A0A3Q0KGF8_SCHMA Loading...

Meiotic nuclear division protein 1 homolog AlphaSync

Required for proper homologous chromosome pairing and efficient cross-over and intragenic recombination during meiosis.

AlphaFold DB , UniProt , Accession A0A3Q0KGF8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 205 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
1M36.6Very low67.4Low240 Ų240132.6 Ų132.6100%1.18269%0.693SS**  099.10-74-73.8-10400108.5K3M1-K3 PolarHBondContact O-N 3.23Å
2S43.4Very low69.4Low123 Ų123125 Ų12586%0.8665%0.65SS**  trans-55.8124.6177.7-78.10000110.3K4S2-K4 PolarHBondContact O-N 2.83Å
3K48Very low71.3Confident208 Ų208118.3 Ų118.390%0.90461%0.611SS**  trans-55.2114.8173-74.6-178.5176.5179.10107.7M1 K5M1-K3 PolarHBondContact O-N 3.23Å; K3-K5 PolarHBondContact O-N 3.3Å
4K52.5Low72.9Confident207 Ų207117.4 Ų117.490%0.960%0.603SS**  trans-53.1113.6175.8-78.5-178.3174.1178.50108.1S2 G6S2-K4 PolarHBondContact O-N 2.83Å; K4-G6 PolarHBondContact O-N 2.96Å
5K61.6Low74.2Confident203 Ų203116.1 Ų116.188%0.88359%0.588SS**PPolyproline II helixtrans-56.9126.5175.6-146175.5-177.2-177.10106.9K3K3-K5 PolarHBondContact O-N 3.3Å
6G67.9Low75.5Confident68 Ų68108.9 Ų108.970%0.70155%0.551SS**PPolyproline II helixtrans-59.2148.7176.700000110.2K4 S8K4-G6 PolarHBondContact O-N 2.96Å; G6-S8 PolarHBondContact O-N 2.99Å
7L76.9Confident76.5Confident49 Ų49103.3 Ų103.326%0.25752%0.523SS..PPolyproline II helixtrans-57.2131.6178-116.879000110.7E11 K12L7-E11 WeakPolarHBondContact CA-OE2 3.26Å; L7-E11 HydrophobicContact CD2-CB 3.97Å; L7-E11 HydrophobicContact CG-CB 3.85Å; L7-K12 HydrophobicContact CB-CG 3.94Å; L7-K12 HydrophobicContact CD2-CG 3.91Å; L7-K12 WeakPolarHBondContact O-CE 3.44Å
8S87Confident77.4Confident53 Ų53100.6 Ų100.637%0.37151%0.51SS..PPolyproline II helixtrans-66.3164.6172.983.30000111G6 D10 E11 K12G6-S8 PolarHBondContact O-N 2.99Å; S8-D10 VanDerWaalsContact C-N 3.33Å; S8-D10 PolarHBondContact O-N 2.79Å; S8-D10 PolarHBondContact OG-N 2.8Å; S8-E11 PolarHBondContact N-OE2 3.37Å; S8-E11 PolarHBondContact O-N 3.23Å; S8-E11 WeakPolarHBondContact OG-CG 3.34Å; S8-E11 PolarHBondContact OG-N 3.4Å; S8-E11 VanDerWaalsContact OG-N 3.1Å; S8-K12 WeakPolarHBondContact O-CG 3.23Å; S8-K12 PolarHBondContact O-N 2.91Å
9L86.3Confident78.3Confident99 Ų9995.3 Ų95.352%0.51848%0.483SS..Hα-helixtrans-58-47.8175.5-170.690.2000110.7E11 K12 R13L9-E11 VanDerWaalsContact C-N 3.34Å; L9-E11 PolarHBondContact O-N 2.86Å; L9-K12 WeakPolarHBondContact O-CB 2.88Å; L9-K12 PolarHBondContact O-N 3.47Å; L9-K12 VanDerWaalsContact O-N 3.12Å; L9-R13 WeakPolarHBondContact O-CG 3.01Å; L9-R13 PolarHBondContact O-N 3.04Å
10D89Confident79.1Confident111 Ų11190.5 Ų90.559%0.59446%0.459SS*.Hα-helixtrans-64.4-38.1-178.5-63.2-35.3000112.3S8 K12 R13 Q14S8-D10 VanDerWaalsContact C-N 3.33Å; S8-D10 PolarHBondContact O-N 2.79Å; S8-D10 PolarHBondContact OG-N 2.8Å; D10-K12 VanDerWaalsContact C-N 3.33Å; D10-K12 PolarHBondContact O-N 2.95Å; D10-R13 WeakPolarHBondContact O-CB 3.16Å; D10-R13 PolarHBondContact O-N 3.34Å; D10-Q14 PolarHBondContact O-N 3.37Å
11E92.1Very high79.8Confident98 Ų9888.9 Ų88.946%0.45845%0.447SS..Hα-helixtrans-63.6-39.3173.8-72.1173.5154.200111.6L7 S8 L9 R15L7-E11 WeakPolarHBondContact CA-OE2 3.26Å; L7-E11 HydrophobicContact CD2-CB 3.97Å; L7-E11 HydrophobicContact CG-CB 3.85Å; S8-E11 PolarHBondContact N-OE2 3.37Å; S8-E11 PolarHBondContact O-N 3.23Å; S8-E11 WeakPolarHBondContact OG-CG 3.34Å; S8-E11 PolarHBondContact OG-N 3.4Å; S8-E11 VanDerWaalsContact OG-N 3.1Å; L9-E11 VanDerWaalsContact C-N 3.34Å; L9-E11 PolarHBondContact O-N 2.86Å; E11-R15 WeakPolarHBondContact O-CB 3.43Å; E11-R15 WeakPolarHBondContact O-CG 3.32Å; E11-R15 PolarHBondContact O-N 2.66Å
12K92Very high82.5Confident41 Ų4183.1 Ų83.118%0.17842%0.418CS..Hα-helixtrans-65.3-42.3174.6-66.4174-174.5-174.70111.2L7 S8 L9 D10 R15 M16 I42 S46 V50L7-K12 HydrophobicContact CB-CG 3.94Å; L7-K12 HydrophobicContact CD2-CG 3.91Å; L7-K12 WeakPolarHBondContact O-CE 3.44Å; S8-K12 WeakPolarHBondContact O-CG 3.23Å; S8-K12 PolarHBondContact O-N 2.91Å; L9-K12 WeakPolarHBondContact O-CB 2.88Å; L9-K12 PolarHBondContact O-N 3.47Å; L9-K12 VanDerWaalsContact O-N 3.12Å; D10-K12 VanDerWaalsContact C-N 3.33Å; D10-K12 PolarHBondContact O-N 2.95Å; K12-R15 PolarHBondContact O-N 2.66Å; K12-M16 WeakPolarHBondContact O-CB 3.32Å; K12-M16 PolarHBondContact O-N 3.43Å; K12-I42 HydrophobicContact CB-CD1 4.44Å; K12-I42 HydrophobicContact CB-CG1 4.48Å; K12-I42 HydrophobicContact CB-CG2 4.44Å; K12-I42 HydrophobicContact CD-CG2 4.31Å; K12-I42 HydrophobicContact CG-CG2 4.3Å; K12-I42 WeakPolarHBondContact O-CD1 3.46Å; K12-S46 PolarHBondContact NZ-OG 3.26Å; K12-S46 VanDerWaalsContact NZ-OG 3.16Å; K12-V50 HydrophobicContact CB-CG1 4.09Å; K12-V50 HydrophobicContact CB-CG2 3.76Å; K12-V50 HydrophobicContact CD-CG2 3.96Å
13R93.9Very high84.8Confident38 Ų3881.4 Ų81.414%0.14340%0.395CS..Hα-helixtrans-59.8-49.4177.4-71.3-177.468.1177.14.2111L9 D10 M16 L17 V50 S53 L54 D57L9-R13 WeakPolarHBondContact O-CG 3.01Å; L9-R13 PolarHBondContact O-N 3.04Å; D10-R13 WeakPolarHBondContact O-CB 3.16Å; D10-R13 PolarHBondContact O-N 3.34Å; R13-M16 PolarHBondContact O-N 2.84Å; R13-L17 PolarHBondContact O-N 2.89Å; R13-V50 HydrophobicContact CB-CG1 4.45Å; R13-V50 HydrophobicContact CG-CG1 3.97Å; R13-S53 PolarHBondContact NE-OG 2.84Å; R13-L54 HydrophobicContact CB-CD2 4.03Å; R13-L54 HydrophobicContact CB-CG 4.48Å; R13-L54 HydrophobicContact CG-CD2 4.36Å; R13-L54 HydrophobicContact CG-CG 4.49Å; R13-D57 IonicContact CZ-OD2 3.25Å; R13-D57 VanDerWaalsContact CZ-OD2 3.25Å; R13-D57 IonicContact NH1-OD2 3.03Å; R13-D57 PolarHBondContact NH1-OD2 3.47Å; R13-D57 IonicContact NH2-OD2 2.62Å; R13-D57 PolarHBondContact NH2-OD2 2.84Å
14Q93.2Very high86.9Confident105 Ų10577.7 Ų77.749%0.49138%0.378SS..Hα-helixtrans-60.6-49.4178.5-173.359.447.600111.2D10 M16 L17 D18D10-Q14 PolarHBondContact O-N 3.37Å; Q14-M16 VanDerWaalsContact C-N 3.29Å; Q14-M16 PolarHBondContact O-N 3.29Å; Q14-L17 WeakPolarHBondContact O-CB 3.49Å; Q14-L17 PolarHBondContact O-N 3.46Å; Q14-L17 VanDerWaalsContact O-N 3.13Å; Q14-D18 PolarHBondContact NE2-OD1 2.71Å; Q14-D18 PolarHBondContact O-N 3.15Å
15R93.4Very high88.9Confident99 Ų9971.4 Ų71.437%0.37436%0.355SS..Hα-helixtrans-63.5-33.8179.9-72.5-170.1-171.21772.8113.6E11 K12 F19 K40 I42E11-R15 WeakPolarHBondContact O-CB 3.43Å; E11-R15 WeakPolarHBondContact O-CG 3.32Å; E11-R15 PolarHBondContact O-N 2.66Å; K12-R15 PolarHBondContact O-N 2.66Å; R15-F19 PolarHBondContact O-N 3.36Å; R15-K40 HydrophobicContact CB-CB 4.17Å; R15-K40 HydrophobicContact CB-CD 4.47Å; R15-K40 HydrophobicContact CB-CG 4.45Å; R15-K40 WeakPolarHBondContact CD-O 3.33Å; R15-K40 PolarHBondContact NH1-O 3.46Å; R15-K40 WeakPolarHBondContact O-CE 3.23Å; R15-K40 WeakPolarHBondContact O-CG 3.36Å; R15-I42 HydrophobicContact CB-CD1 4.26Å
