A0A077ZBX5_TRITR Loading...

Alpha-1,3-glucosyltransferase

AlphaFold DB , UniProt , Accession A0A077ZBX5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 491 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
1M36.8Very low43Very low241 Ų241145.5 Ų145.5100%1.18780%0.8SS**  096.20-72.2-178.1175.100108.8
2P40.6Very low45.3Very low130 Ų130140.1 Ų140.184%0.84477%0.769SS**  trans-90.9122.8161.422.1-6000108.5
3S44.6Very low47Very low114 Ų114135.4 Ų135.480%0.79775%0.747SS**  trans-49.6134.6177.948.60000112.5S5S3-S5 PolarHBondContact O-N 3.13Å; S3-S5 VanDerWaalsContact O-N 3.13Å
4R39.2Very low49Very low240 Ų240136 Ų13691%0.90674%0.738SS**  trans-38.7115.4167.4-73.1175.5172.4167.8-4.2110.6V6R4-V6 PolarHBondContact O-N 3.13Å; R4-V6 VanDerWaalsContact O-N 3.16Å
5S40.7Very low51.2Low103 Ų103132.9 Ų132.972%0.7272%0.721SS**  trans-54.4116157.847.90000107.1S3 D7S3-S5 PolarHBondContact O-N 3.13Å; S3-S5 VanDerWaalsContact O-N 3.13Å; S5-D7 PolarHBondContact O-N 3.16Å; S5-D7 VanDerWaalsContact O-N 3.13Å
6V43.9Very low53.5Low130 Ų130128.6 Ų128.679%0.78870%0.7SS**  trans-51.1119.3168174.80000106.9R4 Q8R4-V6 PolarHBondContact O-N 3.13Å; R4-V6 VanDerWaalsContact O-N 3.16Å; V6-Q8 PolarHBondContact O-N 2.79Å
7D37.2Very low55.8Low146 Ų146122 Ų12278%0.78166%0.663SS**  trans-56.388.6170.8-69.2-51000108.4S5 V9S5-D7 PolarHBondContact O-N 3.16Å; S5-D7 VanDerWaalsContact O-N 3.13Å; D7-V9 PolarHBondContact O-N 2.82Å
8Q41.3Very low58Low170 Ų170120 Ų12079%0.79466%0.655SS**  trans-66.594.5155.5-81.9-174.2-22.600104.9V6 V10V6-Q8 PolarHBondContact O-N 2.79Å; Q8-V10 PolarHBondContact O-N 2.75Å
9V44.9Very low59.9Low118 Ų118118.3 Ų118.372%0.71565%0.648SS**  trans-54.896.3159.2179.40000105.2D7 V11D7-V9 PolarHBondContact O-N 2.82Å; V9-V11 HydrophobicContact CG1-CG2 3.99Å; V9-V11 PolarHBondContact O-N 2.95Å
10V48.4Very low61.7Low128 Ų128112.7 Ų112.778%0.77662%0.618SS**  trans-69.384.8169.3-178.80000104.5Q8 D12Q8-V10 PolarHBondContact O-N 2.75Å; V10-D12 PolarHBondContact O-N 3.1Å; V10-D12 VanDerWaalsContact O-N 3.1Å
11V55.8Low63.4Low81 Ų81108.6 Ų108.649%0.49160%0.597SS.*  trans-55.9117.6170.7178.70000105.6V9 V13 D15 V16V9-V11 HydrophobicContact CG1-CG2 3.99Å; V9-V11 PolarHBondContact O-N 2.95Å; V11-V13 PolarHBondContact O-N 3.04Å; V11-D15 HydrophobicContact CG1-CB 3.97Å; V11-V16 HydrophobicContact CG1-CG2 3.66Å
12D69.8Low66.3Low80 Ų80101.2 Ų101.243%0.42857%0.565SS.*  trans-59.9134.9178.4-171.1-27.5000106.7V10 K14 D15 V16V10-D12 PolarHBondContact O-N 3.1Å; V10-D12 VanDerWaalsContact O-N 3.1Å; D12-K14 PolarHBondContact O-N 3.34Å; D12-K14 PolarHBondContact OD1-N 3.3Å; D12-D15 WeakPolarHBondContact CB-OD2 3.43Å; D12-D15 PolarHBondContact N-OD2 3.23Å; D12-D15 WeakPolarHBondContact O-CA 3.44Å; D12-D15 VanDerWaalsContact O-CB 3.26Å; D12-D15 WeakPolarHBondContact O-CB 3.26Å; D12-D15 PolarHBondContact O-N 3.41Å; D12-V16 PolarHBondContact O-N 2.81Å
13V68.4Low68.9Low79 Ų7998 Ų9848%0.47954%0.543SS..Hα-helixtrans-55.8-26.2179.4172.20000111.3V11 F17 M151V11-V13 PolarHBondContact O-N 3.04Å; V13-F17 PolarHBondContact O-N 3.04Å; V13-M151 HydrophobicContact CG1-CB 3.05Å; V13-M151 HydrophobicContact CG1-CE 4.07Å; V13-M151 HydrophobicContact CG1-CG 3.33Å
14K74.4Confident71.5Confident144 Ų14492.6 Ų92.663%0.62651%0.505SS*.Hα-helixtrans-66.4-40.5170-66.4-179.4-179.8173.90113.1D12 V16 F17 V18D12-K14 PolarHBondContact O-N 3.34Å; D12-K14 PolarHBondContact OD1-N 3.3Å; K14-V16 PolarHBondContact O-N 3.32Å; K14-F17 PolarHBondContact O-N 2.85Å; K14-F17 VanDerWaalsContact O-N 3.11Å; K14-V18 PolarHBondContact O-N 3.28Å; K14-V18 VanDerWaalsContact O-N 3.1Å
15D82.7Confident74.3Confident89 Ų8983 Ų8348%0.47647%0.471SS..Hα-helixtrans-61.3-38.3178.5-59-26.5000110.2V11 D12 F17 V18 V19V11-D15 HydrophobicContact CG1-CB 3.97Å; D12-D15 WeakPolarHBondContact CB-OD2 3.43Å; D12-D15 PolarHBondContact N-OD2 3.23Å; D12-D15 WeakPolarHBondContact O-CA 3.44Å; D12-D15 VanDerWaalsContact O-CB 3.26Å; D12-D15 WeakPolarHBondContact O-CB 3.26Å; D12-D15 PolarHBondContact O-N 3.41Å; D15-F17 VanDerWaalsContact C-N 3.33Å; D15-F17 PolarHBondContact O-N 3.45Å; D15-V18 PolarHBondContact O-N 3.14Å; D15-V19 WeakPolarHBondContact O-CG2 3.32Å; D15-V19 PolarHBondContact O-N 3.1Å
16V87.8Confident77Confident64 Ų6480 Ų8039%0.38845%0.453SS..Hα-helixtrans-63.9-37.4176.9-165.90000111.9V11 D12 K14 V19 A20 I155V11-V16 HydrophobicContact CG1-CG2 3.66Å; D12-V16 PolarHBondContact O-N 2.81Å; K14-V16 PolarHBondContact O-N 3.32Å; V16-V19 PolarHBondContact O-N 3.11Å; V16-A20 PolarHBondContact O-N 3.35Å; V16-A20 VanDerWaalsContact O-N 3.12Å; V16-I155 HydrophobicContact CB-CD1 3.97Å; V16-I155 HydrophobicContact CG1-CD1 3.67Å
17F92.7Very high79.6Confident17 Ų1775 Ų758%0.07542%0.422CS..Hα-helixtrans-67.8-40.2176-167.9-82.6000111.4V13 K14 D15 V19 A20 V21 I139 V142 L143 M151 K154 I155 Y158V13-F17 PolarHBondContact O-N 3.04Å; K14-F17 PolarHBondContact O-N 2.85Å; K14-F17 VanDerWaalsContact O-N 3.11Å; D15-F17 VanDerWaalsContact C-N 3.33Å; D15-F17 PolarHBondContact O-N 3.45Å; F17-V19 VanDerWaalsContact C-N 3.29Å; F17-V19 PolarHBondContact O-N 3.15Å; F17-A20 WeakPolarHBondContact O-CB 3.06Å; F17-A20 PolarHBondContact O-N 3.15Å; F17-A20 VanDerWaalsContact O-N 3.1Å; F17-V21 HydrophobicContact CD1-CG2 4.02Å; F17-V21 HydrophobicContact CE1-CG2 3.76Å; F17-V21 PolarHBondContact O-N 3.37Å; F17-V21 VanDerWaalsContact O-N 3.08Å; F17-I139 HydrophobicContact CE1-CB 4.32Å; F17-I139 HydrophobicContact CE1-CG1 3.95Å; F17-I139 HydrophobicContact CE1-CG2 3.69Å; F17-I139 HydrophobicContact CZ-CB 4.4Å; F17-I139 HydrophobicContact CZ-CG1 4.21Å; F17-I139 HydrophobicContact CZ-CG2 3.99Å; F17-V142 HydrophobicContact CE2-CG2 3.89Å; F17-V142 HydrophobicContact CZ-CG2 3.84Å; F17-L143 HydrophobicContact CD2-CD2 4.36Å; F17-L143 HydrophobicContact CE2-CD2 4.08Å; F17-L143 HydrophobicContact CZ-CD2 4.28Å; F17-L143 HydrophobicContact CZ-CG 4.37Å; F17-M151 HydrophobicContact CB-SD 4.27Å; F17-M151 HydrophobicContact CD2-SD 3.86Å; F17-M151 HydrophobicContact CG-SD 4.37Å; F17-K154 HydrophobicContact CE2-CB 4.49Å; F17-I155 HydrophobicContact CB-CD1 4.4Å; F17-I155 HydrophobicContact CB-CG1 4.25Å; F17-I155 HydrophobicContact CD2-CG1 3.63Å; F17-I155 HydrophobicContact CE2-CG1 4.42Å; F17-I155 HydrophobicContact CG-CG1 4.33Å; F17-Y158 HydrophobicContact CE2-CG 4.49Å; F17-Y158 HydrophobicContact CZ-CD2 4.23Å; F17-Y158 HydrophobicContact CZ-CG 4.16Å
18V94.4Very high82.5Confident86 Ų8668.1 Ų68.152%0.52139%0.385SS..Hα-helixtrans-60.1-41.9174.3175.70000110.7K14 D15 A20 V21 V22K14-V18 PolarHBondContact O-N 3.28Å; K14-V18 VanDerWaalsContact O-N 3.1Å; D15-V18 PolarHBondContact O-N 3.14Å; V18-A20 VanDerWaalsContact C-N 3.29Å; V18-A20 PolarHBondContact O-N 2.77Å; V18-V21 WeakPolarHBondContact O-CB 3.47Å; V18-V21 PolarHBondContact O-N 3.41Å; V18-V21 VanDerWaalsContact O-N 3.14Å; V18-V22 HydrophobicContact CG1-CG2 4.38Å; V18-V22 WeakPolarHBondContact O-CG2 3.2Å; V18-V22 PolarHBondContact O-N 2.83Å
19V95Very high85.2Confident87 Ų8762.4 Ų62.453%0.52736%0.363SS..Hα-helixtrans-57.8-42.6173.9172.30000111.2D15 V16 F17 V21 V22 V23D15-V19 WeakPolarHBondContact O-CG2 3.32Å; D15-V19 PolarHBondContact O-N 3.1Å; V16-V19 PolarHBondContact O-N 3.11Å; F17-V19 VanDerWaalsContact C-N 3.29Å; F17-V19 PolarHBondContact O-N 3.15Å; V19-V21 VanDerWaalsContact C-N 3.32Å; V19-V21 PolarHBondContact O-N 2.97Å; V19-V22 PolarHBondContact O-N 3.32Å; V19-V23 HydrophobicContact CG1-CG2 4.26Å; V19-V23 WeakPolarHBondContact O-CB 3.39Å; V19-V23 VanDerWaalsContact O-CG2 3.29Å; V19-V23 WeakPolarHBondContact O-CG2 3.29Å; V19-V23 PolarHBondContact O-N 3.12Å
20A95.7Very high87.7Confident6 Ų661.9 Ų61.95%0.0536%0.356CS..Hα-helixtrans-61.4-39.6176.800000112.5V16 F17 V18 S24 I155 Y158 L159V16-A20 PolarHBondContact O-N 3.35Å; V16-A20 VanDerWaalsContact O-N 3.12Å; F17-A20 WeakPolarHBondContact O-CB 3.06Å; F17-A20 PolarHBondContact O-N 3.15Å; F17-A20 VanDerWaalsContact O-N 3.1Å; V18-A20 VanDerWaalsContact C-N 3.29Å; V18-A20 PolarHBondContact O-N 2.77Å; A20-S24 WeakPolarHBondContact O-CB 3.26Å; A20-S24 PolarHBondContact O-N 3.35Å; A20-S24 VanDerWaalsContact O-N 3.07Å; A20-I155 HydrophobicContact CB-CG2 3.84Å; A20-Y158 HydrophobicContact CB-CD1 4.18Å; A20-Y158 HydrophobicContact CB-CE1 4.43Å; A20-L159 HydrophobicContact CB-CD1 4.33Å; A20-L159 HydrophobicContact CB-CD2 4.05Å; A20-L159 HydrophobicContact CB-CG 4.23Å
21V97.3Very high90Very high27 Ų2756.1 Ų56.116%0.16432%0.322CS..Hα-helixtrans-63.6-47.4174.5177.70000110.8F17 V18 V19 V23 S24 I25 I139 Y158F17-V21 HydrophobicContact CD1-CG2 4.02Å; F17-V21 HydrophobicContact CE1-CG2 3.76Å; F17-V21 PolarHBondContact O-N 3.37Å; F17-V21 VanDerWaalsContact O-N 3.08Å; V18-V21 WeakPolarHBondContact O-CB 3.47Å; V18-V21 PolarHBondContact O-N 3.41Å; V18-V21 VanDerWaalsContact O-N 3.14Å; V19-V21 VanDerWaalsContact C-N 3.32Å; V19-V21 PolarHBondContact O-N 2.97Å; V21-V23 VanDerWaalsContact C-N 3.35Å; V21-V23 PolarHBondContact O-N 3.45Å; V21-S24 WeakPolarHBondContact O-CB 3.39Å; V21-S24 PolarHBondContact O-N 3.14Å; V21-S24 VanDerWaalsContact O-N 3.17Å; V21-I25 HydrophobicContact CG1-CD1 4.05Å; V21-I25 WeakPolarHBondContact O-CG1 3.4Å; V21-I25 PolarHBondContact O-N 3.16Å; V21-I139 HydrophobicContact CG1-CD1 4.27Å; V21-I139 HydrophobicContact CG2-CD1 3.7Å; V21-I139 HydrophobicContact CG2-CG1 4.13Å; V21-Y158 HydrophobicContact CG2-CE1 4.08Å
22V97.3Very high92Very high87 Ų8752.9 Ų52.953%0.52730%0.303SS..Hα-helixtrans-61.4-42.3178.5172.70000111.5V18 V19 S24 I25 A26V18-V22 HydrophobicContact CG1-CG2 4.38Å; V18-V22 WeakPolarHBondContact O-CG2 3.2Å; V18-V22 PolarHBondContact O-N 2.83Å; V19-V22 PolarHBondContact O-N 3.32Å; V22-S24 VanDerWaalsContact C-N 3.32Å; V22-S24 PolarHBondContact O-N 3.37Å; V22-I25 PolarHBondContact O-N 3.13Å; V22-A26 WeakPolarHBondContact O-CB 3.49Å; V22-A26 PolarHBondContact O-N 3.31Å
23V96.7Very high93.2Very high62 Ų6255.5 Ų55.538%0.37632%0.317SS..Hα-helixtrans-59.2-44.5174.9167.20000110.9V19 V21 I25 A26 I27V19-V23 HydrophobicContact CG1-CG2 4.26Å; V19-V23 WeakPolarHBondContact O-CB 3.39Å; V19-V23 VanDerWaalsContact O-CG2 3.29Å; V19-V23 WeakPolarHBondContact O-CG2 3.29Å; V19-V23 PolarHBondContact O-N 3.12Å; V21-V23 VanDerWaalsContact C-N 3.35Å; V21-V23 PolarHBondContact O-N 3.45Å; V23-I25 VanDerWaalsContact C-N 3.34Å; V23-I25 PolarHBondContact O-N 2.91Å; V23-A26 PolarHBondContact O-N 3.48Å; V23-I27 HydrophobicContact CG1-CD1 3.72Å; V23-I27 WeakPolarHBondContact O-CD1 3.38Å; V23-I27 WeakPolarHBondContact O-CG1 3.26Å; V23-I27 PolarHBondContact O-N 3.01Å
24S97.6Very high94.5Very high0 Ų052.3 Ų52.30%030%0.298CS..Hα-helixtrans-62.4-39179.2-1630000112.8A20 V21 V22 R28 T162A20-S24 WeakPolarHBondContact O-CB 3.26Å; A20-S24 PolarHBondContact O-N 3.35Å; A20-S24 VanDerWaalsContact O-N 3.07Å; V21-S24 WeakPolarHBondContact O-CB 3.39Å; V21-S24 PolarHBondContact O-N 3.14Å; V21-S24 VanDerWaalsContact O-N 3.17Å; V22-S24 VanDerWaalsContact C-N 3.32Å; V22-S24 PolarHBondContact O-N 3.37Å; S24-R28 WeakPolarHBondContact O-CD 3.49Å; S24-R28 WeakPolarHBondContact O-CG 3.4Å; S24-R28 PolarHBondContact O-N 3.25Å; S24-R28 PolarHBondContact O-NH1 2.99Å; S24-R28 VanDerWaalsContact O-NH1 3.1Å; S24-R28 PolarHBondContact OG-NH1 3.08Å; S24-T162 WeakPolarHBondContact OG-CB 3.29Å; S24-T162 PolarHBondContact OG-OG1 3.45Å
25I98.3Very high95.6Very high39 Ų3947.4 Ų47.420%0.228%0.28CS..Hα-helixtrans-69.2-45.1174.1-67.1168.7000110.9V21 V22 V23 I27 R28 C29 L127 M131 L135V21-I25 HydrophobicContact CG1-CD1 4.05Å; V21-I25 WeakPolarHBondContact O-CG1 3.4Å; V21-I25 PolarHBondContact O-N 3.16Å; V22-I25 PolarHBondContact O-N 3.13Å; V23-I25 VanDerWaalsContact C-N 3.34Å; V23-I25 PolarHBondContact O-N 2.91Å; I25-I27 VanDerWaalsContact C-N 3.3Å; I25-I27 PolarHBondContact O-N 3.37Å; I25-R28 WeakPolarHBondContact O-CB 3.28Å; I25-R28 PolarHBondContact O-N 3.37Å; I25-C29 PolarHBondContact O-N 3.1Å; I25-C29 PolarHBondContact O-SG 3.44Å; I25-L127 HydrophobicContact CG2-CD1 4.4Å; I25-M131 HydrophobicContact CD1-CE 4.04Å; I25-M131 HydrophobicContact CD1-CG 4.45Å; I25-M131 HydrophobicContact CD1-SD 4.43Å; I25-L135 HydrophobicContact CD1-CD1 4.48Å; I25-L135 HydrophobicContact CG1-CD1 3.78Å
26A98Very high96.3Very high41 Ų4143.6 Ų43.634%0.33926%0.259SS..Hα-helixtrans-61.2-39.4-178.800000111.9V22 V23 C29 N30V22-A26 WeakPolarHBondContact O-CB 3.49Å; V22-A26 PolarHBondContact O-N 3.31Å; V23-A26 PolarHBondContact O-N 3.48Å; A26-C29 PolarHBondContact O-N 3.42Å; A26-N30 PolarHBondContact O-N 2.87Å; A26-N30 PolarHBondContact O-ND2 3.37Å
27I98Very high96.7Very high25 Ų2541.2 Ų41.213%0.12825%0.246CC..Hα-helixtrans-64.5-41.9176.8-69.4161.3000111.1V23 I25 N30 A31 L163 I168 M403 L406V23-I27 HydrophobicContact CG1-CD1 3.72Å; V23-I27 WeakPolarHBondContact O-CD1 3.38Å; V23-I27 WeakPolarHBondContact O-CG1 3.26Å; V23-I27 PolarHBondContact O-N 3.01Å; I25-I27 VanDerWaalsContact C-N 3.3Å; I25-I27 PolarHBondContact O-N 3.37Å; I27-N30 PolarHBondContact O-N 2.6Å; I27-A31 WeakPolarHBondContact O-CB 3.41Å; I27-A31 PolarHBondContact O-N 2.93Å; I27-L163 HydrophobicContact CD1-CD1 4.26Å; I27-L163 HydrophobicContact CD1-CD2 3.49Å; I27-L163 VanDerWaalsContact CD1-CD2 3.49Å; I27-I168 HydrophobicContact CG2-CD1 3.87Å; I27-M403 HydrophobicContact CG2-CE 3.89Å; I27-M403 HydrophobicContact CG2-SD 3.57Å; I27-M403 VanDerWaalsContact CG2-SD 3.57Å; I27-L406 HydrophobicContact CD1-CD2 3.66Å; I27-L406 HydrophobicContact CG1-CD2 4.22Å; I27-L406 HydrophobicContact CG2-CD2 4.33Å
28R98.2Very high96.9Very high0 Ų040.6 Ų40.60%024%0.244CC..Hα-helixtrans-62-42.1174.7-71.8163.4168.357.78.4112.4S24 I25 A31 S32 L127 D130 T162 I168 F172S24-R28 WeakPolarHBondContact O-CD 3.49Å; S24-R28 WeakPolarHBondContact O-CG 3.4Å; S24-R28 PolarHBondContact O-N 3.25Å; S24-R28 PolarHBondContact O-NH1 2.99Å; S24-R28 VanDerWaalsContact O-NH1 3.1Å; S24-R28 PolarHBondContact OG-NH1 3.08Å; I25-R28 WeakPolarHBondContact O-CB 3.28Å; I25-R28 PolarHBondContact O-N 3.37Å; R28-A31 PolarHBondContact O-N 3.14Å; R28-S32 WeakPolarHBondContact O-CB 3.49Å; R28-S32 PolarHBondContact O-N 2.85Å; R28-S32 PolarHBondContact O-OG 3.41Å; R28-L127 HydrophobicContact CB-CD1 4.12Å; R28-D130 VanDerWaalsContact CD-OD2 3.24Å; R28-D130 WeakPolarHBondContact CD-OD2 3.32Å; R28-D130 IonicContact CZ-OD2 2.75Å; R28-D130 IonicContact NE-OD1 2.85Å; R28-D130 IonicContact NE-OD2 3.84Å; R28-D130 PolarHBondContact NE-OD2 3.14Å; R28-D130 IonicContact NH2-OD2 2.58Å; R28-T162 PolarHBondContact NH1-O 3.09Å; R28-T162 PolarHBondContact NH2-O 3.41Å; R28-I168 HydrophobicContact CG-CG1 4.47Å; R28-F172 HydrophobicContact CB-CD1 3.8Å; R28-F172 HydrophobicContact CB-CD2 4.19Å; R28-F172 HydrophobicContact CB-CE1 3.7Å; R28-F172 HydrophobicContact CB-CE2 4.1Å; R28-F172 HydrophobicContact CB-CG 4.02Å; R28-F172 HydrophobicContact CB-CZ 3.84Å; R28-F172 VanDerWaalsContact CD-CZ 3.49Å; R28-F172 HydrophobicContact CG-CD1 4.31Å; R28-F172 HydrophobicContact CG-CD2 3.84Å; R28-F172 HydrophobicContact CG-CE1 4.06Å; R28-F172 HydrophobicContact CG-CE2 3.55Å; R28-F172 HydrophobicContact CG-CG 4.19Å; R28-F172 HydrophobicContact CG-CZ 3.65Å
29C97.8Very high97Very high51 Ų5138.7 Ų38.735%0.34523%0.23SC..Hα-helixtrans-61.8-44.3175.6-63.90000111.3I25 A26 S32I25-C29 PolarHBondContact O-N 3.1Å; I25-C29 PolarHBondContact O-SG 3.44Å; A26-C29 PolarHBondContact O-N 3.42Å; C29-S32 WeakPolarHBondContact O-CB 2.99Å; C29-S32 PolarHBondContact O-N 2.91Å
30N97.2Very high97Very high107 Ų10740.4 Ų40.457%0.57224%0.236SC*.Hα-helixtrans-64.7-42.6176.6-82.1-81.9000112.2A26 I27 S32 L33A26-N30 PolarHBondContact O-N 2.87Å; A26-N30 PolarHBondContact O-ND2 3.37Å; I27-N30 PolarHBondContact O-N 2.6Å; N30-S32 PolarHBondContact O-N 3.44Å; N30-L33 WeakPolarHBondContact O-CB 3.35Å; N30-L33 WeakPolarHBondContact O-CG 3.48Å; N30-L33 PolarHBondContact O-N 2.92Å
31A97.3Very high97Very high7 Ų744.5 Ų44.56%0.05825%0.252CS..Hα-helixtrans-62-30.8175.600000112.5I27 R28 L33 S34 I168 F172 V173I27-A31 WeakPolarHBondContact O-CB 3.41Å; I27-A31 PolarHBondContact O-N 2.93Å; R28-A31 PolarHBondContact O-N 3.14Å; A31-L33 PolarHBondContact O-N 3.45Å; A31-S34 WeakPolarHBondContact O-CB 3.37Å; A31-S34 PolarHBondContact O-N 3.25Å; A31-S34 PolarHBondContact O-OG 3.46Å; A31-I168 HydrophobicContact CB-CG2 3.42Å; A31-I168 VanDerWaalsContact CB-CG2 3.42Å; A31-F172 HydrophobicContact CB-CB 4.12Å; A31-V173 HydrophobicContact CB-CG2 3.99Å
32S96.7Very high96.8Very high13 Ų1347.9 Ų47.99%0.09128%0.275CS..THydrogen-bonded Turntrans-67.4-15.7178.7-61.30000114.9R28 C29 N30 S34 R123 F172R28-S32 WeakPolarHBondContact O-CB 3.49Å; R28-S32 PolarHBondContact O-N 2.85Å; R28-S32 PolarHBondContact O-OG 3.41Å; C29-S32 WeakPolarHBondContact O-CB 2.99Å; C29-S32 PolarHBondContact O-N 2.91Å; N30-S32 PolarHBondContact O-N 3.44Å; S32-S34 PolarHBondContact O-N 3.32Å; S32-R123 PolarHBondContact O-NE 3.33Å; S32-F172 VanDerWaalsContact CA-O 3.3Å; S32-F172 WeakPolarHBondContact CA-O 3.28Å; S32-F172 WeakPolarHBondContact OG-CD1 3.42Å
33L96.1Very high96.6Very high135 Ų13548.8 Ų48.871%0.70728%0.283SS*.THydrogen-bonded Turntrans-71.6-17.8176.4-58.9177.4000112.4N30 A31N30-L33 WeakPolarHBondContact O-CB 3.35Å; N30-L33 WeakPolarHBondContact O-CG 3.48Å; N30-L33 PolarHBondContact O-N 2.92Å; A31-L33 PolarHBondContact O-N 3.45Å
34S95.8Very high96.5Very high12 Ų1249.5 Ų49.58%0.08428%0.283CS..SBendtrans-66.7161.1-179.2-59.30000113.2A31 S32 K119 R123 S399A31-S34 WeakPolarHBondContact O-CB 3.37Å; A31-S34 PolarHBondContact O-N 3.25Å; A31-S34 PolarHBondContact O-OG 3.46Å; S32-S34 PolarHBondContact O-N 3.32Å; S34-K119 WeakPolarHBondContact O-CE 3.19Å; S34-K119 PolarHBondContact O-NZ 3.2Å; S34-R123 PolarHBondContact O-NH2 3.01Å; S34-S399 PolarHBondContact OG-OG 2.9Å
35P96.6Very high96.4Very high40 Ų4051.4 Ų51.426%0.2629%0.291SS..PPolyproline II helixtrans-50.4144.5163.8-28.437.9000112E39 D394P35-E39 WeakPolarHBondContact CA-OE2 3.31Å; P35-E39 WeakPolarHBondContact CB-OE2 3.48Å; P35-D394 WeakPolarHBondContact CB-O 3.45Å
36Y97.1Very high96.2Very high10 Ų1049.8 Ų49.84%0.03928%0.284CS..PPolyproline II helixtrans-98165.8173.350.4-104.3000111G38 E39 Y48 E114 K119Y36-G38 PolarHBondContact O-N 3.37Å; Y36-G38 VanDerWaalsContact O-N 3.12Å; Y36-E39 HydrophobicContact CD2-CB 3.69Å; Y36-E39 HydrophobicContact CD2-CG 4.38Å; Y36-E39 HydrophobicContact CE1-CB 4.36Å; Y36-E39 HydrophobicContact CE1-CG 4.02Å; Y36-E39 WeakPolarHBondContact CE1-OE1 3.48Å; Y36-E39 VanDerWaalsContact CE2-CA 3.41Å; Y36-E39 HydrophobicContact CE2-CB 3.47Å; Y36-E39 VanDerWaalsContact CE2-CB 3.47Å; Y36-E39 HydrophobicContact CE2-CG 3.83Å; Y36-E39 HydrophobicContact CG-CB 4.23Å; Y36-E39 PolarHBondContact O-N 3.37Å; Y36-Y48 AromaticContact CD1-CD2 3.91Å; Y36-Y48 HydrophobicContact CD1-CD2 3.91Å; Y36-Y48 HydrophobicContact CD1-CE2 4.05Å; Y36-Y48 HydrophobicContact CD1-CG 4.27Å; Y36-Y48 VanDerWaalsContact CD2-CB 3.48Å; Y36-Y48 AromaticContact CD2-CD1 3.97Å; Y36-Y48 HydrophobicContact CD2-CD1 3.97Å; Y36-Y48 AromaticContact CD2-CD2 3.95Å; Y36-Y48 HydrophobicContact CD2-CD2 3.95Å; Y36-Y48 AromaticContact CD2-CG 3.52Å; Y36-Y48 HydrophobicContact CD2-CG 3.52Å; Y36-Y48 HydrophobicContact CE1-CD2 4.45Å; Y36-Y48 HydrophobicContact CE1-CE2 4.33Å; Y36-Y48 AromaticContact CE2-CD1 3.83Å; Y36-Y48 HydrophobicContact CE2-CD1 3.83Å; Y36-Y48 HydrophobicContact CE2-CD2 4.49Å; Y36-Y48 HydrophobicContact CE2-CE1 4.37Å; Y36-Y48 AromaticContact CE2-CG 3.9Å; Y36-Y48 HydrophobicContact CE2-CG 3.9Å; Y36-Y48 HydrophobicContact CG-CD1 4.44Å; Y36-Y48 AromaticContact CG-CD2 3.65Å; Y36-Y48 HydrophobicContact CG-CD2 3.65Å; Y36-Y48 HydrophobicContact CG-CE2 4.26Å; Y36-Y48 AromaticContact CG-CG 3.75Å; Y36-Y48 HydrophobicContact CG-CG 3.75Å; Y36-E114 PolarHBondContact OH-OE1 3.08Å; Y36-K119 HydrophobicContact CD1-CD 3.99Å; Y36-K119 HydrophobicContact CD1-CG 4.02Å; Y36-K119 HydrophobicContact CE1-CB 4.34Å; Y36-K119 HydrophobicContact CE1-CD 3.79Å; Y36-K119 HydrophobicContact CE1-CG 3.92Å
37S97.4Very high96.2Very high14 Ų1448.9 Ų48.910%0.09827%0.274CS..THydrogen-bonded Turntrans-62.4119.3178.7-161.90000111.7G46 H174 D394S37-G46 CarbonylContact O-C 3.6Å; S37-G46 WeakPolarHBondContact O-CA 3.35Å; S37-H174 VanDerWaalsContact CB-CE1 3.43Å; S37-H174 WeakPolarHBondContact CB-CE1 3.3Å; S37-H174 WeakPolarHBondContact CB-ND1 3.41Å; S37-H174 WeakPolarHBondContact CB-O 3.44Å; S37-H174 PolarHBondContact N-O 2.79Å; S37-H174 VanDerWaalsContact N-O 3.11Å; S37-H174 PolarHBondContact OG-CE1 3.29Å; S37-H174 PolarHBondContact OG-ND1 3.49Å; S37-D394 VanDerWaalsContact CA-OD1 3.3Å; S37-D394 WeakPolarHBondContact CA-OD1 3.29Å; S37-D394 WeakPolarHBondContact CB-OD1 3.38Å; S37-D394 PolarHBondContact OG-OD1 3.09Å
38G96.6Very high96.2Very high4 Ų448 Ų484%0.04127%0.268CS..THydrogen-bonded Turntrans88.4717900000116.3Y36 N40 K41 F45Y36-G38 PolarHBondContact O-N 3.37Å; Y36-G38 VanDerWaalsContact O-N 3.12Å; G38-N40 PolarHBondContact O-N 3.06Å; G38-K41 WeakPolarHBondContact O-CB 3.36Å; G38-K41 PolarHBondContact O-N 2.9Å; G38-F45 WeakPolarHBondContact O-CD1 3.37Å
39E96.7Very high96.2Very high46 Ų4648.2 Ų48.222%0.21527%0.269CS..THydrogen-bonded Turntrans-54.6126.7178.3-169.5172.1-12900111.3P35 Y36 K41 E114 K119P35-E39 WeakPolarHBondContact CA-OE2 3.31Å; P35-E39 WeakPolarHBondContact CB-OE2 3.48Å; Y36-E39 HydrophobicContact CD2-CB 3.69Å; Y36-E39 HydrophobicContact CD2-CG 4.38Å; Y36-E39 HydrophobicContact CE1-CB 4.36Å; Y36-E39 HydrophobicContact CE1-CG 4.02Å; Y36-E39 WeakPolarHBondContact CE1-OE1 3.48Å; Y36-E39 VanDerWaalsContact CE2-CA 3.41Å; Y36-E39 HydrophobicContact CE2-CB 3.47Å; Y36-E39 VanDerWaalsContact CE2-CB 3.47Å; Y36-E39 HydrophobicContact CE2-CG 3.83Å; Y36-E39 HydrophobicContact CG-CB 4.23Å; Y36-E39 PolarHBondContact O-N 3.37Å; E39-K41 VanDerWaalsContact C-N 3.31Å; E39-K41 PolarHBondContact O-N 3.21Å; E39-E114 WeakPolarHBondContact CA-OE1 3.46Å; E39-K119 IonicContact OE1-NZ 2.9Å; E39-K119 PolarHBondContact OE1-NZ 3.35Å; E39-K119 IonicContact OE2-NZ 3.96Å
40N95.6Very high96.1Very high123 Ų12345.9 Ų45.966%0.65825%0.254SS*.THydrogen-bonded Turntrans5534.8-175-58.4-72.1000114.9G38 P42 E114G38-N40 PolarHBondContact O-N 3.06Å; N40-P42 VanDerWaalsContact C-CD 3.44Å; N40-P42 WeakPolarHBondContact O-CD 3.45Å; N40-E114 WeakPolarHBondContact CA-OE2 3.48Å; N40-E114 PolarHBondContact N-OE1 3.3Å; N40-E114 PolarHBondContact N-OE2 3.11Å; N40-E114 PolarHBondContact OD1-OE2 2.96Å
41K94.8Very high96.2Very high92 Ų9240.9 Ų40.940%0.423%0.227SC..  trans-120.565.8178.7-62.8-175.6-173.3175.20113.6G38 E39 F45 K393G38-K41 WeakPolarHBondContact O-CB 3.36Å; G38-K41 PolarHBondContact O-N 2.9Å; E39-K41 VanDerWaalsContact C-N 3.31Å; E39-K41 PolarHBondContact O-N 3.21Å; K41-F45 WeakPolarHBondContact O-CA 3.43Å; K41-F45 PolarHBondContact O-N 3.05Å; K41-K393 PolarHBondContact NZ-O 3.13Å
42P93.6Very high96.2Very high97 Ų9740.7 Ų40.763%0.6323%0.225SC*.THydrogen-bonded Turntrans-62.7158174.629.3-36000112.1N40 F45N40-P42 VanDerWaalsContact C-CD 3.44Å; N40-P42 WeakPolarHBondContact O-CD 3.45Å; P42-F45 HydrophobicContact CB-CE2 4.26Å; P42-F45 HydrophobicContact CB-CZ 4Å
43P92.6Very high96.3Very high107 Ų10740.1 Ų40.170%0.69522%0.221SC*.THydrogen-bonded Turncis-88.3-19.30.833.5-34.2000114F45P43-F45 WeakPolarHBondContact O-CD2 3.38Å; P43-F45 WeakPolarHBondContact O-CE2 3.34Å
44M93.9Very high96.4Very high76 Ų7634.1 Ų34.137%0.37419%0.189SC..THydrogen-bonded Turntrans-91.1-21.8-172.7-69.4-63.7-65.200113.7G46 Y77 W78M44-G46 PolarHBondContact O-N 3.32Å; M44-Y77 HydrophobicContact CE-CD2 4.25Å; M44-Y77 HydrophobicContact SD-CD2 3.63Å; M44-Y77 HydrophobicContact SD-CE2 4Å; M44-W78 PolarHBondContact O-NE1 3.01Å
45F95.4Very high96.5Very high40 Ų4033.6 Ų33.618%0.17519%0.185CC..  trans56.6-129.4-174.6-54.7-95.5000111.3G38 K41 P42 P43 E49 G112 E114G38-F45 WeakPolarHBondContact O-CD1 3.37Å; K41-F45 WeakPolarHBondContact O-CA 3.43Å; K41-F45 PolarHBondContact O-N 3.05Å; P42-F45 HydrophobicContact CB-CE2 4.26Å; P42-F45 HydrophobicContact CB-CZ 4Å; P43-F45 WeakPolarHBondContact O-CD2 3.38Å; P43-F45 WeakPolarHBondContact O-CE2 3.34Å; F45-E49 HydrophobicContact CB-CB 3.69Å; F45-E49 HydrophobicContact CB-CG 4.19Å; F45-E49 HydrophobicContact CD2-CG 4.22Å; F45-E49 HydrophobicContact CG-CB 4.34Å; F45-E49 HydrophobicContact CG-CG 4.45Å; F45-G112 WeakPolarHBondContact CZ-O 3.39Å; F45-E114 HydrophobicContact CE1-CG 4.08Å
46G95.8Very high96.6Very high5 Ų531.7 Ų31.75%0.05217%0.173CC..  trans-157.1-161.8-17400000112S37 M44 Y48 E49 A50S37-G46 CarbonylContact O-C 3.6Å; S37-G46 WeakPolarHBondContact O-CA 3.35Å; M44-G46 PolarHBondContact O-N 3.32Å; G46-Y48 PolarHBondContact O-N 3.26Å; G46-Y48 VanDerWaalsContact O-N 3.08Å; G46-E49 PolarHBondContact O-N 3.17Å; G46-A50 PolarHBondContact O-N 2.78Å; G46-A50 VanDerWaalsContact O-N 3.14Å
47D96.5Very high96.6Very high23 Ų2331.2 Ų31.212%0.12317%0.171CC..Hα-helixtrans-59.6-27.4-171.9-77.2-0.5000113.2A50 Q51 H174 Q176 K356D47-A50 WeakPolarHBondContact O-CB 3.49Å; D47-A50 PolarHBondContact O-N 3.45Å; D47-Q51 WeakPolarHBondContact O-CG 3.23Å; D47-Q51 PolarHBondContact O-N 2.85Å; D47-Q51 VanDerWaalsContact O-N 3.09Å; D47-H174 IonicContact OD2-CD2 2.77Å; D47-H174 IonicContact OD2-CE1 2.95Å; D47-H174 IonicContact OD2-NE2 2.71Å; D47-H174 PolarHBondContact OD2-NE2 2.9Å; D47-Q176 VanDerWaalsContact CG-NE2 3.28Å; D47-Q176 PolarHBondContact OD2-NE2 3.45Å; D47-K356 IonicContact OD2-NZ 3.36Å; D47-K356 PolarHBondContact OD2-NZ 3.12Å
48Y97.8Very high96.7Very high5 Ų530.7 Ų30.72%0.0217%0.167CC..Hα-helixtrans-58.7-48.3172.6-178.2-84.8000112.3Y36 G46 A50 Q51 R52 L118 K119 M122 F175Y36-Y48 AromaticContact CD1-CD2 3.91Å; Y36-Y48 HydrophobicContact CD1-CD2 3.91Å; Y36-Y48 HydrophobicContact CD1-CE2 4.05Å; Y36-Y48 HydrophobicContact CD1-CG 4.27Å; Y36-Y48 VanDerWaalsContact CD2-CB 3.48Å; Y36-Y48 AromaticContact CD2-CD1 3.97Å; Y36-Y48 HydrophobicContact CD2-CD1 3.97Å; Y36-Y48 AromaticContact CD2-CD2 3.95Å; Y36-Y48 HydrophobicContact CD2-CD2 3.95Å; Y36-Y48 AromaticContact CD2-CG 3.52Å; Y36-Y48 HydrophobicContact CD2-CG 3.52Å; Y36-Y48 HydrophobicContact CE1-CD2 4.45Å; Y36-Y48 HydrophobicContact CE1-CE2 4.33Å; Y36-Y48 AromaticContact CE2-CD1 3.83Å; Y36-Y48 HydrophobicContact CE2-CD1 3.83Å; Y36-Y48 HydrophobicContact CE2-CD2 4.49Å; Y36-Y48 HydrophobicContact CE2-CE1 4.37Å; Y36-Y48 AromaticContact CE2-CG 3.9Å; Y36-Y48 HydrophobicContact CE2-CG 3.9Å; Y36-Y48 HydrophobicContact CG-CD1 4.44Å; Y36-Y48 AromaticContact CG-CD2 3.65Å; Y36-Y48 HydrophobicContact CG-CD2 3.65Å; Y36-Y48 HydrophobicContact CG-CE2 4.26Å; Y36-Y48 AromaticContact CG-CG 3.75Å; Y36-Y48 HydrophobicContact CG-CG 3.75Å; G46-Y48 PolarHBondContact O-N 3.26Å; G46-Y48 VanDerWaalsContact O-N 3.08Å; Y48-A50 VanDerWaalsContact C-N 3.33Å; Y48-Q51 PolarHBondContact O-N 3.23Å; Y48-R52 PolarHBondContact O-N 2.77Å; Y48-R52 VanDerWaalsContact O-N 3.08Å; Y48-L118 VanDerWaalsContact OH-C 3.23Å; Y48-L118 WeakPolarHBondContact OH-CG 3.24Å; Y48-L118 PolarHBondContact OH-O 2.69Å; Y48-L118 VanDerWaalsContact OH-O 3.13Å; Y48-K119 WeakPolarHBondContact OH-CA 3.41Å; Y48-K119 PolarHBondContact OH-N 2.96Å; Y48-M122 HydrophobicContact CE2-CB 3.58Å; Y48-M122 HydrophobicContact CE2-CG 4Å; Y48-M122 WeakPolarHBondContact OH-CB 3.4Å; Y48-M122 VanDerWaalsContact OH-CG 3.27Å; Y48-M122 WeakPolarHBondContact OH-CG 3.31Å; Y48-F175 HydrophobicContact CD2-CB 4.02Å; Y48-F175 AromaticContact CD2-CD1 3.83Å; Y48-F175 HydrophobicContact CD2-CD1 3.83Å; Y48-F175 AromaticContact CD2-CD2 3.68Å; Y48-F175 HydrophobicContact CD2-CD2 3.68Å; Y48-F175 HydrophobicContact CD2-CE1 4.25Å; Y48-F175 HydrophobicContact CD2-CE2 4.12Å; Y48-F175 AromaticContact CD2-CG 3.54Å; Y48-F175 HydrophobicContact CD2-CG 3.54Å; Y48-F175 HydrophobicContact CD2-CZ 4.39Å; Y48-F175 HydrophobicContact CE2-CD2 4.03Å; Y48-F175 HydrophobicContact CE2-CE2 4.09Å; Y48-F175 HydrophobicContact CE2-CG 4.31Å; Y48-F175 HydrophobicContact CE2-CZ 4.41Å; Y48-F175 HydrophobicContact CG-CD1 4.38Å; Y48-F175 HydrophobicContact CG-CG 4.37Å
49E98.1Very high96.7Very high5 Ų531.3 Ų31.32%0.02317%0.169CC..Hα-helixtrans-69.6-34.1178.9178.956.2-164.900111.1F45 G46 Q51 R52 H53 Y77 G112F45-E49 HydrophobicContact CB-CB 3.69Å; F45-E49 HydrophobicContact CB-CG 4.19Å; F45-E49 HydrophobicContact CD2-CG 4.22Å; F45-E49 HydrophobicContact CG-CB 4.34Å; F45-E49 HydrophobicContact CG-CG 4.45Å; G46-E49 PolarHBondContact O-N 3.17Å; E49-Q51 PolarHBondContact O-N 3.16Å; E49-R52 VanDerWaalsContact CD-NE 3.29Å; E49-R52 PolarHBondContact O-N 2.95Å; E49-R52 IonicContact OE1-CZ 2.95Å; E49-R52 VanDerWaalsContact OE1-CZ 3.27Å; E49-R52 IonicContact OE1-NE 3.8Å; E49-R52 PolarHBondContact OE1-NE 2.88Å; E49-R52 IonicContact OE1-NH2 3.92Å; E49-R52 PolarHBondContact OE1-NH2 2.98Å; E49-R52 WeakPolarHBondContact OE2-CD 3.47Å; E49-R52 IonicContact OE2-CZ 2.64Å; E49-R52 IonicContact OE2-NE 2.69Å; E49-R52 PolarHBondContact OE2-NE 3.16Å; E49-R52 IonicContact OE2-NH2 3.67Å; E49-H53 VanDerWaalsContact O-CB 3.25Å; E49-H53 WeakPolarHBondContact O-CB 3.41Å; E49-H53 PolarHBondContact O-N 3.14Å; E49-Y77 HydrophobicContact CG-CE1 4.44Å; E49-Y77 WeakPolarHBondContact CG-OH 3.34Å; E49-Y77 PolarHBondContact OE1-OH 3.34Å; E49-Y77 VanDerWaalsContact OE1-OH 3.1Å; E49-G112 PolarHBondContact OE1-N 2.74Å
50A97.7Very high96.8Very high2 Ų232.4 Ų32.42%0.01718%0.176CC..Hα-helixtrans-56.8-49.7173.300000111.5G46 D47 Y48 H53 W54 W78G46-A50 PolarHBondContact O-N 2.78Å; G46-A50 VanDerWaalsContact O-N 3.14Å; D47-A50 WeakPolarHBondContact O-CB 3.49Å; D47-A50 PolarHBondContact O-N 3.45Å; Y48-A50 VanDerWaalsContact C-N 3.33Å; A50-H53 PolarHBondContact O-N 3.23Å; A50-W54 PolarHBondContact O-N 3.33Å; A50-W54 PolarHBondContact O-NE1 3.18Å; A50-W78 HydrophobicContact CB-CB 3.97Å; A50-W78 HydrophobicContact CB-CD2 3.44Å; A50-W78 VanDerWaalsContact CB-CD2 3.44Å; A50-W78 HydrophobicContact CB-CE3 3.4Å; A50-W78 HydrophobicContact CB-CG 3.71Å; A50-W78 HydrophobicContact CB-CZ3 4.02Å
51Q98.1Very high96.8Very high3 Ų327.2 Ų27.21%0.01415%0.149CC..Hα-helixtrans-64.7-41.7178.5-60.3-54.2-43.400112.1D47 Y48 E49 W54 M55 M122 F175 Y177D47-Q51 WeakPolarHBondContact O-CG 3.23Å; D47-Q51 PolarHBondContact O-N 2.85Å; D47-Q51 VanDerWaalsContact O-N 3.09Å; Y48-Q51 PolarHBondContact O-N 3.23Å; E49-Q51 PolarHBondContact O-N 3.16Å; Q51-W54 PolarHBondContact O-N 2.9Å; Q51-W54 VanDerWaalsContact OE1-CZ3 3.27Å; Q51-M55 WeakPolarHBondContact O-CG 3.46Å; Q51-M55 PolarHBondContact O-N 3.3Å; Q51-M122 HydrophobicContact CB-CE 4.08Å; Q51-F175 HydrophobicContact CB-CD1 4.29Å; Q51-F175 HydrophobicContact CB-CE1 3.8Å; Q51-F175 HydrophobicContact CG-CD1 4Å; Q51-F175 HydrophobicContact CG-CE1 3.87Å; Q51-Y177 HydrophobicContact CB-CE2 4.26Å; Q51-Y177 HydrophobicContact CG-CD2 4.21Å; Q51-Y177 HydrophobicContact CG-CE2 4.15Å
52R98.2Very high96.9Very high2 Ų225.9 Ų25.91%0.00815%0.149CC..Hα-helixtrans-61.2-46176-170.5-146.662.171.64.9110.9Y48 E49 W54 M55 E56 W104 S110 L118 M122Y48-R52 PolarHBondContact O-N 2.77Å; Y48-R52 VanDerWaalsContact O-N 3.08Å; E49-R52 VanDerWaalsContact CD-NE 3.29Å; E49-R52 PolarHBondContact O-N 2.95Å; E49-R52 IonicContact OE1-CZ 2.95Å; E49-R52 VanDerWaalsContact OE1-CZ 3.27Å; E49-R52 IonicContact OE1-NE 3.8Å; E49-R52 PolarHBondContact OE1-NE 2.88Å; E49-R52 IonicContact OE1-NH2 3.92Å; E49-R52 PolarHBondContact OE1-NH2 2.98Å; E49-R52 WeakPolarHBondContact OE2-CD 3.47Å; E49-R52 IonicContact OE2-CZ 2.64Å; E49-R52 IonicContact OE2-NE 2.69Å; E49-R52 PolarHBondContact OE2-NE 3.16Å; E49-R52 IonicContact OE2-NH2 3.67Å; R52-W54 VanDerWaalsContact C-N 3.29Å; R52-W54 PolarHBondContact O-N 3.09Å; R52-M55 WeakPolarHBondContact O-CB 3.39Å; R52-M55 PolarHBondContact O-N 3.38Å; R52-M55 VanDerWaalsContact O-N 3.09Å; R52-E56 IonicContact CZ-OE2 3.09Å; R52-E56 IonicContact NH1-OE2 3.64Å; R52-E56 PolarHBondContact NH1-OE2 2.9Å; R52-E56 VanDerWaalsContact NH1-OE2 3.09Å; R52-E56 IonicContact NH2-OE2 2.98Å; R52-E56 PolarHBondContact NH2-OE2 3.34Å; R52-E56 PolarHBondContact O-N 3.05Å; R52-W104 PolarHBondContact NH1-O 2.93Å; R52-S110 PolarHBondContact NE-O 3.06Å; R52-S110 PolarHBondContact NH1-O 3.36Å; R52-S110 PolarHBondContact NH1-OG 3.48Å; R52-S110 PolarHBondContact NH2-O 3.29Å; R52-L118 HydrophobicContact CG-CD2 4.28Å; R52-M122 HydrophobicContact CB-CE 3.96Å
53H98Very high97Very high1 Ų124.3 Ų24.31%0.00514%0.135CC..Hα-helixtrans-63.2-36.6178.5-172.953.7000111.7E49 A50 M55 E56 I57 Y77 W78E49-H53 VanDerWaalsContact O-CB 3.25Å; E49-H53 WeakPolarHBondContact O-CB 3.41Å; E49-H53 PolarHBondContact O-N 3.14Å; A50-H53 PolarHBondContact O-N 3.23Å; H53-M55 VanDerWaalsContact C-N 3.28Å; H53-M55 PolarHBondContact O-N 3.26Å; H53-E56 IonicContact CE1-OE2 2.76Å; H53-E56 IonicContact ND1-OE1 2.68Å; H53-E56 IonicContact ND1-OE2 3.38Å; H53-E56 PolarHBondContact ND1-OE2 2.88Å; H53-E56 WeakPolarHBondContact O-CB 3.46Å; H53-E56 PolarHBondContact O-N 3.17Å; H53-E56 VanDerWaalsContact O-N 3.12Å; H53-I57 VanDerWaalsContact CE1-CG2 3.46Å; H53-I57 WeakPolarHBondContact CE1-CG2 3.34Å; H53-I57 WeakPolarHBondContact NE2-CG2 3.32Å; H53-I57 WeakPolarHBondContact O-CG1 3.46Å; H53-I57 PolarHBondContact O-N 3.29Å; H53-Y77 HydrophobicContact CB-CE1 4.47Å; H53-Y77 AromaticContact CD2-CD1 3.9Å; H53-Y77 PolarHBondContact CD2-O 3.26Å; H53-Y77 AromaticContact NE2-CD1 3.96Å; H53-Y77 PolarHBondContact NE2-O 3.44Å; H53-W78 HydrophobicContact CB-CB 4.49Å
54W98.3Very high97.1Very high10 Ų1023.5 Ų23.54%0.03813%0.125CC..Hα-helixtrans-61-36.8173.1-62.9-7.4000112.7A50 Q51 R52 I57 T58 W78 L80 Y82 T86A50-W54 PolarHBondContact O-N 3.33Å; A50-W54 PolarHBondContact O-NE1 3.18Å; Q51-W54 PolarHBondContact O-N 2.9Å; Q51-W54 VanDerWaalsContact OE1-CZ3 3.27Å; R52-W54 VanDerWaalsContact C-N 3.29Å; R52-W54 PolarHBondContact O-N 3.09Å; W54-I57 WeakPolarHBondContact O-CG1 3.39Å; W54-T58 WeakPolarHBondContact O-CB 3.47Å; W54-T58 WeakPolarHBondContact O-CG2 3.35Å; W54-T58 PolarHBondContact O-N 3.49Å; W54-T58 VanDerWaalsContact O-N 3.14Å; W54-T58 PolarHBondContact O-OG1 3.14Å; W54-W78 VanDerWaalsContact CD1-O 3.31Å; W54-W78 PolarHBondContact NE1-O 2.82Å; W54-L80 HydrophobicContact CB-CD1 4.12Å; W54-L80 HydrophobicContact CD2-CD1 4.43Å; W54-L80 HydrophobicContact CD2-CG 4.27Å; W54-L80 HydrophobicContact CG-CD1 4.01Å; W54-L80 HydrophobicContact CG-CG 4.24Å; W54-Y82 HydrophobicContact CH2-CD1 4.16Å; W54-Y82 AromaticContact CH2-CD2 3.72Å; W54-Y82 HydrophobicContact CH2-CD2 3.72Å; W54-Y82 HydrophobicContact CH2-CE1 4.18Å; W54-Y82 AromaticContact CH2-CE2 3.75Å; W54-Y82 HydrophobicContact CH2-CE2 3.75Å; W54-Y82 AromaticContact CH2-CG 3.91Å; W54-Y82 HydrophobicContact CH2-CG 3.91Å; W54-Y82 AromaticContact CH2-CZ 3.97Å; W54-Y82 AromaticContact CZ3-CD2 3.61Å; W54-Y82 HydrophobicContact CZ3-CD2 3.61Å; W54-Y82 AromaticContact CZ3-CE2 3.83Å; W54-Y82 HydrophobicContact CZ3-CE2 3.83Å; W54-Y82 HydrophobicContact CZ3-CG 4.11Å; W54-T86 HydrophobicContact CE3-CG2 3.87Å; W54-T86 HydrophobicContact CZ3-CG2 3.78Å
55M98.5Very high97.2Very high1 Ų122.6 Ų22.61%0.00512%0.12CC..Hα-helixtrans-65.8-42.6172.8-61.4179.1-167.900111.5Q51 R52 H53 T58 I59 S90 L93 V105 M122Q51-M55 WeakPolarHBondContact O-CG 3.46Å; Q51-M55 PolarHBondContact O-N 3.3Å; R52-M55 WeakPolarHBondContact O-CB 3.39Å; R52-M55 PolarHBondContact O-N 3.38Å; R52-M55 VanDerWaalsContact O-N 3.09Å; H53-M55 VanDerWaalsContact C-N 3.28Å; H53-M55 PolarHBondContact O-N 3.26Å; M55-T58 PolarHBondContact O-OG1 3.2Å; M55-I59 WeakPolarHBondContact O-CG1 3.35Å; M55-I59 WeakPolarHBondContact O-CG2 3.29Å; M55-I59 PolarHBondContact O-N 3.39Å; M55-S90 WeakPolarHBondContact CG-O 2.88Å; M55-L93 HydrophobicContact CE-CB 3.65Å; M55-L93 HydrophobicContact CE-CD1 3.64Å; M55-L93 HydrophobicContact CE-CG 4.32Å; M55-L93 HydrophobicContact CG-CB 4.33Å; M55-L93 HydrophobicContact SD-CB 3.89Å; M55-V105 HydrophobicContact CB-CG1 4.1Å; M55-M122 HydrophobicContact CE-CE 3.89Å; M55-M122 HydrophobicContact CE-SD 3.52Å; M55-M122 VanDerWaalsContact CE-SD 3.52Å; M55-M122 HydrophobicContact SD-CE 4.43Å; M55-M122 HydrophobicContact SD-SD 3.79Å
56E98.1Very high97.2Very high0 Ų021 Ų210%011%0.113CC..Hα-helixtrans-59.3-52.4176.2179.1-162.9157.700111.9R52 H53 T58 N60 L107 E108 S110R52-E56 IonicContact CZ-OE2 3.09Å; R52-E56 IonicContact NH1-OE2 3.64Å; R52-E56 PolarHBondContact NH1-OE2 2.9Å; R52-E56 VanDerWaalsContact NH1-OE2 3.09Å; R52-E56 IonicContact NH2-OE2 2.98Å; R52-E56 PolarHBondContact NH2-OE2 3.34Å; R52-E56 PolarHBondContact O-N 3.05Å; H53-E56 IonicContact CE1-OE2 2.76Å; H53-E56 IonicContact ND1-OE1 2.68Å; H53-E56 IonicContact ND1-OE2 3.38Å; H53-E56 PolarHBondContact ND1-OE2 2.88Å; H53-E56 WeakPolarHBondContact O-CB 3.46Å; H53-E56 PolarHBondContact O-N 3.17Å; H53-E56 VanDerWaalsContact O-N 3.12Å; E56-T58 PolarHBondContact O-N 3.45Å; E56-N60 WeakPolarHBondContact O-CB 3.41Å; E56-N60 PolarHBondContact O-N 3.04Å; E56-N60 PolarHBondContact O-ND2 2.84Å; E56-L107 HydrophobicContact CG-CD1 4.42Å; E56-L107 VanDerWaalsContact OE1-CA 3.3Å; E56-L107 WeakPolarHBondContact OE1-CA 3.12Å; E56-E108 PolarHBondContact OE1-N 2.72Å; E56-S110 VanDerWaalsContact CD-OG 3.28Å; E56-S110 PolarHBondContact OE2-OG 2.69Å
57I97.9Very high97.3Very high0 Ų020.9 Ų20.90%011%0.11CC..Hα-helixtrans-66.9-41.4-176.761.3172.2000111.7H53 W54 I59 N60 L61 L80H53-I57 VanDerWaalsContact CE1-CG2 3.46Å; H53-I57 WeakPolarHBondContact CE1-CG2 3.34Å; H53-I57 WeakPolarHBondContact NE2-CG2 3.32Å; H53-I57 WeakPolarHBondContact O-CG1 3.46Å; H53-I57 PolarHBondContact O-N 3.29Å; W54-I57 WeakPolarHBondContact O-CG1 3.39Å; I57-I59 VanDerWaalsContact C-N 3.32Å; I57-I59 PolarHBondContact O-N 3.15Å; I57-N60 PolarHBondContact O-N 3.27Å; I57-L61 HydrophobicContact CB-CD1 4.04Å; I57-L61 HydrophobicContact CG2-CD1 4.24Å; I57-L61 VanDerWaalsContact O-CB 3.27Å; I57-L61 WeakPolarHBondContact O-CB 3.28Å; I57-L61 WeakPolarHBondContact O-CG 3.5Å; I57-L61 PolarHBondContact O-N 3.43Å; I57-L80 HydrophobicContact CD1-CB 4.18Å; I57-L80 HydrophobicContact CD1-CD1 4.03Å
58T97.9Very high97.2Very high2 Ų222.4 Ų22.41%0.01212%0.121CC..Hα-helixtrans-69.9-29.9-172.751.60000112.5W54 M55 E56 W66 L80 A87 W91W54-T58 WeakPolarHBondContact O-CB 3.47Å; W54-T58 WeakPolarHBondContact O-CG2 3.35Å; W54-T58 PolarHBondContact O-N 3.49Å; W54-T58 VanDerWaalsContact O-N 3.14Å; W54-T58 PolarHBondContact O-OG1 3.14Å; M55-T58 PolarHBondContact O-OG1 3.2Å; E56-T58 PolarHBondContact O-N 3.45Å; T58-W66 HydrophobicContact CG2-CD2 3.93Å; T58-W66 HydrophobicContact CG2-CE3 4.07Å; T58-W66 HydrophobicContact CG2-CG 4.47Å; T58-W66 HydrophobicContact CG2-CH2 4.23Å; T58-W66 HydrophobicContact CG2-CZ2 4.11Å; T58-W66 HydrophobicContact CG2-CZ3 4.22Å; T58-W66 VanDerWaalsContact O-CZ2 3.25Å; T58-W66 WeakPolarHBondContact O-CZ2 3.49Å; T58-L80 HydrophobicContact CG2-CD1 4.05Å; T58-A87 HydrophobicContact CG2-CB 4.21Å; T58-W91 VanDerWaalsContact O-CD1 3.3Å; T58-W91 VanDerWaalsContact OG1-CA 3.28Å; T58-W91 WeakPolarHBondContact OG1-CA 3.28Å; T58-W91 PolarHBondContact OG1-N 3.41Å
59I97.5Very high97Very high18 Ų1827.8 Ų27.89%0.09215%0.146CC..Hα-helixtrans-86-22.2178.674.2172.1000114.2M55 I57 R98 V105M55-I59 WeakPolarHBondContact O-CG1 3.35Å; M55-I59 WeakPolarHBondContact O-CG2 3.29Å; M55-I59 PolarHBondContact O-N 3.39Å; I57-I59 VanDerWaalsContact C-N 3.32Å; I57-I59 PolarHBondContact O-N 3.15Å; I59-R98 HydrophobicContact CD1-CB 4.23Å; I59-V105 HydrophobicContact CD1-CB 3.57Å; I59-V105 HydrophobicContact CD1-CG1 4.37Å; I59-V105 HydrophobicContact CD1-CG2 3.35Å
60N97.8Very high96.8Very high68 Ų6828.9 Ų28.936%0.36415%0.154SC..Hα-helixtrans-105.6-26.7-172.8-67.9-61.8000113E56 I57 V105 L107E56-N60 WeakPolarHBondContact O-CB 3.41Å; E56-N60 PolarHBondContact O-N 3.04Å; E56-N60 PolarHBondContact O-ND2 2.84Å; I57-N60 PolarHBondContact O-N 3.27Å; N60-V105 PolarHBondContact ND2-O 3.31Å; N60-L107 HydrophobicContact CB-CB 4.11Å; N60-L107 HydrophobicContact CB-CD1 4.21Å; N60-L107 HydrophobicContact CB-CD2 4.32Å; N60-L107 HydrophobicContact CB-CG 4.45Å
61L97.4Very high96.4Very high15 Ų1536.9 Ų36.98%0.07920%0.196CC..SBendtrans-103.6149.2-176.9-56.1-175.5000111.9I57 E65 W66 N73 L107I57-L61 HydrophobicContact CB-CD1 4.04Å; I57-L61 HydrophobicContact CG2-CD1 4.24Å; I57-L61 VanDerWaalsContact O-CB 3.27Å; I57-L61 WeakPolarHBondContact O-CB 3.28Å; I57-L61 WeakPolarHBondContact O-CG 3.5Å; I57-L61 PolarHBondContact O-N 3.43Å; L61-E65 HydrophobicContact CB-CB 4.37Å; L61-W66 PolarHBondContact O-NE1 3.29Å; L61-N73 HydrophobicContact CD1-CB 3.65Å; L61-L107 HydrophobicContact CD2-CD1 4.12Å; L61-L107 HydrophobicContact CD2-CD2 3.81Å; L61-L107 HydrophobicContact CG-CD1 4.35Å
62P96Very high96.2Very high63 Ų6338.8 Ų38.841%0.40921%0.21SC..  trans-66.3153.8172.133.5-37.6000110.8D64 E65 W66P62-D64 VanDerWaalsContact CB-OD1 3.24Å; P62-D64 WeakPolarHBondContact CB-OD1 2.97Å; P62-D64 WeakPolarHBondContact CG-OD1 2.8Å; P62-D64 PolarHBondContact O-N 2.95Å; P62-E65 HydrophobicContact CG-CB 4.23Å; P62-E65 HydrophobicContact CG-CG 3.93Å; P62-E65 WeakPolarHBondContact CG-OE1 3.43Å; P62-E65 PolarHBondContact O-N 3.44Å; P62-W66 PolarHBondContact O-NE1 3.17Å
63I95.8Very high96Very high65 Ų6538.8 Ų38.833%0.33321%0.21SC..G310 helixtrans-58.4-33.3-170.1-72.9175000113.1E65 W66 P258 F259I63-E65 PolarHBondContact O-N 3.07Å; I63-W66 HydrophobicContact CD1-CH2 4.5Å; I63-W66 HydrophobicContact CG1-CD2 4.39Å; I63-W66 HydrophobicContact CG1-CH2 3.94Å; I63-W66 HydrophobicContact CG1-CZ2 3.69Å; I63-W66 HydrophobicContact CG1-CZ3 4.36Å; I63-W66 PolarHBondContact O-N 2.99Å; I63-P258 HydrophobicContact CG2-CB 3.67Å; I63-P258 HydrophobicContact CG2-CG 4.46Å; I63-F259 HydrophobicContact CG2-CE1 3.8Å; I63-F259 HydrophobicContact CG2-CE2 4.28Å; I63-F259 HydrophobicContact CG2-CZ 3.62Å
64D94Very high95.9Very high90 Ų9041.1 Ų41.148%0.48122%0.223SC..G310 helixtrans-69.9-18178.956.9-28.9000113.4P62 V68 L265P62-D64 VanDerWaalsContact CB-OD1 3.24Å; P62-D64 WeakPolarHBondContact CB-OD1 2.97Å; P62-D64 WeakPolarHBondContact CG-OD1 2.8Å; P62-D64 PolarHBondContact O-N 2.95Å; D64-V68 WeakPolarHBondContact O-CG2 3.4Å; D64-L265 HydrophobicContact CB-CD2 4.31Å
65E95.8Very high95.7Very high57 Ų5741.6 Ų41.627%0.26623%0.226SC..G310 helixtrans-92.9-13.2175.7-70.9-170.3-131.100113.8L61 P62 I63 Y67 V68 S70 N73L61-E65 HydrophobicContact CB-CB 4.37Å; P62-E65 HydrophobicContact CG-CB 4.23Å; P62-E65 HydrophobicContact CG-CG 3.93Å; P62-E65 WeakPolarHBondContact CG-OE1 3.43Å; P62-E65 PolarHBondContact O-N 3.44Å; I63-E65 PolarHBondContact O-N 3.07Å; E65-Y67 VanDerWaalsContact C-N 3.25Å; E65-Y67 PolarHBondContact O-N 2.88Å; E65-Y67 VanDerWaalsContact O-N 3.12Å; E65-V68 PolarHBondContact O-N 3.4Å; E65-V68 VanDerWaalsContact O-O 3.08Å; E65-S70 VanDerWaalsContact OE2-CB 3.27Å; E65-S70 WeakPolarHBondContact OE2-CB 3.46Å; E65-S70 PolarHBondContact OE2-OG 2.93Å; E65-N73 PolarHBondContact O-ND2 2.72Å
66W97.1Very high95.4Very high6 Ų648.3 Ų48.32%0.02326%0.259CS..THydrogen-bonded Turntrans-58.3-33.2-172.5-69.32.8000114.5T58 L61 P62 I63 N73 A87 Y88 W91 F259T58-W66 HydrophobicContact CG2-CD2 3.93Å; T58-W66 HydrophobicContact CG2-CE3 4.07Å; T58-W66 HydrophobicContact CG2-CG 4.47Å; T58-W66 HydrophobicContact CG2-CH2 4.23Å; T58-W66 HydrophobicContact CG2-CZ2 4.11Å; T58-W66 HydrophobicContact CG2-CZ3 4.22Å; T58-W66 VanDerWaalsContact O-CZ2 3.25Å; T58-W66 WeakPolarHBondContact O-CZ2 3.49Å; L61-W66 PolarHBondContact O-NE1 3.29Å; P62-W66 PolarHBondContact O-NE1 3.17Å; I63-W66 HydrophobicContact CD1-CH2 4.5Å; I63-W66 HydrophobicContact CG1-CD2 4.39Å; I63-W66 HydrophobicContact CG1-CH2 3.94Å; I63-W66 HydrophobicContact CG1-CZ2 3.69Å; I63-W66 HydrophobicContact CG1-CZ3 4.36Å; I63-W66 PolarHBondContact O-N 2.99Å; W66-N73 PolarHBondContact O-ND2 3.35Å; W66-A87 HydrophobicContact CE3-CB 3.51Å; W66-A87 HydrophobicContact CZ3-CB 3.53Å; W66-Y88 HydrophobicContact CH2-CD1 4.05Å; W66-Y88 HydrophobicContact CH2-CE1 4.31Å; W66-Y88 AromaticContact CZ3-CD1 3.84Å; W66-Y88 HydrophobicContact CZ3-CD1 3.84Å; W66-Y88 AromaticContact CZ3-CE1 3.94Å; W66-Y88 HydrophobicContact CZ3-CE1 3.94Å; W66-W91 HydrophobicContact CH2-CB 4.24Å; W66-W91 HydrophobicContact CH2-CG 4.46Å; W66-F259 AromaticContact CE3-CZ 3.98Å; W66-F259 HydrophobicContact CE3-CZ 3.98Å; W66-F259 HydrophobicContact CZ3-CZ 4.39Å
