact CG-CG 4.34Å; S77-E81 WeakPolarHBondContact O-CG 3.35Å; V78-E81 PolarHBondContact O-N 3.48Å; F79-E81 PolarHBondContact O-N 2.88Å; E81-L83 PolarHBondContact O-N 2.99Å; E81-R84 WeakPolarHBondContact O-CB 3.44Å; E81-R84 PolarHBondContact O-N 3.47Å; E81-R84 IonicContact OE1-CZ 3.7Å; E81-R84 IonicContact OE1-NH1 2.87Å; E81-R84 PolarHBondContact OE1-NH1 3.29Å; E81-R84 IonicContact OE2-CZ 3.99Å; E81-R84 IonicContact OE2-NE 2.75Å; E81-R84 IonicContact OE2-NH1 3.61Å; E81-R84 PolarHBondContact OE2-NH1 3.26Å; E81-L163 HydrophobicContact CB-CD2 3.62Å; E81-I167 HydrophobicContact CB-CG1 4.38Å; E81-I167 HydrophobicContact CG-CG1 3.94Å
82L87.8Confident88.9Confident4 Ų465.3 Ų65.32%0.02135%0.347CS..Hα-helixtrans-62.9-22171.3-98.763.7000113.1V78 F79 R84 I85 R90 H93 L163V78-L82 HydrophobicContact CG1-CD1 3.61Å; V78-L82 HydrophobicContact CG1-CD2 4.06Å; V78-L82 HydrophobicContact CG1-CG 4.41Å; V78-L82 WeakPolarHBondContact O-CB 3.25Å; V78-L82 VanDerWaalsContact O-CD1 3.31Å; V78-L82 WeakPolarHBondContact O-CD1 3.43Å; V78-L82 PolarHBondContact O-N 3.47Å; F79-L82 PolarHBondContact O-N 2.98Å; L82-R84 VanDerWaalsContact C-N 3.3Å; L82-I85 HydrophobicContact CD1-CD1 4.28Å; L82-I85 HydrophobicContact CG-CD1 4.06Å; L82-I85 WeakPolarHBondContact O-CG1 2.88Å; L82-R90 HydrophobicContact CB-CG 4.49Å; L82-R90 PolarHBondContact O-NE 3.07Å; L82-R90 PolarHBondContact O-NH2 3.16Å; L82-H93 HydrophobicContact CD2-CB 3.61Å; L82-L163 HydrophobicContact CD1-CD1 3.93Å; L82-L163 HydrophobicContact CD1-CD2 4.11Å; L82-L163 HydrophobicContact CD1-CG 4.47Å
83L88.8Confident89.6Confident111 Ų11163.7 Ų63.758%0.58134%0.335SS*.THydrogen-bonded Turntrans-75.8-18.1174.7-70.2174.5000113.3F79 P80 E81 R90F79-L83 WeakPolarHBondContact O-CG 3.47Å; F79-L83 PolarHBondContact O-N 3.34Å; F79-L83 VanDerWaalsContact O-N 3.1Å; P80-L83 WeakPolarHBondContact O-CB 3.4Å; P80-L83 PolarHBondContact O-N 3.48Å; E81-L83 PolarHBondContact O-N 2.99Å; L83-R90 VanDerWaalsContact CA-CZ 3.45Å; L83-R90 PolarHBondContact O-NH2 3.17Å
84R85.8Confident90Very high157 Ų15759.3 Ų59.359%0.59232%0.324SS*.THydrogen-bonded Turntrans-89.2-18.5179.5-64.5-179.9177.7152.41.6113.6E81 L82E81-R84 WeakPolarHBondContact O-CB 3.44Å; E81-R84 PolarHBondContact O-N 3.47Å; E81-R84 IonicContact OE1-CZ 3.7Å; E81-R84 IonicContact OE1-NH1 2.87Å; E81-R84 PolarHBondContact OE1-NH1 3.29Å; E81-R84 IonicContact OE2-CZ 3.99Å; E81-R84 IonicContact OE2-NE 2.75Å; E81-R84 IonicContact OE2-NH1 3.61Å; E81-R84 PolarHBondContact OE2-NH1 3.26Å; L82-R84 VanDerWaalsContact C-N 3.3Å
85I85.9Confident90.4Very high16 Ų1660.9 Ų60.98%0.08233%0.332CS..SBendtrans-99.2-177.3-177.570.1174.3000112.5L82 P89 R90 M159 E162 L163L82-I85 HydrophobicContact CD1-CD1 4.28Å; L82-I85 HydrophobicContact CG-CD1 4.06Å; L82-I85 WeakPolarHBondContact O-CG1 2.88Å; I85-P89 HydrophobicContact CD1-CB 4.32Å; I85-P89 HydrophobicContact CD1-CG 3.8Å; I85-P89 HydrophobicContact CG1-CG 4.28Å; I85-R90 PolarHBondContact O-NH2 3Å; I85-M159 HydrophobicContact CD1-CG 4.09Å; I85-E162 HydrophobicContact CB-CB 4.14Å; I85-E162 WeakPolarHBondContact CB-OE2 3.25Å; I85-E162 HydrophobicContact CG2-CB 3.79Å; I85-L163 HydrophobicContact CD1-CD1 4.32Å; I85-L163 HydrophobicContact CD1-CG 4.2Å; I85-L163 HydrophobicContact CG2-CG 4.4Å
86E84.4Confident90.6Very high105 Ų10555.7 Ų55.749%0.49130%0.295SS..  trans-51.2153.6176.6-76.9-171.3167.100114.7P89 E162E86-P89 HydrophobicContact CB-CG 4.18Å; E86-P89 WeakPolarHBondContact O-CD 3.36Å; E86-P89 WeakPolarHBondContact O-CG 3.22Å; E86-E162 WeakPolarHBondContact CG-OE1 3.46Å; E86-E162 WeakPolarHBondContact CG-OE2 3.45Å; E86-E162 PolarHBondContact N-OE2 3.31Å; E86-E162 VanDerWaalsContact N-OE2 3.12Å
87V88.9Confident90.9Very high98 Ų9856 Ų5659%0.59430%0.298SS*.Hα-helixtrans-70.5-36.5-176.8-177.70000112R90 V91V87-R90 WeakPolarHBondContact O-CB 3.33Å; V87-R90 PolarHBondContact O-N 3.41Å; V87-V91 HydrophobicContact CG1-CG2 3.91Å; V87-V91 WeakPolarHBondContact O-CG2 3.19Å; V87-V91 PolarHBondContact O-N 3.39Å
88T89.8Confident91.1Very high81 Ų8155.4 Ų55.450%0.49730%0.301SS..Hα-helixtrans-57.9-56.2-176.2-53.40000113.3R90 V91 L92 T157T88-R90 PolarHBondContact O-N 3.24Å; T88-V91 PolarHBondContact O-N 2.9Å; T88-L92 HydrophobicContact CG2-CD1 4.27Å; T88-L92 WeakPolarHBondContact O-CG 3.48Å; T88-L92 PolarHBondContact O-N 2.9Å; T88-L92 VanDerWaalsContact O-N 3.1Å; T88-T157 HydrophobicContact CG2-CG2 4.25Å
89P90Very high91.4Very high1 Ų156.7 Ų56.71%0.00631%0.307CS..Hα-helixtrans-64.2-31.5-179.225.3-35.6000113.2I85 E86 H93 N153 T157 M159I85-P89 HydrophobicContact CD1-CB 4.32Å; I85-P89 HydrophobicContact CD1-CG 3.8Å; I85-P89 HydrophobicContact CG1-CG 4.28Å; E86-P89 HydrophobicContact CB-CG 4.18Å; E86-P89 WeakPolarHBondContact O-CD 3.36Å; E86-P89 WeakPolarHBondContact O-CG 3.22Å; P89-H93 WeakPolarHBondContact O-CB 3.31Å; P89-H93 PolarHBondContact O-N 3.38Å; P89-N153 WeakPolarHBondContact CA-OD1 3.5Å; P89-N153 PolarHBondContact O-ND2 2.78Å; P89-T157 HydrophobicContact CB-CG2 4.47Å; P89-M159 HydrophobicContact CB-CB 3.65Å; P89-M159 HydrophobicContact CB-CG 3.85Å; P89-M159 HydrophobicContact CB-SD 3.95Å; P89-M159 HydrophobicContact CG-CB 4.34Å
90R91.7Very high91.8Very high76 Ų7652 Ų5229%0.28729%0.287SS..Hα-helixtrans-63.3-47.6174.9-178.2-165.4-51.8-172.28.4112.1L82 L83 I85 V87 T88 H93 G94L82-R90 HydrophobicContact CB-CG 4.49Å; L82-R90 PolarHBondContact O-NE 3.07Å; L82-R90 PolarHBondContact O-NH2 3.16Å; L83-R90 VanDerWaalsContact CA-CZ 3.45Å; L83-R90 PolarHBondContact O-NH2 3.17Å; I85-R90 PolarHBondContact O-NH2 3Å; V87-R90 WeakPolarHBondContact O-CB 3.33Å; V87-R90 PolarHBondContact O-N 3.41Å; T88-R90 PolarHBondContact O-N 3.24Å; R90-H93 PolarHBondContact O-N 2.98Å; R90-G94 PolarHBondContact O-N 3.37Å
91V93.2Very high92.1Very high87 Ų8750.2 Ų50.253%0.52728%0.28SS..Hα-helixtrans-65.9-43-179.9172.50000110.8V87 T88 G94 L95V87-V91 HydrophobicContact CG1-CG2 3.91Å; V87-V91 WeakPolarHBondContact O-CG2 3.19Å; V87-V91 PolarHBondContact O-N 3.39Å; T88-V91 PolarHBondContact O-N 2.9Å; V91-G94 PolarHBondContact O-N 3.31Å; V91-L95 WeakPolarHBondContact O-CB 3.43Å; V91-L95 PolarHBondContact O-N 2.96Å
92L94.1Very high92.5Very high49 Ų4952.6 Ų52.626%0.25729%0.294SS..Hα-helixtrans-64.3-42178.2-67.5175.9000112.1T88 L95 C96 I149 N153 T157T88-L92 HydrophobicContact CG2-CD1 4.27Å; T88-L92 WeakPolarHBondContact O-CG 3.48Å; T88-L92 PolarHBondContact O-N 2.9Å; T88-L92 VanDerWaalsContact O-N 3.1Å; L92-L95 PolarHBondContact O-N 3.42Å; L92-C96 PolarHBondContact O-N 3.3Å; L92-C96 PolarHBondContact O-SG 3.29Å; L92-I149 HydrophobicContact CB-CG2 4.27Å; L92-I149 HydrophobicContact CD2-CG2 4.11Å; L92-N153 HydrophobicContact CB-CB 4.09Å; L92-N153 HydrophobicContact CD1-CB 4.12Å; L92-T157 HydrophobicContact CD1-CG2 4.11Å
93H94.1Very high93Very high1 Ų152.4 Ų52.41%0.00529%0.293CS..Hα-helixtrans-64.7-43174.6-167.174.8000111.9L57 L82 P89 R90 L95 C96 L97L57-H93 PolarHBondContact O-NE2 2.63Å; L82-H93 HydrophobicContact CD2-CB 3.61Å; P89-H93 WeakPolarHBondContact O-CB 3.31Å; P89-H93 PolarHBondContact O-N 3.38Å; R90-H93 PolarHBondContact O-N 2.98Å; H93-L95 VanDerWaalsContact C-N 3.33Å; H93-L95 PolarHBondContact O-N 2.76Å; H93-C96 WeakPolarHBondContact O-CB 3.46Å; H93-C96 PolarHBondContact O-N 2.86Å; H93-L97 WeakPolarHBondContact O-CG 3.42Å; H93-L97 PolarHBondContact O-N 2.99Å; H93-L97 VanDerWaalsContact O-N 3.08Å
94G94.3Very high93.3Very high34 Ų3451.4 Ų51.435%0.35128%0.284SS..Hα-helixtrans-60.7-40.5174.300000112.9R90 V91 L97 G98R90-G94 PolarHBondContact O-N 3.37Å; V91-G94 PolarHBondContact O-N 3.31Å; G94-L97 PolarHBondContact O-N 2.94Å; G94-G98 PolarHBondContact O-N 3.4Å
95L96.6Very high93.8Very high84 Ų8449.7 Ų49.744%0.4429%0.286SS..Hα-helixtrans-63-43.4175.3-179.861000111.5V91 L92 H93 L97 G98 L99 I149V91-L95 WeakPolarHBondContact O-CB 3.43Å; V91-L95 PolarHBondContact O-N 2.96Å; L92-L95 PolarHBondContact O-N 3.42Å; H93-L95 VanDerWaalsContact C-N 3.33Å; H93-L95 PolarHBondContact O-N 2.76Å; L95-L97 VanDerWaalsContact C-N 3.32Å; L95-L97 PolarHBondContact O-N 2.64Å; L95-G98 PolarHBondContact O-N 3.23Å; L95-L99 HydrophobicContact CD1-CD1 4.31Å; L95-L99 HydrophobicContact CD1-CG 4.25Å; L95-L99 HydrophobicContact CG-CD1 4.16Å; L95-L99 WeakPolarHBondContact O-CB 3.48Å; L95-L99 WeakPolarHBondContact O-CG 3.43Å; L95-L99 PolarHBondContact O-N 3.17Å; L95-I149 HydrophobicContact CD2-CD1 3.86Å; L95-I149 HydrophobicContact CG-CD1 4.25Å
96C96.2Very high94.3Very high0 Ų049.6 Ų49.60%029%0.286CS..Hα-helixtrans-56.1-46.7173.1-74.90000111.6L92 H93 L99 L100 V146 I149L92-C96 PolarHBondContact O-N 3.3Å; L92-C96 PolarHBondContact O-SG 3.29Å; H93-C96 WeakPolarHBondContact O-CB 3.46Å; H93-C96 PolarHBondContact O-N 2.86Å; C96-L99 PolarHBondContact O-N 2.93Å; C96-L100 WeakPolarHBondContact O-CB 3.25Å; C96-L100 VanDerWaalsContact O-CG 3.25Å; C96-L100 WeakPolarHBondContact O-CG 3.34Å; C96-L100 PolarHBondContact O-N 3.24Å; C96-V146 HydrophobicContact CB-CG1 4.31Å; C96-I149 WeakPolarHBondContact SG-CG2 3.46Å
97L96.2Very high94.8Very high24 Ų2444.7 Ų44.713%0.12626%0.263CS..Hα-helixtrans-65.3-40.5178.8-67.2176.6000112.8L57 F58 F79 H93 G94 L95 L100 G101L57-L97 HydrophobicContact CB-CD2 3.97Å; L57-L97 HydrophobicContact CD1-CD2 4.01Å; L57-L97 HydrophobicContact CD2-CD2 3.86Å; L57-L97 HydrophobicContact CG-CD2 4.16Å; F58-L97 HydrophobicContact CE1-CD1 4.27Å; F58-L97 HydrophobicContact CE1-CD2 4.05Å; F58-L97 HydrophobicContact CZ-CD2 3.98Å; F79-L97 HydrophobicContact CE1-CD1 3.47Å; F79-L97 VanDerWaalsContact CE1-CD1 3.47Å; F79-L97 HydrophobicContact CE2-CD1 4.34Å; F79-L97 HydrophobicContact CZ-CD1 3.27Å; H93-L97 WeakPolarHBondContact O-CG 3.42Å; H93-L97 PolarHBondContact O-N 2.99Å; H93-L97 VanDerWaalsContact O-N 3.08Å; G94-L97 PolarHBondContact O-N 2.94Å; L95-L97 VanDerWaalsContact C-N 3.32Å; L95-L97 PolarHBondContact O-N 2.64Å; L97-L100 HydrophobicContact CD2-CD1 4.48Å; L97-L100 PolarHBondContact O-N 2.7Å; L97-G101 PolarHBondContact O-N 3.31Å
98G96.9Very high95.1Very high47 Ų4741.7 Ų41.749%0.48525%0.249SC..Hα-helixtrans-61.7-44.7175.200000112.2G94 L95 G101 L102G94-G98 PolarHBondContact O-N 3.4Å; L95-G98 PolarHBondContact O-N 3.23Å; G98-G101 PolarHBondContact O-N 3.41Å; G98-L102 PolarHBondContact O-N 3.28Å
99L97.5Very high95.3Very high27 Ų2741.9 Ų41.914%0.14125%0.246CC..Hα-helixtrans-65.7-38.8176.1-70.7173000112.3L95 C96 L102 C103 L145 V146 I149L95-L99 HydrophobicContact CD1-CD1 4.31Å; L95-L99 HydrophobicContact CD1-CG 4.25Å; L95-L99 HydrophobicContact CG-CD1 4.16Å; L95-L99 WeakPolarHBondContact O-CB 3.48Å; L95-L99 WeakPolarHBondContact O-CG 3.43Å; L95-L99 PolarHBondContact O-N 3.17Å; C96-L99 PolarHBondContact O-N 2.93Å; L99-L102 WeakPolarHBondContact O-CB 3.41Å; L99-L102 PolarHBondContact O-N 3.17Å; L99-C103 PolarHBondContact O-N 2.76Å; L99-C103 PolarHBondContact O-SG 2.77Å; L99-L145 HydrophobicContact CD1-CB 4.06Å; L99-V146 HydrophobicContact CB-CG2 3.44Å; L99-V146 VanDerWaalsContact CB-CG2 3.44Å; L99-V146 HydrophobicContact CD1-CG2 4.09Å; L99-V146 HydrophobicContact CG-CG2 4.43Å; L99-I149 HydrophobicContact CD1-CD1 3.77Å