16M94.3Very high90.4Very high0 Ų067.5 Ų67.50%034%0.338CS..Hα-helixtrans-69.7-39.2175.2-177.1172.2-71.700111.4K12 R13 Q14 F19 F20 C36 I42 V47 V50 L51 L54K12-M16 WeakPolarHBondContact O-CB 3.32Å; K12-M16 PolarHBondContact O-N 3.43Å; R13-M16 PolarHBondContact O-N 2.84Å; Q14-M16 VanDerWaalsContact C-N 3.29Å; Q14-M16 PolarHBondContact O-N 3.29Å; M16-F19 WeakPolarHBondContact O-CB 3.28Å; M16-F19 PolarHBondContact O-N 3.09Å; M16-F20 HydrophobicContact CG-CD2 4.18Å; M16-F20 HydrophobicContact CG-CE2 3.87Å; M16-F20 VanDerWaalsContact O-CD2 3.23Å; M16-F20 WeakPolarHBondContact O-CD2 3.21Å; M16-F20 PolarHBondContact O-N 3.14Å; M16-F20 VanDerWaalsContact O-N 3.14Å; M16-F20 HydrophobicContact SD-CE2 4.43Å; M16-C36 HydrophobicContact CE-CB 4.5Å; M16-I42 HydrophobicContact CB-CD1 3.84Å; M16-I42 HydrophobicContact CE-CD1 4.15Å; M16-V47 HydrophobicContact CE-CB 4.19Å; M16-V47 HydrophobicContact CE-CG1 3.71Å; M16-V47 HydrophobicContact CE-CG2 4.32Å; M16-V50 HydrophobicContact CB-CG1 4.19Å; M16-V50 HydrophobicContact CE-CB 4.09Å; M16-V50 HydrophobicContact CE-CG1 3.92Å; M16-V50 HydrophobicContact SD-CB 4.35Å; M16-V50 HydrophobicContact SD-CG1 3.84Å; M16-L51 HydrophobicContact CE-CB 4.48Å; M16-L51 HydrophobicContact SD-CB 3.8Å; M16-L51 HydrophobicContact SD-CD1 4.09Å; M16-L54 HydrophobicContact CB-CD1 3.87Å; M16-L54 HydrophobicContact CG-CD1 3.79Å; M16-L54 HydrophobicContact SD-CD1 3.85Å
17L92.2Very high91.7Very high14 Ų1465 Ų657%0.07331%0.308CS..Hα-helixtrans-62.6-45.3171.5-76.5168.4000111.9R13 Q14 F19 F20 Y21 L54 L59 V60R13-L17 PolarHBondContact O-N 2.89Å; Q14-L17 WeakPolarHBondContact O-CB 3.49Å; Q14-L17 PolarHBondContact O-N 3.46Å; Q14-L17 VanDerWaalsContact O-N 3.13Å; L17-F19 PolarHBondContact O-N 3.43Å; L17-F20 PolarHBondContact O-N 3.28Å; L17-F20 VanDerWaalsContact O-N 3.09Å; L17-Y21 PolarHBondContact O-N 2.76Å; L17-L54 HydrophobicContact CD1-CD2 3.59Å; L17-L54 HydrophobicContact CD2-CD1 4.26Å; L17-L54 HydrophobicContact CD2-CD2 4.04Å; L17-L54 HydrophobicContact CG-CD1 3.93Å; L17-L54 HydrophobicContact CG-CD2 3.64Å; L17-L54 HydrophobicContact CG-CG 4.43Å; L17-L59 HydrophobicContact CD1-CB 4.42Å; L17-L59 HydrophobicContact CD1-CD1 3.96Å; L17-L59 HydrophobicContact CD2-CB 3.82Å; L17-V60 HydrophobicContact CD2-CG2 4Å
18D93.2Very high92.6Very high54 Ų5465.5 Ų65.529%0.28931%0.309SS..Hα-helixtrans-58.2-38.4176.8-61.3-21.5000110.6Q14 Y21 E22Q14-D18 PolarHBondContact NE2-OD1 2.71Å; Q14-D18 PolarHBondContact O-N 3.15Å; D18-Y21 PolarHBondContact O-N 3.01Å; D18-E22 VanDerWaalsContact O-CB 3.26Å; D18-E22 WeakPolarHBondContact O-CB 3.4Å; D18-E22 WeakPolarHBondContact O-CG 3.37Å; D18-E22 PolarHBondContact O-N 3.28Å
19F94.9Very high92.9Very high0 Ų065.3 Ų65.30%030%0.304CS..Hα-helixtrans-59.8-49.9173.6172.2-92.1000112.2R15 M16 L17 Y21 E22 K23 F27 L32 L35 E39 K40R15-F19 PolarHBondContact O-N 3.36Å; M16-F19 WeakPolarHBondContact O-CB 3.28Å; M16-F19 PolarHBondContact O-N 3.09Å; L17-F19 PolarHBondContact O-N 3.43Å; F19-Y21 VanDerWaalsContact C-N 3.31Å; F19-Y21 PolarHBondContact O-N 3.3Å; F19-E22 PolarHBondContact O-N 2.83Å; F19-K23 HydrophobicContact CD2-CG 4.08Å; F19-K23 HydrophobicContact CE1-CG 4.27Å; F19-K23 HydrophobicContact CE2-CD 4.35Å; F19-K23 HydrophobicContact CE2-CG 3.76Å; F19-K23 HydrophobicContact CG-CG 4.48Å; F19-K23 HydrophobicContact CZ-CG 3.85Å; F19-K23 WeakPolarHBondContact O-CB 3.14Å; F19-K23 VanDerWaalsContact O-CG 3.31Å; F19-K23 WeakPolarHBondContact O-CG 3.39Å; F19-K23 PolarHBondContact O-N 2.86Å; F19-F27 HydrophobicContact CD1-CE2 4.46Å; F19-F27 HydrophobicContact CE1-CD1 4.47Å; F19-F27 AromaticContact CE1-CD2 3.87Å; F19-F27 HydrophobicContact CE1-CD2 3.87Å; F19-F27 HydrophobicContact CE1-CE1 4.21Å; F19-F27 AromaticContact CE1-CE2 3.56Å; F19-F27 HydrophobicContact CE1-CE2 3.56Å; F19-F27 HydrophobicContact CE1-CG 4.31Å; F19-F27 AromaticContact CE1-CZ 3.74Å; F19-F27 HydrophobicContact CE1-CZ 3.74Å; F19-F27 HydrophobicContact CZ-CD1 4.47Å; F19-F27 AromaticContact CZ-CE1 3.96Å; F19-F27 HydrophobicContact CZ-CE1 3.96Å; F19-F27 HydrophobicContact CZ-CE2 4.06Å; F19-F27 AromaticContact CZ-CZ 3.73Å; F19-F27 HydrophobicContact CZ-CZ 3.73Å; F19-L32 HydrophobicContact CD1-CD2 4.12Å; F19-L32 HydrophobicContact CE1-CD2 3.59Å; F19-L35 HydrophobicContact CE2-CB 3.83Å; F19-L35 HydrophobicContact CZ-CB 3.67Å; F19-L35 HydrophobicContact CZ-CD1 3.92Å; F19-L35 HydrophobicContact CZ-CG 4.42Å; F19-E39 WeakPolarHBondContact CE2-OE2 3.43Å; F19-K40 HydrophobicContact CB-CD 4.37Å; F19-K40 HydrophobicContact CB-CG 3.84Å; F19-K40 HydrophobicContact CD2-CG 4.38Å
20F94.7Very high93.2Very high0 Ų068.7 Ų68.70%031%0.314CS..Hα-helixtrans-62-40.6177.4-77.4-72000111.9M16 L17 K24 F27 L32 L51 V60 F71 A73M16-F20 HydrophobicContact CG-CD2 4.18Å; M16-F20 HydrophobicContact CG-CE2 3.87Å; M16-F20 VanDerWaalsContact O-CD2 3.23Å; M16-F20 WeakPolarHBondContact O-CD2 3.21Å; M16-F20 PolarHBondContact O-N 3.14Å; M16-F20 VanDerWaalsContact O-N 3.14Å; M16-F20 HydrophobicContact SD-CE2 4.43Å; L17-F20 PolarHBondContact O-N 3.28Å; L17-F20 VanDerWaalsContact O-N 3.09Å; F20-K24 WeakPolarHBondContact O-CA 3.5Å; F20-K24 PolarHBondContact O-N 2.85Å; F20-F27 AromaticContact CD1-CD2 3.93Å; F20-F27 HydrophobicContact CD1-CD2 3.93Å; F20-F27 HydrophobicContact CD1-CE2 4.23Å; F20-F27 AromaticContact CE1-CD2 3.71Å; F20-F27 HydrophobicContact CE1-CD2 3.71Å; F20-F27 HydrophobicContact CE1-CE2 4.45Å; F20-L32 HydrophobicContact CE1-CD1 4.38Å; F20-L32 HydrophobicContact CE1-CD2 3.94Å; F20-L32 HydrophobicContact CE2-CD2 4.33Å; F20-L32 HydrophobicContact CZ-CD1 3.73Å; F20-L32 HydrophobicContact CZ-CD2 3.65Å; F20-L32 HydrophobicContact CZ-CG 4.36Å; F20-L51 HydrophobicContact CE2-CD1 3.86Å; F20-L51 HydrophobicContact CZ-CD1 3.8Å; F20-V60 HydrophobicContact CD2-CG2 3.79Å; F20-V60 HydrophobicContact CE2-CG1 4.03Å; F20-V60 HydrophobicContact CE2-CG2 3.71Å; F20-V60 HydrophobicContact CZ-CG1 3.95Å; F20-V60 HydrophobicContact CZ-CG2 4.45Å; F20-F71 HydrophobicContact CE1-CB 4.26Å; F20-F71 WeakPolarHBondContact CE1-O 3.31Å; F20-F71 HydrophobicContact CZ-CB 4.06Å; F20-A73 HydrophobicContact CB-CB 3.73Å; F20-A73 HydrophobicContact CG-CB 4.09Å
21Y92.4Very high93.4Very high56 Ų5667 Ų6722%0.2230%0.303CS..Hα-helixtrans-72.9-30.3-178.6-70.7-4.3000113.9L17 D18 F19 K24 A73 P75 A78L17-Y21 PolarHBondContact O-N 2.76Å; D18-Y21 PolarHBondContact O-N 3.01Å; F19-Y21 VanDerWaalsContact C-N 3.31Å; F19-Y21 PolarHBondContact O-N 3.3Å; Y21-K24 VanDerWaalsContact O-CE 3.23Å; Y21-K24 WeakPolarHBondContact O-CE 3.46Å; Y21-K24 WeakPolarHBondContact O-CG 3.47Å; Y21-A73 HydrophobicContact CD1-CB 4.22Å; Y21-A73 HydrophobicContact CE1-CB 3.76Å; Y21-P75 HydrophobicContact CD1-CG 3.92Å; Y21-P75 HydrophobicContact CD2-CG 4.35Å; Y21-P75 HydrophobicContact CG-CG 3.8Å; Y21-A78 VanDerWaalsContact OH-CB 3.32Å; Y21-A78 WeakPolarHBondContact OH-CB 3.42Å
22E93.3Very high93.5Very high119 Ų11962.4 Ų62.456%0.55628%0.281SS*.Hα-helixtrans-72.5-48.8172.1-77.6167.1-157.400111.1D18 F19 K40D18-E22 VanDerWaalsContact O-CB 3.26Å; D18-E22 WeakPolarHBondContact O-CB 3.4Å; D18-E22 WeakPolarHBondContact O-CG 3.37Å; D18-E22 PolarHBondContact O-N 3.28Å; F19-E22 PolarHBondContact O-N 2.83Å; E22-K40 IonicContact OE1-NZ 2.66Å; E22-K40 PolarHBondContact OE1-NZ 3.11Å; E22-K40 IonicContact OE2-NZ 2.76Å; E22-K40 PolarHBondContact OE2-NZ 2.84Å