67Y96.8Very high95.3Very high2 Ų249.2 Ų49.21%0.00826%0.263CS..THydrogen-bonded Turntrans-114.28.2-177.6-66.9-93.5000113.4E65 L80 Y82 P83 F259 V269 R272 L273E65-Y67 VanDerWaalsContact C-N 3.25Å; E65-Y67 PolarHBondContact O-N 2.88Å; E65-Y67 VanDerWaalsContact O-N 3.12Å; Y67-L80 HydrophobicContact CD1-CB 4.37Å; Y67-L80 HydrophobicContact CD1-CD2 4.18Å; Y67-L80 WeakPolarHBondContact CD1-O 3.48Å; Y67-L80 HydrophobicContact CE1-CB 4.26Å; Y67-L80 HydrophobicContact CE1-CD2 3.29Å; Y67-L80 HydrophobicContact CE1-CG 4.39Å; Y67-L80 HydrophobicContact CE2-CD2 4.09Å; Y67-L80 WeakPolarHBondContact OH-CD2 3.44Å; Y67-Y82 VanDerWaalsContact CE1-O 3.28Å; Y67-Y82 WeakPolarHBondContact CE1-O 3.5Å; Y67-Y82 PolarHBondContact OH-O 2.84Å; Y67-P83 VanDerWaalsContact OH-C 3.3Å; Y67-F259 HydrophobicContact CD2-CD1 4.18Å; Y67-F259 AromaticContact CD2-CE1 3.58Å; Y67-F259 HydrophobicContact CD2-CE1 3.58Å; Y67-F259 HydrophobicContact CD2-CZ 4.29Å; Y67-F259 HydrophobicContact CE2-CD1 4.23Å; Y67-F259 AromaticContact CE2-CE1 3.53Å; Y67-F259 HydrophobicContact CE2-CE1 3.53Å; Y67-F259 AromaticContact CE2-CZ 3.79Å; Y67-F259 HydrophobicContact CE2-CZ 3.79Å; Y67-V269 HydrophobicContact CD1-CB 4.42Å; Y67-V269 HydrophobicContact CD1-CG1 4.33Å; Y67-V269 HydrophobicContact CD1-CG2 4.15Å; Y67-V269 HydrophobicContact CD2-CG2 3.67Å; Y67-V269 HydrophobicContact CE1-CG1 4.06Å; Y67-V269 HydrophobicContact CE1-CG2 4.48Å; Y67-V269 HydrophobicContact CE2-CG2 4.04Å; Y67-V269 HydrophobicContact CG-CB 4.43Å; Y67-V269 HydrophobicContact CG-CG2 3.71Å; Y67-R272 HydrophobicContact CD1-CB 4.27Å; Y67-R272 HydrophobicContact CD1-CG 4.27Å; Y67-L273 HydrophobicContact CE1-CD1 4.22Å
68V95.1Very high95.2Very high56 Ų5652.4 Ų52.434%0.33928%0.275SS..SBendtrans-119.9136.5-173.5-177.60000108.8D64 E65 S70 N73 L265 A268D64-V68 WeakPolarHBondContact O-CG2 3.4Å; E65-V68 PolarHBondContact O-N 3.4Å; E65-V68 VanDerWaalsContact O-O 3.08Å; V68-S70 PolarHBondContact O-N 2.96Å; V68-N73 PolarHBondContact O-ND2 2.72Å; V68-L265 HydrophobicContact CG2-CD1 4.19Å; V68-A268 HydrophobicContact CG2-CB 3.92Å
69H93.7Very high95.1Very high118 Ų11852.4 Ų52.455%0.54628%0.275SS..  trans-69.8123.9174-172.282.7000109.1N73 D74 L75H69-N73 WeakPolarHBondContact CA-O 3.3Å; H69-N73 PolarHBondContact ND1-O 3.03Å; H69-D74 IonicContact CE1-OD1 3.39Å; H69-D74 PolarHBondContact CE1-OD1 3.48Å; H69-D74 IonicContact ND1-OD1 2.75Å; H69-L75 HydrophobicContact CB-CB 4.48Å; H69-L75 HydrophobicContact CB-CD1 3.96Å; H69-L75 HydrophobicContact CB-CG 3.99Å; H69-L75 PolarHBondContact ND1-N 3.25Å
70S93Very high95Very high28 Ų2851.6 Ų51.620%0.19627%0.271CS..  trans-137176.5179.480.60000109.9E65 V68 S72 N73E65-S70 VanDerWaalsContact OE2-CB 3.27Å; E65-S70 WeakPolarHBondContact OE2-CB 3.46Å; E65-S70 PolarHBondContact OE2-OG 2.93Å; V68-S70 PolarHBondContact O-N 2.96Å; S70-S72 PolarHBondContact O-N 2.94Å; S70-S72 VanDerWaalsContact O-N 3.17Å; S70-S72 PolarHBondContact OG-N 3.43Å; S70-N73 PolarHBondContact N-O 3.45Å; S70-N73 CarbonylContact O-C 3.37Å; S70-N73 PolarHBondContact O-N 3.48Å; S70-N73 PolarHBondContact OG-N 3.41Å
71N90.4Very high94.8Very high169 Ų16949.5 Ų49.590%0.90426%0.26SS*.SBendtrans-60.8-23.8174.6-66.9-25.2000112.5
72S92.5Very high94.8Very high44 Ų4450.7 Ų50.731%0.30826%0.263SS..SBendtrans-108.1-9.2-178-59.70000113.3S70S70-S72 PolarHBondContact O-N 2.94Å; S70-S72 VanDerWaalsContact O-N 3.17Å; S70-S72 PolarHBondContact OG-N 3.43Å
73N95.2Very high94.9Very high1 Ų147.8 Ų47.81%0.00525%0.245CC..  trans-126.1101.3176.8-167.98.8000111.9L61 E65 W66 V68 H69 S70 L75L61-N73 HydrophobicContact CD1-CB 3.65Å; E65-N73 PolarHBondContact O-ND2 2.72Å; W66-N73 PolarHBondContact O-ND2 3.35Å; V68-N73 PolarHBondContact O-ND2 2.72Å; H69-N73 WeakPolarHBondContact CA-O 3.3Å; H69-N73 PolarHBondContact ND1-O 3.03Å; S70-N73 PolarHBondContact N-O 3.45Å; S70-N73 CarbonylContact O-C 3.37Å; S70-N73 PolarHBondContact O-N 3.48Å; S70-N73 PolarHBondContact OG-N 3.41Å; N73-L75 PolarHBondContact O-N 3.37Å
74D94.4Very high95Very high50 Ų5044.7 Ų44.727%0.26723%0.229SC..  trans-87.395.8173.5-179.613.1000111.4H69 M76 Y77H69-D74 IonicContact CE1-OD1 3.39Å; H69-D74 PolarHBondContact CE1-OD1 3.48Å; H69-D74 IonicContact ND1-OD1 2.75Å; D74-M76 PolarHBondContact O-N 3.48Å; D74-M76 WeakPolarHBondContact OD1-CB 3.2Å; D74-M76 PolarHBondContact OD1-N 3.36Å; D74-Y77 PolarHBondContact O-N 2.92Å
75L94Very high95.2Very high20 Ų2042.4 Ų42.411%0.10522%0.216CC..THydrogen-bonded Turntrans-59.8-11.2175.9-63.4-173.5000115.9H69 N73 G79 R272H69-L75 HydrophobicContact CB-CB 4.48Å; H69-L75 HydrophobicContact CB-CD1 3.96Å; H69-L75 HydrophobicContact CB-CG 3.99Å; H69-L75 PolarHBondContact ND1-N 3.25Å; N73-L75 PolarHBondContact O-N 3.37Å; L75-G79 PolarHBondContact O-N 2.86Å; L75-R272 PolarHBondContact O-NH2 3.21Å
76M93.1Very high95.4Very high143 Ų14339.7 Ų39.770%0.70420%0.204SC*.THydrogen-bonded Turntrans-80.1-24.3171.7-63-61.9125.300112.2D74 W78D74-M76 PolarHBondContact O-N 3.48Å; D74-M76 WeakPolarHBondContact OD1-CB 3.2Å; D74-M76 PolarHBondContact OD1-N 3.36Å; M76-W78 PolarHBondContact O-N 3.4Å
77Y95.5Very high95.4Very high19 Ų1939.4 Ų39.48%0.07520%0.203CC..THydrogen-bonded Turntrans-95.388.1172-168.1-96.5000109.9M44 E49 H53 D74 G79 R111 G112M44-Y77 HydrophobicContact CE-CD2 4.25Å; M44-Y77 HydrophobicContact SD-CD2 3.63Å; M44-Y77 HydrophobicContact SD-CE2 4Å; E49-Y77 HydrophobicContact CG-CE1 4.44Å; E49-Y77 WeakPolarHBondContact CG-OH 3.34Å; E49-Y77 PolarHBondContact OE1-OH 3.34Å; E49-Y77 VanDerWaalsContact OE1-OH 3.1Å; H53-Y77 HydrophobicContact CB-CE1 4.47Å; H53-Y77 AromaticContact CD2-CD1 3.9Å; H53-Y77 PolarHBondContact CD2-O 3.26Å; H53-Y77 AromaticContact NE2-CD1 3.96Å; H53-Y77 PolarHBondContact NE2-O 3.44Å; D74-Y77 PolarHBondContact O-N 2.92Å; Y77-G79 VanDerWaalsContact C-N 3.29Å; Y77-G79 PolarHBondContact O-N 2.93Å; Y77-G79 VanDerWaalsContact O-N 3.16Å; Y77-R111 HydrophobicContact CD1-CG 4.37Å; Y77-R111 HydrophobicContact CE1-CB 4.12Å; Y77-R111 HydrophobicContact CE1-CG 3.85Å; Y77-G112 PolarHBondContact OH-N 3.32Å
78W95.7Very high95.5Very high67 Ų6742.1 Ų42.125%0.25421%0.213SC..THydrogen-bonded Turntrans49.642.8176.8-63.1118.8000115.6M44 A50 H53 W54 M76M44-W78 PolarHBondContact O-NE1 3.01Å; A50-W78 HydrophobicContact CB-CB 3.97Å; A50-W78 HydrophobicContact CB-CD2 3.44Å; A50-W78 VanDerWaalsContact CB-CD2 3.44Å; A50-W78 HydrophobicContact CB-CE3 3.4Å; A50-W78 HydrophobicContact CB-CG 3.71Å; A50-W78 HydrophobicContact CB-CZ3 4.02Å; H53-W78 HydrophobicContact CB-CB 4.49Å; W54-W78 VanDerWaalsContact CD1-O 3.31Å; W54-W78 PolarHBondContact NE1-O 2.82Å; M76-W78 PolarHBondContact O-N 3.4Å
79G95.7Very high95.7Very high2 Ų240.4 Ų40.42%0.02120%0.202CC..  trans-55.2149.3175.300000112.7L75 Y77 D81 R272L75-G79 PolarHBondContact O-N 2.86Å; Y77-G79 VanDerWaalsContact C-N 3.29Å; Y77-G79 PolarHBondContact O-N 2.93Å; Y77-G79 VanDerWaalsContact O-N 3.16Å; G79-D81 PolarHBondContact O-N 2.88Å; G79-R272 VanDerWaalsContact C-NH2 3.27Å; G79-R272 VanDerWaalsContact CA-NH2 3.35Å; G79-R272 PolarHBondContact O-NH2 3.28Å; G79-R272 VanDerWaalsContact O-NH2 3.12Å
80L96.4Very high95.9Very high0 Ų034.9 Ų34.90%018%0.176CC..  trans-69.1121.2-172.5-150.6141.2000111.3W54 I57 T58 Y67 Y82 A87W54-L80 HydrophobicContact CB-CD1 4.12Å; W54-L80 HydrophobicContact CD2-CD1 4.43Å; W54-L80 HydrophobicContact CD2-CG 4.27Å; W54-L80 HydrophobicContact CG-CD1 4.01Å; W54-L80 HydrophobicContact CG-CG 4.24Å; I57-L80 HydrophobicContact CD1-CB 4.18Å; I57-L80 HydrophobicContact CD1-CD1 4.03Å; T58-L80 HydrophobicContact CG2-CD1 4.05Å; Y67-L80 HydrophobicContact CD1-CB 4.37Å; Y67-L80 HydrophobicContact CD1-CD2 4.18Å; Y67-L80 WeakPolarHBondContact CD1-O 3.48Å; Y67-L80 HydrophobicContact CE1-CB 4.26Å; Y67-L80 HydrophobicContact CE1-CD2 3.29Å; Y67-L80 HydrophobicContact CE1-CG 4.39Å; Y67-L80 HydrophobicContact CE2-CD2 4.09Å; Y67-L80 WeakPolarHBondContact OH-CD2 3.44Å; L80-Y82 VanDerWaalsContact CD2-O 3.29Å; L80-Y82 WeakPolarHBondContact CD2-O 3.32Å; L80-A87 HydrophobicContact CD1-CB 3.91Å; L80-A87 HydrophobicContact CD2-CB 3.96Å
81D93.8Very high96.1Very high25 Ų2539 Ų3913%0.13419%0.187CC..  trans-115.5-3-170.6-76.1-10.2000113.8G79 Q212 R272 R278G79-D81 PolarHBondContact O-N 2.88Å; D81-Q212 PolarHBondContact O-NE2 3.46Å; D81-R272 IonicContact OD1-CZ 2.96Å; D81-R272 IonicContact OD1-NE 3.72Å; D81-R272 PolarHBondContact OD1-NE 2.88Å; D81-R272 IonicContact OD1-NH2 3.74Å; D81-R272 PolarHBondContact OD1-NH2 2.93Å; D81-R272 IonicContact OD2-NH2 3.84Å; D81-R278 IonicContact OD1-NH2 3.5Å; D81-R278 IonicContact OD2-CZ 3.13Å; D81-R278 IonicContact OD2-NH1 2.87Å; D81-R278 PolarHBondContact OD2-NH1 3.05Å; D81-R278 VanDerWaalsContact OD2-NH1 3.09Å; D81-R278 IonicContact OD2-NH2 2.67Å; D81-R278 PolarHBondContact OD2-NH2 3.19Å
82Y97Very high96.5Very high39 Ų3936.1 Ų36.115%0.15317%0.17CC..SBendtrans-107.5156.1-176.1-70.33.1000110.9W54 Y67 L80 T86 K211W54-Y82 HydrophobicContact CH2-CD1 4.16Å; W54-Y82 AromaticContact CH2-CD2 3.72Å; W54-Y82 HydrophobicContact CH2-CD2 3.72Å; W54-Y82 HydrophobicContact CH2-CE1 4.18Å; W54-Y82 AromaticContact CH2-CE2 3.75Å; W54-Y82 HydrophobicContact CH2-CE2 3.75Å; W54-Y82 AromaticContact CH2-CG 3.91Å; W54-Y82 HydrophobicContact CH2-CG 3.91Å; W54-Y82 AromaticContact CH2-CZ 3.97Å; W54-Y82 AromaticContact CZ3-CD2 3.61Å; W54-Y82 HydrophobicContact CZ3-CD2 3.61Å; W54-Y82 AromaticContact CZ3-CE2 3.83Å; W54-Y82 HydrophobicContact CZ3-CE2 3.83Å; W54-Y82 HydrophobicContact CZ3-CG 4.11Å; Y67-Y82 VanDerWaalsContact CE1-O 3.28Å; Y67-Y82 WeakPolarHBondContact CE1-O 3.5Å; Y67-Y82 PolarHBondContact OH-O 2.84Å; L80-Y82 VanDerWaalsContact CD2-O 3.29Å; L80-Y82 WeakPolarHBondContact CD2-O 3.32Å; Y82-T86 HydrophobicContact CD2-CG2 3.85Å; Y82-T86 HydrophobicContact CG-CG2 4.3Å; Y82-K211 VanDerWaalsContact CE2-CE 3.45Å; Y82-K211 VanDerWaalsContact OH-CE 3.23Å; Y82-K211 WeakPolarHBondContact OH-CE 3.37Å; Y82-K211 PolarHBondContact OH-NZ 3.2Å
83P98Very high96.8Very high2 Ų234.9 Ų34.91%0.01316%0.16CC..  trans-63.7166.9-178.79.3-14.8000114Y67 L85 T86 L208 C209 Y210 Q212 W256 L273Y67-P83 VanDerWaalsContact OH-C 3.3Å; P83-L85 PolarHBondContact O-N 3.25Å; P83-T86 WeakPolarHBondContact O-CB 3.32Å; P83-T86 PolarHBondContact O-N 3.43Å; P83-L208 WeakPolarHBondContact CG-O 3.37Å; P83-C209 CarbonylContact C-O 3.24Å; P83-C209 WeakPolarHBondContact CB-O 3.11Å; P83-C209 WeakPolarHBondContact CG-O 3.46Å; P83-Y210 WeakPolarHBondContact CD-O 3.4Å; P83-Q212 HydrophobicContact CG-CB 4.26Å; P83-W256 HydrophobicContact CB-CZ2 4.33Å; P83-L273 HydrophobicContact CB-CD2 3.75Å; P83-L273 HydrophobicContact CB-CG 4.41Å; P83-L273 HydrophobicContact CG-CD2 4.12Å; P83-L273 HydrophobicContact CG-CG 4.5Å
84P98.2Very high96.9Very high0 Ų034.8 Ų34.80%016%0.159CC..Hα-helixtrans-52.9-30.9-167.4-33.938.4000116.6T86 A87 Y88 I255 W256 F259P84-T86 VanDerWaalsContact C-N 3.26Å; P84-T86 PolarHBondContact O-N 3.42Å; P84-A87 WeakPolarHBondContact O-CB 3Å; P84-A87 PolarHBondContact O-N 3.32Å; P84-Y88 HydrophobicContact CB-CE2 4.03Å; P84-Y88 VanDerWaalsContact O-CD2 3.26Å; P84-Y88 WeakPolarHBondContact O-CD2 3.3Å; P84-Y88 PolarHBondContact O-N 2.92Å; P84-I255 HydrophobicContact CB-CG2 4.02Å; P84-W256 HydrophobicContact CG-CD2 3.97Å; P84-W256 HydrophobicContact CG-CE3 4.35Å; P84-W256 HydrophobicContact CG-CG 4.29Å; P84-W256 HydrophobicContact CG-CZ2 4.32Å; P84-F259 HydrophobicContact CB-CD2 3.88Å; P84-F259 HydrophobicContact CB-CE2 3.6Å; P84-F259 HydrophobicContact CB-CZ 4.47Å; P84-F259 HydrophobicContact CG-CD2 3.59Å; P84-F259 HydrophobicContact CG-CE2 3.77Å; P84-F259 HydrophobicContact CG-CG 4.29Å
85L98.4Very high97.1Very high43 Ų4334.8 Ų34.823%0.22516%0.158CC..Hα-helixtrans-67-30.6-179.5-165.761.8000111.8P83 Y88 H89 L184 C206 C209 Y210 I255P83-L85 PolarHBondContact O-N 3.25Å; L85-Y88 HydrophobicContact CD1-CD2 4.31Å; L85-H89 WeakPolarHBondContact O-CB 3.45Å; L85-H89 PolarHBondContact O-N 3.09Å; L85-L184 HydrophobicContact CD2-CD1 4.23Å; L85-C206 HydrophobicContact CD2-CB 3.94Å; L85-C206 VanDerWaalsContact CD2-O 3.29Å; L85-C206 WeakPolarHBondContact CD2-O 3.44Å; L85-C209 HydrophobicContact CB-CB 4.13Å; L85-C209 WeakPolarHBondContact CB-O 3.26Å; L85-C209 PolarHBondContact N-O 2.88Å; L85-Y210 HydrophobicContact CB-CD2 4.37Å; L85-Y210 HydrophobicContact CD2-CD2 4.43Å; L85-Y210 HydrophobicContact CG-CD2 4.18Å; L85-I255 HydrophobicContact CB-CG2 4.37Å
86T98.6Very high97.3Very high0 Ų035 Ų350%017%0.165CC..Hα-helixtrans-63.8-44.7169.2-73.40000110.6W54 Y82 P83 P84 Y88 H89 S90 Y210W54-T86 HydrophobicContact CE3-CG2 3.87Å; W54-T86 HydrophobicContact CZ3-CG2 3.78Å; Y82-T86 HydrophobicContact CD2-CG2 3.85Å; Y82-T86 HydrophobicContact CG-CG2 4.3Å; P83-T86 WeakPolarHBondContact O-CB 3.32Å; P83-T86 PolarHBondContact O-N 3.43Å; P84-T86 VanDerWaalsContact C-N 3.26Å; P84-T86 PolarHBondContact O-N 3.42Å; T86-Y88 VanDerWaalsContact C-N 3.34Å; T86-Y88 PolarHBondContact O-N 3.07Å; T86-H89 WeakPolarHBondContact O-CB 3.44Å; T86-H89 PolarHBondContact O-N 2.8Å; T86-H89 VanDerWaalsContact O-N 3.14Å; T86-S90 PolarHBondContact O-N 2.64Å; T86-S90 PolarHBondContact O-OG 3.09Å; T86-Y210 PolarHBondContact OG1-O 3.24Å
87A98.3Very high97.6Very high0 Ų028.3 Ų28.30%013%0.132CC..Hα-helixtrans-62.7-40.9-179.700000111.9T58 W66 L80 P84 H89 S90 W91T58-A87 HydrophobicContact CG2-CB 4.21Å; W66-A87 HydrophobicContact CE3-CB 3.51Å; W66-A87 HydrophobicContact CZ3-CB 3.53Å; L80-A87 HydrophobicContact CD1-CB 3.91Å; L80-A87 HydrophobicContact CD2-CB 3.96Å; P84-A87 WeakPolarHBondContact O-CB 3Å; P84-A87 PolarHBondContact O-N 3.32Å; A87-H89 VanDerWaalsContact C-N 3.35Å; A87-H89 PolarHBondContact O-N 2.72Å; A87-S90 PolarHBondContact O-N 2.95Å; A87-W91 WeakPolarHBondContact O-CB 3.38Å; A87-W91 PolarHBondContact O-N 3.12Å
88Y98.5Very high97.7Very high58 Ų5832.4 Ų32.423%0.22715%0.147CC..Hα-helixtrans-66-35.7173.6-57.1-40.8000113W66 P84 L85 T86 W91 M92 I255 P258 F259W66-Y88 HydrophobicContact CH2-CD1 4.05Å; W66-Y88 HydrophobicContact CH2-CE1 4.31Å; W66-Y88 AromaticContact CZ3-CD1 3.84Å; W66-Y88 HydrophobicContact CZ3-CD1 3.84Å; W66-Y88 AromaticContact CZ3-CE1 3.94Å; W66-Y88 HydrophobicContact CZ3-CE1 3.94Å; P84-Y88 HydrophobicContact CB-CE2 4.03Å; P84-Y88 VanDerWaalsContact O-CD2 3.26Å; P84-Y88 WeakPolarHBondContact O-CD2 3.3Å; P84-Y88 PolarHBondContact O-N 2.92Å; L85-Y88 HydrophobicContact CD1-CD2 4.31Å; T86-Y88 VanDerWaalsContact C-N 3.34Å; T86-Y88 PolarHBondContact O-N 3.07Å; Y88-W91 WeakPolarHBondContact O-CB 3.46Å; Y88-W91 PolarHBondContact O-N 3.08Å; Y88-M92 PolarHBondContact O-N 3.05Å; Y88-I255 HydrophobicContact CE2-CG2 4.22Å; Y88-I255 WeakPolarHBondContact CE2-O 3.45Å; Y88-I255 PolarHBondContact OH-O 3.28Å; Y88-P258 VanDerWaalsContact OH-CD 3.26Å; Y88-P258 WeakPolarHBondContact OH-CD 3.46Å; Y88-P258 WeakPolarHBondContact OH-CG 3.39Å; Y88-F259 HydrophobicContact CE1-CE2 4.36Å; Y88-F259 WeakPolarHBondContact OH-CE2 3.15Å
89H98.4Very high97.8Very high21 Ų2136.2 Ų36.210%0.09717%0.171CC..Hα-helixtrans-65.6-46.8173.9179.9-133.3000111.2L85 T86 A87 W91 M92 L93 S129 Y177 Y210L85-H89 WeakPolarHBondContact O-CB 3.45Å; L85-H89 PolarHBondContact O-N 3.09Å; T86-H89 WeakPolarHBondContact O-CB 3.44Å; T86-H89 PolarHBondContact O-N 2.8Å; T86-H89 VanDerWaalsContact O-N 3.14Å; A87-H89 VanDerWaalsContact C-N 3.35Å; A87-H89 PolarHBondContact O-N 2.72Å; H89-W91 VanDerWaalsContact C-N 3.29Å; H89-W91 PolarHBondContact O-N 2.96Å; H89-M92 PolarHBondContact O-N 3.43Å; H89-L93 WeakPolarHBondContact O-CG 3.27Å; H89-L93 PolarHBondContact O-N 3.01Å; H89-S129 PolarHBondContact NE2-OG 2.82Å; H89-Y177 AromaticContact CE1-CD1 3.66Å; H89-Y177 AromaticContact CE1-CE1 3.83Å; H89-Y210 HydrophobicContact CB-CE2 3.8Å; H89-Y210 PolarHBondContact CE1-OH 3.14Å; H89-Y210 AromaticContact CG-CE2 3.94Å; H89-Y210 AromaticContact ND1-CE2 3.62Å; H89-Y210 AromaticContact ND1-CZ 3.66Å; H89-Y210 PolarHBondContact ND1-OH 3.25Å
90S98.5Very high97.8Very high2 Ų240.6 Ų40.61%0.01420%0.197CC..Hα-helixtrans-59.7-38.8173.7-63.80000112.2M55 T86 A87 L93 G94M55-S90 WeakPolarHBondContact CG-O 2.88Å; T86-S90 PolarHBondContact O-N 2.64Å; T86-S90 PolarHBondContact O-OG 3.09Å; A87-S90 PolarHBondContact O-N 2.95Å; S90-L93 PolarHBondContact O-N 2.88Å; S90-G94 PolarHBondContact O-N 3.03Å
91W98.4Very high97.9Very high113 Ų11343.4 Ų43.443%0.42821%0.212SC..Hα-helixtrans-60.4-47.3174.3174.675.7000112.1T58 W66 A87 Y88 H89 G94 H95T58-W91 VanDerWaalsContact O-CD1 3.3Å; T58-W91 VanDerWaalsContact OG1-CA 3.28Å; T58-W91 WeakPolarHBondContact OG1-CA 3.28Å; T58-W91 PolarHBondContact OG1-N 3.41Å; W66-W91 HydrophobicContact CH2-CB 4.24Å; W66-W91 HydrophobicContact CH2-CG 4.46Å; A87-W91 WeakPolarHBondContact O-CB 3.38Å; A87-W91 PolarHBondContact O-N 3.12Å; Y88-W91 WeakPolarHBondContact O-CB 3.46Å; Y88-W91 PolarHBondContact O-N 3.08Å; H89-W91 VanDerWaalsContact C-N 3.29Å; H89-W91 PolarHBondContact O-N 2.96Å; W91-G94 PolarHBondContact O-N 3.49Å; W91-H95 AromaticContact CE2-CD2 3.63Å; W91-H95 AromaticContact CE2-NE2 3.22Å; W91-H95 AromaticContact CZ2-CD2 3.58Å; W91-H95 AromaticContact CZ2-NE2 3.18Å; W91-H95 WeakPolarHBondContact CZ2-NE2 2.8Å; W91-H95 AromaticContact NE1-CD2 3.97Å; W91-H95 AromaticContact NE1-CE1 3.72Å; W91-H95 AromaticContact NE1-NE2 3.25Å; W91-H95 PolarHBondContact NE1-NE2 3.3Å; W91-H95 PolarHBondContact O-N 3.43Å
92M98.2Very high98.1Very high109 Ų10950.8 Ų50.854%0.53724%0.239SC..Hα-helixtrans-62.1-46.8177.6-176.5-173.17600111.5Y88 H89 G94 H95 G96Y88-M92 PolarHBondContact O-N 3.05Å; H89-M92 PolarHBondContact O-N 3.43Å; M92-G94 VanDerWaalsContact C-N 3.35Å; M92-H95 PolarHBondContact O-N 3.19Å; M92-G96 PolarHBondContact O-N 3.44Å
93L98.3Very high98.1Very high18 Ų1851.8 Ų51.89%0.09425%0.249CC..Hα-helixtrans-66.3-37.1177.7-64.3-174.2000112M55 H89 S90 H95 G96 A97 T125 Y177M55-L93 HydrophobicContact CE-CB 3.65Å; M55-L93 HydrophobicContact CE-CD1 3.64Å; M55-L93 HydrophobicContact CE-CG 4.32Å; M55-L93 HydrophobicContact CG-CB 4.33Å; M55-L93 HydrophobicContact SD-CB 3.89Å; H89-L93 WeakPolarHBondContact O-CG 3.27Å; H89-L93 PolarHBondContact O-N 3.01Å; S90-L93 PolarHBondContact O-N 2.88Å; L93-H95 VanDerWaalsContact C-N 3.31Å; L93-H95 PolarHBondContact O-N 3.21Å; L93-G96 CarbonylContact O-C 3.54Å; L93-G96 WeakPolarHBondContact O-CA 3.01Å; L93-G96 PolarHBondContact O-N 2.94Å; L93-A97 PolarHBondContact O-N 2.84Å; L93-T125 HydrophobicContact CD1-CG2 4.45Å; L93-T125 HydrophobicContact CD2-CG2 3.88Å; L93-Y177 HydrophobicContact CD1-CE1 3.91Å; L93-Y177 HydrophobicContact CD1-CE2 4.38Å; L93-Y177 WeakPolarHBondContact CD1-OH 3.42Å
94G98.3Very high98.1Very high0 Ų052.1 Ų52.10%025%0.25CC..Hα-helixtrans-64-33.9175.700000113S90 W91 M92 A97 R98S90-G94 PolarHBondContact O-N 3.03Å; W91-G94 PolarHBondContact O-N 3.49Å; M92-G94 VanDerWaalsContact C-N 3.35Å; G94-A97 PolarHBondContact O-N 3.03Å; G94-R98 WeakPolarHBondContact O-CB 3.44Å; G94-R98 PolarHBondContact O-N 3.3Å
95H98.3Very high98.1Very high49 Ų4952.3 Ų52.323%0.22725%0.251CS..Hα-helixtrans-64-41.4168.9-79.9-18.6000112.4W91 M92 L93 R98 I99W91-H95 AromaticContact CE2-CD2 3.63Å; W91-H95 AromaticContact CE2-NE2 3.22Å; W91-H95 AromaticContact CZ2-CD2 3.58Å; W91-H95 AromaticContact CZ2-NE2 3.18Å; W91-H95 WeakPolarHBondContact CZ2-NE2 2.8Å; W91-H95 AromaticContact NE1-CD2 3.97Å; W91-H95 AromaticContact NE1-CE1 3.72Å; W91-H95 AromaticContact NE1-NE2 3.25Å; W91-H95 PolarHBondContact NE1-NE2 3.3Å; W91-H95 PolarHBondContact O-N 3.43Å; M92-H95 PolarHBondContact O-N 3.19Å; L93-H95 VanDerWaalsContact C-N 3.31Å; L93-H95 PolarHBondContact O-N 3.21Å; H95-R98 PolarHBondContact CE1-NH2 3.1Å; H95-R98 VanDerWaalsContact CE1-NH2 3.26Å; H95-R98 PolarHBondContact ND1-NH2 3.42Å; H95-R98 PolarHBondContact O-N 2.93Å; H95-I99 VanDerWaalsContact O-CG1 3.3Å; H95-I99 WeakPolarHBondContact O-CG1 3.45Å; H95-I99 PolarHBondContact O-N 3.4Å; H95-I99 VanDerWaalsContact O-N 3.14Å
96G97.9Very high98Very high26 Ų2653.7 Ų53.727%0.26826%0.256SS..Hα-helixtrans-57.9-48.617100000112.2M92 L93 R98 I99 V100M92-G96 PolarHBondContact O-N 3.44Å; L93-G96 CarbonylContact O-C 3.54Å; L93-G96 WeakPolarHBondContact O-CA 3.01Å; L93-G96 PolarHBondContact O-N 2.94Å; G96-R98 PolarHBondContact O-N 3.39Å; G96-I99 PolarHBondContact O-N 2.97Å; G96-V100 WeakPolarHBondContact O-CG2 3.45Å; G96-V100 PolarHBondContact O-N 2.95Å
97A98.2Very high97.9Very high1 Ų156 Ų561%0.00827%0.268CS..Hα-helixtrans-58.6-46.817800000111.4L93 G94 I99 V100 N101 W104 V105 F121L93-A97 PolarHBondContact O-N 2.84Å; G94-A97 PolarHBondContact O-N 3.03Å; A97-I99 VanDerWaalsContact C-N 3.26Å; A97-I99 PolarHBondContact O-N 3.23Å; A97-V100 PolarHBondContact O-N 3.22Å; A97-V100 VanDerWaalsContact O-N 3.14Å; A97-N101 CarbonylContact O-C 3.57Å; A97-N101 PolarHBondContact O-N 2.86Å; A97-W104 HydrophobicContact CB-CE3 4.31Å; A97-V105 HydrophobicContact CB-CG1 3.84Å; A97-V105 HydrophobicContact CB-CG2 4.43Å; A97-F121 HydrophobicContact CB-CD1 4.45Å; A97-F121 HydrophobicContact CB-CE1 3.67Å; A97-F121 HydrophobicContact CB-CZ 3.8Å; A97-F121 VanDerWaalsContact N-CZ 3.32Å
98R97.7Very high97.6Very high105 Ų10561.1 Ų61.140%0.39629%0.292SS..Hα-helixtrans-61.6-31.9179.4-170.617564.7-179.52.1113.4I59 G94 H95 G96 R102 V105I59-R98 HydrophobicContact CD1-CB 4.23Å; G94-R98 WeakPolarHBondContact O-CB 3.44Å; G94-R98 PolarHBondContact O-N 3.3Å; H95-R98 PolarHBondContact CE1-NH2 3.1Å; H95-R98 VanDerWaalsContact CE1-NH2 3.26Å; H95-R98 PolarHBondContact ND1-NH2 3.42Å; H95-R98 PolarHBondContact O-N 2.93Å; G96-R98 PolarHBondContact O-N 3.39Å; R98-R102 HydrophobicContact CG-CG 4Å; R98-R102 VanDerWaalsContact O-CG 3.31Å; R98-R102 WeakPolarHBondContact O-CG 3.45Å; R98-V105 HydrophobicContact CB-CG2 3.92Å; R98-V105 HydrophobicContact CG-CG2 4.47Å
99I97.8Very high97.4Very high147 Ų14766.4 Ų66.475%0.75432%0.316SS*.Hα-helixtrans-71.2-42.6176.3-69.1164.5000110.4H95 G96 A97H95-I99 VanDerWaalsContact O-CG1 3.3Å; H95-I99 WeakPolarHBondContact O-CG1 3.45Å; H95-I99 PolarHBondContact O-N 3.4Å; H95-I99 VanDerWaalsContact O-N 3.14Å; G96-I99 PolarHBondContact O-N 2.97Å; A97-I99 VanDerWaalsContact C-N 3.26Å; A97-I99 PolarHBondContact O-N 3.23Å
100V97.6Very high97.3Very high94 Ų9465.4 Ų65.457%0.5731%0.312SS*.Hα-helixtrans-73.1-54-178.8178.50000111G96 A97 W104 F121G96-V100 WeakPolarHBondContact O-CG2 3.45Å; G96-V100 PolarHBondContact O-N 2.95Å; A97-V100 PolarHBondContact O-N 3.22Å; A97-V100 VanDerWaalsContact O-N 3.14Å; V100-W104 HydrophobicContact CB-CH2 4.33Å; V100-W104 HydrophobicContact CB-CZ3 3.89Å; V100-W104 HydrophobicContact CG1-CH2 3.52Å; V100-W104 HydrophobicContact CG1-CZ3 3.59Å; V100-F121 HydrophobicContact CG2-CD2 4.3Å; V100-F121 HydrophobicContact CG2-CE2 4.29Å
101N97.8Very high97.2Very high59 Ų5969.3 Ų69.332%0.31633%0.326SS..  trans-153.2114.9176.1-171.9-12000111A97 T103 W104A97-N101 CarbonylContact O-C 3.57Å; A97-N101 PolarHBondContact O-N 2.86Å; N101-T103 PolarHBondContact ND2-OG1 2.82Å; N101-T103 PolarHBondContact O-N 3.18Å; N101-T103 PolarHBondContact OD1-N 3.22Å; N101-T103 VanDerWaalsContact OD1-N 3.09Å; N101-T103 PolarHBondContact OD1-OG1 2.92Å; N101-W104 HydrophobicContact CB-CD2 3.69Å; N101-W104 HydrophobicContact CB-CE3 4.07Å; N101-W104 HydrophobicContact CB-CG 4.15Å; N101-W104 HydrophobicContact CB-CH2 4.22Å; N101-W104 HydrophobicContact CB-CZ2 3.83Å; N101-W104 HydrophobicContact CB-CZ3 4.32Å; N101-W104 PolarHBondContact ND2-NE1 3.49Å; N101-W104 PolarHBondContact O-N 3.24Å
102R97.2Very high97.1Very high181 Ų18164.7 Ų64.768%0.68331%0.313SS*.G310 helixtrans-60-33.7-178.4-66-173.6178.5-174.80.5112.9R98 W104 V105 E106R98-R102 HydrophobicContact CG-CG 4Å; R98-R102 VanDerWaalsContact O-CG 3.31Å; R98-R102 WeakPolarHBondContact O-CG 3.45Å; R102-W104 PolarHBondContact O-N 3.33Å; R102-W104 VanDerWaalsContact O-N 3.09Å; R102-V105 PolarHBondContact O-N 3.47Å; R102-V105 VanDerWaalsContact O-N 3.14Å; R102-E106 PolarHBondContact O-N 3.43Å
103T97.9Very high97Very high60 Ų6061.8 Ų61.837%0.36830%0.3SS..G310 helixtrans-65.6-17-173.6680000113.4N101 V105 S110N101-T103 PolarHBondContact ND2-OG1 2.82Å; N101-T103 PolarHBondContact O-N 3.18Å; N101-T103 PolarHBondContact OD1-N 3.22Å; N101-T103 VanDerWaalsContact OD1-N 3.09Å; N101-T103 PolarHBondContact OD1-OG1 2.92Å; T103-V105 VanDerWaalsContact C-N 3.27Å; T103-V105 PolarHBondContact O-N 2.88Å; T103-S110 WeakPolarHBondContact O-CB 3.27Å
104W98Very high96.8Very high9 Ų964 Ų643%0.03431%0.31CS..G310 helixtrans-72.7-20.1178-61.9-14.2000114R52 A97 V100 N101 R102 S110 D117 L118 F121R52-W104 PolarHBondContact NH1-O 2.93Å; A97-W104 HydrophobicContact CB-CE3 4.31Å; V100-W104 HydrophobicContact CB-CH2 4.33Å; V100-W104 HydrophobicContact CB-CZ3 3.89Å; V100-W104 HydrophobicContact CG1-CH2 3.52Å; V100-W104 HydrophobicContact CG1-CZ3 3.59Å; N101-W104 HydrophobicContact CB-CD2 3.69Å; N101-W104 HydrophobicContact CB-CE3 4.07Å; N101-W104 HydrophobicContact CB-CG 4.15Å; N101-W104 HydrophobicContact CB-CH2 4.22Å; N101-W104 HydrophobicContact CB-CZ2 3.83Å; N101-W104 HydrophobicContact CB-CZ3 4.32Å; N101-W104 PolarHBondContact ND2-NE1 3.49Å; N101-W104 PolarHBondContact O-N 3.24Å; R102-W104 PolarHBondContact O-N 3.33Å; R102-W104 VanDerWaalsContact O-N 3.09Å; W104-S110 WeakPolarHBondContact O-CB 3.39Å; W104-D117 HydrophobicContact CH2-CB 4.26Å; W104-D117 HydrophobicContact CZ2-CB 3.68Å; W104-L118 HydrophobicContact CB-CD1 3.98Å; W104-L118 HydrophobicContact CB-CD2 4.49Å; W104-L118 HydrophobicContact CD2-CB 4.16Å; W104-L118 HydrophobicContact CD2-CD1 3.66Å; W104-L118 HydrophobicContact CD2-CG 4.39Å; W104-L118 HydrophobicContact CE3-CD1 3.8Å; W104-L118 HydrophobicContact CG-CB 4.37Å; W104-L118 HydrophobicContact CG-CD1 3.77Å; W104-L118 HydrophobicContact CG-CD2 4.32Å; W104-L118 HydrophobicContact CG-CG 4.36Å; W104-L118 HydrophobicContact CZ2-CB 4.29Å; W104-L118 HydrophobicContact CZ3-CD1 4.49Å; W104-F121 HydrophobicContact CE3-CB 4.44Å; W104-F121 HydrophobicContact CE3-CD1 4.29Å; W104-F121 HydrophobicContact CE3-CG 4.26Å; W104-F121 HydrophobicContact CH2-CB 3.91Å; W104-F121 HydrophobicContact CH2-CG 4.41Å; W104-F121 HydrophobicContact CZ3-CB 3.57Å; W104-F121 HydrophobicContact CZ3-CD1 4.08Å; W104-F121 AromaticContact CZ3-CD2 3.99Å; W104-F121 HydrophobicContact CZ3-CD2 3.99Å; W104-F121 AromaticContact CZ3-CG 3.6Å; W104-F121 HydrophobicContact CZ3-CG 3.6Å
105V97.7Very high96.7Very high4 Ų466 Ų662%0.02432%0.323CS..G310 helixtrans-137.323.6-172.4-68.30000111.4M55 I59 N60 A97 R98 R102 T103 L107M55-V105 HydrophobicContact CB-CG1 4.1Å; I59-V105 HydrophobicContact CD1-CB 3.57Å; I59-V105 HydrophobicContact CD1-CG1 4.37Å; I59-V105 HydrophobicContact CD1-CG2 3.35Å; N60-V105 PolarHBondContact ND2-O 3.31Å; A97-V105 HydrophobicContact CB-CG1 3.84Å; A97-V105 HydrophobicContact CB-CG2 4.43Å; R98-V105 HydrophobicContact CB-CG2 3.92Å; R98-V105 HydrophobicContact CG-CG2 4.47Å; R102-V105 PolarHBondContact O-N 3.47Å; R102-V105 VanDerWaalsContact O-N 3.14Å; T103-V105 VanDerWaalsContact C-N 3.27Å; T103-V105 PolarHBondContact O-N 2.88Å; V105-L107 PolarHBondContact O-N 2.86Å
106E97.1Very high96.6Very high71 Ų7170.3 Ų70.333%0.33235%0.348SS..  trans-73124170.8-83.6-179.1-162.200110R102 E108 K109 S110R102-E106 PolarHBondContact O-N 3.43Å; E106-E108 PolarHBondContact O-N 2.94Å; E106-K109 HydrophobicContact CB-CB 4.09Å; E106-K109 PolarHBondContact O-N 3.44Å; E106-K109 WeakPolarHBondContact OE2-CD 3.42Å; E106-S110 PolarHBondContact N-OG 2.96Å; E106-S110 VanDerWaalsContact O-CB 3.29Å; E106-S110 WeakPolarHBondContact O-CB 3.39Å; E106-S110 PolarHBondContact O-N 3.33Å; E106-S110 PolarHBondContact O-OG 3.47Å
107L96Very high96.6Very high49 Ų4974.3 Ų74.326%0.25736%0.363SS..THydrogen-bonded Turntrans-54.2128.9-178.8-169.866.5000110.9E56 N60 L61 V105 K109E56-L107 HydrophobicContact CG-CD1 4.42Å; E56-L107 VanDerWaalsContact OE1-CA 3.3Å; E56-L107 WeakPolarHBondContact OE1-CA 3.12Å; N60-L107 HydrophobicContact CB-CB 4.11Å; N60-L107 HydrophobicContact CB-CD1 4.21Å; N60-L107 HydrophobicContact CB-CD2 4.32Å; N60-L107 HydrophobicContact CB-CG 4.45Å; L61-L107 HydrophobicContact CD2-CD1 4.12Å; L61-L107 HydrophobicContact CD2-CD2 3.81Å; L61-L107 HydrophobicContact CG-CD1 4.35Å; V105-L107 PolarHBondContact O-N 2.86Å; L107-K109 PolarHBondContact O-N 2.88Å
108E91.9Very high96.6Very high108 Ų10874.4 Ų74.451%0.50536%0.363SS..THydrogen-bonded Turntrans65.5-23.6-179.7-65.1172-177.200116.3E56 E106E56-E108 PolarHBondContact OE1-N 2.72Å; E106-E108 PolarHBondContact O-N 2.94Å
109K94.9Very high96.6Very high168 Ų16870.8 Ų70.873%0.7335%0.35SS*.THydrogen-bonded Turntrans-88.2-27.2-179-66.5178.4179.5178.40113.7E106 L107E106-K109 HydrophobicContact CB-CB 4.09Å; E106-K109 PolarHBondContact O-N 3.44Å; E106-K109 WeakPolarHBondContact OE2-CD 3.42Å; L107-K109 PolarHBondContact O-N 2.88Å
110S95.9Very high96.6Very high1 Ų170.6 Ų70.61%0.00734%0.344CS..SBendtrans-89.41.7-174.760.40000114.1R52 E56 T103 W104 E106 G112 I113R52-S110 PolarHBondContact NE-O 3.06Å; R52-S110 PolarHBondContact NH1-O 3.36Å; R52-S110 PolarHBondContact NH1-OG 3.48Å; R52-S110 PolarHBondContact NH2-O 3.29Å; E56-S110 VanDerWaalsContact CD-OG 3.28Å; E56-S110 PolarHBondContact OE2-OG 2.69Å; T103-S110 WeakPolarHBondContact O-CB 3.27Å; W104-S110 WeakPolarHBondContact O-CB 3.39Å; E106-S110 PolarHBondContact N-OG 2.96Å; E106-S110 VanDerWaalsContact O-CB 3.29Å; E106-S110 WeakPolarHBondContact O-CB 3.39Å; E106-S110 PolarHBondContact O-N 3.33Å; E106-S110 PolarHBondContact O-OG 3.47Å; S110-G112 PolarHBondContact O-N 3.11Å; S110-I113 WeakPolarHBondContact O-CB 3.29Å; S110-I113 WeakPolarHBondContact O-CG2 3.46Å; S110-I113 PolarHBondContact O-N 3.25Å
111R95.8Very high96.7Very high84 Ų8467.4 Ų67.432%0.31732%0.323SS..THydrogen-bonded Turntrans-60.9124.6-179.6-67-172.5-176.1-176.63.6111.4Y77 I113Y77-R111 HydrophobicContact CD1-CG 4.37Å; Y77-R111 HydrophobicContact CE1-CB 4.12Å; Y77-R111 HydrophobicContact CE1-CG 3.85Å; R111-I113 PolarHBondContact O-N 3.43Å
112G95.7Very high96.7Very high15 Ų1564.7 Ų64.716%0.15531%0.308CS..THydrogen-bonded Turntrans68.220.1178.600000114.6F45 E49 Y77 S110 E114F45-G112 WeakPolarHBondContact CZ-O 3.39Å; E49-G112 PolarHBondContact OE1-N 2.74Å; Y77-G112 PolarHBondContact OH-N 3.32Å; S110-G112 PolarHBondContact O-N 3.11Å; G112-E114 PolarHBondContact O-N 3.23Å
113I96.2Very high96.7Very high49 Ų4956.8 Ų56.825%0.25128%0.278SS..  trans-69.7125178.5-165.9172.5000110.5S110 R111 L118S110-I113 WeakPolarHBondContact O-CB 3.29Å; S110-I113 WeakPolarHBondContact O-CG2 3.46Å; S110-I113 PolarHBondContact O-N 3.25Å; R111-I113 PolarHBondContact O-N 3.43Å; I113-L118 HydrophobicContact CG2-CD2 3.64Å
114E96.1Very high96.7Very high64 Ų6455.4 Ų55.430%0.29927%0.271SS..  trans-116.6126.7176.2-62.7-169.111100109.5Y36 E39 N40 F45 G112Y36-E114 PolarHBondContact OH-OE1 3.08Å; E39-E114 WeakPolarHBondContact CA-OE1 3.46Å; N40-E114 WeakPolarHBondContact CA-OE2 3.48Å; N40-E114 PolarHBondContact N-OE1 3.3Å; N40-E114 PolarHBondContact N-OE2 3.11Å; N40-E114 PolarHBondContact OD1-OE2 2.96Å; F45-E114 HydrophobicContact CE1-CG 4.08Å; G112-E114 PolarHBondContact O-N 3.23Å
115S95.9Very high96.7Very high41 Ų4155.6 Ų55.629%0.28727%0.273SS..  trans-154.7153.217265.50000110.2D117 L118 K119S115-D117 VanDerWaalsContact C-N 3.28Å; S115-D117 PolarHBondContact O-N 2.96Å; S115-L118 PolarHBondContact O-N 3.13Å; S115-L118 WeakPolarHBondContact OG-CB 3.39Å; S115-L118 PolarHBondContact OG-N 3.25Å; S115-K119 PolarHBondContact O-N 3.3Å
116L96.4Very high96.8Very high141 Ų14155.5 Ų55.574%0.73827%0.272SS*.Hα-helixtrans-63.1-37.8178.3-171.667000111.6K119 F120L116-K119 WeakPolarHBondContact O-CB 3.42Å; L116-K119 PolarHBondContact O-N 3.22Å; L116-F120 WeakPolarHBondContact O-CB 3.43Å; L116-F120 PolarHBondContact O-N 3.23Å
117D97.7Very high96.8Very high110 Ų11053.4 Ų53.459%0.58826%0.263SS*.Hα-helixtrans-66.8-40.8179.5-60.8-36000111.8W104 S115 F120 F121W104-D117 HydrophobicContact CH2-CB 4.26Å; W104-D117 HydrophobicContact CZ2-CB 3.68Å; S115-D117 VanDerWaalsContact C-N 3.28Å; S115-D117 PolarHBondContact O-N 2.96Å; D117-F120 PolarHBondContact O-N 3.45Å; D117-F121 WeakPolarHBondContact O-CB 3.48Å; D117-F121 PolarHBondContact O-N 2.98Å
118L97.8Very high96.9Very high2 Ų257 Ų571%0.0128%0.277CS..Hα-helixtrans-66.1-42.9174.3179.556.3000110.8Y48 R52 W104 I113 S115 F120 F121 M122Y48-L118 VanDerWaalsContact OH-C 3.23Å; Y48-L118 WeakPolarHBondContact OH-CG 3.24Å; Y48-L118 PolarHBondContact OH-O 2.69Å; Y48-L118 VanDerWaalsContact OH-O 3.13Å; R52-L118 HydrophobicContact CG-CD2 4.28Å; W104-L118 HydrophobicContact CB-CD1 3.98Å; W104-L118 HydrophobicContact CB-CD2 4.49Å; W104-L118 HydrophobicContact CD2-CB 4.16Å; W104-L118 HydrophobicContact CD2-CD1 3.66Å; W104-L118 HydrophobicContact CD2-CG 4.39Å; W104-L118 HydrophobicContact CE3-CD1 3.8Å; W104-L118 HydrophobicContact CG-CB 4.37Å; W104-L118 HydrophobicContact CG-CD1 3.77Å; W104-L118 HydrophobicContact CG-CD2 4.32Å; W104-L118 HydrophobicContact CG-CG 4.36Å; W104-L118 HydrophobicContact CZ2-CB 4.29Å; W104-L118 HydrophobicContact CZ3-CD1 4.49Å; I113-L118 HydrophobicContact CG2-CD2 3.64Å; S115-L118 PolarHBondContact O-N 3.13Å; S115-L118 WeakPolarHBondContact OG-CB 3.39Å; S115-L118 PolarHBondContact OG-N 3.25Å; L118-F120 VanDerWaalsContact C-N 3.3Å; L118-F120 PolarHBondContact O-N 2.96Å; L118-F121 HydrophobicContact CD1-CD1 4.41Å; L118-F121 PolarHBondContact O-N 3.18Å; L118-M122 HydrophobicContact CD1-CG 3.76Å; L118-M122 HydrophobicContact CG-CG 4.25Å; L118-M122 WeakPolarHBondContact O-CB 3.44Å; L118-M122 VanDerWaalsContact O-CG 3.26Å; L118-M122 WeakPolarHBondContact O-CG 3.26Å; L118-M122 PolarHBondContact O-N 3.1Å
119K97.9Very high97.2Very high29 Ų2952.4 Ų52.413%0.12626%0.257CS..Hα-helixtrans-55.3-48.1173.8-174.2179.1-172.4159.20110.6S34 Y36 E39 Y48 S115 L116 M122 R123S34-K119 WeakPolarHBondContact O-CE 3.19Å; S34-K119 PolarHBondContact O-NZ 3.2Å; Y36-K119 HydrophobicContact CD1-CD 3.99Å; Y36-K119 HydrophobicContact CD1-CG 4.02Å; Y36-K119 HydrophobicContact CE1-CB 4.34Å; Y36-K119 HydrophobicContact CE1-CD 3.79Å; Y36-K119 HydrophobicContact CE1-CG 3.92Å; E39-K119 IonicContact OE1-NZ 2.9Å; E39-K119 PolarHBondContact OE1-NZ 3.35Å; E39-K119 IonicContact OE2-NZ 3.96Å; Y48-K119 WeakPolarHBondContact OH-CA 3.41Å; Y48-K119 PolarHBondContact OH-N 2.96Å; S115-K119 PolarHBondContact O-N 3.3Å; L116-K119 WeakPolarHBondContact O-CB 3.42Å; L116-K119 PolarHBondContact O-N 3.22Å; K119-M122 PolarHBondContact O-N 2.87Å; K119-R123 HydrophobicContact CG-CG 4.42Å; K119-R123 WeakPolarHBondContact O-CB 3.26Å; K119-R123 WeakPolarHBondContact O-CG 3.44Å; K119-R123 PolarHBondContact O-N 3.45Å
120F97.8Very high97.4Very high143 Ų14344.5 Ų44.563%0.62722%0.223SC*.Hα-helixtrans-60.1-50.6177.5179.6-100.7000111.9L116 D117 L118 M122 R123 C124L116-F120 WeakPolarHBondContact O-CB 3.43Å; L116-F120 PolarHBondContact O-N 3.23Å; D117-F120 PolarHBondContact O-N 3.45Å; L118-F120 VanDerWaalsContact C-N 3.3Å; L118-F120 PolarHBondContact O-N 2.96Å; F120-M122 PolarHBondContact O-N 2.94Å; F120-R123 PolarHBondContact O-N 2.83Å; F120-C124 VanDerWaalsContact CZ-SG 3.58Å; F120-C124 PolarHBondContact O-N 2.91Å; F120-C124 PolarHBondContact O-SG 3.01Å; F120-C124 VanDerWaalsContact O-SG 3.38Å
121F98.3Very high97.5Very high28 Ų2847.5 Ų47.512%0.12324%0.237CC..Hα-helixtrans-54.7-51.4177.8172.7-95.2000111.8A97 V100 W104 D117 L118 R123 C124 T125A97-F121 HydrophobicContact CB-CD1 4.45Å; A97-F121 HydrophobicContact CB-CE1 3.67Å; A97-F121 HydrophobicContact CB-CZ 3.8Å; A97-F121 VanDerWaalsContact N-CZ 3.32Å; V100-F121 HydrophobicContact CG2-CD2 4.3Å; V100-F121 HydrophobicContact CG2-CE2 4.29Å; W104-F121 HydrophobicContact CE3-CB 4.44Å; W104-F121 HydrophobicContact CE3-CD1 4.29Å; W104-F121 HydrophobicContact CE3-CG 4.26Å; W104-F121 HydrophobicContact CH2-CB 3.91Å; W104-F121 HydrophobicContact CH2-CG 4.41Å; W104-F121 HydrophobicContact CZ3-CB 3.57Å; W104-F121 HydrophobicContact CZ3-CD1 4.08Å; W104-F121 AromaticContact CZ3-CD2 3.99Å; W104-F121 HydrophobicContact CZ3-CD2 3.99Å; W104-F121 AromaticContact CZ3-CG 3.6Å; W104-F121 HydrophobicContact CZ3-CG 3.6Å; D117-F121 WeakPolarHBondContact O-CB 3.48Å; D117-F121 PolarHBondContact O-N 2.98Å; L118-F121 HydrophobicContact CD1-CD1 4.41Å; L118-F121 PolarHBondContact O-N 3.18Å; F121-R123 PolarHBondContact O-N 3.41Å; F121-C124 WeakPolarHBondContact O-CB 3.12Å; F121-C124 PolarHBondContact O-N 2.9Å; F121-C124 VanDerWaalsContact O-N 3.16Å; F121-T125 HydrophobicContact CD1-CG2 4.34Å; F121-T125 HydrophobicContact CE1-CG2 3.83Å; F121-T125 HydrophobicContact CE2-CG2 4.18Å; F121-T125 HydrophobicContact CZ-CG2 3.74Å; F121-T125 WeakPolarHBondContact O-CG2 3.5Å; F121-T125 PolarHBondContact O-N 3.36Å
122M98.4Very high97.5Very high1 Ų149.8 Ų49.81%0.00525%0.25CC..Hα-helixtrans-63.7-40.4-178.6-71.4-69.7-84.600111.8Y48 Q51 R52 M55 L118 K119 F120 C124 T125 V126 F175Y48-M122 HydrophobicContact CE2-CB 3.58Å; Y48-M122 HydrophobicContact CE2-CG 4Å; Y48-M122 WeakPolarHBondContact OH-CB 3.4Å; Y48-M122 VanDerWaalsContact OH-CG 3.27Å; Y48-M122 WeakPolarHBondContact OH-CG 3.31Å; Q51-M122 HydrophobicContact CB-CE 4.08Å; R52-M122 HydrophobicContact CB-CE 3.96Å; M55-M122 HydrophobicContact CE-CE 3.89Å; M55-M122 HydrophobicContact CE-SD 3.52Å; M55-M122 VanDerWaalsContact CE-SD 3.52Å; M55-M122 HydrophobicContact SD-CE 4.43Å; M55-M122 HydrophobicContact SD-SD 3.79Å; L118-M122 HydrophobicContact CD1-CG 3.76Å; L118-M122 HydrophobicContact CG-CG 4.25Å; L118-M122 WeakPolarHBondContact O-CB 3.44Å; L118-M122 VanDerWaalsContact O-CG 3.26Å; L118-M122 WeakPolarHBondContact O-CG 3.26Å; L118-M122 PolarHBondContact O-N 3.1Å; K119-M122 PolarHBondContact O-N 2.87Å; F120-M122 PolarHBondContact O-N 2.94Å; M122-C124 VanDerWaalsContact C-N 3.33Å; M122-C124 PolarHBondContact O-N 2.87Å; M122-T125 WeakPolarHBondContact CA-OG1 3.33Å; M122-T125 PolarHBondContact O-N 3.36Å; M122-T125 PolarHBondContact O-OG1 3.46Å; M122-V126 PolarHBondContact O-N 2.9Å; M122-F175 VanDerWaalsContact C-CE2 3.45Å; M122-F175 HydrophobicContact CB-CE2 3.66Å; M122-F175 HydrophobicContact CB-CZ 3.59Å; M122-F175 HydrophobicContact CE-CE1 3.58Å; M122-F175 HydrophobicContact CE-CZ 3.65Å; M122-F175 HydrophobicContact CG-CZ 4.38Å; M122-F175 WeakPolarHBondContact O-CE2 3.45Å; M122-F175 WeakPolarHBondContact O-CZ 3.5Å; M122-F175 HydrophobicContact SD-CZ 4.26Å
123R98Very high97.6Very high15 Ų1551.3 Ų51.36%0.05725%0.254CS..Hα-helixtrans-65.2-37.5175-68.3-63.6-162.7-159.2-0.2111.6S32 S34 K119 F120 F121 L127 F172 V173S32-R123 PolarHBondContact O-NE 3.33Å; S34-R123 PolarHBondContact O-NH2 3.01Å; K119-R123 HydrophobicContact CG-CG 4.42Å; K119-R123 WeakPolarHBondContact O-CB 3.26Å; K119-R123 WeakPolarHBondContact O-CG 3.44Å; K119-R123 PolarHBondContact O-N 3.45Å; F120-R123 PolarHBondContact O-N 2.83Å; F121-R123 PolarHBondContact O-N 3.41Å; R123-L127 WeakPolarHBondContact O-CB 3.47Å; R123-L127 PolarHBondContact O-N 2.92Å; R123-L127 VanDerWaalsContact O-N 3.11Å; R123-F172 PolarHBondContact NH1-O 3.1Å; R123-V173 PolarHBondContact NH1-O 3.14Å; R123-V173 PolarHBondContact NH2-O 3.39Å
124C98Very high97.7Very high32 Ų3249 Ų4922%0.21624%0.242CC..Hα-helixtrans-63.8-41.5174.2-73.60000112.3F120 F121 M122 V126 L127 F128F120-C124 VanDerWaalsContact CZ-SG 3.58Å; F120-C124 PolarHBondContact O-N 2.91Å; F120-C124 PolarHBondContact O-SG 3.01Å; F120-C124 VanDerWaalsContact O-SG 3.38Å; F121-C124 WeakPolarHBondContact O-CB 3.12Å; F121-C124 PolarHBondContact O-N 2.9Å; F121-C124 VanDerWaalsContact O-N 3.16Å; M122-C124 VanDerWaalsContact C-N 3.33Å; M122-C124 PolarHBondContact O-N 2.87Å; C124-V126 PolarHBondContact O-N 3.23Å; C124-L127 PolarHBondContact O-N 2.89Å; C124-F128 HydrophobicContact CB-CD2 4.37Å; C124-F128 HydrophobicContact CB-CE2 4.3Å; C124-F128 WeakPolarHBondContact O-CD2 3.34Å; C124-F128 PolarHBondContact O-N 2.97Å
125T98.4Very high97.8Very high13 Ų1346.2 Ų46.28%0.0823%0.229CC..Hα-helixtrans-63.8-41.4-18053.90000112L93 F121 M122 S129 Y177L93-T125 HydrophobicContact CD1-CG2 4.45Å; L93-T125 HydrophobicContact CD2-CG2 3.88Å; F121-T125 HydrophobicContact CD1-CG2 4.34Å; F121-T125 HydrophobicContact CE1-CG2 3.83Å; F121-T125 HydrophobicContact CE2-CG2 4.18Å; F121-T125 HydrophobicContact CZ-CG2 3.74Å; F121-T125 WeakPolarHBondContact O-CG2 3.5Å; F121-T125 PolarHBondContact O-N 3.36Å; M122-T125 WeakPolarHBondContact CA-OG1 3.33Å; M122-T125 PolarHBondContact O-N 3.36Å; M122-T125 PolarHBondContact O-OG1 3.46Å; T125-S129 WeakPolarHBondContact O-CB 3.05Å; T125-S129 PolarHBondContact O-N 2.99Å; T125-S129 PolarHBondContact O-OG 2.92Å; T125-Y177 WeakPolarHBondContact CB-OH 3.48Å; T125-Y177 PolarHBondContact OG1-OH 3.02Å
126V98.3Very high97.9Very high1 Ų147.4 Ų47.41%0.00623%0.232CC..Hα-helixtrans-62.3-43.5173.2174.60000111.1M122 C124 S129 D130 D171 F172 F175 Y177M122-V126 PolarHBondContact O-N 2.9Å; C124-V126 PolarHBondContact O-N 3.23Å; V126-S129 PolarHBondContact O-N 2.87Å; V126-D130 WeakPolarHBondContact O-CB 3.38Å; V126-D130 PolarHBondContact O-N 3.47Å; V126-D171 HydrophobicContact CG1-CB 4.19Å; V126-F172 HydrophobicContact CG1-CD1 4.27Å; V126-F172 HydrophobicContact CG1-CE1 4.01Å; V126-F172 HydrophobicContact CG1-CZ 4.22Å; V126-F175 HydrophobicContact CG2-CD2 4.18Å; V126-F175 HydrophobicContact CG2-CE1 4.29Å; V126-F175 HydrophobicContact CG2-CE2 3.53Å; V126-F175 HydrophobicContact CG2-CZ 3.59Å; V126-Y177 HydrophobicContact CB-CD1 4.42Å; V126-Y177 HydrophobicContact CB-CE1 4.08Å; V126-Y177 HydrophobicContact CG2-CD1 3.8Å; V126-Y177 HydrophobicContact CG2-CE1 3.38Å; V126-Y177 HydrophobicContact CG2-CE2 4.19Å; V126-Y177 HydrophobicContact CG2-CG 4.38Å
127L98.4Very high98Very high28 Ų2840.7 Ų40.715%0.14720%0.197CC..Hα-helixtrans-62.5-46179-177.265.3000112.5I25 R28 R123 C124 D130 M131 F172I25-L127 HydrophobicContact CG2-CD1 4.4Å; R28-L127 HydrophobicContact CB-CD1 4.12Å; R123-L127 WeakPolarHBondContact O-CB 3.47Å; R123-L127 PolarHBondContact O-N 2.92Å; R123-L127 VanDerWaalsContact O-N 3.11Å; C124-L127 PolarHBondContact O-N 2.89Å; L127-D130 PolarHBondContact O-N 3.37Å; L127-M131 HydrophobicContact CG-SD 4.21Å; L127-M131 VanDerWaalsContact O-CG 3.27Å; L127-M131 WeakPolarHBondContact O-CG 3.38Å; L127-M131 PolarHBondContact O-N 3.12Å; L127-F172 HydrophobicContact CB-CE1 4.08Å; L127-F172 HydrophobicContact CD1-CE1 3.78Å; L127-F172 HydrophobicContact CD1-CZ 4.25Å
128F97.8Very high98Very high123 Ų12335.4 Ų35.454%0.53917%0.169SC..Hα-helixtrans-61.7-45.9177.1-80.6-64.6000111.4C124 D130 M131 F132C124-F128 HydrophobicContact CB-CD2 4.37Å; C124-F128 HydrophobicContact CB-CE2 4.3Å; C124-F128 WeakPolarHBondContact O-CD2 3.34Å; C124-F128 PolarHBondContact O-N 2.97Å; F128-D130 VanDerWaalsContact C-N 3.34Å; F128-D130 PolarHBondContact O-N 3.25Å; F128-M131 PolarHBondContact O-N 2.65Å; F128-F132 HydrophobicContact CD1-CE2 4.44Å; F128-F132 VanDerWaalsContact O-CD2 3.28Å; F128-F132 WeakPolarHBondContact O-CD2 3.29Å; F128-F132 PolarHBondContact O-N 2.92Å
129S98.1Very high98Very high12 Ų1236.8 Ų36.88%0.08418%0.176CC..Hα-helixtrans-60.3-43.3176.8-67.20000111.9H89 T125 V126 L133H89-S129 PolarHBondContact NE2-OG 2.82Å; T125-S129 WeakPolarHBondContact O-CB 3.05Å; T125-S129 PolarHBondContact O-N 2.99Å; T125-S129 PolarHBondContact O-OG 2.92Å; V126-S129 PolarHBondContact O-N 2.87Å; S129-L133 VanDerWaalsContact O-CB 3.23Å; S129-L133 WeakPolarHBondContact O-CB 3.39Å; S129-L133 PolarHBondContact O-N 3.38Å
130D98.5Very high97.9Very high2 Ų238.5 Ų38.51%0.01119%0.186CC..Hα-helixtrans-63.4-41.7176.8-179.979.1000112.8R28 V126 L127 F128 F132 F134 L135 F172 C179R28-D130 VanDerWaalsContact CD-OD2 3.24Å; R28-D130 WeakPolarHBondContact CD-OD2 3.32Å; R28-D130 IonicContact CZ-OD2 2.75Å; R28-D130 IonicContact NE-OD1 2.85Å; R28-D130 IonicContact NE-OD2 3.84Å; R28-D130 PolarHBondContact NE-OD2 3.14Å; R28-D130 IonicContact NH2-OD2 2.58Å; V126-D130 WeakPolarHBondContact O-CB 3.38Å; V126-D130 PolarHBondContact O-N 3.47Å; L127-D130 PolarHBondContact O-N 3.37Å; F128-D130 VanDerWaalsContact C-N 3.34Å; F128-D130 PolarHBondContact O-N 3.25Å; D130-F132 PolarHBondContact O-N 2.9Å; D130-F134 CarbonylContact O-C 3.4Å; D130-F134 WeakPolarHBondContact O-CA 3.32Å; D130-F134 WeakPolarHBondContact O-CB 3.22Å; D130-F134 PolarHBondContact O-N 3.32Å; D130-L135 PolarHBondContact O-N 3.35Å; D130-L135 WeakPolarHBondContact OD2-CG 3.3Å; D130-F172 HydrophobicContact CB-CE2 4.33Å; D130-F172 HydrophobicContact CB-CZ 3.65Å; D130-C179 HydrophobicContact CB-CB 3.84Å; D130-C179 WeakPolarHBondContact OD1-CB 3.49Å