100L97.1Very high95.5Very high0 Ų041.8 Ų41.80%025%0.246CC..Hα-helixtrans-64.4-40.8173.2-73.3169000111.9L24 M28 W32 L57 C96 L97 L102 C103 F104 V146 L191L24-L100 HydrophobicContact CD1-CD2 3.74Å; M28-L100 HydrophobicContact CE-CB 4.38Å; M28-L100 HydrophobicContact CG-CD1 4.49Å; M28-L100 HydrophobicContact SD-CB 4.39Å; W32-L100 HydrophobicContact CH2-CD1 3.79Å; W32-L100 HydrophobicContact CH2-CD2 4.16Å; W32-L100 HydrophobicContact CZ2-CD1 4.13Å; L57-L100 HydrophobicContact CD1-CD1 3.65Å; L57-L100 HydrophobicContact CD2-CD1 4.12Å; C96-L100 WeakPolarHBondContact O-CB 3.25Å; C96-L100 VanDerWaalsContact O-CG 3.25Å; C96-L100 WeakPolarHBondContact O-CG 3.34Å; C96-L100 PolarHBondContact O-N 3.24Å; L97-L100 HydrophobicContact CD2-CD1 4.48Å; L97-L100 PolarHBondContact O-N 2.7Å; L100-L102 VanDerWaalsContact C-N 3.32Å; L100-L102 PolarHBondContact O-N 3.3Å; L100-C103 VanDerWaalsContact O-CB 3.31Å; L100-C103 WeakPolarHBondContact O-CB 3.42Å; L100-C103 PolarHBondContact O-N 2.93Å; L100-F104 PolarHBondContact O-N 2.91Å; L100-V146 HydrophobicContact CD1-CG1 4.2Å; L100-V146 HydrophobicContact CD2-CG1 4.05Å; L100-V146 HydrophobicContact CD2-CG2 4.28Å; L100-V146 HydrophobicContact CG-CG1 4Å; L100-V146 HydrophobicContact CG-CG2 4Å; L100-L191 HydrophobicContact CD2-CD1 4.14Å; L100-L191 HydrophobicContact CD2-CD2 4Å; L100-L191 HydrophobicContact CD2-CG 4.44Å
101G97.1Very high95.6Very high29 Ų2939.6 Ų39.630%0.29924%0.239SC..Hα-helixtrans-60.7-42.4172.300000111.9L97 G98 F104 L105L97-G101 PolarHBondContact O-N 3.31Å; G98-G101 PolarHBondContact O-N 3.41Å; G101-F104 WeakPolarHBondContact O-CB 3.26Å; G101-F104 PolarHBondContact O-N 3.47Å; G101-L105 WeakPolarHBondContact O-CG 3.36Å; G101-L105 PolarHBondContact O-N 3.1Å
102L96.9Very high95.6Very high74 Ų7440.9 Ų40.939%0.38724%0.242SC..Hα-helixtrans-62.5-41.8173.9-176.464.6000111.9G98 L99 L100 F104 L105 T106 I138G98-L102 PolarHBondContact O-N 3.28Å; L99-L102 WeakPolarHBondContact O-CB 3.41Å; L99-L102 PolarHBondContact O-N 3.17Å; L100-L102 VanDerWaalsContact C-N 3.32Å; L100-L102 PolarHBondContact O-N 3.3Å; L102-F104 VanDerWaalsContact C-N 3.3Å; L102-F104 PolarHBondContact O-N 2.82Å; L102-L105 PolarHBondContact O-N 3.16Å; L102-T106 HydrophobicContact CD1-CG2 3.89Å; L102-T106 HydrophobicContact CG-CG2 4.24Å; L102-T106 WeakPolarHBondContact O-CB 3.46Å; L102-T106 WeakPolarHBondContact O-CG2 3.27Å; L102-T106 PolarHBondContact O-N 3.29Å; L102-T106 PolarHBondContact O-OG1 3.09Å; L102-I138 HydrophobicContact CD2-CG2 3.93Å; L102-I138 HydrophobicContact CG-CG2 4.14Å
103C96.8Very high95.4Very high0 Ų039 Ų390%023%0.233CC..Hα-helixtrans-55.8-47.1173.5-66.40000110.8L24 L99 L100 T106 S107 S139 S142 Y194L24-C103 HydrophobicContact CD2-CB 3.75Å; L99-C103 PolarHBondContact O-N 2.76Å; L99-C103 PolarHBondContact O-SG 2.77Å; L100-C103 VanDerWaalsContact O-CB 3.31Å; L100-C103 WeakPolarHBondContact O-CB 3.42Å; L100-C103 PolarHBondContact O-N 2.93Å; C103-T106 PolarHBondContact O-OG1 3.16Å; C103-S107 WeakPolarHBondContact O-CB 3.42Å; C103-S107 PolarHBondContact O-N 2.84Å; C103-S107 PolarHBondContact O-OG 3.24Å; C103-S139 PolarHBondContact SG-O 2.97Å; C103-S142 PolarHBondContact SG-OG 2.68Å; C103-Y194 HydrophobicContact CB-CE1 4.28Å; C103-Y194 WeakPolarHBondContact CB-OH 3.46Å; C103-Y194 PolarHBondContact O-OH 3.03Å
104F95.6Very high95.3Very high90 Ų9039 Ų3940%0.39523%0.233SC..Hα-helixtrans-62.6-49.3-178.9-166.5-84.3000111.6I21 L24 L100 G101 L102 S107 A108I21-F104 HydrophobicContact CG2-CD2 4.02Å; I21-F104 HydrophobicContact CG2-CE2 3.54Å; I21-F104 HydrophobicContact CG2-CZ 3.94Å; L24-F104 HydrophobicContact CD2-CB 4.14Å; L24-F104 HydrophobicContact CD2-CD2 4.3Å; L100-F104 PolarHBondContact O-N 2.91Å; G101-F104 WeakPolarHBondContact O-CB 3.26Å; G101-F104 PolarHBondContact O-N 3.47Å; L102-F104 VanDerWaalsContact C-N 3.3Å; L102-F104 PolarHBondContact O-N 2.82Å; F104-S107 PolarHBondContact O-N 2.98Å; F104-A108 WeakPolarHBondContact O-CB 3.28Å; F104-A108 PolarHBondContact O-N 3.48Å
105L96.6Very high95.1Very high121 Ų12141 Ų4163%0.63424%0.235SC*.Hα-helixtrans-64.5-46.6-179.4-68.9174.2000112.6G101 L102 A108 L109G101-L105 WeakPolarHBondContact O-CG 3.36Å; G101-L105 PolarHBondContact O-N 3.1Å; L102-L105 PolarHBondContact O-N 3.16Å; L105-A108 PolarHBondContact O-N 3.45Å; L105-L109 PolarHBondContact O-N 3.41Å
106T95.6Very high94.8Very high14 Ų1442.7 Ų42.79%0.08624%0.237CC..Hα-helixtrans-67.2-37.5179.751.60000111.7L102 C103 L109 S110 C135 I138 S139L102-T106 HydrophobicContact CD1-CG2 3.89Å; L102-T106 HydrophobicContact CG-CG2 4.24Å; L102-T106 WeakPolarHBondContact O-CB 3.46Å; L102-T106 WeakPolarHBondContact O-CG2 3.27Å; L102-T106 PolarHBondContact O-N 3.29Å; L102-T106 PolarHBondContact O-OG1 3.09Å; C103-T106 PolarHBondContact O-OG1 3.16Å; T106-L109 PolarHBondContact O-N 3.48Å; T106-S110 PolarHBondContact O-N 3.02Å; T106-C135 WeakPolarHBondContact O-CB 3.48Å; T106-I138 HydrophobicContact CG2-CB 4.3Å; T106-I138 HydrophobicContact CG2-CG2 3.88Å; T106-S139 VanDerWaalsContact OG1-CB 3.28Å; T106-S139 WeakPolarHBondContact OG1-CB 3.49Å
107S95.4Very high94.4Very high2 Ų242.7 Ų42.71%0.01424%0.237CC..Hα-helixtrans-65.2-41.1173.8-55.90000111.6I21 C103 F104 L109 S110 I111 Y194I21-S107 VanDerWaalsContact CD1-C 3.45Å; I21-S107 VanDerWaalsContact CD1-CB 3.44Å; C103-S107 WeakPolarHBondContact O-CB 3.42Å; C103-S107 PolarHBondContact O-N 2.84Å; C103-S107 PolarHBondContact O-OG 3.24Å; F104-S107 PolarHBondContact O-N 2.98Å; S107-L109 VanDerWaalsContact C-N 3.33Å; S107-L109 PolarHBondContact O-N 2.89Å; S107-S110 WeakPolarHBondContact O-CB 3.39Å; S107-S110 PolarHBondContact O-N 3.44Å; S107-I111 PolarHBondContact O-N 3.05Å; S107-Y194 PolarHBondContact OG-OH 3.06Å
108A95.4Very high93.9Very high35 Ų3541.8 Ų41.829%0.28923%0.232SC..Hα-helixtrans-63-41.3176.200000111.5I21 F104 L105 S110 I111 L112I21-A108 HydrophobicContact CD1-CB 4.19Å; F104-A108 WeakPolarHBondContact O-CB 3.28Å; F104-A108 PolarHBondContact O-N 3.48Å; L105-A108 PolarHBondContact O-N 3.45Å; A108-S110 VanDerWaalsContact C-N 3.33Å; A108-S110 PolarHBondContact O-N 3.32Å; A108-I111 WeakPolarHBondContact O-CB 3.3Å; A108-I111 PolarHBondContact O-N 2.86Å; A108-L112 WeakPolarHBondContact O-CG 3.46Å; A108-L112 PolarHBondContact O-N 2.88Å
109L94.4Very high93.4Very high84 Ų8445 Ų4544%0.4424%0.243SC..Hα-helixtrans-62.7-39.9173.6-172.859000111.7L105 T106 S107 I111 L112 V113 C135L105-L109 PolarHBondContact O-N 3.41Å; T106-L109 PolarHBondContact O-N 3.48Å; S107-L109 VanDerWaalsContact C-N 3.33Å; S107-L109 PolarHBondContact O-N 2.89Å; L109-I111 VanDerWaalsContact C-N 3.32Å; L109-I111 PolarHBondContact O-N 3.35Å; L109-L112 PolarHBondContact O-N 2.97Å; L109-V113 HydrophobicContact CD1-CG2 4.38Å; L109-V113 HydrophobicContact CG-CG2 4.43Å; L109-V113 VanDerWaalsContact O-CG2 3.31Å; L109-V113 WeakPolarHBondContact O-CG2 3.42Å; L109-V113 PolarHBondContact O-N 3.34Å; L109-C135 VanDerWaalsContact CD2-SG 3.58Å
110S93.6Very high92.6Very high0 Ų044.3 Ų44.30%024%0.24CC..Hα-helixtrans-60.1-40.1175.4-166.10000112.4T106 S107 A108 S114 S136T106-S110 PolarHBondContact O-N 3.02Å; S107-S110 WeakPolarHBondContact O-CB 3.39Å; S107-S110 PolarHBondContact O-N 3.44Å; A108-S110 VanDerWaalsContact C-N 3.33Å; A108-S110 PolarHBondContact O-N 3.32Å; S110-S114 VanDerWaalsContact O-CB 3.25Å; S110-S114 WeakPolarHBondContact O-CB 3.31Å; S110-S114 PolarHBondContact O-N 3.42Å; S110-S114 PolarHBondContact O-OG 3.35Å; S110-S136 PolarHBondContact OG-OG 3.2Å
111I94.2Very high91.3Very high30 Ų3048.1 Ų48.115%0.15426%0.26CS..Hα-helixtrans-62.6-49.7173.1-66.4169.7000110.5T17 A18 I21 S107 A108 L109 V113 S114 L115T17-I111 WeakPolarHBondContact OG1-CG1 3.49Å; A18-I111 HydrophobicContact CB-CD1 4.02Å; I21-I111 HydrophobicContact CD1-CD1 3.35Å; I21-I111 HydrophobicContact CD1-CG1 4.34Å; I21-I111 HydrophobicContact CG1-CD1 4.35Å; S107-I111 PolarHBondContact O-N 3.05Å; A108-I111 WeakPolarHBondContact O-CB 3.3Å; A108-I111 PolarHBondContact O-N 2.86Å; L109-I111 VanDerWaalsContact C-N 3.32Å; L109-I111 PolarHBondContact O-N 3.35Å; I111-V113 PolarHBondContact O-N 3.48Å; I111-S114 PolarHBondContact O-N 2.81Å; I111-S114 VanDerWaalsContact O-N 3.16Å; I111-L115 HydrophobicContact CG2-CD1 3.71Å; I111-L115 HydrophobicContact CG2-CG 4.13Å; I111-L115 WeakPolarHBondContact O-CB 3.44Å; I111-L115 WeakPolarHBondContact O-CG 3.4Å; I111-L115 PolarHBondContact O-N 2.89Å
112L92.6Very high89.6Confident113 Ų11349 Ų4959%0.59226%0.261SS*.Hα-helixtrans-59.4-46.6-179-70.8173.4000111.6A108 L109 S114 L115 Y116A108-L112 WeakPolarHBondContact O-CG 3.46Å; A108-L112 PolarHBondContact O-N 2.88Å; L109-L112 PolarHBondContact O-N 2.97Å; L112-S114 VanDerWaalsContact C-N 3.33Å; L112-S114 PolarHBondContact O-N 3.49Å; L112-L115 PolarHBondContact O-N 3.29Å; L112-Y116 VanDerWaalsContact O-CB 3.26Å; L112-Y116 WeakPolarHBondContact O-CB 3.33Å; L112-Y116 PolarHBondContact O-N 3.09Å
113V90.9Very high87.6Confident11 Ų1155.5 Ų55.57%0.06728%0.282CS..Hα-helixtrans-62.1-42.4176.11730000110.6L109 I111 N117 V132L109-V113 HydrophobicContact CD1-CG2 4.38Å; L109-V113 HydrophobicContact CG-CG2 4.43Å; L109-V113 VanDerWaalsContact O-CG2 3.31Å; L109-V113 WeakPolarHBondContact O-CG2 3.42Å; L109-V113 PolarHBondContact O-N 3.34Å; I111-V113 PolarHBondContact O-N 3.48Å; V113-N117 VanDerWaalsContact CG1-ND2 3.31Å; V113-N117 WeakPolarHBondContact CG1-ND2 3.41Å; V113-N117 WeakPolarHBondContact O-CB 3.47Å; V113-N117 PolarHBondContact O-N 3.5Å; V113-N117 PolarHBondContact O-ND2 3.05Å; V113-V132 HydrophobicContact CG1-CG2 3.91Å
114S91.1Very high85.8Confident0 Ų062.1 Ų62.10%031%0.312CS..Hα-helixtrans-65.7-46179.5-62.60000112.1S13 S110 I111 L112 N117 S118 V132S13-S114 PolarHBondContact OG-OG 3.29Å; S110-S114 VanDerWaalsContact O-CB 3.25Å; S110-S114 WeakPolarHBondContact O-CB 3.31Å; S110-S114 PolarHBondContact O-N 3.42Å; S110-S114 PolarHBondContact O-OG 3.35Å; I111-S114 PolarHBondContact O-N 2.81Å; I111-S114 VanDerWaalsContact O-N 3.16Å; L112-S114 VanDerWaalsContact C-N 3.33Å; L112-S114 PolarHBondContact O-N 3.49Å; S114-N117 PolarHBondContact O-N 2.91Å; S114-S118 PolarHBondContact O-N 3.17Å; S114-V132 WeakPolarHBondContact OG-CG2 3.22Å
115L91.3Very high84.1Confident76 Ų7660.8 Ų60.840%0.39831%0.312SS..Hα-helixtrans-64.6-44.2177.1-69.9177000111.6L11 A14 I111 L112 N117 S118 V119L11-L115 HydrophobicContact CD2-CD2 4.01Å; A14-L115 HydrophobicContact CB-CD2 3.82Å; A14-L115 HydrophobicContact CB-CG 4.05Å; I111-L115 HydrophobicContact CG2-CD1 3.71Å; I111-L115 HydrophobicContact CG2-CG 4.13Å; I111-L115 WeakPolarHBondContact O-CB 3.44Å; I111-L115 WeakPolarHBondContact O-CG 3.4Å; I111-L115 PolarHBondContact O-N 2.89Å; L112-L115 PolarHBondContact O-N 3.29Å; L115-N117 PolarHBondContact O-N 3.33Å; L115-S118 WeakPolarHBondContact O-CB 3.43Å; L115-S118 PolarHBondContact O-N 3.44Å; L115-S118 VanDerWaalsContact O-N 3.17Å; L115-S118 PolarHBondContact O-OG 2.93Å; L115-V119 PolarHBondContact O-N 3.45Å