23K92.7Very high93.5Very high87 Ų8763.2 Ų63.238%0.37829%0.285SS..Hα-helixtrans-73.8-36.4-176-65.3-63.5-176.5-178.20113.1F19 D25 F27 E39F19-K23 HydrophobicContact CD2-CG 4.08Å; F19-K23 HydrophobicContact CE1-CG 4.27Å; F19-K23 HydrophobicContact CE2-CD 4.35Å; F19-K23 HydrophobicContact CE2-CG 3.76Å; F19-K23 HydrophobicContact CG-CG 4.48Å; F19-K23 HydrophobicContact CZ-CG 3.85Å; F19-K23 WeakPolarHBondContact O-CB 3.14Å; F19-K23 VanDerWaalsContact O-CG 3.31Å; F19-K23 WeakPolarHBondContact O-CG 3.39Å; F19-K23 PolarHBondContact O-N 2.86Å; K23-D25 PolarHBondContact O-N 3.27Å; K23-F27 HydrophobicContact CB-CE2 3.91Å; K23-F27 HydrophobicContact CB-CZ 3.63Å; K23-F27 HydrophobicContact CG-CE2 4.39Å; K23-F27 HydrophobicContact CG-CZ 3.85Å; K23-E39 WeakPolarHBondContact CE-OE1 3.34Å; K23-E39 WeakPolarHBondContact CE-OE2 3.49Å; K23-E39 VanDerWaalsContact NZ-CD 3.29Å; K23-E39 IonicContact NZ-OE1 2.79Å; K23-E39 PolarHBondContact NZ-OE1 2.85Å; K23-E39 IonicContact NZ-OE2 2.99Å; K23-E39 PolarHBondContact NZ-OE2 2.84Å
24K91.8Very high93.5Very high130 Ų13069.7 Ų69.757%0.56531%0.31SS*.  trans50.346.4-177.3-54.1175.8-174.4171.40111.4F20 Y21 F74F20-K24 WeakPolarHBondContact O-CA 3.5Å; F20-K24 PolarHBondContact O-N 2.85Å; Y21-K24 VanDerWaalsContact O-CE 3.23Å; Y21-K24 WeakPolarHBondContact O-CE 3.46Å; Y21-K24 WeakPolarHBondContact O-CG 3.47Å; K24-F74 HydrophobicContact CB-CD1 4.16Å; K24-F74 HydrophobicContact CB-CE1 4.02Å; K24-F74 WeakPolarHBondContact O-CE1 3.46Å
25D93.5Very high93.4Very high75 Ų7566.3 Ų66.340%0.40130%0.295SS..SBendtrans-138.6169.1-178-153.9-5.3000110.1K23 F27K23-D25 PolarHBondContact O-N 3.27Å; D25-F27 HydrophobicContact CB-CE2 4.05Å; D25-F27 HydrophobicContact CB-CZ 3.89Å; D25-F27 WeakPolarHBondContact O-CD2 3.48Å; D25-F27 WeakPolarHBondContact O-CE2 3.44Å
26F93.6Very high93.3Very high122 Ų12261.6 Ų61.654%0.53528%0.277SS..  trans-96.4147.2174.960-90.4000110.9Y70 F71 W72F26-Y70 AromaticContact CD2-CD1 3.74Å; F26-Y70 HydrophobicContact CD2-CD1 3.74Å; F26-Y70 HydrophobicContact CD2-CE1 4.12Å; F26-Y70 HydrophobicContact CE2-CD1 4.33Å; F26-Y70 HydrophobicContact CE2-CE1 4.26Å; F26-F71 WeakPolarHBondContact CA-O 3.39Å; F26-W72 HydrophobicContact CB-CB 4.13Å
27F95.5Very high93.1Very high15 Ų1566.6 Ų66.67%0.06630%0.3CS..EExtended strand (participates in β ladder)trans-138.7147.1-176.4-59.5-81.2000111.8F19 F20 K23 D25 E31 L32 L35 F71F19-F27 HydrophobicContact CD1-CE2 4.46Å; F19-F27 HydrophobicContact CE1-CD1 4.47Å; F19-F27 AromaticContact CE1-CD2 3.87Å; F19-F27 HydrophobicContact CE1-CD2 3.87Å; F19-F27 HydrophobicContact CE1-CE1 4.21Å; F19-F27 AromaticContact CE1-CE2 3.56Å; F19-F27 HydrophobicContact CE1-CE2 3.56Å; F19-F27 HydrophobicContact CE1-CG 4.31Å; F19-F27 AromaticContact CE1-CZ 3.74Å; F19-F27 HydrophobicContact CE1-CZ 3.74Å; F19-F27 HydrophobicContact CZ-CD1 4.47Å; F19-F27 AromaticContact CZ-CE1 3.96Å; F19-F27 HydrophobicContact CZ-CE1 3.96Å; F19-F27 HydrophobicContact CZ-CE2 4.06Å; F19-F27 AromaticContact CZ-CZ 3.73Å; F19-F27 HydrophobicContact CZ-CZ 3.73Å; F20-F27 AromaticContact CD1-CD2 3.93Å; F20-F27 HydrophobicContact CD1-CD2 3.93Å; F20-F27 HydrophobicContact CD1-CE2 4.23Å; F20-F27 AromaticContact CE1-CD2 3.71Å; F20-F27 HydrophobicContact CE1-CD2 3.71Å; F20-F27 HydrophobicContact CE1-CE2 4.45Å; K23-F27 HydrophobicContact CB-CE2 3.91Å; K23-F27 HydrophobicContact CB-CZ 3.63Å; K23-F27 HydrophobicContact CG-CE2 4.39Å; K23-F27 HydrophobicContact CG-CZ 3.85Å; D25-F27 HydrophobicContact CB-CE2 4.05Å; D25-F27 HydrophobicContact CB-CZ 3.89Å; D25-F27 WeakPolarHBondContact O-CD2 3.48Å; D25-F27 WeakPolarHBondContact O-CE2 3.44Å; F27-E31 HydrophobicContact CD1-CB 4.43Å; F27-L32 HydrophobicContact CB-CD1 4.11Å; F27-L32 HydrophobicContact CB-CD2 3.66Å; F27-L32 HydrophobicContact CB-CG 3.58Å; F27-L32 HydrophobicContact CD2-CD2 4.01Å; F27-L32 HydrophobicContact CG-CD2 3.86Å; F27-L32 HydrophobicContact CG-CG 4.31Å; F27-L35 HydrophobicContact CD1-CD1 3.89Å; F27-L35 HydrophobicContact CE1-CD1 3.66Å; F27-F71 PolarHBondContact N-O 3.34Å; F27-F71 PolarHBondContact O-N 3.46Å
28Q95.3Very high93.1Very high59 Ų5974.5 Ų74.528%0.27633%0.334SS..EExtended strand (participates in β ladder)trans-84157.3164.8-60.8-172.2-6.700110.7K30 E31 L32 Y70Q28-K30 VanDerWaalsContact C-N 3.27Å; Q28-K30 PolarHBondContact O-N 3.29Å; Q28-E31 HydrophobicContact CB-CG 4.28Å; Q28-E31 PolarHBondContact N-OE2 2.9Å; Q28-E31 WeakPolarHBondContact O-CB 3.29Å; Q28-E31 PolarHBondContact O-N 3.37Å; Q28-L32 PolarHBondContact O-N 3.25Å; Q28-Y70 HydrophobicContact CG-CD1 3.97Å; Q28-Y70 HydrophobicContact CG-CE1 3.73Å; Q28-Y70 PolarHBondContact NE2-OH 2.88Å
29L93.7Very high93Very high50 Ų5076 Ų7626%0.26234%0.339SS..Hα-helixtrans-53.2-43.2179.7179.661.8000112.8E31 L32 E33 K48 L51 F71L29-E31 VanDerWaalsContact C-N 3.27Å; L29-E31 PolarHBondContact O-N 2.92Å; L29-L32 PolarHBondContact O-N 3.5Å; L29-E33 WeakPolarHBondContact O-CG 3.34Å; L29-E33 PolarHBondContact O-N 2.93Å; L29-K48 HydrophobicContact CD1-CB 4.23Å; L29-K48 HydrophobicContact CD1-CG 4.3Å; L29-K48 HydrophobicContact CD2-CD 4.25Å; L29-K48 HydrophobicContact CD2-CG 4.25Å; L29-L51 HydrophobicContact CD1-CD2 3.82Å; L29-F71 HydrophobicContact CB-CE2 4.26Å
30K92.1Very high92.8Very high169 Ų16977.5 Ų77.574%0.73535%0.346SS*.Hα-helixtrans-63.1-33.1178.5-67.9-178.1177.8179.70112.8Q28 R34Q28-K30 VanDerWaalsContact C-N 3.27Å; Q28-K30 PolarHBondContact O-N 3.29Å; K30-R34 PolarHBondContact O-N 2.9Å
31E93.5Very high92.5Very high77 Ų7780 Ų8036%0.3637%0.372SS..Hα-helixtrans-73.8-42178-62.3175.114000110.6F27 Q28 L29 R34 L35F27-E31 HydrophobicContact CD1-CB 4.43Å; Q28-E31 HydrophobicContact CB-CG 4.28Å; Q28-E31 PolarHBondContact N-OE2 2.9Å; Q28-E31 WeakPolarHBondContact O-CB 3.29Å; Q28-E31 PolarHBondContact O-N 3.37Å; L29-E31 VanDerWaalsContact C-N 3.27Å; L29-E31 PolarHBondContact O-N 2.92Å; E31-R34 PolarHBondContact O-N 3.2Å; E31-L35 WeakPolarHBondContact O-CB 3.42Å; E31-L35 VanDerWaalsContact O-CG 3.29Å; E31-L35 WeakPolarHBondContact O-CG 3.39Å; E31-L35 PolarHBondContact O-N 3.2Å
32L93.6Very high92.3Very high0 Ų077.4 Ų77.40%036%0.362CS..Hα-helixtrans-61.6-43.5175.2-69.6169.1000111.9F19 F20 F27 Q28 L29 R34 L35 C36 V47 L51 F71F19-L32 HydrophobicContact CD1-CD2 4.12Å; F19-L32 HydrophobicContact CE1-CD2 3.59Å; F20-L32 HydrophobicContact CE1-CD1 4.38Å; F20-L32 HydrophobicContact CE1-CD2 3.94Å; F20-L32 HydrophobicContact CE2-CD2 4.33Å; F20-L32 HydrophobicContact CZ-CD1 3.73Å; F20-L32 HydrophobicContact CZ-CD2 3.65Å; F20-L32 HydrophobicContact CZ-CG 4.36Å; F27-L32 HydrophobicContact CB-CD1 4.11Å; F27-L32 HydrophobicContact CB-CD2 3.66Å; F27-L32 HydrophobicContact CB-CG 3.58Å; F27-L32 HydrophobicContact CD2-CD2 4.01Å; F27-L32 HydrophobicContact CG-CD2 3.86Å; F27-L32 HydrophobicContact CG-CG 4.31Å; Q28-L32 PolarHBondContact O-N 3.25Å; L29-L32 PolarHBondContact O-N 3.5Å; L32-R34 PolarHBondContact O-N 2.7Å; L32-L35 PolarHBondContact O-N 3.45Å; L32-C36 WeakPolarHBondContact O-CB 3.49Å; L32-C36 PolarHBondContact O-N 3.46Å; L32-C36 PolarHBondContact O-SG 3.47Å; L32-C36 VanDerWaalsContact O-SG 3.38Å; L32-V47 HydrophobicContact CB-CG1 4.03Å; L32-L51 HydrophobicContact CD1-CD1 3.99Å; L32-L51 HydrophobicContact CD1-CD2 3.61Å; L32-L51 HydrophobicContact CD1-CG 4.43Å; L32-F71 HydrophobicContact CD1-CB 4.07Å; L32-F71 HydrophobicContact CD1-CD2 4.21Å; L32-F71 HydrophobicContact CD1-CG 4.36Å
33E93.2Very high92.1Very high58 Ų5875.1 Ų75.127%0.27135%0.354SS..Hα-helixtrans-56.1-39.7177.1-78174.6172.900112L29 Q37 V47L29-E33 WeakPolarHBondContact O-CG 3.34Å; L29-E33 PolarHBondContact O-N 2.93Å; E33-Q37 WeakPolarHBondContact O-CB 3.29Å; E33-V47 HydrophobicContact CG-CB 4.16Å; E33-V47 HydrophobicContact CG-CG1 4.08Å