131M97.8Very high97.9Very high64 Ų6431.7 Ų31.732%0.31516%0.156SC..Iπ-helixtrans-59.2-47.9179.4-74.7174.266.700112.7I25 L127 F128 L135 L136I25-M131 HydrophobicContact CD1-CE 4.04Å; I25-M131 HydrophobicContact CD1-CG 4.45Å; I25-M131 HydrophobicContact CD1-SD 4.43Å; L127-M131 HydrophobicContact CG-SD 4.21Å; L127-M131 VanDerWaalsContact O-CG 3.27Å; L127-M131 WeakPolarHBondContact O-CG 3.38Å; L127-M131 PolarHBondContact O-N 3.12Å; F128-M131 PolarHBondContact O-N 2.65Å; M131-L135 HydrophobicContact CG-CD1 4.17Å; M131-L136 PolarHBondContact O-N 2.88Å; M131-L136 VanDerWaalsContact O-N 3.09Å
132F96Very high97.7Very high133 Ų13330.4 Ų30.458%0.58315%0.15SC*.Iπ-helixtrans-82.2-37.4-176.6-71.8-73.4000113.3F128 D130F128-F132 HydrophobicContact CD1-CE2 4.44Å; F128-F132 VanDerWaalsContact O-CD2 3.28Å; F128-F132 WeakPolarHBondContact O-CD2 3.29Å; F128-F132 PolarHBondContact O-N 2.92Å; D130-F132 PolarHBondContact O-N 2.9Å
133L97.5Very high97.5Very high46 Ų4633.7 Ų33.724%0.24117%0.168CC..Iπ-helixtrans-96.3-28.7-170.5-61.5168.3000112.2S129 P137 V180 G183 L184S129-L133 VanDerWaalsContact O-CB 3.23Å; S129-L133 WeakPolarHBondContact O-CB 3.39Å; S129-L133 PolarHBondContact O-N 3.38Å; L133-P137 WeakPolarHBondContact O-CD 3.31Å; L133-P137 WeakPolarHBondContact O-CG 3.26Å; L133-V180 HydrophobicContact CD1-CB 4.17Å; L133-V180 HydrophobicContact CD1-CG1 3.82Å; L133-V180 HydrophobicContact CD1-CG2 3.93Å; L133-G183 CarbonylContact O-C 3.47Å; L133-G183 WeakPolarHBondContact O-CA 3.49Å; L133-G183 VanDerWaalsContact O-O 3.13Å; L133-L184 HydrophobicContact CD2-CD2 4.28Å
134F98.4Very high97.3Very high2 Ų235.4 Ų35.41%0.00918%0.182CC..Iπ-helixtrans-112.6-50.9-177.8-172.3-103.4000113.9D130 P137 S138 I161 Y167 C179 L182 M186D130-F134 CarbonylContact O-C 3.4Å; D130-F134 WeakPolarHBondContact O-CA 3.32Å; D130-F134 WeakPolarHBondContact O-CB 3.22Å; D130-F134 PolarHBondContact O-N 3.32Å; F134-P137 WeakPolarHBondContact O-CD 3.31Å; F134-P137 WeakPolarHBondContact O-CG 3.42Å; F134-S138 WeakPolarHBondContact O-CB 3.33Å; F134-S138 PolarHBondContact O-N 2.67Å; F134-S138 PolarHBondContact O-OG 3.42Å; F134-I161 HydrophobicContact CZ-CG2 4.08Å; F134-Y167 AromaticContact CE1-CD2 3.95Å; F134-Y167 HydrophobicContact CE1-CD2 3.95Å; F134-Y167 HydrophobicContact CE1-CE2 4.14Å; F134-Y167 HydrophobicContact CE2-CE2 4.27Å; F134-Y167 AromaticContact CZ-CD2 3.68Å; F134-Y167 HydrophobicContact CZ-CD2 3.68Å; F134-Y167 HydrophobicContact CZ-CE1 4.49Å; F134-Y167 AromaticContact CZ-CE2 3.42Å; F134-Y167 HydrophobicContact CZ-CE2 3.42Å; F134-Y167 VanDerWaalsContact CZ-CE2 3.42Å; F134-Y167 HydrophobicContact CZ-CG 4.32Å; F134-Y167 AromaticContact CZ-CZ 3.84Å; F134-C179 HydrophobicContact CB-CB 4.15Å; F134-L182 HydrophobicContact CD2-CB 4.41Å; F134-L182 HydrophobicContact CE2-CB 4.44Å; F134-M186 HydrophobicContact CD2-CG 4.32Å; F134-M186 HydrophobicContact CE2-CG 4.04Å
135L98.3Very high96.9Very high4 Ų434.5 Ų34.52%0.02117%0.174CC..Iπ-helixtrans-66.9-45.4-178.7-61.2-175.8000111.7I25 D130 M131 S138 I139 T162I25-L135 HydrophobicContact CD1-CD1 4.48Å; I25-L135 HydrophobicContact CG1-CD1 3.78Å; D130-L135 PolarHBondContact O-N 3.35Å; D130-L135 WeakPolarHBondContact OD2-CG 3.3Å; M131-L135 HydrophobicContact CG-CD1 4.17Å; L135-S138 WeakPolarHBondContact O-CB 3.19Å; L135-S138 PolarHBondContact O-N 3.41Å; L135-S138 VanDerWaalsContact O-N 3.16Å; L135-I139 WeakPolarHBondContact O-CG1 3.39Å; L135-I139 PolarHBondContact O-N 3.02Å; L135-T162 HydrophobicContact CD2-CG2 3.66Å
136L97.9Very high96.4Very high66 Ų6639.1 Ų39.135%0.34621%0.205SC..Hα-helixtrans-58.9-52.9-179.4-178.158.1000113.7M131 S138 I139 L140 W187M131-L136 PolarHBondContact O-N 2.88Å; M131-L136 VanDerWaalsContact O-N 3.09Å; L136-S138 PolarHBondContact O-N 3Å; L136-I139 WeakPolarHBondContact O-CB 3.42Å; L136-I139 PolarHBondContact O-N 3.02Å; L136-I139 VanDerWaalsContact O-N 3.14Å; L136-L140 WeakPolarHBondContact O-CG 3.49Å; L136-L140 PolarHBondContact O-N 2.95Å; L136-W187 HydrophobicContact CD2-CH2 4.4Å; L136-W187 HydrophobicContact CD2-CZ2 3.87Å; L136-W187 HydrophobicContact CG-CZ2 4.03Å
137P98.1Very high96Very high0 Ų041.1 Ų41.10%022%0.219CC..Hα-helixtrans-65.8-27.7175.525.9-34.4000112.6L133 F134 I139 L140 Y141 M186 W187 V190L133-P137 WeakPolarHBondContact O-CD 3.31Å; L133-P137 WeakPolarHBondContact O-CG 3.26Å; F134-P137 WeakPolarHBondContact O-CD 3.31Å; F134-P137 WeakPolarHBondContact O-CG 3.42Å; P137-I139 VanDerWaalsContact C-N 3.35Å; P137-L140 PolarHBondContact O-N 3.05Å; P137-Y141 VanDerWaalsContact O-CB 3.23Å; P137-Y141 WeakPolarHBondContact O-CB 3.38Å; P137-Y141 PolarHBondContact O-N 3.31Å; P137-M186 HydrophobicContact CB-CB 4.1Å; P137-M186 HydrophobicContact CG-CB 3.99Å; P137-W187 HydrophobicContact CB-CD2 3.92Å; P137-W187 HydrophobicContact CB-CG 3.89Å; P137-W187 HydrophobicContact CG-CD2 4.37Å; P137-W187 HydrophobicContact CG-CG 4.08Å; P137-V190 HydrophobicContact CB-CG2 4.21Å; P137-V190 WeakPolarHBondContact O-CG2 3.39Å
138S98Very high95.5Very high0 Ų040.6 Ų40.60%022%0.216CC..Hα-helixtrans-64.3-39.1171.9-60.60000112.1F134 L135 L136 V142F134-S138 WeakPolarHBondContact O-CB 3.33Å; F134-S138 PolarHBondContact O-N 2.67Å; F134-S138 PolarHBondContact O-OG 3.42Å; L135-S138 WeakPolarHBondContact O-CB 3.19Å; L135-S138 PolarHBondContact O-N 3.41Å; L135-S138 VanDerWaalsContact O-N 3.16Å; L136-S138 PolarHBondContact O-N 3Å; S138-V142 WeakPolarHBondContact O-CG2 3.38Å; S138-V142 PolarHBondContact O-N 3.27Å
139I97.5Very high95.1Very high31 Ų3143.7 Ų43.716%0.15923%0.229CC..Hα-helixtrans-62.6-51.8172.1-66.8167000109.8F17 V21 L135 L136 P137 Y141 V142 L143 Y158F17-I139 HydrophobicContact CE1-CB 4.32Å; F17-I139 HydrophobicContact CE1-CG1 3.95Å; F17-I139 HydrophobicContact CE1-CG2 3.69Å; F17-I139 HydrophobicContact CZ-CB 4.4Å; F17-I139 HydrophobicContact CZ-CG1 4.21Å; F17-I139 HydrophobicContact CZ-CG2 3.99Å; V21-I139 HydrophobicContact CG1-CD1 4.27Å; V21-I139 HydrophobicContact CG2-CD1 3.7Å; V21-I139 HydrophobicContact CG2-CG1 4.13Å; L135-I139 WeakPolarHBondContact O-CG1 3.39Å; L135-I139 PolarHBondContact O-N 3.02Å; L136-I139 WeakPolarHBondContact O-CB 3.42Å; L136-I139 PolarHBondContact O-N 3.02Å; L136-I139 VanDerWaalsContact O-N 3.14Å; P137-I139 VanDerWaalsContact C-N 3.35Å; I139-Y141 VanDerWaalsContact C-N 3.31Å; I139-Y141 PolarHBondContact O-N 2.86Å; I139-V142 VanDerWaalsContact O-CG2 3.26Å; I139-V142 WeakPolarHBondContact O-CG2 3.29Å; I139-V142 PolarHBondContact O-N 2.94Å; I139-L143 HydrophobicContact CG2-CD1 3.59Å; I139-L143 HydrophobicContact CG2-CG 4.13Å; I139-L143 WeakPolarHBondContact O-CB 3.25Å; I139-L143 VanDerWaalsContact O-CG 3.26Å; I139-L143 WeakPolarHBondContact O-CG 3.3Å; I139-L143 PolarHBondContact O-N 3.22Å; I139-Y158 HydrophobicContact CD1-CE2 4.46Å; I139-Y158 HydrophobicContact CG1-CD2 4.1Å; I139-Y158 HydrophobicContact CG1-CE2 3.54Å
140L97Very high94.7Very high65 Ų6545.5 Ų45.534%0.3424%0.242SC..Hα-helixtrans-58.9-44.4-179-65.5177.6000111.3L136 P137 V142 L143 S144 W187 V190L136-L140 WeakPolarHBondContact O-CG 3.49Å; L136-L140 PolarHBondContact O-N 2.95Å; P137-L140 PolarHBondContact O-N 3.05Å; L140-V142 PolarHBondContact O-N 2.89Å; L140-L143 PolarHBondContact O-N 3.37Å; L140-S144 WeakPolarHBondContact O-CB 3.27Å; L140-S144 PolarHBondContact O-N 3.32Å; L140-S144 PolarHBondContact O-OG 2.97Å; L140-W187 HydrophobicContact CD1-CH2 3.55Å; L140-W187 HydrophobicContact CD1-CZ2 4.39Å; L140-W187 HydrophobicContact CD1-CZ3 3.71Å; L140-V190 HydrophobicContact CB-CG1 4.2Å; L140-V190 HydrophobicContact CB-CG2 4.4Å
141Y96.9Very high94.2Very high0 Ų047.8 Ų47.80%025%0.253CS..Hα-helixtrans-55.7-52.5178.4179.3-100.9000112P137 I139 S144 K145 Y157 I161 M186 I189 V190 E193 H336 L367P137-Y141 VanDerWaalsContact O-CB 3.23Å; P137-Y141 WeakPolarHBondContact O-CB 3.38Å; P137-Y141 PolarHBondContact O-N 3.31Å; I139-Y141 VanDerWaalsContact C-N 3.31Å; I139-Y141 PolarHBondContact O-N 2.86Å; Y141-S144 PolarHBondContact O-OG 3.24Å; Y141-K145 HydrophobicContact CE1-CD 4.43Å; Y141-K145 HydrophobicContact CE2-CD 4.22Å; Y141-K145 WeakPolarHBondContact O-CB 3.45Å; Y141-K145 PolarHBondContact O-N 3.37Å; Y141-K145 VanDerWaalsContact O-N 3.13Å; Y141-K145 PolarHBondContact OH-NZ 2.98Å; Y141-Y157 HydrophobicContact CE1-CD1 4.43Å; Y141-Y157 AromaticContact CE1-CE1 3.81Å; Y141-Y157 HydrophobicContact CE1-CE1 3.81Å; Y141-I161 HydrophobicContact CD1-CD1 4.16Å; Y141-I161 HydrophobicContact CE1-CD1 4.45Å; Y141-M186 HydrophobicContact CG-CE 4.43Å; Y141-I189 HydrophobicContact CD2-CG2 4.03Å; Y141-I189 HydrophobicContact CE2-CG2 3.85Å; Y141-V190 HydrophobicContact CD2-CG2 4.47Å; Y141-E193 HydrophobicContact CD2-CG 4.43Å; Y141-E193 HydrophobicContact CE2-CG 4.04Å; Y141-H336 PolarHBondContact OH-CE1 3.2Å; Y141-L367 HydrophobicContact CD1-CD2 4.36Å; Y141-L367 HydrophobicContact CE1-CD2 3.77Å; Y141-L367 HydrophobicContact CE2-CD2 4Å
142V95.5Very high93.8Very high0 Ų052.2 Ų52.20%027%0.27CS..Hα-helixtrans-71.1-32.6-178.3-60.50000112.6F17 S138 I139 L140 L148 K154 Y157 I161F17-V142 HydrophobicContact CE2-CG2 3.89Å; F17-V142 HydrophobicContact CZ-CG2 3.84Å; S138-V142 WeakPolarHBondContact O-CG2 3.38Å; S138-V142 PolarHBondContact O-N 3.27Å; I139-V142 VanDerWaalsContact O-CG2 3.26Å; I139-V142 WeakPolarHBondContact O-CG2 3.29Å; I139-V142 PolarHBondContact O-N 2.94Å; L140-V142 PolarHBondContact O-N 2.89Å; V142-L148 HydrophobicContact CB-CD1 4.31Å; V142-K154 WeakPolarHBondContact O-CD 3.45Å; V142-Y157 HydrophobicContact CG1-CD1 3.87Å; V142-Y157 HydrophobicContact CG1-CG 4.47Å; V142-I161 HydrophobicContact CG1-CD1 4.34Å
143L94.4Very high93.6Very high70 Ų7049.5 Ų49.537%0.36626%0.26SS..Hα-helixtrans-71.6-37.2-180-70.9-176.5000111.5F17 I139 L140 M151 K154F17-L143 HydrophobicContact CD2-CD2 4.36Å; F17-L143 HydrophobicContact CE2-CD2 4.08Å; F17-L143 HydrophobicContact CZ-CD2 4.28Å; F17-L143 HydrophobicContact CZ-CG 4.37Å; I139-L143 HydrophobicContact CG2-CD1 3.59Å; I139-L143 HydrophobicContact CG2-CG 4.13Å; I139-L143 WeakPolarHBondContact O-CB 3.25Å; I139-L143 VanDerWaalsContact O-CG 3.26Å; I139-L143 WeakPolarHBondContact O-CG 3.3Å; I139-L143 PolarHBondContact O-N 3.22Å; L140-L143 PolarHBondContact O-N 3.37Å; L143-M151 HydrophobicContact CD2-SD 4.23Å; L143-K154 HydrophobicContact CD2-CD 4.11Å; L143-K154 PolarHBondContact O-NZ 3.43Å
144S92.6Very high93.3Very high51 Ų5149.2 Ų49.236%0.35726%0.257SS..Hα-helixtrans-82.7-11.4177.969.40000113.9L140 Y141 P146L140-S144 WeakPolarHBondContact O-CB 3.27Å; L140-S144 PolarHBondContact O-N 3.32Å; L140-S144 PolarHBondContact O-OG 2.97Å; Y141-S144 PolarHBondContact O-OG 3.24Å; S144-P146 WeakPolarHBondContact O-CD 3.43Å
145K90Very high93.1Very high13 Ų1350.2 Ų50.26%0.05726%0.262CS..  trans-70.8116.1-174.9-157.976-178.2175.90112.2Y141 S147 L148 E193Y141-K145 HydrophobicContact CE1-CD 4.43Å; Y141-K145 HydrophobicContact CE2-CD 4.22Å; Y141-K145 WeakPolarHBondContact O-CB 3.45Å; Y141-K145 PolarHBondContact O-N 3.37Å; Y141-K145 VanDerWaalsContact O-N 3.13Å; Y141-K145 PolarHBondContact OH-NZ 2.98Å; K145-S147 VanDerWaalsContact C-N 3.33Å; K145-S147 VanDerWaalsContact CG-OG 3.28Å; K145-S147 WeakPolarHBondContact CG-OG 3.49Å; K145-S147 PolarHBondContact O-N 2.88Å; K145-L148 HydrophobicContact CB-CD1 4.06Å; K145-L148 HydrophobicContact CB-CG 4.12Å; K145-L148 HydrophobicContact CG-CD1 4.42Å; K145-L148 HydrophobicContact CG-CG 4.23Å; K145-L148 PolarHBondContact O-N 3.47Å; K145-E193 IonicContact NZ-OE1 3.04Å; K145-E193 PolarHBondContact NZ-OE1 3.4Å; K145-E193 IonicContact NZ-OE2 3.27Å; K145-E193 PolarHBondContact NZ-OE2 2.99Å
146P88.2Confident92.9Very high111 Ų11151.5 Ų51.572%0.72127%0.269SS*.THydrogen-bonded Turntrans-70.6-25-176.2-21.234.6000114.6S144 L148S144-P146 WeakPolarHBondContact O-CD 3.43Å; P146-L148 PolarHBondContact O-N 3.46Å
147S88.3Confident92.8Very high43 Ų4348.9 Ų48.930%0.30126%0.255SS..THydrogen-bonded Turntrans-69-22.6178.852.70000113.3K145 E370K145-S147 VanDerWaalsContact C-N 3.33Å; K145-S147 VanDerWaalsContact CG-OG 3.28Å; K145-S147 WeakPolarHBondContact CG-OG 3.49Å; K145-S147 PolarHBondContact O-N 2.88Å; S147-E370 VanDerWaalsContact CB-CD 3.44Å; S147-E370 WeakPolarHBondContact CB-OE1 3.34Å; S147-E370 WeakPolarHBondContact CB-OE2 3.3Å; S147-E370 PolarHBondContact OG-OE1 3.28Å; S147-E370 PolarHBondContact OG-OE2 3.5Å
148L89.5Confident92.7Very high17 Ų1748.9 Ų48.99%0.08926%0.255CS..  trans-93.897178.6-53.1-178.8000109.4V142 K145 P146 E153 K154 Y157V142-L148 HydrophobicContact CB-CD1 4.31Å; K145-L148 HydrophobicContact CB-CD1 4.06Å; K145-L148 HydrophobicContact CB-CG 4.12Å; K145-L148 HydrophobicContact CG-CD1 4.42Å; K145-L148 HydrophobicContact CG-CG 4.23Å; K145-L148 PolarHBondContact O-N 3.47Å; P146-L148 PolarHBondContact O-N 3.46Å; L148-E153 HydrophobicContact CB-CB 4.29Å; L148-E153 HydrophobicContact CD2-CB 4.26Å; L148-K154 HydrophobicContact CB-CG 3.72Å; L148-K154 HydrophobicContact CD1-CG 4.24Å; L148-K154 WeakPolarHBondContact O-CE 3.15Å; L148-Y157 HydrophobicContact CD1-CD1 4.47Å; L148-Y157 HydrophobicContact CD1-CD2 4.34Å; L148-Y157 HydrophobicContact CD1-CG 3.94Å; L148-Y157 HydrophobicContact CD2-CD2 4.17Å
149K87.8Confident92.7Very high188 Ų18850 Ų5082%0.81726%0.261SS*.  trans-81.7-39.9-170.9-63.2-175.1-179.7-175.80112.4E153K149-E153 PolarHBondContact N-OE2 3.36Å
150S89.7Confident92.6Very high49 Ų4948.6 Ų48.634%0.34325%0.254SS..SBendtrans-99.1151.3-178.772.90000111.6K152 E153 K154S150-K152 PolarHBondContact O-N 2.89Å; S150-E153 PolarHBondContact N-OE2 3.25Å; S150-E153 VanDerWaalsContact N-OE2 3.14Å; S150-E153 WeakPolarHBondContact O-CB 3.31Å; S150-E153 PolarHBondContact O-N 3.46Å; S150-E153 VanDerWaalsContact O-N 3.15Å; S150-E153 VanDerWaalsContact OG-CG 3.32Å; S150-E153 WeakPolarHBondContact OG-CG 3.39Å; S150-E153 PolarHBondContact OG-N 2.88Å; S150-E153 VanDerWaalsContact OG-N 3.14Å; S150-K154 PolarHBondContact O-N 2.96Å; S150-K154 VanDerWaalsContact O-N 3.15Å
151M89.8Confident92.6Very high50 Ų5045.6 Ų45.625%0.24624%0.238CC..Hα-helixtrans-61.8-31.2172.8-167.468.881.100111.8V13 F17 L143 E153 K154 I155V13-M151 HydrophobicContact CG1-CB 3.05Å; V13-M151 HydrophobicContact CG1-CE 4.07Å; V13-M151 HydrophobicContact CG1-CG 3.33Å; F17-M151 HydrophobicContact CB-SD 4.27Å; F17-M151 HydrophobicContact CD2-SD 3.86Å; F17-M151 HydrophobicContact CG-SD 4.37Å; L143-M151 HydrophobicContact CD2-SD 4.23Å; M151-E153 VanDerWaalsContact C-N 3.34Å; M151-E153 PolarHBondContact O-N 3.27Å; M151-K154 WeakPolarHBondContact O-CB 3.47Å; M151-K154 PolarHBondContact O-N 2.86Å; M151-K154 VanDerWaalsContact O-N 3.16Å; M151-K154 HydrophobicContact SD-CB 4.3Å; M151-K154 HydrophobicContact SD-CD 4.23Å; M151-I155 HydrophobicContact CG-CD1 3.95Å; M151-I155 HydrophobicContact CG-CG1 4.23Å; M151-I155 VanDerWaalsContact O-CG1 3.29Å; M151-I155 WeakPolarHBondContact O-CG1 3.49Å; M151-I155 PolarHBondContact O-N 3.27Å
152K89.5Confident92.7Very high157 Ų15745.6 Ų45.668%0.68324%0.238SC*.Hα-helixtrans-58.3-46.7174.2-175.9-179.7177.41800111.2S150 K154 I155 V156S150-K152 PolarHBondContact O-N 2.89Å; K152-K154 VanDerWaalsContact C-N 3.31Å; K152-K154 PolarHBondContact O-N 2.94Å; K152-I155 PolarHBondContact O-N 2.92Å; K152-V156 VanDerWaalsContact O-CG2 3.31Å; K152-V156 WeakPolarHBondContact O-CG2 3.23Å; K152-V156 PolarHBondContact O-N 3.47Å
153E90.6Very high92.8Very high77 Ų7746.1 Ų46.136%0.3624%0.241SC..Hα-helixtrans-60.4-41.8175.3-73.7165.5178.200111.5L148 K149 S150 M151 V156 Y157L148-E153 HydrophobicContact CB-CB 4.29Å; L148-E153 HydrophobicContact CD2-CB 4.26Å; K149-E153 PolarHBondContact N-OE2 3.36Å; S150-E153 PolarHBondContact N-OE2 3.25Å; S150-E153 VanDerWaalsContact N-OE2 3.14Å; S150-E153 WeakPolarHBondContact O-CB 3.31Å; S150-E153 PolarHBondContact O-N 3.46Å; S150-E153 VanDerWaalsContact O-N 3.15Å; S150-E153 VanDerWaalsContact OG-CG 3.32Å; S150-E153 WeakPolarHBondContact OG-CG 3.39Å; S150-E153 PolarHBondContact OG-N 2.88Å; S150-E153 VanDerWaalsContact OG-N 3.14Å; M151-E153 VanDerWaalsContact C-N 3.34Å; M151-E153 PolarHBondContact O-N 3.27Å; E153-V156 PolarHBondContact O-N 3.41Å; E153-Y157 WeakPolarHBondContact O-CB 3.17Å; E153-Y157 PolarHBondContact O-N 2.92Å
154K92.6Very high93Very high40 Ų4042.8 Ų42.817%0.17422%0.223CC..Hα-helixtrans-63.2-42.9176.7-63.5-177.4178.2-167.40112.5F17 V142 L143 L148 S150 M151 K152 Y157 Y158F17-K154 HydrophobicContact CE2-CB 4.49Å; V142-K154 WeakPolarHBondContact O-CD 3.45Å; L143-K154 HydrophobicContact CD2-CD 4.11Å; L143-K154 PolarHBondContact O-NZ 3.43Å; L148-K154 HydrophobicContact CB-CG 3.72Å; L148-K154 HydrophobicContact CD1-CG 4.24Å; L148-K154 WeakPolarHBondContact O-CE 3.15Å; S150-K154 PolarHBondContact O-N 2.96Å; S150-K154 VanDerWaalsContact O-N 3.15Å; M151-K154 WeakPolarHBondContact O-CB 3.47Å; M151-K154 PolarHBondContact O-N 2.86Å; M151-K154 VanDerWaalsContact O-N 3.16Å; M151-K154 HydrophobicContact SD-CB 4.3Å; M151-K154 HydrophobicContact SD-CD 4.23Å; K152-K154 VanDerWaalsContact C-N 3.31Å; K152-K154 PolarHBondContact O-N 2.94Å; K154-Y157 PolarHBondContact O-N 3.38Å; K154-Y158 VanDerWaalsContact O-CB 3.28Å; K154-Y158 WeakPolarHBondContact O-CB 3.49Å; K154-Y158 PolarHBondContact O-N 3.35Å
155I94.1Very high93.2Very high23 Ų2340.3 Ų40.312%0.11821%0.206CC..Hα-helixtrans-63.7-47.6176.3-70.1167.2000110.5V16 F17 A20 M151 K152 Y157 Y158 L159V16-I155 HydrophobicContact CB-CD1 3.97Å; V16-I155 HydrophobicContact CG1-CD1 3.67Å; F17-I155 HydrophobicContact CB-CD1 4.4Å; F17-I155 HydrophobicContact CB-CG1 4.25Å; F17-I155 HydrophobicContact CD2-CG1 3.63Å; F17-I155 HydrophobicContact CE2-CG1 4.42Å; F17-I155 HydrophobicContact CG-CG1 4.33Å; A20-I155 HydrophobicContact CB-CG2 3.84Å; M151-I155 HydrophobicContact CG-CD1 3.95Å; M151-I155 HydrophobicContact CG-CG1 4.23Å; M151-I155 VanDerWaalsContact O-CG1 3.29Å; M151-I155 WeakPolarHBondContact O-CG1 3.49Å; M151-I155 PolarHBondContact O-N 3.27Å; K152-I155 PolarHBondContact O-N 2.92Å; I155-Y157 VanDerWaalsContact C-N 3.33Å; I155-Y157 PolarHBondContact O-N 3.06Å; I155-Y158 PolarHBondContact O-N 3.29Å; I155-L159 HydrophobicContact CG2-CD1 3.93Å; I155-L159 HydrophobicContact CG2-CG 4.4Å; I155-L159 WeakPolarHBondContact O-CB 3.44Å; I155-L159 WeakPolarHBondContact O-CG 3.47Å; I155-L159 PolarHBondContact O-N 3.43Å
156V93.4Very high93.6Very high30 Ų3039.7 Ų39.718%0.18220%0.204CC..Hα-helixtrans-59.8-45.6177.7168.60000110.3K152 E153 Y158 L159 L160 F410 F415K152-V156 VanDerWaalsContact O-CG2 3.31Å; K152-V156 WeakPolarHBondContact O-CG2 3.23Å; K152-V156 PolarHBondContact O-N 3.47Å; E153-V156 PolarHBondContact O-N 3.41Å; V156-Y158 PolarHBondContact O-N 3.18Å; V156-L159 PolarHBondContact O-N 2.92Å; V156-L160 WeakPolarHBondContact O-CB 3.48Å; V156-L160 PolarHBondContact O-N 3.44Å; V156-F410 HydrophobicContact CG1-CZ 4.11Å; V156-F410 WeakPolarHBondContact O-CZ 3.47Å; V156-F415 HydrophobicContact CG1-CE2 3.85Å; V156-F415 HydrophobicContact CG1-CZ 3.79Å
157Y95.1Very high94.1Very high12 Ų1234.6 Ų34.65%0.04717%0.17CC..Hα-helixtrans-68-37.1179.7-151.2-81.5000112.3Y141 V142 L148 E153 K154 I155 L160 I161 L366 L367 E370Y141-Y157 HydrophobicContact CE1-CD1 4.43Å; Y141-Y157 AromaticContact CE1-CE1 3.81Å; Y141-Y157 HydrophobicContact CE1-CE1 3.81Å; V142-Y157 HydrophobicContact CG1-CD1 3.87Å; V142-Y157 HydrophobicContact CG1-CG 4.47Å; L148-Y157 HydrophobicContact CD1-CD1 4.47Å; L148-Y157 HydrophobicContact CD1-CD2 4.34Å; L148-Y157 HydrophobicContact CD1-CG 3.94Å; L148-Y157 HydrophobicContact CD2-CD2 4.17Å; E153-Y157 WeakPolarHBondContact O-CB 3.17Å; E153-Y157 PolarHBondContact O-N 2.92Å; K154-Y157 PolarHBondContact O-N 3.38Å; I155-Y157 VanDerWaalsContact C-N 3.33Å; I155-Y157 PolarHBondContact O-N 3.06Å; Y157-L160 WeakPolarHBondContact O-CB 3.27Å; Y157-L160 PolarHBondContact O-N 3.45Å; Y157-I161 HydrophobicContact CD1-CD1 3.76Å; Y157-I161 HydrophobicContact CD1-CG1 4.23Å; Y157-I161 HydrophobicContact CE1-CD1 3.8Å; Y157-I161 HydrophobicContact CE1-CG1 4.24Å; Y157-I161 WeakPolarHBondContact O-CG1 3.44Å; Y157-I161 PolarHBondContact O-N 3.09Å; Y157-I161 VanDerWaalsContact O-N 3.14Å; Y157-L366 PolarHBondContact OH-O 3.12Å; Y157-L367 PolarHBondContact OH-O 3.26Å; Y157-E370 HydrophobicContact CE2-CB 4.4Å
158Y96.8Very high94.6Very high0 Ų032.6 Ų32.60%016%0.156CC..Hα-helixtrans-61.4-47.4174173.7-101.7000112.1F17 A20 V21 I139 K154 I155 V156 L160 I161 T162F17-Y158 HydrophobicContact CE2-CG 4.49Å; F17-Y158 HydrophobicContact CZ-CD2 4.23Å; F17-Y158 HydrophobicContact CZ-CG 4.16Å; A20-Y158 HydrophobicContact CB-CD1 4.18Å; A20-Y158 HydrophobicContact CB-CE1 4.43Å; V21-Y158 HydrophobicContact CG2-CE1 4.08Å; I139-Y158 HydrophobicContact CD1-CE2 4.46Å; I139-Y158 HydrophobicContact CG1-CD2 4.1Å; I139-Y158 HydrophobicContact CG1-CE2 3.54Å; K154-Y158 VanDerWaalsContact O-CB 3.28Å; K154-Y158 WeakPolarHBondContact O-CB 3.49Å; K154-Y158 PolarHBondContact O-N 3.35Å; I155-Y158 PolarHBondContact O-N 3.29Å; V156-Y158 PolarHBondContact O-N 3.18Å; Y158-L160 VanDerWaalsContact C-N 3.34Å; Y158-I161 PolarHBondContact O-N 3.39Å; Y158-T162 HydrophobicContact CD2-CG2 3.94Å; Y158-T162 HydrophobicContact CE1-CG2 4.33Å; Y158-T162 HydrophobicContact CE2-CG2 3.49Å; Y158-T162 VanDerWaalsContact CE2-CG2 3.49Å; Y158-T162 WeakPolarHBondContact O-CB 3.36Å; Y158-T162 WeakPolarHBondContact O-CG2 3.39Å; Y158-T162 PolarHBondContact O-N 2.91Å; Y158-T162 PolarHBondContact O-OG1 2.82Å
159L96.9Very high95Very high24 Ų2432 Ų3213%0.12615%0.153CC..Hα-helixtrans-68.8-34178.8-67.8177.4000111.5A20 I155 V156 I161 T162 L163 F410A20-L159 HydrophobicContact CB-CD1 4.33Å; A20-L159 HydrophobicContact CB-CD2 4.05Å; A20-L159 HydrophobicContact CB-CG 4.23Å; I155-L159 HydrophobicContact CG2-CD1 3.93Å; I155-L159 HydrophobicContact CG2-CG 4.4Å; I155-L159 WeakPolarHBondContact O-CB 3.44Å; I155-L159 WeakPolarHBondContact O-CG 3.47Å; I155-L159 PolarHBondContact O-N 3.43Å; V156-L159 PolarHBondContact O-N 2.92Å; L159-I161 VanDerWaalsContact C-N 3.34Å; L159-I161 PolarHBondContact O-N 3.31Å; L159-T162 PolarHBondContact O-N 3.07Å; L159-L163 HydrophobicContact CB-CD1 4.11Å; L159-L163 HydrophobicContact CB-CG 4.25Å; L159-L163 HydrophobicContact CD2-CD1 4.03Å; L159-L163 HydrophobicContact CD2-CD2 4.47Å; L159-L163 HydrophobicContact CD2-CG 4.08Å; L159-L163 WeakPolarHBondContact O-CA 3.35Å; L159-L163 WeakPolarHBondContact O-CB 3.37Å; L159-L163 VanDerWaalsContact O-CG 3.31Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 3.16Å; L159-F410 HydrophobicContact CB-CE1 4.5Å; L159-F410 HydrophobicContact CB-CE2 3.8Å; L159-F410 HydrophobicContact CB-CZ 3.76Å; L159-F410 HydrophobicContact CD1-CE2 4.25Å
160L96Very high95.5Very high0 Ų023.1 Ų23.10%011%0.114CC..Hα-helixtrans-57.1-47.4172.2177.974000111.6V156 Y157 Y158 L366 V369 L377 Y407 F410 F415V156-L160 WeakPolarHBondContact O-CB 3.48Å; V156-L160 PolarHBondContact O-N 3.44Å; Y157-L160 WeakPolarHBondContact O-CB 3.27Å; Y157-L160 PolarHBondContact O-N 3.45Å; Y158-L160 VanDerWaalsContact C-N 3.34Å; L160-L366 HydrophobicContact CG-CD2 3.98Å; L160-L366 WeakPolarHBondContact O-CD2 3.39Å; L160-V369 HydrophobicContact CD2-CB 3.99Å; L160-V369 HydrophobicContact CD2-CG1 3.76Å; L160-V369 HydrophobicContact CD2-CG2 4.01Å; L160-L377 HydrophobicContact CD1-CD2 4.05Å; L160-Y407 HydrophobicContact CD1-CE2 4.37Å; L160-Y407 WeakPolarHBondContact CD1-OH 3.24Å; L160-Y407 WeakPolarHBondContact O-CE2 3.48Å; L160-Y407 PolarHBondContact O-OH 3.24Å; L160-F410 HydrophobicContact CB-CE1 3.94Å; L160-F410 HydrophobicContact CB-CZ 4.38Å; L160-F410 HydrophobicContact CD1-CE1 4.24Å; L160-F415 HydrophobicContact CB-CE2 4.45Å; L160-F415 HydrophobicContact CB-CZ 4.4Å; L160-F415 HydrophobicContact CD1-CE2 3.88Å; L160-F415 HydrophobicContact CD1-CZ 4.16Å; L160-F415 HydrophobicContact CD2-CE1 4.47Å; L160-F415 HydrophobicContact CD2-CE2 4.33Å; L160-F415 HydrophobicContact CD2-CZ 3.76Å; L160-F415 HydrophobicContact CG-CE2 4.45Å; L160-F415 HydrophobicContact CG-CZ 4.33Å
161I97.5Very high95.9Very high2 Ų220.8 Ų20.81%0.0110%0.098CC..Hα-helixtrans-67.5-53.7177.8-63.7168.2000110.4F134 Y141 V142 Y157 Y158 L159 Y164 L366F134-I161 HydrophobicContact CZ-CG2 4.08Å; Y141-I161 HydrophobicContact CD1-CD1 4.16Å; Y141-I161 HydrophobicContact CE1-CD1 4.45Å; V142-I161 HydrophobicContact CG1-CD1 4.34Å; Y157-I161 HydrophobicContact CD1-CD1 3.76Å; Y157-I161 HydrophobicContact CD1-CG1 4.23Å; Y157-I161 HydrophobicContact CE1-CD1 3.8Å; Y157-I161 HydrophobicContact CE1-CG1 4.24Å; Y157-I161 WeakPolarHBondContact O-CG1 3.44Å; Y157-I161 PolarHBondContact O-N 3.09Å; Y157-I161 VanDerWaalsContact O-N 3.14Å; Y158-I161 PolarHBondContact O-N 3.39Å; L159-I161 VanDerWaalsContact C-N 3.34Å; L159-I161 PolarHBondContact O-N 3.31Å; I161-Y164 WeakPolarHBondContact O-CB 3.35Å; I161-Y164 PolarHBondContact O-N 2.72Å; I161-L366 HydrophobicContact CG1-CB 4.28Å; I161-L366 HydrophobicContact CG2-CD1 4.49Å
162T97.9Very high96.3Very high0 Ų018.5 Ų18.50%09%0.087CC..Hα-helixtrans-83.3-20-164.462.70000114.2S24 R28 L135 Y158 L159S24-T162 WeakPolarHBondContact OG-CB 3.29Å; S24-T162 PolarHBondContact OG-OG1 3.45Å; R28-T162 PolarHBondContact NH1-O 3.09Å; R28-T162 PolarHBondContact NH2-O 3.41Å; L135-T162 HydrophobicContact CD2-CG2 3.66Å; Y158-T162 HydrophobicContact CD2-CG2 3.94Å; Y158-T162 HydrophobicContact CE1-CG2 4.33Å; Y158-T162 HydrophobicContact CE2-CG2 3.49Å; Y158-T162 VanDerWaalsContact CE2-CG2 3.49Å; Y158-T162 WeakPolarHBondContact O-CB 3.36Å; Y158-T162 WeakPolarHBondContact O-CG2 3.39Å; Y158-T162 PolarHBondContact O-N 2.91Å; Y158-T162 PolarHBondContact O-OG1 2.82Å; L159-T162 PolarHBondContact O-N 3.07Å
163L97.7Very high96.7Very high11 Ų1111.1 Ų11.16%0.0585%0.054CC..THydrogen-bonded Turntrans-93.24.8173.6-55.7-171.3000113.3I27 L159 P165 Y407I27-L163 HydrophobicContact CD1-CD1 4.26Å; I27-L163 HydrophobicContact CD1-CD2 3.49Å; I27-L163 VanDerWaalsContact CD1-CD2 3.49Å; L159-L163 HydrophobicContact CB-CD1 4.11Å; L159-L163 HydrophobicContact CB-CG 4.25Å; L159-L163 HydrophobicContact CD2-CD1 4.03Å; L159-L163 HydrophobicContact CD2-CD2 4.47Å; L159-L163 HydrophobicContact CD2-CG 4.08Å; L159-L163 WeakPolarHBondContact O-CA 3.35Å; L159-L163 WeakPolarHBondContact O-CB 3.37Å; L159-L163 VanDerWaalsContact O-CG 3.31Å; L159-L163 WeakPolarHBondContact O-CG 3.45Å; L159-L163 PolarHBondContact O-N 3.16Å; L163-P165 VanDerWaalsContact O-CD 3.26Å; L163-P165 WeakPolarHBondContact O-CD 2.85Å; L163-P165 VanDerWaalsContact O-N 3.13Å; L163-Y407 HydrophobicContact CB-CD2 4.22Å; L163-Y407 VanDerWaalsContact O-CD2 3.26Å; L163-Y407 WeakPolarHBondContact O-CD2 3.36Å
164Y98.3Very high97.1Very high0 Ų07.7 Ų7.70%04%0.038CC..  trans-56.3118.3175.5173.1-116.7000110.5I161 G166 Y167 L359 A362 L366 L380 S383 V384 Y407I161-Y164 WeakPolarHBondContact O-CB 3.35Å; I161-Y164 PolarHBondContact O-N 2.72Å; Y164-G166 PolarHBondContact O-N 2.98Å; Y164-G166 VanDerWaalsContact O-N 3.14Å; Y164-Y167 HydrophobicContact CD1-CD1 4.12Å; Y164-Y167 AromaticContact CD1-CD2 3.64Å; Y164-Y167 HydrophobicContact CD1-CD2 3.64Å; Y164-Y167 HydrophobicContact CD1-CE1 4.17Å; Y164-Y167 AromaticContact CD1-CE2 3.71Å; Y164-Y167 HydrophobicContact CD1-CE2 3.71Å; Y164-Y167 AromaticContact CD1-CG 3.85Å; Y164-Y167 HydrophobicContact CD1-CG 3.85Å; Y164-Y167 AromaticContact CD1-CZ 4Å; Y164-Y167 HydrophobicContact CE1-CE1 4.49Å; Y164-Y167 HydrophobicContact CG-CD2 4.25Å; Y164-Y167 HydrophobicContact CG-CE2 4.32Å; Y164-Y167 PolarHBondContact O-N 3.22Å; Y164-Y167 VanDerWaalsContact O-N 3.17Å; Y164-L359 HydrophobicContact CE1-CD2 3.81Å; Y164-A362 HydrophobicContact CD1-CB 4.28Å; Y164-A362 HydrophobicContact CE1-CB 3.48Å; Y164-A362 VanDerWaalsContact CE1-CB 3.48Å; Y164-L366 HydrophobicContact CD1-CD1 4.39Å; Y164-L366 HydrophobicContact CG-CD1 4.24Å; Y164-L380 HydrophobicContact CD2-CD2 3.97Å; Y164-L380 HydrophobicContact CE2-CB 4.19Å; Y164-L380 HydrophobicContact CE2-CD2 3.73Å; Y164-S383 WeakPolarHBondContact OH-CB 3.43Å; Y164-S383 PolarHBondContact OH-OG 3.26Å; Y164-V384 HydrophobicContact CD2-CG2 4.34Å; Y164-V384 HydrophobicContact CE2-CG2 3.61Å; Y164-Y407 HydrophobicContact CD2-CE1 4.12Å
165P98.4Very high97.3Very high0 Ų05.8 Ų5.80%03%0.03CC..Hα-helixtrans-59.7-31.7-171.1-29.736.8000113.8L163 Y167 I168 L169 V384 M403 Y407L163-P165 VanDerWaalsContact O-CD 3.26Å; L163-P165 WeakPolarHBondContact O-CD 2.85Å; L163-P165 VanDerWaalsContact O-N 3.13Å; P165-Y167 VanDerWaalsContact C-N 3.3Å; P165-Y167 PolarHBondContact O-N 3.11Å; P165-I168 PolarHBondContact O-N 3.48Å; P165-L169 HydrophobicContact CB-CD1 4.12Å; P165-L169 VanDerWaalsContact O-CB 3.31Å; P165-L169 WeakPolarHBondContact O-CB 3.26Å; P165-L169 WeakPolarHBondContact O-CG 3.21Å; P165-L169 PolarHBondContact O-N 3.27Å; P165-V384 HydrophobicContact CB-CG1 3.9Å; P165-V384 HydrophobicContact CB-CG2 3.77Å; P165-V384 HydrophobicContact CG-CG1 4.43Å; P165-V384 HydrophobicContact CG-CG2 3.99Å; P165-M403 HydrophobicContact CB-CB 3.86Å; P165-M403 HydrophobicContact CG-CB 4.25Å; P165-M403 WeakPolarHBondContact CG-O 3.17Å; P165-Y407 VanDerWaalsContact CD-CD1 3.45Å; P165-Y407 HydrophobicContact CG-CD1 3.94Å; P165-Y407 HydrophobicContact CG-CG 3.77Å
166G98.1Very high97.5Very high0 Ų04.8 Ų4.80%03%0.025CC..Hα-helixtrans-58.2-41.2179.700000112.7Y164 V170 L359Y164-G166 PolarHBondContact O-N 2.98Å; Y164-G166 VanDerWaalsContact O-N 3.14Å; G166-V170 WeakPolarHBondContact O-CB 3.5Å; G166-V170 VanDerWaalsContact O-CG2 3.23Å; G166-V170 WeakPolarHBondContact O-CG2 3.47Å; G166-V170 PolarHBondContact O-N 3.34Å; G166-V170 VanDerWaalsContact O-N 3.13Å; G166-L359 VanDerWaalsContact C-CD2 3.42Å
167Y98.2Very high97.7Very high4 Ų43.6 Ų3.62%0.0162%0.017CC..Hα-helixtrans-65.7-47.1176.5-60.4-40.9000111.5F134 Y164 P165 D171 L182 L359 T363 L366F134-Y167 AromaticContact CE1-CD2 3.95Å; F134-Y167 HydrophobicContact CE1-CD2 3.95Å; F134-Y167 HydrophobicContact CE1-CE2 4.14Å; F134-Y167 HydrophobicContact CE2-CE2 4.27Å; F134-Y167 AromaticContact CZ-CD2 3.68Å; F134-Y167 HydrophobicContact CZ-CD2 3.68Å; F134-Y167 HydrophobicContact CZ-CE1 4.49Å; F134-Y167 AromaticContact CZ-CE2 3.42Å; F134-Y167 HydrophobicContact CZ-CE2 3.42Å; F134-Y167 VanDerWaalsContact CZ-CE2 3.42Å; F134-Y167 HydrophobicContact CZ-CG 4.32Å; F134-Y167 AromaticContact CZ-CZ 3.84Å; Y164-Y167 HydrophobicContact CD1-CD1 4.12Å; Y164-Y167 AromaticContact CD1-CD2 3.64Å; Y164-Y167 HydrophobicContact CD1-CD2 3.64Å; Y164-Y167 HydrophobicContact CD1-CE1 4.17Å; Y164-Y167 AromaticContact CD1-CE2 3.71Å; Y164-Y167 HydrophobicContact CD1-CE2 3.71Å; Y164-Y167 AromaticContact CD1-CG 3.85Å; Y164-Y167 HydrophobicContact CD1-CG 3.85Å; Y164-Y167 AromaticContact CD1-CZ 4Å; Y164-Y167 HydrophobicContact CE1-CE1 4.49Å; Y164-Y167 HydrophobicContact CG-CD2 4.25Å; Y164-Y167 HydrophobicContact CG-CE2 4.32Å; Y164-Y167 PolarHBondContact O-N 3.22Å; Y164-Y167 VanDerWaalsContact O-N 3.17Å; P165-Y167 VanDerWaalsContact C-N 3.3Å; P165-Y167 PolarHBondContact O-N 3.11Å; Y167-D171 WeakPolarHBondContact O-CB 3.42Å; Y167-D171 PolarHBondContact O-N 3.12Å; Y167-L182 HydrophobicContact CD1-CD1 4.07Å; Y167-L182 HydrophobicContact CE1-CD1 3.64Å; Y167-L359 HydrophobicContact CD1-CD1 4.35Å; Y167-L359 HydrophobicContact CD1-CD2 4.09Å; Y167-L359 HydrophobicContact CE1-CB 4.3Å; Y167-L359 HydrophobicContact CE1-CD2 4.39Å; Y167-T363 WeakPolarHBondContact OH-CA 3.34Å; Y167-T363 WeakPolarHBondContact OH-CB 3.29Å; Y167-T363 WeakPolarHBondContact OH-CG2 3.12Å; Y167-T363 PolarHBondContact OH-OG1 2.83Å; Y167-L366 HydrophobicContact CE2-CD1 3.63Å; Y167-L366 WeakPolarHBondContact OH-CD1 3.5Å
168I98.5Very high97.8Very high1 Ų13.4 Ų3.41%0.0052%0.017CC..Iπ-helixtrans-66.9-44.6-174.9-61.6166.3000110.7I27 R28 A31 P165 F172 V173 M403I27-I168 HydrophobicContact CG2-CD1 3.87Å; R28-I168 HydrophobicContact CG-CG1 4.47Å; A31-I168 HydrophobicContact CB-CG2 3.42Å; A31-I168 VanDerWaalsContact CB-CG2 3.42Å; P165-I168 PolarHBondContact O-N 3.48Å; I168-F172 HydrophobicContact CG2-CB 4.49Å; I168-F172 WeakPolarHBondContact O-CA 3.31Å; I168-F172 WeakPolarHBondContact O-CB 3.46Å; I168-F172 PolarHBondContact O-N 2.81Å; I168-V173 PolarHBondContact O-N 2.62Å; I168-M403 HydrophobicContact CB-SD 4.44Å; I168-M403 HydrophobicContact CD1-SD 4.03Å; I168-M403 HydrophobicContact CG2-CG 4.27Å; I168-M403 HydrophobicContact CG2-SD 3.87Å
169L98.3Very high97.9Very high4 Ų43.5 Ų3.52%0.0212%0.018CC..Iπ-helixtrans-67.4-41.4-179.5-66.6169.7000111.9P165 V173 H174 F400 M403P165-L169 HydrophobicContact CB-CD1 4.12Å; P165-L169 VanDerWaalsContact O-CB 3.31Å; P165-L169 WeakPolarHBondContact O-CB 3.26Å; P165-L169 WeakPolarHBondContact O-CG 3.21Å; P165-L169 PolarHBondContact O-N 3.27Å; L169-V173 HydrophobicContact CD2-CG2 4.1Å; L169-V173 VanDerWaalsContact O-CB 3.27Å; L169-V173 WeakPolarHBondContact O-CB 3.4Å; L169-V173 PolarHBondContact O-N 3.37Å; L169-H174 WeakPolarHBondContact O-CB 3.46Å; L169-H174 PolarHBondContact O-N 3.06Å; L169-F400 HydrophobicContact CD1-CD2 3.65Å; L169-F400 HydrophobicContact CD1-CE2 4.17Å; L169-F400 HydrophobicContact CD1-CG 4.47Å; L169-F400 HydrophobicContact CD2-CB 4.47Å; L169-M403 HydrophobicContact CD2-CB 4.47Å; L169-M403 HydrophobicContact CD2-CG 4.24Å
170V98.1Very high98Very high1 Ų12.6 Ų2.61%0.0061%0.013CC..Iπ-helixtrans-77.1-40.9-176.6-179.70000111.6G166 H174 F175 Q176 N178 K356 L359 L387G166-V170 WeakPolarHBondContact O-CB 3.5Å; G166-V170 VanDerWaalsContact O-CG2 3.23Å; G166-V170 WeakPolarHBondContact O-CG2 3.47Å; G166-V170 PolarHBondContact O-N 3.34Å; G166-V170 VanDerWaalsContact O-N 3.13Å; V170-H174 WeakPolarHBondContact O-CB 3.42Å; V170-F175 PolarHBondContact O-N 2.89Å; V170-Q176 HydrophobicContact CG1-CB 4.13Å; V170-Q176 HydrophobicContact CG1-CG 4.16Å; V170-Q176 PolarHBondContact O-N 3.4Å; V170-N178 WeakPolarHBondContact CG1-ND2 3.49Å; V170-K356 HydrophobicContact CG1-CB 4.34Å; V170-K356 HydrophobicContact CG1-CD 3.99Å; V170-K356 HydrophobicContact CG1-CG 4.08Å; V170-K356 HydrophobicContact CG2-CG 4.45Å; V170-L359 HydrophobicContact CB-CD1 3.83Å; V170-L359 HydrophobicContact CG1-CD1 3.99Å; V170-L359 HydrophobicContact CG2-CD1 3.96Å; V170-L387 HydrophobicContact CG2-CD1 4.04Å; V170-L387 HydrophobicContact CG2-CD2 4.49Å
171D98.3Very high98.1Very high1 Ų12.7 Ų2.71%0.0051%0.014CC..Iπ-helixtrans-88-44.4-175.3-71.3-5.1000112.5V126 Y167 F175 Q176 N178 C179V126-D171 HydrophobicContact CG1-CB 4.19Å; Y167-D171 WeakPolarHBondContact O-CB 3.42Å; Y167-D171 PolarHBondContact O-N 3.12Å; D171-F175 VanDerWaalsContact O-CA 3.3Å; D171-F175 WeakPolarHBondContact O-CA 3.49Å; D171-F175 PolarHBondContact O-N 3.31Å; D171-Q176 WeakPolarHBondContact CA-O 3.3Å; D171-Q176 WeakPolarHBondContact CB-O 3.33Å; D171-Q176 VanDerWaalsContact CG-O 3.3Å; D171-Q176 PolarHBondContact O-N 2.86Å; D171-Q176 WeakPolarHBondContact OD1-CB 3.18Å; D171-N178 VanDerWaalsContact OD1-CB 3.26Å; D171-N178 WeakPolarHBondContact OD1-CB 3.19Å; D171-N178 PolarHBondContact OD1-N 3.42Å; D171-N178 VanDerWaalsContact OD1-N 3.1Å; D171-N178 PolarHBondContact OD1-ND2 3.29Å; D171-N178 PolarHBondContact OD2-N 3.3Å; D171-C179 VanDerWaalsContact OD2-CB 3.29Å; D171-C179 WeakPolarHBondContact OD2-CB 3.39Å; D171-C179 PolarHBondContact OD2-N 3.38Å
172F98.4Very high98.1Very high2 Ų22.8 Ų2.81%0.0092%0.015CC..Iπ-helixtrans-97.2-19.7-171.8-62.5-88.7000114.1R28 A31 S32 R123 V126 L127 D130 I168R28-F172 HydrophobicContact CB-CD1 3.8Å; R28-F172 HydrophobicContact CB-CD2 4.19Å; R28-F172 HydrophobicContact CB-CE1 3.7Å; R28-F172 HydrophobicContact CB-CE2 4.1Å; R28-F172 HydrophobicContact CB-CG 4.02Å; R28-F172 HydrophobicContact CB-CZ 3.84Å; R28-F172 VanDerWaalsContact CD-CZ 3.49Å; R28-F172 HydrophobicContact CG-CD1 4.31Å; R28-F172 HydrophobicContact CG-CD2 3.84Å; R28-F172 HydrophobicContact CG-CE1 4.06Å; R28-F172 HydrophobicContact CG-CE2 3.55Å; R28-F172 HydrophobicContact CG-CG 4.19Å; R28-F172 HydrophobicContact CG-CZ 3.65Å; A31-F172 HydrophobicContact CB-CB 4.12Å; S32-F172 VanDerWaalsContact CA-O 3.3Å; S32-F172 WeakPolarHBondContact CA-O 3.28Å; S32-F172 WeakPolarHBondContact OG-CD1 3.42Å; R123-F172 PolarHBondContact NH1-O 3.1Å; V126-F172 HydrophobicContact CG1-CD1 4.27Å; V126-F172 HydrophobicContact CG1-CE1 4.01Å; V126-F172 HydrophobicContact CG1-CZ 4.22Å; L127-F172 HydrophobicContact CB-CE1 4.08Å; L127-F172 HydrophobicContact CD1-CE1 3.78Å; L127-F172 HydrophobicContact CD1-CZ 4.25Å; D130-F172 HydrophobicContact CB-CE2 4.33Å; D130-F172 HydrophobicContact CB-CZ 3.65Å; I168-F172 HydrophobicContact CG2-CB 4.49Å; I168-F172 WeakPolarHBondContact O-CA 3.31Å; I168-F172 WeakPolarHBondContact O-CB 3.46Å; I168-F172 PolarHBondContact O-N 2.81Å
173V98.1Very high98.1Very high1 Ų12.8 Ų2.81%0.0062%0.015CC..Iπ-helixtrans-97.6-67.3172.1176.70000109.5A31 R123 I168 L169 F175 A396A31-V173 HydrophobicContact CB-CG2 3.99Å; R123-V173 PolarHBondContact NH1-O 3.14Å; R123-V173 PolarHBondContact NH2-O 3.39Å; I168-V173 PolarHBondContact O-N 2.62Å; L169-V173 HydrophobicContact CD2-CG2 4.1Å; L169-V173 VanDerWaalsContact O-CB 3.27Å; L169-V173 WeakPolarHBondContact O-CB 3.4Å; L169-V173 PolarHBondContact O-N 3.37Å; V173-F175 VanDerWaalsContact C-N 3.25Å; V173-F175 PolarHBondContact O-N 3.38Å; V173-A396 HydrophobicContact CG1-CB 3.25Å
174H97.8Very high98.2Very high5 Ų53.1 Ų3.12%0.0232%0.016CC..THydrogen-bonded Turntrans-63.4-26.8-176.7179.278.2000113.9S37 D47 L169 V170 K356 L390 D394S37-H174 VanDerWaalsContact CB-CE1 3.43Å; S37-H174 WeakPolarHBondContact CB-CE1 3.3Å; S37-H174 WeakPolarHBondContact CB-ND1 3.41Å; S37-H174 WeakPolarHBondContact CB-O 3.44Å; S37-H174 PolarHBondContact N-O 2.79Å; S37-H174 VanDerWaalsContact N-O 3.11Å; S37-H174 PolarHBondContact OG-CE1 3.29Å; S37-H174 PolarHBondContact OG-ND1 3.49Å; D47-H174 IonicContact OD2-CD2 2.77Å; D47-H174 IonicContact OD2-CE1 2.95Å; D47-H174 IonicContact OD2-NE2 2.71Å; D47-H174 PolarHBondContact OD2-NE2 2.9Å; L169-H174 WeakPolarHBondContact O-CB 3.46Å; L169-H174 PolarHBondContact O-N 3.06Å; V170-H174 WeakPolarHBondContact O-CB 3.42Å; H174-K356 PolarHBondContact NE2-NZ 2.99Å; H174-L390 VanDerWaalsContact CE1-CD1 3.41Å; H174-L390 WeakPolarHBondContact CE1-CD1 3.38Å; H174-L390 WeakPolarHBondContact ND1-CD1 3.31Å; H174-D394 IonicContact CE1-OD2 2.71Å; H174-D394 IonicContact CG-OD2 2.63Å; H174-D394 IonicContact ND1-OD1 2.8Å; H174-D394 IonicContact ND1-OD2 3.83Å; H174-D394 PolarHBondContact ND1-OD2 2.71Å
175F98.1Very high98.2Very high0 Ų03.1 Ų3.10%02%0.016CC..THydrogen-bonded Turntrans79.288.9-177.8-160.4-88.2000114.2Y48 Q51 M122 V126 V170 D171 V173 Y177Y48-F175 HydrophobicContact CD2-CB 4.02Å; Y48-F175 AromaticContact CD2-CD1 3.83Å; Y48-F175 HydrophobicContact CD2-CD1 3.83Å; Y48-F175 AromaticContact CD2-CD2 3.68Å; Y48-F175 HydrophobicContact CD2-CD2 3.68Å; Y48-F175 HydrophobicContact CD2-CE1 4.25Å; Y48-F175 HydrophobicContact CD2-CE2 4.12Å; Y48-F175 AromaticContact CD2-CG 3.54Å; Y48-F175 HydrophobicContact CD2-CG 3.54Å; Y48-F175 HydrophobicContact CD2-CZ 4.39Å; Y48-F175 HydrophobicContact CE2-CD2 4.03Å; Y48-F175 HydrophobicContact CE2-CE2 4.09Å; Y48-F175 HydrophobicContact CE2-CG 4.31Å; Y48-F175 HydrophobicContact CE2-CZ 4.41Å; Y48-F175 HydrophobicContact CG-CD1 4.38Å; Y48-F175 HydrophobicContact CG-CG 4.37Å; Q51-F175 HydrophobicContact CB-CD1 4.29Å; Q51-F175 HydrophobicContact CB-CE1 3.8Å; Q51-F175 HydrophobicContact CG-CD1 4Å; Q51-F175 HydrophobicContact CG-CE1 3.87Å; M122-F175 VanDerWaalsContact C-CE2 3.45Å; M122-F175 HydrophobicContact CB-CE2 3.66Å; M122-F175 HydrophobicContact CB-CZ 3.59Å; M122-F175 HydrophobicContact CE-CE1 3.58Å; M122-F175 HydrophobicContact CE-CZ 3.65Å; M122-F175 HydrophobicContact CG-CZ 4.38Å; M122-F175 WeakPolarHBondContact O-CE2 3.45Å; M122-F175 WeakPolarHBondContact O-CZ 3.5Å; M122-F175 HydrophobicContact SD-CZ 4.26Å; V126-F175 HydrophobicContact CG2-CD2 4.18Å; V126-F175 HydrophobicContact CG2-CE1 4.29Å; V126-F175 HydrophobicContact CG2-CE2 3.53Å; V126-F175 HydrophobicContact CG2-CZ 3.59Å; V170-F175 PolarHBondContact O-N 2.89Å; D171-F175 VanDerWaalsContact O-CA 3.3Å; D171-F175 WeakPolarHBondContact O-CA 3.49Å; D171-F175 PolarHBondContact O-N 3.31Å; V173-F175 VanDerWaalsContact C-N 3.25Å; V173-F175 PolarHBondContact O-N 3.38Å; F175-Y177 AromaticContact CE1-CE2 4Å; F175-Y177 HydrophobicContact CE1-CE2 4Å; F175-Y177 HydrophobicContact CZ-CE2 4.24Å
176Q97.1Very high98.2Very high3 Ų33.1 Ų3.11%0.0142%0.016CC..  trans-145.9160.5175.8-80.8-75.3-25.300110.5D47 V170 D171 N178D47-Q176 VanDerWaalsContact CG-NE2 3.28Å; D47-Q176 PolarHBondContact OD2-NE2 3.45Å; V170-Q176 HydrophobicContact CG1-CB 4.13Å; V170-Q176 HydrophobicContact CG1-CG 4.16Å; V170-Q176 PolarHBondContact O-N 3.4Å; D171-Q176 WeakPolarHBondContact CA-O 3.3Å; D171-Q176 WeakPolarHBondContact CB-O 3.33Å; D171-Q176 VanDerWaalsContact CG-O 3.3Å; D171-Q176 PolarHBondContact O-N 2.86Å; D171-Q176 WeakPolarHBondContact OD1-CB 3.18Å; Q176-N178 WeakPolarHBondContact CB-ND2 3.33Å
177Y98.1Very high98.2Very high4 Ų45.1 Ų5.12%0.0162%0.024CC..  trans-105.243.9173.8-67.2-82.6000111.7Q51 H89 L93 T125 V126 F175 C179 V180 Y210Q51-Y177 HydrophobicContact CB-CE2 4.26Å; Q51-Y177 HydrophobicContact CG-CD2 4.21Å; Q51-Y177 HydrophobicContact CG-CE2 4.15Å; H89-Y177 AromaticContact CE1-CD1 3.66Å; H89-Y177 AromaticContact CE1-CE1 3.83Å; L93-Y177 HydrophobicContact CD1-CE1 3.91Å; L93-Y177 HydrophobicContact CD1-CE2 4.38Å; L93-Y177 WeakPolarHBondContact CD1-OH 3.42Å; T125-Y177 WeakPolarHBondContact CB-OH 3.48Å; T125-Y177 PolarHBondContact OG1-OH 3.02Å; V126-Y177 HydrophobicContact CB-CD1 4.42Å; V126-Y177 HydrophobicContact CB-CE1 4.08Å; V126-Y177 HydrophobicContact CG2-CD1 3.8Å; V126-Y177 HydrophobicContact CG2-CE1 3.38Å; V126-Y177 HydrophobicContact CG2-CE2 4.19Å; V126-Y177 HydrophobicContact CG2-CG 4.38Å; F175-Y177 AromaticContact CE1-CE2 4Å; F175-Y177 HydrophobicContact CE1-CE2 4Å; F175-Y177 HydrophobicContact CZ-CE2 4.24Å; Y177-C179 PolarHBondContact O-N 2.93Å; Y177-V180 HydrophobicContact CD1-CG2 4.35Å; Y177-V180 PolarHBondContact O-N 3.27Å; Y177-Y210 WeakPolarHBondContact CB-OH 3.36Å; Y177-Y210 WeakPolarHBondContact O-CE1 3.36Å
178N97.9Very high98.3Very high9 Ų95 Ų55%0.0482%0.023CC..Hα-helixtrans-67.1-30.4176.2-60.5-74.9000111.5V170 D171 Q176 V180 S181 L182 K211 L359V170-N178 WeakPolarHBondContact CG1-ND2 3.49Å; D171-N178 VanDerWaalsContact OD1-CB 3.26Å; D171-N178 WeakPolarHBondContact OD1-CB 3.19Å; D171-N178 PolarHBondContact OD1-N 3.42Å; D171-N178 VanDerWaalsContact OD1-N 3.1Å; D171-N178 PolarHBondContact OD1-ND2 3.29Å; D171-N178 PolarHBondContact OD2-N 3.3Å; Q176-N178 WeakPolarHBondContact CB-ND2 3.33Å; N178-V180 PolarHBondContact O-N 3.35Å; N178-V180 VanDerWaalsContact O-N 3.12Å; N178-S181 PolarHBondContact O-N 2.92Å; N178-S181 VanDerWaalsContact O-N 3.16Å; N178-L182 HydrophobicContact CB-CD1 4.15Å; N178-L182 WeakPolarHBondContact O-CB 3.49Å; N178-L182 WeakPolarHBondContact O-CG 3.43Å; N178-L182 PolarHBondContact O-N 3.37Å; N178-K211 PolarHBondContact OD1-NZ 3.41Å; N178-L359 HydrophobicContact CB-CD1 4.25Å
179C98.2Very high98.2Very high2 Ų25 Ų51%0.0142%0.023CC..Hα-helixtrans-51.9-29.6173.8660000113.3D130 F134 D171 Y177 G183D130-C179 HydrophobicContact CB-CB 3.84Å; D130-C179 WeakPolarHBondContact OD1-CB 3.49Å; F134-C179 HydrophobicContact CB-CB 4.15Å; D171-C179 VanDerWaalsContact OD2-CB 3.29Å; D171-C179 WeakPolarHBondContact OD2-CB 3.39Å; D171-C179 PolarHBondContact OD2-N 3.38Å; Y177-C179 PolarHBondContact O-N 2.93Å; C179-G183 WeakPolarHBondContact O-CA 3.42Å; C179-G183 PolarHBondContact O-N 3.27Å
180V98.6Very high98.2Very high5 Ų55 Ų53%0.032%0.024CC..Hα-helixtrans-71.6-54.4176.7175.90000110.8L133 Y177 N178 G183 L184 Y210L133-V180 HydrophobicContact CD1-CB 4.17Å; L133-V180 HydrophobicContact CD1-CG1 3.82Å; L133-V180 HydrophobicContact CD1-CG2 3.93Å; Y177-V180 HydrophobicContact CD1-CG2 4.35Å; Y177-V180 PolarHBondContact O-N 3.27Å; N178-V180 PolarHBondContact O-N 3.35Å; N178-V180 VanDerWaalsContact O-N 3.12Å; V180-G183 PolarHBondContact O-N 3.12Å; V180-L184 HydrophobicContact CG1-CD1 4.1Å; V180-L184 WeakPolarHBondContact O-CB 3.3Å; V180-L184 VanDerWaalsContact O-CG 3.27Å; V180-L184 WeakPolarHBondContact O-CG 3.3Å; V180-L184 PolarHBondContact O-N 3.32Å; V180-Y210 HydrophobicContact CB-CD1 4.08Å; V180-Y210 HydrophobicContact CB-CD2 4.29Å; V180-Y210 HydrophobicContact CB-CE1 3.63Å; V180-Y210 HydrophobicContact CB-CE2 3.87Å; V180-Y210 HydrophobicContact CB-CG 4.38Å; V180-Y210 HydrophobicContact CG1-CD1 3.92Å; V180-Y210 HydrophobicContact CG1-CD2 3.36Å; V180-Y210 HydrophobicContact CG1-CE1 3.8Å; V180-Y210 HydrophobicContact CG1-CE2 3.22Å; V180-Y210 HydrophobicContact CG1-CG 3.7Å; V180-Y210 VanDerWaalsContact CG1-CZ 3.45Å; V180-Y210 HydrophobicContact CG2-CE1 4.38Å; V180-Y210 HydrophobicContact CG2-CE2 4.32Å