116Y89.3Confident82.1Confident119 Ų11962.7 Ų62.747%0.46731%0.312SS..Hα-helixtrans-58.2-49176.1-178.1-94.1000111.1L112 S118 V119 S120L112-Y116 VanDerWaalsContact O-CB 3.26Å; L112-Y116 WeakPolarHBondContact O-CB 3.33Å; L112-Y116 PolarHBondContact O-N 3.09Å; Y116-S118 PolarHBondContact O-N 3.49Å; Y116-V119 PolarHBondContact O-N 3.29Å; Y116-S120 VanDerWaalsContact O-CB 3.27Å; Y116-S120 WeakPolarHBondContact O-CB 3.35Å; Y116-S120 PolarHBondContact O-N 3.15Å; Y116-S120 PolarHBondContact O-OG 3.26Å
117N87.2Confident80.8Confident0 Ų067.2 Ų67.20%033%0.333CS..Hα-helixtrans-66.7-23179.4-76.4-55.3000113.6K6 F10 V113 S114 L115 V119 T125 G128K6-N117 WeakPolarHBondContact CE-O 3.39Å; K6-N117 PolarHBondContact NZ-O 2.87Å; F10-N117 HydrophobicContact CD1-CB 3.7Å; F10-N117 HydrophobicContact CD2-CB 4.22Å; F10-N117 HydrophobicContact CE1-CB 3.61Å; F10-N117 HydrophobicContact CE2-CB 4.16Å; F10-N117 HydrophobicContact CG-CB 4Å; F10-N117 HydrophobicContact CZ-CB 3.85Å; V113-N117 VanDerWaalsContact CG1-ND2 3.31Å; V113-N117 WeakPolarHBondContact CG1-ND2 3.41Å; V113-N117 WeakPolarHBondContact O-CB 3.47Å; V113-N117 PolarHBondContact O-N 3.5Å; V113-N117 PolarHBondContact O-ND2 3.05Å; S114-N117 PolarHBondContact O-N 2.91Å; L115-N117 PolarHBondContact O-N 3.33Å; N117-V119 VanDerWaalsContact C-N 3.35Å; N117-T125 WeakPolarHBondContact OD1-CB 3.31Å; N117-T125 WeakPolarHBondContact OD1-CG2 3.35Å; N117-G128 PolarHBondContact ND2-O 3.38Å
118S86.4Confident80Confident5 Ų567.3 Ų67.34%0.03533%0.334CS..Hα-helixtrans-69.6-31.2176.578.90000113.3T7 S114 L115 Y116T7-S118 PolarHBondContact OG1-O 3.37Å; S114-S118 PolarHBondContact O-N 3.17Å; L115-S118 WeakPolarHBondContact O-CB 3.43Å; L115-S118 PolarHBondContact O-N 3.44Å; L115-S118 VanDerWaalsContact O-N 3.17Å; L115-S118 PolarHBondContact O-OG 2.93Å; Y116-S118 PolarHBondContact O-N 3.49Å
119V85.9Confident79.5Confident115 Ų11566.7 Ų66.770%0.69733%0.327SS*.Hα-helixtrans-102-29.9-177.8-1750000111.7L115 Y116 N117L115-V119 PolarHBondContact O-N 3.45Å; Y116-V119 PolarHBondContact O-N 3.29Å; N117-V119 VanDerWaalsContact C-N 3.35Å
120S80.7Confident79.1Confident13 Ų1367.9 Ų67.99%0.09133%0.334CS..SBendtrans-68.5149.4-175.274.50000113.2K6 Y116 E124K6-S120 PolarHBondContact NZ-O 3.23Å; Y116-S120 VanDerWaalsContact O-CB 3.27Å; Y116-S120 WeakPolarHBondContact O-CB 3.35Å; Y116-S120 PolarHBondContact O-N 3.15Å; Y116-S120 PolarHBondContact O-OG 3.26Å; S120-E124 PolarHBondContact OG-O 3.27Å
121N70.4Confident78.8Confident79 Ų7967.9 Ų67.942%0.42233%0.334SS..  trans-65.2150.3177.6-135.21.3000110M1 Y123 E124M1-N121 PolarHBondContact N-OD1 2.94Å; N121-Y123 PolarHBondContact O-N 2.93Å; N121-E124 PolarHBondContact O-N 3.04Å; N121-E124 VanDerWaalsContact O-N 3.11Å
122P62.4Low78.7Confident47 Ų4766.4 Ų66.431%0.30533%0.327SS..THydrogen-bonded Turntrans-57.9-22.7-174.9-2332.1000115.4
123Y54.2Low78.6Confident212 Ų21263.1 Ų63.183%0.83131%0.306SS*.THydrogen-bonded Turntrans-96.9-6.1-175.9-56.2-73.3000113.6N121N121-Y123 PolarHBondContact O-N 2.93Å
124E58.1Low78.7Confident138 Ų13866 Ų6665%0.64533%0.325SS*.  trans-12557.2179.5-68.9-174.5166.200110.1S120 N121S120-E124 PolarHBondContact OG-O 3.27Å; N121-E124 PolarHBondContact O-N 3.04Å; N121-E124 VanDerWaalsContact O-N 3.11Å
125T61.4Low78.9Confident62 Ų6266.4 Ų66.438%0.3833%0.327SS..  trans-89.9109.617353.10000109.9N117 M127N117-T125 WeakPolarHBondContact OD1-CB 3.31Å; N117-T125 WeakPolarHBondContact OD1-CG2 3.35Å; T125-M127 PolarHBondContact O-N 2.92Å
126Y54.4Low79Confident162 Ų16262.9 Ų62.964%0.63531%0.309SS*.SBendtrans-70.7114.7166.3-170.4-97.3000108.5G128Y126-G128 PolarHBondContact O-N 3.1Å
127M67.3Low79.2Confident109 Ų10959.9 Ų59.954%0.53731%0.305SS..SBendtrans58.5-15.9-174.5-70.9-178.1147.400117.6T125 N130 G131T125-M127 PolarHBondContact O-N 2.92Å; M127-N130 WeakPolarHBondContact O-CB 3.42Å; M127-N130 PolarHBondContact O-N 2.97Å; M127-G131 PolarHBondContact O-N 3.45Å; M127-G131 VanDerWaalsContact O-N 3.13Å
128G78.8Confident79.6Confident3 Ų363.6 Ų63.63%0.03132%0.324CS..Hα-helixtrans51.4-143.4174.700000113.8N117 Y126 N130 G131N117-G128 PolarHBondContact ND2-O 3.38Å; Y126-G128 PolarHBondContact O-N 3.1Å; G128-N130 VanDerWaalsContact C-N 3.26Å; G128-N130 PolarHBondContact O-N 3.26Å; G128-G131 PolarHBondContact O-N 3.24Å
129P84.3Confident80Confident22 Ų2263.4 Ų63.414%0.14332%0.323CS..Hα-helixtrans-56.5-35.4173.2-27.436.6000114F10 G131 V132 Y133 V205 D209F10-P129 HydrophobicContact CZ-CG 4.43Å; P129-G131 VanDerWaalsContact C-N 3.28Å; P129-G131 PolarHBondContact O-N 3.4Å; P129-V132 PolarHBondContact O-N 3.04Å; P129-V132 VanDerWaalsContact O-N 3.09Å; P129-Y133 HydrophobicContact CB-CE2 3.82Å; P129-Y133 WeakPolarHBondContact O-CD2 3.49Å; P129-Y133 PolarHBondContact O-N 3.48Å; P129-V205 HydrophobicContact CB-CG1 3.68Å; P129-V205 HydrophobicContact CG-CG1 4.4Å; P129-D209 HydrophobicContact CG-CB 4.37Å
130N87.4Confident80.5Confident109 Ų10958.3 Ų58.358%0.58329%0.293SS*.Hα-helixtrans-63-33.1-176.4-65.4-16.6000112.7M127 G128 Y133 T134M127-N130 WeakPolarHBondContact O-CB 3.42Å; M127-N130 PolarHBondContact O-N 2.97Å; G128-N130 VanDerWaalsContact C-N 3.26Å; G128-N130 PolarHBondContact O-N 3.26Å; N130-Y133 PolarHBondContact O-N 3.06Å; N130-T134 WeakPolarHBondContact O-CB 3.45Å; N130-T134 WeakPolarHBondContact O-CG2 3.33Å; N130-T134 PolarHBondContact O-N 3.29Å; N130-T134 PolarHBondContact O-OG1 3.18Å
131G87.8Confident81.2Confident0 Ų064.2 Ų64.20%032%0.317CS..Hα-helixtrans-64.1-41.5175.100000112.1M127 G128 P129 T134 C135M127-G131 PolarHBondContact O-N 3.45Å; M127-G131 VanDerWaalsContact O-N 3.13Å; G128-G131 PolarHBondContact O-N 3.24Å; P129-G131 VanDerWaalsContact C-N 3.28Å; P129-G131 PolarHBondContact O-N 3.4Å; G131-T134 PolarHBondContact O-OG1 2.73Å; G131-T134 VanDerWaalsContact O-OG1 3.05Å; G131-C135 WeakPolarHBondContact O-CB 3.21Å; G131-C135 PolarHBondContact O-N 2.66Å; G131-C135 VanDerWaalsContact O-N 3.13Å; G131-C135 PolarHBondContact O-SG 3.28Å
132V90.5Very high82.5Confident0 Ų060.5 Ų60.50%030%0.297CS..Hα-helixtrans-68.9-41.5177.4-178.50000110.8F10 V113 S114 P129 S136 V205F10-V132 HydrophobicContact CE1-CG2 4.24Å; V113-V132 HydrophobicContact CG1-CG2 3.91Å; S114-V132 WeakPolarHBondContact OG-CG2 3.22Å; P129-V132 PolarHBondContact O-N 3.04Å; P129-V132 VanDerWaalsContact O-N 3.09Å; V132-S136 WeakPolarHBondContact O-CB 3.47Å; V132-S136 PolarHBondContact O-N 3.42Å; V132-S136 PolarHBondContact O-OG 2.83Å; V132-V205 HydrophobicContact CB-CG1 4.44Å; V132-V205 HydrophobicContact CB-CG2 4.23Å; V132-V205 HydrophobicContact CG1-CB 4.42Å; V132-V205 HydrophobicContact CG1-CG2 3.83Å; V132-V205 HydrophobicContact CG2-CG2 4.37Å
133Y92Very high84.1Confident43 Ų4358.3 Ų58.317%0.16928%0.283CS..Hα-helixtrans-61.2-49.7177.7-60.5-26.5000112.1P129 N130 S137 I202 V205 Y206P129-Y133 HydrophobicContact CB-CE2 3.82Å; P129-Y133 WeakPolarHBondContact O-CD2 3.49Å; P129-Y133 PolarHBondContact O-N 3.48Å; N130-Y133 PolarHBondContact O-N 3.06Å; Y133-S137 WeakPolarHBondContact O-CB 3.32Å; Y133-S137 PolarHBondContact O-N 2.83Å; Y133-S137 PolarHBondContact O-OG 3.32Å; Y133-I202 HydrophobicContact CD1-CG2 3.86Å; Y133-I202 HydrophobicContact CE1-CG2 4.23Å; Y133-V205 HydrophobicContact CD1-CG1 4.44Å; Y133-V205 HydrophobicContact CE1-CB 3.88Å; Y133-V205 HydrophobicContact CE1-CG1 3.67Å; Y133-V205 PolarHBondContact OH-O 3.29Å; Y133-Y206 WeakPolarHBondContact OH-CA 3.22Å; Y133-Y206 PolarHBondContact OH-N 3.19Å
134T93.1Very high86.1Confident73 Ų7351.4 Ų51.445%0.44826%0.263SS..Hα-helixtrans-63.9-51.1-17849.20000111.2N130 G131 S136 S137 I138N130-T134 WeakPolarHBondContact O-CB 3.45Å; N130-T134 WeakPolarHBondContact O-CG2 3.33Å; N130-T134 PolarHBondContact O-N 3.29Å; N130-T134 PolarHBondContact O-OG1 3.18Å; G131-T134 PolarHBondContact O-OG1 2.73Å; G131-T134 VanDerWaalsContact O-OG1 3.05Å; T134-S136 PolarHBondContact O-N 2.98Å; T134-S137 PolarHBondContact O-N 3.27Å; T134-I138 VanDerWaalsContact O-CG1 3.25Å; T134-I138 WeakPolarHBondContact O-CG1 3.29Å; T134-I138 PolarHBondContact O-N 3.48Å
135C93.6Very high88Confident8 Ų847.4 Ų47.45%0.05425%0.245CC..Hα-helixtrans-61.8-48-178.5-660000112.2T106 L109 G131 I138 S139T106-C135 WeakPolarHBondContact O-CB 3.48Å; L109-C135 VanDerWaalsContact CD2-SG 3.58Å; G131-C135 WeakPolarHBondContact O-CB 3.21Å; G131-C135 PolarHBondContact O-N 2.66Å; G131-C135 VanDerWaalsContact O-N 3.13Å; G131-C135 PolarHBondContact O-SG 3.28Å; C135-I138 PolarHBondContact O-N 2.91Å; C135-S139 WeakPolarHBondContact O-CB 3.28Å; C135-S139 PolarHBondContact O-N 2.85Å
136S93.8Very high89.7Confident1 Ų144.4 Ų44.41%0.00723%0.227CC..Hα-helixtrans-73.6-28.1-177.3-47.10000112.4S110 V132 T134 S139 A140S110-S136 PolarHBondContact OG-OG 3.2Å; V132-S136 WeakPolarHBondContact O-CB 3.47Å; V132-S136 PolarHBondContact O-N 3.42Å; V132-S136 PolarHBondContact O-OG 2.83Å; T134-S136 PolarHBondContact O-N 2.98Å; S136-S139 PolarHBondContact O-OG 3.42Å; S136-S139 VanDerWaalsContact O-OG 3.09Å; S136-A140 VanDerWaalsContact O-CB 3.29Å; S136-A140 WeakPolarHBondContact O-CB 3.47Å; S136-A140 PolarHBondContact O-N 2.99Å
137S94.1Very high91.7Very high56 Ų5637.7 Ų37.739%0.39220%0.202SC..Hα-helixtrans-71.7-43.8174.7-61.50000111.4Y133 T134 S139 A140 F141 I202Y133-S137 WeakPolarHBondContact O-CB 3.32Å; Y133-S137 PolarHBondContact O-N 2.83Å; Y133-S137 PolarHBondContact O-OG 3.32Å; T134-S137 PolarHBondContact O-N 3.27Å; S137-S139 VanDerWaalsContact C-N 3.3Å; S137-S139 PolarHBondContact O-N 3.41Å; S137-A140 PolarHBondContact O-N 3.4Å; S137-F141 VanDerWaalsContact O-CB 3.3Å; S137-F141 WeakPolarHBondContact O-CB 3.31Å; S137-F141 PolarHBondContact O-N 2.94Å; S137-I202 WeakPolarHBondContact OG-CD1 3.42Å
138I95.4Very high93Very high79 Ų7936.6 Ų36.641%0.40520%0.197SC..Hα-helixtrans-58.4-48.7174.7-68165.3000108.9L102 T106 T134 C135 A140 F141 S142L102-I138 HydrophobicContact CD2-CG2 3.93Å; L102-I138 HydrophobicContact CG-CG2 4.14Å; T106-I138 HydrophobicContact CG2-CB 4.3Å; T106-I138 HydrophobicContact CG2-CG2 3.88Å; T134-I138 VanDerWaalsContact O-CG1 3.25Å; T134-I138 WeakPolarHBondContact O-CG1 3.29Å; T134-I138 PolarHBondContact O-N 3.48Å; C135-I138 PolarHBondContact O-N 2.91Å; I138-A140 PolarHBondContact O-N 3.13Å; I138-F141 PolarHBondContact O-N 3.24Å; I138-S142 WeakPolarHBondContact O-CB 3.42Å; I138-S142 PolarHBondContact O-N 3.41Å; I138-S142 PolarHBondContact O-OG 3.44Å
139S95.1Very high93.9Very high0 Ų037.7 Ų37.70%020%0.203CC..Hα-helixtrans-62.2-44.5-177.990.80000112.6C103 T106 C135 S136 S137 S142 S143 Y194 S198C103-S139 PolarHBondContact SG-O 2.97Å; T106-S139 VanDerWaalsContact OG1-CB 3.28Å; T106-S139 WeakPolarHBondContact OG1-CB 3.49Å; C135-S139 WeakPolarHBondContact O-CB 3.28Å; C135-S139 PolarHBondContact O-N 2.85Å; S136-S139 PolarHBondContact O-OG 3.42Å; S136-S139 VanDerWaalsContact O-OG 3.09Å; S137-S139 VanDerWaalsContact C-N 3.3Å; S137-S139 PolarHBondContact O-N 3.41Å; S139-S142 WeakPolarHBondContact CA-OG 3.22Å; S139-S142 PolarHBondContact O-OG 2.93Å; S139-S142 VanDerWaalsContact O-OG 3.09Å; S139-S143 WeakPolarHBondContact O-CB 3.34Å; S139-S143 PolarHBondContact O-N 2.93Å; S139-S143 PolarHBondContact O-OG 3.19Å; S139-Y194 WeakPolarHBondContact CB-OH 3.38Å; S139-Y194 PolarHBondContact OG-OH 3.25Å; S139-S198 PolarHBondContact OG-OG 2.89Å