34R92.6Very high91.9Very high175 Ų17572.6 Ų72.666%0.6635%0.347SS*.Hα-helixtrans-77.6-47.5178-170.5-178.569164.4-0.6112.6K30 E31 L32 K38K30-R34 PolarHBondContact O-N 2.9Å; E31-R34 PolarHBondContact O-N 3.2Å; L32-R34 PolarHBondContact O-N 2.7Å; R34-K38 WeakPolarHBondContact O-CB 3.33Å; R34-K38 PolarHBondContact O-N 2.94Å
35L92.5Very high91.7Very high33 Ų3373.9 Ų73.917%0.17336%0.357CS..Hα-helixtrans-75.2-43.1-172.6-68.1173.6000112.1F19 F27 E31 L32 Q37 K38 E39F19-L35 HydrophobicContact CE2-CB 3.83Å; F19-L35 HydrophobicContact CZ-CB 3.67Å; F19-L35 HydrophobicContact CZ-CD1 3.92Å; F19-L35 HydrophobicContact CZ-CG 4.42Å; F27-L35 HydrophobicContact CD1-CD1 3.89Å; F27-L35 HydrophobicContact CE1-CD1 3.66Å; E31-L35 WeakPolarHBondContact O-CB 3.42Å; E31-L35 VanDerWaalsContact O-CG 3.29Å; E31-L35 WeakPolarHBondContact O-CG 3.39Å; E31-L35 PolarHBondContact O-N 3.2Å; L32-L35 PolarHBondContact O-N 3.45Å; L35-Q37 VanDerWaalsContact C-N 3.3Å; L35-Q37 PolarHBondContact O-N 3.17Å; L35-K38 PolarHBondContact O-N 3.36Å; L35-E39 WeakPolarHBondContact O-CB 3.32Å; L35-E39 PolarHBondContact O-N 3.27Å
36C91.1Very high91.6Very high0 Ų071.1 Ų71.10%034%0.343CS..Hα-helixtrans-67.1-31.6178.9-64.20000112.3M16 L32 K40 G41 I42 V47M16-C36 HydrophobicContact CE-CB 4.5Å; L32-C36 WeakPolarHBondContact O-CB 3.49Å; L32-C36 PolarHBondContact O-N 3.46Å; L32-C36 PolarHBondContact O-SG 3.47Å; L32-C36 VanDerWaalsContact O-SG 3.38Å; C36-K40 CarbonylContact O-C 3.47Å; C36-K40 WeakPolarHBondContact O-CA 3.41Å; C36-K40 WeakPolarHBondContact O-CB 3.47Å; C36-K40 PolarHBondContact O-N 2.96Å; C36-K40 VanDerWaalsContact O-N 3.1Å; C36-G41 PolarHBondContact O-N 3.27Å; C36-G41 VanDerWaalsContact O-N 3.08Å; C36-I42 HydrophobicContact CB-CB 4.37Å; C36-I42 HydrophobicContact CB-CD1 4.39Å; C36-I42 PolarHBondContact O-N 2.91Å; C36-I42 VanDerWaalsContact O-N 3.15Å; C36-V47 HydrophobicContact CB-CG2 4.01Å
37Q90.5Very high91.6Very high105 Ų10565.3 Ų65.349%0.49132%0.318SS..Hα-helixtrans-67.7-44.4172.5-172.7176.713.800111.6E33 L35 G41 I42E33-Q37 WeakPolarHBondContact O-CB 3.29Å; L35-Q37 VanDerWaalsContact C-N 3.3Å; L35-Q37 PolarHBondContact O-N 3.17Å; Q37-G41 WeakPolarHBondContact O-CA 3.35Å; Q37-G41 PolarHBondContact O-N 3.49Å; Q37-I42 WeakPolarHBondContact CA-O 3.44Å; Q37-I42 WeakPolarHBondContact CB-O 3.47Å
38K90.5Very high91.6Very high181 Ų18169.9 Ų69.979%0.78734%0.338SS*.Hα-helixtrans-71.3-45.8-178.1-173.8178.5177.7-175.80113.1R34 L35R34-K38 WeakPolarHBondContact O-CB 3.33Å; R34-K38 PolarHBondContact O-N 2.94Å; L35-K38 PolarHBondContact O-N 3.36Å
39E92.2Very high91.5Very high84 Ų8472.4 Ų72.439%0.39335%0.353SS..Hα-helixtrans-95.4-35-170-62.9-169.8-177.300113.5F19 K23 L35F19-E39 WeakPolarHBondContact CE2-OE2 3.43Å; K23-E39 WeakPolarHBondContact CE-OE1 3.34Å; K23-E39 WeakPolarHBondContact CE-OE2 3.49Å; K23-E39 VanDerWaalsContact NZ-CD 3.29Å; K23-E39 IonicContact NZ-OE1 2.79Å; K23-E39 PolarHBondContact NZ-OE1 2.85Å; K23-E39 IonicContact NZ-OE2 2.99Å; K23-E39 PolarHBondContact NZ-OE2 2.84Å; L35-E39 WeakPolarHBondContact O-CB 3.32Å; L35-E39 PolarHBondContact O-N 3.27Å
40K89.6Confident91.6Very high32 Ų3270.1 Ų70.114%0.13934%0.341CS..Hα-helixtrans-110.7-5.5-174.9-62.6-54.9-167.7-173.60114R15 F19 E22 C36 I42R15-K40 HydrophobicContact CB-CB 4.17Å; R15-K40 HydrophobicContact CB-CD 4.47Å; R15-K40 HydrophobicContact CB-CG 4.45Å; R15-K40 WeakPolarHBondContact CD-O 3.33Å; R15-K40 PolarHBondContact NH1-O 3.46Å; R15-K40 WeakPolarHBondContact O-CE 3.23Å; R15-K40 WeakPolarHBondContact O-CG 3.36Å; F19-K40 HydrophobicContact CB-CD 4.37Å; F19-K40 HydrophobicContact CB-CG 3.84Å; F19-K40 HydrophobicContact CD2-CG 4.38Å; E22-K40 IonicContact OE1-NZ 2.66Å; E22-K40 PolarHBondContact OE1-NZ 3.11Å; E22-K40 IonicContact OE2-NZ 2.76Å; E22-K40 PolarHBondContact OE2-NZ 2.84Å; C36-K40 CarbonylContact O-C 3.47Å; C36-K40 WeakPolarHBondContact O-CA 3.41Å; C36-K40 WeakPolarHBondContact O-CB 3.47Å; C36-K40 PolarHBondContact O-N 2.96Å; C36-K40 VanDerWaalsContact O-N 3.1Å; K40-I42 VanDerWaalsContact C-N 3.26Å; K40-I42 HydrophobicContact CB-CD1 4.15Å; K40-I42 HydrophobicContact CB-CG1 4.09Å; K40-I42 PolarHBondContact O-N 2.88Å
41G88.3Confident91.7Very high53 Ų5362.1 Ų62.155%0.54631%0.306SS..  trans68.122.8179.500000113.7C36 Q37C36-G41 PolarHBondContact O-N 3.27Å; C36-G41 VanDerWaalsContact O-N 3.08Å; Q37-G41 WeakPolarHBondContact O-CA 3.35Å; Q37-G41 PolarHBondContact O-N 3.49Å
42I89.5Confident91.8Very high1 Ų161.7 Ų61.71%0.00531%0.305CS..  trans-81.8125.5177.4-57.5175.4000108K12 R15 M16 C36 Q37 K40 S44 V47K12-I42 HydrophobicContact CB-CD1 4.44Å; K12-I42 HydrophobicContact CB-CG1 4.48Å; K12-I42 HydrophobicContact CB-CG2 4.44Å; K12-I42 HydrophobicContact CD-CG2 4.31Å; K12-I42 HydrophobicContact CG-CG2 4.3Å; K12-I42 WeakPolarHBondContact O-CD1 3.46Å; R15-I42 HydrophobicContact CB-CD1 4.26Å; M16-I42 HydrophobicContact CB-CD1 3.84Å; M16-I42 HydrophobicContact CE-CD1 4.15Å; C36-I42 HydrophobicContact CB-CB 4.37Å; C36-I42 HydrophobicContact CB-CD1 4.39Å; C36-I42 PolarHBondContact O-N 2.91Å; C36-I42 VanDerWaalsContact O-N 3.15Å; Q37-I42 WeakPolarHBondContact CA-O 3.44Å; Q37-I42 WeakPolarHBondContact CB-O 3.47Å; K40-I42 VanDerWaalsContact C-N 3.26Å; K40-I42 HydrophobicContact CB-CD1 4.15Å; K40-I42 HydrophobicContact CB-CG1 4.09Å; K40-I42 PolarHBondContact O-N 2.88Å; I42-S44 PolarHBondContact O-N 3.03Å; I42-V47 HydrophobicContact CB-CG2 4.32Å; I42-V47 HydrophobicContact CG2-CG2 3.82Å
43N88.8Confident91.9Very high72 Ų7263 Ų6339%0.38532%0.315SS..  trans-56.7127176.6176.18000110.1M45 S46 V47N43-M45 PolarHBondContact O-N 3.49Å; N43-M45 PolarHBondContact OD1-N 2.87Å; N43-S46 WeakPolarHBondContact O-CA 3.47Å; N43-S46 PolarHBondContact O-N 2.88Å; N43-S46 PolarHBondContact O-OG 2.99Å; N43-V47 PolarHBondContact O-N 2.94Å
44S88.4Confident91.9Very high33 Ų3360.3 Ų60.323%0.23130%0.302CS..Hα-helixtrans-50.4-42.2-179.3176.80000112.6I42 S46 V47I42-S44 PolarHBondContact O-N 3.03Å; S44-S46 PolarHBondContact O-N 3.3Å; S44-S46 VanDerWaalsContact O-N 3.09Å; S44-V47 WeakPolarHBondContact O-CB 3.45Å; S44-V47 PolarHBondContact O-N 3.31Å; S44-V47 VanDerWaalsContact O-N 3.09Å
45M88.1Confident92Very high158 Ų15853.1 Ų53.178%0.77828%0.277SS*.Hα-helixtrans-61.6-22.8176.9-68.1-174.5-74.900114N43N43-M45 PolarHBondContact O-N 3.49Å; N43-M45 PolarHBondContact OD1-N 2.87Å
46S91.5Very high92Very high16 Ų1658.2 Ų58.211%0.11230%0.3CS..Hα-helixtrans-100.5-7178.6630000114.3K12 N43 S44 K48 D49 V50K12-S46 PolarHBondContact NZ-OG 3.26Å; K12-S46 VanDerWaalsContact NZ-OG 3.16Å; N43-S46 WeakPolarHBondContact O-CA 3.47Å; N43-S46 PolarHBondContact O-N 2.88Å; N43-S46 PolarHBondContact O-OG 2.99Å; S44-S46 PolarHBondContact O-N 3.3Å; S44-S46 VanDerWaalsContact O-N 3.09Å; S46-K48 VanDerWaalsContact C-N 3.33Å; S46-K48 PolarHBondContact O-N 3.13Å; S46-D49 PolarHBondContact O-N 2.87Å; S46-V50 WeakPolarHBondContact O-CB 3.46Å; S46-V50 WeakPolarHBondContact O-CG2 3.27Å; S46-V50 PolarHBondContact O-N 3.2Å; S46-V50 VanDerWaalsContact O-N 3.09Å