181S98.3Very high98.2Very high2 Ų26.1 Ų6.11%0.0143%0.029CC..Hα-helixtrans-61.7-54.6179.5-173.70000111.5N178 G183 L184 F185 A207 E214N178-S181 PolarHBondContact O-N 2.92Å; N178-S181 VanDerWaalsContact O-N 3.16Å; S181-G183 PolarHBondContact O-N 3.24Å; S181-L184 PolarHBondContact O-N 3.19Å; S181-F185 PolarHBondContact O-N 3.02Å; S181-A207 WeakPolarHBondContact O-CB 3.5Å; S181-A207 PolarHBondContact OG-O 3.5Å; S181-E214 WeakPolarHBondContact OG-CG 3.47Å; S181-E214 PolarHBondContact OG-OE1 2.9Å
182L98.4Very high98.2Very high4 Ų46.2 Ų6.22%0.0213%0.029CC..Hα-helixtrans-65.6-30.2-179.4-66.7176.1000111.4F134 Y167 N178 F185 M186 L359 L360F134-L182 HydrophobicContact CD2-CB 4.41Å; F134-L182 HydrophobicContact CE2-CB 4.44Å; Y167-L182 HydrophobicContact CD1-CD1 4.07Å; Y167-L182 HydrophobicContact CE1-CD1 3.64Å; N178-L182 HydrophobicContact CB-CD1 4.15Å; N178-L182 WeakPolarHBondContact O-CB 3.49Å; N178-L182 WeakPolarHBondContact O-CG 3.43Å; N178-L182 PolarHBondContact O-N 3.37Å; L182-F185 WeakPolarHBondContact O-CB 3.46Å; L182-F185 PolarHBondContact O-N 2.98Å; L182-M186 WeakPolarHBondContact O-CB 3.18Å; L182-M186 VanDerWaalsContact O-CG 3.29Å; L182-M186 WeakPolarHBondContact O-CG 3.32Å; L182-M186 PolarHBondContact O-N 3.35Å; L182-L359 HydrophobicContact CD1-CB 3.96Å; L182-L360 HydrophobicContact CD2-CD2 3.83Å
183G98.4Very high98Very high0 Ų07.9 Ų7.90%04%0.037CC..Hα-helixtrans-67.2-47.2173.700000113.4L133 C179 V180 S181 F185 M186 W187L133-G183 CarbonylContact O-C 3.47Å; L133-G183 WeakPolarHBondContact O-CA 3.49Å; L133-G183 VanDerWaalsContact O-O 3.13Å; C179-G183 WeakPolarHBondContact O-CA 3.42Å; C179-G183 PolarHBondContact O-N 3.27Å; V180-G183 PolarHBondContact O-N 3.12Å; S181-G183 PolarHBondContact O-N 3.24Å; G183-F185 VanDerWaalsContact C-N 3.26Å; G183-F185 PolarHBondContact O-N 3.47Å; G183-M186 CarbonylContact O-C 3.39Å; G183-M186 WeakPolarHBondContact O-CB 3.25Å; G183-M186 PolarHBondContact O-N 3.07Å; G183-M186 VanDerWaalsContact O-N 3.1Å; G183-W187 PolarHBondContact O-N 2.9Å
184L98.8Very high97.9Very high17 Ų1711.9 Ų11.99%0.0896%0.059CC..Hα-helixtrans-60.7-37.9171.9-69.9165.6000111.3L85 L133 V180 S181 W187 A188 F203 C206 A207L85-L184 HydrophobicContact CD2-CD1 4.23Å; L133-L184 HydrophobicContact CD2-CD2 4.28Å; V180-L184 HydrophobicContact CG1-CD1 4.1Å; V180-L184 WeakPolarHBondContact O-CB 3.3Å; V180-L184 VanDerWaalsContact O-CG 3.27Å; V180-L184 WeakPolarHBondContact O-CG 3.3Å; V180-L184 PolarHBondContact O-N 3.32Å; S181-L184 PolarHBondContact O-N 3.19Å; L184-W187 WeakPolarHBondContact O-CB 3.23Å; L184-W187 PolarHBondContact O-N 3.45Å; L184-A188 PolarHBondContact O-N 3.23Å; L184-F203 HydrophobicContact CD2-CD1 3.9Å; L184-F203 HydrophobicContact CD2-CE1 4.4Å; L184-C206 HydrophobicContact CD1-CB 3.99Å; L184-C206 HydrophobicContact CD2-CB 4.17Å; L184-A207 HydrophobicContact CB-CB 3.7Å
185F98.7Very high97.8Very high0 Ų016.9 Ų16.90%09%0.085CC..Hα-helixtrans-62.3-44.9170.6170.4-109.4000112S181 L182 G183 W187 A188 I189 F204 A207 H217 I221 L339 T363 P364S181-F185 PolarHBondContact O-N 3.02Å; L182-F185 WeakPolarHBondContact O-CB 3.46Å; L182-F185 PolarHBondContact O-N 2.98Å; G183-F185 VanDerWaalsContact C-N 3.26Å; G183-F185 PolarHBondContact O-N 3.47Å; F185-W187 VanDerWaalsContact C-N 3.33Å; F185-W187 PolarHBondContact O-N 3.18Å; F185-A188 WeakPolarHBondContact O-CA 3.36Å; F185-A188 VanDerWaalsContact O-CB 3.3Å; F185-A188 WeakPolarHBondContact O-CB 3.47Å; F185-A188 PolarHBondContact O-N 3.23Å; F185-I189 HydrophobicContact CE1-CD1 4.47Å; F185-I189 HydrophobicContact CE1-CG1 4.12Å; F185-I189 HydrophobicContact CE2-CD1 3.9Å; F185-I189 HydrophobicContact CE2-CG1 4.15Å; F185-I189 HydrophobicContact CZ-CD1 3.81Å; F185-I189 HydrophobicContact CZ-CG1 3.94Å; F185-I189 WeakPolarHBondContact O-CG1 3.38Å; F185-I189 PolarHBondContact O-N 2.99Å; F185-F204 HydrophobicContact CD2-CD2 4.06Å; F185-F204 HydrophobicContact CD2-CE2 4.2Å; F185-A207 HydrophobicContact CB-CB 4.32Å; F185-H217 AromaticContact CD2-ND1 3.97Å; F185-H217 HydrophobicContact CE2-CB 4.06Å; F185-H217 AromaticContact CE2-CG 3.79Å; F185-H217 AromaticContact CE2-ND1 3.81Å; F185-I221 HydrophobicContact CE2-CD1 4.29Å; F185-L339 HydrophobicContact CE2-CD1 4.29Å; F185-L339 HydrophobicContact CE2-CD2 3.92Å; F185-L339 HydrophobicContact CZ-CD1 3.99Å; F185-L339 HydrophobicContact CZ-CD2 4.06Å; F185-T363 HydrophobicContact CD1-CG2 3.92Å; F185-T363 HydrophobicContact CE1-CG2 3.8Å; F185-P364 HydrophobicContact CE1-CG 4.45Å; F185-P364 HydrophobicContact CZ-CG 4.34Å
186M98.3Very high97.8Very high1 Ų121 Ų211%0.00511%0.107CC..Hα-helixtrans-61.9-38.1175.4-77.4-63.8-6500112.5F134 P137 Y141 L182 G183 A188 I189 V190 T363 L367F134-M186 HydrophobicContact CD2-CG 4.32Å; F134-M186 HydrophobicContact CE2-CG 4.04Å; P137-M186 HydrophobicContact CB-CB 4.1Å; P137-M186 HydrophobicContact CG-CB 3.99Å; Y141-M186 HydrophobicContact CG-CE 4.43Å; L182-M186 WeakPolarHBondContact O-CB 3.18Å; L182-M186 VanDerWaalsContact O-CG 3.29Å; L182-M186 WeakPolarHBondContact O-CG 3.32Å; L182-M186 PolarHBondContact O-N 3.35Å; G183-M186 CarbonylContact O-C 3.39Å; G183-M186 WeakPolarHBondContact O-CB 3.25Å; G183-M186 PolarHBondContact O-N 3.07Å; G183-M186 VanDerWaalsContact O-N 3.1Å; M186-A188 VanDerWaalsContact C-N 3.33Å; M186-A188 PolarHBondContact O-N 2.79Å; M186-I189 PolarHBondContact O-N 3.32Å; M186-V190 WeakPolarHBondContact O-CG2 3.21Å; M186-V190 PolarHBondContact O-N 3.37Å; M186-T363 HydrophobicContact CG-CG2 4.21Å; M186-T363 HydrophobicContact SD-CG2 3.79Å; M186-L367 HydrophobicContact CE-CD2 4.24Å; M186-L367 HydrophobicContact SD-CD2 4.21Å
187W98.5Very high97.8Very high42 Ų4220.8 Ų20.816%0.15911%0.106CC..Hα-helixtrans-58.2-44.7169.4-86.7105.4000111.6L136 P137 L140 G183 L184 F185 I189 V190 M191 F203L136-W187 HydrophobicContact CD2-CH2 4.4Å; L136-W187 HydrophobicContact CD2-CZ2 3.87Å; L136-W187 HydrophobicContact CG-CZ2 4.03Å; P137-W187 HydrophobicContact CB-CD2 3.92Å; P137-W187 HydrophobicContact CB-CG 3.89Å; P137-W187 HydrophobicContact CG-CD2 4.37Å; P137-W187 HydrophobicContact CG-CG 4.08Å; L140-W187 HydrophobicContact CD1-CH2 3.55Å; L140-W187 HydrophobicContact CD1-CZ2 4.39Å; L140-W187 HydrophobicContact CD1-CZ3 3.71Å; G183-W187 PolarHBondContact O-N 2.9Å; L184-W187 WeakPolarHBondContact O-CB 3.23Å; L184-W187 PolarHBondContact O-N 3.45Å; F185-W187 VanDerWaalsContact C-N 3.33Å; F185-W187 PolarHBondContact O-N 3.18Å; W187-I189 VanDerWaalsContact C-N 3.33Å; W187-I189 PolarHBondContact O-N 2.81Å; W187-V190 PolarHBondContact O-N 2.96Å; W187-M191 HydrophobicContact CE3-CE 3.65Å; W187-M191 HydrophobicContact CZ3-CE 3.71Å; W187-M191 VanDerWaalsContact O-CG 3.3Å; W187-M191 WeakPolarHBondContact O-CG 3.3Å; W187-M191 PolarHBondContact O-N 3.17Å; W187-F203 HydrophobicContact CB-CB 4.16Å; W187-F203 HydrophobicContact CB-CD1 3.73Å; W187-F203 HydrophobicContact CB-CD2 4Å; W187-F203 HydrophobicContact CB-CE1 4.05Å; W187-F203 HydrophobicContact CB-CE2 4.29Å; W187-F203 HydrophobicContact CB-CG 3.71Å; W187-F203 HydrophobicContact CB-CZ 4.32Å; W187-F203 HydrophobicContact CD2-CE1 4.35Å; W187-F203 HydrophobicContact CD2-CZ 4.17Å; W187-F203 HydrophobicContact CE3-CE2 4.19Å; W187-F203 HydrophobicContact CE3-CZ 4.11Å; W187-F203 HydrophobicContact CG-CD1 4.2Å; W187-F203 HydrophobicContact CG-CE1 4.06Å; W187-F203 HydrophobicContact CG-CZ 4.29Å
188A98.7Very high97.8Very high0 Ų023.6 Ų23.60%012%0.12CC..Hα-helixtrans-59.9-42.3175.300000112L184 F185 M186 M191 F192 A200 F203 F204L184-A188 PolarHBondContact O-N 3.23Å; F185-A188 WeakPolarHBondContact O-CA 3.36Å; F185-A188 VanDerWaalsContact O-CB 3.3Å; F185-A188 WeakPolarHBondContact O-CB 3.47Å; F185-A188 PolarHBondContact O-N 3.23Å; M186-A188 VanDerWaalsContact C-N 3.33Å; M186-A188 PolarHBondContact O-N 2.79Å; A188-M191 PolarHBondContact O-N 3.34Å; A188-F192 HydrophobicContact CB-CE2 4.21Å; A188-F192 WeakPolarHBondContact O-CD2 3.48Å; A188-F192 WeakPolarHBondContact O-CG 3.42Å; A188-F192 PolarHBondContact O-N 3.24Å; A188-A200 WeakPolarHBondContact CB-O 3.36Å; A188-A200 WeakPolarHBondContact O-CB 3.31Å; A188-F203 HydrophobicContact CB-CB 3.99Å; A188-F204 HydrophobicContact CB-CB 4Å
189I98.3Very high97.9Very high1 Ų126.2 Ų26.21%0.00514%0.136CC..Hα-helixtrans-60.2-47.1175.6-63.1-58.6000111.7Y141 F185 M186 W187 M191 F192 E193 L339 L367Y141-I189 HydrophobicContact CD2-CG2 4.03Å; Y141-I189 HydrophobicContact CE2-CG2 3.85Å; F185-I189 HydrophobicContact CE1-CD1 4.47Å; F185-I189 HydrophobicContact CE1-CG1 4.12Å; F185-I189 HydrophobicContact CE2-CD1 3.9Å; F185-I189 HydrophobicContact CE2-CG1 4.15Å; F185-I189 HydrophobicContact CZ-CD1 3.81Å; F185-I189 HydrophobicContact CZ-CG1 3.94Å; F185-I189 WeakPolarHBondContact O-CG1 3.38Å; F185-I189 PolarHBondContact O-N 2.99Å; M186-I189 PolarHBondContact O-N 3.32Å; W187-I189 VanDerWaalsContact C-N 3.33Å; W187-I189 PolarHBondContact O-N 2.81Å; I189-M191 VanDerWaalsContact C-N 3.25Å; I189-M191 PolarHBondContact O-N 3.14Å; I189-F192 HydrophobicContact CD1-CD2 4.45Å; I189-F192 PolarHBondContact O-N 3.31Å; I189-E193 HydrophobicContact CG2-CG 4.46Å; I189-E193 WeakPolarHBondContact O-CG 3.45Å; I189-E193 PolarHBondContact O-N 2.87Å; I189-L339 HydrophobicContact CD1-CD1 3.57Å; I189-L367 HydrophobicContact CD1-CD1 4.24Å; I189-L367 HydrophobicContact CG1-CD1 4.01Å; I189-L367 HydrophobicContact CG2-CD1 3.97Å; I189-L367 HydrophobicContact CG2-CD2 4.4Å
190V98.1Very high97.9Very high6 Ų626.1 Ų26.14%0.03614%0.135CC..Hα-helixtrans-57.2-41.8176.1173.10000110.9P137 L140 Y141 M186 W187 E193 N194P137-V190 HydrophobicContact CB-CG2 4.21Å; P137-V190 WeakPolarHBondContact O-CG2 3.39Å; L140-V190 HydrophobicContact CB-CG1 4.2Å; L140-V190 HydrophobicContact CB-CG2 4.4Å; Y141-V190 HydrophobicContact CD2-CG2 4.47Å; M186-V190 WeakPolarHBondContact O-CG2 3.21Å; M186-V190 PolarHBondContact O-N 3.37Å; W187-V190 PolarHBondContact O-N 2.96Å; V190-E193 PolarHBondContact O-N 3.21Å; V190-N194 PolarHBondContact O-N 3.34Å; V190-N194 PolarHBondContact O-ND2 3.42Å
191M98Very high97.9Very high24 Ų2426 Ų2612%0.11814%0.135CC..Hα-helixtrans-69.8-38178.9-63.6-58.5143.300112.5W187 A188 I189 N194 D195 L196 V199 A200 F203W187-M191 HydrophobicContact CE3-CE 3.65Å; W187-M191 HydrophobicContact CZ3-CE 3.71Å; W187-M191 VanDerWaalsContact O-CG 3.3Å; W187-M191 WeakPolarHBondContact O-CG 3.3Å; W187-M191 PolarHBondContact O-N 3.17Å; A188-M191 PolarHBondContact O-N 3.34Å; I189-M191 VanDerWaalsContact C-N 3.25Å; I189-M191 PolarHBondContact O-N 3.14Å; M191-N194 CarbonylContact O-C 3.57Å; M191-N194 PolarHBondContact O-N 3.44Å; M191-D195 PolarHBondContact O-N 3.33Å; M191-L196 HydrophobicContact CB-CB 4.15Å; M191-L196 PolarHBondContact O-N 3.37Å; M191-L196 HydrophobicContact SD-CB 4.29Å; M191-L196 HydrophobicContact SD-CD1 3.7Å; M191-V199 HydrophobicContact CG-CB 4.22Å; M191-V199 HydrophobicContact CG-CG1 3.91Å; M191-V199 HydrophobicContact SD-CB 4.34Å; M191-V199 HydrophobicContact SD-CG1 3.94Å; M191-A200 HydrophobicContact CB-CB 3.57Å; M191-F203 HydrophobicContact CE-CE2 4.45Å; M191-F203 HydrophobicContact CG-CD2 4.1Å; M191-F203 HydrophobicContact CG-CE2 4.29Å
192F97.8Very high97.9Very high2 Ų230.2 Ų30.21%0.00915%0.153CC..Hα-helixtrans-63.5-39.8173.7-72.4-48.7000112.4A188 I189 N194 D195 A200 I221 Y224 L225 L335A188-F192 HydrophobicContact CB-CE2 4.21Å; A188-F192 WeakPolarHBondContact O-CD2 3.48Å; A188-F192 WeakPolarHBondContact O-CG 3.42Å; A188-F192 PolarHBondContact O-N 3.24Å; I189-F192 HydrophobicContact CD1-CD2 4.45Å; I189-F192 PolarHBondContact O-N 3.31Å; F192-N194 PolarHBondContact O-N 3.05Å; F192-D195 PolarHBondContact O-N 2.97Å; F192-D195 VanDerWaalsContact O-N 3.12Å; F192-A200 HydrophobicContact CD1-CB 3.39Å; F192-A200 HydrophobicContact CD2-CB 3.99Å; F192-A200 HydrophobicContact CE1-CB 3.26Å; F192-A200 HydrophobicContact CE2-CB 3.89Å; F192-A200 HydrophobicContact CG-CB 3.74Å; F192-A200 HydrophobicContact CZ-CB 3.53Å; F192-I221 HydrophobicContact CE2-CD1 4.24Å; F192-I221 HydrophobicContact CE2-CG1 4.24Å; F192-I221 HydrophobicContact CE2-CG2 4.2Å; F192-I221 HydrophobicContact CZ-CG2 3.75Å; F192-Y224 HydrophobicContact CD1-CD1 4.44Å; F192-Y224 AromaticContact CD1-CE1 3.83Å; F192-Y224 HydrophobicContact CD1-CE1 3.83Å; F192-Y224 HydrophobicContact CE1-CD1 4.48Å; F192-Y224 HydrophobicContact CE1-CE1 4.27Å; F192-Y224 HydrophobicContact CG-CE1 4.34Å; F192-L225 HydrophobicContact CE1-CD1 4.32Å; F192-L225 HydrophobicContact CE1-CD2 3.87Å; F192-L225 HydrophobicContact CE1-CG 4.24Å; F192-L225 HydrophobicContact CZ-CD1 4.41Å; F192-L335 HydrophobicContact CB-CD2 4.06Å; F192-L335 HydrophobicContact CD2-CD2 3.79Å; F192-L335 HydrophobicContact CE2-CD2 4.42Å; F192-L335 HydrophobicContact CG-CD2 3.94Å
193E95Very high97.9Very high38 Ų3831.9 Ų31.918%0.17816%0.16CC..Hα-helixtrans-62.8-22.6175.2-71.3-80.3160.700112.9Y141 K145 I189 V190 H336Y141-E193 HydrophobicContact CD2-CG 4.43Å; Y141-E193 HydrophobicContact CE2-CG 4.04Å; K145-E193 IonicContact NZ-OE1 3.04Å; K145-E193 PolarHBondContact NZ-OE1 3.4Å; K145-E193 IonicContact NZ-OE2 3.27Å; K145-E193 PolarHBondContact NZ-OE2 2.99Å; I189-E193 HydrophobicContact CG2-CG 4.46Å; I189-E193 WeakPolarHBondContact O-CG 3.45Å; I189-E193 PolarHBondContact O-N 2.87Å; V190-E193 PolarHBondContact O-N 3.21Å; E193-H336 IonicContact OE1-CE1 2.7Å; E193-H336 PolarHBondContact OE1-CE1 3.24Å; E193-H336 IonicContact OE1-ND1 2.84Å; E193-H336 IonicContact OE1-NE2 3.98Å; E193-H336 PolarHBondContact OE1-NE2 3.49Å; E193-H336 VanDerWaalsContact OE1-NE2 3.16Å
194N95.1Very high98Very high85 Ų8532.6 Ų32.646%0.45516%0.164SC..THydrogen-bonded Turntrans-104.316177.4-69.7-85.4000113V190 M191 F192 L196V190-N194 PolarHBondContact O-N 3.34Å; V190-N194 PolarHBondContact O-ND2 3.42Å; M191-N194 CarbonylContact O-C 3.57Å; M191-N194 PolarHBondContact O-N 3.44Å; F192-N194 PolarHBondContact O-N 3.05Å; N194-L196 HydrophobicContact CB-CD1 4.4Å; N194-L196 HydrophobicContact CB-CG 4.34Å; N194-L196 PolarHBondContact O-N 2.93Å; N194-L196 VanDerWaalsContact O-N 3.08Å
195D95.5Very high98Very high109 Ų10932.1 Ų32.158%0.58316%0.161SC*.THydrogen-bonded Turntrans57.818.6-178.4-76.7-57.2000115.5M191 F192 D197 K228M191-D195 PolarHBondContact O-N 3.33Å; F192-D195 PolarHBondContact O-N 2.97Å; F192-D195 VanDerWaalsContact O-N 3.12Å; D195-D197 PolarHBondContact O-N 3.27Å; D195-K228 IonicContact OD1-NZ 3.84Å; D195-K228 PolarHBondContact OD1-NZ 3Å
196L97.8Very high98Very high86 Ų8632.6 Ų32.645%0.4517%0.165SC..  trans-86.457177.1-62.9177.2000111.2M191 N194 M198 V199 A200M191-L196 HydrophobicContact CB-CB 4.15Å; M191-L196 PolarHBondContact O-N 3.37Å; M191-L196 HydrophobicContact SD-CB 4.29Å; M191-L196 HydrophobicContact SD-CD1 3.7Å; N194-L196 HydrophobicContact CB-CD1 4.4Å; N194-L196 HydrophobicContact CB-CG 4.34Å; N194-L196 PolarHBondContact O-N 2.93Å; N194-L196 VanDerWaalsContact O-N 3.08Å; L196-M198 PolarHBondContact O-N 3.43Å; L196-M198 VanDerWaalsContact O-N 3.09Å; L196-V199 HydrophobicContact CB-CB 4.34Å; L196-V199 HydrophobicContact CB-CG2 4.44Å; L196-V199 PolarHBondContact O-N 3.45Å; L196-A200 PolarHBondContact O-N 3.35Å
197D98.3Very high98Very high0 Ų032.6 Ų32.60%016%0.164CC..Hα-helixtrans-55.1-34.4-169.6-64.8-27.9000114.2D195 S201 L225 K228 K240 L244D195-D197 PolarHBondContact O-N 3.27Å; D197-S201 WeakPolarHBondContact O-CB 3.37Å; D197-S201 PolarHBondContact O-N 3.4Å; D197-S201 PolarHBondContact O-OG 2.91Å; D197-L225 HydrophobicContact CB-CD2 3.79Å; D197-K228 VanDerWaalsContact CG-NZ 3.27Å; D197-K228 IonicContact OD1-NZ 2.86Å; D197-K228 PolarHBondContact OD1-NZ 2.86Å; D197-K228 WeakPolarHBondContact OD2-CD 3.23Å; D197-K228 VanDerWaalsContact OD2-CE 3.26Å; D197-K228 WeakPolarHBondContact OD2-CE 3.48Å; D197-K228 IonicContact OD2-NZ 3.77Å; D197-K228 PolarHBondContact OD2-NZ 2.69Å; D197-K240 WeakPolarHBondContact OD2-CE 3.3Å; D197-K240 IonicContact OD2-NZ 2.74Å; D197-K240 PolarHBondContact OD2-NZ 3.43Å; D197-L244 HydrophobicContact CB-CD2 4.1Å
198M98.4Very high98Very high63 Ų6331.8 Ų31.831%0.3116%0.163SC..Hα-helixtrans-70.9-45179.8-69.771.7177.600111.4L196 A200 S201 F202 K240 C243 L244 V247L196-M198 PolarHBondContact O-N 3.43Å; L196-M198 VanDerWaalsContact O-N 3.09Å; M198-A200 VanDerWaalsContact C-N 3.33Å; M198-S201 WeakPolarHBondContact O-CB 3.3Å; M198-S201 PolarHBondContact O-N 2.9Å; M198-F202 PolarHBondContact O-N 3.11Å; M198-F202 VanDerWaalsContact O-N 3.08Å; M198-K240 HydrophobicContact CE-CG 3.96Å; M198-C243 HydrophobicContact CE-CB 3.79Å; M198-L244 HydrophobicContact CE-CG 4.43Å; M198-L244 HydrophobicContact CG-CD2 4.22Å; M198-L244 HydrophobicContact SD-CD2 4.3Å; M198-V247 HydrophobicContact CB-CG2 4.28Å; M198-V247 HydrophobicContact CG-CG2 4.49Å
199V98.6Very high98Very high63 Ų6331.9 Ų31.938%0.38216%0.164SC..Hα-helixtrans-68.1-39.2177.6-173.60000109.9M191 L196 S201 F202 F203M191-V199 HydrophobicContact CG-CB 4.22Å; M191-V199 HydrophobicContact CG-CG1 3.91Å; M191-V199 HydrophobicContact SD-CB 4.34Å; M191-V199 HydrophobicContact SD-CG1 3.94Å; L196-V199 HydrophobicContact CB-CB 4.34Å; L196-V199 HydrophobicContact CB-CG2 4.44Å; L196-V199 PolarHBondContact O-N 3.45Å; V199-S201 VanDerWaalsContact C-N 3.31Å; V199-S201 PolarHBondContact O-N 2.99Å; V199-F202 WeakPolarHBondContact O-CB 3.18Å; V199-F202 PolarHBondContact O-N 3.38Å; V199-F203 HydrophobicContact CG1-CD2 3.9Å; V199-F203 HydrophobicContact CG1-CE2 3.67Å; V199-F203 VanDerWaalsContact O-CD2 3.32Å; V199-F203 WeakPolarHBondContact O-CD2 3.23Å; V199-F203 PolarHBondContact O-N 3.36Å; V199-F203 VanDerWaalsContact O-N 3.09Å
200A98.7Very high98Very high0 Ų032.1 Ų32.10%017%0.165CC..Hα-helixtrans-58.4-43.717300000112A188 M191 F192 L196 M198 F202 F203 F204A188-A200 WeakPolarHBondContact CB-O 3.36Å; A188-A200 WeakPolarHBondContact O-CB 3.31Å; M191-A200 HydrophobicContact CB-CB 3.57Å; F192-A200 HydrophobicContact CD1-CB 3.39Å; F192-A200 HydrophobicContact CD2-CB 3.99Å; F192-A200 HydrophobicContact CE1-CB 3.26Å; F192-A200 HydrophobicContact CE2-CB 3.89Å; F192-A200 HydrophobicContact CG-CB 3.74Å; F192-A200 HydrophobicContact CZ-CB 3.53Å; L196-A200 PolarHBondContact O-N 3.35Å; M198-A200 VanDerWaalsContact C-N 3.33Å; A200-F202 PolarHBondContact O-N 2.87Å; A200-F203 PolarHBondContact O-N 3.04Å; A200-F204 WeakPolarHBondContact O-CB 3.39Å; A200-F204 PolarHBondContact O-N 3.19Å
201S98.7Very high97.9Very high3 Ų332.8 Ų32.82%0.02117%0.167CC..Hα-helixtrans-63.2-39.7177.7-59.60000112.2D197 M198 V199 F204 V205 L225 L244D197-S201 WeakPolarHBondContact O-CB 3.37Å; D197-S201 PolarHBondContact O-N 3.4Å; D197-S201 PolarHBondContact O-OG 2.91Å; M198-S201 WeakPolarHBondContact O-CB 3.3Å; M198-S201 PolarHBondContact O-N 2.9Å; V199-S201 VanDerWaalsContact C-N 3.31Å; V199-S201 PolarHBondContact O-N 2.99Å; S201-F204 PolarHBondContact O-N 3.35Å; S201-V205 VanDerWaalsContact O-CG2 3.29Å; S201-V205 WeakPolarHBondContact O-CG2 3.39Å; S201-V205 PolarHBondContact O-N 3.36Å; S201-L225 WeakPolarHBondContact OG-CD1 3.21Å; S201-L244 WeakPolarHBondContact OG-CD2 3.23Å
202F98.8Very high97.8Very high90 Ų9032.3 Ų32.340%0.39517%0.165SC..Hα-helixtrans-58-53.4173166.2-97.3000111.4M198 V199 A200 F204 V205 C206 V247 T251M198-F202 PolarHBondContact O-N 3.11Å; M198-F202 VanDerWaalsContact O-N 3.08Å; V199-F202 WeakPolarHBondContact O-CB 3.18Å; V199-F202 PolarHBondContact O-N 3.38Å; A200-F202 PolarHBondContact O-N 2.87Å; F202-F204 VanDerWaalsContact C-N 3.33Å; F202-F204 PolarHBondContact O-N 3.32Å; F202-V205 PolarHBondContact O-N 3.01Å; F202-C206 PolarHBondContact O-N 3.22Å; F202-C206 PolarHBondContact O-SG 2.87Å; F202-C206 VanDerWaalsContact O-SG 3.37Å; F202-V247 HydrophobicContact CB-CG1 4.06Å; F202-T251 HydrophobicContact CD2-CG2 3.74Å; F202-T251 HydrophobicContact CE2-CG2 3.98Å
203F98.8Very high97.6Very high39 Ų3933.9 Ų33.917%0.17117%0.173CC..Hα-helixtrans-61.8-39.3-179.9-80.1-64000112.7L184 W187 A188 M191 V199 A200 C206 A207L184-F203 HydrophobicContact CD2-CD1 3.9Å; L184-F203 HydrophobicContact CD2-CE1 4.4Å; W187-F203 HydrophobicContact CB-CB 4.16Å; W187-F203 HydrophobicContact CB-CD1 3.73Å; W187-F203 HydrophobicContact CB-CD2 4Å; W187-F203 HydrophobicContact CB-CE1 4.05Å; W187-F203 HydrophobicContact CB-CE2 4.29Å; W187-F203 HydrophobicContact CB-CG 3.71Å; W187-F203 HydrophobicContact CB-CZ 4.32Å; W187-F203 HydrophobicContact CD2-CE1 4.35Å; W187-F203 HydrophobicContact CD2-CZ 4.17Å; W187-F203 HydrophobicContact CE3-CE2 4.19Å; W187-F203 HydrophobicContact CE3-CZ 4.11Å; W187-F203 HydrophobicContact CG-CD1 4.2Å; W187-F203 HydrophobicContact CG-CE1 4.06Å; W187-F203 HydrophobicContact CG-CZ 4.29Å; A188-F203 HydrophobicContact CB-CB 3.99Å; M191-F203 HydrophobicContact CE-CE2 4.45Å; M191-F203 HydrophobicContact CG-CD2 4.1Å; M191-F203 HydrophobicContact CG-CE2 4.29Å; V199-F203 HydrophobicContact CG1-CD2 3.9Å; V199-F203 HydrophobicContact CG1-CE2 3.67Å; V199-F203 VanDerWaalsContact O-CD2 3.32Å; V199-F203 WeakPolarHBondContact O-CD2 3.23Å; V199-F203 PolarHBondContact O-N 3.36Å; V199-F203 VanDerWaalsContact O-N 3.09Å; A200-F203 PolarHBondContact O-N 3.04Å; F203-C206 WeakPolarHBondContact O-CB 3.4Å; F203-C206 PolarHBondContact O-N 2.94Å; F203-A207 PolarHBondContact O-N 2.83Å
204F98.8Very high97.7Very high16 Ų1632.1 Ų32.17%0.0716%0.164CC..Hα-helixtrans-67.8-38.7177.6-175.9-114.4000112.5F185 A188 A200 S201 F202 C206 A207 L208 E214 H217 A218 I221F185-F204 HydrophobicContact CD2-CD2 4.06Å; F185-F204 HydrophobicContact CD2-CE2 4.2Å; A188-F204 HydrophobicContact CB-CB 4Å; A200-F204 WeakPolarHBondContact O-CB 3.39Å; A200-F204 PolarHBondContact O-N 3.19Å; S201-F204 PolarHBondContact O-N 3.35Å; F202-F204 VanDerWaalsContact C-N 3.33Å; F202-F204 PolarHBondContact O-N 3.32Å; F204-C206 VanDerWaalsContact C-N 3.3Å; F204-C206 PolarHBondContact O-N 3.08Å; F204-A207 WeakPolarHBondContact O-CB 3.46Å; F204-A207 PolarHBondContact O-N 3.35Å; F204-L208 WeakPolarHBondContact O-CB 3.46Å; F204-L208 PolarHBondContact O-N 3.42Å; F204-E214 HydrophobicContact CE2-CB 4.38Å; F204-H217 HydrophobicContact CE2-CB 3.81Å; F204-H217 HydrophobicContact CZ-CB 3.96Å; F204-A218 HydrophobicContact CE1-CB 3.87Å; F204-A218 HydrophobicContact CZ-CB 3.91Å; F204-I221 HydrophobicContact CB-CD1 4.47Å; F204-I221 HydrophobicContact CD1-CD1 3.74Å; F204-I221 HydrophobicContact CD1-CG2 4.24Å; F204-I221 HydrophobicContact CD2-CD1 3.43Å; F204-I221 VanDerWaalsContact CD2-CD1 3.43Å; F204-I221 HydrophobicContact CE1-CB 4.48Å; F204-I221 HydrophobicContact CE1-CD1 3.76Å; F204-I221 HydrophobicContact CE2-CD1 3.47Å; F204-I221 VanDerWaalsContact CE2-CD1 3.47Å; F204-I221 HydrophobicContact CG-CD1 3.58Å; F204-I221 HydrophobicContact CZ-CD1 3.64Å
205V98.8Very high97.7Very high6 Ų631 Ų314%0.03616%0.158CC..Hα-helixtrans-64.3-38.3173.1173.40000110.8S201 F202 L208 C209 V248 T251 F252S201-V205 VanDerWaalsContact O-CG2 3.29Å; S201-V205 WeakPolarHBondContact O-CG2 3.39Å; S201-V205 PolarHBondContact O-N 3.36Å; F202-V205 PolarHBondContact O-N 3.01Å; V205-L208 PolarHBondContact O-N 3.29Å; V205-C209 WeakPolarHBondContact O-CB 3.29Å; V205-C209 PolarHBondContact O-N 3.32Å; V205-C209 PolarHBondContact O-SG 3.43Å; V205-V248 HydrophobicContact CG2-CB 4.3Å; V205-V248 HydrophobicContact CG2-CG1 3.96Å; V205-V248 HydrophobicContact CG2-CG2 4.09Å; V205-T251 HydrophobicContact CB-CG2 4.02Å; V205-T251 HydrophobicContact CG1-CG2 3.63Å; V205-F252 HydrophobicContact CG1-CD1 4.13Å; V205-F252 HydrophobicContact CG1-CD2 3.76Å; V205-F252 HydrophobicContact CG1-CE1 4.15Å; V205-F252 HydrophobicContact CG1-CE2 3.78Å; V205-F252 HydrophobicContact CG1-CG 3.94Å; V205-F252 HydrophobicContact CG1-CZ 3.98Å; V205-F252 HydrophobicContact CG2-CD2 4.38Å; V205-F252 HydrophobicContact CG2-CE2 4Å
206C98.8Very high97.8Very high11 Ų1126.3 Ų26.37%0.07413%0.132CC..Hα-helixtrans-62-44.8172.3-67.70000111.9L85 L184 F202 F203 F204 L208 C209 Y210L85-C206 HydrophobicContact CD2-CB 3.94Å; L85-C206 VanDerWaalsContact CD2-O 3.29Å; L85-C206 WeakPolarHBondContact CD2-O 3.44Å; L184-C206 HydrophobicContact CD1-CB 3.99Å; L184-C206 HydrophobicContact CD2-CB 4.17Å; F202-C206 PolarHBondContact O-N 3.22Å; F202-C206 PolarHBondContact O-SG 2.87Å; F202-C206 VanDerWaalsContact O-SG 3.37Å; F203-C206 WeakPolarHBondContact O-CB 3.4Å; F203-C206 PolarHBondContact O-N 2.94Å; F204-C206 VanDerWaalsContact C-N 3.3Å; F204-C206 PolarHBondContact O-N 3.08Å; C206-L208 VanDerWaalsContact C-N 3.32Å; C206-L208 PolarHBondContact O-N 2.85Å; C206-C209 CarbonylContact O-C 3.59Å; C206-C209 PolarHBondContact O-N 3.44Å; C206-Y210 PolarHBondContact O-N 3.43Å
207A98.7Very high97.9Very high0 Ų022.2 Ų22.20%011%0.111CC..Hα-helixtrans-56.4-48.2175.600000111S181 L184 F185 F203 F204 C209 Y210 K211 E214S181-A207 WeakPolarHBondContact O-CB 3.5Å; S181-A207 PolarHBondContact OG-O 3.5Å; L184-A207 HydrophobicContact CB-CB 3.7Å; F185-A207 HydrophobicContact CB-CB 4.32Å; F203-A207 PolarHBondContact O-N 2.83Å; F204-A207 WeakPolarHBondContact O-CB 3.46Å; F204-A207 PolarHBondContact O-N 3.35Å; A207-C209 PolarHBondContact O-N 3.37Å; A207-Y210 WeakPolarHBondContact O-CB 3.29Å; A207-Y210 PolarHBondContact O-N 3.05Å; A207-K211 PolarHBondContact O-N 3.48Å; A207-E214 HydrophobicContact CB-CG 4.02Å
208L98Very high97.9Very high26 Ų2623.3 Ų23.314%0.13612%0.119CC..Hα-helixtrans-63.9-37.5177.6178.759.6000113.5P83 F204 V205 C206 Y210 K211 E214 L215 F252P83-L208 WeakPolarHBondContact CG-O 3.37Å; F204-L208 WeakPolarHBondContact O-CB 3.46Å; F204-L208 PolarHBondContact O-N 3.42Å; V205-L208 PolarHBondContact O-N 3.29Å; C206-L208 VanDerWaalsContact C-N 3.32Å; C206-L208 PolarHBondContact O-N 2.85Å; L208-Y210 PolarHBondContact O-N 3.26Å; L208-K211 CarbonylContact O-C 3.52Å; L208-E214 HydrophobicContact CB-CB 4.28Å; L208-E214 HydrophobicContact CD1-CB 4.21Å; L208-L215 HydrophobicContact CD1-CB 4.47Å; L208-L215 HydrophobicContact CD1-CD2 3.83Å; L208-L215 HydrophobicContact CD1-CG 3.62Å; L208-L215 HydrophobicContact CD2-CD2 4.14Å; L208-F252 HydrophobicContact CD2-CZ 3.78Å; L208-F252 HydrophobicContact CG-CZ 4.48Å
209C98.4Very high97.9Very high2 Ų221.8 Ų21.81%0.01411%0.114CC..Hα-helixtrans-76.9-8.6174.2-67.50000113.5P83 L85 V205 C206 A207 F252 I255P83-C209 CarbonylContact C-O 3.24Å; P83-C209 WeakPolarHBondContact CB-O 3.11Å; P83-C209 WeakPolarHBondContact CG-O 3.46Å; L85-C209 HydrophobicContact CB-CB 4.13Å; L85-C209 WeakPolarHBondContact CB-O 3.26Å; L85-C209 PolarHBondContact N-O 2.88Å; V205-C209 WeakPolarHBondContact O-CB 3.29Å; V205-C209 PolarHBondContact O-N 3.32Å; V205-C209 PolarHBondContact O-SG 3.43Å; C206-C209 CarbonylContact O-C 3.59Å; C206-C209 PolarHBondContact O-N 3.44Å; A207-C209 PolarHBondContact O-N 3.37Å; C209-F252 WeakPolarHBondContact SG-CE1 3.45Å; C209-I255 HydrophobicContact CB-CD1 3.88Å; C209-I255 HydrophobicContact CB-CG2 3.93Å
210Y98.4Very high97.9Very high5 Ų518.8 Ų18.82%0.0210%0.096CC..Hα-helixtrans-89.1-51.7169.8-165-88.6000110.6P83 L85 T86 H89 Y177 V180 C206 A207 L208P83-Y210 WeakPolarHBondContact CD-O 3.4Å; L85-Y210 HydrophobicContact CB-CD2 4.37Å; L85-Y210 HydrophobicContact CD2-CD2 4.43Å; L85-Y210 HydrophobicContact CG-CD2 4.18Å; T86-Y210 PolarHBondContact OG1-O 3.24Å; H89-Y210 HydrophobicContact CB-CE2 3.8Å; H89-Y210 PolarHBondContact CE1-OH 3.14Å; H89-Y210 AromaticContact CG-CE2 3.94Å; H89-Y210 AromaticContact ND1-CE2 3.62Å; H89-Y210 AromaticContact ND1-CZ 3.66Å; H89-Y210 PolarHBondContact ND1-OH 3.25Å; Y177-Y210 WeakPolarHBondContact CB-OH 3.36Å; Y177-Y210 WeakPolarHBondContact O-CE1 3.36Å; V180-Y210 HydrophobicContact CB-CD1 4.08Å; V180-Y210 HydrophobicContact CB-CD2 4.29Å; V180-Y210 HydrophobicContact CB-CE1 3.63Å; V180-Y210 HydrophobicContact CB-CE2 3.87Å; V180-Y210 HydrophobicContact CB-CG 4.38Å; V180-Y210 HydrophobicContact CG1-CD1 3.92Å; V180-Y210 HydrophobicContact CG1-CD2 3.36Å; V180-Y210 HydrophobicContact CG1-CE1 3.8Å; V180-Y210 HydrophobicContact CG1-CE2 3.22Å; V180-Y210 HydrophobicContact CG1-CG 3.7Å; V180-Y210 VanDerWaalsContact CG1-CZ 3.45Å; V180-Y210 HydrophobicContact CG2-CE1 4.38Å; V180-Y210 HydrophobicContact CG2-CE2 4.32Å; C206-Y210 PolarHBondContact O-N 3.43Å; A207-Y210 WeakPolarHBondContact O-CB 3.29Å; A207-Y210 PolarHBondContact O-N 3.05Å; L208-Y210 PolarHBondContact O-N 3.26Å
211K96.8Very high97.9Very high21 Ų2119 Ų199%0.09110%0.098CC..  trans-134.3118177.1-159169.1-129-168.50110.7Y82 N178 A207 L208 M213 E214Y82-K211 VanDerWaalsContact CE2-CE 3.45Å; Y82-K211 VanDerWaalsContact OH-CE 3.23Å; Y82-K211 WeakPolarHBondContact OH-CE 3.37Å; Y82-K211 PolarHBondContact OH-NZ 3.2Å; N178-K211 PolarHBondContact OD1-NZ 3.41Å; A207-K211 PolarHBondContact O-N 3.48Å; L208-K211 CarbonylContact O-C 3.52Å; K211-M213 HydrophobicContact CG-CB 4.37Å; K211-M213 HydrophobicContact CG-CG 4.39Å; K211-M213 PolarHBondContact O-N 3.05Å; K211-E214 WeakPolarHBondContact O-CB 3.07Å; K211-E214 PolarHBondContact O-N 3.28Å
212Q95.1Very high97.9Very high13 Ų1324.7 Ų24.76%0.06112%0.122CC..G310 helixtrans-60-20.9-177.270.1-83.629.500113.5D81 P83 E214 L215 L273 F274D81-Q212 PolarHBondContact O-NE2 3.46Å; P83-Q212 HydrophobicContact CG-CB 4.26Å; Q212-E214 PolarHBondContact O-N 3.02Å; Q212-L215 WeakPolarHBondContact O-CB 3.31Å; Q212-L215 VanDerWaalsContact O-CG 3.24Å; Q212-L215 WeakPolarHBondContact O-CG 3.25Å; Q212-L215 PolarHBondContact O-N 3.34Å; Q212-L215 VanDerWaalsContact O-N 3.15Å; Q212-L273 HydrophobicContact CG-CB 4.49Å; Q212-L273 PolarHBondContact NE2-O 3.27Å; Q212-F274 HydrophobicContact CB-CE1 4.32Å; Q212-F274 HydrophobicContact CB-CZ 4.16Å; Q212-F274 HydrophobicContact CG-CE1 4.21Å; Q212-F274 HydrophobicContact CG-CZ 4.48Å
213M93.5Very high97.9Very high36 Ų3621.5 Ų21.518%0.17711%0.111CC..G310 helixtrans-67.3-16178.2-56-63.3-179.200112.9K211 L215 Y216 L360K211-M213 HydrophobicContact CG-CB 4.37Å; K211-M213 HydrophobicContact CG-CG 4.39Å; K211-M213 PolarHBondContact O-N 3.05Å; M213-L215 PolarHBondContact O-N 2.78Å; M213-Y216 WeakPolarHBondContact O-CB 3.34Å; M213-Y216 WeakPolarHBondContact O-CD1 3.16Å; M213-Y216 PolarHBondContact O-N 3.33Å; M213-Y216 HydrophobicContact SD-CE1 4.46Å; M213-L360 HydrophobicContact CB-CD1 3.52Å; M213-L360 WeakPolarHBondContact O-CD1 3.42Å
214E97.1Very high97.8Very high0 Ų019.9 Ų19.90%010%0.103CC..G310 helixtrans-60.2-11169.4-72.3-68.1166.900113.5S181 F204 A207 L208 K211 Q212 Y216 H217 L360S181-E214 WeakPolarHBondContact OG-CG 3.47Å; S181-E214 PolarHBondContact OG-OE1 2.9Å; F204-E214 HydrophobicContact CE2-CB 4.38Å; A207-E214 HydrophobicContact CB-CG 4.02Å; L208-E214 HydrophobicContact CB-CB 4.28Å; L208-E214 HydrophobicContact CD1-CB 4.21Å; K211-E214 WeakPolarHBondContact O-CB 3.07Å; K211-E214 PolarHBondContact O-N 3.28Å; Q212-E214 PolarHBondContact O-N 3.02Å; E214-Y216 PolarHBondContact O-N 3.43Å; E214-H217 PolarHBondContact O-N 3.01Å; E214-H217 IonicContact OE2-CE1 3.87Å; E214-H217 PolarHBondContact OE2-CE1 3.38Å; E214-H217 IonicContact OE2-CG 3.98Å; E214-H217 IonicContact OE2-ND1 3.16Å; E214-H217 PolarHBondContact OE2-ND1 3Å; E214-L360 HydrophobicContact CG-CD2 4.47Å
215L96.5Very high97.8Very high63 Ų6319.9 Ų19.933%0.3310%0.104SC..G310 helixtrans-51.8-22.9166.8-77.3173.5000113L208 Q212 M213 H217 A218 P219 F274L208-L215 HydrophobicContact CD1-CB 4.47Å; L208-L215 HydrophobicContact CD1-CD2 3.83Å; L208-L215 HydrophobicContact CD1-CG 3.62Å; L208-L215 HydrophobicContact CD2-CD2 4.14Å; Q212-L215 WeakPolarHBondContact O-CB 3.31Å; Q212-L215 VanDerWaalsContact O-CG 3.24Å; Q212-L215 WeakPolarHBondContact O-CG 3.25Å; Q212-L215 PolarHBondContact O-N 3.34Å; Q212-L215 VanDerWaalsContact O-N 3.15Å; M213-L215 PolarHBondContact O-N 2.78Å; L215-H217 PolarHBondContact O-N 3.38Å; L215-A218 HydrophobicContact CD2-CB 4.28Å; L215-A218 PolarHBondContact O-N 3.14Å; L215-A218 VanDerWaalsContact O-N 3.13Å; L215-P219 WeakPolarHBondContact O-CD 3.45Å; L215-F274 HydrophobicContact CD1-CE1 3.78Å; L215-F274 HydrophobicContact CD1-CZ 3.79Å
216Y97.6Very high97.8Very high10 Ų1022 Ų224%0.03912%0.115CC..G310 helixtrans-60-30.3177.3-76.530.1000112.1M213 E214 S342 S343 F346 F347 S350 L360M213-Y216 WeakPolarHBondContact O-CB 3.34Å; M213-Y216 WeakPolarHBondContact O-CD1 3.16Å; M213-Y216 PolarHBondContact O-N 3.33Å; M213-Y216 HydrophobicContact SD-CE1 4.46Å; E214-Y216 PolarHBondContact O-N 3.43Å; Y216-S342 PolarHBondContact O-OG 2.94Å; Y216-S343 PolarHBondContact O-N 3.43Å; Y216-F346 HydrophobicContact CD1-CB 3.62Å; Y216-F346 AromaticContact CD1-CD1 3.78Å; Y216-F346 HydrophobicContact CD1-CD1 3.78Å; Y216-F346 AromaticContact CD1-CG 3.74Å; Y216-F346 HydrophobicContact CD1-CG 3.74Å; Y216-F346 HydrophobicContact CD2-CB 3.52Å; Y216-F346 HydrophobicContact CD2-CG 4.44Å; Y216-F346 HydrophobicContact CE1-CB 3.86Å; Y216-F346 AromaticContact CE1-CD1 3.98Å; Y216-F346 HydrophobicContact CE1-CD1 3.98Å; Y216-F346 HydrophobicContact CE1-CG 4.2Å; Y216-F346 HydrophobicContact CE2-CB 3.76Å; Y216-F346 HydrophobicContact CG-CB 3.46Å; Y216-F346 VanDerWaalsContact CG-CB 3.46Å; Y216-F346 HydrophobicContact CG-CD1 4.41Å; Y216-F346 HydrophobicContact CG-CD2 4.45Å; Y216-F346 AromaticContact CG-CG 3.9Å; Y216-F346 HydrophobicContact CG-CG 3.9Å; Y216-F347 HydrophobicContact CE2-CB 4.3Å; Y216-S350 PolarHBondContact OH-OG 3.2Å; Y216-L360 HydrophobicContact CD2-CB 4.28Å; Y216-L360 HydrophobicContact CD2-CD1 3.82Å; Y216-L360 HydrophobicContact CE2-CD1 4.11Å; Y216-L360 HydrophobicContact CG-CD1 4.12Å
217H98.5Very high97.8Very high0 Ų021.5 Ų21.50%011%0.112CC..THydrogen-bonded Turntrans-92.8-19.5178.3-60.1130.4000113.3F185 F204 E214 L215 A220 I221 L339 L360 P364F185-H217 AromaticContact CD2-ND1 3.97Å; F185-H217 HydrophobicContact CE2-CB 4.06Å; F185-H217 AromaticContact CE2-CG 3.79Å; F185-H217 AromaticContact CE2-ND1 3.81Å; F204-H217 HydrophobicContact CE2-CB 3.81Å; F204-H217 HydrophobicContact CZ-CB 3.96Å; E214-H217 PolarHBondContact O-N 3.01Å; E214-H217 IonicContact OE2-CE1 3.87Å; E214-H217 PolarHBondContact OE2-CE1 3.38Å; E214-H217 IonicContact OE2-CG 3.98Å; E214-H217 IonicContact OE2-ND1 3.16Å; E214-H217 PolarHBondContact OE2-ND1 3Å; L215-H217 PolarHBondContact O-N 3.38Å; H217-A220 PolarHBondContact O-N 3.43Å; H217-I221 HydrophobicContact CB-CD1 4.26Å; H217-I221 PolarHBondContact O-N 3.44Å; H217-L339 HydrophobicContact CB-CD2 3.58Å; H217-L360 PolarHBondContact CE1-O 3.37Å; H217-L360 PolarHBondContact NE2-O 3.38Å; H217-P364 WeakPolarHBondContact NE2-CG 3.28Å
218A98.4Very high97.7Very high22 Ų2222.8 Ų22.818%0.18212%0.117CC..Hα-helixtrans-61.5-43.2-169.200000113.9F204 L215 A220 I221 F222F204-A218 HydrophobicContact CE1-CB 3.87Å; F204-A218 HydrophobicContact CZ-CB 3.91Å; L215-A218 HydrophobicContact CD2-CB 4.28Å; L215-A218 PolarHBondContact O-N 3.14Å; L215-A218 VanDerWaalsContact O-N 3.13Å; A218-A220 PolarHBondContact O-N 3.49Å; A218-I221 PolarHBondContact O-N 3.42Å; A218-F222 VanDerWaalsContact O-CB 3.29Å; A218-F222 WeakPolarHBondContact O-CB 3.27Å; A218-F222 PolarHBondContact O-N 3.39Å
219P98.4Very high97.7Very high31 Ų3121.9 Ų21.920%0.20111%0.113CC..Hα-helixtrans-60.7-42.1178.3-29.639.8000113.5L215 F222 C223 I319 F346L215-P219 WeakPolarHBondContact O-CD 3.45Å; P219-F222 PolarHBondContact O-N 2.95Å; P219-C223 WeakPolarHBondContact O-CB 3.26Å; P219-C223 PolarHBondContact O-N 3.43Å; P219-C223 PolarHBondContact O-SG 2.95Å; P219-I319 HydrophobicContact CB-CD1 3.91Å; P219-I319 HydrophobicContact CG-CD1 3.93Å; P219-F346 HydrophobicContact CG-CE2 3.89Å; P219-F346 HydrophobicContact CG-CZ 4.16Å
220A98.4Very high97.7Very high0 Ų025.8 Ų25.80%014%0.139CC..Hα-helixtrans-64.2-45.4178.100000111.8H217 A218 C223 Y224 L339H217-A220 PolarHBondContact O-N 3.43Å; A218-A220 PolarHBondContact O-N 3.49Å; A220-C223 PolarHBondContact O-N 3.03Å; A220-Y224 VanDerWaalsContact O-CB 3.31Å; A220-Y224 WeakPolarHBondContact O-CB 3.49Å; A220-Y224 PolarHBondContact O-N 3.25Å; A220-L339 HydrophobicContact CB-CD2 4.14Å; A220-L339 HydrophobicContact CB-CG 4.26Å
221I98.7Very high97.6Very high6 Ų631.9 Ų31.93%0.03117%0.166CC..Hα-helixtrans-64.4-44.1177.6-69.5170.2000111F185 F192 F204 H217 A218 Y224 L225 L335 L339F185-I221 HydrophobicContact CE2-CD1 4.29Å; F192-I221 HydrophobicContact CE2-CD1 4.24Å; F192-I221 HydrophobicContact CE2-CG1 4.24Å; F192-I221 HydrophobicContact CE2-CG2 4.2Å; F192-I221 HydrophobicContact CZ-CG2 3.75Å; F204-I221 HydrophobicContact CB-CD1 4.47Å; F204-I221 HydrophobicContact CD1-CD1 3.74Å; F204-I221 HydrophobicContact CD1-CG2 4.24Å; F204-I221 HydrophobicContact CD2-CD1 3.43Å; F204-I221 VanDerWaalsContact CD2-CD1 3.43Å; F204-I221 HydrophobicContact CE1-CB 4.48Å; F204-I221 HydrophobicContact CE1-CD1 3.76Å; F204-I221 HydrophobicContact CE2-CD1 3.47Å; F204-I221 VanDerWaalsContact CE2-CD1 3.47Å; F204-I221 HydrophobicContact CG-CD1 3.58Å; F204-I221 HydrophobicContact CZ-CD1 3.64Å; H217-I221 HydrophobicContact CB-CD1 4.26Å; H217-I221 PolarHBondContact O-N 3.44Å; A218-I221 PolarHBondContact O-N 3.42Å; I221-Y224 PolarHBondContact O-N 3.22Å; I221-L225 HydrophobicContact CG2-CD1 3.89Å; I221-L225 HydrophobicContact CG2-CG 4.4Å; I221-L225 WeakPolarHBondContact O-CB 3.5Å; I221-L225 WeakPolarHBondContact O-CG 3.44Å; I221-L225 PolarHBondContact O-N 3.48Å; I221-L335 HydrophobicContact CG1-CD1 4.14Å; I221-L339 HydrophobicContact CD1-CD2 4.13Å; I221-L339 HydrophobicContact CG1-CD2 3.9Å
222F98.6Very high97.6Very high122 Ų12234.3 Ų34.354%0.53518%0.18SC..Hα-helixtrans-58.6-51.2176.8173.3-96.2000111.2A218 P219 Y224 L225 L226A218-F222 VanDerWaalsContact O-CB 3.29Å; A218-F222 WeakPolarHBondContact O-CB 3.27Å; A218-F222 PolarHBondContact O-N 3.39Å; P219-F222 PolarHBondContact O-N 2.95Å; F222-Y224 VanDerWaalsContact C-N 3.34Å; F222-Y224 PolarHBondContact O-N 2.92Å; F222-L225 PolarHBondContact O-N 2.84Å; F222-L226 HydrophobicContact CE1-CD2 3.86Å; F222-L226 HydrophobicContact CZ-CD2 3.9Å; F222-L226 VanDerWaalsContact O-CB 3.23Å; F222-L226 WeakPolarHBondContact O-CB 3.36Å; F222-L226 PolarHBondContact O-N 3.35Å
223C98.6Very high97.6Very high23 Ų2341.4 Ų41.416%0.15521%0.21CC..Hα-helixtrans-62.6-39.2179-77.40000112.4P219 A220 G227 C323 V326 F327P219-C223 WeakPolarHBondContact O-CB 3.26Å; P219-C223 PolarHBondContact O-N 3.43Å; P219-C223 PolarHBondContact O-SG 2.95Å; A220-C223 PolarHBondContact O-N 3.03Å; C223-G227 PolarHBondContact O-N 3.46Å; C223-C323 HydrophobicContact CB-CB 4.33Å; C223-C323 WeakPolarHBondContact CB-O 3.35Å; C223-V326 HydrophobicContact CB-CG1 3.85Å; C223-F327 HydrophobicContact CB-CB 4.07Å; C223-F327 WeakPolarHBondContact O-CA 3.23Å
224Y98.6Very high97.7Very high4 Ų443.9 Ų43.92%0.01624%0.237CC..Hα-helixtrans-60.7-53174.6171.1-105.7000112.1F192 A220 I221 F222 G227 K228 V326 P330 L335F192-Y224 HydrophobicContact CD1-CD1 4.44Å; F192-Y224 AromaticContact CD1-CE1 3.83Å; F192-Y224 HydrophobicContact CD1-CE1 3.83Å; F192-Y224 HydrophobicContact CE1-CD1 4.48Å; F192-Y224 HydrophobicContact CE1-CE1 4.27Å; F192-Y224 HydrophobicContact CG-CE1 4.34Å; A220-Y224 VanDerWaalsContact O-CB 3.31Å; A220-Y224 WeakPolarHBondContact O-CB 3.49Å; A220-Y224 PolarHBondContact O-N 3.25Å; I221-Y224 PolarHBondContact O-N 3.22Å; F222-Y224 VanDerWaalsContact C-N 3.34Å; F222-Y224 PolarHBondContact O-N 2.92Å; Y224-G227 PolarHBondContact O-N 2.94Å; Y224-K228 HydrophobicContact CD1-CD 4.48Å; Y224-K228 HydrophobicContact CE1-CD 3.8Å; Y224-K228 HydrophobicContact CE2-CD 4.24Å; Y224-K228 HydrophobicContact CE2-CG 4.5Å; Y224-K228 PolarHBondContact O-N 3.45Å; Y224-K228 PolarHBondContact OH-NZ 2.81Å; Y224-V326 HydrophobicContact CD2-CG2 3.82Å; Y224-V326 HydrophobicContact CG-CG2 4.29Å; Y224-P330 HydrophobicContact CD2-CB 3.78Å; Y224-P330 HydrophobicContact CE2-CB 4Å; Y224-L335 HydrophobicContact CD1-CD1 4.24Å; Y224-L335 HydrophobicContact CD1-CD2 3.86Å; Y224-L335 HydrophobicContact CD1-CG 4.48Å; Y224-L335 HydrophobicContact CD2-CB 3.88Å; Y224-L335 HydrophobicContact CD2-CD2 4.45Å; Y224-L335 HydrophobicContact CE1-CD2 3.91Å; Y224-L335 HydrophobicContact CE2-CB 4.17Å; Y224-L335 HydrophobicContact CE2-CD2 4.48Å; Y224-L335 HydrophobicContact CG-CB 4.15Å; Y224-L335 HydrophobicContact CG-CD1 3.96Å; Y224-L335 HydrophobicContact CG-CD2 4.15Å; Y224-L335 HydrophobicContact CG-CG 4.3Å
225L98.6Very high97.7Very high17 Ų1754.5 Ų54.59%0.08928%0.277CS..Hα-helixtrans-65.3-43-178.9-75.4176.8000112.4F192 D197 S201 I221 F222 G227 K228 C229 L244F192-L225 HydrophobicContact CE1-CD1 4.32Å; F192-L225 HydrophobicContact CE1-CD2 3.87Å; F192-L225 HydrophobicContact CE1-CG 4.24Å; F192-L225 HydrophobicContact CZ-CD1 4.41Å; D197-L225 HydrophobicContact CB-CD2 3.79Å; S201-L225 WeakPolarHBondContact OG-CD1 3.21Å; I221-L225 HydrophobicContact CG2-CD1 3.89Å; I221-L225 HydrophobicContact CG2-CG 4.4Å; I221-L225 WeakPolarHBondContact O-CB 3.5Å; I221-L225 WeakPolarHBondContact O-CG 3.44Å; I221-L225 PolarHBondContact O-N 3.48Å; F222-L225 PolarHBondContact O-N 2.84Å; L225-G227 VanDerWaalsContact C-N 3.31Å; L225-G227 PolarHBondContact O-N 3.41Å; L225-K228 PolarHBondContact O-N 2.86Å; L225-C229 PolarHBondContact O-N 3.14Å; L225-C229 PolarHBondContact O-SG 2.81Å; L225-L244 HydrophobicContact CB-CD1 4.25Å; L225-L244 HydrophobicContact CD1-CD2 4.38Å; L225-L244 HydrophobicContact CD2-CD1 4.11Å; L225-L244 HydrophobicContact CD2-CD2 4.27Å
226L98.3Very high97.8Very high49 Ų4956.8 Ų56.826%0.25729%0.286SS..Hα-helixtrans-63.2-41.5175.4-172.966.1000110.7F222 K228 C229 C230 F241 F327F222-L226 HydrophobicContact CE1-CD2 3.86Å; F222-L226 HydrophobicContact CZ-CD2 3.9Å; F222-L226 VanDerWaalsContact O-CB 3.23Å; F222-L226 WeakPolarHBondContact O-CB 3.36Å; F222-L226 PolarHBondContact O-N 3.35Å; L226-K228 PolarHBondContact O-N 3.17Å; L226-C229 WeakPolarHBondContact O-CB 3.26Å; L226-C229 PolarHBondContact O-N 3.17Å; L226-C229 VanDerWaalsContact O-N 3.12Å; L226-C230 PolarHBondContact O-N 3.16Å; L226-C230 PolarHBondContact O-SG 2.71Å; L226-C230 VanDerWaalsContact O-SG 3.36Å; L226-F241 HydrophobicContact CD1-CD2 4.05Å; L226-F241 HydrophobicContact CD1-CE2 4.04Å; L226-F327 HydrophobicContact CB-CD2 4.37Å; L226-F327 HydrophobicContact CB-CE2 4.42Å; L226-F327 HydrophobicContact CD2-CD2 4.32Å; L226-F327 HydrophobicContact CD2-CE2 3.97Å; L226-F327 HydrophobicContact CG-CD2 4.32Å; L226-F327 HydrophobicContact CG-CE2 3.91Å
227G98.1Very high97.8Very high1 Ų156.5 Ų56.51%0.0129%0.286CS..Hα-helixtrans-56.4-46.5173.300000112.3C223 Y224 L225 C229 C230 K231 F327C223-G227 PolarHBondContact O-N 3.46Å; Y224-G227 PolarHBondContact O-N 2.94Å; L225-G227 VanDerWaalsContact C-N 3.31Å; L225-G227 PolarHBondContact O-N 3.41Å; G227-C229 VanDerWaalsContact C-N 3.31Å; G227-C229 PolarHBondContact O-N 3.43Å; G227-C230 PolarHBondContact O-N 2.88Å; G227-K231 VanDerWaalsContact O-CG 3.32Å; G227-K231 WeakPolarHBondContact O-CG 3.31Å; G227-K231 PolarHBondContact O-N 3.47Å; G227-F327 VanDerWaalsContact CA-O 3.25Å; G227-F327 WeakPolarHBondContact CA-O 3.43Å
228K97.9Very high97.8Very high27 Ų2761.8 Ų61.812%0.11731%0.314CS..Hα-helixtrans-59-42.4174.6-68.9-176.894.5166.40111.4D195 D197 Y224 L225 L226 K231 L232 P330D195-K228 IonicContact OD1-NZ 3.84Å; D195-K228 PolarHBondContact OD1-NZ 3Å; D197-K228 VanDerWaalsContact CG-NZ 3.27Å; D197-K228 IonicContact OD1-NZ 2.86Å; D197-K228 PolarHBondContact OD1-NZ 2.86Å; D197-K228 WeakPolarHBondContact OD2-CD 3.23Å; D197-K228 VanDerWaalsContact OD2-CE 3.26Å; D197-K228 WeakPolarHBondContact OD2-CE 3.48Å; D197-K228 IonicContact OD2-NZ 3.77Å; D197-K228 PolarHBondContact OD2-NZ 2.69Å; Y224-K228 HydrophobicContact CD1-CD 4.48Å; Y224-K228 HydrophobicContact CE1-CD 3.8Å; Y224-K228 HydrophobicContact CE2-CD 4.24Å; Y224-K228 HydrophobicContact CE2-CG 4.5Å; Y224-K228 PolarHBondContact O-N 3.45Å; Y224-K228 PolarHBondContact OH-NZ 2.81Å; L225-K228 PolarHBondContact O-N 2.86Å; L226-K228 PolarHBondContact O-N 3.17Å; K228-K231 PolarHBondContact O-N 3.45Å; K228-L232 WeakPolarHBondContact O-CG 3.04Å; K228-P330 HydrophobicContact CG-CB 3.76Å; K228-P330 HydrophobicContact CG-CG 4.03Å