140A95.2Very high94.4Very high8 Ų836.8 Ų36.87%0.06620%0.196CC..Hα-helixtrans-62.9-48.7176.300000111.3S136 S137 I138 S143 V144 L199S136-A140 VanDerWaalsContact O-CB 3.29Å; S136-A140 WeakPolarHBondContact O-CB 3.47Å; S136-A140 PolarHBondContact O-N 2.99Å; S137-A140 PolarHBondContact O-N 3.4Å; I138-A140 PolarHBondContact O-N 3.13Å; A140-S143 PolarHBondContact O-N 2.87Å; A140-S143 PolarHBondContact O-OG 3.35Å; A140-V144 PolarHBondContact O-N 2.94Å; A140-L199 HydrophobicContact CB-CD2 4.09Å; A140-L199 HydrophobicContact CB-CG 4.35Å
141F96.5Very high94.7Very high137 Ų13733.2 Ų33.260%0.60118%0.178SC*.Hα-helixtrans-62.5-47.1179.6178.1-107.6000112.4S137 I138 S143 V144 L145S137-F141 VanDerWaalsContact O-CB 3.3Å; S137-F141 WeakPolarHBondContact O-CB 3.31Å; S137-F141 PolarHBondContact O-N 2.94Å; I138-F141 PolarHBondContact O-N 3.24Å; F141-S143 VanDerWaalsContact C-N 3.28Å; F141-S143 PolarHBondContact O-N 3.29Å; F141-V144 PolarHBondContact O-N 2.76Å; F141-L145 HydrophobicContact CD1-CD1 3.92Å; F141-L145 HydrophobicContact CD1-CG 4.43Å; F141-L145 HydrophobicContact CE1-CD1 3.33Å; F141-L145 HydrophobicContact CE1-CG 4.02Å; F141-L145 HydrophobicContact CE2-CD1 4.49Å; F141-L145 HydrophobicContact CE2-CD2 4.49Å; F141-L145 HydrophobicContact CE2-CG 4.35Å; F141-L145 HydrophobicContact CZ-CD1 3.66Å; F141-L145 HydrophobicContact CZ-CD2 4.14Å; F141-L145 HydrophobicContact CZ-CG 3.96Å; F141-L145 PolarHBondContact O-N 3.24Å
142S96.4Very high95Very high2 Ų237 Ų371%0.01420%0.198CC..Hα-helixtrans-62.3-35.617850.60000112.1C103 I138 S139 L145 V146C103-S142 PolarHBondContact SG-OG 2.68Å; I138-S142 WeakPolarHBondContact O-CB 3.42Å; I138-S142 PolarHBondContact O-N 3.41Å; I138-S142 PolarHBondContact O-OG 3.44Å; S139-S142 WeakPolarHBondContact CA-OG 3.22Å; S139-S142 PolarHBondContact O-OG 2.93Å; S139-S142 VanDerWaalsContact O-OG 3.09Å; S142-L145 PolarHBondContact O-N 2.95Å; S142-V146 VanDerWaalsContact O-CG2 3.28Å; S142-V146 WeakPolarHBondContact O-CG2 3.46Å; S142-V146 PolarHBondContact O-N 3.44Å
143S96.4Very high95.1Very high0 Ų037 Ų370%020%0.198CC..Hα-helixtrans-66.2-39.4176.571.60000113.1S139 A140 F141 V146 L147 A195S139-S143 WeakPolarHBondContact O-CB 3.34Å; S139-S143 PolarHBondContact O-N 2.93Å; S139-S143 PolarHBondContact O-OG 3.19Å; A140-S143 PolarHBondContact O-N 2.87Å; A140-S143 PolarHBondContact O-OG 3.35Å; F141-S143 VanDerWaalsContact C-N 3.28Å; F141-S143 PolarHBondContact O-N 3.29Å; S143-V146 PolarHBondContact O-N 3.48Å; S143-L147 PolarHBondContact O-N 2.96Å; S143-L147 VanDerWaalsContact O-N 3.1Å; S143-A195 WeakPolarHBondContact OG-CB 3.45Å
144V96.4Very high95Very high67 Ų6735 Ų3541%0.40619%0.19SC..Hα-helixtrans-65.2-41.8174.6174.70000110.6A140 F141 V146 L147 I148A140-V144 PolarHBondContact O-N 2.94Å; F141-V144 PolarHBondContact O-N 2.76Å; V144-V146 VanDerWaalsContact C-N 3.32Å; V144-V146 PolarHBondContact O-N 2.85Å; V144-L147 WeakPolarHBondContact O-CB 3.43Å; V144-L147 PolarHBondContact O-N 3.25Å; V144-I148 HydrophobicContact CG1-CD1 4.07Å; V144-I148 WeakPolarHBondContact O-CG1 3.33Å; V144-I148 PolarHBondContact O-N 2.95Å
145L97.4Very high94.8Very high54 Ų5436.8 Ų36.828%0.28320%0.196SC..Hα-helixtrans-59.3-42.4174.2-73.3-178.5000112.1L99 F141 S142 L147 I148 I149L99-L145 HydrophobicContact CD1-CB 4.06Å; F141-L145 HydrophobicContact CD1-CD1 3.92Å; F141-L145 HydrophobicContact CD1-CG 4.43Å; F141-L145 HydrophobicContact CE1-CD1 3.33Å; F141-L145 HydrophobicContact CE1-CG 4.02Å; F141-L145 HydrophobicContact CE2-CD1 4.49Å; F141-L145 HydrophobicContact CE2-CD2 4.49Å; F141-L145 HydrophobicContact CE2-CG 4.35Å; F141-L145 HydrophobicContact CZ-CD1 3.66Å; F141-L145 HydrophobicContact CZ-CD2 4.14Å; F141-L145 HydrophobicContact CZ-CG 3.96Å; F141-L145 PolarHBondContact O-N 3.24Å; S142-L145 PolarHBondContact O-N 2.95Å; L145-L147 VanDerWaalsContact C-N 3.34Å; L145-L147 PolarHBondContact O-N 3.07Å; L145-I148 PolarHBondContact O-N 3.11Å; L145-I149 HydrophobicContact CB-CD1 4.29Å; L145-I149 WeakPolarHBondContact O-CB 3.34Å; L145-I149 WeakPolarHBondContact O-CD1 3.38Å; L145-I149 VanDerWaalsContact O-CG1 3.22Å; L145-I149 WeakPolarHBondContact O-CG1 3.38Å; L145-I149 PolarHBondContact O-N 3.39Å
146V97.5Very high94.6Very high0 Ų042.7 Ų42.70%023%0.226CC..Hα-helixtrans-59.6-45176.4171.60000111.2W32 C96 L99 L100 S142 S143 V144 I148 I149 Y150 L191W32-V146 HydrophobicContact CH2-CG1 4.14Å; W32-V146 HydrophobicContact CZ3-CG1 4.04Å; C96-V146 HydrophobicContact CB-CG1 4.31Å; L99-V146 HydrophobicContact CB-CG2 3.44Å; L99-V146 VanDerWaalsContact CB-CG2 3.44Å; L99-V146 HydrophobicContact CD1-CG2 4.09Å; L99-V146 HydrophobicContact CG-CG2 4.43Å; L100-V146 HydrophobicContact CD1-CG1 4.2Å; L100-V146 HydrophobicContact CD2-CG1 4.05Å; L100-V146 HydrophobicContact CD2-CG2 4.28Å; L100-V146 HydrophobicContact CG-CG1 4Å; L100-V146 HydrophobicContact CG-CG2 4Å; S142-V146 VanDerWaalsContact O-CG2 3.28Å; S142-V146 WeakPolarHBondContact O-CG2 3.46Å; S142-V146 PolarHBondContact O-N 3.44Å; S143-V146 PolarHBondContact O-N 3.48Å; V144-V146 VanDerWaalsContact C-N 3.32Å; V144-V146 PolarHBondContact O-N 2.85Å; V146-I148 VanDerWaalsContact C-N 3.25Å; V146-I148 PolarHBondContact O-N 3.33Å; V146-I149 PolarHBondContact O-N 3.17Å; V146-Y150 WeakPolarHBondContact O-CB 3.36Å; V146-Y150 PolarHBondContact O-N 2.91Å; V146-L191 HydrophobicContact CB-CD2 3.91Å; V146-L191 HydrophobicContact CG1-CD2 3.72Å
147L96.2Very high94.4Very high21 Ų2143.4 Ų43.411%0.1123%0.23CC..Hα-helixtrans-57.8-39.8178-72.1173.6000112.2S143 V144 L145 Y188 L191 I192S143-L147 PolarHBondContact O-N 2.96Å; S143-L147 VanDerWaalsContact O-N 3.1Å; V144-L147 WeakPolarHBondContact O-CB 3.43Å; V144-L147 PolarHBondContact O-N 3.25Å; L145-L147 VanDerWaalsContact C-N 3.34Å; L145-L147 PolarHBondContact O-N 3.07Å; L147-Y188 HydrophobicContact CB-CE2 4.18Å; L147-Y188 HydrophobicContact CD2-CD1 4.18Å; L147-Y188 HydrophobicContact CD2-CD2 3.79Å; L147-Y188 HydrophobicContact CD2-CE1 3.87Å; L147-Y188 HydrophobicContact CD2-CE2 3.45Å; L147-Y188 VanDerWaalsContact CD2-CE2 3.45Å; L147-Y188 HydrophobicContact CD2-CG 4.14Å; L147-Y188 VanDerWaalsContact CD2-CZ 3.49Å; L147-Y188 WeakPolarHBondContact CD2-O 3.4Å; L147-Y188 HydrophobicContact CG-CE2 4.44Å; L147-Y188 WeakPolarHBondContact O-CE2 3.44Å; L147-Y188 PolarHBondContact O-OH 3.32Å; L147-L191 HydrophobicContact CD1-CB 4.29Å; L147-L191 HydrophobicContact CD2-CB 3.64Å; L147-L191 HydrophobicContact CD2-CD2 4.13Å; L147-L191 HydrophobicContact CG-CB 4.01Å; L147-L191 HydrophobicContact CG-CD2 4.04Å; L147-I192 HydrophobicContact CD1-CG1 3.98Å
148I96.3Very high94Very high85 Ų8546.6 Ų46.644%0.43624%0.237SC..Hα-helixtrans-73-54.5179.4-63.7166.9000110.2V144 L145 V146 Y150 V151 L152V144-I148 HydrophobicContact CG1-CD1 4.07Å; V144-I148 WeakPolarHBondContact O-CG1 3.33Å; V144-I148 PolarHBondContact O-N 2.95Å; L145-I148 PolarHBondContact O-N 3.11Å; V146-I148 VanDerWaalsContact C-N 3.25Å; V146-I148 PolarHBondContact O-N 3.33Å; I148-Y150 VanDerWaalsContact C-N 3.29Å; I148-Y150 PolarHBondContact O-N 2.84Å; I148-V151 PolarHBondContact O-N 3.05Å; I148-L152 HydrophobicContact CG2-CD1 3.69Å; I148-L152 HydrophobicContact CG2-CG 4.16Å; I148-L152 WeakPolarHBondContact O-CB 3.32Å; I148-L152 WeakPolarHBondContact O-CG 3.37Å; I148-L152 PolarHBondContact O-N 2.91Å
149I96.3Very high93.5Very high27 Ų2742.8 Ų42.814%0.13822%0.218CC..Hα-helixtrans-60.2-40.9-175.6-65.4163.8000110.7L92 L95 C96 L99 L145 V146 L152 N153L92-I149 HydrophobicContact CB-CG2 4.27Å; L92-I149 HydrophobicContact CD2-CG2 4.11Å; L95-I149 HydrophobicContact CD2-CD1 3.86Å; L95-I149 HydrophobicContact CG-CD1 4.25Å; C96-I149 WeakPolarHBondContact SG-CG2 3.46Å; L99-I149 HydrophobicContact CD1-CD1 3.77Å; L145-I149 HydrophobicContact CB-CD1 4.29Å; L145-I149 WeakPolarHBondContact O-CB 3.34Å; L145-I149 WeakPolarHBondContact O-CD1 3.38Å; L145-I149 VanDerWaalsContact O-CG1 3.22Å; L145-I149 WeakPolarHBondContact O-CG1 3.38Å; L145-I149 PolarHBondContact O-N 3.39Å; V146-I149 PolarHBondContact O-N 3.17Å; I149-L152 PolarHBondContact O-N 2.92Å; I149-N153 WeakPolarHBondContact O-CB 3.28Å; I149-N153 PolarHBondContact O-N 3.23Å
150Y94.8Very high93Very high3 Ų342.8 Ų42.81%0.01222%0.218CC..Hα-helixtrans-61.1-47.9179.7-172.6-96.1000111.9W32 S33 V146 I148 N153 H154 Y188W32-Y150 HydrophobicContact CB-CE1 4.09Å; W32-Y150 HydrophobicContact CB-CE2 4.32Å; W32-Y150 VanDerWaalsContact CB-OH 3.22Å; W32-Y150 WeakPolarHBondContact CB-OH 3.38Å; W32-Y150 HydrophobicContact CE3-CD1 4.22Å; W32-Y150 HydrophobicContact CE3-CD2 4.01Å; W32-Y150 HydrophobicContact CE3-CE1 4.21Å; W32-Y150 HydrophobicContact CE3-CE2 4.01Å; W32-Y150 HydrophobicContact CE3-CG 4.12Å; W32-Y150 HydrophobicContact CZ3-CD2 4.43Å; W32-Y150 HydrophobicContact CZ3-CG 4.45Å; S33-Y150 WeakPolarHBondContact CB-OH 3.4Å; S33-Y150 PolarHBondContact OG-OH 3.48Å; V146-Y150 WeakPolarHBondContact O-CB 3.36Å; V146-Y150 PolarHBondContact O-N 2.91Å; I148-Y150 VanDerWaalsContact C-N 3.29Å; I148-Y150 PolarHBondContact O-N 2.84Å; Y150-N153 PolarHBondContact O-N 2.79Å; Y150-H154 AromaticContact CE1-CD2 3.88Å; Y150-H154 AromaticContact CE1-NE2 3.76Å; Y150-H154 AromaticContact CE2-NE2 3.97Å; Y150-H154 AromaticContact CZ-CD2 3.92Å; Y150-H154 AromaticContact CZ-NE2 3.41Å; Y150-H154 PolarHBondContact O-CD2 3.42Å; Y150-H154 PolarHBondContact O-N 2.79Å; Y150-H154 PolarHBondContact OH-NE2 2.87Å; Y150-Y188 AromaticContact CD1-CD2 3.85Å; Y150-Y188 HydrophobicContact CD1-CD2 3.85Å; Y150-Y188 HydrophobicContact CD1-CE2 4.18Å; Y150-Y188 HydrophobicContact CE1-CD2 4.47Å
151V94.4Very high92.6Very high34 Ų3445.5 Ų45.521%0.20623%0.229CC..Hα-helixtrans-67.3-43.1178.4172.70000111.2I148 N153 H154 I155 V184 Y188I148-V151 PolarHBondContact O-N 3.05Å; V151-N153 VanDerWaalsContact C-N 3.28Å; V151-N153 PolarHBondContact O-N 2.79Å; V151-H154 PolarHBondContact O-N 3.33Å; V151-H154 VanDerWaalsContact O-N 3.1Å; V151-I155 HydrophobicContact CG1-CD1 3.52Å; V151-I155 HydrophobicContact CG1-CG1 4.19Å; V151-I155 WeakPolarHBondContact O-CG1 3.41Å; V151-I155 PolarHBondContact O-N 3.39Å; V151-V184 HydrophobicContact CG2-CG1 4.48Å; V151-Y188 HydrophobicContact CG2-CE2 3.58Å; V151-Y188 VanDerWaalsContact CG2-OH 3.31Å; V151-Y188 WeakPolarHBondContact CG2-OH 3.41Å
152L93.6Very high92.1Very high78 Ų7841 Ų4141%0.40821%0.21SC..Hα-helixtrans-61.3-38.3177-70.1-177.8000111.9I148 I149 H154 I155 L156I148-L152 HydrophobicContact CG2-CD1 3.69Å; I148-L152 HydrophobicContact CG2-CG 4.16Å; I148-L152 WeakPolarHBondContact O-CB 3.32Å; I148-L152 WeakPolarHBondContact O-CG 3.37Å; I148-L152 PolarHBondContact O-N 2.91Å; I149-L152 PolarHBondContact O-N 2.92Å; L152-H154 VanDerWaalsContact C-N 3.29Å; L152-H154 PolarHBondContact O-N 3.31Å; L152-I155 PolarHBondContact O-N 3.34Å; L152-L156 HydrophobicContact CB-CD1 4.26Å; L152-L156 HydrophobicContact CD2-CD1 4.04Å; L152-L156 HydrophobicContact CD2-CG 4.45Å; L152-L156 VanDerWaalsContact O-CB 3.29Å; L152-L156 WeakPolarHBondContact O-CB 3.27Å; L152-L156 PolarHBondContact O-N 3.24Å