47V93.9Very high91.9Very high0 Ų062.6 Ų62.60%032%0.323CS..Hα-helixtrans-61-44.9-178166.40000110.3M16 L32 E33 C36 I42 N43 S44 D49 V50 L51M16-V47 HydrophobicContact CE-CB 4.19Å; M16-V47 HydrophobicContact CE-CG1 3.71Å; M16-V47 HydrophobicContact CE-CG2 4.32Å; L32-V47 HydrophobicContact CB-CG1 4.03Å; E33-V47 HydrophobicContact CG-CB 4.16Å; E33-V47 HydrophobicContact CG-CG1 4.08Å; C36-V47 HydrophobicContact CB-CG2 4.01Å; I42-V47 HydrophobicContact CB-CG2 4.32Å; I42-V47 HydrophobicContact CG2-CG2 3.82Å; N43-V47 PolarHBondContact O-N 2.94Å; S44-V47 WeakPolarHBondContact O-CB 3.45Å; S44-V47 PolarHBondContact O-N 3.31Å; S44-V47 VanDerWaalsContact O-N 3.09Å; V47-D49 PolarHBondContact O-N 3.08Å; V47-V50 PolarHBondContact O-N 3.4Å; V47-L51 WeakPolarHBondContact O-CB 3.17Å; V47-L51 PolarHBondContact O-N 3.1Å
48K93.7Very high91.8Very high112 Ų11258.8 Ų58.849%0.48731%0.312SS..Hα-helixtrans-58.9-48.5179.5-172.3-179.4178.6-176.30112.3L29 S46 L51 M52L29-K48 HydrophobicContact CD1-CB 4.23Å; L29-K48 HydrophobicContact CD1-CG 4.3Å; L29-K48 HydrophobicContact CD2-CD 4.25Å; L29-K48 HydrophobicContact CD2-CG 4.25Å; S46-K48 VanDerWaalsContact C-N 3.33Å; S46-K48 PolarHBondContact O-N 3.13Å; K48-L51 PolarHBondContact O-N 3.38Å; K48-M52 WeakPolarHBondContact O-CB 3.17Å; K48-M52 VanDerWaalsContact O-CG 3.29Å; K48-M52 WeakPolarHBondContact O-CG 3.43Å; K48-M52 PolarHBondContact O-N 3.24Å
49D94.4Very high91.8Very high111 Ų11153.6 Ų53.659%0.59429%0.293SS*.Hα-helixtrans-66.5-41.2-178.1-62.8-25.1000112S46 V47 M52 S53S46-D49 PolarHBondContact O-N 2.87Å; V47-D49 PolarHBondContact O-N 3.08Å; D49-M52 PolarHBondContact O-N 3.4Å; D49-S53 WeakPolarHBondContact O-CB 3.23Å; D49-S53 PolarHBondContact O-N 3.15Å
50V95.1Very high91.9Very high2 Ų249.7 Ų49.71%0.01227%0.274CS..Hα-helixtrans-65-43.5176.7174.60000110.7K12 R13 M16 S46 V47 S53 L54K12-V50 HydrophobicContact CB-CG1 4.09Å; K12-V50 HydrophobicContact CB-CG2 3.76Å; K12-V50 HydrophobicContact CD-CG2 3.96Å; R13-V50 HydrophobicContact CB-CG1 4.45Å; R13-V50 HydrophobicContact CG-CG1 3.97Å; M16-V50 HydrophobicContact CB-CG1 4.19Å; M16-V50 HydrophobicContact CE-CB 4.09Å; M16-V50 HydrophobicContact CE-CG1 3.92Å; M16-V50 HydrophobicContact SD-CB 4.35Å; M16-V50 HydrophobicContact SD-CG1 3.84Å; S46-V50 WeakPolarHBondContact O-CB 3.46Å; S46-V50 WeakPolarHBondContact O-CG2 3.27Å; S46-V50 PolarHBondContact O-N 3.2Å; S46-V50 VanDerWaalsContact O-N 3.09Å; V47-V50 PolarHBondContact O-N 3.4Å; V50-S53 PolarHBondContact O-N 3.41Å; V50-L54 HydrophobicContact CG1-CD1 4.47Å; V50-L54 WeakPolarHBondContact O-CG 3.45Å; V50-L54 PolarHBondContact O-N 3.05Å
51L95.2Very high92.1Very high1 Ų149.9 Ų49.91%0.00528%0.277CS..Hα-helixtrans-61.2-49.8176.9178.665.5000111.1M16 F20 L29 L32 V47 K48 S53 L54 V55 V60 F71M16-L51 HydrophobicContact CE-CB 4.48Å; M16-L51 HydrophobicContact SD-CB 3.8Å; M16-L51 HydrophobicContact SD-CD1 4.09Å; F20-L51 HydrophobicContact CE2-CD1 3.86Å; F20-L51 HydrophobicContact CZ-CD1 3.8Å; L29-L51 HydrophobicContact CD1-CD2 3.82Å; L32-L51 HydrophobicContact CD1-CD1 3.99Å; L32-L51 HydrophobicContact CD1-CD2 3.61Å; L32-L51 HydrophobicContact CD1-CG 4.43Å; V47-L51 WeakPolarHBondContact O-CB 3.17Å; V47-L51 PolarHBondContact O-N 3.1Å; K48-L51 PolarHBondContact O-N 3.38Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 3.22Å; L51-L54 WeakPolarHBondContact O-CB 3.12Å; L51-L54 PolarHBondContact O-N 3.34Å; L51-L54 VanDerWaalsContact O-N 3.09Å; L51-V55 HydrophobicContact CD1-CG2 4.5Å; L51-V55 WeakPolarHBondContact O-CG2 3.25Å; L51-V55 PolarHBondContact O-N 3.2Å; L51-V60 HydrophobicContact CD1-CG1 3.92Å; L51-F71 HydrophobicContact CD1-CB 4.21Å; L51-F71 HydrophobicContact CD1-CD1 4.03Å; L51-F71 HydrophobicContact CD1-CG 4.16Å; L51-F71 HydrophobicContact CD2-CD1 3.85Å; L51-F71 HydrophobicContact CD2-CD2 3.85Å; L51-F71 HydrophobicContact CD2-CE1 3.89Å; L51-F71 HydrophobicContact CD2-CE2 3.91Å; L51-F71 HydrophobicContact CD2-CG 3.82Å; L51-F71 HydrophobicContact CD2-CZ 3.92Å; L51-F71 HydrophobicContact CG-CD1 4.04Å; L51-F71 HydrophobicContact CG-CE1 4.21Å; L51-F71 HydrophobicContact CG-CG 4.35Å
52M95Very high92.4Very high69 Ų6950.3 Ų50.334%0.3427%0.269SS..Hα-helixtrans-62.8-37.4179.2-69.4-56.4-60.100111.7K48 D49 L54 V55 H56K48-M52 WeakPolarHBondContact O-CB 3.17Å; K48-M52 VanDerWaalsContact O-CG 3.29Å; K48-M52 WeakPolarHBondContact O-CG 3.43Å; K48-M52 PolarHBondContact O-N 3.24Å; D49-M52 PolarHBondContact O-N 3.4Å; M52-L54 VanDerWaalsContact C-N 3.34Å; M52-L54 PolarHBondContact O-N 2.96Å; M52-V55 PolarHBondContact O-N 3.03Å; M52-H56 WeakPolarHBondContact O-CB 3.41Å; M52-H56 PolarHBondContact O-N 2.95Å; M52-H56 PolarHBondContact O-ND1 3.36Å
53S94.8Very high92.7Very high28 Ų2854.4 Ų54.420%0.19629%0.291CS..Hα-helixtrans-60.9-40.6172.4174.30000112.5R13 D49 V50 L51 D57R13-S53 PolarHBondContact NE-OG 2.84Å; D49-S53 WeakPolarHBondContact O-CB 3.23Å; D49-S53 PolarHBondContact O-N 3.15Å; V50-S53 PolarHBondContact O-N 3.41Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 3.22Å; S53-D57 PolarHBondContact O-N 3.26Å
54L93.9Very high93.1Very high0 Ų057.9 Ų57.90%030%0.303CS..Hα-helixtrans-69.3-34.4175.3-70.5173.1000113.1R13 M16 L17 V50 L51 M52 G58 L59 V60R13-L54 HydrophobicContact CB-CD2 4.03Å; R13-L54 HydrophobicContact CB-CG 4.48Å; R13-L54 HydrophobicContact CG-CD2 4.36Å; R13-L54 HydrophobicContact CG-CG 4.49Å; M16-L54 HydrophobicContact CB-CD1 3.87Å; M16-L54 HydrophobicContact CG-CD1 3.79Å; M16-L54 HydrophobicContact SD-CD1 3.85Å; L17-L54 HydrophobicContact CD1-CD2 3.59Å; L17-L54 HydrophobicContact CD2-CD1 4.26Å; L17-L54 HydrophobicContact CD2-CD2 4.04Å; L17-L54 HydrophobicContact CG-CD1 3.93Å; L17-L54 HydrophobicContact CG-CD2 3.64Å; L17-L54 HydrophobicContact CG-CG 4.43Å; V50-L54 HydrophobicContact CG1-CD1 4.47Å; V50-L54 WeakPolarHBondContact O-CG 3.45Å; V50-L54 PolarHBondContact O-N 3.05Å; L51-L54 WeakPolarHBondContact O-CB 3.12Å; L51-L54 PolarHBondContact O-N 3.34Å; L51-L54 VanDerWaalsContact O-N 3.09Å; M52-L54 VanDerWaalsContact C-N 3.34Å; M52-L54 PolarHBondContact O-N 2.96Å; L54-G58 PolarHBondContact O-N 3.35Å; L54-L59 HydrophobicContact CD2-CB 4.29Å; L54-L59 HydrophobicContact CD2-CD1 3.9Å; L54-L59 PolarHBondContact O-N 3.12Å; L54-V60 HydrophobicContact CB-CB 4.16Å; L54-V60 HydrophobicContact CB-CG2 3.71Å; L54-V60 HydrophobicContact CD1-CG2 4.05Å; L54-V60 HydrophobicContact CG-CG2 4.48Å; L54-V60 PolarHBondContact O-N 2.93Å
55V94.6Very high93.4Very high25 Ų2561.3 Ų61.315%0.15232%0.317CS..Hα-helixtrans-68.1-44.6175.1169.60000110.9L51 M52 D57 G58 V60 T62 F71L51-V55 HydrophobicContact CD1-CG2 4.5Å; L51-V55 WeakPolarHBondContact O-CG2 3.25Å; L51-V55 PolarHBondContact O-N 3.2Å; M52-V55 PolarHBondContact O-N 3.03Å; V55-D57 VanDerWaalsContact C-N 3.3Å; V55-D57 PolarHBondContact O-N 3.27Å; V55-G58 WeakPolarHBondContact O-CA 3.46Å; V55-G58 PolarHBondContact O-N 2.93Å; V55-V60 WeakPolarHBondContact CA-O 3.45Å; V55-V60 HydrophobicContact CG2-CB 4.01Å; V55-V60 HydrophobicContact CG2-CG1 3.97Å; V55-T62 HydrophobicContact CG1-CG2 3.62Å; V55-F71 HydrophobicContact CG2-CD1 3.87Å; V55-F71 HydrophobicContact CG2-CE1 4.02Å
56H92.9Very high93.7Very high140 Ų14056.9 Ų56.965%0.64831%0.313SS*.Hα-helixtrans-61.6-38177.7-66.6162000112.3M52 G58M52-H56 WeakPolarHBondContact O-CB 3.41Å; M52-H56 PolarHBondContact O-N 2.95Å; M52-H56 PolarHBondContact O-ND1 3.36Å; H56-G58 PolarHBondContact O-N 3.3Å