229C98.1Very high97.8Very high8 Ų869.5 Ų69.55%0.05434%0.338CS..Hα-helixtrans-63-44.7177.5-620000111.7L225 L226 G227 K231 L232 G237 F241L225-C229 PolarHBondContact O-N 3.14Å; L225-C229 PolarHBondContact O-SG 2.81Å; L226-C229 WeakPolarHBondContact O-CB 3.26Å; L226-C229 PolarHBondContact O-N 3.17Å; L226-C229 VanDerWaalsContact O-N 3.12Å; G227-C229 VanDerWaalsContact C-N 3.31Å; G227-C229 PolarHBondContact O-N 3.43Å; C229-K231 VanDerWaalsContact C-N 3.32Å; C229-K231 PolarHBondContact O-N 2.86Å; C229-L232 PolarHBondContact O-N 3.46Å; C229-G237 WeakPolarHBondContact O-CA 3.2Å; C229-F241 HydrophobicContact CB-CB 4.38Å
230C97.2Very high97.7Very high83 Ų8369.8 Ų69.856%0.56134%0.336SS*.Hα-helixtrans-70.2-23.4-179.5-67.80000114.1L226 G227 F327L226-C230 PolarHBondContact O-N 3.16Å; L226-C230 PolarHBondContact O-SG 2.71Å; L226-C230 VanDerWaalsContact O-SG 3.36Å; G227-C230 PolarHBondContact O-N 2.88Å; C230-F327 HydrophobicContact CB-CE2 4.41Å; C230-F327 HydrophobicContact CB-CZ 4.49Å
231K96.1Very high97.7Very high133 Ų13374 Ų7458%0.57836%0.355SS*.Hα-helixtrans-76.7-21.9175.4-74-76.7-177.4170.20113.3G227 K228 C229 R328 P330G227-K231 VanDerWaalsContact O-CG 3.32Å; G227-K231 WeakPolarHBondContact O-CG 3.31Å; G227-K231 PolarHBondContact O-N 3.47Å; K228-K231 PolarHBondContact O-N 3.45Å; C229-K231 VanDerWaalsContact C-N 3.32Å; C229-K231 PolarHBondContact O-N 2.86Å; K231-R328 WeakPolarHBondContact CE-O 3.3Å; K231-R328 PolarHBondContact NZ-O 3.13Å; K231-P330 HydrophobicContact CG-CG 4.11Å
232L96.5Very high97.7Very high72 Ų7277 Ų7738%0.37737%0.374SS..SBendtrans-78163.3176.1-66172.6000111.3K228 C229 Q236 K240K228-L232 WeakPolarHBondContact O-CG 3.04Å; C229-L232 PolarHBondContact O-N 3.46Å; L232-Q236 HydrophobicContact CB-CB 4.16Å; L232-K240 HydrophobicContact CD1-CB 4.31Å; L232-K240 HydrophobicContact CD1-CD 3.7Å
233K96.4Very high97.7Very high162 Ų16272.7 Ų72.770%0.70436%0.358SS*.  trans-58.9143.8169.6-65.1-177.4-179.2-1800109.6R235 Q236 G237K233-R235 VanDerWaalsContact C-N 3.33Å; K233-R235 PolarHBondContact O-N 3.22Å; K233-Q236 WeakPolarHBondContact O-CA 3.46Å; K233-Q236 WeakPolarHBondContact O-CB 3.33Å; K233-Q236 PolarHBondContact O-N 2.92Å; K233-G237 PolarHBondContact O-N 3.31Å
234A95.9Very high97.7Very high89 Ų8972.1 Ų72.174%0.73635%0.354SS*.Hα-helixtrans-43.1-50.1-171.200000114.9G237 L238A234-G237 PolarHBondContact O-N 3.24Å; A234-L238 VanDerWaalsContact O-CB 3.3Å; A234-L238 WeakPolarHBondContact O-CB 3.43Å; A234-L238 PolarHBondContact O-N 2.99Å
235R97.2Very high97.7Very high223 Ų22373.8 Ų73.884%0.84237%0.366SS*.Hα-helixtrans-64.3-41.4178.8-175177.8177.4-177.4-0.1113.3K233 W239K233-R235 VanDerWaalsContact C-N 3.33Å; K233-R235 PolarHBondContact O-N 3.22Å; R235-W239 WeakPolarHBondContact O-CB 3.18Å; R235-W239 PolarHBondContact O-N 3.35Å
236Q97.5Very high97.7Very high110 Ų11078.6 Ų78.651%0.51439%0.391SS..Hα-helixtrans-71.4-40.9178.9-69.2174.9-20.400111.1L232 K233 W239 K240L232-Q236 HydrophobicContact CB-CB 4.16Å; K233-Q236 WeakPolarHBondContact O-CA 3.46Å; K233-Q236 WeakPolarHBondContact O-CB 3.33Å; K233-Q236 PolarHBondContact O-N 2.92Å; Q236-W239 PolarHBondContact O-N 3.01Å; Q236-K240 WeakPolarHBondContact O-CB 3.48Å; Q236-K240 PolarHBondContact O-N 2.68Å
237G97.7Very high97.7Very high5 Ų577.8 Ų77.85%0.05239%0.388CS..Hα-helixtrans-61.1-47174.500000111.9C229 K233 A234 K240 F241C229-G237 WeakPolarHBondContact O-CA 3.2Å; K233-G237 PolarHBondContact O-N 3.31Å; A234-G237 PolarHBondContact O-N 3.24Å; G237-K240 PolarHBondContact O-N 2.76Å; G237-F241 WeakPolarHBondContact O-CB 3.46Å; G237-F241 PolarHBondContact O-N 2.76Å
238L97.9Very high97.7Very high111 Ų11179.8 Ų79.858%0.58140%0.4SS*.Hα-helixtrans-61.4-45.5175.9-178.162000111.6A234 K240 F241 T242A234-L238 VanDerWaalsContact O-CB 3.3Å; A234-L238 WeakPolarHBondContact O-CB 3.43Å; A234-L238 PolarHBondContact O-N 2.99Å; L238-K240 PolarHBondContact O-N 3.48Å; L238-F241 PolarHBondContact O-N 2.98Å; L238-T242 PolarHBondContact O-N 3.44Å; L238-T242 PolarHBondContact O-OG1 2.92Å
239W98.2Very high97.8Very high183 Ų18383.9 Ų83.969%0.69342%0.422SS*.Hα-helixtrans-58.7-48.8176.3178.3-105.3000112R235 Q236 F241 T242 C243R235-W239 WeakPolarHBondContact O-CB 3.18Å; R235-W239 PolarHBondContact O-N 3.35Å; Q236-W239 PolarHBondContact O-N 3.01Å; W239-F241 VanDerWaalsContact C-N 3.34Å; W239-F241 PolarHBondContact O-N 3.47Å; W239-T242 PolarHBondContact O-N 2.9Å; W239-C243 VanDerWaalsContact CE2-SG 3.57Å; W239-C243 PolarHBondContact O-N 3.41Å; W239-C243 PolarHBondContact O-SG 3.11Å; W239-C243 VanDerWaalsContact O-SG 3.35Å
240K98.1Very high97.8Very high37 Ų3785.7 Ų85.716%0.16144%0.435CS..Hα-helixtrans-60.1-44.6177.8-170.8179.8-179.794.10111.3D197 M198 L232 Q236 G237 L238 C243 L244D197-K240 WeakPolarHBondContact OD2-CE 3.3Å; D197-K240 IonicContact OD2-NZ 2.74Å; D197-K240 PolarHBondContact OD2-NZ 3.43Å; M198-K240 HydrophobicContact CE-CG 3.96Å; L232-K240 HydrophobicContact CD1-CB 4.31Å; L232-K240 HydrophobicContact CD1-CD 3.7Å; Q236-K240 WeakPolarHBondContact O-CB 3.48Å; Q236-K240 PolarHBondContact O-N 2.68Å; G237-K240 PolarHBondContact O-N 2.76Å; L238-K240 PolarHBondContact O-N 3.48Å; K240-C243 PolarHBondContact O-N 3.37Å; K240-L244 HydrophobicContact CG-CD1 4.15Å; K240-L244 VanDerWaalsContact O-CG 3.31Å; K240-L244 WeakPolarHBondContact O-CG 3.21Å; K240-L244 PolarHBondContact O-N 2.97Å
241F98.3Very high97.9Very high90 Ų9082.1 Ų82.140%0.39541%0.411SS..Hα-helixtrans-58.3-49.3175.6178.6-93.9000111.3L226 C229 G237 L238 W239 C243 L244 S245L226-F241 HydrophobicContact CD1-CD2 4.05Å; L226-F241 HydrophobicContact CD1-CE2 4.04Å; C229-F241 HydrophobicContact CB-CB 4.38Å; G237-F241 WeakPolarHBondContact O-CB 3.46Å; G237-F241 PolarHBondContact O-N 2.76Å; L238-F241 PolarHBondContact O-N 2.98Å; W239-F241 VanDerWaalsContact C-N 3.34Å; W239-F241 PolarHBondContact O-N 3.47Å; F241-C243 PolarHBondContact O-N 2.73Å; F241-L244 PolarHBondContact O-N 2.83Å; F241-S245 PolarHBondContact O-N 2.78Å; F241-S245 PolarHBondContact O-OG 2.89Å; F241-S245 VanDerWaalsContact O-OG 3.05Å
242T98.4Very high98Very high69 Ų6978.9 Ų78.942%0.42340%0.397SS..Hα-helixtrans-59.9-43.8178-58.50000112.1L238 W239 S245 L246L238-T242 PolarHBondContact O-N 3.44Å; L238-T242 PolarHBondContact O-OG1 2.92Å; W239-T242 PolarHBondContact O-N 2.9Å; T242-S245 PolarHBondContact O-N 3.1Å; T242-L246 WeakPolarHBondContact O-CB 3.44Å; T242-L246 PolarHBondContact O-N 3.21Å
243C98.5Very high98Very high31 Ų3178.5 Ų78.521%0.20940%0.4CS..Hα-helixtrans-62-44.5176-68.60000112.1M198 W239 K240 F241 L246 V247M198-C243 HydrophobicContact CE-CB 3.79Å; W239-C243 VanDerWaalsContact CE2-SG 3.57Å; W239-C243 PolarHBondContact O-N 3.41Å; W239-C243 PolarHBondContact O-SG 3.11Å; W239-C243 VanDerWaalsContact O-SG 3.35Å; K240-C243 PolarHBondContact O-N 3.37Å; F241-C243 PolarHBondContact O-N 2.73Å; C243-L246 PolarHBondContact O-N 3.38Å; C243-V247 WeakPolarHBondContact O-CG2 3.43Å; C243-V247 PolarHBondContact O-N 3.42Å
244L98.5Very high98.1Very high11 Ų1177 Ų776%0.05840%0.398CS..Hα-helixtrans-61.7-47.3176.6-71.8167.8000111.2D197 M198 S201 L225 K240 F241 L246 V247 V248D197-L244 HydrophobicContact CB-CD2 4.1Å; M198-L244 HydrophobicContact CE-CG 4.43Å; M198-L244 HydrophobicContact CG-CD2 4.22Å; M198-L244 HydrophobicContact SD-CD2 4.3Å; S201-L244 WeakPolarHBondContact OG-CD2 3.23Å; L225-L244 HydrophobicContact CB-CD1 4.25Å; L225-L244 HydrophobicContact CD1-CD2 4.38Å; L225-L244 HydrophobicContact CD2-CD1 4.11Å; L225-L244 HydrophobicContact CD2-CD2 4.27Å; K240-L244 HydrophobicContact CG-CD1 4.15Å; K240-L244 VanDerWaalsContact O-CG 3.31Å; K240-L244 WeakPolarHBondContact O-CG 3.21Å; K240-L244 PolarHBondContact O-N 2.97Å; F241-L244 PolarHBondContact O-N 2.83Å; L244-L246 VanDerWaalsContact C-N 3.3Å; L244-L246 PolarHBondContact O-N 2.92Å; L244-V247 PolarHBondContact O-N 2.87Å; L244-V248 WeakPolarHBondContact O-CG2 3.38Å; L244-V248 PolarHBondContact O-N 3.09Å
245S98.3Very high98.2Very high39 Ų3973.5 Ų73.527%0.27337%0.367SS..Hα-helixtrans-58.8-41.6176.2-59.10000112F241 T242 V248 L249F241-S245 PolarHBondContact O-N 2.78Å; F241-S245 PolarHBondContact O-OG 2.89Å; F241-S245 VanDerWaalsContact O-OG 3.05Å; T242-S245 PolarHBondContact O-N 3.1Å; S245-V248 PolarHBondContact O-N 2.93Å; S245-L249 VanDerWaalsContact O-CB 3.3Å; S245-L249 WeakPolarHBondContact O-CB 3.28Å; S245-L249 VanDerWaalsContact O-CG 3.23Å; S245-L249 WeakPolarHBondContact O-CG 3.5Å; S245-L249 PolarHBondContact O-N 3.27Å
246L98.6Very high98.2Very high117 Ų11764.2 Ų64.261%0.61333%0.332SS*.Hα-helixtrans-64.3-44178.4-175.3140.1000111.6T242 C243 L244 S250T242-L246 WeakPolarHBondContact O-CB 3.44Å; T242-L246 PolarHBondContact O-N 3.21Å; C243-L246 PolarHBondContact O-N 3.38Å; L244-L246 VanDerWaalsContact C-N 3.3Å; L244-L246 PolarHBondContact O-N 2.92Å; L246-S250 WeakPolarHBondContact O-CB 3.38Å; L246-S250 PolarHBondContact O-N 3.37Å; L246-S250 PolarHBondContact O-OG 2.98Å
247V98.7Very high98.2Very high32 Ų3265.8 Ų65.819%0.19433%0.333CS..Hα-helixtrans-62.7-47.1176.11730000111M198 F202 C243 L244 S250 T251M198-V247 HydrophobicContact CB-CG2 4.28Å; M198-V247 HydrophobicContact CG-CG2 4.49Å; F202-V247 HydrophobicContact CB-CG1 4.06Å; C243-V247 WeakPolarHBondContact O-CG2 3.43Å; C243-V247 PolarHBondContact O-N 3.42Å; L244-V247 PolarHBondContact O-N 2.87Å; V247-S250 PolarHBondContact O-OG 3.13Å; V247-S250 VanDerWaalsContact O-OG 3.12Å; V247-T251 VanDerWaalsContact O-CB 3.31Å; V247-T251 WeakPolarHBondContact O-CB 3.34Å; V247-T251 PolarHBondContact O-N 3.33Å; V247-T251 PolarHBondContact O-OG1 3.49Å
248V98.6Very high98.1Very high44 Ų4467 Ų6727%0.26734%0.34SS..Hα-helixtrans-61.9-52.2-179.6170.50000111.1V205 L244 S245 T251 F252V205-V248 HydrophobicContact CG2-CB 4.3Å; V205-V248 HydrophobicContact CG2-CG1 3.96Å; V205-V248 HydrophobicContact CG2-CG2 4.09Å; L244-V248 WeakPolarHBondContact O-CG2 3.38Å; L244-V248 PolarHBondContact O-N 3.09Å; S245-V248 PolarHBondContact O-N 2.93Å; V248-T251 PolarHBondContact O-N 2.95Å; V248-F252 HydrophobicContact CG1-CD2 3.85Å; V248-F252 HydrophobicContact CG1-CE2 3.88Å; V248-F252 VanDerWaalsContact O-CD2 3.3Å; V248-F252 WeakPolarHBondContact O-CD2 3.26Å; V248-F252 PolarHBondContact O-N 3.41Å
249L98.4Very high98Very high112 Ų11261.7 Ų61.759%0.58631%0.312SS*.Hα-helixtrans-65.4-44.1-177.8-68.3173.5000111.9S245 T251 F252 C253S245-L249 VanDerWaalsContact O-CB 3.3Å; S245-L249 WeakPolarHBondContact O-CB 3.28Å; S245-L249 VanDerWaalsContact O-CG 3.23Å; S245-L249 WeakPolarHBondContact O-CG 3.5Å; S245-L249 PolarHBondContact O-N 3.27Å; L249-T251 PolarHBondContact O-N 3.35Å; L249-F252 PolarHBondContact O-N 3.26Å; L249-C253 WeakPolarHBondContact O-CB 3.34Å; L249-C253 PolarHBondContact O-N 3.41Å; L249-C253 PolarHBondContact O-SG 3.01Å
250S98.4Very high97.8Very high46 Ų4656.4 Ų56.432%0.32230%0.297SS..Hα-helixtrans-63.4-41.6178.158.40000112L246 V247 F252 C253 I254L246-S250 WeakPolarHBondContact O-CB 3.38Å; L246-S250 PolarHBondContact O-N 3.37Å; L246-S250 PolarHBondContact O-OG 2.98Å; V247-S250 PolarHBondContact O-OG 3.13Å; V247-S250 VanDerWaalsContact O-OG 3.12Å; S250-F252 PolarHBondContact O-N 2.79Å; S250-C253 PolarHBondContact O-N 3.21Å; S250-I254 WeakPolarHBondContact O-CB 3.27Å; S250-I254 WeakPolarHBondContact O-CG1 3.42Å; S250-I254 PolarHBondContact O-N 3.39Å
251T98.6Very high97.5Very high8 Ų863 Ų635%0.04932%0.32CS..Hα-helixtrans-62.5-45.4177.4-52.80000111F202 V205 V247 V248 L249 I254 I255F202-T251 HydrophobicContact CD2-CG2 3.74Å; F202-T251 HydrophobicContact CE2-CG2 3.98Å; V205-T251 HydrophobicContact CB-CG2 4.02Å; V205-T251 HydrophobicContact CG1-CG2 3.63Å; V247-T251 VanDerWaalsContact O-CB 3.31Å; V247-T251 WeakPolarHBondContact O-CB 3.34Å; V247-T251 PolarHBondContact O-N 3.33Å; V247-T251 PolarHBondContact O-OG1 3.49Å; V248-T251 PolarHBondContact O-N 2.95Å; L249-T251 PolarHBondContact O-N 3.35Å; T251-I254 PolarHBondContact O-N 2.89Å; T251-I255 HydrophobicContact CG2-CD1 3.91Å; T251-I255 WeakPolarHBondContact O-CG1 3.47Å; T251-I255 PolarHBondContact O-N 3.36Å; T251-I255 VanDerWaalsContact O-N 3.08Å
252F98.2Very high97.2Very high65 Ų6564.4 Ų64.429%0.28533%0.328SS..Hα-helixtrans-59.4-50.4173.2-88.7-65.1000111.8V205 L208 C209 V248 L249 S250 I254 I255 W256V205-F252 HydrophobicContact CG1-CD1 4.13Å; V205-F252 HydrophobicContact CG1-CD2 3.76Å; V205-F252 HydrophobicContact CG1-CE1 4.15Å; V205-F252 HydrophobicContact CG1-CE2 3.78Å; V205-F252 HydrophobicContact CG1-CG 3.94Å; V205-F252 HydrophobicContact CG1-CZ 3.98Å; V205-F252 HydrophobicContact CG2-CD2 4.38Å; V205-F252 HydrophobicContact CG2-CE2 4Å; L208-F252 HydrophobicContact CD2-CZ 3.78Å; L208-F252 HydrophobicContact CG-CZ 4.48Å; C209-F252 WeakPolarHBondContact SG-CE1 3.45Å; V248-F252 HydrophobicContact CG1-CD2 3.85Å; V248-F252 HydrophobicContact CG1-CE2 3.88Å; V248-F252 VanDerWaalsContact O-CD2 3.3Å; V248-F252 WeakPolarHBondContact O-CD2 3.26Å; V248-F252 PolarHBondContact O-N 3.41Å; L249-F252 PolarHBondContact O-N 3.26Å; S250-F252 PolarHBondContact O-N 2.79Å; F252-I254 VanDerWaalsContact C-N 3.3Å; F252-I254 PolarHBondContact O-N 3.43Å; F252-I255 PolarHBondContact O-N 2.99Å; F252-W256 AromaticContact CD1-CD1 3.98Å; F252-W256 AromaticContact CD1-NE1 3.98Å; F252-W256 VanDerWaalsContact O-CB 3.26Å; F252-W256 WeakPolarHBondContact O-CB 3.31Å; F252-W256 PolarHBondContact O-N 3.09Å
253C97.8Very high97Very high65 Ų6568.4 Ų68.444%0.43934%0.342SS..Hα-helixtrans-59.2-40-179.3-72.60000112.2L249 S250 W257L249-C253 WeakPolarHBondContact O-CB 3.34Å; L249-C253 PolarHBondContact O-N 3.41Å; L249-C253 PolarHBondContact O-SG 3.01Å; S250-C253 PolarHBondContact O-N 3.21Å; C253-W257 VanDerWaalsContact O-CA 3.24Å; C253-W257 WeakPolarHBondContact O-CA 3.23Å; C253-W257 VanDerWaalsContact O-CB 3.24Å; C253-W257 WeakPolarHBondContact O-CB 3.2Å; C253-W257 PolarHBondContact O-N 3.29Å
254I98Very high96.8Very high129 Ų12975.5 Ų75.566%0.66237%0.37SS*.Hα-helixtrans-65.7-51178.3-70.3165.5000110.4S250 T251 F252 W257S250-I254 WeakPolarHBondContact O-CB 3.27Å; S250-I254 WeakPolarHBondContact O-CG1 3.42Å; S250-I254 PolarHBondContact O-N 3.39Å; T251-I254 PolarHBondContact O-N 2.89Å; F252-I254 VanDerWaalsContact C-N 3.3Å; F252-I254 PolarHBondContact O-N 3.43Å; I254-W257 WeakPolarHBondContact O-CB 3.3Å; I254-W257 PolarHBondContact O-N 3.08Å
255I98.3Very high96.6Very high16 Ų1675.6 Ų75.68%0.08237%0.37CS..Hα-helixtrans-66.2-43.3-176.9-66.5171.5000111P84 L85 Y88 C209 T251 F252 W257P84-I255 HydrophobicContact CB-CG2 4.02Å; L85-I255 HydrophobicContact CB-CG2 4.37Å; Y88-I255 HydrophobicContact CE2-CG2 4.22Å; Y88-I255 WeakPolarHBondContact CE2-O 3.45Å; Y88-I255 PolarHBondContact OH-O 3.28Å; C209-I255 HydrophobicContact CB-CD1 3.88Å; C209-I255 HydrophobicContact CB-CG2 3.93Å; T251-I255 HydrophobicContact CG2-CD1 3.91Å; T251-I255 WeakPolarHBondContact O-CG1 3.47Å; T251-I255 PolarHBondContact O-N 3.36Å; T251-I255 VanDerWaalsContact O-N 3.08Å; F252-I255 PolarHBondContact O-N 2.99Å; I255-W257 VanDerWaalsContact C-N 3.34Å
256W97.9Very high96.5Very high29 Ų2975.2 Ų75.211%0.1137%0.366CS..Hα-helixtrans-86.9-0.2-176.9-7670.9000113.9P83 P84 F252 P258 F259 I260 V269 L270 L273P83-W256 HydrophobicContact CB-CZ2 4.33Å; P84-W256 HydrophobicContact CG-CD2 3.97Å; P84-W256 HydrophobicContact CG-CE3 4.35Å; P84-W256 HydrophobicContact CG-CG 4.29Å; P84-W256 HydrophobicContact CG-CZ2 4.32Å; F252-W256 AromaticContact CD1-CD1 3.98Å; F252-W256 AromaticContact CD1-NE1 3.98Å; F252-W256 VanDerWaalsContact O-CB 3.26Å; F252-W256 WeakPolarHBondContact O-CB 3.31Å; F252-W256 PolarHBondContact O-N 3.09Å; W256-P258 VanDerWaalsContact C-CD 3.46Å; W256-P258 VanDerWaalsContact O-N 3.14Å; W256-F259 HydrophobicContact CE3-CB 4.24Å; W256-F259 WeakPolarHBondContact O-CA 3.34Å; W256-F259 PolarHBondContact O-N 2.82Å; W256-I260 HydrophobicContact CB-CG2 3.93Å; W256-I260 HydrophobicContact CE3-CG2 4.45Å; W256-I260 PolarHBondContact O-N 3.4Å; W256-I260 VanDerWaalsContact O-N 3.08Å; W256-V269 HydrophobicContact CH2-CB 4.42Å; W256-V269 HydrophobicContact CH2-CG1 3.55Å; W256-V269 HydrophobicContact CZ2-CG1 4.49Å; W256-V269 HydrophobicContact CZ3-CB 4.1Å; W256-V269 HydrophobicContact CZ3-CG1 3.62Å; W256-L270 HydrophobicContact CH2-CD2 4.04Å; W256-L270 HydrophobicContact CZ3-CD2 4.42Å; W256-L273 HydrophobicContact CH2-CD2 3.9Å; W256-L273 HydrophobicContact CZ2-CD2 4.01Å
257W96.6Very high96.3Very high143 Ų14373.8 Ų73.854%0.54236%0.357SS..THydrogen-bonded Turntrans-46.8-46.9-172.2177.8-113.7000114.5C253 I254 I255 F259 I260 R261C253-W257 VanDerWaalsContact O-CA 3.24Å; C253-W257 WeakPolarHBondContact O-CA 3.23Å; C253-W257 VanDerWaalsContact O-CB 3.24Å; C253-W257 WeakPolarHBondContact O-CB 3.2Å; C253-W257 PolarHBondContact O-N 3.29Å; I254-W257 WeakPolarHBondContact O-CB 3.3Å; I254-W257 PolarHBondContact O-N 3.08Å; I255-W257 VanDerWaalsContact C-N 3.34Å; W257-F259 VanDerWaalsContact C-N 3.29Å; W257-F259 PolarHBondContact O-N 3Å; W257-I260 HydrophobicContact CE3-CD1 4.35Å; W257-I260 WeakPolarHBondContact O-CG1 3.31Å; W257-R261 WeakPolarHBondContact O-CG 3.38Å
258P95.4Very high96.1Very high29 Ų2973.4 Ų73.419%0.18836%0.357CS..THydrogen-bonded Turntrans-67.6-31.2179.5-20.235.7000112.9I63 Y88 W256I63-P258 HydrophobicContact CG2-CB 3.67Å; I63-P258 HydrophobicContact CG2-CG 4.46Å; Y88-P258 VanDerWaalsContact OH-CD 3.26Å; Y88-P258 WeakPolarHBondContact OH-CD 3.46Å; Y88-P258 WeakPolarHBondContact OH-CG 3.39Å; W256-P258 VanDerWaalsContact C-CD 3.46Å; W256-P258 VanDerWaalsContact O-N 3.14Å
259F96.1Very high96Very high0 Ų071.3 Ų71.30%034%0.344CS..THydrogen-bonded Turntrans-88.6-18-171.2-57.3-78.4000114I63 W66 Y67 P84 Y88 W256 W257 L265 T266 V269I63-F259 HydrophobicContact CG2-CE1 3.8Å; I63-F259 HydrophobicContact CG2-CE2 4.28Å; I63-F259 HydrophobicContact CG2-CZ 3.62Å; W66-F259 AromaticContact CE3-CZ 3.98Å; W66-F259 HydrophobicContact CE3-CZ 3.98Å; W66-F259 HydrophobicContact CZ3-CZ 4.39Å; Y67-F259 HydrophobicContact CD2-CD1 4.18Å; Y67-F259 AromaticContact CD2-CE1 3.58Å; Y67-F259 HydrophobicContact CD2-CE1 3.58Å; Y67-F259 HydrophobicContact CD2-CZ 4.29Å; Y67-F259 HydrophobicContact CE2-CD1 4.23Å; Y67-F259 AromaticContact CE2-CE1 3.53Å; Y67-F259 HydrophobicContact CE2-CE1 3.53Å; Y67-F259 AromaticContact CE2-CZ 3.79Å; Y67-F259 HydrophobicContact CE2-CZ 3.79Å; P84-F259 HydrophobicContact CB-CD2 3.88Å; P84-F259 HydrophobicContact CB-CE2 3.6Å; P84-F259 HydrophobicContact CB-CZ 4.47Å; P84-F259 HydrophobicContact CG-CD2 3.59Å; P84-F259 HydrophobicContact CG-CE2 3.77Å; P84-F259 HydrophobicContact CG-CG 4.29Å; Y88-F259 HydrophobicContact CE1-CE2 4.36Å; Y88-F259 WeakPolarHBondContact OH-CE2 3.15Å; W256-F259 HydrophobicContact CE3-CB 4.24Å; W256-F259 WeakPolarHBondContact O-CA 3.34Å; W256-F259 PolarHBondContact O-N 2.82Å; W257-F259 VanDerWaalsContact C-N 3.29Å; W257-F259 PolarHBondContact O-N 3Å; F259-L265 HydrophobicContact CB-CG 4.46Å; F259-L265 HydrophobicContact CD1-CD1 4.09Å; F259-L265 HydrophobicContact CD1-CD2 3.99Å; F259-L265 HydrophobicContact CD1-CG 3.94Å; F259-T266 WeakPolarHBondContact O-CA 3.46Å; F259-T266 PolarHBondContact O-N 2.88Å; F259-T266 VanDerWaalsContact O-N 3.15Å; F259-T266 PolarHBondContact O-OG1 3.47Å; F259-V269 HydrophobicContact CB-CG2 4.21Å; F259-V269 HydrophobicContact CD1-CG2 3.58Å; F259-V269 HydrophobicContact CE1-CG2 4.29Å; F259-V269 HydrophobicContact CG-CG2 4.08Å
260I95.1Very high95.8Very high73 Ų7369 Ų6937%0.37433%0.333SS..SBendtrans-91.5-7.1178.562.5174.3000113.8W256 W257 E262 T266W256-I260 HydrophobicContact CB-CG2 3.93Å; W256-I260 HydrophobicContact CE3-CG2 4.45Å; W256-I260 PolarHBondContact O-N 3.4Å; W256-I260 VanDerWaalsContact O-N 3.08Å; W257-I260 HydrophobicContact CE3-CD1 4.35Å; W257-I260 WeakPolarHBondContact O-CG1 3.31Å; I260-E262 VanDerWaalsContact C-N 3.29Å; I260-E262 PolarHBondContact O-N 3.45Å; I260-T266 WeakPolarHBondContact CA-OG1 3.28Å
261R91.1Very high95.6Very high174 Ų17476 Ų7666%0.65735%0.352SS*.SBendtrans-63.6-36.2179.5-72.1174.2178.4-160.6-1.1112.5W257W257-R261 WeakPolarHBondContact O-CG 3.38Å
262E92.1Very high95.3Very high121 Ų12177.4 Ų77.457%0.56536%0.356SS*.SBendtrans-125.9127.8-179-66.2-173.4-162.600110.7I260 K264 L265 T266I260-E262 VanDerWaalsContact C-N 3.29Å; I260-E262 PolarHBondContact O-N 3.45Å; E262-K264 PolarHBondContact O-N 3.35Å; E262-L265 HydrophobicContact CB-CB 4.2Å; E262-L265 PolarHBondContact O-N 3.24Å; E262-L265 VanDerWaalsContact O-N 3.08Å; E262-T266 PolarHBondContact O-N 2.93Å; E262-T266 PolarHBondContact O-OG1 2.95Å; E262-T266 VanDerWaalsContact O-OG1 3.1Å
263Q93.9Very high95.1Very high152 Ų15274.6 Ų74.671%0.7134%0.344SS*.Hα-helixtrans-57-35.8179.6-175.1-179.7-1.600112.5T266 M267Q263-T266 PolarHBondContact O-N 2.91Å; Q263-M267 HydrophobicContact CG-CG 4.49Å; Q263-M267 WeakPolarHBondContact O-CB 3.24Å; Q263-M267 VanDerWaalsContact O-CG 3.3Å; Q263-M267 WeakPolarHBondContact O-CG 3.46Å; Q263-M267 PolarHBondContact O-N 2.95Å
264K93.9Very high94.8Very high181 Ų18176.3 Ų76.379%0.78735%0.345SS*.Hα-helixtrans-62.5-46.8177.6-70-177.6-179.7176.50111.3E262 M267 A268E262-K264 PolarHBondContact O-N 3.35Å; K264-M267 PolarHBondContact O-N 3.4Å; K264-A268 PolarHBondContact O-N 2.81Å
265L94.7Very high94.2Very high13 Ų1371.5 Ų71.57%0.06832%0.321CS..Hα-helixtrans-65.7-44.4178.3-177.357.6000111.1D64 V68 F259 E262 M267 A268 V269D64-L265 HydrophobicContact CB-CD2 4.31Å; V68-L265 HydrophobicContact CG2-CD1 4.19Å; F259-L265 HydrophobicContact CB-CG 4.46Å; F259-L265 HydrophobicContact CD1-CD1 4.09Å; F259-L265 HydrophobicContact CD1-CD2 3.99Å; F259-L265 HydrophobicContact CD1-CG 3.94Å; E262-L265 HydrophobicContact CB-CB 4.2Å; E262-L265 PolarHBondContact O-N 3.24Å; E262-L265 VanDerWaalsContact O-N 3.08Å; L265-M267 VanDerWaalsContact C-N 3.3Å; L265-M267 PolarHBondContact O-N 3.14Å; L265-A268 WeakPolarHBondContact O-CB 3.49Å; L265-A268 PolarHBondContact O-N 2.97Å; L265-A268 VanDerWaalsContact O-N 3.14Å; L265-V269 WeakPolarHBondContact O-CG2 3.45Å; L265-V269 PolarHBondContact O-N 3.27Å
266T96Very high93.4Very high30 Ų3074 Ų7418%0.18434%0.338CS..Hα-helixtrans-56.2-46.8175.3-48.30000111.3F259 I260 E262 Q263 A268 V269 L270F259-T266 WeakPolarHBondContact O-CA 3.46Å; F259-T266 PolarHBondContact O-N 2.88Å; F259-T266 VanDerWaalsContact O-N 3.15Å; F259-T266 PolarHBondContact O-OG1 3.47Å; I260-T266 WeakPolarHBondContact CA-OG1 3.28Å; E262-T266 PolarHBondContact O-N 2.93Å; E262-T266 PolarHBondContact O-OG1 2.95Å; E262-T266 VanDerWaalsContact O-OG1 3.1Å; Q263-T266 PolarHBondContact O-N 2.91Å; T266-A268 PolarHBondContact O-N 2.83Å; T266-V269 PolarHBondContact O-N 2.88Å; T266-L270 HydrophobicContact CG2-CD1 4.1Å; T266-L270 WeakPolarHBondContact O-CG 3.26Å; T266-L270 PolarHBondContact O-N 2.69Å
267M95.1Very high92.3Very high88 Ų8881.9 Ų81.943%0.43338%0.376SS..Hα-helixtrans-67.8-33.8179.2-74-63.5-169.700112.8Q263 K264 L265 L270 R271Q263-M267 HydrophobicContact CG-CG 4.49Å; Q263-M267 WeakPolarHBondContact O-CB 3.24Å; Q263-M267 VanDerWaalsContact O-CG 3.3Å; Q263-M267 WeakPolarHBondContact O-CG 3.46Å; Q263-M267 PolarHBondContact O-N 2.95Å; K264-M267 PolarHBondContact O-N 3.4Å; L265-M267 VanDerWaalsContact C-N 3.3Å; L265-M267 PolarHBondContact O-N 3.14Å; M267-L270 HydrophobicContact SD-CD1 4.39Å; M267-R271 WeakPolarHBondContact O-CB 3.33Å; M267-R271 VanDerWaalsContact O-CG 3.26Å; M267-R271 WeakPolarHBondContact O-CG 3.41Å; M267-R271 PolarHBondContact O-N 3.23Å
268A94.4Very high91.1Very high23 Ų2380.2 Ų80.219%0.1937%0.369CS..Hα-helixtrans-61.4-50.217400000110.8V68 K264 L265 T266 L270 R271 R272V68-A268 HydrophobicContact CG2-CB 3.92Å; K264-A268 PolarHBondContact O-N 2.81Å; L265-A268 WeakPolarHBondContact O-CB 3.49Å; L265-A268 PolarHBondContact O-N 2.97Å; L265-A268 VanDerWaalsContact O-N 3.14Å; T266-A268 PolarHBondContact O-N 2.83Å; A268-L270 PolarHBondContact O-N 2.83Å; A268-R271 PolarHBondContact O-N 3.4Å; A268-R272 WeakPolarHBondContact O-CG 3.46Å; A268-R272 PolarHBondContact O-N 3.26Å
269V96.1Very high90.1Very high0 Ų079.4 Ų79.40%037%0.366CS..Hα-helixtrans-57.4-52.8175.8-178.80000110.2Y67 W256 F259 L265 T266 R271 R272 L273Y67-V269 HydrophobicContact CD1-CB 4.42Å; Y67-V269 HydrophobicContact CD1-CG1 4.33Å; Y67-V269 HydrophobicContact CD1-CG2 4.15Å; Y67-V269 HydrophobicContact CD2-CG2 3.67Å; Y67-V269 HydrophobicContact CE1-CG1 4.06Å; Y67-V269 HydrophobicContact CE1-CG2 4.48Å; Y67-V269 HydrophobicContact CE2-CG2 4.04Å; Y67-V269 HydrophobicContact CG-CB 4.43Å; Y67-V269 HydrophobicContact CG-CG2 3.71Å; W256-V269 HydrophobicContact CH2-CB 4.42Å; W256-V269 HydrophobicContact CH2-CG1 3.55Å; W256-V269 HydrophobicContact CZ2-CG1 4.49Å; W256-V269 HydrophobicContact CZ3-CB 4.1Å; W256-V269 HydrophobicContact CZ3-CG1 3.62Å; F259-V269 HydrophobicContact CB-CG2 4.21Å; F259-V269 HydrophobicContact CD1-CG2 3.58Å; F259-V269 HydrophobicContact CE1-CG2 4.29Å; F259-V269 HydrophobicContact CG-CG2 4.08Å; L265-V269 WeakPolarHBondContact O-CG2 3.45Å; L265-V269 PolarHBondContact O-N 3.27Å; T266-V269 PolarHBondContact O-N 2.88Å; V269-R271 VanDerWaalsContact C-N 3.3Å; V269-R271 PolarHBondContact O-N 3.13Å; V269-R272 PolarHBondContact O-N 3.49Å; V269-L273 HydrophobicContact CG1-CD1 3.73Å; V269-L273 HydrophobicContact CG1-CD2 4.31Å; V269-L273 WeakPolarHBondContact O-CD1 3.29Å; V269-L273 PolarHBondContact O-N 2.84Å
270L94.9Very high89Confident65 Ų6579.7 Ų79.734%0.3437%0.367SS..Hα-helixtrans-58.9-38.1-177.8-71.1174.3000113.5W256 T266 M267 A268 R272 L273 F274W256-L270 HydrophobicContact CH2-CD2 4.04Å; W256-L270 HydrophobicContact CZ3-CD2 4.42Å; T266-L270 HydrophobicContact CG2-CD1 4.1Å; T266-L270 WeakPolarHBondContact O-CG 3.26Å; T266-L270 PolarHBondContact O-N 2.69Å; M267-L270 HydrophobicContact SD-CD1 4.39Å; A268-L270 PolarHBondContact O-N 2.83Å; L270-R272 VanDerWaalsContact C-N 3.35Å; L270-L273 PolarHBondContact O-N 3.38Å; L270-F274 HydrophobicContact CD2-CE2 4.46Å; L270-F274 PolarHBondContact O-N 3Å
271R93.4Very high87.8Confident191 Ų19179 Ų7972%0.72136%0.361SS*.Hα-helixtrans-67.6-33.3176.8-75.5175.9-177.6-173.20.6112.8M267 A268 V269M267-R271 WeakPolarHBondContact O-CB 3.33Å; M267-R271 VanDerWaalsContact O-CG 3.26Å; M267-R271 WeakPolarHBondContact O-CG 3.41Å; M267-R271 PolarHBondContact O-N 3.23Å; A268-R271 PolarHBondContact O-N 3.4Å; V269-R271 VanDerWaalsContact C-N 3.3Å; V269-R271 PolarHBondContact O-N 3.13Å
272R93.5Very high86.4Confident38 Ų3874.4 Ų74.414%0.14335%0.347CS..Hα-helixtrans-70.8-40.1173.9-65.4-57.9-64.1-163.2-6.5111.8Y67 L75 G79 D81 A268 V269 L270Y67-R272 HydrophobicContact CD1-CB 4.27Å; Y67-R272 HydrophobicContact CD1-CG 4.27Å; L75-R272 PolarHBondContact O-NH2 3.21Å; G79-R272 VanDerWaalsContact C-NH2 3.27Å; G79-R272 VanDerWaalsContact CA-NH2 3.35Å; G79-R272 PolarHBondContact O-NH2 3.28Å; G79-R272 VanDerWaalsContact O-NH2 3.12Å; D81-R272 IonicContact OD1-CZ 2.96Å; D81-R272 IonicContact OD1-NE 3.72Å; D81-R272 PolarHBondContact OD1-NE 2.88Å; D81-R272 IonicContact OD1-NH2 3.74Å; D81-R272 PolarHBondContact OD1-NH2 2.93Å; D81-R272 IonicContact OD2-NH2 3.84Å; A268-R272 WeakPolarHBondContact O-CG 3.46Å; A268-R272 PolarHBondContact O-N 3.26Å; V269-R272 PolarHBondContact O-N 3.49Å; L270-R272 VanDerWaalsContact C-N 3.35Å
273L93.4Very high85.3Confident7 Ų771.8 Ų71.84%0.03734%0.337CS..Hα-helixtrans-69.6-37.8-179.5-88.158.7000113.1Y67 P83 Q212 W256 V269 L270 P275Y67-L273 HydrophobicContact CE1-CD1 4.22Å; P83-L273 HydrophobicContact CB-CD2 3.75Å; P83-L273 HydrophobicContact CB-CG 4.41Å; P83-L273 HydrophobicContact CG-CD2 4.12Å; P83-L273 HydrophobicContact CG-CG 4.5Å; Q212-L273 HydrophobicContact CG-CB 4.49Å; Q212-L273 PolarHBondContact NE2-O 3.27Å; W256-L273 HydrophobicContact CH2-CD2 3.9Å; W256-L273 HydrophobicContact CZ2-CD2 4.01Å; V269-L273 HydrophobicContact CG1-CD1 3.73Å; V269-L273 HydrophobicContact CG1-CD2 4.31Å; V269-L273 WeakPolarHBondContact O-CD1 3.29Å; V269-L273 PolarHBondContact O-N 2.84Å; L270-L273 PolarHBondContact O-N 3.38Å; L273-P275 VanDerWaalsContact C-CD 3.43Å; L273-P275 WeakPolarHBondContact O-CD 3.31Å
274F91.3Very high84.8Confident101 Ų10167.4 Ų67.444%0.44332%0.315SS..SBendtrans-121.871.8-177.9-57.4-72.1000111.2Q212 L215 L270 V276Q212-F274 HydrophobicContact CB-CE1 4.32Å; Q212-F274 HydrophobicContact CB-CZ 4.16Å; Q212-F274 HydrophobicContact CG-CE1 4.21Å; Q212-F274 HydrophobicContact CG-CZ 4.48Å; L215-F274 HydrophobicContact CD1-CE1 3.78Å; L215-F274 HydrophobicContact CD1-CZ 3.79Å; L270-F274 HydrophobicContact CD2-CE2 4.46Å; L270-F274 PolarHBondContact O-N 3Å; F274-V276 PolarHBondContact O-N 2.99Å
275P85.1Confident84.6Confident27 Ų2758.8 Ų58.818%0.17528%0.278CS..  trans-79.784.6-174.534.4-36.8000110.7L273 E277 R278L273-P275 VanDerWaalsContact C-CD 3.43Å; L273-P275 WeakPolarHBondContact O-CD 3.31Å; P275-E277 PolarHBondContact O-N 3.3Å; P275-R278 HydrophobicContact CB-CG 3.96Å; P275-R278 HydrophobicContact CG-CG 4.1Å; P275-R278 PolarHBondContact O-N 2.58Å; P275-R278 VanDerWaalsContact O-N 3.14Å
276V81.3Confident84.5Confident70 Ų7058.3 Ų58.342%0.42428%0.275SS..G310 helixtrans-56-23.9-179178.60000113.1F274 R278 T304 L308 Y351F274-V276 PolarHBondContact O-N 2.99Å; V276-R278 VanDerWaalsContact C-N 3.35Å; V276-R278 PolarHBondContact O-N 3.44Å; V276-T304 HydrophobicContact CG1-CG2 4.41Å; V276-L308 HydrophobicContact CG1-CD1 3.44Å; V276-L308 VanDerWaalsContact CG1-CD1 3.44Å; V276-L308 HydrophobicContact CG1-CD2 4.28Å; V276-L308 HydrophobicContact CG1-CG 4.4Å; V276-Y351 PolarHBondContact O-OH 3.1Å; V276-Y351 VanDerWaalsContact O-OH 3.05Å
277E75.3Confident84.4Confident194 Ų19456.9 Ų56.991%0.90727%0.267SS*.G310 helixtrans-77.9-14.3-176.8-62.4177.9-176.700114P275 G279P275-E277 PolarHBondContact O-N 3.3Å; E277-G279 PolarHBondContact O-N 3.29Å
278R72.2Confident84.3Confident108 Ų10855 Ų5541%0.40826%0.258SS..G310 helixtrans-74.2-3.2-175.7-72-174-172.9177.74.1114.8D81 P275 V276 H352D81-R278 IonicContact OD1-NH2 3.5Å; D81-R278 IonicContact OD2-CZ 3.13Å; D81-R278 IonicContact OD2-NH1 2.87Å; D81-R278 PolarHBondContact OD2-NH1 3.05Å; D81-R278 VanDerWaalsContact OD2-NH1 3.09Å; D81-R278 IonicContact OD2-NH2 2.67Å; D81-R278 PolarHBondContact OD2-NH2 3.19Å; P275-R278 HydrophobicContact CB-CG 3.96Å; P275-R278 HydrophobicContact CG-CG 4.1Å; P275-R278 PolarHBondContact O-N 2.58Å; P275-R278 VanDerWaalsContact O-N 3.14Å; V276-R278 VanDerWaalsContact C-N 3.35Å; V276-R278 PolarHBondContact O-N 3.44Å; R278-H352 VanDerWaalsContact CB-NE2 3.26Å; R278-H352 WeakPolarHBondContact CB-NE2 3.5Å
279G74.3Confident84.2Confident12 Ų1254.7 Ų54.712%0.12425%0.252CS..  trans84.2-175177.800000113.5E277 Y281 Y351 H352E277-G279 PolarHBondContact O-N 3.29Å; G279-Y281 PolarHBondContact O-N 2.84Å; G279-Y351 VanDerWaalsContact C-CZ 3.48Å; G279-Y351 VanDerWaalsContact C-OH 3.29Å; G279-Y351 WeakPolarHBondContact CA-OH 3.48Å; G279-Y351 PolarHBondContact N-OH 3.38Å; G279-Y351 WeakPolarHBondContact O-CE1 3.27Å; G279-Y351 VanDerWaalsContact O-CZ 3.31Å; G279-Y351 PolarHBondContact O-OH 3.29Å; G279-H352 PolarHBondContact O-CD2 3.45Å
280L72Confident83.9Confident5 Ų555 Ų553%0.02625%0.254CS..SBendtrans-74-29.3-162-168.360.3000115.2W289 L298 C311 Y351 H352L280-W289 HydrophobicContact CD1-CG 4.35Å; L280-W289 HydrophobicContact CD2-CB 3.62Å; L280-W289 HydrophobicContact CD2-CG 4.03Å; L280-W289 HydrophobicContact CG-CB 3.94Å; L280-W289 HydrophobicContact CG-CG 4.14Å; L280-L298 HydrophobicContact CD2-CD1 4.46Å; L280-C311 WeakPolarHBondContact CD1-SG 3.16Å; L280-Y351 HydrophobicContact CB-CE2 4.42Å; L280-Y351 HydrophobicContact CD1-CD2 3.4Å; L280-Y351 HydrophobicContact CD1-CE2 3.76Å; L280-Y351 HydrophobicContact CD1-CG 4.31Å; L280-H352 WeakPolarHBondContact O-CA 3.49Å; L280-H352 PolarHBondContact O-N 2.93Å
281Y70.5Confident83.7Confident59 Ų5952.8 Ų52.823%0.23124%0.244CC..EExtended strand (participates in β ladder)trans-157.3144.9179.342.6-104.5000108.5G279 D283 W289 C290 S293G279-Y281 PolarHBondContact O-N 2.84Å; Y281-D283 WeakPolarHBondContact CD2-O 3.45Å; Y281-W289 HydrophobicContact CD1-CB 4Å; Y281-W289 HydrophobicContact CE1-CB 4.18Å; Y281-C290 HydrophobicContact CD1-CB 3.92Å; Y281-C290 HydrophobicContact CD2-CB 4.3Å; Y281-C290 VanDerWaalsContact CE1-CA 3.45Å; Y281-C290 HydrophobicContact CE1-CB 3.9Å; Y281-C290 HydrophobicContact CE2-CB 4.3Å; Y281-C290 HydrophobicContact CG-CB 4.13Å; Y281-S293 VanDerWaalsContact OH-CB 3.27Å; Y281-S293 WeakPolarHBondContact OH-CB 3.46Å; Y281-S293 PolarHBondContact OH-OG 3.14Å
282E62.1Low83.6Confident78 Ų7847.1 Ų47.136%0.36423%0.228SC..EExtended strand (participates in β ladder)trans-92.6116.8173.3-164.1-175.9-109.200108V285 V353 H354E282-V285 WeakPolarHBondContact O-CG2 3.24Å; E282-V353 PolarHBondContact N-O 3.05Å; E282-V353 VanDerWaalsContact N-O 3.13Å; E282-H354 WeakPolarHBondContact CB-ND1 3.46Å; E282-H354 IonicContact OE1-CE1 3.09Å; E282-H354 PolarHBondContact OE1-CE1 3.43Å; E282-H354 IonicContact OE1-ND1 3.85Å; E282-H354 IonicContact OE2-CE1 3.55Å; E282-H354 PolarHBondContact OE2-CE1 3.4Å; E282-H354 IonicContact OE2-CG 2.81Å; E282-H354 IonicContact OE2-ND1 3.47Å; E282-H354 PolarHBondContact OE2-ND1 3.47Å
283D68.7Low83.4Confident66 Ų6646 Ų4635%0.35323%0.226SC..SBendtrans64.3-166.7-175.9-92.8-50.1000115Y281 V285 K393Y281-D283 WeakPolarHBondContact CD2-O 3.45Å; D283-V285 PolarHBondContact O-N 3.5Å; D283-K393 IonicContact OD1-NZ 2.97Å; D283-K393 PolarHBondContact OD1-NZ 3.41Å; D283-K393 VanDerWaalsContact OD1-NZ 3.13Å; D283-K393 IonicContact OD2-NZ 3.76Å; D283-K393 PolarHBondContact OD2-NZ 3.43Å
284K83.6Confident83Confident59 Ų5949.5 Ų49.526%0.25725%0.248SC..SBendtrans-89.688.5-174.6-67.871.9171.9-166.80107.1D456 V460 S463K284-D456 WeakPolarHBondContact CE-OD1 3.21Å; K284-D456 WeakPolarHBondContact CE-OD2 3.16Å; K284-D456 IonicContact NZ-OD1 3.78Å; K284-D456 PolarHBondContact NZ-OD1 3.49Å; K284-D456 IonicContact NZ-OD2 3.5Å; K284-D456 PolarHBondContact NZ-OD2 3.2Å; K284-V460 HydrophobicContact CG-CG2 4.01Å; K284-S463 PolarHBondContact O-OG 3.14Å
285V89.1Confident82.8Confident0 Ų051.7 Ų51.70%026%0.263CS..  trans-95.8146.2-176.5-175.90000110.1E282 D283 N287 C290 F347 V353 E355E282-V285 WeakPolarHBondContact O-CG2 3.24Å; D283-V285 PolarHBondContact O-N 3.5Å; V285-N287 HydrophobicContact CG1-CB 4.27Å; V285-N287 PolarHBondContact O-N 3.41Å; V285-C290 WeakPolarHBondContact O-CB 3.26Å; V285-C290 PolarHBondContact O-SG 3.03Å; V285-F347 HydrophobicContact CG1-CE1 4.44Å; V285-F347 HydrophobicContact CG1-CE2 4.15Å; V285-F347 HydrophobicContact CG1-CZ 3.73Å; V285-V353 HydrophobicContact CG1-CB 4.42Å; V285-V353 HydrophobicContact CG1-CG1 3.94Å; V285-E355 HydrophobicContact CG2-CB 4.33Å
286A93.3Very high82.9Confident3 Ų353.7 Ų53.73%0.02527%0.274CS..SBendtrans-74.244.8174.800000113.6F347 S463 A466 C467 F470A286-F347 HydrophobicContact CB-CE1 4.35Å; A286-F347 WeakPolarHBondContact O-CE1 3.24Å; A286-S463 WeakPolarHBondContact CA-O 3.36Å; A286-S463 WeakPolarHBondContact CB-O 3.26Å; A286-A466 HydrophobicContact CB-CB 3.63Å; A286-C467 HydrophobicContact CB-CB 4.44Å; A286-C467 WeakPolarHBondContact O-CB 3.33Å; A286-F470 HydrophobicContact CB-CD2 4.04Å; A286-F470 HydrophobicContact CB-CE2 3.58Å
287N93Very high83.1Confident0 Ų055.3 Ų55.30%028%0.276CS..SBendtrans-105.1167.9175.778-1.7000111.9V285 W289 C290 S291 F347 C467V285-N287 HydrophobicContact CG1-CB 4.27Å; V285-N287 PolarHBondContact O-N 3.41Å; N287-W289 VanDerWaalsContact C-N 3.28Å; N287-W289 PolarHBondContact O-N 3.09Å; N287-W289 PolarHBondContact OD1-N 3.32Å; N287-C290 WeakPolarHBondContact OD1-CB 3.25Å; N287-C290 PolarHBondContact OD1-N 3.02Å; N287-S291 WeakPolarHBondContact O-CB 3.44Å; N287-S291 PolarHBondContact O-N 2.98Å; N287-S291 VanDerWaalsContact O-N 3.14Å; N287-S291 PolarHBondContact O-OG 3.48Å; N287-F347 VanDerWaalsContact CB-O 3.26Å; N287-F347 WeakPolarHBondContact CB-O 3.41Å; N287-C467 PolarHBondContact O-SG 3.48Å; N287-C467 VanDerWaalsContact O-SG 3.41Å
288L93.7Very high83.5Confident49 Ų4947.1 Ų47.126%0.25724%0.238SC..Hα-helixtrans-61.1-41.3-177.7-74.3173.7000111.2S291 L292 L348 C349 V471L288-S291 PolarHBondContact O-N 2.83Å; L288-L292 VanDerWaalsContact O-CB 3.22Å; L288-L292 WeakPolarHBondContact O-CB 3.24Å; L288-L292 WeakPolarHBondContact O-CG 3.34Å; L288-L292 PolarHBondContact O-N 3.28Å; L288-L348 WeakPolarHBondContact CB-O 3.4Å; L288-L348 HydrophobicContact CD1-CB 4.28Å; L288-L348 HydrophobicContact CG-CB 4.23Å; L288-L348 HydrophobicContact CG-CD2 4.44Å; L288-L348 PolarHBondContact N-O 3.26Å; L288-C349 VanDerWaalsContact CD1-SG 3.55Å; L288-V471 HydrophobicContact CD2-CG2 3.5Å; L288-V471 HydrophobicContact CG-CG2 4.3Å
289W92.2Very high83.9Confident16 Ų1648.4 Ų48.46%0.06125%0.247CC..Hα-helixtrans-68.3-42.4-174.3-51.4128.7000113.5L280 Y281 N287 L292 S293 L298 L310 C311 T314 C349 S350L280-W289 HydrophobicContact CD1-CG 4.35Å; L280-W289 HydrophobicContact CD2-CB 3.62Å; L280-W289 HydrophobicContact CD2-CG 4.03Å; L280-W289 HydrophobicContact CG-CB 3.94Å; L280-W289 HydrophobicContact CG-CG 4.14Å; Y281-W289 HydrophobicContact CD1-CB 4Å; Y281-W289 HydrophobicContact CE1-CB 4.18Å; N287-W289 VanDerWaalsContact C-N 3.28Å; N287-W289 PolarHBondContact O-N 3.09Å; N287-W289 PolarHBondContact OD1-N 3.32Å; W289-L292 HydrophobicContact CE3-CD1 4.44Å; W289-S293 VanDerWaalsContact O-CB 3.32Å; W289-S293 WeakPolarHBondContact O-CB 3.46Å; W289-S293 PolarHBondContact O-N 3.28Å; W289-L298 HydrophobicContact CE3-CD1 3.63Å; W289-L298 HydrophobicContact CZ3-CD1 4.22Å; W289-L310 HydrophobicContact CH2-CD2 4.28Å; W289-L310 HydrophobicContact CH2-CG 4.12Å; W289-L310 HydrophobicContact CZ3-CD2 4.25Å; W289-C311 HydrophobicContact CZ2-CB 4.37Å; W289-C311 PolarHBondContact NE1-SG 3.09Å; W289-T314 HydrophobicContact CH2-CG2 4.09Å; W289-T314 VanDerWaalsContact CZ2-OG1 3.3Å; W289-T314 WeakPolarHBondContact CZ2-OG1 3.24Å; W289-C349 HydrophobicContact CZ2-CB 4.46Å; W289-C349 WeakPolarHBondContact CZ2-O 3.48Å; W289-C349 PolarHBondContact NE1-O 3Å; W289-S350 PolarHBondContact NE1-O 3.41Å
290C89.4Confident84.4Confident6 Ų657.8 Ų57.84%0.04128%0.278CS..Hα-helixtrans-66.1-45.4176179.40000110.1Y281 V285 N287 L292 S293Y281-C290 HydrophobicContact CD1-CB 3.92Å; Y281-C290 HydrophobicContact CD2-CB 4.3Å; Y281-C290 VanDerWaalsContact CE1-CA 3.45Å; Y281-C290 HydrophobicContact CE1-CB 3.9Å; Y281-C290 HydrophobicContact CE2-CB 4.3Å; Y281-C290 HydrophobicContact CG-CB 4.13Å; V285-C290 WeakPolarHBondContact O-CB 3.26Å; V285-C290 PolarHBondContact O-SG 3.03Å; N287-C290 WeakPolarHBondContact OD1-CB 3.25Å; N287-C290 PolarHBondContact OD1-N 3.02Å; C290-L292 PolarHBondContact O-N 3.33Å; C290-S293 WeakPolarHBondContact O-CB 3.48Å; C290-S293 PolarHBondContact O-N 2.84Å; C290-S293 VanDerWaalsContact O-N 3.15Å; C290-S293 PolarHBondContact O-OG 3.37Å
291S90.8Very high85.1Confident19 Ų1964 Ų6413%0.13331%0.307CS..Hα-helixtrans-63.2-45.1178.7-56.50000112.4N287 L288 S293 V294 C467N287-S291 WeakPolarHBondContact O-CB 3.44Å; N287-S291 PolarHBondContact O-N 2.98Å; N287-S291 VanDerWaalsContact O-N 3.14Å; N287-S291 PolarHBondContact O-OG 3.48Å; L288-S291 PolarHBondContact O-N 2.83Å; S291-S293 PolarHBondContact O-N 2.91Å; S291-V294 PolarHBondContact O-N 3.45Å; S291-C467 WeakPolarHBondContact OG-CB 3.3Å; S291-C467 PolarHBondContact OG-SG 3.45Å
292L91.3Very high85.9Confident73 Ų7365.6 Ų65.638%0.38232%0.315SS..Hα-helixtrans-67.5-26176.5-72.5171000112.4L288 W289 C290 V294 L295 V296L288-L292 VanDerWaalsContact O-CB 3.22Å; L288-L292 WeakPolarHBondContact O-CB 3.24Å; L288-L292 WeakPolarHBondContact O-CG 3.34Å; L288-L292 PolarHBondContact O-N 3.28Å; W289-L292 HydrophobicContact CE3-CD1 4.44Å; C290-L292 PolarHBondContact O-N 3.33Å; L292-V294 PolarHBondContact O-N 3.38Å; L292-V294 VanDerWaalsContact O-N 3.09Å; L292-L295 PolarHBondContact O-N 2.87Å; L292-V296 PolarHBondContact O-N 3.48Å
293S88.6Confident87.2Confident14 Ų1466.6 Ų66.610%0.09833%0.327CS..THydrogen-bonded Turntrans-64.6-14.7-179.581.20000114.4Y281 W289 C290 S291 V296 K297Y281-S293 VanDerWaalsContact OH-CB 3.27Å; Y281-S293 WeakPolarHBondContact OH-CB 3.46Å; Y281-S293 PolarHBondContact OH-OG 3.14Å; W289-S293 VanDerWaalsContact O-CB 3.32Å; W289-S293 WeakPolarHBondContact O-CB 3.46Å; W289-S293 PolarHBondContact O-N 3.28Å; C290-S293 WeakPolarHBondContact O-CB 3.48Å; C290-S293 PolarHBondContact O-N 2.84Å; C290-S293 VanDerWaalsContact O-N 3.15Å; C290-S293 PolarHBondContact O-OG 3.37Å; S291-S293 PolarHBondContact O-N 2.91Å; S293-V296 WeakPolarHBondContact CA-O 3.26Å; S293-K297 VanDerWaalsContact O-CD 3.29Å; S293-K297 WeakPolarHBondContact O-CD 3.35Å; S293-K297 WeakPolarHBondContact O-CE 3.41Å; S293-K297 PolarHBondContact O-NZ 2.84Å
294V85.6Confident88.1Confident81 Ų8167.1 Ų67.149%0.49133%0.333SS..THydrogen-bonded Turntrans-69.8-37.6171.3-176.40000110.7S291 L292 V460 V464S291-V294 PolarHBondContact O-N 3.45Å; L292-V294 PolarHBondContact O-N 3.38Å; L292-V294 VanDerWaalsContact O-N 3.09Å; V294-V460 HydrophobicContact CG2-CG1 3.52Å; V294-V464 HydrophobicContact CG2-CG2 4.43Å
295L87.5Confident88.4Confident146 Ų14672 Ų7276%0.76436%0.356SS*.THydrogen-bonded Turntrans-94.4-45.2-177.5-57.4177.3000111.8L292L292-L295 PolarHBondContact O-N 2.87Å
296V87Confident88.5Confident69 Ų6973.2 Ų73.242%0.41837%0.369SS..  trans-129111.5-173.5-177.70000109.6L292 S293 L298L292-V296 PolarHBondContact O-N 3.48Å; S293-V296 WeakPolarHBondContact CA-O 3.26Å; V296-L298 VanDerWaalsContact C-N 3.32Å; V296-L298 HydrophobicContact CG1-CD2 4.19Å; V296-L298 PolarHBondContact O-N 2.95Å
297K85.9Confident88.4Confident105 Ų10573.4 Ų73.446%0.45737%0.369SS..  trans-74.283.9174.3-62.4-65178.3-163.40110.2S293 K299 R300 H301S293-K297 VanDerWaalsContact O-CD 3.29Å; S293-K297 WeakPolarHBondContact O-CD 3.35Å; S293-K297 WeakPolarHBondContact O-CE 3.41Å; S293-K297 PolarHBondContact O-NZ 2.84Å; K297-K299 VanDerWaalsContact C-N 3.25Å; K297-K299 PolarHBondContact O-N 3.37Å; K297-R300 HydrophobicContact CB-CG 4.02Å; K297-R300 WeakPolarHBondContact O-CB 3.34Å; K297-R300 PolarHBondContact O-N 3.21Å; K297-H301 PolarHBondContact O-ND1 3.22Å; K297-H301 VanDerWaalsContact O-ND1 3.09Å
298L82Confident88.3Confident21 Ų2175.4 Ų75.411%0.1138%0.38CS..G310 helixtrans-53.6-38-177.6-69.8170.7000113.4L280 W289 V296 R300 H301 F302 L307L280-L298 HydrophobicContact CD2-CD1 4.46Å; W289-L298 HydrophobicContact CE3-CD1 3.63Å; W289-L298 HydrophobicContact CZ3-CD1 4.22Å; V296-L298 VanDerWaalsContact C-N 3.32Å; V296-L298 HydrophobicContact CG1-CD2 4.19Å; V296-L298 PolarHBondContact O-N 2.95Å; L298-R300 PolarHBondContact O-N 2.85Å; L298-R300 VanDerWaalsContact O-N 3.08Å; L298-H301 PolarHBondContact O-N 2.96Å; L298-F302 HydrophobicContact CD2-CD2 4.26Å; L298-F302 HydrophobicContact CD2-CE2 4.1Å; L298-F302 PolarHBondContact O-N 3.05Å; L298-F302 VanDerWaalsContact O-N 3.08Å; L298-L307 HydrophobicContact CB-CD2 4.01Å
299K80.9Confident88.4Confident135 Ų13576 Ų7659%0.58739%0.392SS*.G310 helixtrans-59.6-19176.5-67.4-172.8179.4-177.80114.2K297 L307K297-K299 VanDerWaalsContact C-N 3.25Å; K297-K299 PolarHBondContact O-N 3.37Å; K299-L307 HydrophobicContact CG-CD1 4.26Å
300R85.5Confident88.5Confident209 Ų20977.7 Ų77.779%0.78940%0.402SS*.G310 helixtrans-83.6-20.1175.6-65.7-174.7177.6170.9-2.5113.1K297 L298K297-R300 HydrophobicContact CB-CG 4.02Å; K297-R300 WeakPolarHBondContact O-CB 3.34Å; K297-R300 PolarHBondContact O-N 3.21Å; L298-R300 PolarHBondContact O-N 2.85Å; L298-R300 VanDerWaalsContact O-N 3.08Å
301H86Confident88.7Confident135 Ų13577.5 Ų77.563%0.62540%0.401SS*.THydrogen-bonded Turntrans-108.1-24.2-171.9-61.187.3000112.8K297 L298K297-H301 PolarHBondContact O-ND1 3.22Å; K297-H301 VanDerWaalsContact O-ND1 3.09Å; L298-H301 PolarHBondContact O-N 2.96Å
302F86.7Confident88.9Confident93 Ų9380.4 Ų80.441%0.40842%0.417SS..SBendtrans-124.8141.8-175.6-65.8-83.9000111.3L298 L307L298-F302 HydrophobicContact CD2-CD2 4.26Å; L298-F302 HydrophobicContact CD2-CE2 4.1Å; L298-F302 PolarHBondContact O-N 3.05Å; L298-F302 VanDerWaalsContact O-N 3.08Å; F302-L307 HydrophobicContact CB-CD2 3.67Å; F302-L307 HydrophobicContact CB-CG 3.67Å; F302-L307 HydrophobicContact CD2-CD2 4.23Å; F302-L307 HydrophobicContact CG-CD2 4.17Å
303T90.4Very high89.2Confident99 Ų9981.7 Ų81.761%0.60742%0.424SS*.  trans-67.9162.8166.463.80000110.3Q305 G306 L307T303-Q305 VanDerWaalsContact C-N 3.26Å; T303-Q305 PolarHBondContact O-N 3.32Å; T303-G306 PolarHBondContact O-N 3.38Å; T303-G306 PolarHBondContact OG1-N 2.84Å; T303-G306 VanDerWaalsContact OG1-N 3.14Å; T303-L307 PolarHBondContact O-N 3.34Å