153N93.4Very high91.6Very high1 Ų140.9 Ų40.91%0.00521%0.209CC..Hα-helixtrans-59.8-43.3174.8-167.325.5000110.6P89 L92 I149 Y150 V151 T157 M159P89-N153 WeakPolarHBondContact CA-OD1 3.5Å; P89-N153 PolarHBondContact O-ND2 2.78Å; L92-N153 HydrophobicContact CB-CB 4.09Å; L92-N153 HydrophobicContact CD1-CB 4.12Å; I149-N153 WeakPolarHBondContact O-CB 3.28Å; I149-N153 PolarHBondContact O-N 3.23Å; Y150-N153 PolarHBondContact O-N 2.79Å; V151-N153 VanDerWaalsContact C-N 3.28Å; V151-N153 PolarHBondContact O-N 2.79Å; N153-T157 WeakPolarHBondContact O-CB 3.41Å; N153-T157 WeakPolarHBondContact O-CG2 3.45Å; N153-T157 PolarHBondContact O-N 3.41Å; N153-T157 PolarHBondContact O-OG1 2.93Å; N153-T157 WeakPolarHBondContact OD1-CG2 3.13Å; N153-T157 PolarHBondContact OD1-OG1 2.92Å; N153-M159 PolarHBondContact ND2-SD 3.45Å; N153-M159 VanDerWaalsContact ND2-SD 3.45Å
154H89.8Confident91.1Very high1 Ų141.1 Ų41.11%0.00521%0.211CC..Hα-helixtrans-71.2-32.5177.1-82.7-102.3000114.1S33 Y150 V151 L152 M159 Q160 K180 L182S33-H154 PolarHBondContact OG-CE1 3Å; S33-H154 PolarHBondContact OG-NE2 3.48Å; Y150-H154 AromaticContact CE1-CD2 3.88Å; Y150-H154 AromaticContact CE1-NE2 3.76Å; Y150-H154 AromaticContact CE2-NE2 3.97Å; Y150-H154 AromaticContact CZ-CD2 3.92Å; Y150-H154 AromaticContact CZ-NE2 3.41Å; Y150-H154 PolarHBondContact O-CD2 3.42Å; Y150-H154 PolarHBondContact O-N 2.79Å; Y150-H154 PolarHBondContact OH-NE2 2.87Å; V151-H154 PolarHBondContact O-N 3.33Å; V151-H154 VanDerWaalsContact O-N 3.1Å; L152-H154 VanDerWaalsContact C-N 3.29Å; L152-H154 PolarHBondContact O-N 3.31Å; H154-M159 WeakPolarHBondContact NE2-CE 3.22Å; H154-Q160 PolarHBondContact CE1-NE2 3.43Å; H154-Q160 PolarHBondContact ND1-NE2 2.98Å; H154-K180 WeakPolarHBondContact O-CE 3.39Å; H154-K180 PolarHBondContact O-NZ 3.01Å; H154-L182 HydrophobicContact CB-CD1 4.03Å; H154-L182 HydrophobicContact CB-CD2 3.63Å; H154-L182 HydrophobicContact CB-CG 4.45Å; H154-L182 WeakPolarHBondContact ND1-CD1 3.31Å
155I88.8Confident90.5Very high110 Ų11038.5 Ų38.556%0.56420%0.195SC*.Hα-helixtrans-84.4-45.5-177.1-65.4174.7000111.6V151 L152V151-I155 HydrophobicContact CG1-CD1 3.52Å; V151-I155 HydrophobicContact CG1-CG1 4.19Å; V151-I155 WeakPolarHBondContact O-CG1 3.41Å; V151-I155 PolarHBondContact O-N 3.39Å; L152-I155 PolarHBondContact O-N 3.34Å
156L89.2Confident90Very high133 Ų13337.2 Ų37.270%0.69619%0.191SC*.Hα-helixtrans-89.7-16.9-169.4-59.5-179.9000113.6L152L152-L156 HydrophobicContact CB-CD1 4.26Å; L152-L156 HydrophobicContact CD2-CD1 4.04Å; L152-L156 HydrophobicContact CD2-CG 4.45Å; L152-L156 VanDerWaalsContact O-CB 3.29Å; L152-L156 WeakPolarHBondContact O-CB 3.27Å; L152-L156 PolarHBondContact O-N 3.24Å
157T88.6Confident89.3Confident15 Ų1538.3 Ų38.39%0.09220%0.196CC..SBendtrans-110.2157.3-179.981.90000112.5T88 P89 L92 N153 M159 K180T88-T157 HydrophobicContact CG2-CG2 4.25Å; P89-T157 HydrophobicContact CB-CG2 4.47Å; L92-T157 HydrophobicContact CD1-CG2 4.11Å; N153-T157 WeakPolarHBondContact O-CB 3.41Å; N153-T157 WeakPolarHBondContact O-CG2 3.45Å; N153-T157 PolarHBondContact O-N 3.41Å; N153-T157 PolarHBondContact O-OG1 2.93Å; N153-T157 WeakPolarHBondContact OD1-CG2 3.13Å; N153-T157 PolarHBondContact OD1-OG1 2.92Å; T157-M159 PolarHBondContact O-N 2.63Å; T157-M159 WeakPolarHBondContact OG1-CB 3.27Å; T157-M159 PolarHBondContact OG1-N 3.28Å; T157-K180 PolarHBondContact O-NZ 3.1Å
158K86.3Confident88.5Confident123 Ų12337.4 Ų37.454%0.53519%0.192SC..  trans-84.616.9173.6-62.9-174.6-179.9179.10113.3Q160 E161 E162K158-Q160 PolarHBondContact O-N 3.22Å; K158-E161 HydrophobicContact CB-CB 4.4Å; K158-E161 WeakPolarHBondContact O-CB 3.32Å; K158-E161 PolarHBondContact O-N 3.35Å; K158-E162 HydrophobicContact CB-CG 4.49Å; K158-E162 PolarHBondContact O-N 3.35Å
159M85.9Confident87.7Confident0 Ų039.3 Ų39.30%021%0.208CC..Hα-helixtrans-42.8-49.2-177.1-178.2170.579.700113.3M55 I85 P89 N153 H154 T157 L163M55-M159 HydrophobicContact CE-CE 4.09Å; M55-M159 HydrophobicContact SD-CE 3.97Å; I85-M159 HydrophobicContact CD1-CG 4.09Å; P89-M159 HydrophobicContact CB-CB 3.65Å; P89-M159 HydrophobicContact CB-CG 3.85Å; P89-M159 HydrophobicContact CB-SD 3.95Å; P89-M159 HydrophobicContact CG-CB 4.34Å; N153-M159 PolarHBondContact ND2-SD 3.45Å; N153-M159 VanDerWaalsContact ND2-SD 3.45Å; H154-M159 WeakPolarHBondContact NE2-CE 3.22Å; T157-M159 PolarHBondContact O-N 2.63Å; T157-M159 WeakPolarHBondContact OG1-CB 3.27Å; T157-M159 PolarHBondContact OG1-N 3.28Å; M159-L163 HydrophobicContact CG-CD1 3.51Å; M159-L163 VanDerWaalsContact O-CB 3.26Å; M159-L163 WeakPolarHBondContact O-CB 3.05Å; M159-L163 VanDerWaalsContact O-CD1 3.29Å; M159-L163 WeakPolarHBondContact O-CD1 3.18Å; M159-L163 WeakPolarHBondContact O-CG 3.42Å; M159-L163 PolarHBondContact O-N 3.31Å; M159-L163 HydrophobicContact SD-CD1 4.49Å
160Q84.6Confident86.7Confident0 Ų039 Ų390%021%0.206CC..Hα-helixtrans-71.1-36.1-177.5-59.1-60.8-23.100113.2T35 M37 M55 H154 K158 E162 V164T35-Q160 HydrophobicContact CG2-CB 4.32Å; T35-Q160 HydrophobicContact CG2-CG 4.08Å; M37-Q160 HydrophobicContact CE-CB 3.77Å; M37-Q160 HydrophobicContact SD-CB 3.89Å; M55-Q160 PolarHBondContact SD-NE2 3.39Å; H154-Q160 PolarHBondContact CE1-NE2 3.43Å; H154-Q160 PolarHBondContact ND1-NE2 2.98Å; K158-Q160 PolarHBondContact O-N 3.22Å; Q160-E162 VanDerWaalsContact C-N 3.31Å; Q160-V164 WeakPolarHBondContact O-CG2 3.48Å; Q160-V164 PolarHBondContact O-N 2.58Å
161E85.9Confident85.5Confident64 Ų6443 Ų4330%0.29923%0.233SC..Hα-helixtrans-69.9-32.2-179.7-68.3160.2-147.600111.2M37 K158 P165 L177M37-E161 HydrophobicContact SD-CG 4.1Å; K158-E161 HydrophobicContact CB-CB 4.4Å; K158-E161 WeakPolarHBondContact O-CB 3.32Å; K158-E161 PolarHBondContact O-N 3.35Å; E161-P165 WeakPolarHBondContact O-CD 3.34Å; E161-P165 WeakPolarHBondContact O-CG 3.33Å; E161-L177 HydrophobicContact CG-CB 4.39Å
162E86.1Confident84.2Confident42 Ų4247 Ų4720%0.19625%0.252CS..Hα-helixtrans-84.7-33.7176.9-67175.9-166.800112.8I85 E86 K158 Q160 P165 S166I85-E162 HydrophobicContact CB-CB 4.14Å; I85-E162 WeakPolarHBondContact CB-OE2 3.25Å; I85-E162 HydrophobicContact CG2-CB 3.79Å; E86-E162 WeakPolarHBondContact CG-OE1 3.46Å; E86-E162 WeakPolarHBondContact CG-OE2 3.45Å; E86-E162 PolarHBondContact N-OE2 3.31Å; E86-E162 VanDerWaalsContact N-OE2 3.12Å; K158-E162 HydrophobicContact CB-CG 4.49Å; K158-E162 PolarHBondContact O-N 3.35Å; Q160-E162 VanDerWaalsContact C-N 3.31Å; E162-P165 WeakPolarHBondContact O-CD 3.35Å; E162-P165 WeakPolarHBondContact O-CG 3.47Å; E162-S166 VanDerWaalsContact O-CB 3.27Å; E162-S166 WeakPolarHBondContact O-CB 3.41Å; E162-S166 PolarHBondContact O-N 3.31Å
163L86.3Confident82.8Confident0 Ų049 Ų490%027%0.269CS..Hα-helixtrans-65.1-43.4179.2-92.6156000112.5I53 M55 F76 E81 L82 I85 M159 S166 I167I53-L163 HydrophobicContact CD1-CB 4.02Å; M55-L163 HydrophobicContact SD-CD1 4.18Å; F76-L163 HydrophobicContact CE2-CD2 4.33Å; E81-L163 HydrophobicContact CB-CD2 3.62Å; L82-L163 HydrophobicContact CD1-CD1 3.93Å; L82-L163 HydrophobicContact CD1-CD2 4.11Å; L82-L163 HydrophobicContact CD1-CG 4.47Å; I85-L163 HydrophobicContact CD1-CD1 4.32Å; I85-L163 HydrophobicContact CD1-CG 4.2Å; I85-L163 HydrophobicContact CG2-CG 4.4Å; M159-L163 HydrophobicContact CG-CD1 3.51Å; M159-L163 VanDerWaalsContact O-CB 3.26Å; M159-L163 WeakPolarHBondContact O-CB 3.05Å; M159-L163 VanDerWaalsContact O-CD1 3.29Å; M159-L163 WeakPolarHBondContact O-CD1 3.18Å; M159-L163 WeakPolarHBondContact O-CG 3.42Å; M159-L163 PolarHBondContact O-N 3.31Å; M159-L163 HydrophobicContact SD-CD1 4.49Å; L163-S166 PolarHBondContact O-N 3.47Å; L163-I167 HydrophobicContact CB-CD1 4.22Å; L163-I167 HydrophobicContact CD2-CD1 3.91Å; L163-I167 HydrophobicContact CD2-CG1 4.4Å; L163-I167 WeakPolarHBondContact O-CB 3.5Å; L163-I167 VanDerWaalsContact O-CD1 3.31Å; L163-I167 WeakPolarHBondContact O-CD1 3.14Å; L163-I167 WeakPolarHBondContact O-CG1 3.36Å; L163-I167 PolarHBondContact O-N 3.26Å
164V86Confident81.6Confident6 Ų650.8 Ų50.84%0.03628%0.281CS..Hα-helixtrans-58-53.4-176.6169.30000113.2M37 A51 I53 L62 Q160 A168 L177M37-V164 HydrophobicContact CE-CG2 3.52Å; A51-V164 HydrophobicContact CB-CG1 4.09Å; I53-V164 HydrophobicContact CD1-CG2 4.4Å; I53-V164 HydrophobicContact CG2-CG2 4.47Å; L62-V164 HydrophobicContact CD1-CG1 4.35Å; L62-V164 HydrophobicContact CD1-CG2 3.9Å; L62-V164 HydrophobicContact CD2-CG1 4.49Å; Q160-V164 WeakPolarHBondContact O-CG2 3.48Å; Q160-V164 PolarHBondContact O-N 2.58Å; V164-A168 WeakPolarHBondContact O-CB 3.38Å; V164-A168 PolarHBondContact O-N 3.32Å; V164-L177 HydrophobicContact CB-CD1 3.7Å; V164-L177 HydrophobicContact CG1-CD1 3.85Å; V164-L177 HydrophobicContact CG1-CD2 4.39Å; V164-L177 HydrophobicContact CG2-CD1 4.27Å
165P84.1Confident80.9Confident12 Ų1251.8 Ų51.88%0.07829%0.287CS..Hα-helixtrans-68.1-34.9177.727-34.2000112.2E161 E162 A168 T169 I170 D172E161-P165 WeakPolarHBondContact O-CD 3.34Å; E161-P165 WeakPolarHBondContact O-CG 3.33Å; E162-P165 WeakPolarHBondContact O-CD 3.35Å; E162-P165 WeakPolarHBondContact O-CG 3.47Å; P165-A168 PolarHBondContact O-N 3.45Å; P165-T169 PolarHBondContact O-N 3.31Å; P165-I170 PolarHBondContact O-N 3.45Å; P165-D172 WeakPolarHBondContact CB-OD1 3.38Å; P165-D172 WeakPolarHBondContact CG-OD1 3.27Å
166S85.1Confident80.5Confident27 Ų2749.7 Ų49.719%0.18928%0.28CS..Hα-helixtrans-60-48.8176.7-165.70000112.4E162 L163 T169E162-S166 VanDerWaalsContact O-CB 3.27Å; E162-S166 WeakPolarHBondContact O-CB 3.41Å; E162-S166 PolarHBondContact O-N 3.31Å; L163-S166 PolarHBondContact O-N 3.47Å; S166-T169 PolarHBondContact O-N 3.36Å
167I84.1Confident80.1Confident22 Ų2244.7 Ų44.711%0.11325%0.253CS..Hα-helixtrans-67.8-42.5177.9-64.9158.3000110.8I53 L62 D74 F76 E81 L163 T169I53-I167 HydrophobicContact CD1-CD1 4.13Å; L62-I167 HydrophobicContact CB-CG2 4.41Å; L62-I167 HydrophobicContact CD2-CB 3.96Å; L62-I167 HydrophobicContact CD2-CG2 3.78Å; D74-I167 HydrophobicContact CB-CG2 4.09Å; F76-I167 HydrophobicContact CB-CG2 4.42Å; F76-I167 HydrophobicContact CD1-CD1 3.55Å; F76-I167 HydrophobicContact CD1-CG1 4.25Å; F76-I167 HydrophobicContact CD1-CG2 4.24Å; F76-I167 HydrophobicContact CD2-CD1 3.84Å; F76-I167 HydrophobicContact CD2-CG1 4.32Å; F76-I167 HydrophobicContact CE1-CD1 3.46Å; F76-I167 VanDerWaalsContact CE1-CD1 3.46Å; F76-I167 HydrophobicContact CE2-CD1 3.77Å; F76-I167 HydrophobicContact CG-CD1 3.75Å; F76-I167 HydrophobicContact CG-CG1 4.11Å; F76-I167 HydrophobicContact CG-CG2 4.49Å; F76-I167 HydrophobicContact CZ-CD1 3.58Å; E81-I167 HydrophobicContact CB-CG1 4.38Å; E81-I167 HydrophobicContact CG-CG1 3.94Å; L163-I167 HydrophobicContact CB-CD1 4.22Å; L163-I167 HydrophobicContact CD2-CD1 3.91Å; L163-I167 HydrophobicContact CD2-CG1 4.4Å; L163-I167 WeakPolarHBondContact O-CB 3.5Å; L163-I167 VanDerWaalsContact O-CD1 3.31Å; L163-I167 WeakPolarHBondContact O-CD1 3.14Å; L163-I167 WeakPolarHBondContact O-CG1 3.36Å; L163-I167 PolarHBondContact O-N 3.26Å; I167-T169 PolarHBondContact O-N 3.02Å