57D89.5Confident93.7Very high92 Ų9262.8 Ų62.849%0.49235%0.348SS..THydrogen-bonded Turntrans-79.10.1175-69.60000112.5R13 S53 V55 L59R13-D57 IonicContact CZ-OD2 3.25Å; R13-D57 VanDerWaalsContact CZ-OD2 3.25Å; R13-D57 IonicContact NH1-OD2 3.03Å; R13-D57 PolarHBondContact NH1-OD2 3.47Å; R13-D57 IonicContact NH2-OD2 2.62Å; R13-D57 PolarHBondContact NH2-OD2 2.84Å; S53-D57 PolarHBondContact O-N 3.26Å; V55-D57 VanDerWaalsContact C-N 3.3Å; V55-D57 PolarHBondContact O-N 3.27Å; D57-L59 VanDerWaalsContact C-N 3.27Å; D57-L59 HydrophobicContact CB-CD1 4.28Å; D57-L59 HydrophobicContact CB-CG 4.34Å; D57-L59 PolarHBondContact O-N 3.03Å
58G88.4Confident93.7Very high25 Ų2564.3 Ų64.326%0.25836%0.359SS..THydrogen-bonded Turntrans62.832.1177.500000113.6L54 V55 H56 K81L54-G58 PolarHBondContact O-N 3.35Å; V55-G58 WeakPolarHBondContact O-CA 3.46Å; V55-G58 PolarHBondContact O-N 2.93Å; H56-G58 PolarHBondContact O-N 3.3Å; G58-K81 PolarHBondContact O-NZ 3.47Å
59L89.3Confident93.8Very high71 Ų7161.7 Ų61.737%0.37235%0.352SS..SBendtrans-92.8-27.4174-63.8170.6000111.7L17 L54 D57 A73L17-L59 HydrophobicContact CD1-CB 4.42Å; L17-L59 HydrophobicContact CD1-CD1 3.96Å; L17-L59 HydrophobicContact CD2-CB 3.82Å; L54-L59 HydrophobicContact CD2-CB 4.29Å; L54-L59 HydrophobicContact CD2-CD1 3.9Å; L54-L59 PolarHBondContact O-N 3.12Å; D57-L59 VanDerWaalsContact C-N 3.27Å; D57-L59 HydrophobicContact CB-CD1 4.28Å; D57-L59 HydrophobicContact CB-CG 4.34Å; D57-L59 PolarHBondContact O-N 3.03Å; L59-A73 WeakPolarHBondContact O-CB 3.24Å
60V94Very high93.9Very high2 Ų258.9 Ų58.91%0.01233%0.334CS..SBendtrans-116.8132.5170.8174.30000107.9L17 F20 L51 L54 V55 F71 A73L17-V60 HydrophobicContact CD2-CG2 4Å; F20-V60 HydrophobicContact CD2-CG2 3.79Å; F20-V60 HydrophobicContact CE2-CG1 4.03Å; F20-V60 HydrophobicContact CE2-CG2 3.71Å; F20-V60 HydrophobicContact CZ-CG1 3.95Å; F20-V60 HydrophobicContact CZ-CG2 4.45Å; L51-V60 HydrophobicContact CD1-CG1 3.92Å; L54-V60 HydrophobicContact CB-CB 4.16Å; L54-V60 HydrophobicContact CB-CG2 3.71Å; L54-V60 HydrophobicContact CD1-CG2 4.05Å; L54-V60 HydrophobicContact CG-CG2 4.48Å; L54-V60 PolarHBondContact O-N 2.93Å; V55-V60 WeakPolarHBondContact CA-O 3.45Å; V55-V60 HydrophobicContact CG2-CB 4.01Å; V55-V60 HydrophobicContact CG2-CG1 3.97Å; V60-F71 HydrophobicContact CG1-CB 4.07Å; V60-F71 HydrophobicContact CG1-CD1 4.44Å; V60-A73 HydrophobicContact CG2-CB 4.1Å
61D94Very high94Very high36 Ų3659.4 Ų59.419%0.19334%0.336CS..EExtended strand (participates in β ladder)trans-84.3150.7173.4-66-57.8000110.6F71 W72 K77D61-F71 VanDerWaalsContact O-CA 3.27Å; D61-F71 WeakPolarHBondContact O-CA 3.42Å; D61-W72 HydrophobicContact CB-CD2 3.97Å; D61-W72 VanDerWaalsContact CB-CE2 3.49Å; D61-W72 HydrophobicContact CB-CG 4.38Å; D61-W72 HydrophobicContact CB-CH2 4.35Å; D61-W72 HydrophobicContact CB-CZ2 3.72Å; D61-W72 PolarHBondContact N-O 3.02Å; D61-W72 PolarHBondContact O-N 2.9Å; D61-W72 VanDerWaalsContact O-N 3.11Å; D61-W72 PolarHBondContact OD2-NE1 3.45Å; D61-K77 IonicContact OD1-NZ 3.98Å; D61-K77 PolarHBondContact OD1-NZ 3.35Å; D61-K77 WeakPolarHBondContact OD2-CD 3.37Å; D61-K77 VanDerWaalsContact OD2-CE 3.28Å; D61-K77 WeakPolarHBondContact OD2-CE 3.46Å; D61-K77 IonicContact OD2-NZ 2.71Å; D61-K77 PolarHBondContact OD2-NZ 2.91Å
62T95.5Very high94Very high62 Ų6262.1 Ų62.138%0.3835%0.346SS..EExtended strand (participates in β ladder)trans-135.5141.3173.8-170.90000109.9V55 V69 Y70 F71V55-T62 HydrophobicContact CG1-CG2 3.62Å; T62-V69 VanDerWaalsContact OG1-CG1 3.23Å; T62-V69 WeakPolarHBondContact OG1-CG1 3.3Å; T62-Y70 VanDerWaalsContact CA-O 3.25Å; T62-Y70 WeakPolarHBondContact CA-O 3.46Å; T62-Y70 PolarHBondContact OG1-O 3.42Å; T62-F71 WeakPolarHBondContact OG1-CD1 3.43Å; T62-F71 WeakPolarHBondContact OG1-CE1 3.48Å
63D96.3Very high94Very high88 Ų8858.9 Ų58.947%0.47133%0.33SS..EExtended strand (participates in β ladder)trans-148.9149171.8-164.79.1000111.2V69 Y70 W72D63-V69 WeakPolarHBondContact O-CA 3.49Å; D63-Y70 PolarHBondContact N-O 3.5Å; D63-Y70 PolarHBondContact O-N 2.86Å; D63-W72 HydrophobicContact CB-CH2 3.54Å; D63-W72 HydrophobicContact CB-CZ3 3.77Å
64K96.1Very high93.8Very high144 Ų14461 Ų6163%0.62634%0.336SS*.EExtended strand (participates in β ladder)trans-103.3110.5-179.5-174.6-177.9178.6-174.40109.6G66 S68 V69K64-G66 WeakPolarHBondContact CE-O 3.22Å; K64-S68 WeakPolarHBondContact CA-O 3.46Å; K64-V69 HydrophobicContact CB-CG2 4.28Å; K64-V69 HydrophobicContact CG-CG2 4.14Å
65I94.7Very high93.6Very high105 Ų10563.7 Ų63.754%0.53835%0.353SS..EExtended strand (participates in β ladder)trans-113.4109.8178.6-53.7171.2000108T67 S68 Y70I65-T67 PolarHBondContact O-N 2.96Å; I65-S68 PolarHBondContact N-O 3.35Å; I65-S68 PolarHBondContact O-N 3.38Å; I65-Y70 HydrophobicContact CB-CD2 3.98Å; I65-Y70 HydrophobicContact CB-CE2 3.84Å; I65-Y70 HydrophobicContact CD1-CD2 4Å; I65-Y70 HydrophobicContact CD1-CE2 4.39Å; I65-Y70 HydrophobicContact CG1-CD2 4.12Å; I65-Y70 HydrophobicContact CG1-CE2 4.44Å
66G93.9Very high93.4Very high66 Ų6666.8 Ų66.868%0.6838%0.376SS*.THydrogen-bonded Turntrans65.1-122-173.400000112K64K64-G66 WeakPolarHBondContact CE-O 3.22Å
67T92.8Very high93.2Very high140 Ų14065 Ų6586%0.85937%0.366SS*.THydrogen-bonded Turntrans-91.9-6.5178.553.90000113.3I65I65-T67 PolarHBondContact O-N 2.96Å
68S93.5Very high93Very high31 Ų3162.3 Ų62.322%0.21736%0.358CS..EExtended strand (participates in β ladder)trans-111.6145.9-173.2-59.40000112.1K64 I65K64-S68 WeakPolarHBondContact CA-O 3.46Å; I65-S68 PolarHBondContact N-O 3.35Å; I65-S68 PolarHBondContact O-N 3.38Å
69V96Very high93Very high58 Ų5864.1 Ų64.135%0.35237%0.37SS..EExtended strand (participates in β ladder)trans-106.1128.7173.9-176.20000108.3T62 D63 K64 F71T62-V69 VanDerWaalsContact OG1-CG1 3.23Å; T62-V69 WeakPolarHBondContact OG1-CG1 3.3Å; D63-V69 WeakPolarHBondContact O-CA 3.49Å; K64-V69 HydrophobicContact CB-CG2 4.28Å; K64-V69 HydrophobicContact CG-CG2 4.14Å; V69-F71 HydrophobicContact CB-CE2 4.32Å; V69-F71 HydrophobicContact CB-CZ 4.49Å; V69-F71 HydrophobicContact CG1-CE1 4.27Å; V69-F71 HydrophobicContact CG1-CE2 3.8Å; V69-F71 HydrophobicContact CG1-CZ 3.63Å
70Y97Very high93Very high52 Ų5265.2 Ų65.220%0.20437%0.373CS..EExtended strand (participates in β ladder)trans-109.8146.7-178.8-64.3-83.7000110F26 Q28 T62 D63 I65F26-Y70 AromaticContact CD2-CD1 3.74Å; F26-Y70 HydrophobicContact CD2-CD1 3.74Å; F26-Y70 HydrophobicContact CD2-CE1 4.12Å; F26-Y70 HydrophobicContact CE2-CD1 4.33Å; F26-Y70 HydrophobicContact CE2-CE1 4.26Å; Q28-Y70 HydrophobicContact CG-CD1 3.97Å; Q28-Y70 HydrophobicContact CG-CE1 3.73Å; Q28-Y70 PolarHBondContact NE2-OH 2.88Å; T62-Y70 VanDerWaalsContact CA-O 3.25Å; T62-Y70 WeakPolarHBondContact CA-O 3.46Å; T62-Y70 PolarHBondContact OG1-O 3.42Å; D63-Y70 PolarHBondContact N-O 3.5Å; D63-Y70 PolarHBondContact O-N 2.86Å; I65-Y70 HydrophobicContact CB-CD2 3.98Å; I65-Y70 HydrophobicContact CB-CE2 3.84Å; I65-Y70 HydrophobicContact CD1-CD2 4Å; I65-Y70 HydrophobicContact CD1-CE2 4.39Å; I65-Y70 HydrophobicContact CG1-CD2 4.12Å; I65-Y70 HydrophobicContact CG1-CE2 4.44Å