304T87.7Confident89.6Confident78 Ų7882.8 Ų82.848%0.47943%0.43SS..Hα-helixtrans-54.8-42.9175.8-52.50000111.9V276 L307 L308V276-T304 HydrophobicContact CG1-CG2 4.41Å; T304-L307 PolarHBondContact O-N 3.35Å; T304-L308 HydrophobicContact CG2-CD1 4.3Å; T304-L308 VanDerWaalsContact O-CG 3.31Å; T304-L308 WeakPolarHBondContact O-CG 3.37Å; T304-L308 PolarHBondContact O-N 2.7Å
305Q89.9Confident90.1Very high161 Ų16179.2 Ų79.275%0.75241%0.409SS*.Hα-helixtrans-64.6-41175.6-70.1-174-20.400112.5T303 L307 L308 A309T303-Q305 VanDerWaalsContact C-N 3.26Å; T303-Q305 PolarHBondContact O-N 3.32Å; Q305-L307 VanDerWaalsContact C-N 3.35Å; Q305-L307 PolarHBondContact O-N 2.86Å; Q305-L308 PolarHBondContact O-N 3.2Å; Q305-A309 WeakPolarHBondContact O-CB 3.28Å; Q305-A309 PolarHBondContact O-N 3.44Å
306G92Very high90.6Very high25 Ų2576.8 Ų76.826%0.25840%0.396SS..Hα-helixtrans-62-41.2174.900000112.6T303 A309 L310T303-G306 PolarHBondContact O-N 3.38Å; T303-G306 PolarHBondContact OG1-N 2.84Å; T303-G306 VanDerWaalsContact OG1-N 3.14Å; G306-A309 PolarHBondContact O-N 3.07Å; G306-L310 WeakPolarHBondContact O-CB 3.48Å; G306-L310 PolarHBondContact O-N 3.09Å
307L90.9Very high91.1Very high8 Ų878.6 Ų78.64%0.04240%0.403CS..Hα-helixtrans-64.7-44.2175.1-71.9174.2000112L298 K299 F302 T303 T304 Q305 A309 L310 C311 Y351L298-L307 HydrophobicContact CB-CD2 4.01Å; K299-L307 HydrophobicContact CG-CD1 4.26Å; F302-L307 HydrophobicContact CB-CD2 3.67Å; F302-L307 HydrophobicContact CB-CG 3.67Å; F302-L307 HydrophobicContact CD2-CD2 4.23Å; F302-L307 HydrophobicContact CG-CD2 4.17Å; T303-L307 PolarHBondContact O-N 3.34Å; T304-L307 PolarHBondContact O-N 3.35Å; Q305-L307 VanDerWaalsContact C-N 3.35Å; Q305-L307 PolarHBondContact O-N 2.86Å; L307-A309 VanDerWaalsContact C-N 3.33Å; L307-A309 PolarHBondContact O-N 2.96Å; L307-L310 PolarHBondContact O-N 3.25Å; L307-C311 WeakPolarHBondContact O-CB 3.46Å; L307-C311 PolarHBondContact O-N 3.14Å; L307-C311 PolarHBondContact O-SG 2.98Å; L307-Y351 HydrophobicContact CB-CE2 4.46Å
308L91.3Very high91.6Very high42 Ų4274.5 Ų74.522%0.2239%0.391CS..Hα-helixtrans-59-45.9176.3-73.2163000111.2V276 T304 Q305 C311 T312 Y351V276-L308 HydrophobicContact CG1-CD1 3.44Å; V276-L308 VanDerWaalsContact CG1-CD1 3.44Å; V276-L308 HydrophobicContact CG1-CD2 4.28Å; V276-L308 HydrophobicContact CG1-CG 4.4Å; T304-L308 HydrophobicContact CG2-CD1 4.3Å; T304-L308 VanDerWaalsContact O-CG 3.31Å; T304-L308 WeakPolarHBondContact O-CG 3.37Å; T304-L308 PolarHBondContact O-N 2.7Å; Q305-L308 PolarHBondContact O-N 3.2Å; L308-C311 PolarHBondContact O-N 3.42Å; L308-T312 VanDerWaalsContact O-CB 3.28Å; L308-T312 WeakPolarHBondContact O-CB 3.41Å; L308-T312 PolarHBondContact O-N 3.26Å; L308-T312 PolarHBondContact O-OG1 3.22Å; L308-Y351 HydrophobicContact CD2-CD1 3.53Å; L308-Y351 HydrophobicContact CD2-CD2 3.58Å; L308-Y351 HydrophobicContact CD2-CE1 3.85Å; L308-Y351 HydrophobicContact CD2-CE2 3.88Å; L308-Y351 HydrophobicContact CD2-CG 3.4Å; L308-Y351 VanDerWaalsContact CD2-CG 3.4Å; L308-Y351 HydrophobicContact CG-CD2 4.11Å; L308-Y351 HydrophobicContact CG-CE2 4.13Å; L308-Y351 HydrophobicContact CG-CG 4.41Å
309A94Very high92.3Very high62 Ų6274 Ų7451%0.51239%0.388SS..Hα-helixtrans-62.1-44.4177.500000111.7Q305 G306 L307 T312 L313Q305-A309 WeakPolarHBondContact O-CB 3.28Å; Q305-A309 PolarHBondContact O-N 3.44Å; G306-A309 PolarHBondContact O-N 3.07Å; L307-A309 VanDerWaalsContact C-N 3.33Å; L307-A309 PolarHBondContact O-N 2.96Å; A309-T312 PolarHBondContact O-N 3.01Å; A309-L313 WeakPolarHBondContact O-CB 3.37Å; A309-L313 PolarHBondContact O-N 3.36Å
310L94.4Very high93.1Very high51 Ų5173.6 Ų73.627%0.26739%0.39SS..Hα-helixtrans-62.1-47.4177.5178.763.8000112.1W289 G306 L307 T312 L313 T314W289-L310 HydrophobicContact CH2-CD2 4.28Å; W289-L310 HydrophobicContact CH2-CG 4.12Å; W289-L310 HydrophobicContact CZ3-CD2 4.25Å; G306-L310 WeakPolarHBondContact O-CB 3.48Å; G306-L310 PolarHBondContact O-N 3.09Å; L307-L310 PolarHBondContact O-N 3.25Å; L310-T312 VanDerWaalsContact C-N 3.34Å; L310-T312 PolarHBondContact O-N 3.43Å; L310-L313 PolarHBondContact O-N 3.09Å; L310-T314 HydrophobicContact CD1-CG2 4.15Å; L310-T314 WeakPolarHBondContact O-CB 3.41Å; L310-T314 WeakPolarHBondContact O-CG2 3.36Å; L310-T314 PolarHBondContact O-N 3.3Å; L310-T314 PolarHBondContact O-OG1 3.31Å
311C94.4Very high93.6Very high2 Ų265.5 Ų65.51%0.01436%0.364CS..Hα-helixtrans-63.3-42.4178.3-62.70000111.2L280 W289 L307 L308 T314 T315 C349L280-C311 WeakPolarHBondContact CD1-SG 3.16Å; W289-C311 HydrophobicContact CZ2-CB 4.37Å; W289-C311 PolarHBondContact NE1-SG 3.09Å; L307-C311 WeakPolarHBondContact O-CB 3.46Å; L307-C311 PolarHBondContact O-N 3.14Å; L307-C311 PolarHBondContact O-SG 2.98Å; L308-C311 PolarHBondContact O-N 3.42Å; C311-T314 WeakPolarHBondContact CA-OG1 3.47Å; C311-T314 PolarHBondContact O-OG1 2.69Å; C311-T314 VanDerWaalsContact O-OG1 3.09Å; C311-T315 VanDerWaalsContact O-CB 3.24Å; C311-T315 WeakPolarHBondContact O-CB 3.33Å; C311-T315 PolarHBondContact O-N 3.01Å; C311-T315 PolarHBondContact O-OG1 3Å; C311-C349 WeakPolarHBondContact CA-O 3.25Å; C311-C349 WeakPolarHBondContact CB-O 3.4Å
312T94.8Very high94Very high79 Ų7959.1 Ų59.149%0.48534%0.335SS..Hα-helixtrans-61.5-50177-57.20000110.4L308 A309 L310 T314 T315 L316L308-T312 VanDerWaalsContact O-CB 3.28Å; L308-T312 WeakPolarHBondContact O-CB 3.41Å; L308-T312 PolarHBondContact O-N 3.26Å; L308-T312 PolarHBondContact O-OG1 3.22Å; A309-T312 PolarHBondContact O-N 3.01Å; L310-T312 VanDerWaalsContact C-N 3.34Å; L310-T312 PolarHBondContact O-N 3.43Å; T312-T314 PolarHBondContact O-N 2.88Å; T312-T315 PolarHBondContact O-N 3.36Å; T312-L316 HydrophobicContact CG2-CD1 3.96Å; T312-L316 HydrophobicContact CG2-CG 4.39Å; T312-L316 WeakPolarHBondContact O-CB 3.47Å; T312-L316 VanDerWaalsContact O-CG 3.24Å; T312-L316 WeakPolarHBondContact O-CG 3.14Å; T312-L316 PolarHBondContact O-N 3.07Å
313L97.2Very high94.6Very high101 Ų10155.1 Ų55.153%0.52932%0.318SS..Hα-helixtrans-61.1-48.4-179.7179.762.6000111.9A309 L310 T315 L316 L317A309-L313 WeakPolarHBondContact O-CB 3.37Å; A309-L313 PolarHBondContact O-N 3.36Å; L310-L313 PolarHBondContact O-N 3.09Å; L313-T315 PolarHBondContact O-N 3.05Å; L313-L316 PolarHBondContact O-N 3.5Å; L313-L317 HydrophobicContact CD1-CD1 4.29Å; L313-L317 HydrophobicContact CD1-CG 4.36Å; L313-L317 HydrophobicContact CG-CD1 4.11Å; L313-L317 WeakPolarHBondContact O-CB 3.41Å; L313-L317 VanDerWaalsContact O-CG 3.28Å; L313-L317 WeakPolarHBondContact O-CG 3.17Å; L313-L317 PolarHBondContact O-N 3.09Å
314T96.5Very high94.9Very high36 Ų3657.2 Ų57.222%0.22132%0.315CS..Hα-helixtrans-66-37.4-179.848.50000112.5W289 L310 C311 T312 L317 G318W289-T314 HydrophobicContact CH2-CG2 4.09Å; W289-T314 VanDerWaalsContact CZ2-OG1 3.3Å; W289-T314 WeakPolarHBondContact CZ2-OG1 3.24Å; L310-T314 HydrophobicContact CD1-CG2 4.15Å; L310-T314 WeakPolarHBondContact O-CB 3.41Å; L310-T314 WeakPolarHBondContact O-CG2 3.36Å; L310-T314 PolarHBondContact O-N 3.3Å; L310-T314 PolarHBondContact O-OG1 3.31Å; C311-T314 WeakPolarHBondContact CA-OG1 3.47Å; C311-T314 PolarHBondContact O-OG1 2.69Å; C311-T314 VanDerWaalsContact O-OG1 3.09Å; T312-T314 PolarHBondContact O-N 2.88Å; T314-L317 PolarHBondContact O-N 3.09Å; T314-G318 PolarHBondContact O-N 3.41Å
315T97.2Very high95.3Very high7 Ų754.9 Ų54.94%0.04330%0.299CS..Hα-helixtrans-63.6-47.2172.8-56.80000111C311 T312 L313 L317 G318 I319 F346 C349 S350C311-T315 VanDerWaalsContact O-CB 3.24Å; C311-T315 WeakPolarHBondContact O-CB 3.33Å; C311-T315 PolarHBondContact O-N 3.01Å; C311-T315 PolarHBondContact O-OG1 3Å; T312-T315 PolarHBondContact O-N 3.36Å; L313-T315 PolarHBondContact O-N 3.05Å; T315-L317 VanDerWaalsContact C-N 3.33Å; T315-L317 PolarHBondContact O-N 3.02Å; T315-G318 PolarHBondContact O-N 3.15Å; T315-G318 VanDerWaalsContact O-N 3.14Å; T315-I319 HydrophobicContact CG2-CG2 4.49Å; T315-I319 WeakPolarHBondContact O-CG2 3.3Å; T315-I319 PolarHBondContact O-N 3.45Å; T315-F346 HydrophobicContact CG2-CB 4.48Å; T315-F346 HydrophobicContact CG2-CD1 3.64Å; T315-F346 HydrophobicContact CG2-CD2 4.1Å; T315-F346 HydrophobicContact CG2-CE1 3.77Å; T315-F346 HydrophobicContact CG2-CE2 4.22Å; T315-F346 HydrophobicContact CG2-CG 3.81Å; T315-F346 HydrophobicContact CG2-CZ 4.06Å; T315-C349 WeakPolarHBondContact OG1-CB 3.48Å; T315-C349 PolarHBondContact OG1-O 3.24Å; T315-S350 WeakPolarHBondContact OG1-CA 3.4Å; T315-S350 PolarHBondContact OG1-N 2.87Å
316L97.4Very high95.6Very high95 Ų9547.2 Ų47.250%0.49726%0.263SS..Hα-helixtrans-60.3-42178-72.7175.3000112T312 L313 G318 I319 M320T312-L316 HydrophobicContact CG2-CD1 3.96Å; T312-L316 HydrophobicContact CG2-CG 4.39Å; T312-L316 WeakPolarHBondContact O-CB 3.47Å; T312-L316 VanDerWaalsContact O-CG 3.24Å; T312-L316 WeakPolarHBondContact O-CG 3.14Å; T312-L316 PolarHBondContact O-N 3.07Å; L313-L316 PolarHBondContact O-N 3.5Å; L316-G318 VanDerWaalsContact C-N 3.33Å; L316-G318 PolarHBondContact O-N 2.74Å; L316-I319 HydrophobicContact CD2-CD1 4.13Å; L316-I319 WeakPolarHBondContact O-CG1 3.44Å; L316-I319 PolarHBondContact O-N 3.45Å; L316-M320 VanDerWaalsContact O-CB 3.3Å; L316-M320 WeakPolarHBondContact O-CB 3.48Å; L316-M320 PolarHBondContact O-N 3.31Å; L316-M320 VanDerWaalsContact O-N 3.09Å
317L97.1Very high95.9Very high106 Ų10648.7 Ų48.756%0.55526%0.262SS*.Hα-helixtrans-63.8-37.7175.7-71.6172.3000112.2L313 T314 T315 P321L313-L317 HydrophobicContact CD1-CD1 4.29Å; L313-L317 HydrophobicContact CD1-CG 4.36Å; L313-L317 HydrophobicContact CG-CD1 4.11Å; L313-L317 WeakPolarHBondContact O-CB 3.41Å; L313-L317 VanDerWaalsContact O-CG 3.28Å; L313-L317 WeakPolarHBondContact O-CG 3.17Å; L313-L317 PolarHBondContact O-N 3.09Å; T314-L317 PolarHBondContact O-N 3.09Å; T315-L317 VanDerWaalsContact C-N 3.33Å; T315-L317 PolarHBondContact O-N 3.02Å; L317-P321 WeakPolarHBondContact O-CD 3.38Å
318G96.3Very high96.1Very high20 Ų2055.2 Ų55.221%0.20629%0.286CS..Hα-helixtrans-65.7-45.6176.700000113.1T314 T315 L316 P321 S345T314-G318 PolarHBondContact O-N 3.41Å; T315-G318 PolarHBondContact O-N 3.15Å; T315-G318 VanDerWaalsContact O-N 3.14Å; L316-G318 VanDerWaalsContact C-N 3.33Å; L316-G318 PolarHBondContact O-N 2.74Å; G318-P321 WeakPolarHBondContact O-CD 3.23Å; G318-S345 VanDerWaalsContact C-OG 3.25Å; G318-S345 WeakPolarHBondContact CA-OG 3.13Å; G318-S345 PolarHBondContact O-OG 3.11Å
319I97.3Very high96.3Very high11 Ų1157.1 Ų57.16%0.05630%0.297CS..Hα-helixtrans-78.5-22.4-17770.1178.4000113.8P219 T315 L316 S322 C323 F346P219-I319 HydrophobicContact CB-CD1 3.91Å; P219-I319 HydrophobicContact CG-CD1 3.93Å; T315-I319 HydrophobicContact CG2-CG2 4.49Å; T315-I319 WeakPolarHBondContact O-CG2 3.3Å; T315-I319 PolarHBondContact O-N 3.45Å; L316-I319 HydrophobicContact CD2-CD1 4.13Å; L316-I319 WeakPolarHBondContact O-CG1 3.44Å; L316-I319 PolarHBondContact O-N 3.45Å; I319-S322 PolarHBondContact O-N 3.4Å; I319-S322 PolarHBondContact O-OG 3.08Å; I319-S322 VanDerWaalsContact O-OG 3.09Å; I319-C323 VanDerWaalsContact O-CB 3.31Å; I319-C323 WeakPolarHBondContact O-CB 3.3Å; I319-C323 PolarHBondContact O-N 2.7Å; I319-C323 PolarHBondContact O-SG 3.22Å; I319-F346 HydrophobicContact CD1-CE2 4.12Å; I319-F346 HydrophobicContact CD1-CZ 4.48Å; I319-F346 HydrophobicContact CG2-CD2 4.05Å; I319-F346 HydrophobicContact CG2-CE2 4Å
320M97.2Very high96.4Very high126 Ų12655.6 Ų55.662%0.62128%0.282SS*.Hα-helixtrans-58.1-46-170.3-176.7179.8-174.400114L316 S322 W324L316-M320 VanDerWaalsContact O-CB 3.3Å; L316-M320 WeakPolarHBondContact O-CB 3.48Å; L316-M320 PolarHBondContact O-N 3.31Å; L316-M320 VanDerWaalsContact O-N 3.09Å; M320-S322 PolarHBondContact O-N 3.37Å; M320-W324 VanDerWaalsContact O-CB 3.25Å; M320-W324 WeakPolarHBondContact O-CB 3.49Å; M320-W324 PolarHBondContact O-N 3.41Å
321P96Very high96.4Very high39 Ų3954.4 Ų54.425%0.25328%0.277SS..Hα-helixtrans-61.6-44.4-178.3-22.734.4000112.9L317 G318 H325 T478 L482L317-P321 WeakPolarHBondContact O-CD 3.38Å; G318-P321 WeakPolarHBondContact O-CD 3.23Å; P321-H325 WeakPolarHBondContact O-CB 3.47Å; P321-H325 PolarHBondContact O-N 3.48Å; P321-T478 HydrophobicContact CB-CG2 4.16Å; P321-T478 HydrophobicContact CG-CG2 4.39Å; P321-L482 HydrophobicContact CB-CD1 4.41Å; P321-L482 HydrophobicContact CB-CD2 4.18Å
322S95.9Very high96.4Very high1 Ų156 Ų561%0.00729%0.287CS..Hα-helixtrans-73.8-38.9-178.259.10000112I319 M320 H325 V326 S338 S341I319-S322 PolarHBondContact O-N 3.4Å; I319-S322 PolarHBondContact O-OG 3.08Å; I319-S322 VanDerWaalsContact O-OG 3.09Å; M320-S322 PolarHBondContact O-N 3.37Å; S322-H325 PolarHBondContact O-N 2.71Å; S322-V326 PolarHBondContact O-N 2.96Å; S322-V326 VanDerWaalsContact O-N 3.09Å; S322-S338 PolarHBondContact O-OG 3.03Å; S322-S341 WeakPolarHBondContact CB-OG 3.37Å; S322-S341 PolarHBondContact OG-OG 3.16Å; S322-S341 VanDerWaalsContact OG-OG 3.09Å
323C97.5Very high96.4Very high9 Ų953.7 Ų53.76%0.06127%0.273CS..Hα-helixtrans-63.1-43.2173.6-70.90000111.9C223 I319 V326 F327C223-C323 HydrophobicContact CB-CB 4.33Å; C223-C323 WeakPolarHBondContact CB-O 3.35Å; I319-C323 VanDerWaalsContact O-CB 3.31Å; I319-C323 WeakPolarHBondContact O-CB 3.3Å; I319-C323 PolarHBondContact O-N 2.7Å; I319-C323 PolarHBondContact O-SG 3.22Å; C323-V326 WeakPolarHBondContact O-CG1 3.4Å; C323-F327 WeakPolarHBondContact O-CB 3.48Å; C323-F327 PolarHBondContact O-N 2.83Å
324W96.9Very high96.3Very high142 Ų14249.2 Ų49.254%0.53825%0.25SC..Hα-helixtrans-64-41.7175.5178.9-110.7000112.2M320 F327 R328M320-W324 VanDerWaalsContact O-CB 3.25Å; M320-W324 WeakPolarHBondContact O-CB 3.49Å; M320-W324 PolarHBondContact O-N 3.41Å; W324-F327 HydrophobicContact CE3-CD1 4.12Å; W324-F327 HydrophobicContact CZ3-CD1 4.04Å; W324-F327 HydrophobicContact CZ3-CE1 4.17Å; W324-F327 PolarHBondContact O-N 3.45Å; W324-R328 HydrophobicContact CD2-CG 4.43Å; W324-R328 HydrophobicContact CZ2-CG 4.25Å; W324-R328 PolarHBondContact O-N 3.37Å; W324-R328 VanDerWaalsContact O-N 3.12Å
325H95.9Very high96.3Very high30 Ų3047.5 Ų47.514%0.13924%0.239CC..Hα-helixtrans-61.3-49.6179.3-177.3-94.8000112.2P321 S322 F327 R328 N329 N334 I481P321-H325 WeakPolarHBondContact O-CB 3.47Å; P321-H325 PolarHBondContact O-N 3.48Å; S322-H325 PolarHBondContact O-N 2.71Å; H325-F327 VanDerWaalsContact C-N 3.34Å; H325-F327 PolarHBondContact O-N 3.28Å; H325-R328 PolarHBondContact O-N 2.88Å; H325-N329 PolarHBondContact O-N 3.45Å; H325-N329 VanDerWaalsContact O-N 3.09Å; H325-N334 PolarHBondContact CE1-OD1 3.19Å; H325-N334 VanDerWaalsContact CE1-OD1 3.25Å; H325-I481 HydrophobicContact CB-CG2 3.59Å; H325-I481 VanDerWaalsContact CG-CG2 3.41Å
326V96.9Very high96.3Very high0 Ų047.3 Ų47.30%024%0.238CC..Hα-helixtrans-68.1-33.6179.669.70000112.4C223 Y224 S322 C323 R328 N329 P330 N334 L335 S338C223-V326 HydrophobicContact CB-CG1 3.85Å; Y224-V326 HydrophobicContact CD2-CG2 3.82Å; Y224-V326 HydrophobicContact CG-CG2 4.29Å; S322-V326 PolarHBondContact O-N 2.96Å; S322-V326 VanDerWaalsContact O-N 3.09Å; C323-V326 WeakPolarHBondContact O-CG1 3.4Å; V326-R328 VanDerWaalsContact C-N 3.34Å; V326-R328 PolarHBondContact O-N 2.9Å; V326-N329 CarbonylContact O-C 3.07Å; V326-N329 VanDerWaalsContact O-C 3.24Å; V326-N329 PolarHBondContact O-N 3.31Å; V326-P330 VanDerWaalsContact O-CA 3.27Å; V326-P330 WeakPolarHBondContact O-CA 3.4Å; V326-P330 VanDerWaalsContact O-N 3.15Å; V326-N334 HydrophobicContact CB-CB 4.35Å; V326-N334 HydrophobicContact CG2-CB 4.02Å; V326-L335 HydrophobicContact CG2-CB 4.46Å; V326-S338 WeakPolarHBondContact CB-OG 3.28Å
327F97.6Very high96.3Very high55 Ų5542.9 Ų42.924%0.24121%0.214CC..Hα-helixtrans-59.4-43.9172.8170-103.3000112.1C223 L226 G227 C230 C323 W324 H325C223-F327 HydrophobicContact CB-CB 4.07Å; C223-F327 WeakPolarHBondContact O-CA 3.23Å; L226-F327 HydrophobicContact CB-CD2 4.37Å; L226-F327 HydrophobicContact CB-CE2 4.42Å; L226-F327 HydrophobicContact CD2-CD2 4.32Å; L226-F327 HydrophobicContact CD2-CE2 3.97Å; L226-F327 HydrophobicContact CG-CD2 4.32Å; L226-F327 HydrophobicContact CG-CE2 3.91Å; G227-F327 VanDerWaalsContact CA-O 3.25Å; G227-F327 WeakPolarHBondContact CA-O 3.43Å; C230-F327 HydrophobicContact CB-CE2 4.41Å; C230-F327 HydrophobicContact CB-CZ 4.49Å; C323-F327 WeakPolarHBondContact O-CB 3.48Å; C323-F327 PolarHBondContact O-N 2.83Å; W324-F327 HydrophobicContact CE3-CD1 4.12Å; W324-F327 HydrophobicContact CZ3-CD1 4.04Å; W324-F327 HydrophobicContact CZ3-CE1 4.17Å; W324-F327 PolarHBondContact O-N 3.45Å; H325-F327 VanDerWaalsContact C-N 3.34Å; H325-F327 PolarHBondContact O-N 3.28Å
328R96.3Very high96.3Very high146 Ų14637.8 Ų37.855%0.55119%0.188SC*.Hα-helixtrans-72.3-34.1-179.8-69.5-168.679.31697.1113.2K231 W324 H325 V326K231-R328 WeakPolarHBondContact CE-O 3.3Å; K231-R328 PolarHBondContact NZ-O 3.13Å; W324-R328 HydrophobicContact CD2-CG 4.43Å; W324-R328 HydrophobicContact CZ2-CG 4.25Å; W324-R328 PolarHBondContact O-N 3.37Å; W324-R328 VanDerWaalsContact O-N 3.12Å; H325-R328 PolarHBondContact O-N 2.88Å; V326-R328 VanDerWaalsContact C-N 3.34Å; V326-R328 PolarHBondContact O-N 2.9Å
329N95.4Very high96.4Very high82 Ų8236.9 Ų36.944%0.43918%0.178SC..SBendtrans-13478.6-176.9-63.7-46.8000110.3H325 V326 S331 N334H325-N329 PolarHBondContact O-N 3.45Å; H325-N329 VanDerWaalsContact O-N 3.09Å; V326-N329 CarbonylContact O-C 3.07Å; V326-N329 VanDerWaalsContact O-C 3.24Å; V326-N329 PolarHBondContact O-N 3.31Å; N329-S331 PolarHBondContact O-N 3.02Å; N329-N334 PolarHBondContact O-ND2 3.21Å
330P96.1Very high96.5Very high30 Ų3036.3 Ų36.320%0.19518%0.176CC..  trans-76.987.2-174.232.4-37.1000111.1Y224 K228 K231 V326Y224-P330 HydrophobicContact CD2-CB 3.78Å; Y224-P330 HydrophobicContact CE2-CB 4Å; K228-P330 HydrophobicContact CG-CB 3.76Å; K228-P330 HydrophobicContact CG-CG 4.03Å; K231-P330 HydrophobicContact CG-CG 4.11Å; V326-P330 VanDerWaalsContact O-CA 3.27Å; V326-P330 WeakPolarHBondContact O-CA 3.4Å; V326-P330 VanDerWaalsContact O-N 3.15Å
331S94.9Very high96.5Very high25 Ų2530.3 Ų30.318%0.17515%0.146CC..  trans-113.8158.9168.568.70000110.3N329 T333 N334 L335N329-S331 PolarHBondContact O-N 3.02Å; S331-T333 VanDerWaalsContact C-N 3.31Å; S331-T333 PolarHBondContact O-N 3.21Å; S331-N334 PolarHBondContact O-N 3.11Å; S331-N334 WeakPolarHBondContact OG-CB 3.2Å; S331-N334 VanDerWaalsContact OG-CG 3.28Å; S331-N334 PolarHBondContact OG-N 2.98Å; S331-N334 PolarHBondContact OG-ND2 2.73Å; S331-L335 PolarHBondContact O-N 3.12Å
332T94.3Very high96.6Very high36 Ų3628.5 Ų28.522%0.22113%0.134CC..Hα-helixtrans-62.1-38.5178.951.10000111.9N334 L335 H336T332-N334 PolarHBondContact O-N 3.23Å; T332-L335 WeakPolarHBondContact O-CB 3.18Å; T332-L335 PolarHBondContact O-N 2.67Å; T332-H336 PolarHBondContact O-CD2 3.2Å; T332-H336 PolarHBondContact O-N 3.15Å
333T94.1Very high96.7Very high30 Ų3028.4 Ų28.418%0.18413%0.134CC..Hα-helixtrans-61-44.4172.7-53.80000112.4S331 L335 H336 L337 Y371 H487S331-T333 VanDerWaalsContact C-N 3.31Å; S331-T333 PolarHBondContact O-N 3.21Å; T333-L335 VanDerWaalsContact C-N 3.31Å; T333-L335 PolarHBondContact O-N 3.41Å; T333-H336 PolarHBondContact O-N 3.32Å; T333-L337 HydrophobicContact CG2-CD1 4.19Å; T333-L337 WeakPolarHBondContact O-CG 3.41Å; T333-L337 PolarHBondContact O-N 2.87Å; T333-Y371 HydrophobicContact CG2-CD1 3.91Å; T333-Y371 HydrophobicContact CG2-CD2 4.03Å; T333-Y371 HydrophobicContact CG2-CE1 3.65Å; T333-Y371 HydrophobicContact CG2-CE2 3.79Å; T333-Y371 HydrophobicContact CG2-CG 4.1Å; T333-H487 WeakPolarHBondContact CG2-CE1 3.29Å
334N95.5Very high96.7Very high7 Ų728 Ų284%0.03713%0.131CC..Hα-helixtrans-67.3-34.8176.6-73.3-22.1000111.6H325 V326 N329 S331 T332 S338 H487H325-N334 PolarHBondContact CE1-OD1 3.19Å; H325-N334 VanDerWaalsContact CE1-OD1 3.25Å; V326-N334 HydrophobicContact CB-CB 4.35Å; V326-N334 HydrophobicContact CG2-CB 4.02Å; N329-N334 PolarHBondContact O-ND2 3.21Å; S331-N334 PolarHBondContact O-N 3.11Å; S331-N334 WeakPolarHBondContact OG-CB 3.2Å; S331-N334 VanDerWaalsContact OG-CG 3.28Å; S331-N334 PolarHBondContact OG-N 2.98Å; S331-N334 PolarHBondContact OG-ND2 2.73Å; T332-N334 PolarHBondContact O-N 3.23Å; N334-S338 VanDerWaalsContact O-CB 3.27Å; N334-S338 WeakPolarHBondContact O-CB 3.43Å; N334-S338 PolarHBondContact O-N 3.23Å; N334-S338 PolarHBondContact O-OG 3.33Å; N334-S338 VanDerWaalsContact O-OG 3.07Å; N334-H487 PolarHBondContact OD1-NE2 2.85Å; N334-H487 VanDerWaalsContact OD1-NE2 3.11Å
335L97.6Very high96.8Very high1 Ų121.4 Ų21.41%0.00511%0.106CC..Hα-helixtrans-60-48.9171.7174.662.3000110.9F192 I221 Y224 V326 S331 T332 T333 L337 S338 L339F192-L335 HydrophobicContact CB-CD2 4.06Å; F192-L335 HydrophobicContact CD2-CD2 3.79Å; F192-L335 HydrophobicContact CE2-CD2 4.42Å; F192-L335 HydrophobicContact CG-CD2 3.94Å; I221-L335 HydrophobicContact CG1-CD1 4.14Å; Y224-L335 HydrophobicContact CD1-CD1 4.24Å; Y224-L335 HydrophobicContact CD1-CD2 3.86Å; Y224-L335 HydrophobicContact CD1-CG 4.48Å; Y224-L335 HydrophobicContact CD2-CB 3.88Å; Y224-L335 HydrophobicContact CD2-CD2 4.45Å; Y224-L335 HydrophobicContact CE1-CD2 3.91Å; Y224-L335 HydrophobicContact CE2-CB 4.17Å; Y224-L335 HydrophobicContact CE2-CD2 4.48Å; Y224-L335 HydrophobicContact CG-CB 4.15Å; Y224-L335 HydrophobicContact CG-CD1 3.96Å; Y224-L335 HydrophobicContact CG-CD2 4.15Å; Y224-L335 HydrophobicContact CG-CG 4.3Å; V326-L335 HydrophobicContact CG2-CB 4.46Å; S331-L335 PolarHBondContact O-N 3.12Å; T332-L335 WeakPolarHBondContact O-CB 3.18Å; T332-L335 PolarHBondContact O-N 2.67Å; T333-L335 VanDerWaalsContact C-N 3.31Å; T333-L335 PolarHBondContact O-N 3.41Å; L335-L337 PolarHBondContact O-N 3.29Å; L335-S338 PolarHBondContact O-N 2.79Å; L335-L339 HydrophobicContact CD1-CD1 3.87Å; L335-L339 HydrophobicContact CD1-CD2 4.46Å; L335-L339 HydrophobicContact CD1-CG 3.9Å; L335-L339 HydrophobicContact CG-CD1 3.75Å; L335-L339 HydrophobicContact CG-CG 4.27Å; L335-L339 WeakPolarHBondContact O-CB 3.36Å; L335-L339 WeakPolarHBondContact O-CD1 3.39Å; L335-L339 WeakPolarHBondContact O-CG 3.4Å; L335-L339 PolarHBondContact O-N 3.03Å
336H97.2Very high96.8Very high2 Ų221.8 Ų21.81%0.00911%0.108CC..Hα-helixtrans-59.5-47178.9-67.3-177.3000112.5Y141 E193 T332 T333 S338 L339 L340 C368 Y371Y141-H336 PolarHBondContact OH-CE1 3.2Å; E193-H336 IonicContact OE1-CE1 2.7Å; E193-H336 PolarHBondContact OE1-CE1 3.24Å; E193-H336 IonicContact OE1-ND1 2.84Å; E193-H336 IonicContact OE1-NE2 3.98Å; E193-H336 PolarHBondContact OE1-NE2 3.49Å; E193-H336 VanDerWaalsContact OE1-NE2 3.16Å; T332-H336 PolarHBondContact O-CD2 3.2Å; T332-H336 PolarHBondContact O-N 3.15Å; T333-H336 PolarHBondContact O-N 3.32Å; H336-S338 PolarHBondContact O-N 3.33Å; H336-L339 PolarHBondContact O-N 3.31Å; H336-L340 WeakPolarHBondContact O-CB 3.36Å; H336-L340 PolarHBondContact O-N 2.68Å; H336-C368 VanDerWaalsContact C-SG 3.53Å; H336-C368 PolarHBondContact O-SG 2.87Å; H336-C368 VanDerWaalsContact O-SG 3.42Å; H336-Y371 HydrophobicContact CB-CE2 3.87Å; H336-Y371 AromaticContact ND1-CE2 3.85Å; H336-Y371 AromaticContact ND1-CZ 3.99Å; H336-Y371 PolarHBondContact ND1-OH 3.47Å
337L96.8Very high96.9Very high2 Ų221.9 Ų21.91%0.0111%0.108CC..Hα-helixtrans-64.7-40.1178.6-68.4169.2000111.8T333 L335 L340 S341 Y371 Y480 I481T333-L337 HydrophobicContact CG2-CD1 4.19Å; T333-L337 WeakPolarHBondContact O-CG 3.41Å; T333-L337 PolarHBondContact O-N 2.87Å; L335-L337 PolarHBondContact O-N 3.29Å; L337-L340 PolarHBondContact O-N 2.9Å; L337-S341 PolarHBondContact O-N 3.05Å; L337-Y371 HydrophobicContact CD2-CD2 4.22Å; L337-Y371 HydrophobicContact CG-CD2 4.32Å; L337-Y480 HydrophobicContact CD1-CD1 4.09Å; L337-Y480 HydrophobicContact CD1-CE1 3.86Å; L337-Y480 HydrophobicContact CD2-CD1 4.18Å; L337-Y480 HydrophobicContact CD2-CE1 4.23Å; L337-I481 HydrophobicContact CB-CD1 3.95Å; L337-I481 HydrophobicContact CB-CG1 3.85Å; L337-I481 HydrophobicContact CD1-CG1 4.36Å
338S97.5Very high96.8Very high0 Ų019.5 Ų19.50%010%0.098CC..Hα-helixtrans-72.7-32.9177.3-65.60000113S322 V326 N334 L335 H336 L340 S342S322-S338 PolarHBondContact O-OG 3.03Å; V326-S338 WeakPolarHBondContact CB-OG 3.28Å; N334-S338 VanDerWaalsContact O-CB 3.27Å; N334-S338 WeakPolarHBondContact O-CB 3.43Å; N334-S338 PolarHBondContact O-N 3.23Å; N334-S338 PolarHBondContact O-OG 3.33Å; N334-S338 VanDerWaalsContact O-OG 3.07Å; L335-S338 PolarHBondContact O-N 2.79Å; H336-S338 PolarHBondContact O-N 3.33Å; S338-L340 VanDerWaalsContact C-N 3.31Å; S338-S342 WeakPolarHBondContact O-CB 3.48Å; S338-S342 PolarHBondContact O-N 3.28Å
339L98.4Very high96.8Very high0 Ų013.2 Ų13.20%08%0.076CC..Hα-helixtrans-61.1-43.4170.4-76.5164.4000110.9F185 I189 H217 A220 I221 L335 H336 S343 P364F185-L339 HydrophobicContact CE2-CD1 4.29Å; F185-L339 HydrophobicContact CE2-CD2 3.92Å; F185-L339 HydrophobicContact CZ-CD1 3.99Å; F185-L339 HydrophobicContact CZ-CD2 4.06Å; I189-L339 HydrophobicContact CD1-CD1 3.57Å; H217-L339 HydrophobicContact CB-CD2 3.58Å; A220-L339 HydrophobicContact CB-CD2 4.14Å; A220-L339 HydrophobicContact CB-CG 4.26Å; I221-L339 HydrophobicContact CD1-CD2 4.13Å; I221-L339 HydrophobicContact CG1-CD2 3.9Å; L335-L339 HydrophobicContact CD1-CD1 3.87Å; L335-L339 HydrophobicContact CD1-CD2 4.46Å; L335-L339 HydrophobicContact CD1-CG 3.9Å; L335-L339 HydrophobicContact CG-CD1 3.75Å; L335-L339 HydrophobicContact CG-CG 4.27Å; L335-L339 WeakPolarHBondContact O-CB 3.36Å; L335-L339 WeakPolarHBondContact O-CD1 3.39Å; L335-L339 WeakPolarHBondContact O-CG 3.4Å; L335-L339 PolarHBondContact O-N 3.03Å; H336-L339 PolarHBondContact O-N 3.31Å; L339-S343 VanDerWaalsContact O-CB 3.3Å; L339-S343 WeakPolarHBondContact O-CB 3.28Å; L339-S343 PolarHBondContact O-N 3.34Å; L339-S343 PolarHBondContact O-OG 3.16Å; L339-P364 HydrophobicContact CB-CB 3.95Å; L339-P364 HydrophobicContact CB-CG 3.93Å
340L98.1Very high96.7Very high0 Ų09.9 Ų9.90%06%0.059CC..Hα-helixtrans-63.5-53.1177.6178.556.7000112.1H336 L337 S338 S343 L344 V361 P364 A365 C368 F473 I477H336-L340 WeakPolarHBondContact O-CB 3.36Å; H336-L340 PolarHBondContact O-N 2.68Å; L337-L340 PolarHBondContact O-N 2.9Å; S338-L340 VanDerWaalsContact C-N 3.31Å; L340-S343 PolarHBondContact O-OG 3.46Å; L340-S343 VanDerWaalsContact O-OG 3.11Å; L340-L344 VanDerWaalsContact O-CB 3.26Å; L340-L344 WeakPolarHBondContact O-CB 3.45Å; L340-L344 PolarHBondContact O-N 3.31Å; L340-V361 HydrophobicContact CD1-CG1 3.89Å; L340-P364 HydrophobicContact CB-CB 3.83Å; L340-P364 HydrophobicContact CD1-CB 4.31Å; L340-A365 HydrophobicContact CD1-CB 3.75Å; L340-C368 HydrophobicContact CD2-CB 3.89Å; L340-F473 HydrophobicContact CD1-CE1 3.98Å; L340-F473 HydrophobicContact CD2-CE1 4Å; L340-F473 HydrophobicContact CD2-CZ 3.81Å; L340-F473 HydrophobicContact CG-CE1 4.23Å; L340-I477 HydrophobicContact CD2-CD1 3.9Å; L340-I477 HydrophobicContact CD2-CG1 4.02Å; L340-I477 HydrophobicContact CD2-CG2 4.3Å; L340-I477 HydrophobicContact CG-CG2 4.46Å
341S97.8Very high96.3Very high0 Ų010.4 Ų10.40%06%0.057CC..Hα-helixtrans-65-41.9178.7164.90000112.1S322 L337 L344 S345 E474S322-S341 WeakPolarHBondContact CB-OG 3.37Å; S322-S341 PolarHBondContact OG-OG 3.16Å; S322-S341 VanDerWaalsContact OG-OG 3.09Å; L337-S341 PolarHBondContact O-N 3.05Å; S341-L344 PolarHBondContact O-N 3.42Å; S341-S345 VanDerWaalsContact O-CB 3.23Å; S341-S345 WeakPolarHBondContact O-CB 3.33Å; S341-S345 PolarHBondContact O-N 3.09Å; S341-S345 PolarHBondContact O-OG 3.27Å; S341-E474 WeakPolarHBondContact CA-OE2 3.36Å; S341-E474 PolarHBondContact OG-OE1 2.97Å
342S98.1Very high95.9Very high0 Ų09.9 Ų9.90%05%0.052CC..Hα-helixtrans-58.6-55.5177.5-178.30000110.8Y216 S338 L344 S345 F346Y216-S342 PolarHBondContact O-OG 2.94Å; S338-S342 WeakPolarHBondContact O-CB 3.48Å; S338-S342 PolarHBondContact O-N 3.28Å; S342-L344 VanDerWaalsContact C-N 3.33Å; S342-L344 PolarHBondContact O-N 3.46Å; S342-S345 PolarHBondContact O-N 2.97Å; S342-F346 VanDerWaalsContact O-CD2 3.3Å; S342-F346 WeakPolarHBondContact O-CD2 3.41Å; S342-F346 PolarHBondContact O-N 3.12Å
343S98.3Very high95.7Very high0 Ų08.2 Ų8.20%04%0.042CC..Hα-helixtrans-63.1-38-177.758.60000113Y216 L339 L340 F346 F347 V361Y216-S343 PolarHBondContact O-N 3.43Å; L339-S343 VanDerWaalsContact O-CB 3.3Å; L339-S343 WeakPolarHBondContact O-CB 3.28Å; L339-S343 PolarHBondContact O-N 3.34Å; L339-S343 PolarHBondContact O-OG 3.16Å; L340-S343 PolarHBondContact O-OG 3.46Å; L340-S343 VanDerWaalsContact O-OG 3.11Å; S343-F346 PolarHBondContact O-N 3.31Å; S343-F347 WeakPolarHBondContact O-CB 3.45Å; S343-F347 PolarHBondContact O-N 2.9Å; S343-V361 WeakPolarHBondContact O-CG2 3.3Å
344L98.1Very high95.5Very high0 Ų08.2 Ų8.20%04%0.04CC..Hα-helixtrans-69-41.1177.1-176.450.3000112.3L340 S341 S342 F346 F347 L348 V361 F379 F470 F473 E474L340-L344 VanDerWaalsContact O-CB 3.26Å; L340-L344 WeakPolarHBondContact O-CB 3.45Å; L340-L344 PolarHBondContact O-N 3.31Å; S341-L344 PolarHBondContact O-N 3.42Å; S342-L344 VanDerWaalsContact C-N 3.33Å; S342-L344 PolarHBondContact O-N 3.46Å; L344-F346 VanDerWaalsContact C-N 3.34Å; L344-F346 PolarHBondContact O-N 2.83Å; L344-F347 PolarHBondContact O-N 3.23Å; L344-L348 HydrophobicContact CD1-CD1 3.92Å; L344-L348 HydrophobicContact CD1-CG 3.93Å; L344-L348 HydrophobicContact CG-CD1 3.95Å; L344-L348 HydrophobicContact CG-CG 4.42Å; L344-L348 WeakPolarHBondContact O-CB 3.09Å; L344-L348 WeakPolarHBondContact O-CG 3.47Å; L344-L348 PolarHBondContact O-N 3.21Å; L344-V361 HydrophobicContact CB-CG1 3.65Å; L344-V361 HydrophobicContact CD1-CG1 4.05Å; L344-V361 HydrophobicContact CG-CG1 4.29Å; L344-F379 HydrophobicContact CD1-CE2 4.05Å; L344-F379 HydrophobicContact CD2-CE2 4.37Å; L344-F470 HydrophobicContact CD1-CB 4.12Å; L344-F473 HydrophobicContact CD2-CD1 3.55Å; L344-F473 HydrophobicContact CD2-CE1 4.21Å; L344-E474 WeakPolarHBondContact CB-OE2 3.2Å; L344-E474 HydrophobicContact CD2-CB 3.7Å; L344-E474 HydrophobicContact CD2-CG 4.5Å; L344-E474 WeakPolarHBondContact CD2-OE2 3.46Å; L344-E474 HydrophobicContact CG-CB 4.01Å; L344-E474 HydrophobicContact CG-CG 4.45Å
345S98Very high95.3Very high4 Ų48.7 Ų8.73%0.0284%0.042CC..Hα-helixtrans-60.3-41.8172.5-83.90000112.1G318 S341 S342 C349 E474G318-S345 VanDerWaalsContact C-OG 3.25Å; G318-S345 WeakPolarHBondContact CA-OG 3.13Å; G318-S345 PolarHBondContact O-OG 3.11Å; S341-S345 VanDerWaalsContact O-CB 3.23Å; S341-S345 WeakPolarHBondContact O-CB 3.33Å; S341-S345 PolarHBondContact O-N 3.09Å; S341-S345 PolarHBondContact O-OG 3.27Å; S342-S345 PolarHBondContact O-N 2.97Å; S345-C349 VanDerWaalsContact O-CB 3.3Å; S345-C349 WeakPolarHBondContact O-CB 3.13Å; S345-C349 PolarHBondContact O-N 3.4Å; S345-E474 PolarHBondContact OG-OE1 3.5Å
346F97.2Very high95.2Very high38 Ų389.9 Ų9.917%0.1675%0.047CC..Hα-helixtrans-61.9-46.9171-88.6-84.9000111.9Y216 P219 T315 I319 S342 S343 L344 L348 S350Y216-F346 HydrophobicContact CD1-CB 3.62Å; Y216-F346 AromaticContact CD1-CD1 3.78Å; Y216-F346 HydrophobicContact CD1-CD1 3.78Å; Y216-F346 AromaticContact CD1-CG 3.74Å; Y216-F346 HydrophobicContact CD1-CG 3.74Å; Y216-F346 HydrophobicContact CD2-CB 3.52Å; Y216-F346 HydrophobicContact CD2-CG 4.44Å; Y216-F346 HydrophobicContact CE1-CB 3.86Å; Y216-F346 AromaticContact CE1-CD1 3.98Å; Y216-F346 HydrophobicContact CE1-CD1 3.98Å; Y216-F346 HydrophobicContact CE1-CG 4.2Å; Y216-F346 HydrophobicContact CE2-CB 3.76Å; Y216-F346 HydrophobicContact CG-CB 3.46Å; Y216-F346 VanDerWaalsContact CG-CB 3.46Å; Y216-F346 HydrophobicContact CG-CD1 4.41Å; Y216-F346 HydrophobicContact CG-CD2 4.45Å; Y216-F346 AromaticContact CG-CG 3.9Å; Y216-F346 HydrophobicContact CG-CG 3.9Å; P219-F346 HydrophobicContact CG-CE2 3.89Å; P219-F346 HydrophobicContact CG-CZ 4.16Å; T315-F346 HydrophobicContact CG2-CB 4.48Å; T315-F346 HydrophobicContact CG2-CD1 3.64Å; T315-F346 HydrophobicContact CG2-CD2 4.1Å; T315-F346 HydrophobicContact CG2-CE1 3.77Å; T315-F346 HydrophobicContact CG2-CE2 4.22Å; T315-F346 HydrophobicContact CG2-CG 3.81Å; T315-F346 HydrophobicContact CG2-CZ 4.06Å; I319-F346 HydrophobicContact CD1-CE2 4.12Å; I319-F346 HydrophobicContact CD1-CZ 4.48Å; I319-F346 HydrophobicContact CG2-CD2 4.05Å; I319-F346 HydrophobicContact CG2-CE2 4Å; S342-F346 VanDerWaalsContact O-CD2 3.3Å; S342-F346 WeakPolarHBondContact O-CD2 3.41Å; S342-F346 PolarHBondContact O-N 3.12Å; S343-F346 PolarHBondContact O-N 3.31Å; L344-F346 VanDerWaalsContact C-N 3.34Å; L344-F346 PolarHBondContact O-N 2.83Å; F346-L348 VanDerWaalsContact C-N 3.32Å; F346-L348 PolarHBondContact O-N 3.46Å; F346-S350 WeakPolarHBondContact O-CB 3.36Å; F346-S350 PolarHBondContact O-N 3.48Å; F346-S350 PolarHBondContact O-OG 2.94Å
347F97Very high95.1Very high1 Ų110.3 Ų10.30%0.0045%0.05CC..Hα-helixtrans-60.8-40.1179.4-177.7-90.2000112.6Y216 V285 A286 N287 S343 L344 V353 S357 I358 V361 F470Y216-F347 HydrophobicContact CE2-CB 4.3Å; V285-F347 HydrophobicContact CG1-CE1 4.44Å; V285-F347 HydrophobicContact CG1-CE2 4.15Å; V285-F347 HydrophobicContact CG1-CZ 3.73Å; A286-F347 HydrophobicContact CB-CE1 4.35Å; A286-F347 WeakPolarHBondContact O-CE1 3.24Å; N287-F347 VanDerWaalsContact CB-O 3.26Å; N287-F347 WeakPolarHBondContact CB-O 3.41Å; S343-F347 WeakPolarHBondContact O-CB 3.45Å; S343-F347 PolarHBondContact O-N 2.9Å; L344-F347 PolarHBondContact O-N 3.23Å; F347-V353 HydrophobicContact CD2-CG1 3.65Å; F347-V353 HydrophobicContact CE2-CG1 3.76Å; F347-V353 HydrophobicContact CG-CG1 4.26Å; F347-V353 HydrophobicContact CZ-CG1 4.47Å; F347-S357 VanDerWaalsContact CD2-OG 3.28Å; F347-S357 WeakPolarHBondContact CD2-OG 3.48Å; F347-S357 WeakPolarHBondContact CE2-OG 3.4Å; F347-I358 HydrophobicContact CD1-CD1 3.93Å; F347-I358 HydrophobicContact CD2-CB 4.32Å; F347-I358 HydrophobicContact CD2-CD1 4.14Å; F347-I358 HydrophobicContact CE1-CD1 3.77Å; F347-I358 HydrophobicContact CE2-CB 3.72Å; F347-I358 HydrophobicContact CE2-CD1 4Å; F347-I358 HydrophobicContact CE2-CG1 4.41Å; F347-I358 HydrophobicContact CG-CD1 4.12Å; F347-I358 HydrophobicContact CZ-CB 4Å; F347-I358 HydrophobicContact CZ-CD1 3.81Å; F347-I358 HydrophobicContact CZ-CG1 4.33Å; F347-V361 HydrophobicContact CB-CG2 3.77Å; F347-V361 HydrophobicContact CG-CG2 4.26Å; F347-F470 HydrophobicContact CD1-CD2 4.23Å; F347-F470 HydrophobicContact CD1-CE2 4.48Å; F347-F470 AromaticContact CE1-CD2 3.77Å; F347-F470 HydrophobicContact CE1-CD2 3.77Å; F347-F470 AromaticContact CE1-CE2 3.7Å; F347-F470 HydrophobicContact CE1-CE2 3.7Å; F347-F470 HydrophobicContact CZ-CE2 4.3Å
348L96.9Very high95.1Very high6 Ų610.2 Ų10.23%0.0315%0.049CC..Hα-helixtrans-75.9-40.4-178.2-74.1172.9000113.2L288 L344 F346 F470 V471 E474L288-L348 WeakPolarHBondContact CB-O 3.4Å; L288-L348 HydrophobicContact CD1-CB 4.28Å; L288-L348 HydrophobicContact CG-CB 4.23Å; L288-L348 HydrophobicContact CG-CD2 4.44Å; L288-L348 PolarHBondContact N-O 3.26Å; L344-L348 HydrophobicContact CD1-CD1 3.92Å; L344-L348 HydrophobicContact CD1-CG 3.93Å; L344-L348 HydrophobicContact CG-CD1 3.95Å; L344-L348 HydrophobicContact CG-CG 4.42Å; L344-L348 WeakPolarHBondContact O-CB 3.09Å; L344-L348 WeakPolarHBondContact O-CG 3.47Å; L344-L348 PolarHBondContact O-N 3.21Å; F346-L348 VanDerWaalsContact C-N 3.32Å; F346-L348 PolarHBondContact O-N 3.46Å; L348-F470 HydrophobicContact CD2-CB 3.88Å; L348-V471 HydrophobicContact CD1-CG2 4.15Å; L348-V471 HydrophobicContact CD2-CG2 4.01Å; L348-E474 HydrophobicContact CD1-CB 4.05Å; L348-E474 HydrophobicContact CD1-CG 4.43Å
349C95.7Very high95.2Very high14 Ų1410.3 Ų10.310%0.0955%0.05CC..Hα-helixtrans-116.4-12.6-164.1-57.90000114.8L288 W289 C311 T315 S345L288-C349 VanDerWaalsContact CD1-SG 3.55Å; W289-C349 HydrophobicContact CZ2-CB 4.46Å; W289-C349 WeakPolarHBondContact CZ2-O 3.48Å; W289-C349 PolarHBondContact NE1-O 3Å; C311-C349 WeakPolarHBondContact CA-O 3.25Å; C311-C349 WeakPolarHBondContact CB-O 3.4Å; T315-C349 WeakPolarHBondContact OG1-CB 3.48Å; T315-C349 PolarHBondContact OG1-O 3.24Å; S345-C349 VanDerWaalsContact O-CB 3.3Å; S345-C349 WeakPolarHBondContact O-CB 3.13Å; S345-C349 PolarHBondContact O-N 3.4Å
350S92.9Very high95.1Very high11 Ų1110.8 Ų10.88%0.0775%0.052CC..SBendtrans-75.9163.6-175.472.90000112.8Y216 W289 T315 F346 V353Y216-S350 PolarHBondContact OH-OG 3.2Å; W289-S350 PolarHBondContact NE1-O 3.41Å; T315-S350 WeakPolarHBondContact OG1-CA 3.4Å; T315-S350 PolarHBondContact OG1-N 2.87Å; F346-S350 WeakPolarHBondContact O-CB 3.36Å; F346-S350 PolarHBondContact O-N 3.48Å; F346-S350 PolarHBondContact O-OG 2.94Å; S350-V353 WeakPolarHBondContact OG-CG2 3.31Å
351Y88.7Confident95.2Very high41 Ų4110.8 Ų10.816%0.1615%0.052CC..SBendtrans-82.1135.7173.9-173.1-87.8000109.5V276 G279 L280 L307 L308V276-Y351 PolarHBondContact O-OH 3.1Å; V276-Y351 VanDerWaalsContact O-OH 3.05Å; G279-Y351 VanDerWaalsContact C-CZ 3.48Å; G279-Y351 VanDerWaalsContact C-OH 3.29Å; G279-Y351 WeakPolarHBondContact CA-OH 3.48Å; G279-Y351 PolarHBondContact N-OH 3.38Å; G279-Y351 WeakPolarHBondContact O-CE1 3.27Å; G279-Y351 VanDerWaalsContact O-CZ 3.31Å; G279-Y351 PolarHBondContact O-OH 3.29Å; L280-Y351 HydrophobicContact CB-CE2 4.42Å; L280-Y351 HydrophobicContact CD1-CD2 3.4Å; L280-Y351 HydrophobicContact CD1-CE2 3.76Å; L280-Y351 HydrophobicContact CD1-CG 4.31Å; L307-Y351 HydrophobicContact CB-CE2 4.46Å; L308-Y351 HydrophobicContact CD2-CD1 3.53Å; L308-Y351 HydrophobicContact CD2-CD2 3.58Å; L308-Y351 HydrophobicContact CD2-CE1 3.85Å; L308-Y351 HydrophobicContact CD2-CE2 3.88Å; L308-Y351 HydrophobicContact CD2-CG 3.4Å; L308-Y351 VanDerWaalsContact CD2-CG 3.4Å; L308-Y351 HydrophobicContact CG-CD2 4.11Å; L308-Y351 HydrophobicContact CG-CE2 4.13Å; L308-Y351 HydrophobicContact CG-CG 4.41Å
352H86.1Confident95.2Very high15 Ų1510.8 Ų10.87%0.0695%0.052CC..SBendtrans63.264.3175.5-165.5-114.5000113.6R278 G279 L280 H354R278-H352 VanDerWaalsContact CB-NE2 3.26Å; R278-H352 WeakPolarHBondContact CB-NE2 3.5Å; G279-H352 PolarHBondContact O-CD2 3.45Å; L280-H352 WeakPolarHBondContact O-CA 3.49Å; L280-H352 PolarHBondContact O-N 2.93Å; H352-H354 AromaticContact CE1-CE1 3.78Å; H352-H354 AromaticContact CE1-NE2 3.22Å; H352-H354 PolarHBondContact CE1-NE2 3.08Å; H352-H354 AromaticContact ND1-NE2 3.71Å; H352-H354 AromaticContact NE2-NE2 3.85Å
353V89.7Confident95.2Very high0 Ų010.8 Ų10.80%05%0.053CC..EExtended strand (participates in β ladder)trans-92.4142.2174.6-1730000110.1E282 V285 F347 S350 S357E282-V353 PolarHBondContact N-O 3.05Å; E282-V353 VanDerWaalsContact N-O 3.13Å; V285-V353 HydrophobicContact CG1-CB 4.42Å; V285-V353 HydrophobicContact CG1-CG1 3.94Å; F347-V353 HydrophobicContact CD2-CG1 3.65Å; F347-V353 HydrophobicContact CE2-CG1 3.76Å; F347-V353 HydrophobicContact CG-CG1 4.26Å; F347-V353 HydrophobicContact CZ-CG1 4.47Å; S350-V353 WeakPolarHBondContact OG-CG2 3.31Å; V353-S357 VanDerWaalsContact CG1-OG 3.24Å; V353-S357 WeakPolarHBondContact CG1-OG 3.46Å
354H90.3Very high95.2Very high30 Ų3010.8 Ų10.814%0.1395%0.053CC..EExtended strand (participates in β ladder)trans-107148.1173.1-63.7-99.5000110.7E282 H352 K356 S357E282-H354 WeakPolarHBondContact CB-ND1 3.46Å; E282-H354 IonicContact OE1-CE1 3.09Å; E282-H354 PolarHBondContact OE1-CE1 3.43Å; E282-H354 IonicContact OE1-ND1 3.85Å; E282-H354 IonicContact OE2-CE1 3.55Å; E282-H354 PolarHBondContact OE2-CE1 3.4Å; E282-H354 IonicContact OE2-CG 2.81Å; E282-H354 IonicContact OE2-ND1 3.47Å; E282-H354 PolarHBondContact OE2-ND1 3.47Å; H352-H354 AromaticContact CE1-CE1 3.78Å; H352-H354 AromaticContact CE1-NE2 3.22Å; H352-H354 PolarHBondContact CE1-NE2 3.08Å; H352-H354 AromaticContact ND1-NE2 3.71Å; H352-H354 AromaticContact NE2-NE2 3.85Å; H354-K356 PolarHBondContact O-N 3.15Å; H354-S357 WeakPolarHBondContact O-CB 3.48Å; H354-S357 PolarHBondContact O-N 2.85Å; H354-S357 PolarHBondContact O-OG 3.35Å
355E91.7Very high95.2Very high18 Ų1810.8 Ų10.88%0.0845%0.053CC..G310 helixtrans-54.4-40177.268-168170.100112.6V285 S357 I358 L387 L390V285-E355 HydrophobicContact CG2-CB 4.33Å; E355-S357 PolarHBondContact O-N 2.95Å; E355-I358 VanDerWaalsContact O-CG2 3.28Å; E355-I358 WeakPolarHBondContact O-CG2 3.36Å; E355-I358 PolarHBondContact O-N 2.92Å; E355-L387 HydrophobicContact CG-CD2 4.46Å; E355-L390 HydrophobicContact CG-CD2 4.45Å; E355-L390 WeakPolarHBondContact OE1-CB 3.3Å; E355-L390 VanDerWaalsContact OE1-CD1 3.22Å; E355-L390 WeakPolarHBondContact OE1-CD1 3.43Å
356K94.6Very high95.1Very high26 Ų2610.7 Ų10.711%0.1135%0.052CC..G310 helixtrans-65.2-21.7179-63.4176.4-70.8-132.70113.5D47 V170 H174 H354 I358 L359 L390D47-K356 IonicContact OD2-NZ 3.36Å; D47-K356 PolarHBondContact OD2-NZ 3.12Å; V170-K356 HydrophobicContact CG1-CB 4.34Å; V170-K356 HydrophobicContact CG1-CD 3.99Å; V170-K356 HydrophobicContact CG1-CG 4.08Å; V170-K356 HydrophobicContact CG2-CG 4.45Å; H174-K356 PolarHBondContact NE2-NZ 2.99Å; H354-K356 PolarHBondContact O-N 3.15Å; K356-I358 PolarHBondContact O-N 2.67Å; K356-I358 VanDerWaalsContact O-N 3.15Å; K356-L359 WeakPolarHBondContact O-CG 3.21Å; K356-L359 PolarHBondContact O-N 3.37Å; K356-L390 HydrophobicContact CD-CD2 4.05Å; K356-L390 HydrophobicContact CG-CD2 3.73Å
357S95.3Very high95.1Very high10 Ų108.9 Ų8.97%0.074%0.044CC..G310 helixtrans-68.6-10.8-179.769.60000113.2F347 V353 H354 E355 L359 L360F347-S357 VanDerWaalsContact CD2-OG 3.28Å; F347-S357 WeakPolarHBondContact CD2-OG 3.48Å; F347-S357 WeakPolarHBondContact CE2-OG 3.4Å; V353-S357 VanDerWaalsContact CG1-OG 3.24Å; V353-S357 WeakPolarHBondContact CG1-OG 3.46Å; H354-S357 WeakPolarHBondContact O-CB 3.48Å; H354-S357 PolarHBondContact O-N 2.85Å; H354-S357 PolarHBondContact O-OG 3.35Å; E355-S357 PolarHBondContact O-N 2.95Å; S357-L359 PolarHBondContact O-N 3.36Å; S357-L359 VanDerWaalsContact O-N 3.09Å; S357-L360 VanDerWaalsContact O-CB 3.31Å; S357-L360 WeakPolarHBondContact O-CB 3.42Å; S357-L360 PolarHBondContact O-N 3.45Å
358I97.3Very high95Very high0 Ų08.9 Ų8.90%04%0.044CC..Hα-helixtrans-58.7-22.5173-16459.4000112.6F347 E355 K356 L360 V361 A362 F379 S383 L387 F470F347-I358 HydrophobicContact CD1-CD1 3.93Å; F347-I358 HydrophobicContact CD2-CB 4.32Å; F347-I358 HydrophobicContact CD2-CD1 4.14Å; F347-I358 HydrophobicContact CE1-CD1 3.77Å; F347-I358 HydrophobicContact CE2-CB 3.72Å; F347-I358 HydrophobicContact CE2-CD1 4Å; F347-I358 HydrophobicContact CE2-CG1 4.41Å; F347-I358 HydrophobicContact CG-CD1 4.12Å; F347-I358 HydrophobicContact CZ-CB 4Å; F347-I358 HydrophobicContact CZ-CD1 3.81Å; F347-I358 HydrophobicContact CZ-CG1 4.33Å; E355-I358 VanDerWaalsContact O-CG2 3.28Å; E355-I358 WeakPolarHBondContact O-CG2 3.36Å; E355-I358 PolarHBondContact O-N 2.92Å; K356-I358 PolarHBondContact O-N 2.67Å; K356-I358 VanDerWaalsContact O-N 3.15Å; I358-L360 PolarHBondContact O-N 2.98Å; I358-V361 HydrophobicContact CD1-CB 4.26Å; I358-V361 HydrophobicContact CD1-CG2 4.26Å; I358-V361 PolarHBondContact O-N 3.48Å; I358-V361 VanDerWaalsContact O-N 3.08Å; I358-A362 PolarHBondContact O-N 2.76Å; I358-F379 HydrophobicContact CD1-CE2 4.16Å; I358-F379 HydrophobicContact CD1-CZ 3.74Å; I358-F379 HydrophobicContact CG1-CZ 4.41Å; I358-S383 VanDerWaalsContact CG1-CB 3.49Å; I358-L387 HydrophobicContact CG2-CD1 4.19Å; I358-L387 HydrophobicContact CG2-CD2 4.07Å; I358-L387 HydrophobicContact CG2-CG 4.21Å; I358-F470 HydrophobicContact CD1-CD2 4.27Å; I358-F470 HydrophobicContact CD1-CE1 4.41Å; I358-F470 HydrophobicContact CD1-CE2 3.65Å; I358-F470 HydrophobicContact CD1-CZ 3.76Å; I358-F470 HydrophobicContact CG1-CE2 4.32Å; I358-F470 HydrophobicContact CG1-CZ 4.11Å
359L98.2Very high94.7Very high2 Ų28.7 Ų8.71%0.014%0.043CC..Hα-helixtrans-63-30.1174.5-58.6-176.3000113.1Y164 G166 Y167 V170 N178 L182 K356 S357 V361 A362 T363 L387Y164-L359 HydrophobicContact CE1-CD2 3.81Å; G166-L359 VanDerWaalsContact C-CD2 3.42Å; Y167-L359 HydrophobicContact CD1-CD1 4.35Å; Y167-L359 HydrophobicContact CD1-CD2 4.09Å; Y167-L359 HydrophobicContact CE1-CB 4.3Å; Y167-L359 HydrophobicContact CE1-CD2 4.39Å; V170-L359 HydrophobicContact CB-CD1 3.83Å; V170-L359 HydrophobicContact CG1-CD1 3.99Å; V170-L359 HydrophobicContact CG2-CD1 3.96Å; N178-L359 HydrophobicContact CB-CD1 4.25Å; L182-L359 HydrophobicContact CD1-CB 3.96Å; K356-L359 WeakPolarHBondContact O-CG 3.21Å; K356-L359 PolarHBondContact O-N 3.37Å; S357-L359 PolarHBondContact O-N 3.36Å; S357-L359 VanDerWaalsContact O-N 3.09Å; L359-V361 PolarHBondContact O-N 2.77Å; L359-A362 PolarHBondContact O-N 2.91Å; L359-T363 PolarHBondContact O-N 2.64Å; L359-T363 VanDerWaalsContact O-N 3.12Å; L359-T363 PolarHBondContact O-OG1 3.03Å; L359-L387 HydrophobicContact CD2-CD1 4.49Å