168A79.9Confident79.8Confident3 Ų346.7 Ų46.73%0.02527%0.266CS..Hα-helixtrans-72.1-6.9-179.600000113.5R64 V164 P165 I170R64-A168 VanDerWaalsContact CZ-CB 3.47Å; V164-A168 WeakPolarHBondContact O-CB 3.38Å; V164-A168 PolarHBondContact O-N 3.32Å; P165-A168 PolarHBondContact O-N 3.45Å; A168-I170 HydrophobicContact CB-CB 4.35Å; A168-I170 HydrophobicContact CB-CD1 3.58Å; A168-I170 HydrophobicContact CB-CG1 3.72Å; A168-I170 PolarHBondContact O-N 3.08Å
169T79.4Confident79.6Confident125 Ų12546.8 Ų46.877%0.76727%0.268SS*.THydrogen-bonded Turntrans52.236.7-172.258.50000112.8P165 S166 I167P165-T169 PolarHBondContact O-N 3.31Å; S166-T169 PolarHBondContact O-N 3.36Å; I167-T169 PolarHBondContact O-N 3.02Å
170I73.8Confident79.7Confident21 Ų2149.7 Ų49.711%0.10828%0.28CS..  trans-100137.8-179.7-65.1173.5000108.2N69 P165 A168 D172 S174 V175N69-I170 HydrophobicContact CB-CD1 4.22Å; P165-I170 PolarHBondContact O-N 3.45Å; A168-I170 HydrophobicContact CB-CB 4.35Å; A168-I170 HydrophobicContact CB-CD1 3.58Å; A168-I170 HydrophobicContact CB-CG1 3.72Å; A168-I170 PolarHBondContact O-N 3.08Å; I170-D172 PolarHBondContact O-N 2.88Å; I170-S174 WeakPolarHBondContact CG2-OG 3.02Å; I170-V175 HydrophobicContact CG2-CG2 3.83Å
171P70.8Confident79.9Confident87 Ų8757.8 Ų57.857%0.56531%0.311SS*.  trans-59.6127.3172.3-20.431.4000111.1T173 S174P171-T173 PolarHBondContact O-N 3.42Å; P171-S174 WeakPolarHBondContact O-CB 3.02Å; P171-S174 PolarHBondContact O-N 3.26Å; P171-S174 PolarHBondContact O-OG 2.91Å
172D65.7Low80.2Confident116 Ų11657.5 Ų57.562%0.6231%0.311SS*.G310 helixtrans-53.1-26-177.6-64.5-28.7000113.6P165 I170 S174P165-D172 WeakPolarHBondContact CB-OD1 3.38Å; P165-D172 WeakPolarHBondContact CG-OD1 3.27Å; I170-D172 PolarHBondContact O-N 2.88Å; D172-S174 VanDerWaalsContact C-N 3.28Å; D172-S174 PolarHBondContact O-N 3.39Å
173T65.5Low80.6Confident122 Ų12259.1 Ų59.175%0.74832%0.319SS*.G310 helixtrans-76.4-11.1179.653.10000114.5P171P171-T173 PolarHBondContact O-N 3.42Å
174S67.9Low80.9Confident38 Ų3861.1 Ų61.127%0.26633%0.331SS..G310 helixtrans-97.7-12-172.967.30000114.4S42 I170 P171 D172S42-S174 WeakPolarHBondContact CB-O 3.43Å; S42-S174 PolarHBondContact N-O 3.47Å; I170-S174 WeakPolarHBondContact CG2-OG 3.02Å; P171-S174 WeakPolarHBondContact O-CB 3.02Å; P171-S174 PolarHBondContact O-N 3.26Å; P171-S174 PolarHBondContact O-OG 2.91Å; D172-S174 VanDerWaalsContact C-N 3.28Å; D172-S174 PolarHBondContact O-N 3.39Å
175V75.3Confident81.4Confident22 Ų2263.6 Ų63.613%0.13334%0.341CS..EExtended strand (participates in β ladder)trans-134.5127-177.8-179.30000110.4C39 P68 I170 L177C39-V175 WeakPolarHBondContact SG-CG1 3.17Å; P68-V175 HydrophobicContact CG-CG2 3.42Å; P68-V175 VanDerWaalsContact CG-CG2 3.42Å; I170-V175 HydrophobicContact CG2-CG2 3.83Å; V175-L177 HydrophobicContact CG1-CD2 4.06Å; V175-L177 HydrophobicContact CG1-CG 4.16Å
176T79.1Confident81.9Confident66 Ų6667.3 Ų67.341%0.40536%0.359SS..EExtended strand (participates in β ladder)trans-99.1121.5167.847.50000109.2E40E40-T176 PolarHBondContact N-O 3.49Å; E40-T176 PolarHBondContact O-N 3.49Å; E40-T176 PolarHBondContact O-OG1 2.91Å
177L82.1Confident82.3Confident27 Ų2766 Ų6614%0.14135%0.35CS..EExtended strand (participates in β ladder)trans-99.4124.8174.7-66.3171.1000109.3M37 D38 C39 A51 E161 V164 V175M37-L177 HydrophobicContact CB-CD2 4.3Å; M37-L177 HydrophobicContact CE-CD1 4.47Å; M37-L177 HydrophobicContact SD-CB 4.46Å; M37-L177 HydrophobicContact SD-CD1 4.44Å; D38-L177 CarbonylContact O-C 3.48Å; D38-L177 WeakPolarHBondContact O-CA 3.5Å; C39-L177 HydrophobicContact CB-CD2 4.04Å; A51-L177 HydrophobicContact CB-CD2 4.21Å; E161-L177 HydrophobicContact CG-CB 4.39Å; V164-L177 HydrophobicContact CB-CD1 3.7Å; V164-L177 HydrophobicContact CG1-CD1 3.85Å; V164-L177 HydrophobicContact CG1-CD2 4.39Å; V164-L177 HydrophobicContact CG2-CD1 4.27Å; V175-L177 HydrophobicContact CG1-CD2 4.06Å; V175-L177 HydrophobicContact CG1-CG 4.16Å
178T81.3Confident82.8Confident58 Ų5866.6 Ų66.636%0.35635%0.351SS..EExtended strand (participates in β ladder)trans-132.5172-178.1670000111.3D38 K180D38-T178 PolarHBondContact N-O 3Å; D38-T178 PolarHBondContact O-N 2.97Å; T178-K180 PolarHBondContact O-N 3.49Å
179H83.7Confident83.6Confident125 Ų12571 Ų7158%0.57937%0.37SS*.EExtended strand (participates in β ladder)trans52.754.3174.5-60.596.6000114.8D38 R181D38-H179 HydrophobicContact CB-CB 4.44Å; D38-H179 WeakPolarHBondContact OD2-CB 3.5Å; D38-H179 IonicContact OD2-CG 3.69Å; D38-H179 IonicContact OD2-ND1 3.72Å; H179-R181 PolarHBondContact O-N 3.31Å
180K86.3Confident84.4Confident61 Ų6166.2 Ų66.227%0.26534%0.34SS..EExtended strand (participates in β ladder)trans-61115.3176-175.5177.2178.1177.80111.9T35 M37 H154 T157 T178T35-K180 HydrophobicContact CG2-CG 3.64Å; M37-K180 HydrophobicContact CG-CB 4.23Å; M37-K180 HydrophobicContact CG-CG 4.34Å; H154-K180 WeakPolarHBondContact O-CE 3.39Å; H154-K180 PolarHBondContact O-NZ 3.01Å; T157-K180 PolarHBondContact O-NZ 3.1Å; T178-K180 PolarHBondContact O-N 3.49Å
181R90Very high85.4Confident170 Ų17065.2 Ų65.264%0.64234%0.335SS*.EExtended strand (participates in β ladder)trans-114.2111.3174.1-63.4-178.7-168.9-121.32.9109.8T35 K36 H179T35-R181 CarbonylContact C-O 3.6Å; T35-R181 WeakPolarHBondContact CA-O 3.47Å; K36-R181 HydrophobicContact CB-CB 4.5Å; K36-R181 PolarHBondContact N-O 3.3Å; K36-R181 PolarHBondContact O-N 3.24Å; H179-R181 PolarHBondContact O-N 3.31Å
182L91.8Very high86.6Confident57 Ų5765 Ų6530%0.29833%0.328SS..EExtended strand (participates in β ladder)trans-91.5125.5177.7179.967.9000110.8H154H154-L182 HydrophobicContact CB-CD1 4.03Å; H154-L182 HydrophobicContact CB-CD2 3.63Å; H154-L182 HydrophobicContact CB-CG 4.45Å; H154-L182 WeakPolarHBondContact ND1-CD1 3.31Å
183E94.1Very high88.1Confident76 Ų7662 Ų6236%0.35531%0.314SS..EExtended strand (participates in β ladder)trans-116116.3168-66.6176.2-163.700109.3S33 K34 K185S33-E183 CarbonylContact C-O 3.54Å; S33-E183 WeakPolarHBondContact CA-O 3.49Å; K34-E183 HydrophobicContact CB-CB 4.43Å; K34-E183 PolarHBondContact N-O 2.82Å; K34-E183 PolarHBondContact O-N 3.36Å; E183-K185 IonicContact OE2-NZ 2.76Å; E183-K185 PolarHBondContact OE2-NZ 3.28Å
184V94.1Very high89.5Confident43 Ų4356.1 Ų56.126%0.26128%0.279SS..EExtended strand (participates in β ladder)trans-72.3147.5170.4-69.40000110.8V151 Y188 F189V151-V184 HydrophobicContact CG2-CG1 4.48Å; V184-Y188 HydrophobicContact CB-CD1 3.95Å; V184-Y188 HydrophobicContact CB-CG 4.16Å; V184-Y188 HydrophobicContact CG1-CD1 4.1Å; V184-Y188 HydrophobicContact CG1-CE1 4.38Å; V184-Y188 HydrophobicContact CG1-CG 4.18Å; V184-Y188 HydrophobicContact CG2-CD1 4.25Å; V184-F189 HydrophobicContact CB-CE2 4.4Å; V184-F189 HydrophobicContact CG2-CE1 4.26Å; V184-F189 HydrophobicContact CG2-CE2 3.68Å; V184-F189 HydrophobicContact CG2-CZ 3.43Å; V184-F189 VanDerWaalsContact CG2-CZ 3.43Å
185K95.5Very high90.9Very high57 Ų5754.9 Ų54.925%0.24827%0.27CS..  trans-119.4-178.3-175-63-63173.8-165.80111.7T31 W32 K34 E183 G187 Y188 F189T31-K185 WeakPolarHBondContact O-CB 3.29Å; W32-K185 PolarHBondContact O-N 2.9Å; K34-K185 HydrophobicContact CB-CG 4.35Å; E183-K185 IonicContact OE2-NZ 2.76Å; E183-K185 PolarHBondContact OE2-NZ 3.28Å; K185-G187 VanDerWaalsContact C-N 3.29Å; K185-G187 PolarHBondContact O-N 2.79Å; K185-Y188 WeakPolarHBondContact O-CB 3.36Å; K185-Y188 PolarHBondContact O-N 3.33Å; K185-Y188 VanDerWaalsContact O-N 3.11Å; K185-F189 VanDerWaalsContact O-CD2 3.3Å; K185-F189 WeakPolarHBondContact O-CD2 3.47Å; K185-F189 PolarHBondContact O-N 2.92Å
186I94.4Very high91.9Very high90 Ų9057.3 Ų57.346%0.46229%0.285SS..Hα-helixtrans-56.9-39.3-169.3-168.960.9000113T30 Y188 F189 L190T30-I186 HydrophobicContact CG2-CG2 4.44Å; I186-Y188 PolarHBondContact O-N 2.59Å; I186-F189 PolarHBondContact O-N 2.76Å; I186-F189 VanDerWaalsContact O-N 3.07Å; I186-L190 HydrophobicContact CD1-CG 4.27Å; I186-L190 HydrophobicContact CG1-CD1 4.01Å; I186-L190 HydrophobicContact CG1-CG 4.09Å; I186-L190 VanDerWaalsContact O-CG 3.28Å; I186-L190 WeakPolarHBondContact O-CG 3.26Å; I186-L190 PolarHBondContact O-N 2.87Å
187G93.4Very high92.6Very high0 Ų055.6 Ų55.60%027%0.274CS..Hα-helixtrans-59-37179.900000112.8T30 T31 K185T30-G187 WeakPolarHBondContact OG1-CA 3.38Å; T30-G187 PolarHBondContact OG1-N 2.83Å; T31-G187 WeakPolarHBondContact O-CA 3.47Å; T31-G187 PolarHBondContact O-N 2.85Å; K185-G187 VanDerWaalsContact C-N 3.29Å; K185-G187 PolarHBondContact O-N 2.79Å
188Y95.4Very high93.2Very high34 Ų3454.4 Ų54.413%0.13327%0.267CS..Hα-helixtrans-66.9-47.8173.8-179.4-93000111.7W32 L147 Y150 V151 V184 K185 I186 L190 L191W32-Y188 HydrophobicContact CE3-CD2 4.43Å; L147-Y188 HydrophobicContact CB-CE2 4.18Å; L147-Y188 HydrophobicContact CD2-CD1 4.18Å; L147-Y188 HydrophobicContact CD2-CD2 3.79Å; L147-Y188 HydrophobicContact CD2-CE1 3.87Å; L147-Y188 HydrophobicContact CD2-CE2 3.45Å; L147-Y188 VanDerWaalsContact CD2-CE2 3.45Å; L147-Y188 HydrophobicContact CD2-CG 4.14Å; L147-Y188 VanDerWaalsContact CD2-CZ 3.49Å; L147-Y188 WeakPolarHBondContact CD2-O 3.4Å; L147-Y188 HydrophobicContact CG-CE2 4.44Å; L147-Y188 WeakPolarHBondContact O-CE2 3.44Å; L147-Y188 PolarHBondContact O-OH 3.32Å; Y150-Y188 AromaticContact CD1-CD2 3.85Å; Y150-Y188 HydrophobicContact CD1-CD2 3.85Å; Y150-Y188 HydrophobicContact CD1-CE2 4.18Å; Y150-Y188 HydrophobicContact CE1-CD2 4.47Å; V151-Y188 HydrophobicContact CG2-CE2 3.58Å; V151-Y188 VanDerWaalsContact CG2-OH 3.31Å; V151-Y188 WeakPolarHBondContact CG2-OH 3.41Å; V184-Y188 HydrophobicContact CB-CD1 3.95Å; V184-Y188 HydrophobicContact CB-CG 4.16Å; V184-Y188 HydrophobicContact CG1-CD1 4.1Å; V184-Y188 HydrophobicContact CG1-CE1 4.38Å; V184-Y188 HydrophobicContact CG1-CG 4.18Å; V184-Y188 HydrophobicContact CG2-CD1 4.25Å; K185-Y188 WeakPolarHBondContact O-CB 3.36Å; K185-Y188 PolarHBondContact O-N 3.33Å; K185-Y188 VanDerWaalsContact O-N 3.11Å; I186-Y188 PolarHBondContact O-N 2.59Å; Y188-L190 VanDerWaalsContact C-N 3.28Å; Y188-L190 PolarHBondContact O-N 2.87Å; Y188-L191 PolarHBondContact O-N 2.82Å
189F95.9Very high93.9Very high97 Ų9756.4 Ų56.443%0.42528%0.275SS..Hα-helixtrans-66-29.6-177.9-72-65.2000113.4V184 K185 I186 L191 I192 P193V184-F189 HydrophobicContact CB-CE2 4.4Å; V184-F189 HydrophobicContact CG2-CE1 4.26Å; V184-F189 HydrophobicContact CG2-CE2 3.68Å; V184-F189 HydrophobicContact CG2-CZ 3.43Å; V184-F189 VanDerWaalsContact CG2-CZ 3.43Å; K185-F189 VanDerWaalsContact O-CD2 3.3Å; K185-F189 WeakPolarHBondContact O-CD2 3.47Å; K185-F189 PolarHBondContact O-N 2.92Å; I186-F189 PolarHBondContact O-N 2.76Å; I186-F189 VanDerWaalsContact O-N 3.07Å; F189-L191 PolarHBondContact O-N 2.8Å; F189-I192 HydrophobicContact CD1-CD1 4.14Å; F189-I192 WeakPolarHBondContact O-CB 3.34Å; F189-I192 PolarHBondContact O-N 3.01Å; F189-I192 VanDerWaalsContact O-N 3.15Å; F189-P193 WeakPolarHBondContact O-CD 3.49Å