71F97Very high92.8Very high13 Ų1369.5 Ų69.56%0.05739%0.392CS..EExtended strand (participates in β ladder)trans-129.7136.7178.1-57.7-89.4000109.7F20 F26 F27 L29 L32 L51 V55 V60 D61 T62 V69F20-F71 HydrophobicContact CE1-CB 4.26Å; F20-F71 WeakPolarHBondContact CE1-O 3.31Å; F20-F71 HydrophobicContact CZ-CB 4.06Å; F26-F71 WeakPolarHBondContact CA-O 3.39Å; F27-F71 PolarHBondContact N-O 3.34Å; F27-F71 PolarHBondContact O-N 3.46Å; L29-F71 HydrophobicContact CB-CE2 4.26Å; L32-F71 HydrophobicContact CD1-CB 4.07Å; L32-F71 HydrophobicContact CD1-CD2 4.21Å; L32-F71 HydrophobicContact CD1-CG 4.36Å; L51-F71 HydrophobicContact CD1-CB 4.21Å; L51-F71 HydrophobicContact CD1-CD1 4.03Å; L51-F71 HydrophobicContact CD1-CG 4.16Å; L51-F71 HydrophobicContact CD2-CD1 3.85Å; L51-F71 HydrophobicContact CD2-CD2 3.85Å; L51-F71 HydrophobicContact CD2-CE1 3.89Å; L51-F71 HydrophobicContact CD2-CE2 3.91Å; L51-F71 HydrophobicContact CD2-CG 3.82Å; L51-F71 HydrophobicContact CD2-CZ 3.92Å; L51-F71 HydrophobicContact CG-CD1 4.04Å; L51-F71 HydrophobicContact CG-CE1 4.21Å; L51-F71 HydrophobicContact CG-CG 4.35Å; V55-F71 HydrophobicContact CG2-CD1 3.87Å; V55-F71 HydrophobicContact CG2-CE1 4.02Å; V60-F71 HydrophobicContact CG1-CB 4.07Å; V60-F71 HydrophobicContact CG1-CD1 4.44Å; D61-F71 VanDerWaalsContact O-CA 3.27Å; D61-F71 WeakPolarHBondContact O-CA 3.42Å; T62-F71 WeakPolarHBondContact OG1-CD1 3.43Å; T62-F71 WeakPolarHBondContact OG1-CE1 3.48Å; V69-F71 HydrophobicContact CB-CE2 4.32Å; V69-F71 HydrophobicContact CB-CZ 4.49Å; V69-F71 HydrophobicContact CG1-CE1 4.27Å; V69-F71 HydrophobicContact CG1-CE2 3.8Å; V69-F71 HydrophobicContact CG1-CZ 3.63Å
72W95.2Very high92.6Very high57 Ų5773 Ų7322%0.21641%0.409CS..EExtended strand (participates in β ladder)trans-153.1158.6176.866.989.4000110.9F26 D61 D63 F74F26-W72 HydrophobicContact CB-CB 4.13Å; D61-W72 HydrophobicContact CB-CD2 3.97Å; D61-W72 VanDerWaalsContact CB-CE2 3.49Å; D61-W72 HydrophobicContact CB-CG 4.38Å; D61-W72 HydrophobicContact CB-CH2 4.35Å; D61-W72 HydrophobicContact CB-CZ2 3.72Å; D61-W72 PolarHBondContact N-O 3.02Å; D61-W72 PolarHBondContact O-N 2.9Å; D61-W72 VanDerWaalsContact O-N 3.11Å; D61-W72 PolarHBondContact OD2-NE1 3.45Å; D63-W72 HydrophobicContact CB-CH2 3.54Å; D63-W72 HydrophobicContact CB-CZ3 3.77Å; W72-F74 HydrophobicContact CB-CE2 4.34Å; W72-F74 AromaticContact CD1-CD2 3.53Å; W72-F74 AromaticContact CD1-CE2 3.32Å; W72-F74 HydrophobicContact CG-CE2 4.02Å
73A93.9Very high92.5Very high2 Ų275.2 Ų75.22%0.01741%0.414CS..  trans-147.6132.6168.300000110F20 Y21 L59 V60F20-A73 HydrophobicContact CB-CB 3.73Å; F20-A73 HydrophobicContact CG-CB 4.09Å; Y21-A73 HydrophobicContact CD1-CB 4.22Å; Y21-A73 HydrophobicContact CE1-CB 3.76Å; L59-A73 WeakPolarHBondContact O-CB 3.24Å; V60-A73 HydrophobicContact CG2-CB 4.1Å
74F92.4Very high92.5Very high72 Ų7274.7 Ų74.732%0.31641%0.411SS..  trans-116.7136.5179.1-65.6-72.2000110.8K24 W72 S76 K77 A78K24-F74 HydrophobicContact CB-CD1 4.16Å; K24-F74 HydrophobicContact CB-CE1 4.02Å; K24-F74 WeakPolarHBondContact O-CE1 3.46Å; W72-F74 HydrophobicContact CB-CE2 4.34Å; W72-F74 AromaticContact CD1-CD2 3.53Å; W72-F74 AromaticContact CD1-CE2 3.32Å; W72-F74 HydrophobicContact CG-CE2 4.02Å; F74-S76 PolarHBondContact O-N 2.89Å; F74-K77 PolarHBondContact O-N 3.25Å; F74-K77 VanDerWaalsContact O-N 3.15Å; F74-A78 PolarHBondContact O-N 3.31Å
75P89.5Confident92.4Very high56 Ų5671.8 Ų71.836%0.36440%0.403SS..Hα-helixtrans-56-37.4177.3-25.332.6000113.2Y21 K77 A78 A79Y21-P75 HydrophobicContact CD1-CG 3.92Å; Y21-P75 HydrophobicContact CD2-CG 4.35Å; Y21-P75 HydrophobicContact CG-CG 3.8Å; P75-K77 PolarHBondContact O-N 3.45Å; P75-A78 PolarHBondContact O-N 2.92Å; P75-A79 PolarHBondContact O-N 3.25Å
76S89.6Confident92.6Very high90 Ų9071.4 Ų71.463%0.62940%0.401SS*.Hα-helixtrans-61.9-41.4179.353.30000112.5F74 A79 Q80F74-S76 PolarHBondContact O-N 2.89Å; S76-A79 PolarHBondContact O-N 3.46Å; S76-Q80 WeakPolarHBondContact O-CB 3.36Å; S76-Q80 PolarHBondContact O-N 2.91Å
77K88Confident92.7Very high102 Ų10273.1 Ų73.144%0.44339%0.391SS..Hα-helixtrans-68.8-40.3179.1-172.8175.1176.21770111.7D61 F74 P75 Q80 K81D61-K77 IonicContact OD1-NZ 3.98Å; D61-K77 PolarHBondContact OD1-NZ 3.35Å; D61-K77 WeakPolarHBondContact OD2-CD 3.37Å; D61-K77 VanDerWaalsContact OD2-CE 3.28Å; D61-K77 WeakPolarHBondContact OD2-CE 3.46Å; D61-K77 IonicContact OD2-NZ 2.71Å; D61-K77 PolarHBondContact OD2-NZ 2.91Å; F74-K77 PolarHBondContact O-N 3.25Å; F74-K77 VanDerWaalsContact O-N 3.15Å; P75-K77 PolarHBondContact O-N 3.45Å; K77-Q80 PolarHBondContact O-N 3.12Å; K77-K81 WeakPolarHBondContact O-CB 3.48Å; K77-K81 PolarHBondContact O-N 2.86Å
78A85.4Confident93Very high37 Ų3772.5 Ų72.531%0.30638%0.376SS..Hα-helixtrans-61.6-46175.700000111.4Y21 F74 P75 K81 L82Y21-A78 VanDerWaalsContact OH-CB 3.32Å; Y21-A78 WeakPolarHBondContact OH-CB 3.42Å; F74-A78 PolarHBondContact O-N 3.31Å; P75-A78 PolarHBondContact O-N 2.92Å; A78-K81 PolarHBondContact O-N 2.9Å; A78-L82 PolarHBondContact O-N 3.38Å
79A88.4Confident93.2Very high62 Ų6274.9 Ų74.951%0.51239%0.389SS..Hα-helixtrans-61.9-44.2175.500000112.3P75 S76 L82 K83P75-A79 PolarHBondContact O-N 3.25Å; S76-A79 PolarHBondContact O-N 3.46Å; A79-L82 PolarHBondContact O-N 3.09Å; A79-K83 PolarHBondContact O-N 3.04Å
80Q90.8Very high93.3Very high95 Ų9575.2 Ų75.244%0.44439%0.392SS..Hα-helixtrans-65.5-40.7178.5-170.56247.600112.1S76 K77 L82 K83 N84S76-Q80 WeakPolarHBondContact O-CB 3.36Å; S76-Q80 PolarHBondContact O-N 2.91Å; K77-Q80 PolarHBondContact O-N 3.12Å; Q80-L82 VanDerWaalsContact C-N 3.34Å; Q80-L82 PolarHBondContact O-N 3.49Å; Q80-K83 PolarHBondContact O-N 2.91Å; Q80-N84 PolarHBondContact NE2-OD1 3.06Å; Q80-N84 WeakPolarHBondContact O-CB 3.43Å; Q80-N84 PolarHBondContact O-N 2.85Å; Q80-N84 PolarHBondContact O-OD1 3.37Å
81K88.7Confident93.4Very high92 Ų9278.1 Ų78.140%0.441%0.407SS..Hα-helixtrans-61.6-43.3175.8-175.9175.5176.5-178.90111G58 K77 A78 N84 N85G58-K81 PolarHBondContact O-NZ 3.47Å; K77-K81 WeakPolarHBondContact O-CB 3.48Å; K77-K81 PolarHBondContact O-N 2.86Å; A78-K81 PolarHBondContact O-N 2.9Å; K81-N84 PolarHBondContact O-N 3.38Å; K81-N85 WeakPolarHBondContact O-CB 3.35Å; K81-N85 PolarHBondContact O-N 3.42Å; K81-N85 PolarHBondContact O-ND2 3.26Å
82L89.7Confident93.4Very high108 Ų10881.1 Ų81.157%0.56542%0.423SS*.Hα-helixtrans-61.8-45.5175.1-178.262000111.4A78 A79 Q80 N85 I86A78-L82 PolarHBondContact O-N 3.38Å; A79-L82 PolarHBondContact O-N 3.09Å; Q80-L82 VanDerWaalsContact C-N 3.34Å; Q80-L82 PolarHBondContact O-N 3.49Å; L82-N85 PolarHBondContact O-N 3.47Å; L82-I86 HydrophobicContact CD1-CD1 4.28Å; L82-I86 HydrophobicContact CD1-CG1 4.49Å; L82-I86 HydrophobicContact CG-CD1 4.03Å; L82-I86 WeakPolarHBondContact O-CG1 3.19Å; L82-I86 PolarHBondContact O-N 3.09Å
83K95Very high93.6Very high110 Ų11082.1 Ų82.148%0.47843%0.432SS..Hα-helixtrans-59.1-49.2176.8-175.9179.3172.3-176.50112A79 Q80 N85 I86 E87A79-K83 PolarHBondContact O-N 3.04Å; Q80-K83 PolarHBondContact O-N 2.91Å; K83-N85 VanDerWaalsContact C-N 3.29Å; K83-N85 PolarHBondContact O-N 3.25Å; K83-I86 PolarHBondContact O-N 3.24Å; K83-I86 VanDerWaalsContact O-N 3.17Å; K83-E87 WeakPolarHBondContact CE-OE1 3.41Å; K83-E87 IonicContact NZ-OE1 2.66Å; K83-E87 PolarHBondContact O-N 2.83Å
84N95.2Very high93.8Very high77 Ų7787.9 Ų87.941%0.41246%0.459SS..Hα-helixtrans-60.4-39.6177.7-67.81.4000111.7Q80 K81 E87 K88Q80-N84 PolarHBondContact NE2-OD1 3.06Å; Q80-N84 WeakPolarHBondContact O-CB 3.43Å; Q80-N84 PolarHBondContact O-N 2.85Å; Q80-N84 PolarHBondContact O-OD1 3.37Å; K81-N84 PolarHBondContact O-N 3.38Å; N84-E87 PolarHBondContact O-N 3.07Å; N84-K88 WeakPolarHBondContact O-CB 3.49Å; N84-K88 PolarHBondContact O-N 3.45Å