360L98Very high94.3Very high10 Ų1010.4 Ų10.45%0.0525%0.049CC..Hα-helixtrans-63.6-35.8174.3-63.5162.1000110.3L182 M213 E214 Y216 H217 S357 I358 P364L182-L360 HydrophobicContact CD2-CD2 3.83Å; M213-L360 HydrophobicContact CB-CD1 3.52Å; M213-L360 WeakPolarHBondContact O-CD1 3.42Å; E214-L360 HydrophobicContact CG-CD2 4.47Å; Y216-L360 HydrophobicContact CD2-CB 4.28Å; Y216-L360 HydrophobicContact CD2-CD1 3.82Å; Y216-L360 HydrophobicContact CE2-CD1 4.11Å; Y216-L360 HydrophobicContact CG-CD1 4.12Å; H217-L360 PolarHBondContact CE1-O 3.37Å; H217-L360 PolarHBondContact NE2-O 3.38Å; S357-L360 VanDerWaalsContact O-CB 3.31Å; S357-L360 WeakPolarHBondContact O-CB 3.42Å; S357-L360 PolarHBondContact O-N 3.45Å; I358-L360 PolarHBondContact O-N 2.98Å; L360-P364 WeakPolarHBondContact O-CD 3.32Å
361V98.5Very high94Very high0 Ų011.3 Ų11.30%05%0.052CC..Hα-helixtrans-81.1-36.8177.1-167.30000112L340 S343 L344 F347 I358 L359 T363 P364 A365 F379L340-V361 HydrophobicContact CD1-CG1 3.89Å; S343-V361 WeakPolarHBondContact O-CG2 3.3Å; L344-V361 HydrophobicContact CB-CG1 3.65Å; L344-V361 HydrophobicContact CD1-CG1 4.05Å; L344-V361 HydrophobicContact CG-CG1 4.29Å; F347-V361 HydrophobicContact CB-CG2 3.77Å; F347-V361 HydrophobicContact CG-CG2 4.26Å; I358-V361 HydrophobicContact CD1-CB 4.26Å; I358-V361 HydrophobicContact CD1-CG2 4.26Å; I358-V361 PolarHBondContact O-N 3.48Å; I358-V361 VanDerWaalsContact O-N 3.08Å; L359-V361 PolarHBondContact O-N 2.77Å; V361-T363 PolarHBondContact O-N 2.64Å; V361-P364 WeakPolarHBondContact O-CD 3.29Å; V361-A365 WeakPolarHBondContact O-CB 3.17Å; V361-A365 PolarHBondContact O-N 3.33Å; V361-F379 HydrophobicContact CB-CE1 4.29Å; V361-F379 HydrophobicContact CB-CZ 3.74Å; V361-F379 HydrophobicContact CG1-CE1 3.89Å; V361-F379 HydrophobicContact CG1-CE2 4.03Å; V361-F379 HydrophobicContact CG1-CZ 3.32Å
362A98.5Very high93.9Very high0 Ų09.5 Ų9.50%05%0.045CC..Hα-helixtrans-60.4-35.3178.400000112.2Y164 I358 L359 A365 L366 L380Y164-A362 HydrophobicContact CD1-CB 4.28Å; Y164-A362 HydrophobicContact CE1-CB 3.48Å; Y164-A362 VanDerWaalsContact CE1-CB 3.48Å; I358-A362 PolarHBondContact O-N 2.76Å; L359-A362 PolarHBondContact O-N 2.91Å; A362-A365 WeakPolarHBondContact O-CB 3.47Å; A362-A365 PolarHBondContact O-N 3.49Å; A362-L366 VanDerWaalsContact O-CG 3.31Å; A362-L366 WeakPolarHBondContact O-CG 3.24Å; A362-L366 PolarHBondContact O-N 3.14Å; A362-L380 HydrophobicContact CB-CD2 4.03Å
363T98.2Very high94Very high1 Ų19.9 Ų9.91%0.0065%0.048CC..Hα-helixtrans-63.2-55.8-178.8-45.40000112Y167 F185 M186 L359 V361 A365 L366 L367Y167-T363 WeakPolarHBondContact OH-CA 3.34Å; Y167-T363 WeakPolarHBondContact OH-CB 3.29Å; Y167-T363 WeakPolarHBondContact OH-CG2 3.12Å; Y167-T363 PolarHBondContact OH-OG1 2.83Å; F185-T363 HydrophobicContact CD1-CG2 3.92Å; F185-T363 HydrophobicContact CE1-CG2 3.8Å; M186-T363 HydrophobicContact CG-CG2 4.21Å; M186-T363 HydrophobicContact SD-CG2 3.79Å; L359-T363 PolarHBondContact O-N 2.64Å; L359-T363 VanDerWaalsContact O-N 3.12Å; L359-T363 PolarHBondContact O-OG1 3.03Å; V361-T363 PolarHBondContact O-N 2.64Å; T363-A365 VanDerWaalsContact C-N 3.29Å; T363-A365 PolarHBondContact O-N 3.35Å; T363-L366 WeakPolarHBondContact O-CB 3.25Å; T363-L366 PolarHBondContact O-N 3.19Å; T363-L367 WeakPolarHBondContact O-CG 3.15Å; T363-L367 PolarHBondContact O-N 2.97Å
364P98.1Very high93.9Very high0 Ų010.9 Ų10.90%05%0.054CC..Hα-helixtrans-60.9-32.2170.5-2434.5000114.3F185 H217 L339 L340 L360 V361 L366 L367 C368F185-P364 HydrophobicContact CE1-CG 4.45Å; F185-P364 HydrophobicContact CZ-CG 4.34Å; H217-P364 WeakPolarHBondContact NE2-CG 3.28Å; L339-P364 HydrophobicContact CB-CB 3.95Å; L339-P364 HydrophobicContact CB-CG 3.93Å; L340-P364 HydrophobicContact CB-CB 3.83Å; L340-P364 HydrophobicContact CD1-CB 4.31Å; L360-P364 WeakPolarHBondContact O-CD 3.32Å; V361-P364 WeakPolarHBondContact O-CD 3.29Å; P364-L366 VanDerWaalsContact C-N 3.32Å; P364-L366 PolarHBondContact O-N 3.09Å; P364-L367 WeakPolarHBondContact O-CB 3.41Å; P364-L367 PolarHBondContact O-N 2.75Å; P364-C368 WeakPolarHBondContact O-CB 3.21Å; P364-C368 PolarHBondContact O-N 3.06Å; P364-C368 PolarHBondContact O-SG 3.3Å
365A98Very high94Very high0 Ų010.6 Ų10.60%05%0.054CC..Hα-helixtrans-62.1-42.4177.100000111.1L340 V361 A362 T363 C368 V369 F379 L380L340-A365 HydrophobicContact CD1-CB 3.75Å; V361-A365 WeakPolarHBondContact O-CB 3.17Å; V361-A365 PolarHBondContact O-N 3.33Å; A362-A365 WeakPolarHBondContact O-CB 3.47Å; A362-A365 PolarHBondContact O-N 3.49Å; T363-A365 VanDerWaalsContact C-N 3.29Å; T363-A365 PolarHBondContact O-N 3.35Å; A365-C368 PolarHBondContact O-N 3.12Å; A365-C368 VanDerWaalsContact O-N 3.11Å; A365-V369 WeakPolarHBondContact O-CG2 3.36Å; A365-V369 PolarHBondContact O-N 3.4Å; A365-F379 HydrophobicContact CB-CD1 3.61Å; A365-F379 HydrophobicContact CB-CE1 3.82Å; A365-L380 HydrophobicContact CB-CD2 4.18Å; A365-L380 HydrophobicContact CB-CG 4.42Å
366L97.4Very high94.1Very high1 Ų19.7 Ų9.71%0.0055%0.05CC..Hα-helixtrans-60.8-43.1173.8-71.5161.3000111.5Y157 L160 I161 Y164 Y167 A362 T363 P364 C368 V369 L380Y157-L366 PolarHBondContact OH-O 3.12Å; L160-L366 HydrophobicContact CG-CD2 3.98Å; L160-L366 WeakPolarHBondContact O-CD2 3.39Å; I161-L366 HydrophobicContact CG1-CB 4.28Å; I161-L366 HydrophobicContact CG2-CD1 4.49Å; Y164-L366 HydrophobicContact CD1-CD1 4.39Å; Y164-L366 HydrophobicContact CG-CD1 4.24Å; Y167-L366 HydrophobicContact CE2-CD1 3.63Å; Y167-L366 WeakPolarHBondContact OH-CD1 3.5Å; A362-L366 VanDerWaalsContact O-CG 3.31Å; A362-L366 WeakPolarHBondContact O-CG 3.24Å; A362-L366 PolarHBondContact O-N 3.14Å; T363-L366 WeakPolarHBondContact O-CB 3.25Å; T363-L366 PolarHBondContact O-N 3.19Å; P364-L366 VanDerWaalsContact C-N 3.32Å; P364-L366 PolarHBondContact O-N 3.09Å; L366-C368 PolarHBondContact O-N 3.36Å; L366-V369 PolarHBondContact O-N 2.96Å; L366-L380 HydrophobicContact CD2-CD1 3.58Å; L366-L380 HydrophobicContact CD2-CD2 4.06Å; L366-L380 HydrophobicContact CD2-CG 4.49Å; L366-L380 HydrophobicContact CG-CD1 4.12Å; L366-L380 HydrophobicContact CG-CD2 3.87Å
367L95.9Very high94.1Very high1 Ų18.7 Ų8.71%0.0055%0.046CC..Hα-helixtrans-62.8-28.3174.6-58177.1000112.8Y141 Y157 M186 I189 T363 P364Y141-L367 HydrophobicContact CD1-CD2 4.36Å; Y141-L367 HydrophobicContact CE1-CD2 3.77Å; Y141-L367 HydrophobicContact CE2-CD2 4Å; Y157-L367 PolarHBondContact OH-O 3.26Å; M186-L367 HydrophobicContact CE-CD2 4.24Å; M186-L367 HydrophobicContact SD-CD2 4.21Å; I189-L367 HydrophobicContact CD1-CD1 4.24Å; I189-L367 HydrophobicContact CG1-CD1 4.01Å; I189-L367 HydrophobicContact CG2-CD1 3.97Å; I189-L367 HydrophobicContact CG2-CD2 4.4Å; T363-L367 WeakPolarHBondContact O-CG 3.15Å; T363-L367 PolarHBondContact O-N 2.97Å; P364-L367 WeakPolarHBondContact O-CB 3.41Å; P364-L367 PolarHBondContact O-N 2.75Å
368C94.8Very high94Very high0 Ų08.7 Ų8.70%05%0.045CC..THydrogen-bonded Turntrans-90-3.4-178.1-680000114.7H336 L340 P364 A365 L366 E370 Y371 C372H336-C368 VanDerWaalsContact C-SG 3.53Å; H336-C368 PolarHBondContact O-SG 2.87Å; H336-C368 VanDerWaalsContact O-SG 3.42Å; L340-C368 HydrophobicContact CD2-CB 3.89Å; P364-C368 WeakPolarHBondContact O-CB 3.21Å; P364-C368 PolarHBondContact O-N 3.06Å; P364-C368 PolarHBondContact O-SG 3.3Å; A365-C368 PolarHBondContact O-N 3.12Å; A365-C368 VanDerWaalsContact O-N 3.11Å; L366-C368 PolarHBondContact O-N 3.36Å; C368-E370 PolarHBondContact O-N 2.8Å; C368-E370 VanDerWaalsContact O-N 3.13Å; C368-Y371 HydrophobicContact CB-CD2 4.11Å; C368-Y371 PolarHBondContact O-N 3.28Å; C368-C372 PolarHBondContact O-N 3.42Å
369V92.1Very high94Very high2 Ų28.7 Ų8.71%0.0125%0.045CC..THydrogen-bonded Turntrans-59.2-28.3-179.1171.90000112.1L160 A365 L366 Y371 T373 C376 L380 F415L160-V369 HydrophobicContact CD2-CB 3.99Å; L160-V369 HydrophobicContact CD2-CG1 3.76Å; L160-V369 HydrophobicContact CD2-CG2 4.01Å; A365-V369 WeakPolarHBondContact O-CG2 3.36Å; A365-V369 PolarHBondContact O-N 3.4Å; L366-V369 PolarHBondContact O-N 2.96Å; V369-Y371 VanDerWaalsContact C-N 3.31Å; V369-Y371 PolarHBondContact O-N 2.85Å; V369-T373 HydrophobicContact CG1-CG2 3.88Å; V369-T373 WeakPolarHBondContact O-CA 3.41Å; V369-T373 WeakPolarHBondContact O-CB 3.42Å; V369-T373 PolarHBondContact O-N 3.3Å; V369-T373 VanDerWaalsContact O-N 3.1Å; V369-T373 PolarHBondContact O-OG1 3.49Å; V369-C376 HydrophobicContact CG2-CB 3.65Å; V369-L380 HydrophobicContact CG2-CD1 4.17Å; V369-F415 HydrophobicContact CG1-CE1 4.07Å
370E86.6Confident93.9Very high50 Ų508.6 Ų8.623%0.2344%0.044CC..THydrogen-bonded Turntrans-67.7-32.2176.4-159.9-166.1136.700112.6S147 Y157 C368S147-E370 VanDerWaalsContact CB-CD 3.44Å; S147-E370 WeakPolarHBondContact CB-OE1 3.34Å; S147-E370 WeakPolarHBondContact CB-OE2 3.3Å; S147-E370 PolarHBondContact OG-OE1 3.28Å; S147-E370 PolarHBondContact OG-OE2 3.5Å; Y157-E370 HydrophobicContact CE2-CB 4.4Å; C368-E370 PolarHBondContact O-N 2.8Å; C368-E370 VanDerWaalsContact O-N 3.13Å
371Y86.3Confident93.8Very high31 Ų318.1 Ų8.112%0.1224%0.042CC..THydrogen-bonded Turntrans-88.1-44.2-176.7-42.5-46.2000111.2T333 H336 L337 C368 V369T333-Y371 HydrophobicContact CG2-CD1 3.91Å; T333-Y371 HydrophobicContact CG2-CD2 4.03Å; T333-Y371 HydrophobicContact CG2-CE1 3.65Å; T333-Y371 HydrophobicContact CG2-CE2 3.79Å; T333-Y371 HydrophobicContact CG2-CG 4.1Å; H336-Y371 HydrophobicContact CB-CE2 3.87Å; H336-Y371 AromaticContact ND1-CE2 3.85Å; H336-Y371 AromaticContact ND1-CZ 3.99Å; H336-Y371 PolarHBondContact ND1-OH 3.47Å; L337-Y371 HydrophobicContact CD2-CD2 4.22Å; L337-Y371 HydrophobicContact CG-CD2 4.32Å; C368-Y371 HydrophobicContact CB-CD2 4.11Å; C368-Y371 PolarHBondContact O-N 3.28Å; V369-Y371 VanDerWaalsContact C-N 3.31Å; V369-Y371 PolarHBondContact O-N 2.85Å
372C86.8Confident93.8Very high3 Ų38.1 Ų8.12%0.024%0.042CC..SBendtrans-134.458.4-171.4-64.30000111.2C368 L374 P375 C376 Y476 I477C368-C372 PolarHBondContact O-N 3.42Å; C372-L374 PolarHBondContact O-N 3.25Å; C372-P375 WeakPolarHBondContact O-CD 3.43Å; C372-C376 WeakPolarHBondContact O-CB 3.36Å; C372-C376 PolarHBondContact O-N 2.93Å; C372-C376 PolarHBondContact O-SG 2.9Å; C372-Y476 HydrophobicContact CB-CE1 4.46Å; C372-I477 HydrophobicContact CB-CD1 4.33Å
373T88.2Confident93.8Very high23 Ų238.1 Ų8.114%0.1414%0.042CC..Hα-helixtrans-47-64.8-170.8-45.40000113.6V369 C376 L377 F415 T419V369-T373 HydrophobicContact CG1-CG2 3.88Å; V369-T373 WeakPolarHBondContact O-CA 3.41Å; V369-T373 WeakPolarHBondContact O-CB 3.42Å; V369-T373 PolarHBondContact O-N 3.3Å; V369-T373 VanDerWaalsContact O-N 3.1Å; V369-T373 PolarHBondContact O-OG1 3.49Å; T373-C376 PolarHBondContact O-N 3.31Å; T373-L377 HydrophobicContact CG2-CD1 3.91Å; T373-L377 HydrophobicContact CG2-CG 4.44Å; T373-L377 VanDerWaalsContact O-CG 3.29Å; T373-L377 WeakPolarHBondContact O-CG 3.3Å; T373-L377 PolarHBondContact O-N 3.49Å; T373-F415 HydrophobicContact CG2-CD1 3.82Å; T373-F415 HydrophobicContact CG2-CE1 4.43Å; T373-T419 HydrophobicContact CG2-CG2 4.17Å
374L88.1Confident93.8Very high21 Ų218.1 Ų8.111%0.114%0.042CC..Hα-helixtrans-66.1-45.7-171.4-177.659.8000113.4C372 C376 L377 I378 L420 Y431C372-L374 PolarHBondContact O-N 3.25Å; L374-C376 VanDerWaalsContact C-N 3.33Å; L374-C376 PolarHBondContact O-N 3.29Å; L374-L377 PolarHBondContact O-N 2.84Å; L374-I378 HydrophobicContact CD1-CD1 4.32Å; L374-I378 HydrophobicContact CD1-CG1 4.42Å; L374-I378 HydrophobicContact CG-CD1 4.15Å; L374-I378 VanDerWaalsContact O-CG1 3.25Å; L374-I378 WeakPolarHBondContact O-CG1 3.13Å; L374-I378 PolarHBondContact O-N 3.04Å; L374-L420 HydrophobicContact CD1-CD2 3.97Å; L374-L420 HydrophobicContact CD2-CD2 3.65Å; L374-L420 HydrophobicContact CG-CD2 4.44Å; L374-Y431 HydrophobicContact CD1-CG 4.49Å
375P91.3Very high93.7Very high23 Ų238.1 Ų8.115%0.1494%0.042CC..Hα-helixtrans-54.1-45.4170.5-28.736.1000113.6C372 I378 F379 F473 Y476C372-P375 WeakPolarHBondContact O-CD 3.43Å; P375-I378 PolarHBondContact O-N 2.83Å; P375-F379 PolarHBondContact O-N 3.22Å; P375-F473 HydrophobicContact CB-CD2 3.92Å; P375-F473 HydrophobicContact CB-CE2 3.63Å; P375-F473 WeakPolarHBondContact O-CE2 3.2Å; P375-Y476 HydrophobicContact CB-CD1 3.97Å; P375-Y476 HydrophobicContact CB-CE1 3.84Å; P375-Y476 HydrophobicContact CG-CD1 4.06Å; P375-Y476 HydrophobicContact CG-CE1 3.5Å; P375-Y476 HydrophobicContact CG-CE2 4.41Å
376C94.1Very high93.7Very high0 Ų08.7 Ų8.70%05%0.046CC..Hα-helixtrans-65.9-39.9179.4-64.70000111.6V369 C372 T373 L374 F379 L380V369-C376 HydrophobicContact CG2-CB 3.65Å; C372-C376 WeakPolarHBondContact O-CB 3.36Å; C372-C376 PolarHBondContact O-N 2.93Å; C372-C376 PolarHBondContact O-SG 2.9Å; T373-C376 PolarHBondContact O-N 3.31Å; L374-C376 VanDerWaalsContact C-N 3.33Å; L374-C376 PolarHBondContact O-N 3.29Å; C376-F379 WeakPolarHBondContact O-CB 3.04Å; C376-F379 PolarHBondContact O-N 3.32Å; C376-L380 WeakPolarHBondContact O-CB 3.41Å; C376-L380 WeakPolarHBondContact O-CG 3.38Å; C376-L380 PolarHBondContact O-N 2.7Å
377L93.7Very high93.7Very high4 Ų48.7 Ų8.72%0.0215%0.046CC..Hα-helixtrans-65-38.7176-67.5176.8000112.3L160 T373 L374 L380 V381 I411 F415 Y431L160-L377 HydrophobicContact CD1-CD2 4.05Å; T373-L377 HydrophobicContact CG2-CD1 3.91Å; T373-L377 HydrophobicContact CG2-CG 4.44Å; T373-L377 VanDerWaalsContact O-CG 3.29Å; T373-L377 WeakPolarHBondContact O-CG 3.3Å; T373-L377 PolarHBondContact O-N 3.49Å; L374-L377 PolarHBondContact O-N 2.84Å; L377-L380 HydrophobicContact CD2-CD1 4.46Å; L377-L380 PolarHBondContact O-N 3.1Å; L377-V381 WeakPolarHBondContact O-CG2 3.28Å; L377-V381 PolarHBondContact O-N 3.45Å; L377-I411 HydrophobicContact CD1-CG2 3.97Å; L377-I411 HydrophobicContact CD2-CD1 3.93Å; L377-I411 HydrophobicContact CD2-CG1 4.14Å; L377-I411 HydrophobicContact CD2-CG2 4.34Å; L377-F415 HydrophobicContact CD1-CB 4.1Å; L377-F415 HydrophobicContact CD1-CG 4.24Å; L377-Y431 HydrophobicContact CB-CE2 4.39Å
378I94.1Very high93.7Very high10 Ų108.7 Ų8.75%0.0515%0.046CC..Hα-helixtrans-61.3-47174-67.4164.6000110.2L374 P375 V381 A382 L430 Y431 T434 V469L374-I378 HydrophobicContact CD1-CD1 4.32Å; L374-I378 HydrophobicContact CD1-CG1 4.42Å; L374-I378 HydrophobicContact CG-CD1 4.15Å; L374-I378 VanDerWaalsContact O-CG1 3.25Å; L374-I378 WeakPolarHBondContact O-CG1 3.13Å; L374-I378 PolarHBondContact O-N 3.04Å; P375-I378 PolarHBondContact O-N 2.83Å; I378-V381 PolarHBondContact O-N 3.09Å; I378-A382 WeakPolarHBondContact O-CB 3.49Å; I378-A382 PolarHBondContact O-N 3.14Å; I378-L430 HydrophobicContact CD1-CB 4.06Å; I378-L430 HydrophobicContact CD1-CD2 3.96Å; I378-L430 HydrophobicContact CD1-CG 3.99Å; I378-L430 HydrophobicContact CG2-CG 4.45Å; I378-Y431 HydrophobicContact CG1-CD2 3.97Å; I378-Y431 HydrophobicContact CG1-CG 4.41Å; I378-T434 HydrophobicContact CG2-CG2 4.45Å; I378-V469 HydrophobicContact CG2-CG1 3.92Å
379F96.7Very high93.7Very high0 Ų010 Ų100%05%0.052CC..Hα-helixtrans-58.9-49.5176.2172.2-94.3000111.8L344 I358 V361 A365 P375 C376 V381 A382 S383 F470 F473L344-F379 HydrophobicContact CD1-CE2 4.05Å; L344-F379 HydrophobicContact CD2-CE2 4.37Å; I358-F379 HydrophobicContact CD1-CE2 4.16Å; I358-F379 HydrophobicContact CD1-CZ 3.74Å; I358-F379 HydrophobicContact CG1-CZ 4.41Å; V361-F379 HydrophobicContact CB-CE1 4.29Å; V361-F379 HydrophobicContact CB-CZ 3.74Å; V361-F379 HydrophobicContact CG1-CE1 3.89Å; V361-F379 HydrophobicContact CG1-CE2 4.03Å; V361-F379 HydrophobicContact CG1-CZ 3.32Å; A365-F379 HydrophobicContact CB-CD1 3.61Å; A365-F379 HydrophobicContact CB-CE1 3.82Å; P375-F379 PolarHBondContact O-N 3.22Å; C376-F379 WeakPolarHBondContact O-CB 3.04Å; C376-F379 PolarHBondContact O-N 3.32Å; F379-V381 VanDerWaalsContact C-N 3.3Å; F379-V381 PolarHBondContact O-N 3.33Å; F379-A382 PolarHBondContact O-N 3.41Å; F379-A382 VanDerWaalsContact O-N 3.14Å; F379-S383 PolarHBondContact O-N 2.64Å; F379-S383 PolarHBondContact O-OG 3.38Å; F379-F470 AromaticContact CD2-CD1 3.59Å; F379-F470 HydrophobicContact CD2-CD1 3.59Å; F379-F470 AromaticContact CD2-CE1 3.92Å; F379-F470 HydrophobicContact CD2-CE1 3.92Å; F379-F470 AromaticContact CE2-CD1 3.48Å; F379-F470 HydrophobicContact CE2-CD1 3.48Å; F379-F470 VanDerWaalsContact CE2-CD1 3.48Å; F379-F470 AromaticContact CE2-CE1 3.7Å; F379-F470 HydrophobicContact CE2-CE1 3.7Å; F379-F470 HydrophobicContact CE2-CG 4.11Å; F379-F470 HydrophobicContact CE2-CZ 4.47Å; F379-F470 HydrophobicContact CZ-CE1 4.48Å; F379-F473 HydrophobicContact CB-CD1 3.71Å; F379-F473 HydrophobicContact CB-CD2 4.12Å; F379-F473 HydrophobicContact CB-CE1 3.69Å; F379-F473 HydrophobicContact CB-CE2 4.12Å; F379-F473 HydrophobicContact CB-CG 3.92Å; F379-F473 HydrophobicContact CB-CZ 3.89Å; F379-F473 HydrophobicContact CD1-CE1 4.1Å; F379-F473 HydrophobicContact CD2-CB 4.48Å; F379-F473 AromaticContact CD2-CD1 3.38Å; F379-F473 HydrophobicContact CD2-CD1 3.38Å; F379-F473 AromaticContact CD2-CE1 3.77Å; F379-F473 HydrophobicContact CD2-CE1 3.77Å; F379-F473 HydrophobicContact CD2-CG 4.11Å; F379-F473 HydrophobicContact CE2-CD1 4.18Å; F379-F473 HydrophobicContact CE2-CE1 4.49Å; F379-F473 AromaticContact CG-CD1 3.6Å; F379-F473 HydrophobicContact CG-CD1 3.6Å; F379-F473 AromaticContact CG-CE1 3.55Å; F379-F473 HydrophobicContact CG-CE1 3.55Å; F379-F473 HydrophobicContact CG-CG 4.28Å; F379-F473 HydrophobicContact CG-CZ 4.2Å
380L97.2Very high93.9Very high0 Ų010.4 Ų10.40%05%0.054CC..Hα-helixtrans-61.9-36.2-178-71.5165.6000112.6Y164 A362 A365 L366 V369 C376 L377 S383 V384Y164-L380 HydrophobicContact CD2-CD2 3.97Å; Y164-L380 HydrophobicContact CE2-CB 4.19Å; Y164-L380 HydrophobicContact CE2-CD2 3.73Å; A362-L380 HydrophobicContact CB-CD2 4.03Å; A365-L380 HydrophobicContact CB-CD2 4.18Å; A365-L380 HydrophobicContact CB-CG 4.42Å; L366-L380 HydrophobicContact CD2-CD1 3.58Å; L366-L380 HydrophobicContact CD2-CD2 4.06Å; L366-L380 HydrophobicContact CD2-CG 4.49Å; L366-L380 HydrophobicContact CG-CD1 4.12Å; L366-L380 HydrophobicContact CG-CD2 3.87Å; V369-L380 HydrophobicContact CG2-CD1 4.17Å; C376-L380 WeakPolarHBondContact O-CB 3.41Å; C376-L380 WeakPolarHBondContact O-CG 3.38Å; C376-L380 PolarHBondContact O-N 2.7Å; L377-L380 HydrophobicContact CD2-CD1 4.46Å; L377-L380 PolarHBondContact O-N 3.1Å; L380-S383 VanDerWaalsContact C-OG 3.32Å; L380-S383 VanDerWaalsContact CA-OG 3.3Å; L380-S383 WeakPolarHBondContact CA-OG 3.37Å; L380-S383 PolarHBondContact O-OG 2.98Å; L380-V384 WeakPolarHBondContact O-CG2 3.48Å; L380-V384 PolarHBondContact O-N 2.7Å
381V96Very high94.3Very high1 Ų18.2 Ų8.21%0.0064%0.044CC..Hα-helixtrans-69.9-45174.5168.20000110.9L377 I378 F379 S383 V384 F385 Y431 T434 N435L377-V381 WeakPolarHBondContact O-CG2 3.28Å; L377-V381 PolarHBondContact O-N 3.45Å; I378-V381 PolarHBondContact O-N 3.09Å; F379-V381 VanDerWaalsContact C-N 3.3Å; F379-V381 PolarHBondContact O-N 3.33Å; V381-S383 VanDerWaalsContact C-N 3.29Å; V381-S383 PolarHBondContact O-N 2.91Å; V381-V384 PolarHBondContact O-N 3.19Å; V381-F385 HydrophobicContact CG1-CD2 3.75Å; V381-F385 HydrophobicContact CG1-CE2 3.39Å; V381-F385 HydrophobicContact CG1-CZ 4.49Å; V381-F385 VanDerWaalsContact O-CD2 3.24Å; V381-F385 WeakPolarHBondContact O-CD2 3.24Å; V381-F385 PolarHBondContact O-N 3.41Å; V381-F385 VanDerWaalsContact O-N 3.1Å; V381-Y431 HydrophobicContact CG2-CE2 3.76Å; V381-T434 HydrophobicContact CG1-CG2 4.41Å; V381-N435 WeakPolarHBondContact CG1-OD1 3.28Å
382A97.6Very high94.7Very high0 Ų09 Ų90%05%0.052CC..Hα-helixtrans-62.3-35.5177.400000112.6I378 F379 V384 F385 S386 T434 V469 F470I378-A382 WeakPolarHBondContact O-CB 3.49Å; I378-A382 PolarHBondContact O-N 3.14Å; F379-A382 PolarHBondContact O-N 3.41Å; F379-A382 VanDerWaalsContact O-N 3.14Å; A382-V384 VanDerWaalsContact C-N 3.35Å; A382-F385 PolarHBondContact O-N 2.91Å; A382-S386 PolarHBondContact O-N 3.49Å; A382-T434 HydrophobicContact CB-CG2 4.02Å; A382-V469 HydrophobicContact CB-CB 4.06Å; A382-V469 HydrophobicContact CB-CG1 3.7Å; A382-V469 HydrophobicContact CB-CG2 4.43Å; A382-F470 HydrophobicContact CB-CD1 4.5Å; A382-F470 HydrophobicContact CB-CE1 3.85Å
383S98Very high95.1Very high0 Ų013 Ų130%07%0.069CC..Hα-helixtrans-67-33.8175.559.40000113Y164 I358 F379 L380 V381 S386Y164-S383 WeakPolarHBondContact OH-CB 3.43Å; Y164-S383 PolarHBondContact OH-OG 3.26Å; I358-S383 VanDerWaalsContact CG1-CB 3.49Å; F379-S383 PolarHBondContact O-N 2.64Å; F379-S383 PolarHBondContact O-OG 3.38Å; L380-S383 VanDerWaalsContact C-OG 3.32Å; L380-S383 VanDerWaalsContact CA-OG 3.3Å; L380-S383 WeakPolarHBondContact CA-OG 3.37Å; L380-S383 PolarHBondContact O-OG 2.98Å; V381-S383 VanDerWaalsContact C-N 3.29Å; V381-S383 PolarHBondContact O-N 2.91Å; S383-S386 PolarHBondContact O-N 3.01Å; S383-S386 PolarHBondContact O-OG 3.47Å
384V97.9Very high95.4Very high1 Ų112.3 Ų12.31%0.0067%0.065CC..Hα-helixtrans-66.9-46171.2177.10000110.7Y164 P165 L380 V381 A382 S386 L387 F400 L404Y164-V384 HydrophobicContact CD2-CG2 4.34Å; Y164-V384 HydrophobicContact CE2-CG2 3.61Å; P165-V384 HydrophobicContact CB-CG1 3.9Å; P165-V384 HydrophobicContact CB-CG2 3.77Å; P165-V384 HydrophobicContact CG-CG1 4.43Å; P165-V384 HydrophobicContact CG-CG2 3.99Å; L380-V384 WeakPolarHBondContact O-CG2 3.48Å; L380-V384 PolarHBondContact O-N 2.7Å; V381-V384 PolarHBondContact O-N 3.19Å; A382-V384 VanDerWaalsContact C-N 3.35Å; V384-S386 VanDerWaalsContact C-N 3.26Å; V384-S386 PolarHBondContact O-N 3.14Å; V384-L387 WeakPolarHBondContact O-CB 3.26Å; V384-L387 PolarHBondContact O-N 2.91Å; V384-F400 HydrophobicContact CG1-CE2 3.93Å; V384-F400 HydrophobicContact CG1-CZ 4.02Å; V384-F400 VanDerWaalsContact O-CE2 3.31Å; V384-F400 WeakPolarHBondContact O-CE2 3.42Å; V384-L404 HydrophobicContact CG1-CD1 4Å
385F97.9Very high95.7Very high0 Ų016.9 Ų16.90%09%0.089CC..Hα-helixtrans-59-35.8176.7-75.9-60.8000113.1V381 A382 L387 F388 F400 L404 G438 I439 M462V381-F385 HydrophobicContact CG1-CD2 3.75Å; V381-F385 HydrophobicContact CG1-CE2 3.39Å; V381-F385 HydrophobicContact CG1-CZ 4.49Å; V381-F385 VanDerWaalsContact O-CD2 3.24Å; V381-F385 WeakPolarHBondContact O-CD2 3.24Å; V381-F385 PolarHBondContact O-N 3.41Å; V381-F385 VanDerWaalsContact O-N 3.1Å; A382-F385 PolarHBondContact O-N 2.91Å; F385-L387 PolarHBondContact O-N 3.38Å; F385-L387 VanDerWaalsContact O-N 3.16Å; F385-F388 VanDerWaalsContact O-CB 3.24Å; F385-F388 WeakPolarHBondContact O-CB 3.24Å; F385-F388 PolarHBondContact O-N 3.38Å; F385-F388 VanDerWaalsContact O-N 3.09Å; F385-F400 HydrophobicContact CD1-CZ 4.43Å; F385-L404 HydrophobicContact CD1-CD2 4.4Å; F385-L404 HydrophobicContact CE1-CD2 3.54Å; F385-L404 HydrophobicContact CZ-CD1 4.28Å; F385-L404 HydrophobicContact CZ-CD2 3.78Å; F385-G438 VanDerWaalsContact CE1-C 3.45Å; F385-I439 HydrophobicContact CE1-CG1 4.21Å; F385-I439 HydrophobicContact CZ-CG1 3.98Å; F385-M462 HydrophobicContact CB-CE 4.2Å; F385-M462 HydrophobicContact CB-SD 3.83Å; F385-M462 HydrophobicContact CD1-CE 4.32Å; F385-M462 WeakPolarHBondContact O-CG 3.37Å
386S97.1Very high96Very high12 Ų1215.9 Ų15.98%0.0848%0.083CC..Hα-helixtrans-62-20.4175.166.80000114.2A382 S383 V384A382-S386 PolarHBondContact O-N 3.49Å; S383-S386 PolarHBondContact O-N 3.01Å; S383-S386 PolarHBondContact O-OG 3.47Å; V384-S386 VanDerWaalsContact C-N 3.26Å; V384-S386 PolarHBondContact O-N 3.14Å
387L96.8Very high96.1Very high1 Ų117.5 Ų17.51%0.0059%0.093CC..THydrogen-bonded Turntrans-932.1178.4-62.5172.2000113.2V170 E355 I358 L359 V384 F385 H389 L390 S391V170-L387 HydrophobicContact CG2-CD1 4.04Å; V170-L387 HydrophobicContact CG2-CD2 4.49Å; E355-L387 HydrophobicContact CG-CD2 4.46Å; I358-L387 HydrophobicContact CG2-CD1 4.19Å; I358-L387 HydrophobicContact CG2-CD2 4.07Å; I358-L387 HydrophobicContact CG2-CG 4.21Å; L359-L387 HydrophobicContact CD2-CD1 4.49Å; V384-L387 WeakPolarHBondContact O-CB 3.26Å; V384-L387 PolarHBondContact O-N 2.91Å; F385-L387 PolarHBondContact O-N 3.38Å; F385-L387 VanDerWaalsContact O-N 3.16Å; L387-H389 PolarHBondContact O-N 2.96Å; L387-L390 HydrophobicContact CD2-CD2 4.45Å; L387-L390 WeakPolarHBondContact O-CB 3.36Å; L387-L390 PolarHBondContact O-N 3.08Å; L387-S391 PolarHBondContact O-N 3.04Å
388F97.4Very high96.2Very high0 Ų023.3 Ų23.30%013%0.128CC..Hα-helixtrans-58.1-48.6-176.2170.4-110.4000112.8F385 L390 S391 V392 V397 F400 F401 C442 L446F385-F388 VanDerWaalsContact O-CB 3.24Å; F385-F388 WeakPolarHBondContact O-CB 3.24Å; F385-F388 PolarHBondContact O-N 3.38Å; F385-F388 VanDerWaalsContact O-N 3.09Å; F388-L390 VanDerWaalsContact C-N 3.26Å; F388-L390 PolarHBondContact O-N 2.86Å; F388-S391 WeakPolarHBondContact O-CB 3.41Å; F388-S391 PolarHBondContact O-N 3.45Å; F388-V392 HydrophobicContact CD1-CG2 4.29Å; F388-V392 HydrophobicContact CD2-CG2 4.38Å; F388-V392 HydrophobicContact CE1-CG2 3.71Å; F388-V392 HydrophobicContact CE2-CG2 3.83Å; F388-V392 HydrophobicContact CZ-CG2 3.45Å; F388-V392 VanDerWaalsContact CZ-CG2 3.45Å; F388-V392 PolarHBondContact O-N 3.08Å; F388-V397 HydrophobicContact CE2-CG1 4.47Å; F388-F400 HydrophobicContact CB-CE1 4.22Å; F388-F400 HydrophobicContact CB-CE2 3.92Å; F388-F400 HydrophobicContact CB-CZ 3.72Å; F388-F400 AromaticContact CD2-CD1 3.72Å; F388-F400 HydrophobicContact CD2-CD1 3.72Å; F388-F400 HydrophobicContact CD2-CD2 4.45Å; F388-F400 AromaticContact CD2-CE1 3.65Å; F388-F400 HydrophobicContact CD2-CE1 3.65Å; F388-F400 HydrophobicContact CD2-CE2 4.4Å; F388-F400 HydrophobicContact CD2-CG 4.14Å; F388-F400 HydrophobicContact CD2-CZ 4.02Å; F388-F400 HydrophobicContact CE2-CD1 4.38Å; F388-F400 HydrophobicContact CG-CE1 4.36Å; F388-F400 HydrophobicContact CG-CZ 4.34Å; F388-F401 HydrophobicContact CE2-CE2 4.21Å; F388-F401 HydrophobicContact CE2-CZ 4.24Å; F388-C442 HydrophobicContact CD1-CB 4.38Å; F388-C442 HydrophobicContact CD2-CB 4.28Å; F388-C442 HydrophobicContact CE1-CB 4.19Å; F388-C442 HydrophobicContact CE2-CB 4.07Å; F388-C442 HydrophobicContact CG-CB 4.43Å; F388-C442 VanDerWaalsContact CG-SG 3.57Å; F388-C442 HydrophobicContact CZ-CB 4.02Å; F388-L446 HydrophobicContact CE2-CD1 4.25Å; F388-L446 HydrophobicContact CZ-CD1 3.93Å; F388-L446 HydrophobicContact CZ-CD2 3.98Å; F388-L446 HydrophobicContact CZ-CG 3.81Å
389H94.8Very high96.4Very high28 Ų2823.7 Ų23.713%0.1313%0.132CC..Hα-helixtrans-68.3-26.6-176.1-70.486.9000112.7L387 V392 K393 S445 F458 S459L387-H389 PolarHBondContact O-N 2.96Å; H389-V392 PolarHBondContact O-N 2.92Å; H389-K393 WeakPolarHBondContact O-CG 3.46Å; H389-K393 PolarHBondContact O-N 3.05Å; H389-S445 PolarHBondContact NE2-OG 2.58Å; H389-F458 PolarHBondContact CE1-O 2.75Å; H389-S459 VanDerWaalsContact CE1-CA 3.4Å; H389-S459 WeakPolarHBondContact CE1-CA 3.43Å; H389-S459 WeakPolarHBondContact NE2-CA 3.45Å; H389-S459 PolarHBondContact NE2-N 2.62Å
390L94.6Very high96.4Very high10 Ų1023.7 Ų23.75%0.05213%0.132CC..Hα-helixtrans-60.7-47.6169-178.855.4000110.7H174 E355 K356 L387 F388 V392 K393 D394H174-L390 VanDerWaalsContact CE1-CD1 3.41Å; H174-L390 WeakPolarHBondContact CE1-CD1 3.38Å; H174-L390 WeakPolarHBondContact ND1-CD1 3.31Å; E355-L390 HydrophobicContact CG-CD2 4.45Å; E355-L390 WeakPolarHBondContact OE1-CB 3.3Å; E355-L390 VanDerWaalsContact OE1-CD1 3.22Å; E355-L390 WeakPolarHBondContact OE1-CD1 3.43Å; K356-L390 HydrophobicContact CD-CD2 4.05Å; K356-L390 HydrophobicContact CG-CD2 3.73Å; L387-L390 HydrophobicContact CD2-CD2 4.45Å; L387-L390 WeakPolarHBondContact O-CB 3.36Å; L387-L390 PolarHBondContact O-N 3.08Å; F388-L390 VanDerWaalsContact C-N 3.26Å; F388-L390 PolarHBondContact O-N 2.86Å; L390-V392 VanDerWaalsContact C-N 3.27Å; L390-V392 PolarHBondContact O-N 3.3Å; L390-K393 WeakPolarHBondContact O-CB 3.22Å; L390-K393 PolarHBondContact O-N 2.9Å; L390-K393 VanDerWaalsContact O-N 3.11Å; L390-D394 PolarHBondContact O-N 2.85Å; L390-D394 VanDerWaalsContact O-N 3.09Å
391S95.8Very high96.5Very high5 Ų526.3 Ų26.34%0.03514%0.143CC..Hα-helixtrans-64.9-31177.4-58.70000112.6L387 F388 N395 A396L387-S391 PolarHBondContact O-N 3.04Å; F388-S391 WeakPolarHBondContact O-CB 3.41Å; F388-S391 PolarHBondContact O-N 3.45Å; S391-N395 PolarHBondContact O-N 3.36Å; S391-A396 PolarHBondContact O-N 2.98Å
392V95.4Very high96.5Very high48 Ų4828.6 Ų28.629%0.29116%0.162SC..Hα-helixtrans-65.6-46.3171.6176.50000110.7F388 H389 L390 D394 N395 V397 L446F388-V392 HydrophobicContact CD1-CG2 4.29Å; F388-V392 HydrophobicContact CD2-CG2 4.38Å; F388-V392 HydrophobicContact CE1-CG2 3.71Å; F388-V392 HydrophobicContact CE2-CG2 3.83Å; F388-V392 HydrophobicContact CZ-CG2 3.45Å; F388-V392 VanDerWaalsContact CZ-CG2 3.45Å; F388-V392 PolarHBondContact O-N 3.08Å; H389-V392 PolarHBondContact O-N 2.92Å; L390-V392 VanDerWaalsContact C-N 3.27Å; L390-V392 PolarHBondContact O-N 3.3Å; V392-D394 PolarHBondContact O-N 3.08Å; V392-N395 PolarHBondContact O-N 3.11Å; V392-N395 VanDerWaalsContact O-N 3.08Å; V392-V397 HydrophobicContact CB-CG2 4.41Å; V392-V397 HydrophobicContact CG2-CG2 3.86Å; V392-L446 HydrophobicContact CG2-CD2 4.45Å
393K93.3Very high96.5Very high86 Ų8629.7 Ų29.737%0.37417%0.167SC..Hα-helixtrans-58.1-34.9177.7-73.8173.3176.7176.60112.2K41 D283 H389 L390K41-K393 PolarHBondContact NZ-O 3.13Å; D283-K393 IonicContact OD1-NZ 2.97Å; D283-K393 PolarHBondContact OD1-NZ 3.41Å; D283-K393 VanDerWaalsContact OD1-NZ 3.13Å; D283-K393 IonicContact OD2-NZ 3.76Å; D283-K393 PolarHBondContact OD2-NZ 3.43Å; H389-K393 WeakPolarHBondContact O-CG 3.46Å; H389-K393 PolarHBondContact O-N 3.05Å; L390-K393 WeakPolarHBondContact O-CB 3.22Å; L390-K393 PolarHBondContact O-N 2.9Å; L390-K393 VanDerWaalsContact O-N 3.11Å
394D95Very high96.5Very high8 Ų830 Ų304%0.04317%0.169CC..THydrogen-bonded Turntrans-89.78.1179.9-57.7-35.6000114.1P35 S37 H174 L390 V392 A396P35-D394 WeakPolarHBondContact CB-O 3.45Å; S37-D394 VanDerWaalsContact CA-OD1 3.3Å; S37-D394 WeakPolarHBondContact CA-OD1 3.29Å; S37-D394 WeakPolarHBondContact CB-OD1 3.38Å; S37-D394 PolarHBondContact OG-OD1 3.09Å; H174-D394 IonicContact CE1-OD2 2.71Å; H174-D394 IonicContact CG-OD2 2.63Å; H174-D394 IonicContact ND1-OD1 2.8Å; H174-D394 IonicContact ND1-OD2 3.83Å; H174-D394 PolarHBondContact ND1-OD2 2.71Å; L390-D394 PolarHBondContact O-N 2.85Å; L390-D394 VanDerWaalsContact O-N 3.09Å; V392-D394 PolarHBondContact O-N 3.08Å; D394-A396 HydrophobicContact CB-CB 4.39Å; D394-A396 PolarHBondContact O-N 3.26Å
395N95.9Very high96.4Very high118 Ų11835 Ų3563%0.63120%0.195SC*.THydrogen-bonded Turntrans56.130.8-174.5-62.1-42.5000114S391 V392S391-N395 PolarHBondContact O-N 3.36Å; V392-N395 PolarHBondContact O-N 3.11Å; V392-N395 VanDerWaalsContact O-N 3.08Å
396A96.2Very high96.3Very high2 Ų238.2 Ų38.22%0.01721%0.212CC..  trans-113.329.3-173.600000114.1V173 S391 D394 V398 S399 F400V173-A396 HydrophobicContact CG1-CB 3.25Å; S391-A396 PolarHBondContact O-N 2.98Å; D394-A396 HydrophobicContact CB-CB 4.39Å; D394-A396 PolarHBondContact O-N 3.26Å; A396-V398 VanDerWaalsContact C-N 3.27Å; A396-V398 PolarHBondContact O-N 3.21Å; A396-S399 PolarHBondContact O-N 2.91Å; A396-S399 VanDerWaalsContact O-N 3.14Å; A396-F400 PolarHBondContact O-N 3.32Å
397V96.8Very high96.3Very high34 Ų3437.8 Ų37.821%0.20621%0.208CC..Hα-helixtrans-58.1-37.4-178.6178.50000112.5F388 V392 S399 F400 F401 L446F388-V397 HydrophobicContact CE2-CG1 4.47Å; V392-V397 HydrophobicContact CB-CG2 4.41Å; V392-V397 HydrophobicContact CG2-CG2 3.86Å; V397-S399 PolarHBondContact O-N 3.44Å; V397-F400 WeakPolarHBondContact O-CB 3.38Å; V397-F400 PolarHBondContact O-N 3.32Å; V397-F401 HydrophobicContact CG1-CD2 3.71Å; V397-F401 HydrophobicContact CG1-CE2 3.56Å; V397-F401 WeakPolarHBondContact O-CD2 3.44Å; V397-F401 PolarHBondContact O-N 3.03Å; V397-F401 VanDerWaalsContact O-N 3.09Å; V397-L446 HydrophobicContact CG1-CD1 3.92Å; V397-L446 HydrophobicContact CG1-CD2 4.23Å; V397-L446 HydrophobicContact CG2-CD2 4.26Å
398V96.6Very high96.1Very high125 Ų12539 Ų3976%0.75822%0.217SC*.Hα-helixtrans-62.1-45.6177.4177.10000110.8A396 F400 F401 A402A396-V398 VanDerWaalsContact C-N 3.27Å; A396-V398 PolarHBondContact O-N 3.21Å; V398-F400 VanDerWaalsContact C-N 3.33Å; V398-F400 PolarHBondContact O-N 3.49Å; V398-F401 PolarHBondContact O-N 3.39Å; V398-A402 VanDerWaalsContact O-CB 3.3Å; V398-A402 WeakPolarHBondContact O-CB 3.41Å; V398-A402 PolarHBondContact O-N 2.85Å
399S97.1Very high95.9Very high18 Ų1843.3 Ų43.313%0.12624%0.243CC..Hα-helixtrans-65.1-39.1178.1-51.40000111.8S34 A396 V397 A402 M403S34-S399 PolarHBondContact OG-OG 2.9Å; A396-S399 PolarHBondContact O-N 2.91Å; A396-S399 VanDerWaalsContact O-N 3.14Å; V397-S399 PolarHBondContact O-N 3.44Å; S399-A402 PolarHBondContact O-N 2.88Å; S399-M403 WeakPolarHBondContact O-CB 3.21Å; S399-M403 VanDerWaalsContact O-CG 3.3Å; S399-M403 WeakPolarHBondContact O-CG 3.39Å; S399-M403 PolarHBondContact O-N 3.5Å
400F98Very high95.8Very high0 Ų043.2 Ų43.20%024%0.242CC..Hα-helixtrans-55.1-55.4174.3-179.2-88.7000111.6L169 V384 F385 F388 A396 V397 V398 M403 L404L169-F400 HydrophobicContact CD1-CD2 3.65Å; L169-F400 HydrophobicContact CD1-CE2 4.17Å; L169-F400 HydrophobicContact CD1-CG 4.47Å; L169-F400 HydrophobicContact CD2-CB 4.47Å; V384-F400 HydrophobicContact CG1-CE2 3.93Å; V384-F400 HydrophobicContact CG1-CZ 4.02Å; V384-F400 VanDerWaalsContact O-CE2 3.31Å; V384-F400 WeakPolarHBondContact O-CE2 3.42Å; F385-F400 HydrophobicContact CD1-CZ 4.43Å; F388-F400 HydrophobicContact CB-CE1 4.22Å; F388-F400 HydrophobicContact CB-CE2 3.92Å; F388-F400 HydrophobicContact CB-CZ 3.72Å; F388-F400 AromaticContact CD2-CD1 3.72Å; F388-F400 HydrophobicContact CD2-CD1 3.72Å; F388-F400 HydrophobicContact CD2-CD2 4.45Å; F388-F400 AromaticContact CD2-CE1 3.65Å; F388-F400 HydrophobicContact CD2-CE1 3.65Å; F388-F400 HydrophobicContact CD2-CE2 4.4Å; F388-F400 HydrophobicContact CD2-CG 4.14Å; F388-F400 HydrophobicContact CD2-CZ 4.02Å; F388-F400 HydrophobicContact CE2-CD1 4.38Å; F388-F400 HydrophobicContact CG-CE1 4.36Å; F388-F400 HydrophobicContact CG-CZ 4.34Å; A396-F400 PolarHBondContact O-N 3.32Å; V397-F400 WeakPolarHBondContact O-CB 3.38Å; V397-F400 PolarHBondContact O-N 3.32Å; V398-F400 VanDerWaalsContact C-N 3.33Å; V398-F400 PolarHBondContact O-N 3.49Å; F400-M403 PolarHBondContact O-N 3.46Å; F400-L404 HydrophobicContact CE1-CD2 3.99Å; F400-L404 WeakPolarHBondContact O-CB 3.4Å; F400-L404 PolarHBondContact O-N 3.44Å
401F97.7Very high95.7Very high56 Ų5643 Ų4325%0.24624%0.241CC..Hα-helixtrans-69.1-36.6-178.8-75.5-67000112.8F388 V397 V398 M403 L404 I405 C442 L446F388-F401 HydrophobicContact CE2-CE2 4.21Å; F388-F401 HydrophobicContact CE2-CZ 4.24Å; V397-F401 HydrophobicContact CG1-CD2 3.71Å; V397-F401 HydrophobicContact CG1-CE2 3.56Å; V397-F401 WeakPolarHBondContact O-CD2 3.44Å; V397-F401 PolarHBondContact O-N 3.03Å; V397-F401 VanDerWaalsContact O-N 3.09Å; V398-F401 PolarHBondContact O-N 3.39Å; F401-M403 VanDerWaalsContact C-N 3.33Å; F401-M403 PolarHBondContact O-N 3.28Å; F401-L404 HydrophobicContact CD1-CD2 4.36Å; F401-L404 PolarHBondContact O-N 2.94Å; F401-I405 VanDerWaalsContact O-CB 3.32Å; F401-I405 WeakPolarHBondContact O-CB 3.45Å; F401-I405 WeakPolarHBondContact O-CD1 3.42Å; F401-I405 WeakPolarHBondContact O-CG1 3.28Å; F401-I405 PolarHBondContact O-N 2.99Å; F401-C442 HydrophobicContact CE1-CB 4.32Å; F401-C442 HydrophobicContact CZ-CB 3.88Å; F401-L446 HydrophobicContact CE2-CD1 3.72Å; F401-L446 HydrophobicContact CZ-CD1 4.09Å
402A97.4Very high95.2Very high48 Ų4846.2 Ų46.240%0.39726%0.258SS..Hα-helixtrans-58.6-45.7175.500000111.4V398 S399 L406V398-A402 VanDerWaalsContact O-CB 3.3Å; V398-A402 WeakPolarHBondContact O-CB 3.41Å; V398-A402 PolarHBondContact O-N 2.85Å; S399-A402 PolarHBondContact O-N 2.88Å; A402-L406 VanDerWaalsContact O-CB 3.26Å; A402-L406 WeakPolarHBondContact O-CB 3.34Å; A402-L406 PolarHBondContact O-N 2.95Å
403M97.8Very high94.7Very high23 Ų2349.2 Ų49.211%0.11327%0.272CS..Hα-helixtrans-70.9-40.6178-63.4-62.679.900112.7I27 P165 I168 L169 S399 F400 F401 L406 Y407I27-M403 HydrophobicContact CG2-CE 3.89Å; I27-M403 HydrophobicContact CG2-SD 3.57Å; I27-M403 VanDerWaalsContact CG2-SD 3.57Å; P165-M403 HydrophobicContact CB-CB 3.86Å; P165-M403 HydrophobicContact CG-CB 4.25Å; P165-M403 WeakPolarHBondContact CG-O 3.17Å; I168-M403 HydrophobicContact CB-SD 4.44Å; I168-M403 HydrophobicContact CD1-SD 4.03Å; I168-M403 HydrophobicContact CG2-CG 4.27Å; I168-M403 HydrophobicContact CG2-SD 3.87Å; L169-M403 HydrophobicContact CD2-CB 4.47Å; L169-M403 HydrophobicContact CD2-CG 4.24Å; S399-M403 WeakPolarHBondContact O-CB 3.21Å; S399-M403 VanDerWaalsContact O-CG 3.3Å; S399-M403 WeakPolarHBondContact O-CG 3.39Å; S399-M403 PolarHBondContact O-N 3.5Å; F400-M403 PolarHBondContact O-N 3.46Å; F401-M403 VanDerWaalsContact C-N 3.33Å; F401-M403 PolarHBondContact O-N 3.28Å; M403-L406 HydrophobicContact CE-CB 4.3Å; M403-L406 HydrophobicContact CE-CD2 3.71Å; M403-L406 PolarHBondContact O-N 3.37Å; M403-Y407 VanDerWaalsContact O-CB 3.3Å; M403-Y407 WeakPolarHBondContact O-CB 3.26Å; M403-Y407 PolarHBondContact O-N 3.38Å
404L96.9Very high94.3Very high8 Ų846.6 Ų46.64%0.04227%0.265CS..Hα-helixtrans-60.9-46.2175.9-179.964.1000111.7V384 F385 F400 F401 S408V384-L404 HydrophobicContact CG1-CD1 4Å; F385-L404 HydrophobicContact CD1-CD2 4.4Å; F385-L404 HydrophobicContact CE1-CD2 3.54Å; F385-L404 HydrophobicContact CZ-CD1 4.28Å; F385-L404 HydrophobicContact CZ-CD2 3.78Å; F400-L404 HydrophobicContact CE1-CD2 3.99Å; F400-L404 WeakPolarHBondContact O-CB 3.4Å; F400-L404 PolarHBondContact O-N 3.44Å; F401-L404 HydrophobicContact CD1-CD2 4.36Å; F401-L404 PolarHBondContact O-N 2.94Å; L404-S408 VanDerWaalsContact O-CB 3.23Å; L404-S408 WeakPolarHBondContact O-CB 3.32Å; L404-S408 PolarHBondContact O-N 3.11Å; L404-S408 PolarHBondContact O-OG 2.92Å
405I96.5Very high93.4Very high105 Ų10547.4 Ų47.454%0.53827%0.268SS..Hα-helixtrans-65.4-48.9179.7-69.1165.9000110.1F401 Y407 S408 V409F401-I405 VanDerWaalsContact O-CB 3.32Å; F401-I405 WeakPolarHBondContact O-CB 3.45Å; F401-I405 WeakPolarHBondContact O-CD1 3.42Å; F401-I405 WeakPolarHBondContact O-CG1 3.28Å; F401-I405 PolarHBondContact O-N 2.99Å; I405-Y407 VanDerWaalsContact C-N 3.32Å; I405-Y407 PolarHBondContact O-N 3.16Å; I405-S408 PolarHBondContact O-N 3.28Å; I405-V409 HydrophobicContact CG2-CG2 4.29Å; I405-V409 WeakPolarHBondContact O-CB 3.49Å; I405-V409 WeakPolarHBondContact O-CG2 3.31Å; I405-V409 PolarHBondContact O-N 3.42Å
406L96.3Very high91.6Very high68 Ų6846.7 Ų46.736%0.35626%0.256SS..Hα-helixtrans-54.7-49.9179179.565.8000111.2I27 A402 M403 V409 F410I27-L406 HydrophobicContact CD1-CD2 3.66Å; I27-L406 HydrophobicContact CG1-CD2 4.22Å; I27-L406 HydrophobicContact CG2-CD2 4.33Å; A402-L406 VanDerWaalsContact O-CB 3.26Å; A402-L406 WeakPolarHBondContact O-CB 3.34Å; A402-L406 PolarHBondContact O-N 2.95Å; M403-L406 HydrophobicContact CE-CB 4.3Å; M403-L406 HydrophobicContact CE-CD2 3.71Å; M403-L406 PolarHBondContact O-N 3.37Å; L406-V409 PolarHBondContact O-N 2.92Å; L406-F410 WeakPolarHBondContact O-CB 3.41Å; L406-F410 PolarHBondContact O-N 2.99Å
407Y95.8Very high89.3Confident3 Ų353.7 Ų53.71%0.01229%0.29CS..Hα-helixtrans-68.5-37.4-178.5-167.6-116.2000112.5L160 L163 Y164 P165 M403 I405 F410 I411L160-Y407 HydrophobicContact CD1-CE2 4.37Å; L160-Y407 WeakPolarHBondContact CD1-OH 3.24Å; L160-Y407 WeakPolarHBondContact O-CE2 3.48Å; L160-Y407 PolarHBondContact O-OH 3.24Å; L163-Y407 HydrophobicContact CB-CD2 4.22Å; L163-Y407 VanDerWaalsContact O-CD2 3.26Å; L163-Y407 WeakPolarHBondContact O-CD2 3.36Å; Y164-Y407 HydrophobicContact CD2-CE1 4.12Å; P165-Y407 VanDerWaalsContact CD-CD1 3.45Å; P165-Y407 HydrophobicContact CG-CD1 3.94Å; P165-Y407 HydrophobicContact CG-CG 3.77Å; M403-Y407 VanDerWaalsContact O-CB 3.3Å; M403-Y407 WeakPolarHBondContact O-CB 3.26Å; M403-Y407 PolarHBondContact O-N 3.38Å; I405-Y407 VanDerWaalsContact C-N 3.32Å; I405-Y407 PolarHBondContact O-N 3.16Å; Y407-F410 HydrophobicContact CD2-CD1 4.41Å; Y407-F410 HydrophobicContact CE2-CD1 4.46Å; Y407-F410 PolarHBondContact O-N 3.49Å; Y407-I411 HydrophobicContact CD1-CD1 3.56Å; Y407-I411 HydrophobicContact CD1-CG1 4.41Å; Y407-I411 HydrophobicContact CE1-CD1 3.29Å; Y407-I411 HydrophobicContact CE1-CG1 4.23Å; Y407-I411 HydrophobicContact CG-CD1 4.3Å; Y407-I411 WeakPolarHBondContact O-CG1 3.24Å; Y407-I411 PolarHBondContact O-N 3.26Å
408S93Very high87Confident26 Ų2661.9 Ų61.918%0.18232%0.318CS..Hα-helixtrans-65.8-41.7176.9-61.50000112.1L404 I405 N412L404-S408 VanDerWaalsContact O-CB 3.23Å; L404-S408 WeakPolarHBondContact O-CB 3.32Å; L404-S408 PolarHBondContact O-N 3.11Å; L404-S408 PolarHBondContact O-OG 2.92Å; I405-S408 PolarHBondContact O-N 3.28Å; S408-N412 WeakPolarHBondContact O-CB 3.22Å; S408-N412 PolarHBondContact O-N 3.1Å
409V93Very high84.9Confident90 Ų9057.6 Ų57.655%0.54529%0.292SS..Hα-helixtrans-63.1-46.3174.5170.70000110I405 L406 I411 N412 D413I405-V409 HydrophobicContact CG2-CG2 4.29Å; I405-V409 WeakPolarHBondContact O-CB 3.49Å; I405-V409 WeakPolarHBondContact O-CG2 3.31Å; I405-V409 PolarHBondContact O-N 3.42Å; L406-V409 PolarHBondContact O-N 2.92Å; V409-I411 PolarHBondContact O-N 3.42Å; V409-N412 PolarHBondContact O-N 2.88Å; V409-D413 PolarHBondContact O-N 3.17Å
410F93.6Very high82.5Confident27 Ų2758.2 Ų58.212%0.11829%0.294CS..Hα-helixtrans-58.3-47.7177169.7-100.1000112.5V156 L159 L160 L406 Y407 N412 D413 S414 F415V156-F410 HydrophobicContact CG1-CZ 4.11Å; V156-F410 WeakPolarHBondContact O-CZ 3.47Å; L159-F410 HydrophobicContact CB-CE1 4.5Å; L159-F410 HydrophobicContact CB-CE2 3.8Å; L159-F410 HydrophobicContact CB-CZ 3.76Å; L159-F410 HydrophobicContact CD1-CE2 4.25Å; L160-F410 HydrophobicContact CB-CE1 3.94Å; L160-F410 HydrophobicContact CB-CZ 4.38Å; L160-F410 HydrophobicContact CD1-CE1 4.24Å; L406-F410 WeakPolarHBondContact O-CB 3.41Å; L406-F410 PolarHBondContact O-N 2.99Å; Y407-F410 HydrophobicContact CD2-CD1 4.41Å; Y407-F410 HydrophobicContact CE2-CD1 4.46Å; Y407-F410 PolarHBondContact O-N 3.49Å; F410-N412 VanDerWaalsContact C-N 3.34Å; F410-N412 PolarHBondContact O-N 3.08Å; F410-D413 PolarHBondContact O-N 3.37Å; F410-S414 VanDerWaalsContact CE2-OG 3.29Å; F410-S414 WeakPolarHBondContact CE2-OG 3.4Å; F410-S414 VanDerWaalsContact O-CB 3.28Å; F410-S414 WeakPolarHBondContact O-CB 3.27Å; F410-S414 PolarHBondContact O-N 2.76Å; F410-S414 PolarHBondContact O-OG 3.12Å; F410-F415 HydrophobicContact CE1-CE2 4.19Å; F410-F415 HydrophobicContact CZ-CE2 4.48Å
411I91Very high80Confident6 Ų665.2 Ų65.23%0.03133%0.331CS..Hα-helixtrans-60.6-46.1176.7-74.6170.1000110.8L377 Y407 V409 D413 S414 F415L377-I411 HydrophobicContact CD1-CG2 3.97Å; L377-I411 HydrophobicContact CD2-CD1 3.93Å; L377-I411 HydrophobicContact CD2-CG1 4.14Å; L377-I411 HydrophobicContact CD2-CG2 4.34Å; Y407-I411 HydrophobicContact CD1-CD1 3.56Å; Y407-I411 HydrophobicContact CD1-CG1 4.41Å; Y407-I411 HydrophobicContact CE1-CD1 3.29Å; Y407-I411 HydrophobicContact CE1-CG1 4.23Å; Y407-I411 HydrophobicContact CG-CD1 4.3Å; Y407-I411 WeakPolarHBondContact O-CG1 3.24Å; Y407-I411 PolarHBondContact O-N 3.26Å; V409-I411 PolarHBondContact O-N 3.42Å; I411-D413 VanDerWaalsContact C-N 3.32Å; I411-D413 PolarHBondContact O-N 3.34Å; I411-S414 PolarHBondContact O-N 3.2Å; I411-F415 WeakPolarHBondContact O-CB 3.43Å; I411-F415 PolarHBondContact O-N 3.18Å
412N86.2Confident77.9Confident72 Ų7273.7 Ų73.739%0.38536%0.361SS..Hα-helixtrans-61.9-39.9-177.9-176.265.3000111.8S408 V409 F410 R416S408-N412 WeakPolarHBondContact O-CB 3.22Å; S408-N412 PolarHBondContact O-N 3.1Å; V409-N412 PolarHBondContact O-N 2.88Å; F410-N412 VanDerWaalsContact C-N 3.34Å; F410-N412 PolarHBondContact O-N 3.08Å; N412-R416 WeakPolarHBondContact O-CB 3.49Å; N412-R416 WeakPolarHBondContact OD1-CD 3.41Å; N412-R416 PolarHBondContact OD1-NH1 2.97Å
413D85.7Confident75.9Confident111 Ų11178 Ų7859%0.59437%0.367SS*.Hα-helixtrans-72.4-48.3176.5-173.966.3000112.1V409 F410 I411V409-D413 PolarHBondContact O-N 3.17Å; F410-D413 PolarHBondContact O-N 3.37Å; I411-D413 VanDerWaalsContact C-N 3.32Å; I411-D413 PolarHBondContact O-N 3.34Å
414S84.6Confident74Confident31 Ų3180.6 Ų80.622%0.21739%0.386CS..Hα-helixtrans-79.6-35.4-168.6-65.40000114.4F410 I411F410-S414 VanDerWaalsContact CE2-OG 3.29Å; F410-S414 WeakPolarHBondContact CE2-OG 3.4Å; F410-S414 VanDerWaalsContact O-CB 3.28Å; F410-S414 WeakPolarHBondContact O-CB 3.27Å; F410-S414 PolarHBondContact O-N 2.76Å; F410-S414 PolarHBondContact O-OG 3.12Å; I411-S414 PolarHBondContact O-N 3.2Å