190L96Very high94.4Very high24 Ų2454 Ų5413%0.12627%0.266CS..THydrogen-bonded Turntrans-67.7-17.4178.9-72.4172.6000113.8L23 F26 A27 I186 Y188 I192 P193 Y194L23-L190 HydrophobicContact CD1-CD2 3.75Å; L23-L190 HydrophobicContact CG-CD2 4.22Å; F26-L190 HydrophobicContact CD1-CD1 3.58Å; F26-L190 HydrophobicContact CE1-CD1 3.91Å; A27-L190 HydrophobicContact CB-CB 3.64Å; A27-L190 HydrophobicContact CB-CD1 4.15Å; I186-L190 HydrophobicContact CD1-CG 4.27Å; I186-L190 HydrophobicContact CG1-CD1 4.01Å; I186-L190 HydrophobicContact CG1-CG 4.09Å; I186-L190 VanDerWaalsContact O-CG 3.28Å; I186-L190 WeakPolarHBondContact O-CG 3.26Å; I186-L190 PolarHBondContact O-N 2.87Å; Y188-L190 VanDerWaalsContact C-N 3.28Å; Y188-L190 PolarHBondContact O-N 2.87Å; L190-I192 VanDerWaalsContact C-N 3.29Å; L190-I192 PolarHBondContact O-N 3.3Å; L190-P193 WeakPolarHBondContact O-CD 3.21Å; L190-P193 WeakPolarHBondContact O-CG 3.35Å; L190-Y194 PolarHBondContact O-N 3.09Å
191L95.5Very high94.7Very high0 Ų051 Ų510%025%0.253CS..Hα-helixtrans-69-26.8171.6-106.180.1000113.1L24 A27 W32 L100 V146 L147 Y188 F189 Y194 A195L24-L191 HydrophobicContact CD1-CD1 4.3Å; A27-L191 HydrophobicContact CB-CD1 4.17Å; W32-L191 HydrophobicContact CH2-CD1 3.31Å; W32-L191 HydrophobicContact CH2-CD2 4.15Å; W32-L191 HydrophobicContact CH2-CG 4.36Å; W32-L191 HydrophobicContact CZ2-CD1 3.66Å; W32-L191 HydrophobicContact CZ3-CD1 4.24Å; L100-L191 HydrophobicContact CD2-CD1 4.14Å; L100-L191 HydrophobicContact CD2-CD2 4Å; L100-L191 HydrophobicContact CD2-CG 4.44Å; V146-L191 HydrophobicContact CB-CD2 3.91Å; V146-L191 HydrophobicContact CG1-CD2 3.72Å; L147-L191 HydrophobicContact CD1-CB 4.29Å; L147-L191 HydrophobicContact CD2-CB 3.64Å; L147-L191 HydrophobicContact CD2-CD2 4.13Å; L147-L191 HydrophobicContact CG-CB 4.01Å; L147-L191 HydrophobicContact CG-CD2 4.04Å; Y188-L191 PolarHBondContact O-N 2.82Å; F189-L191 PolarHBondContact O-N 2.8Å; L191-Y194 WeakPolarHBondContact O-CB 2.88Å; L191-Y194 PolarHBondContact O-N 2.85Å; L191-A195 PolarHBondContact O-N 3.41Å
192I95.7Very high94.8Very high81 Ų8144.5 Ų44.542%0.41523%0.231SC..Hα-helixtrans-65.8-56.2179.1-57.4172.2000111.1L147 F189 L190 Y194 A195 V196L147-I192 HydrophobicContact CD1-CG1 3.98Å; F189-I192 HydrophobicContact CD1-CD1 4.14Å; F189-I192 WeakPolarHBondContact O-CB 3.34Å; F189-I192 PolarHBondContact O-N 3.01Å; F189-I192 VanDerWaalsContact O-N 3.15Å; L190-I192 VanDerWaalsContact C-N 3.29Å; L190-I192 PolarHBondContact O-N 3.3Å; I192-Y194 PolarHBondContact O-N 2.99Å; I192-A195 PolarHBondContact O-N 3.17Å; I192-A195 VanDerWaalsContact O-N 3.16Å; I192-V196 WeakPolarHBondContact O-CG2 2.94Å; I192-V196 PolarHBondContact O-N 3.26Å
193P96.4Very high94.9Very high53 Ų5345.8 Ų45.834%0.34424%0.237SC..Hα-helixtrans-62.8-30.817523.2-31.2000112.6L23 F189 L190 V196 L197L23-P193 HydrophobicContact CD2-CB 3.83Å; L23-P193 HydrophobicContact CD2-CG 3.67Å; F189-P193 WeakPolarHBondContact O-CD 3.49Å; L190-P193 WeakPolarHBondContact O-CD 3.21Å; L190-P193 WeakPolarHBondContact O-CG 3.35Å; P193-V196 PolarHBondContact O-N 2.92Å; P193-L197 WeakPolarHBondContact O-CB 3.36Å; P193-L197 VanDerWaalsContact O-CG 3.25Å; P193-L197 WeakPolarHBondContact O-CG 3.31Å; P193-L197 PolarHBondContact O-N 2.85Å
194Y96.6Very high94.8Very high0 Ų043.8 Ų43.80%023%0.229CC..Hα-helixtrans-56-51.4170.2166-91.1000111.5S20 L24 C103 S107 S139 L190 L191 I192 V196 L197 S198S20-Y194 WeakPolarHBondContact O-CD2 3.35Å; S20-Y194 WeakPolarHBondContact OG-CD2 3.44Å; S20-Y194 WeakPolarHBondContact OG-CE2 3.43Å; S20-Y194 PolarHBondContact OG-O 2.94Å; L24-Y194 HydrophobicContact CB-CD2 3.71Å; L24-Y194 HydrophobicContact CB-CE2 3.9Å; L24-Y194 HydrophobicContact CB-CG 4.47Å; L24-Y194 HydrophobicContact CD1-CD2 4.42Å; L24-Y194 HydrophobicContact CD2-CD2 4.4Å; L24-Y194 HydrophobicContact CD2-CE2 3.83Å; L24-Y194 HydrophobicContact CG-CD2 4.4Å; L24-Y194 HydrophobicContact CG-CE2 4.31Å; C103-Y194 HydrophobicContact CB-CE1 4.28Å; C103-Y194 WeakPolarHBondContact CB-OH 3.46Å; C103-Y194 PolarHBondContact O-OH 3.03Å; S107-Y194 PolarHBondContact OG-OH 3.06Å; S139-Y194 WeakPolarHBondContact CB-OH 3.38Å; S139-Y194 PolarHBondContact OG-OH 3.25Å; L190-Y194 PolarHBondContact O-N 3.09Å; L191-Y194 WeakPolarHBondContact O-CB 2.88Å; L191-Y194 PolarHBondContact O-N 2.85Å; I192-Y194 PolarHBondContact O-N 2.99Å; Y194-V196 VanDerWaalsContact C-N 3.33Å; Y194-V196 PolarHBondContact O-N 3.34Å; Y194-L197 PolarHBondContact O-N 2.87Å; Y194-S198 PolarHBondContact O-N 2.81Å; Y194-S198 PolarHBondContact O-OG 2.9Å
195A95.4Very high94.6Very high11 Ų1141.8 Ų41.89%0.09122%0.217CC..Hα-helixtrans-61.2-42.3179.500000111.7S143 L191 I192 S198 L199S143-A195 WeakPolarHBondContact OG-CB 3.45Å; L191-A195 PolarHBondContact O-N 3.41Å; I192-A195 PolarHBondContact O-N 3.17Å; I192-A195 VanDerWaalsContact O-N 3.16Å; A195-S198 PolarHBondContact O-N 2.98Å; A195-L199 WeakPolarHBondContact O-CG 3.27Å; A195-L199 PolarHBondContact O-N 2.98Å
196V96.6Very high94.4Very high74 Ų7444.7 Ų44.745%0.44823%0.227SC..Hα-helixtrans-61.9-44.8176.7174.40000111.2I192 P193 Y194 S198 L199 L200I192-V196 WeakPolarHBondContact O-CG2 2.94Å; I192-V196 PolarHBondContact O-N 3.26Å; P193-V196 PolarHBondContact O-N 2.92Å; Y194-V196 VanDerWaalsContact C-N 3.33Å; Y194-V196 PolarHBondContact O-N 3.34Å; V196-S198 VanDerWaalsContact C-N 3.33Å; V196-S198 PolarHBondContact O-N 3.38Å; V196-L199 PolarHBondContact O-N 2.82Å; V196-L200 HydrophobicContact CG1-CD1 4.13Å; V196-L200 HydrophobicContact CG1-CG 4.37Å; V196-L200 WeakPolarHBondContact O-CG 3.44Å; V196-L200 PolarHBondContact O-N 2.86Å
197L95.3Very high94.2Very high30 Ų3044.1 Ų44.116%0.15723%0.225CC..Hα-helixtrans-63.2-38.8177.7-72.7169.7000112L16 I19 L23 P193 Y194 L199 L200 A201L16-L197 HydrophobicContact CD2-CD2 3.89Å; I19-L197 HydrophobicContact CG2-CD1 4.02Å; L23-L197 HydrophobicContact CD2-CD1 4.31Å; P193-L197 WeakPolarHBondContact O-CB 3.36Å; P193-L197 VanDerWaalsContact O-CG 3.25Å; P193-L197 WeakPolarHBondContact O-CG 3.31Å; P193-L197 PolarHBondContact O-N 2.85Å; Y194-L197 PolarHBondContact O-N 2.87Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 2.98Å; L197-L200 HydrophobicContact CD2-CD1 4.43Å; L197-L200 PolarHBondContact O-N 2.77Å; L197-A201 PolarHBondContact O-N 2.92Å
198S93.8Very high94Very high1 Ų145.8 Ų45.81%0.00723%0.231CC..Hα-helixtrans-62.1-39.6173.3-70.10000112.2S139 Y194 A195 V196 A201 I202S139-S198 PolarHBondContact OG-OG 2.89Å; Y194-S198 PolarHBondContact O-N 2.81Å; Y194-S198 PolarHBondContact O-OG 2.9Å; A195-S198 PolarHBondContact O-N 2.98Å; V196-S198 VanDerWaalsContact C-N 3.33Å; V196-S198 PolarHBondContact O-N 3.38Å; S198-A201 PolarHBondContact O-N 3.31Å; S198-I202 WeakPolarHBondContact O-CG1 3.35Å; S198-I202 PolarHBondContact O-N 2.82Å
199L94.9Very high93.5Very high101 Ų10147.3 Ų47.353%0.52924%0.242SC..Hα-helixtrans-69.7-37174.8-66.5175.6000112.6A140 A195 V196 L197 A201 I202 L203A140-L199 HydrophobicContact CB-CD2 4.09Å; A140-L199 HydrophobicContact CB-CG 4.35Å; A195-L199 WeakPolarHBondContact O-CG 3.27Å; A195-L199 PolarHBondContact O-N 2.98Å; V196-L199 PolarHBondContact O-N 2.82Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 2.98Å; L199-A201 VanDerWaalsContact C-N 3.32Å; L199-A201 PolarHBondContact O-N 2.84Å; L199-I202 HydrophobicContact CD2-CD1 4.26Å; L199-I202 WeakPolarHBondContact O-CB 3.39Å; L199-I202 PolarHBondContact O-N 2.79Å; L199-L203 PolarHBondContact O-N 2.79Å
200L94.8Very high93.1Very high73 Ų7347.1 Ų47.138%0.38224%0.242SC..Hα-helixtrans-64.7-36.5175.3-72.6174.2000112L16 V196 L197 I202 L203 L204L16-L200 HydrophobicContact CD1-CB 4.1Å; V196-L200 HydrophobicContact CG1-CD1 4.13Å; V196-L200 HydrophobicContact CG1-CG 4.37Å; V196-L200 WeakPolarHBondContact O-CG 3.44Å; V196-L200 PolarHBondContact O-N 2.86Å; L197-L200 HydrophobicContact CD2-CD1 4.43Å; L197-L200 PolarHBondContact O-N 2.77Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 PolarHBondContact O-N 2.82Å; L200-L203 HydrophobicContact CD2-CD2 4.29Å; L200-L203 PolarHBondContact O-N 3.18Å; L200-L204 WeakPolarHBondContact O-CG 3.44Å; L200-L204 PolarHBondContact O-N 3.46Å
201A92.4Very high92.6Very high0 Ų048.2 Ų48.20%026%0.255CS..Hα-helixtrans-61.3-42.1173.600000111.9T17 L197 S198 L199 L204 V205T17-A201 HydrophobicContact CG2-CB 3.6Å; L197-A201 PolarHBondContact O-N 2.92Å; S198-A201 PolarHBondContact O-N 3.31Å; L199-A201 VanDerWaalsContact C-N 3.32Å; L199-A201 PolarHBondContact O-N 2.84Å; A201-L204 PolarHBondContact O-N 3.12Å; A201-V205 PolarHBondContact O-N 3.1Å
202I92.9Very high91.9Very high32 Ų3249.4 Ų49.416%0.16426%0.264CS..Hα-helixtrans-60.3-47.7173-63.6169.6000110.3Y133 S137 S198 L199 L200 L204 V205 Y206Y133-I202 HydrophobicContact CD1-CG2 3.86Å; Y133-I202 HydrophobicContact CE1-CG2 4.23Å; S137-I202 WeakPolarHBondContact OG-CD1 3.42Å; S198-I202 WeakPolarHBondContact O-CG1 3.35Å; S198-I202 PolarHBondContact O-N 2.82Å; L199-I202 HydrophobicContact CD2-CD1 4.26Å; L199-I202 WeakPolarHBondContact O-CB 3.39Å; L199-I202 PolarHBondContact O-N 2.79Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 PolarHBondContact O-N 2.82Å; I202-L204 VanDerWaalsContact C-N 3.34Å; I202-L204 PolarHBondContact O-N 2.83Å; I202-V205 PolarHBondContact O-N 3.32Å; I202-Y206 VanDerWaalsContact O-CB 3.32Å; I202-Y206 WeakPolarHBondContact O-CB 2.96Å; I202-Y206 PolarHBondContact O-N 2.89Å
203L93.1Very high91Very high84 Ų8452 Ų5244%0.4427%0.27SS..Hα-helixtrans-59.1-43.8-179.3179.563.5000111.9L199 L200 V205 Y206 L207L199-L203 PolarHBondContact O-N 2.79Å; L200-L203 HydrophobicContact CD2-CD2 4.29Å; L200-L203 PolarHBondContact O-N 3.18Å; L203-V205 PolarHBondContact O-N 3.25Å; L203-Y206 WeakPolarHBondContact O-CB 3.15Å; L203-Y206 PolarHBondContact O-N 3.42Å; L203-L207 HydrophobicContact CD1-CD1 4.41Å; L203-L207 HydrophobicContact CD1-CG 4.27Å; L203-L207 HydrophobicContact CG-CD1 4.2Å; L203-L207 HydrophobicContact CG-CG 4.47Å; L203-L207 VanDerWaalsContact O-CG 3.28Å; L203-L207 WeakPolarHBondContact O-CG 3.46Å; L203-L207 PolarHBondContact O-N 2.76Å
204L91.9Very high90.2Very high34 Ų3451.9 Ų51.918%0.17827%0.268CS..Hα-helixtrans-61.5-45.1178.4-74.1-175.2000112.4Y9 L12 L16 L200 A201 I202 Y206 L207 Y208Y9-L204 HydrophobicContact CD1-CB 4.48Å; Y9-L204 HydrophobicContact CD1-CD2 4.43Å; Y9-L204 WeakPolarHBondContact CD1-O 2.98Å; L12-L204 HydrophobicContact CB-CD1 3.76Å; L16-L204 HydrophobicContact CD1-CD1 3.47Å; L16-L204 VanDerWaalsContact CD1-CD1 3.47Å; L16-L204 HydrophobicContact CD1-CG 4.31Å; L16-L204 HydrophobicContact CG-CD1 4.49Å; L200-L204 WeakPolarHBondContact O-CG 3.44Å; L200-L204 PolarHBondContact O-N 3.46Å; A201-L204 PolarHBondContact O-N 3.12Å; I202-L204 VanDerWaalsContact C-N 3.34Å; I202-L204 PolarHBondContact O-N 2.83Å; L204-Y206 VanDerWaalsContact C-N 3.32Å; L204-L207 PolarHBondContact O-N 3.18Å; L204-Y208 PolarHBondContact O-N 3.02Å; L204-Y208 VanDerWaalsContact O-N 3.12Å
205V90.3Very high89.3Confident1 Ų156.9 Ų56.91%0.00629%0.291CS..Hα-helixtrans-69.2-35.2178.8176.20000111F10 P129 V132 Y133 A201 I202 L203 Y208 D209F10-V205 HydrophobicContact CE1-CG1 4.36Å; F10-V205 HydrophobicContact CE1-CG2 4.39Å; F10-V205 HydrophobicContact CZ-CG1 4.42Å; P129-V205 HydrophobicContact CB-CG1 3.68Å; P129-V205 HydrophobicContact CG-CG1 4.4Å; V132-V205 HydrophobicContact CB-CG1 4.44Å; V132-V205 HydrophobicContact CB-CG2 4.23Å; V132-V205 HydrophobicContact CG1-CB 4.42Å; V132-V205 HydrophobicContact CG1-CG2 3.83Å; V132-V205 HydrophobicContact CG2-CG2 4.37Å; Y133-V205 HydrophobicContact CD1-CG1 4.44Å; Y133-V205 HydrophobicContact CE1-CB 3.88Å; Y133-V205 HydrophobicContact CE1-CG1 3.67Å; Y133-V205 PolarHBondContact OH-O 3.29Å; A201-V205 PolarHBondContact O-N 3.1Å; I202-V205 PolarHBondContact O-N 3.32Å; L203-V205 PolarHBondContact O-N 3.25Å; V205-Y208 PolarHBondContact O-N 2.79Å; V205-D209 WeakPolarHBondContact O-CB 3.48Å; V205-D209 PolarHBondContact O-N 2.96Å
206Y90.9Very high88.5Confident119 Ų11963.4 Ų63.447%0.46731%0.314SS..Hα-helixtrans-61.8-45.9173176.2-96.2000112.7Y133 I202 L203 L204 Y208 D209 H210Y133-Y206 WeakPolarHBondContact OH-CA 3.22Å; Y133-Y206 PolarHBondContact OH-N 3.19Å; I202-Y206 VanDerWaalsContact O-CB 3.32Å; I202-Y206 WeakPolarHBondContact O-CB 2.96Å; I202-Y206 PolarHBondContact O-N 2.89Å; L203-Y206 WeakPolarHBondContact O-CB 3.15Å; L203-Y206 PolarHBondContact O-N 3.42Å; L204-Y206 VanDerWaalsContact C-N 3.32Å; Y206-Y208 VanDerWaalsContact C-N 3.3Å; Y206-Y208 PolarHBondContact O-N 2.61Å; Y206-D209 PolarHBondContact O-N 3.19Å; Y206-H210 VanDerWaalsContact O-CB 3.28Å; Y206-H210 WeakPolarHBondContact O-CB 3.48Å; Y206-H210 PolarHBondContact O-N 2.86Å
207L89.9Confident87.5Confident78 Ų7867.6 Ų67.641%0.40832%0.321SS..Hα-helixtrans-61.9-39.9177-70.4172.7000111.6Y9 L203 L204 A211Y9-L207 HydrophobicContact CE1-CB 4.3Å; L203-L207 HydrophobicContact CD1-CD1 4.41Å; L203-L207 HydrophobicContact CD1-CG 4.27Å; L203-L207 HydrophobicContact CG-CD1 4.2Å; L203-L207 HydrophobicContact CG-CG 4.47Å; L203-L207 VanDerWaalsContact O-CG 3.28Å; L203-L207 WeakPolarHBondContact O-CG 3.46Å; L203-L207 PolarHBondContact O-N 2.76Å; L204-L207 PolarHBondContact O-N 3.18Å; L207-A211 VanDerWaalsContact O-CB 3.23Å; L207-A211 WeakPolarHBondContact O-CB 3.17Å; L207-A211 PolarHBondContact O-N 3.06Å
208Y89.2Confident86.5Confident34 Ų3471.8 Ų71.813%0.13334%0.34CS..Hα-helixtrans-62.5-49.9173.5165.7-98.7000112.1K6 Y9 F10 L204 V205 Y206 H210 A211 A212K6-Y208 HydrophobicContact CB-CE2 3.57Å; K6-Y208 HydrophobicContact CG-CE1 4.42Å; K6-Y208 HydrophobicContact CG-CE2 3.96Å; K6-Y208 WeakPolarHBondContact CG-OH 3.5Å; Y9-Y208 HydrophobicContact CD2-CD2 4.14Å; F10-Y208 AromaticContact CE2-CD1 3.83Å; F10-Y208 HydrophobicContact CE2-CD1 3.83Å; F10-Y208 AromaticContact CE2-CE1 3.64Å; F10-Y208 HydrophobicContact CE2-CE1 3.64Å; F10-Y208 HydrophobicContact CZ-CD1 4.43Å; F10-Y208 HydrophobicContact CZ-CE1 4.37Å; L204-Y208 PolarHBondContact O-N 3.02Å; L204-Y208 VanDerWaalsContact O-N 3.12Å; V205-Y208 PolarHBondContact O-N 2.79Å; Y206-Y208 VanDerWaalsContact C-N 3.3Å; Y206-Y208 PolarHBondContact O-N 2.61Å; Y208-H210 VanDerWaalsContact C-N 3.32Å; Y208-H210 PolarHBondContact O-N 3Å; Y208-A211 PolarHBondContact O-N 2.04Å; Y208-A212 WeakPolarHBondContact O-CB 3.08Å; Y208-A212 PolarHBondContact O-N 2.85Å
209D86.6Confident85.3Confident67 Ų6778.2 Ų78.236%0.35837%0.37SS..Hα-helixtrans-63.1-41.3-177.6-168.548.7000111P129 V205 Y206 A212 Y213P129-D209 HydrophobicContact CG-CB 4.37Å; V205-D209 WeakPolarHBondContact O-CB 3.48Å; V205-D209 PolarHBondContact O-N 2.96Å; Y206-D209 PolarHBondContact O-N 3.19Å; D209-A212 PolarHBondContact O-N 2.8Å; D209-Y213 VanDerWaalsContact O-CB 3.24Å; D209-Y213 WeakPolarHBondContact O-CB 3.44Å; D209-Y213 PolarHBondContact O-N 2.96Å
210H86.9Confident83.9Confident93 Ų9380.7 Ų80.743%0.43138%0.379SS..Hα-helixtrans-64.9-43.8175.1-168.673.6000112.6Y206 Y208 Y213 T214Y206-H210 VanDerWaalsContact O-CB 3.28Å; Y206-H210 WeakPolarHBondContact O-CB 3.48Å; Y206-H210 PolarHBondContact O-N 2.86Å; Y208-H210 VanDerWaalsContact C-N 3.32Å; Y208-H210 PolarHBondContact O-N 3Å; H210-Y213 PolarHBondContact O-N 2.82Å; H210-T214 WeakPolarHBondContact O-CB 3.1Å; H210-T214 WeakPolarHBondContact O-CG2 3.2Å; H210-T214 PolarHBondContact O-N 2.95Å; H210-T214 PolarHBondContact O-OG1 3.41Å
211A84.6Confident82.2Confident47 Ų4785.4 Ų85.439%0.38839%0.392SS..Hα-helixtrans-64.8-39.817600000112L207 Y208 T214 H215L207-A211 VanDerWaalsContact O-CB 3.23Å; L207-A211 WeakPolarHBondContact O-CB 3.17Å; L207-A211 PolarHBondContact O-N 3.06Å; Y208-A211 PolarHBondContact O-N 2.04Å; A211-T214 WeakPolarHBondContact CA-OG1 3.47Å; A211-T214 PolarHBondContact O-OG1 2.92Å; A211-H215 WeakPolarHBondContact O-CB 3.31Å; A211-H215 PolarHBondContact O-N 3.22Å; A211-H215 VanDerWaalsContact O-N 3.12Å
212A81.7Confident80.3Confident25 Ų2590.3 Ų90.321%0.20742%0.423CS..Hα-helixtrans-67.6-41176.300000111.7Y208 D209 R216Y208-A212 WeakPolarHBondContact O-CB 3.08Å; Y208-A212 PolarHBondContact O-N 2.85Å; D209-A212 PolarHBondContact O-N 2.8Å; A212-R216 WeakPolarHBondContact O-CG 3.2Å; A212-R216 PolarHBondContact O-N 3.02Å; A212-R216 VanDerWaalsContact O-N 3.1Å
213Y77.6Confident78.5Confident136 Ų13695.1 Ų95.153%0.53346%0.455SS..Hα-helixtrans-64.4-46.6177177.5-98.3000112.2D209 H210 H215 R216 R217D209-Y213 VanDerWaalsContact O-CB 3.24Å; D209-Y213 WeakPolarHBondContact O-CB 3.44Å; D209-Y213 PolarHBondContact O-N 2.96Å; H210-Y213 PolarHBondContact O-N 2.82Å; Y213-H215 PolarHBondContact O-N 2.97Å; Y213-R216 PolarHBondContact O-N 2.98Å; Y213-R217 WeakPolarHBondContact O-CB 3.43Å; Y213-R217 PolarHBondContact O-N 2.75Å
214T78.1Confident76.7Confident50 Ų5099.6 Ų99.631%0.30747%0.473SS..Hα-helixtrans-60.9-44.4177.845.10000111.6H210 A211 R216 R217 E218H210-T214 WeakPolarHBondContact O-CB 3.1Å; H210-T214 WeakPolarHBondContact O-CG2 3.2Å; H210-T214 PolarHBondContact O-N 2.95Å; H210-T214 PolarHBondContact O-OG1 3.41Å; A211-T214 WeakPolarHBondContact CA-OG1 3.47Å; A211-T214 PolarHBondContact O-OG1 2.92Å; T214-R216 PolarHBondContact O-N 3.03Å; T214-R217 PolarHBondContact O-N 3.32Å; T214-E218 WeakPolarHBondContact O-CG 3.43Å; T214-E218 PolarHBondContact O-N 2.83Å
215H78.2Confident74.8Confident105 Ų105104.9 Ų104.949%0.48650%0.502SS..Hα-helixtrans-62.6-41.7177-166.8-80.6000113.1A211 Y213 R217 E218 Q219A211-H215 WeakPolarHBondContact O-CB 3.31Å; A211-H215 PolarHBondContact O-N 3.22Å; A211-H215 VanDerWaalsContact O-N 3.12Å; Y213-H215 PolarHBondContact O-N 2.97Å; H215-R217 VanDerWaalsContact C-N 3.34Å; H215-R217 PolarHBondContact O-N 3.02Å; H215-E218 PolarHBondContact O-N 2.79Å; H215-Q219 VanDerWaalsContact CE1-CD 3.4Å; H215-Q219 PolarHBondContact CE1-NE2 3.33Å; H215-Q219 VanDerWaalsContact CE1-NE2 3.27Å; H215-Q219 PolarHBondContact ND1-OE1 2.69Å; H215-Q219 WeakPolarHBondContact O-CG 3.46Å; H215-Q219 PolarHBondContact O-N 3.31Å
216R78.1Confident73.3Confident147 Ų147108.4 Ų108.456%0.55553%0.531SS*.Hα-helixtrans-61-44.5174.4-74.2179.4-173.7-171.92111.4A212 Y213 T214 E218 Q219 E220A212-R216 WeakPolarHBondContact O-CG 3.2Å; A212-R216 PolarHBondContact O-N 3.02Å; A212-R216 VanDerWaalsContact O-N 3.1Å; Y213-R216 PolarHBondContact O-N 2.98Å; T214-R216 PolarHBondContact O-N 3.03Å; R216-E218 VanDerWaalsContact C-N 3.28Å; R216-E218 PolarHBondContact O-N 2.72Å; R216-Q219 PolarHBondContact O-N 2.9Å; R216-E220 WeakPolarHBondContact O-CB 3.41Å; R216-E220 VanDerWaalsContact O-CG 3.32Å; R216-E220 WeakPolarHBondContact O-CG 3.48Å; R216-E220 PolarHBondContact O-N 2.76Å
217R75.5Confident71.6Confident162 Ų162106.9 Ų106.961%0.61154%0.536SS*.Hα-helixtrans-65.8-30.7179.4-164.8177.5177.8-171.50.1113Y213 T214 H215 R221Y213-R217 WeakPolarHBondContact O-CB 3.43Å; Y213-R217 PolarHBondContact O-N 2.75Å; T214-R217 PolarHBondContact O-N 3.32Å; H215-R217 VanDerWaalsContact C-N 3.34Å; H215-R217 PolarHBondContact O-N 3.02Å; R217-R221 PolarHBondContact O-N 3Å
218E74.6Confident69.9Low119 Ų119112.5 Ų112.556%0.55656%0.557SS**Hα-helixtrans-72.4-37.2173.2-74.5177.4178.700112.4T214 H215 R216 R221T214-E218 WeakPolarHBondContact O-CG 3.43Å; T214-E218 PolarHBondContact O-N 2.83Å; H215-E218 PolarHBondContact O-N 2.79Å; R216-E218 VanDerWaalsContact C-N 3.28Å; R216-E218 PolarHBondContact O-N 2.72Å; E218-R221 PolarHBondContact O-N 2.87Å
219Q68.4Low68.4Low135 Ų135119.7 Ų119.763%0.63159%0.591SS**Hα-helixtrans-71.8-29.1173.9-69.4-178.9-46.700113.1H215 R216 R221H215-Q219 VanDerWaalsContact CE1-CD 3.4Å; H215-Q219 PolarHBondContact CE1-NE2 3.33Å; H215-Q219 VanDerWaalsContact CE1-NE2 3.27Å; H215-Q219 PolarHBondContact ND1-OE1 2.69Å; H215-Q219 WeakPolarHBondContact O-CG 3.46Å; H215-Q219 PolarHBondContact O-N 3.31Å; R216-Q219 PolarHBondContact O-N 2.9Å; Q219-R221 VanDerWaalsContact C-N 3.31Å
220E66.4Low66.9Low154 Ų154123.2 Ų123.272%0.7261%0.609SS**THydrogen-bonded Turntrans-83.60175.7-71170.9-174.100113.3R216R216-E220 WeakPolarHBondContact O-CB 3.41Å; R216-E220 VanDerWaalsContact O-CG 3.32Å; R216-E220 WeakPolarHBondContact O-CG 3.48Å; R216-E220 PolarHBondContact O-N 2.76Å
221R58.2Low65.4Low171 Ų171127.1 Ų127.165%0.64563%0.63SS**SBendtrans-62.2142.2169.5-74-169.8-171.9-172.26.6109.2R217 E218 Q219 T223R217-R221 PolarHBondContact O-N 3Å; E218-R221 PolarHBondContact O-N 2.87Å; Q219-R221 VanDerWaalsContact C-N 3.31Å; R221-T223 VanDerWaalsContact C-N 3.3Å; R221-T223 PolarHBondContact O-N 3.27Å
222P53.7Low63.8Low103 Ų103133 Ų13367%0.66965%0.651SS**SBendtrans-73.281.5-164.131.9-35.7000110.7E224 D225P222-E224 VanDerWaalsContact C-N 3.28Å; P222-D225 HydrophobicContact CB-CB 4.49Å
223T55.4Low62.4Low134 Ų134146.5 Ų146.582%0.82270%0.699SS**SBendtrans-94.18.7158.349.40000111.5R221R221-T223 VanDerWaalsContact C-N 3.3Å; R221-T223 PolarHBondContact O-N 3.27Å
224E54.2Low61.6Low178 Ų178147.1 Ų147.183%0.83271%0.707SS**SBendtrans-132.113.5-179.5-136178.3177.200114.8P222 A226P222-E224 VanDerWaalsContact C-N 3.28Å; E224-A226 PolarHBondContact O-N 3.38Å
225D51.4Low60.7Low145 Ų145152.2 Ų152.278%0.77573%0.728SS**  trans-92.651.5154.9-83.8-30.2000108.9P222 P227P222-D225 HydrophobicContact CB-CB 4.49Å; D225-P227 VanDerWaalsContact O-CD 3.3Å; D225-P227 WeakPolarHBondContact O-CD 2.97Å
226A59.1Low59.8Low74 Ų74154.8 Ų154.861%0.61274%0.742SS**  trans-78.7111.8155.600000105.6E224 K228E224-A226 PolarHBondContact O-N 3.38Å; A226-K228 PolarHBondContact O-N 3.22Å
227P55.6Low58.7Low88 Ų88155.2 Ų155.257%0.57175%0.753SS**  trans-56.5116.5177.721.8-31.1000108.5D225 E229 I230D225-P227 VanDerWaalsContact O-CD 3.3Å; D225-P227 WeakPolarHBondContact O-CD 2.97Å; P227-E229 PolarHBondContact O-N 3.33Å; P227-I230 HydrophobicContact CG-CD1 4.35Å
228K55.2Low57.6Low196 Ų196154.8 Ų154.885%0.85276%0.761SS**G310 helixtrans-64.25175.1-82.6-178.5176.8172.10113.4A226A226-K228 PolarHBondContact O-N 3.22Å
229E56.6Low56.5Low184 Ų184157.2 Ų157.286%0.8678%0.775SS**G310 helixtrans-84.7-1.5-176.2-63.6-168.4167.500114.6P227P227-E229 PolarHBondContact O-N 3.33Å
230I55.8Low55.6Low142 Ų142158.8 Ų158.873%0.72879%0.785SS**G310 helixtrans-110.58.5-177.2-28.2179000113.8P227P227-I230 HydrophobicContact CG-CD1 4.35Å
231M55.1Low54.8Low175 Ų175159.2 Ų159.286%0.86279%0.791SS**SBendtrans-105.820.9176.4-70.7-149.9-64.500114.6
232M51.8Low54.5Low169 Ų169158.2 Ų158.283%0.83380%0.803SS**  trans-125.576.3165.1-71.1-164.3-145.800110.6
233Y50.5Low54.6Low310 Ų310163.2 Ų163.2100%1.21682%0.815SS**  trans-151.50148.3-82.5-67.8000109.6

Retrieved 233 of 233 residues in 367 ms (Link to these results)

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