415F76.1Confident72.6Confident24 Ų2489.3 Ų89.311%0.10542%0.423CS..Hα-helixtrans-110.4-25.7-170.3-68.4-88.9000113.4V156 L160 V369 T373 L377 F410 I411 W418 T419V156-F415 HydrophobicContact CG1-CE2 3.85Å; V156-F415 HydrophobicContact CG1-CZ 3.79Å; L160-F415 HydrophobicContact CB-CE2 4.45Å; L160-F415 HydrophobicContact CB-CZ 4.4Å; L160-F415 HydrophobicContact CD1-CE2 3.88Å; L160-F415 HydrophobicContact CD1-CZ 4.16Å; L160-F415 HydrophobicContact CD2-CE1 4.47Å; L160-F415 HydrophobicContact CD2-CE2 4.33Å; L160-F415 HydrophobicContact CD2-CZ 3.76Å; L160-F415 HydrophobicContact CG-CE2 4.45Å; L160-F415 HydrophobicContact CG-CZ 4.33Å; V369-F415 HydrophobicContact CG1-CE1 4.07Å; T373-F415 HydrophobicContact CG2-CD1 3.82Å; T373-F415 HydrophobicContact CG2-CE1 4.43Å; L377-F415 HydrophobicContact CD1-CB 4.1Å; L377-F415 HydrophobicContact CD1-CG 4.24Å; F410-F415 HydrophobicContact CE1-CE2 4.19Å; F410-F415 HydrophobicContact CZ-CE2 4.48Å; I411-F415 WeakPolarHBondContact O-CB 3.43Å; I411-F415 PolarHBondContact O-N 3.18Å; F415-W418 PolarHBondContact O-N 3.4Å; F415-T419 PolarHBondContact O-N 3.03Å; F415-T419 PolarHBondContact O-OG1 2.98Å
416R58.3Low71.6Confident104 Ų10490.6 Ų90.639%0.39242%0.422SS..Hα-helixtrans-71.7-35-174.3-156.1163.6-172.4-145.9-2.4112.9N412 W418 L420 H432N412-R416 WeakPolarHBondContact O-CB 3.49Å; N412-R416 WeakPolarHBondContact OD1-CD 3.41Å; N412-R416 PolarHBondContact OD1-NH1 2.97Å; R416-W418 VanDerWaalsContact C-N 3.28Å; R416-W418 PolarHBondContact O-N 3.14Å; R416-L420 HydrophobicContact CB-CD1 4.24Å; R416-L420 HydrophobicContact CG-CB 4.35Å; R416-L420 HydrophobicContact CG-CD1 3.63Å; R416-H432 PolarHBondContact NH2-CE1 2.88Å; R416-H432 PolarHBondContact NH2-NE2 3.4Å
417M47.4Very low70.7Confident149 Ų14987.5 Ų87.573%0.73441%0.406SS*.Hα-helixtrans-71.5-17.8177.2-69.2-156.5-4900114.3
418W49.1Very low70Confident206 Ų20688.7 Ų88.778%0.7842%0.415SS*.Hα-helixtrans-116-30-172.7-140.276.3000114.7F415 R416F415-W418 PolarHBondContact O-N 3.4Å; R416-W418 VanDerWaalsContact C-N 3.28Å; R416-W418 PolarHBondContact O-N 3.14Å
419T52.1Low69.7Low34 Ų3491.7 Ų91.721%0.20943%0.432CS..Hα-helixtrans-112.5-24.2-170.757.90000115.3T373 F415T373-T419 HydrophobicContact CG2-CG2 4.17Å; F415-T419 PolarHBondContact O-N 3.03Å; F415-T419 PolarHBondContact O-OG1 2.98Å
420L46.1Very low69.5Low32 Ų3289.9 Ų89.917%0.16842%0.419CS..G310 helixtrans-83.8-22.9-175.9-87.6160.1000113.8L374 R416 R422L374-L420 HydrophobicContact CD1-CD2 3.97Å; L374-L420 HydrophobicContact CD2-CD2 3.65Å; L374-L420 HydrophobicContact CG-CD2 4.44Å; R416-L420 HydrophobicContact CB-CD1 4.24Å; R416-L420 HydrophobicContact CG-CB 4.35Å; R416-L420 HydrophobicContact CG-CD1 3.63Å; L420-R422 VanDerWaalsContact C-N 3.3Å; L420-R422 PolarHBondContact O-N 3.48Å
421D46.5Very low69.3Low147 Ų14789.3 Ų89.379%0.78642%0.416SS*.G310 helixtrans-76.3-11.2178.2-87-17.4000114.7
422R53.3Low69.2Low233 Ų23392.4 Ų92.488%0.87943%0.43SS*.G310 helixtrans-1110.3-177.2-68.9-168.2176.1-171.10.4115.1L420L420-R422 VanDerWaalsContact C-N 3.3Å; L420-R422 PolarHBondContact O-N 3.48Å
423R54.3Low69.6Low138 Ų13892.1 Ų92.152%0.52143%0.431SS..SBendtrans-118.5151.2-175.8-67.6-80.7-165.6168.64.8110.2
424P58.8Low70Confident79 Ų7987 Ų8751%0.51340%0.404SS..  trans-58.6140.5-175.925.6-38.4000112.2W426 G427P424-W426 PolarHBondContact O-N 3.5Å; P424-G427 PolarHBondContact O-N 3.25Å
425K68Low70.5Confident190 Ų19086.4 Ų86.483%0.82640%0.399SS*.THydrogen-bonded Turntrans-47.7-27.2-171.7-66.8-177.7176.6-179.20115G427 S428 V429K425-G427 PolarHBondContact O-N 3.01Å; K425-S428 PolarHBondContact O-N 3.34Å; K425-V429 WeakPolarHBondContact O-CG2 3.3Å; K425-V429 PolarHBondContact O-N 3.02Å
426W75.6Confident71.4Confident132 Ų13292 Ų9250%0.542%0.423SS..Hα-helixtrans-60.8-37.3-176.670.7-96.7000114P424 V429 L430 F472P424-W426 PolarHBondContact O-N 3.5Å; W426-V429 PolarHBondContact O-N 3.05Å; W426-L430 HydrophobicContact CZ3-CD2 4.32Å; W426-L430 WeakPolarHBondContact O-CB 3.45Å; W426-L430 PolarHBondContact O-N 3.18Å; W426-F472 HydrophobicContact CZ3-CE1 4.4Å; W426-F472 HydrophobicContact CZ3-CZ 4.21Å
427G77.1Confident73.2Confident3 Ų389.1 Ų89.13%0.03142%0.417CS..Hα-helixtrans-68.5-38.4-178.300000112.2P424 K425 V429 L430 Y431P424-G427 PolarHBondContact O-N 3.25Å; K425-G427 PolarHBondContact O-N 3.01Å; G427-V429 VanDerWaalsContact C-N 3.33Å; G427-L430 PolarHBondContact O-N 3.25Å; G427-Y431 PolarHBondContact O-N 3.16Å
428S80.7Confident75.6Confident29 Ų2982 Ų8220%0.20338%0.382CS..Hα-helixtrans-64.7-42.6175.2-164.10000110.7K425 L430 Y431 H432K425-S428 PolarHBondContact O-N 3.34Å; S428-L430 VanDerWaalsContact C-N 3.34Å; S428-Y431 PolarHBondContact O-N 3.12Å; S428-H432 PolarHBondContact O-CD2 3.09Å; S428-H432 PolarHBondContact O-N 2.71Å; S428-H432 PolarHBondContact OG-NE2 2.7Å
429V86.4Confident77.9Confident88 Ų8876.3 Ų76.353%0.53337%0.366SS..Hα-helixtrans-59.4-48.4175.8172.40000109.6K425 W426 G427 Y431 H432 T433K425-V429 WeakPolarHBondContact O-CG2 3.3Å; K425-V429 PolarHBondContact O-N 3.02Å; W426-V429 PolarHBondContact O-N 3.05Å; G427-V429 VanDerWaalsContact C-N 3.33Å; V429-Y431 VanDerWaalsContact C-N 3.34Å; V429-Y431 PolarHBondContact O-N 3.47Å; V429-H432 PolarHBondContact O-N 2.76Å; V429-T433 WeakPolarHBondContact O-CB 3.33Å; V429-T433 PolarHBondContact O-N 3.39Å; V429-T433 PolarHBondContact O-OG1 2.87Å
430L88.3Confident80Confident52 Ų5277.5 Ų77.527%0.27237%0.373SS..Hα-helixtrans-59.5-43.8179.2-172.459.9000111.9I378 W426 G427 S428 H432 T433 T434 F472I378-L430 HydrophobicContact CD1-CB 4.06Å; I378-L430 HydrophobicContact CD1-CD2 3.96Å; I378-L430 HydrophobicContact CD1-CG 3.99Å; I378-L430 HydrophobicContact CG2-CG 4.45Å; W426-L430 HydrophobicContact CZ3-CD2 4.32Å; W426-L430 WeakPolarHBondContact O-CB 3.45Å; W426-L430 PolarHBondContact O-N 3.18Å; G427-L430 PolarHBondContact O-N 3.25Å; S428-L430 VanDerWaalsContact C-N 3.34Å; L430-H432 PolarHBondContact O-N 2.8Å; L430-T433 PolarHBondContact O-N 3.31Å; L430-T434 WeakPolarHBondContact O-CB 3.44Å; L430-T434 PolarHBondContact O-N 3.15Å; L430-T434 PolarHBondContact O-OG1 3.37Å; L430-F472 HydrophobicContact CD2-CD1 4.26Å; L430-F472 HydrophobicContact CD2-CE1 3.8Å
431Y89.9Confident82.4Confident16 Ų1676.8 Ų76.86%0.06337%0.37CS..Hα-helixtrans-58.9-46.6175.3178.2-95000113.2L374 L377 I378 V381 G427 S428 V429 T434 N435L374-Y431 HydrophobicContact CD1-CG 4.49Å; L377-Y431 HydrophobicContact CB-CE2 4.39Å; I378-Y431 HydrophobicContact CG1-CD2 3.97Å; I378-Y431 HydrophobicContact CG1-CG 4.41Å; V381-Y431 HydrophobicContact CG2-CE2 3.76Å; G427-Y431 PolarHBondContact O-N 3.16Å; S428-Y431 PolarHBondContact O-N 3.12Å; V429-Y431 VanDerWaalsContact C-N 3.34Å; V429-Y431 PolarHBondContact O-N 3.47Å; Y431-T434 PolarHBondContact O-N 2.63Å; Y431-N435 WeakPolarHBondContact CE1-ND2 3.34Å; Y431-N435 PolarHBondContact O-N 3.48Å; Y431-N435 VanDerWaalsContact O-N 3.11Å; Y431-N435 PolarHBondContact O-ND2 2.95Å
432H89.7Confident84.8Confident71 Ų7169.8 Ų69.833%0.32933%0.332SS..Hα-helixtrans-68.2-38.6178.1-68.1-51.7000112R416 S428 V429 L430 N435 F436R416-H432 PolarHBondContact NH2-CE1 2.88Å; R416-H432 PolarHBondContact NH2-NE2 3.4Å; S428-H432 PolarHBondContact O-CD2 3.09Å; S428-H432 PolarHBondContact O-N 2.71Å; S428-H432 PolarHBondContact OG-NE2 2.7Å; V429-H432 PolarHBondContact O-N 2.76Å; L430-H432 PolarHBondContact O-N 2.8Å; H432-N435 PolarHBondContact O-N 3.39Å; H432-F436 VanDerWaalsContact O-CB 3.29Å; H432-F436 WeakPolarHBondContact O-CB 3.33Å; H432-F436 PolarHBondContact O-N 3.36Å
433T92.9Very high86.8Confident66 Ų6660.4 Ų60.441%0.40531%0.305SS..Hα-helixtrans-63.6-43.6175.1-59.70000111.2V429 L430 N435 F436 V437V429-T433 WeakPolarHBondContact O-CB 3.33Å; V429-T433 PolarHBondContact O-N 3.39Å; V429-T433 PolarHBondContact O-OG1 2.87Å; L430-T433 PolarHBondContact O-N 3.31Å; T433-N435 VanDerWaalsContact C-N 3.34Å; T433-N435 PolarHBondContact O-N 2.69Å; T433-F436 PolarHBondContact O-N 3.37Å; T433-V437 HydrophobicContact CG2-CG2 4.17Å; T433-V437 WeakPolarHBondContact O-CB 3.46Å; T433-V437 VanDerWaalsContact O-CG2 3.31Å; T433-V437 WeakPolarHBondContact O-CG2 3.49Å; T433-V437 PolarHBondContact O-N 3.39Å
434T94.8Very high88.8Confident3 Ų356.5 Ų56.52%0.01830%0.296CS..Hα-helixtrans-59.8-45.4176.4-64.30000111.3I378 V381 A382 L430 Y431 G438 F465I378-T434 HydrophobicContact CG2-CG2 4.45Å; V381-T434 HydrophobicContact CG1-CG2 4.41Å; A382-T434 HydrophobicContact CB-CG2 4.02Å; L430-T434 WeakPolarHBondContact O-CB 3.44Å; L430-T434 PolarHBondContact O-N 3.15Å; L430-T434 PolarHBondContact O-OG1 3.37Å; Y431-T434 PolarHBondContact O-N 2.63Å; T434-G438 PolarHBondContact O-N 3.49Å; T434-F465 HydrophobicContact CG2-CZ 3.94Å; T434-F465 WeakPolarHBondContact O-CZ 3.46Å
435N94.6Very high90.6Very high19 Ų1953.9 Ų53.910%0.10228%0.28CS..Hα-helixtrans-62.3-47.9175.1-83.6-82.8000112.2V381 Y431 H432 T433 G438 I439V381-N435 WeakPolarHBondContact CG1-OD1 3.28Å; Y431-N435 WeakPolarHBondContact CE1-ND2 3.34Å; Y431-N435 PolarHBondContact O-N 3.48Å; Y431-N435 VanDerWaalsContact O-N 3.11Å; Y431-N435 PolarHBondContact O-ND2 2.95Å; H432-N435 PolarHBondContact O-N 3.39Å; T433-N435 VanDerWaalsContact C-N 3.34Å; T433-N435 PolarHBondContact O-N 2.69Å; N435-G438 PolarHBondContact O-N 3.49Å; N435-I439 WeakPolarHBondContact O-CB 3.38Å; N435-I439 VanDerWaalsContact O-CG1 3.26Å; N435-I439 WeakPolarHBondContact O-CG1 3.46Å; N435-I439 PolarHBondContact O-N 3.22Å
436F95.7Very high91.9Very high140 Ų14048.6 Ų48.661%0.61426%0.26SS*.Hα-helixtrans-60.1-51.1-178.8177.7-101.7000111.5H432 T433 G438 I439 V440H432-F436 VanDerWaalsContact O-CB 3.29Å; H432-F436 WeakPolarHBondContact O-CB 3.33Å; H432-F436 PolarHBondContact O-N 3.36Å; T433-F436 PolarHBondContact O-N 3.37Å; F436-G438 PolarHBondContact O-N 2.82Å; F436-I439 PolarHBondContact O-N 3.32Å; F436-V440 HydrophobicContact CD1-CG2 4.37Å; F436-V440 HydrophobicContact CD2-CG2 4.38Å; F436-V440 HydrophobicContact CE1-CG2 4.01Å; F436-V440 HydrophobicContact CE2-CG2 4.01Å; F436-V440 HydrophobicContact CZ-CG2 3.82Å; F436-V440 WeakPolarHBondContact O-CB 3.26Å; F436-V440 VanDerWaalsContact O-CG2 3.27Å; F436-V440 WeakPolarHBondContact O-CG2 3.33Å; F436-V440 PolarHBondContact O-N 2.75Å
437V96.7Very high92.8Very high45 Ų4549.4 Ų49.427%0.27327%0.273SS..Hα-helixtrans-62.1-44.8178.7175.70000110.6T433 I439 V440 V441 F465T433-V437 HydrophobicContact CG2-CG2 4.17Å; T433-V437 WeakPolarHBondContact O-CB 3.46Å; T433-V437 VanDerWaalsContact O-CG2 3.31Å; T433-V437 WeakPolarHBondContact O-CG2 3.49Å; T433-V437 PolarHBondContact O-N 3.39Å; V437-I439 PolarHBondContact O-N 2.79Å; V437-V440 PolarHBondContact O-N 3.5Å; V437-V441 HydrophobicContact CG1-CG2 4.31Å; V437-V441 VanDerWaalsContact O-CG2 3.31Å; V437-V441 WeakPolarHBondContact O-CG2 3.38Å; V437-V441 PolarHBondContact O-N 2.85Å; V437-F465 HydrophobicContact CB-CD2 4.3Å; V437-F465 HydrophobicContact CB-CE2 3.73Å; V437-F465 HydrophobicContact CB-CZ 3.89Å; V437-F465 HydrophobicContact CG1-CD1 4.36Å; V437-F465 HydrophobicContact CG1-CD2 3.52Å; V437-F465 HydrophobicContact CG1-CE1 4.31Å; V437-F465 HydrophobicContact CG1-CE2 3.47Å; V437-F465 VanDerWaalsContact CG1-CE2 3.47Å; V437-F465 HydrophobicContact CG1-CG 3.98Å; V437-F465 HydrophobicContact CG1-CZ 3.88Å; V437-F465 HydrophobicContact CG2-CE2 4.47Å
438G97.2Very high93.6Very high0 Ų052.2 Ų52.20%029%0.292CS..Hα-helixtrans-57.3-47.9176.900000112.8F385 T434 N435 F436 V441 C442F385-G438 VanDerWaalsContact CE1-C 3.45Å; T434-G438 PolarHBondContact O-N 3.49Å; N435-G438 PolarHBondContact O-N 3.49Å; F436-G438 PolarHBondContact O-N 2.82Å; G438-V441 PolarHBondContact O-N 3.13Å; G438-C442 PolarHBondContact O-N 3.37Å; G438-C442 PolarHBondContact O-SG 2.9Å
439I96.9Very high94.2Very high85 Ų8558.5 Ų58.544%0.43632%0.323SS..Hα-helixtrans-63.6-44.2177.9-68.9165.9000111.1F385 N435 F436 V437 V441 C442 A443F385-I439 HydrophobicContact CE1-CG1 4.21Å; F385-I439 HydrophobicContact CZ-CG1 3.98Å; N435-I439 WeakPolarHBondContact O-CB 3.38Å; N435-I439 VanDerWaalsContact O-CG1 3.26Å; N435-I439 WeakPolarHBondContact O-CG1 3.46Å; N435-I439 PolarHBondContact O-N 3.22Å; F436-I439 PolarHBondContact O-N 3.32Å; V437-I439 PolarHBondContact O-N 2.79Å; I439-V441 PolarHBondContact O-N 3.09Å; I439-C442 PolarHBondContact O-N 2.68Å; I439-A443 WeakPolarHBondContact O-CB 3.46Å; I439-A443 PolarHBondContact O-N 3.23Å
440V96.8Very high94.4Very high60 Ų6056 Ų5636%0.36431%0.312SS..Hα-helixtrans-60.8-46.1178.9168.80000110.6F436 V437 C442 A443 V444F436-V440 HydrophobicContact CD1-CG2 4.37Å; F436-V440 HydrophobicContact CD2-CG2 4.38Å; F436-V440 HydrophobicContact CE1-CG2 4.01Å; F436-V440 HydrophobicContact CE2-CG2 4.01Å; F436-V440 HydrophobicContact CZ-CG2 3.82Å; F436-V440 WeakPolarHBondContact O-CB 3.26Å; F436-V440 VanDerWaalsContact O-CG2 3.27Å; F436-V440 WeakPolarHBondContact O-CG2 3.33Å; F436-V440 PolarHBondContact O-N 2.75Å; V437-V440 PolarHBondContact O-N 3.5Å; V440-C442 VanDerWaalsContact C-N 3.34Å; V440-C442 PolarHBondContact O-N 3.13Å; V440-A443 PolarHBondContact O-N 3.42Å; V440-V444 HydrophobicContact CG1-CG2 4.23Å; V440-V444 WeakPolarHBondContact O-CB 3.43Å; V440-V444 VanDerWaalsContact O-CG2 3.25Å; V440-V444 WeakPolarHBondContact O-CG2 3.3Å; V440-V444 PolarHBondContact O-N 2.93Å
441V96.1Very high94.6Very high16 Ų1656.6 Ų56.610%0.09732%0.319CS..Hα-helixtrans-63.5-41178178.20000111V437 G438 I439 S445 T461 M462V437-V441 HydrophobicContact CG1-CG2 4.31Å; V437-V441 VanDerWaalsContact O-CG2 3.31Å; V437-V441 WeakPolarHBondContact O-CG2 3.38Å; V437-V441 PolarHBondContact O-N 2.85Å; G438-V441 PolarHBondContact O-N 3.13Å; I439-V441 PolarHBondContact O-N 3.09Å; V441-S445 VanDerWaalsContact O-CB 3.26Å; V441-S445 WeakPolarHBondContact O-CB 3.35Å; V441-S445 PolarHBondContact O-N 3.14Å; V441-T461 HydrophobicContact CG1-CG2 4.22Å; V441-T461 HydrophobicContact CG2-CG2 4.02Å; V441-M462 HydrophobicContact CB-CE 3.79Å; V441-M462 HydrophobicContact CG1-CB 4Å; V441-M462 HydrophobicContact CG1-CE 3.7Å; V441-M462 HydrophobicContact CG1-SD 4.34Å
442C97Very high94.6Very high0 Ų064.4 Ų64.40%036%0.36CS..Hα-helixtrans-62.2-47.1175-63.60000111.8F388 F401 G438 I439 V440 S445 L446 M462F388-C442 HydrophobicContact CD1-CB 4.38Å; F388-C442 HydrophobicContact CD2-CB 4.28Å; F388-C442 HydrophobicContact CE1-CB 4.19Å; F388-C442 HydrophobicContact CE2-CB 4.07Å; F388-C442 HydrophobicContact CG-CB 4.43Å; F388-C442 VanDerWaalsContact CG-SG 3.57Å; F388-C442 HydrophobicContact CZ-CB 4.02Å; F401-C442 HydrophobicContact CE1-CB 4.32Å; F401-C442 HydrophobicContact CZ-CB 3.88Å; G438-C442 PolarHBondContact O-N 3.37Å; G438-C442 PolarHBondContact O-SG 2.9Å; I439-C442 PolarHBondContact O-N 2.68Å; V440-C442 VanDerWaalsContact C-N 3.34Å; V440-C442 PolarHBondContact O-N 3.13Å; C442-S445 PolarHBondContact O-N 2.79Å; C442-L446 WeakPolarHBondContact O-CG 3.39Å; C442-L446 PolarHBondContact O-N 3.37Å; C442-L446 VanDerWaalsContact O-N 3.11Å; C442-M462 WeakPolarHBondContact SG-CE 3.45Å
443A96.3Very high94.7Very high37 Ų3764.3 Ų64.331%0.30638%0.378SS..Hα-helixtrans-63-47-179.600000111.5I439 V440 S445 L446 L447I439-A443 WeakPolarHBondContact O-CB 3.46Å; I439-A443 PolarHBondContact O-N 3.23Å; V440-A443 PolarHBondContact O-N 3.42Å; A443-S445 VanDerWaalsContact C-N 3.3Å; A443-S445 PolarHBondContact O-N 3.41Å; A443-L446 PolarHBondContact O-N 2.83Å; A443-L446 VanDerWaalsContact O-N 3.16Å; A443-L447 VanDerWaalsContact O-CB 3.32Å; A443-L447 WeakPolarHBondContact O-CB 3.21Å; A443-L447 VanDerWaalsContact O-CG 3.24Å; A443-L447 WeakPolarHBondContact O-CG 3.06Å; A443-L447 PolarHBondContact O-N 2.75Å
444V95.8Very high94.6Very high56 Ų5665.9 Ų65.934%0.33938%0.383SS..Hα-helixtrans-60.8-42.1175.9172.60000110.5V440 L446 L447 C448 F458V440-V444 HydrophobicContact CG1-CG2 4.23Å; V440-V444 WeakPolarHBondContact O-CB 3.43Å; V440-V444 VanDerWaalsContact O-CG2 3.25Å; V440-V444 WeakPolarHBondContact O-CG2 3.3Å; V440-V444 PolarHBondContact O-N 2.93Å; V444-L446 PolarHBondContact O-N 2.91Å; V444-L447 PolarHBondContact O-N 2.74Å; V444-C448 HydrophobicContact CG1-CB 4.17Å; V444-C448 WeakPolarHBondContact O-CA 3.39Å; V444-C448 VanDerWaalsContact O-CB 3.22Å; V444-C448 WeakPolarHBondContact O-CB 3.44Å; V444-C448 PolarHBondContact O-N 3.44Å; V444-F458 HydrophobicContact CG1-CD1 4Å; V444-F458 HydrophobicContact CG1-CE1 3.49Å; V444-F458 VanDerWaalsContact CG1-CE1 3.49Å; V444-F458 HydrophobicContact CG1-CZ 4.05Å
445S95.3Very high94.3Very high24 Ų2470.2 Ų70.217%0.16841%0.412CS..Hα-helixtrans-63.2-26.4177.8-173.50000114.2H389 V441 C442 A443H389-S445 PolarHBondContact NE2-OG 2.58Å; V441-S445 VanDerWaalsContact O-CB 3.26Å; V441-S445 WeakPolarHBondContact O-CB 3.35Å; V441-S445 PolarHBondContact O-N 3.14Å; C442-S445 PolarHBondContact O-N 2.79Å; A443-S445 VanDerWaalsContact C-N 3.3Å; A443-S445 PolarHBondContact O-N 3.41Å
446L95.3Very high94.1Very high78 Ų7872.8 Ų72.841%0.40843%0.425SS..Hα-helixtrans-92.6-31.8-179.8-68.3169000112.7F388 V392 V397 F401 C442 A443 V444F388-L446 HydrophobicContact CE2-CD1 4.25Å; F388-L446 HydrophobicContact CZ-CD1 3.93Å; F388-L446 HydrophobicContact CZ-CD2 3.98Å; F388-L446 HydrophobicContact CZ-CG 3.81Å; V392-L446 HydrophobicContact CG2-CD2 4.45Å; V397-L446 HydrophobicContact CG1-CD1 3.92Å; V397-L446 HydrophobicContact CG1-CD2 4.23Å; V397-L446 HydrophobicContact CG2-CD2 4.26Å; F401-L446 HydrophobicContact CE2-CD1 3.72Å; F401-L446 HydrophobicContact CZ-CD1 4.09Å; C442-L446 WeakPolarHBondContact O-CG 3.39Å; C442-L446 PolarHBondContact O-N 3.37Å; C442-L446 VanDerWaalsContact O-N 3.11Å; A443-L446 PolarHBondContact O-N 2.83Å; A443-L446 VanDerWaalsContact O-N 3.16Å; V444-L446 PolarHBondContact O-N 2.91Å
447L95.8Very high94Very high149 Ų14968.9 Ų68.978%0.7841%0.411SS*.Hα-helixtrans-97-24.6-173.2-62.8174.4000113A443 V444A443-L447 VanDerWaalsContact O-CB 3.32Å; A443-L447 WeakPolarHBondContact O-CB 3.21Å; A443-L447 VanDerWaalsContact O-CG 3.24Å; A443-L447 WeakPolarHBondContact O-CG 3.06Å; A443-L447 PolarHBondContact O-N 2.75Å; V444-L447 PolarHBondContact O-N 2.74Å
448C94.5Very high93.8Very high63 Ų6368.1 Ų68.143%0.42640%0.404SS..SBendtrans-110140.5-176.9-57.30000110.9V444 F458V444-C448 HydrophobicContact CG1-CB 4.17Å; V444-C448 WeakPolarHBondContact O-CA 3.39Å; V444-C448 VanDerWaalsContact O-CB 3.22Å; V444-C448 WeakPolarHBondContact O-CB 3.44Å; V444-C448 PolarHBondContact O-N 3.44Å; C448-F458 HydrophobicContact CB-CE2 4.49Å; C448-F458 HydrophobicContact CB-CZ 3.96Å; C448-F458 VanDerWaalsContact O-CE2 3.31Å; C448-F458 WeakPolarHBondContact O-CE2 3.22Å
449N91.3Very high93.6Very high160 Ų16069 Ų6986%0.85641%0.41SS*.PPolyproline II helixtrans-75.6139.9169.2-69.2-42.9000110.1
450A91.5Very high93.5Very high36 Ų3666.7 Ų66.730%0.29840%0.4SS..PPolyproline II helixtrans-63.5139172.100000109.7P455 F458A450-P455 WeakPolarHBondContact CB-O 3.42Å; A450-F458 HydrophobicContact CB-CD2 4.41Å; A450-F458 HydrophobicContact CB-CE2 4.06Å
451P92.7Very high93.4Very high64 Ų6466.7 Ų66.742%0.41640%0.4SS..PPolyproline II helixtrans-57.5144.6173.9-22.332.4000111.2G453 L454 L457P451-G453 PolarHBondContact O-N 3.5Å; P451-L454 CarbonylContact O-C 3.28Å; P451-L454 VanDerWaalsContact O-C 3.28Å; P451-L454 PolarHBondContact O-N 3.12Å; P451-L457 HydrophobicContact CG-CD2 4.06Å
452I89.1Confident93.4Very high180 Ų18066 Ų6692%0.92340%0.396SS*.THydrogen-bonded Turntrans-54.1-34.9-175.6-60.8169.2000112.3
453G91.9Very high93.3Very high69 Ų6966.3 Ų66.371%0.71140%0.398SS*.THydrogen-bonded Turntrans-83.4-8.6178.200000115.5P451P451-G453 PolarHBondContact O-N 3.5Å
454L90.4Very high93.2Very high99 Ų9967.3 Ų67.352%0.51840%0.4SS..  trans-139.463.2-174-62.3172.5000110.8P451 D456 L457P451-L454 CarbonylContact O-C 3.28Å; P451-L454 VanDerWaalsContact O-C 3.28Å; P451-L454 PolarHBondContact O-N 3.12Å; L454-D456 PolarHBondContact O-N 3.49Å; L454-L457 HydrophobicContact CB-CB 4.06Å; L454-L457 HydrophobicContact CD1-CD1 4.39Å; L454-L457 VanDerWaalsContact O-CB 3.31Å; L454-L457 WeakPolarHBondContact O-CB 3.09Å; L454-L457 PolarHBondContact O-N 2.97Å; L454-L457 VanDerWaalsContact O-N 3.1Å
455P89.3Confident93.3Very high95 Ų9566.4 Ų66.462%0.61739%0.391SS*.THydrogen-bonded Turntrans-60.3-30.7-17524.8-35.1000113.1A450A450-P455 WeakPolarHBondContact CB-O 3.42Å
456D90.2Very high93.4Very high72 Ų7265.2 Ų65.239%0.38538%0.383SS..THydrogen-bonded Turntrans-93.17.7-177.9-70.5-45.7000113.7K284 L454 F458 S459 V460K284-D456 WeakPolarHBondContact CE-OD1 3.21Å; K284-D456 WeakPolarHBondContact CE-OD2 3.16Å; K284-D456 IonicContact NZ-OD1 3.78Å; K284-D456 PolarHBondContact NZ-OD1 3.49Å; K284-D456 IonicContact NZ-OD2 3.5Å; K284-D456 PolarHBondContact NZ-OD2 3.2Å; L454-D456 PolarHBondContact O-N 3.49Å; D456-F458 VanDerWaalsContact C-N 3.35Å; D456-F458 PolarHBondContact O-N 3.32Å; D456-S459 PolarHBondContact O-N 2.63Å; D456-S459 VanDerWaalsContact O-N 3.12Å; D456-S459 PolarHBondContact O-OG 3.19Å; D456-V460 HydrophobicContact CB-CG2 4.19Å; D456-V460 WeakPolarHBondContact O-CG2 3.42Å; D456-V460 PolarHBondContact O-N 3.32Å
457L93.4Very high93.4Very high59 Ų5961.7 Ų61.731%0.30937%0.365SS..Hα-helixtrans-47.7-53.4-170.1179.259.1000112.7P451 L454 S459 V460 T461P451-L457 HydrophobicContact CG-CD2 4.06Å; L454-L457 HydrophobicContact CB-CB 4.06Å; L454-L457 HydrophobicContact CD1-CD1 4.39Å; L454-L457 VanDerWaalsContact O-CB 3.31Å; L454-L457 WeakPolarHBondContact O-CB 3.09Å; L454-L457 PolarHBondContact O-N 2.97Å; L454-L457 VanDerWaalsContact O-N 3.1Å; L457-S459 PolarHBondContact O-N 3.05Å; L457-V460 PolarHBondContact O-N 3.35Å; L457-T461 WeakPolarHBondContact O-CB 3.4Å; L457-T461 PolarHBondContact O-N 3.06Å; L457-T461 PolarHBondContact O-OG1 2.83Å
458F93.8Very high93.5Very high29 Ų2957.6 Ų57.613%0.12735%0.353CS..Hα-helixtrans-68.4-37.8-175-52.4-50.8000112.9H389 V444 C448 A450 D456 V460 T461 M462H389-F458 PolarHBondContact CE1-O 2.75Å; V444-F458 HydrophobicContact CG1-CD1 4Å; V444-F458 HydrophobicContact CG1-CE1 3.49Å; V444-F458 VanDerWaalsContact CG1-CE1 3.49Å; V444-F458 HydrophobicContact CG1-CZ 4.05Å; C448-F458 HydrophobicContact CB-CE2 4.49Å; C448-F458 HydrophobicContact CB-CZ 3.96Å; C448-F458 VanDerWaalsContact O-CE2 3.31Å; C448-F458 WeakPolarHBondContact O-CE2 3.22Å; A450-F458 HydrophobicContact CB-CD2 4.41Å; A450-F458 HydrophobicContact CB-CE2 4.06Å; D456-F458 VanDerWaalsContact C-N 3.35Å; D456-F458 PolarHBondContact O-N 3.32Å; F458-V460 VanDerWaalsContact C-N 3.34Å; F458-V460 PolarHBondContact O-N 2.95Å; F458-T461 PolarHBondContact O-N 2.92Å; F458-M462 PolarHBondContact O-N 3Å
459S92.8Very high93.6Very high17 Ų1755.4 Ų55.412%0.11934%0.337CS..Hα-helixtrans-64-41175.671.70000111.9H389 D456 L457 S463H389-S459 VanDerWaalsContact CE1-CA 3.4Å; H389-S459 WeakPolarHBondContact CE1-CA 3.43Å; H389-S459 WeakPolarHBondContact NE2-CA 3.45Å; H389-S459 PolarHBondContact NE2-N 2.62Å; D456-S459 PolarHBondContact O-N 2.63Å; D456-S459 VanDerWaalsContact O-N 3.12Å; D456-S459 PolarHBondContact O-OG 3.19Å; L457-S459 PolarHBondContact O-N 3.05Å; S459-S463 WeakPolarHBondContact O-CB 3.48Å; S459-S463 PolarHBondContact O-N 3.33Å; S459-S463 PolarHBondContact O-OG 3.01Å
460V93.6Very high93.9Very high38 Ų3847.8 Ų47.823%0.2330%0.297CS..Hα-helixtrans-69.2-42.5175.6174.70000110.5K284 V294 D456 L457 F458 M462 S463 V464K284-V460 HydrophobicContact CG-CG2 4.01Å; V294-V460 HydrophobicContact CG2-CG1 3.52Å; D456-V460 HydrophobicContact CB-CG2 4.19Å; D456-V460 WeakPolarHBondContact O-CG2 3.42Å; D456-V460 PolarHBondContact O-N 3.32Å; L457-V460 PolarHBondContact O-N 3.35Å; F458-V460 VanDerWaalsContact C-N 3.34Å; F458-V460 PolarHBondContact O-N 2.95Å; V460-M462 PolarHBondContact O-N 3.32Å; V460-S463 PolarHBondContact O-N 2.93Å; V460-V464 HydrophobicContact CG1-CG2 4.1Å; V460-V464 WeakPolarHBondContact O-CB 3.18Å; V460-V464 VanDerWaalsContact O-CG2 3.27Å; V460-V464 WeakPolarHBondContact O-CG2 3.45Å; V460-V464 PolarHBondContact O-N 3.02Å
461T95.5Very high94.2Very high59 Ų5948.3 Ų48.336%0.36230%0.296SS..Hα-helixtrans-58.4-46.9176.7-61.80000111.5V441 L457 F458 S463 V464 F465V441-T461 HydrophobicContact CG1-CG2 4.22Å; V441-T461 HydrophobicContact CG2-CG2 4.02Å; L457-T461 WeakPolarHBondContact O-CB 3.4Å; L457-T461 PolarHBondContact O-N 3.06Å; L457-T461 PolarHBondContact O-OG1 2.83Å; F458-T461 PolarHBondContact O-N 2.92Å; T461-S463 VanDerWaalsContact C-N 3.35Å; T461-S463 PolarHBondContact O-N 2.94Å; T461-V464 PolarHBondContact O-N 2.93Å; T461-F465 VanDerWaalsContact O-CB 3.31Å; T461-F465 WeakPolarHBondContact O-CB 3.27Å; T461-F465 PolarHBondContact O-N 3.32Å
462M95.8Very high94.3Very high2 Ų250.2 Ų50.21%0.0130%0.298CS..Hα-helixtrans-62.1-43.8176.7-174.66084.600111.6F385 V441 C442 F458 V460 F465 A466F385-M462 HydrophobicContact CB-CE 4.2Å; F385-M462 HydrophobicContact CB-SD 3.83Å; F385-M462 HydrophobicContact CD1-CE 4.32Å; F385-M462 WeakPolarHBondContact O-CG 3.37Å; V441-M462 HydrophobicContact CB-CE 3.79Å; V441-M462 HydrophobicContact CG1-CB 4Å; V441-M462 HydrophobicContact CG1-CE 3.7Å; V441-M462 HydrophobicContact CG1-SD 4.34Å; C442-M462 WeakPolarHBondContact SG-CE 3.45Å; F458-M462 PolarHBondContact O-N 3Å; V460-M462 PolarHBondContact O-N 3.32Å; M462-F465 PolarHBondContact O-N 3.17Å; M462-F465 HydrophobicContact SD-CD1 3.99Å; M462-A466 WeakPolarHBondContact O-CB 3.31Å; M462-A466 PolarHBondContact O-N 3.41Å
463S94.3Very high94.6Very high6 Ų641.9 Ų41.94%0.04226%0.255CS..Hα-helixtrans-62-46179.3-590000112.2K284 A286 S459 V460 T461 A466 C467K284-S463 PolarHBondContact O-OG 3.14Å; A286-S463 WeakPolarHBondContact CA-O 3.36Å; A286-S463 WeakPolarHBondContact CB-O 3.26Å; S459-S463 WeakPolarHBondContact O-CB 3.48Å; S459-S463 PolarHBondContact O-N 3.33Å; S459-S463 PolarHBondContact O-OG 3.01Å; V460-S463 PolarHBondContact O-N 2.93Å; T461-S463 VanDerWaalsContact C-N 3.35Å; T461-S463 PolarHBondContact O-N 2.94Å; S463-A466 PolarHBondContact O-N 2.98Å; S463-C467 WeakPolarHBondContact O-CB 3.39Å; S463-C467 PolarHBondContact O-N 2.89Å
464V95.8Very high94.9Very high59 Ų5939.3 Ų39.336%0.35823%0.225SC..Hα-helixtrans-64.9-43.3178.3171.40000110.8V294 V460 T461 C467 A468V294-V464 HydrophobicContact CG2-CG2 4.43Å; V460-V464 HydrophobicContact CG1-CG2 4.1Å; V460-V464 WeakPolarHBondContact O-CB 3.18Å; V460-V464 VanDerWaalsContact O-CG2 3.27Å; V460-V464 WeakPolarHBondContact O-CG2 3.45Å; V460-V464 PolarHBondContact O-N 3.02Å; T461-V464 PolarHBondContact O-N 2.93Å; V464-C467 PolarHBondContact O-N 3.17Å; V464-A468 PolarHBondContact O-N 3.14Å
465F96.5Very high95.1Very high36 Ų3640.1 Ų40.116%0.15823%0.229CC..Hα-helixtrans-60.1-51.9176.2163.6-109.5000111.9T434 V437 T461 M462 C467 A468 V469T434-F465 HydrophobicContact CG2-CZ 3.94Å; T434-F465 WeakPolarHBondContact O-CZ 3.46Å; V437-F465 HydrophobicContact CB-CD2 4.3Å; V437-F465 HydrophobicContact CB-CE2 3.73Å; V437-F465 HydrophobicContact CB-CZ 3.89Å; V437-F465 HydrophobicContact CG1-CD1 4.36Å; V437-F465 HydrophobicContact CG1-CD2 3.52Å; V437-F465 HydrophobicContact CG1-CE1 4.31Å; V437-F465 HydrophobicContact CG1-CE2 3.47Å; V437-F465 VanDerWaalsContact CG1-CE2 3.47Å; V437-F465 HydrophobicContact CG1-CG 3.98Å; V437-F465 HydrophobicContact CG1-CZ 3.88Å; V437-F465 HydrophobicContact CG2-CE2 4.47Å; T461-F465 VanDerWaalsContact O-CB 3.31Å; T461-F465 WeakPolarHBondContact O-CB 3.27Å; T461-F465 PolarHBondContact O-N 3.32Å; M462-F465 PolarHBondContact O-N 3.17Å; M462-F465 HydrophobicContact SD-CD1 3.99Å; F465-C467 VanDerWaalsContact C-N 3.34Å; F465-C467 PolarHBondContact O-N 3.05Å; F465-A468 PolarHBondContact O-N 3.47Å; F465-V469 HydrophobicContact CE2-CG2 4.06Å; F465-V469 HydrophobicContact CZ-CG2 4.24Å; F465-V469 PolarHBondContact O-N 3.4Å
466A97.2Very high95.3Very high0 Ų038.5 Ų38.50%021%0.211CC..Hα-helixtrans-62.5-42.4178.900000111.3A286 M462 S463 A468 V469 F470A286-A466 HydrophobicContact CB-CB 3.63Å; M462-A466 WeakPolarHBondContact O-CB 3.31Å; M462-A466 PolarHBondContact O-N 3.41Å; S463-A466 PolarHBondContact O-N 2.98Å; A466-A468 VanDerWaalsContact C-N 3.3Å; A466-A468 PolarHBondContact O-N 3.44Å; A466-V469 PolarHBondContact O-N 3.46Å; A466-V469 VanDerWaalsContact O-N 3.16Å; A466-F470 HydrophobicContact CB-CE2 4.11Å; A466-F470 HydrophobicContact CB-CZ 3.99Å; A466-F470 WeakPolarHBondContact O-CB 3.27Å; A466-F470 VanDerWaalsContact O-CD1 3.3Å; A466-F470 WeakPolarHBondContact O-CD1 3.41Å; A466-F470 WeakPolarHBondContact O-CD2 3.43Å; A466-F470 WeakPolarHBondContact O-CG 3.26Å; A466-F470 PolarHBondContact O-N 3.45Å
467C97Very high95.5Very high4 Ų435.1 Ų35.13%0.02719%0.192CC..Hα-helixtrans-58.2-41.1175.9-1750000112A286 N287 S291 S463 V464 F465 V469 F470 V471A286-C467 HydrophobicContact CB-CB 4.44Å; A286-C467 WeakPolarHBondContact O-CB 3.33Å; N287-C467 PolarHBondContact O-SG 3.48Å; N287-C467 VanDerWaalsContact O-SG 3.41Å; S291-C467 WeakPolarHBondContact OG-CB 3.3Å; S291-C467 PolarHBondContact OG-SG 3.45Å; S463-C467 WeakPolarHBondContact O-CB 3.39Å; S463-C467 PolarHBondContact O-N 2.89Å; V464-C467 PolarHBondContact O-N 3.17Å; F465-C467 VanDerWaalsContact C-N 3.34Å; F465-C467 PolarHBondContact O-N 3.05Å; C467-V469 PolarHBondContact O-N 3.49Å; C467-F470 PolarHBondContact O-N 3.46Å; C467-V471 VanDerWaalsContact O-CG2 3.28Å; C467-V471 WeakPolarHBondContact O-CG2 3.33Å; C467-V471 PolarHBondContact O-N 3.09Å
468A96.9Very high95.5Very high62 Ų6233.5 Ų33.551%0.51219%0.185SC..Hα-helixtrans-62.9-42.6177.800000111.9V464 F465 A466 F470 F472V464-A468 PolarHBondContact O-N 3.14Å; F465-A468 PolarHBondContact O-N 3.47Å; A466-A468 VanDerWaalsContact C-N 3.3Å; A466-A468 PolarHBondContact O-N 3.44Å; A468-F470 VanDerWaalsContact C-N 3.34Å; A468-F472 PolarHBondContact O-N 2.96Å; A468-F472 VanDerWaalsContact O-N 3.11Å
469V96.9Very high95.5Very high18 Ų1834.2 Ų34.211%0.10920%0.197CC..Hα-helixtrans-63.1-42.9174.9178.10000110.8I378 A382 F465 A466 C467 F472 F473I378-V469 HydrophobicContact CG2-CG1 3.92Å; A382-V469 HydrophobicContact CB-CB 4.06Å; A382-V469 HydrophobicContact CB-CG1 3.7Å; A382-V469 HydrophobicContact CB-CG2 4.43Å; F465-V469 HydrophobicContact CE2-CG2 4.06Å; F465-V469 HydrophobicContact CZ-CG2 4.24Å; F465-V469 PolarHBondContact O-N 3.4Å; A466-V469 PolarHBondContact O-N 3.46Å; A466-V469 VanDerWaalsContact O-N 3.16Å; C467-V469 PolarHBondContact O-N 3.49Å; V469-F472 PolarHBondContact O-N 2.89Å; V469-F473 WeakPolarHBondContact O-CB 3.31Å; V469-F473 PolarHBondContact O-N 3.28Å
470F97.8Very high95.4Very high0 Ų036 Ų360%020%0.201CC..Hα-helixtrans-64.5-43180-65.1-11000112.7A286 L344 F347 L348 I358 F379 A382 A466 C467 A468 F473 E474A286-F470 HydrophobicContact CB-CD2 4.04Å; A286-F470 HydrophobicContact CB-CE2 3.58Å; L344-F470 HydrophobicContact CD1-CB 4.12Å; F347-F470 HydrophobicContact CD1-CD2 4.23Å; F347-F470 HydrophobicContact CD1-CE2 4.48Å; F347-F470 AromaticContact CE1-CD2 3.77Å; F347-F470 HydrophobicContact CE1-CD2 3.77Å; F347-F470 AromaticContact CE1-CE2 3.7Å; F347-F470 HydrophobicContact CE1-CE2 3.7Å; F347-F470 HydrophobicContact CZ-CE2 4.3Å; L348-F470 HydrophobicContact CD2-CB 3.88Å; I358-F470 HydrophobicContact CD1-CD2 4.27Å; I358-F470 HydrophobicContact CD1-CE1 4.41Å; I358-F470 HydrophobicContact CD1-CE2 3.65Å; I358-F470 HydrophobicContact CD1-CZ 3.76Å; I358-F470 HydrophobicContact CG1-CE2 4.32Å; I358-F470 HydrophobicContact CG1-CZ 4.11Å; F379-F470 AromaticContact CD2-CD1 3.59Å; F379-F470 HydrophobicContact CD2-CD1 3.59Å; F379-F470 AromaticContact CD2-CE1 3.92Å; F379-F470 HydrophobicContact CD2-CE1 3.92Å; F379-F470 AromaticContact CE2-CD1 3.48Å; F379-F470 HydrophobicContact CE2-CD1 3.48Å; F379-F470 VanDerWaalsContact CE2-CD1 3.48Å; F379-F470 AromaticContact CE2-CE1 3.7Å; F379-F470 HydrophobicContact CE2-CE1 3.7Å; F379-F470 HydrophobicContact CE2-CG 4.11Å; F379-F470 HydrophobicContact CE2-CZ 4.47Å; F379-F470 HydrophobicContact CZ-CE1 4.48Å; A382-F470 HydrophobicContact CB-CD1 4.5Å; A382-F470 HydrophobicContact CB-CE1 3.85Å; A466-F470 HydrophobicContact CB-CE2 4.11Å; A466-F470 HydrophobicContact CB-CZ 3.99Å; A466-F470 WeakPolarHBondContact O-CB 3.27Å; A466-F470 VanDerWaalsContact O-CD1 3.3Å; A466-F470 WeakPolarHBondContact O-CD1 3.41Å; A466-F470 WeakPolarHBondContact O-CD2 3.43Å; A466-F470 WeakPolarHBondContact O-CG 3.26Å; A466-F470 PolarHBondContact O-N 3.45Å; C467-F470 PolarHBondContact O-N 3.46Å; A468-F470 VanDerWaalsContact C-N 3.34Å; F470-F473 PolarHBondContact O-N 2.96Å; F470-E474 PolarHBondContact O-N 3.15Å
471V97.2Very high95.3Very high46 Ų4634.3 Ų34.328%0.27919%0.191SC..Hα-helixtrans-63.1-45.8175.81710000110.9L288 L348 C467 F473 E474 L475L288-V471 HydrophobicContact CD2-CG2 3.5Å; L288-V471 HydrophobicContact CG-CG2 4.3Å; L348-V471 HydrophobicContact CD1-CG2 4.15Å; L348-V471 HydrophobicContact CD2-CG2 4.01Å; C467-V471 VanDerWaalsContact O-CG2 3.28Å; C467-V471 WeakPolarHBondContact O-CG2 3.33Å; C467-V471 PolarHBondContact O-N 3.09Å; V471-F473 VanDerWaalsContact C-N 3.27Å; V471-F473 PolarHBondContact O-N 2.98Å; V471-E474 PolarHBondContact O-N 2.87Å; V471-L475 HydrophobicContact CG1-CD1 4.21Å; V471-L475 WeakPolarHBondContact O-CG 3.27Å; V471-L475 PolarHBondContact O-N 3.42Å
472F95.3Very high95Very high104 Ų10436.6 Ų36.646%0.45620%0.2SC..Hα-helixtrans-59.6-41.7176.3177.8-97000111.6W426 L430 A468 V469 Y476W426-F472 HydrophobicContact CZ3-CE1 4.4Å; W426-F472 HydrophobicContact CZ3-CZ 4.21Å; L430-F472 HydrophobicContact CD2-CD1 4.26Å; L430-F472 HydrophobicContact CD2-CE1 3.8Å; A468-F472 PolarHBondContact O-N 2.96Å; A468-F472 VanDerWaalsContact O-N 3.11Å; V469-F472 PolarHBondContact O-N 2.89Å; F472-Y476 WeakPolarHBondContact O-CB 3.32Å; F472-Y476 PolarHBondContact O-N 3.09Å
473F95.6Very high94.7Very high6 Ų641.7 Ų41.73%0.02623%0.228CC..Hα-helixtrans-66.2-41.4177.9-176.9-115.3000112.6L340 L344 P375 F379 V469 F470 V471 L475 Y476 I477L340-F473 HydrophobicContact CD1-CE1 3.98Å; L340-F473 HydrophobicContact CD2-CE1 4Å; L340-F473 HydrophobicContact CD2-CZ 3.81Å; L340-F473 HydrophobicContact CG-CE1 4.23Å; L344-F473 HydrophobicContact CD2-CD1 3.55Å; L344-F473 HydrophobicContact CD2-CE1 4.21Å; P375-F473 HydrophobicContact CB-CD2 3.92Å; P375-F473 HydrophobicContact CB-CE2 3.63Å; P375-F473 WeakPolarHBondContact O-CE2 3.2Å; F379-F473 HydrophobicContact CB-CD1 3.71Å; F379-F473 HydrophobicContact CB-CD2 4.12Å; F379-F473 HydrophobicContact CB-CE1 3.69Å; F379-F473 HydrophobicContact CB-CE2 4.12Å; F379-F473 HydrophobicContact CB-CG 3.92Å; F379-F473 HydrophobicContact CB-CZ 3.89Å; F379-F473 HydrophobicContact CD1-CE1 4.1Å; F379-F473 HydrophobicContact CD2-CB 4.48Å; F379-F473 AromaticContact CD2-CD1 3.38Å; F379-F473 HydrophobicContact CD2-CD1 3.38Å; F379-F473 AromaticContact CD2-CE1 3.77Å; F379-F473 HydrophobicContact CD2-CE1 3.77Å; F379-F473 HydrophobicContact CD2-CG 4.11Å; F379-F473 HydrophobicContact CE2-CD1 4.18Å; F379-F473 HydrophobicContact CE2-CE1 4.49Å; F379-F473 AromaticContact CG-CD1 3.6Å; F379-F473 HydrophobicContact CG-CD1 3.6Å; F379-F473 AromaticContact CG-CE1 3.55Å; F379-F473 HydrophobicContact CG-CE1 3.55Å; F379-F473 HydrophobicContact CG-CG 4.28Å; F379-F473 HydrophobicContact CG-CZ 4.2Å; V469-F473 WeakPolarHBondContact O-CB 3.31Å; V469-F473 PolarHBondContact O-N 3.28Å; F470-F473 PolarHBondContact O-N 2.96Å; V471-F473 VanDerWaalsContact C-N 3.27Å; V471-F473 PolarHBondContact O-N 2.98Å; F473-L475 PolarHBondContact O-N 2.64Å; F473-Y476 WeakPolarHBondContact O-CB 3.49Å; F473-Y476 PolarHBondContact O-N 3.01Å; F473-I477 HydrophobicContact CD1-CG1 4.43Å; F473-I477 HydrophobicContact CD2-CG1 4.16Å; F473-I477 HydrophobicContact CE1-CG1 4.07Å; F473-I477 HydrophobicContact CE2-CD1 3.92Å; F473-I477 HydrophobicContact CE2-CG1 3.75Å; F473-I477 HydrophobicContact CG-CG1 4.49Å; F473-I477 HydrophobicContact CZ-CD1 3.97Å; F473-I477 HydrophobicContact CZ-CG1 3.72Å; F473-I477 WeakPolarHBondContact O-CG1 3.39Å; F473-I477 PolarHBondContact O-N 3.35Å
474E97Very high93.3Very high15 Ų1543.2 Ų43.27%0.0724%0.244CC..Hα-helixtrans-62.7-43.4176.4-178.858.1-172.900112S341 L344 S345 L348 F470 V471 Y476 I477 T478S341-E474 WeakPolarHBondContact CA-OE2 3.36Å; S341-E474 PolarHBondContact OG-OE1 2.97Å; L344-E474 WeakPolarHBondContact CB-OE2 3.2Å; L344-E474 HydrophobicContact CD2-CB 3.7Å; L344-E474 HydrophobicContact CD2-CG 4.5Å; L344-E474 WeakPolarHBondContact CD2-OE2 3.46Å; L344-E474 HydrophobicContact CG-CB 4.01Å; L344-E474 HydrophobicContact CG-CG 4.45Å; S345-E474 PolarHBondContact OG-OE1 3.5Å; L348-E474 HydrophobicContact CD1-CB 4.05Å; L348-E474 HydrophobicContact CD1-CG 4.43Å; F470-E474 PolarHBondContact O-N 3.15Å; V471-E474 PolarHBondContact O-N 2.87Å; E474-Y476 VanDerWaalsContact C-N 3.31Å; E474-Y476 PolarHBondContact O-N 2.96Å; E474-I477 PolarHBondContact O-N 2.94Å; E474-T478 VanDerWaalsContact O-CB 3.28Å; E474-T478 WeakPolarHBondContact O-CB 3.38Å; E474-T478 PolarHBondContact O-N 3.1Å; E474-T478 PolarHBondContact O-OG1 3.17Å
475L95.2Very high91.1Very high116 Ų11647 Ų4761%0.60726%0.263SS*.Hα-helixtrans-61.7-41.8175.1-67.9174000111.2V471 F473 A479V471-L475 HydrophobicContact CG1-CD1 4.21Å; V471-L475 WeakPolarHBondContact O-CG 3.27Å; V471-L475 PolarHBondContact O-N 3.42Å; F473-L475 PolarHBondContact O-N 2.64Å; L475-A479 VanDerWaalsContact O-CB 3.28Å; L475-A479 WeakPolarHBondContact O-CB 3.42Å; L475-A479 PolarHBondContact O-N 3.5Å
476Y93.6Very high89Confident61 Ų6152.8 Ų52.824%0.23928%0.284CS..Hα-helixtrans-62.7-49.3176.8177.5-88.5000111.9C372 P375 F472 F473 E474 A479 Y480C372-Y476 HydrophobicContact CB-CE1 4.46Å; P375-Y476 HydrophobicContact CB-CD1 3.97Å; P375-Y476 HydrophobicContact CB-CE1 3.84Å; P375-Y476 HydrophobicContact CG-CD1 4.06Å; P375-Y476 HydrophobicContact CG-CE1 3.5Å; P375-Y476 HydrophobicContact CG-CE2 4.41Å; F472-Y476 WeakPolarHBondContact O-CB 3.32Å; F472-Y476 PolarHBondContact O-N 3.09Å; F473-Y476 WeakPolarHBondContact O-CB 3.49Å; F473-Y476 PolarHBondContact O-N 3.01Å; E474-Y476 VanDerWaalsContact C-N 3.31Å; E474-Y476 PolarHBondContact O-N 2.96Å; Y476-A479 PolarHBondContact O-N 3.46Å; Y476-Y480 VanDerWaalsContact O-CB 3.31Å; Y476-Y480 WeakPolarHBondContact O-CB 3.4Å; Y476-Y480 PolarHBondContact O-N 3.14Å
477I93.7Very high86.5Confident0 Ų055.8 Ų55.80%030%0.298CS..Hα-helixtrans-65.7-42-178.9-68.8-66.3000110.9L340 C372 F473 E474 A479 Y480 I481L340-I477 HydrophobicContact CD2-CD1 3.9Å; L340-I477 HydrophobicContact CD2-CG1 4.02Å; L340-I477 HydrophobicContact CD2-CG2 4.3Å; L340-I477 HydrophobicContact CG-CG2 4.46Å; C372-I477 HydrophobicContact CB-CD1 4.33Å; F473-I477 HydrophobicContact CD1-CG1 4.43Å; F473-I477 HydrophobicContact CD2-CG1 4.16Å; F473-I477 HydrophobicContact CE1-CG1 4.07Å; F473-I477 HydrophobicContact CE2-CD1 3.92Å; F473-I477 HydrophobicContact CE2-CG1 3.75Å; F473-I477 HydrophobicContact CG-CG1 4.49Å; F473-I477 HydrophobicContact CZ-CD1 3.97Å; F473-I477 HydrophobicContact CZ-CG1 3.72Å; F473-I477 WeakPolarHBondContact O-CG1 3.39Å; F473-I477 PolarHBondContact O-N 3.35Å; E474-I477 PolarHBondContact O-N 2.94Å; I477-A479 PolarHBondContact O-N 2.78Å; I477-Y480 WeakPolarHBondContact O-CB 3.44Å; I477-Y480 PolarHBondContact O-N 3.06Å; I477-I481 HydrophobicContact CG2-CD1 3.86Å; I477-I481 HydrophobicContact CG2-CG1 4.44Å; I477-I481 VanDerWaalsContact O-CG1 3.26Å; I477-I481 WeakPolarHBondContact O-CG1 3.39Å; I477-I481 PolarHBondContact O-N 3.34Å
478T94.1Very high83.7Confident26 Ų2666.9 Ų66.916%0.1634%0.34CS..Hα-helixtrans-60.8-46.1175.4-590000111.2P321 E474 Y480 I481 L482P321-T478 HydrophobicContact CB-CG2 4.16Å; P321-T478 HydrophobicContact CG-CG2 4.39Å; E474-T478 VanDerWaalsContact O-CB 3.28Å; E474-T478 WeakPolarHBondContact O-CB 3.38Å; E474-T478 PolarHBondContact O-N 3.1Å; E474-T478 PolarHBondContact O-OG1 3.17Å; T478-Y480 VanDerWaalsContact C-N 3.32Å; T478-Y480 PolarHBondContact O-N 3.49Å; T478-I481 PolarHBondContact O-N 3.35Å; T478-L482 HydrophobicContact CG2-CD1 4.07Å; T478-L482 WeakPolarHBondContact O-CB 3.31Å; T478-L482 WeakPolarHBondContact O-CG 3.4Å; T478-L482 PolarHBondContact O-N 3.08Å
479A93.3Very high80.7Confident44 Ų4472.7 Ų72.736%0.36435%0.353SS..Hα-helixtrans-64.5-36.5175.400000112.3L475 Y476 I477 N483L475-A479 VanDerWaalsContact O-CB 3.28Å; L475-A479 WeakPolarHBondContact O-CB 3.42Å; L475-A479 PolarHBondContact O-N 3.5Å; Y476-A479 PolarHBondContact O-N 3.46Å; I477-A479 PolarHBondContact O-N 2.78Å; A479-N483 VanDerWaalsContact O-CB 3.3Å; A479-N483 WeakPolarHBondContact O-CB 3.07Å; A479-N483 VanDerWaalsContact O-CG 3.27Å; A479-N483 PolarHBondContact O-N 2.97Å; A479-N483 PolarHBondContact O-ND2 3.29Å
480Y90.9Very high77.8Confident53 Ų5381.7 Ų81.721%0.20839%0.385CS..Hα-helixtrans-62.6-45.4176.1-177.1-90.1000111.3L337 Y476 I477 T478 Y486L337-Y480 HydrophobicContact CD1-CD1 4.09Å; L337-Y480 HydrophobicContact CD1-CE1 3.86Å; L337-Y480 HydrophobicContact CD2-CD1 4.18Å; L337-Y480 HydrophobicContact CD2-CE1 4.23Å; Y476-Y480 VanDerWaalsContact O-CB 3.31Å; Y476-Y480 WeakPolarHBondContact O-CB 3.4Å; Y476-Y480 PolarHBondContact O-N 3.14Å; I477-Y480 WeakPolarHBondContact O-CB 3.44Å; I477-Y480 PolarHBondContact O-N 3.06Å; T478-Y480 VanDerWaalsContact C-N 3.32Å; T478-Y480 PolarHBondContact O-N 3.49Å; Y480-Y486 HydrophobicContact CE2-CD2 4.39Å
481I92Very high74.7Confident4 Ų492 Ų922%0.02143%0.433CS..Hα-helixtrans-61.4-51.5176.2-68.6166.4000110.4H325 L337 I477 T478 N483 G484H325-I481 HydrophobicContact CB-CG2 3.59Å; H325-I481 VanDerWaalsContact CG-CG2 3.41Å; L337-I481 HydrophobicContact CB-CD1 3.95Å; L337-I481 HydrophobicContact CB-CG1 3.85Å; L337-I481 HydrophobicContact CD1-CG1 4.36Å; I477-I481 HydrophobicContact CG2-CD1 3.86Å; I477-I481 HydrophobicContact CG2-CG1 4.44Å; I477-I481 VanDerWaalsContact O-CG1 3.26Å; I477-I481 WeakPolarHBondContact O-CG1 3.39Å; I477-I481 PolarHBondContact O-N 3.34Å; T478-I481 PolarHBondContact O-N 3.35Å; I481-N483 VanDerWaalsContact C-N 3.32Å; I481-N483 PolarHBondContact O-N 2.88Å; I481-G484 PolarHBondContact O-N 3.21Å
482L89.6Confident73.5Confident107 Ų10794.3 Ų94.356%0.5644%0.441SS*.Hα-helixtrans-67-31.1-175-70.4177000113.6P321 T478 G484P321-L482 HydrophobicContact CB-CD1 4.41Å; P321-L482 HydrophobicContact CB-CD2 4.18Å; T478-L482 HydrophobicContact CG2-CD1 4.07Å; T478-L482 WeakPolarHBondContact O-CB 3.31Å; T478-L482 WeakPolarHBondContact O-CG 3.4Å; T478-L482 PolarHBondContact O-N 3.08Å; L482-G484 PolarHBondContact O-N 3.08Å
483N87.9Confident72.4Confident109 Ų10993.7 Ų93.758%0.58344%0.44SS*.THydrogen-bonded Turntrans-71.7-12.9-179.4-80.9-40.8000113.7A479 I481 N485A479-N483 VanDerWaalsContact O-CB 3.3Å; A479-N483 WeakPolarHBondContact O-CB 3.07Å; A479-N483 VanDerWaalsContact O-CG 3.27Å; A479-N483 PolarHBondContact O-N 2.97Å; A479-N483 PolarHBondContact O-ND2 3.29Å; I481-N483 VanDerWaalsContact C-N 3.32Å; I481-N483 PolarHBondContact O-N 2.88Å; N483-N485 WeakPolarHBondContact O-CB 3.2Å; N483-N485 PolarHBondContact O-N 3.09Å; N483-N485 PolarHBondContact O-ND2 2.81Å
484G65.7Low71.1Confident38 Ų3898.6 Ų98.639%0.39246%0.463SS..  trans56.8-3.5164.100000118.6I481 L482 Y486I481-G484 PolarHBondContact O-N 3.21Å; L482-G484 PolarHBondContact O-N 3.08Å; G484-Y486 PolarHBondContact O-N 2.89Å
485N50.8Low69.6Low139 Ų139103.5 Ų103.574%0.74349%0.486SS*.THydrogen-bonded Turntrans-920.1-157.8-84-29.2000115.5N483N483-N485 WeakPolarHBondContact O-CB 3.2Å; N483-N485 PolarHBondContact O-N 3.09Å; N483-N485 PolarHBondContact O-ND2 2.81Å
486Y51.3Low68Low157 Ų157102.8 Ų102.862%0.61648%0.479SS*.THydrogen-bonded Turntrans-101.6-14.2-178.7-78.5-83.4000114.9Y480 G484 R488 K489Y480-Y486 HydrophobicContact CE2-CD2 4.39Å; G484-Y486 PolarHBondContact O-N 2.89Å; Y486-R488 PolarHBondContact O-N 3.06Å; Y486-K489 PolarHBondContact O-N 2.96Å
487H44.3Very low66.3Low63 Ų63105.5 Ų105.529%0.29249%0.494SS..THydrogen-bonded Turntrans-69.5-12.7-178.8-83.1-67.9000115.2T333 N334T333-H487 WeakPolarHBondContact CG2-CE1 3.29Å; N334-H487 PolarHBondContact OD1-NE2 2.85Å; N334-H487 VanDerWaalsContact OD1-NE2 3.11Å
488R39.1Very low64.3Low237 Ų237113.1 Ų113.189%0.89453%0.53SS*.THydrogen-bonded Turntrans-85-1.8178.7-73.4-168.5-162.5177.76.3115.5Y486Y486-R488 PolarHBondContact O-N 3.06Å
489K34.1Very low62Low183 Ų183119.8 Ų119.880%0.79656%0.558SS**SBendtrans-114.30.9-171-85.1-171.3175.9-178.30116Y486Y486-K489 PolarHBondContact O-N 2.96Å
490R35.9Very low59.4Low207 Ų207126.1 Ų126.178%0.78158%0.575SS**  trans-139.4-1.6-175-79.5-167.4178.1-174.60.3117
491E31.5Very low56.6Low216 Ų216132.7 Ų132.7100%1.00961%0.608SS**  trans-88.20154.5-70.9175.9-170.100107.7

Retrieved 491 of 491 residues in 237.8 ms (Link to these results)

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