85N94.9Very high94.1Very high83 Ų8388.3 Ų88.344%0.44447%0.465SS..Hα-helixtrans-65.6-41.5176.6-73.7-11.3000111.7K81 L82 K83 K88 V89K81-N85 WeakPolarHBondContact O-CB 3.35Å; K81-N85 PolarHBondContact O-N 3.42Å; K81-N85 PolarHBondContact O-ND2 3.26Å; L82-N85 PolarHBondContact O-N 3.47Å; K83-N85 VanDerWaalsContact C-N 3.29Å; K83-N85 PolarHBondContact O-N 3.25Å; N85-K88 PolarHBondContact O-N 3.27Å; N85-V89 WeakPolarHBondContact O-CB 3.42Å; N85-V89 VanDerWaalsContact O-CG2 3.24Å; N85-V89 WeakPolarHBondContact O-CG2 3.44Å; N85-V89 PolarHBondContact O-N 3Å
86I97.2Very high94.5Very high97 Ų9789.7 Ų89.750%0.49747%0.472SS..Hα-helixtrans-62.4-46.6175.7-70.2167000110.4L82 K83 V89 T90L82-I86 HydrophobicContact CD1-CD1 4.28Å; L82-I86 HydrophobicContact CD1-CG1 4.49Å; L82-I86 HydrophobicContact CG-CD1 4.03Å; L82-I86 WeakPolarHBondContact O-CG1 3.19Å; L82-I86 PolarHBondContact O-N 3.09Å; K83-I86 PolarHBondContact O-N 3.24Å; K83-I86 VanDerWaalsContact O-N 3.17Å; I86-V89 PolarHBondContact O-N 3.09Å; I86-T90 VanDerWaalsContact O-CB 3.29Å; I86-T90 WeakPolarHBondContact O-CB 3.43Å; I86-T90 PolarHBondContact O-N 3.21Å; I86-T90 PolarHBondContact O-OG1 3.47Å
87E97.7Very high94.9Very high102 Ų10293.8 Ų93.848%0.47747%0.473SS..Hα-helixtrans-59.4-49.2177.5-74.8172.9-175.800111K83 N84 V89 T90 E91K83-E87 WeakPolarHBondContact CE-OE1 3.41Å; K83-E87 IonicContact NZ-OE1 2.66Å; K83-E87 PolarHBondContact O-N 2.83Å; N84-E87 PolarHBondContact O-N 3.07Å; E87-V89 PolarHBondContact O-N 2.92Å; E87-T90 WeakPolarHBondContact O-CB 3.48Å; E87-T90 PolarHBondContact O-N 3.33Å; E87-E91 PolarHBondContact O-N 2.91Å
88K97.9Very high95.4Very high127 Ų12795.9 Ų95.955%0.55248%0.48SS*.Hα-helixtrans-58.9-50.4177.6-175.7-178178.4-176.70112.4N84 N85 T90 E91 D92N84-K88 WeakPolarHBondContact O-CB 3.49Å; N84-K88 PolarHBondContact O-N 3.45Å; N85-K88 PolarHBondContact O-N 3.27Å; K88-T90 PolarHBondContact O-N 3.46Å; K88-E91 WeakPolarHBondContact O-CB 3.42Å; K88-E91 PolarHBondContact O-N 2.94Å; K88-D92 PolarHBondContact O-N 3.23Å
89V97.9Very high96Very high81 Ų8198.7 Ų98.749%0.49149%0.486SS..Hα-helixtrans-63.6-34.5179.6171.60000110.9N85 I86 E87 D92 I93N85-V89 WeakPolarHBondContact O-CB 3.42Å; N85-V89 VanDerWaalsContact O-CG2 3.24Å; N85-V89 WeakPolarHBondContact O-CG2 3.44Å; N85-V89 PolarHBondContact O-N 3Å; I86-V89 PolarHBondContact O-N 3.09Å; E87-V89 PolarHBondContact O-N 2.92Å; V89-D92 PolarHBondContact O-N 3.41Å; V89-I93 HydrophobicContact CG1-CD1 3.96Å; V89-I93 HydrophobicContact CG1-CG1 4.49Å; V89-I93 WeakPolarHBondContact O-CB 3.32Å; V89-I93 WeakPolarHBondContact O-CD1 3.36Å; V89-I93 VanDerWaalsContact O-CG1 3.22Å; V89-I93 WeakPolarHBondContact O-CG1 3.32Å; V89-I93 PolarHBondContact O-N 3.23Å
90T98.2Very high96.5Very high65 Ų65100.5 Ų100.540%0.39949%0.487SS..Hα-helixtrans-65.8-43.8175.6-58.70000111.4I86 E87 K88 I93 Q94I86-T90 VanDerWaalsContact O-CB 3.29Å; I86-T90 WeakPolarHBondContact O-CB 3.43Å; I86-T90 PolarHBondContact O-N 3.21Å; I86-T90 PolarHBondContact O-OG1 3.47Å; E87-T90 WeakPolarHBondContact O-CB 3.48Å; E87-T90 PolarHBondContact O-N 3.33Å; K88-T90 PolarHBondContact O-N 3.46Å; T90-I93 PolarHBondContact O-N 3.47Å; T90-Q94 WeakPolarHBondContact O-CG 3.35Å; T90-Q94 PolarHBondContact O-N 3.43Å
91E98.4Very high96.9Very high113 Ų11398.4 Ų98.453%0.52848%0.482SS..Hα-helixtrans-61.7-46174.3-173.8-179.9-175.800111.3E87 K88 I93 Q94 N95E87-E91 PolarHBondContact O-N 2.91Å; K88-E91 WeakPolarHBondContact O-CB 3.42Å; K88-E91 PolarHBondContact O-N 2.94Å; E91-I93 VanDerWaalsContact C-N 3.31Å; E91-I93 PolarHBondContact O-N 2.89Å; E91-Q94 PolarHBondContact O-N 3.41Å; E91-Q94 VanDerWaalsContact O-N 3.12Å; E91-N95 WeakPolarHBondContact O-CB 3.34Å; E91-N95 PolarHBondContact O-N 3.37Å; E91-N95 PolarHBondContact O-ND2 3.01Å
92D98.3Very high97.3Very high75 Ų7599.8 Ų99.840%0.40149%0.488SS..Hα-helixtrans-59.9-40.2177.3-71.9-24.5000111.8K88 V89 T96K88-D92 PolarHBondContact O-N 3.23Å; V89-D92 PolarHBondContact O-N 3.41Å; D92-T96 VanDerWaalsContact O-CB 3.31Å; D92-T96 WeakPolarHBondContact O-CB 3.45Å; D92-T96 PolarHBondContact O-N 3.05Å; D92-T96 PolarHBondContact O-OG1 3.39Å
93I98.4Very high97.7Very high78 Ų7898.9 Ų98.940%0.449%0.488SS..Hα-helixtrans-63.2-45.3174.5-73.3166000110.9V89 T90 E91 T96 R97V89-I93 HydrophobicContact CG1-CD1 3.96Å; V89-I93 HydrophobicContact CG1-CG1 4.49Å; V89-I93 WeakPolarHBondContact O-CB 3.32Å; V89-I93 WeakPolarHBondContact O-CD1 3.36Å; V89-I93 VanDerWaalsContact O-CG1 3.22Å; V89-I93 WeakPolarHBondContact O-CG1 3.32Å; V89-I93 PolarHBondContact O-N 3.23Å; T90-I93 PolarHBondContact O-N 3.47Å; E91-I93 VanDerWaalsContact C-N 3.31Å; E91-I93 PolarHBondContact O-N 2.89Å; I93-T96 PolarHBondContact O-N 2.76Å; I93-R97 WeakPolarHBondContact O-CB 3.4Å; I93-R97 VanDerWaalsContact O-CG 3.3Å; I93-R97 WeakPolarHBondContact O-CG 3.31Å; I93-R97 PolarHBondContact O-N 3.1Å
94Q98.3Very high97.9Very high124 Ų12496.9 Ų96.958%0.57948%0.484SS*.Hα-helixtrans-63.4-45.8178.8-72.4179.33.600111.3T90 E91 T96 R97 Y98T90-Q94 WeakPolarHBondContact O-CG 3.35Å; T90-Q94 PolarHBondContact O-N 3.43Å; E91-Q94 PolarHBondContact O-N 3.41Å; E91-Q94 VanDerWaalsContact O-N 3.12Å; Q94-T96 PolarHBondContact O-N 3.48Å; Q94-R97 PolarHBondContact O-N 3.47Å; Q94-Y98 PolarHBondContact O-N 2.87Å
95N98.3Very high98Very high81 Ų81101.3 Ų101.343%0.43350%0.496SS..Hα-helixtrans-60-45.8176.1-77.4-27.1000111.6E91 R97 Y98 Q99E91-N95 WeakPolarHBondContact O-CB 3.34Å; E91-N95 PolarHBondContact O-N 3.37Å; E91-N95 PolarHBondContact O-ND2 3.01Å; N95-R97 PolarHBondContact O-N 3.19Å; N95-Y98 WeakPolarHBondContact O-CB 3.4Å; N95-Y98 PolarHBondContact O-N 2.62Å; N95-Q99 WeakPolarHBondContact O-CG 3.22Å; N95-Q99 PolarHBondContact O-N 3.46Å
96T98.2Very high98.1Very high84 Ų84100 Ų10052%0.51550%0.496SS..Hα-helixtrans-62.4-43.9177.9-580000111.4D92 I93 Q94 Y98 Q99 I100D92-T96 VanDerWaalsContact O-CB 3.31Å; D92-T96 WeakPolarHBondContact O-CB 3.45Å; D92-T96 PolarHBondContact O-N 3.05Å; D92-T96 PolarHBondContact O-OG1 3.39Å; I93-T96 PolarHBondContact O-N 2.76Å; Q94-T96 PolarHBondContact O-N 3.48Å; T96-Y98 VanDerWaalsContact C-N 3.31Å; T96-Y98 PolarHBondContact O-N 3.03Å; T96-Q99 PolarHBondContact O-N 3.31Å; T96-I100 HydrophobicContact CG2-CD1 4.02Å; T96-I100 WeakPolarHBondContact O-CG1 3.47Å; T96-I100 PolarHBondContact O-N 3.38Å
97R98.5Very high98.1Very high176 Ų176100.1 Ų100.166%0.66450%0.497SS*.Hα-helixtrans-60.5-40.8175.4-76.9175.8175.5176.40.1112.2I93 Q94 N95 I100 S101I93-R97 WeakPolarHBondContact O-CB 3.4Å; I93-R97 VanDerWaalsContact O-CG 3.3Å; I93-R97 WeakPolarHBondContact O-CG 3.31Å; I93-R97 PolarHBondContact O-N 3.1Å; Q94-R97 PolarHBondContact O-N 3.47Å; N95-R97 PolarHBondContact O-N 3.19Å; R97-I100 PolarHBondContact O-N 2.96Å; R97-S101 PolarHBondContact O-N 3.44Å
98Y98.3Very high98Very high146 Ų14699.2 Ų99.257%0.57350%0.496SS*.Hα-helixtrans-62.5-46.3175174.4-104.6000111.7Q94 N95 T96 I100 S101 K102Q94-Y98 PolarHBondContact O-N 2.87Å; N95-Y98 WeakPolarHBondContact O-CB 3.4Å; N95-Y98 PolarHBondContact O-N 2.62Å; T96-Y98 VanDerWaalsContact C-N 3.31Å; T96-Y98 PolarHBondContact O-N 3.03Å; Y98-I100 PolarHBondContact O-N 3.09Å; Y98-S101 PolarHBondContact O-N 3.41Å; Y98-K102 WeakPolarHBondContact O-CB 3.29Å; Y98-K102 PolarHBondContact O-N 2.79Å
99Q98.4Very high97.9Very high96 Ų9698.6 Ų98.645%0.44950%0.495SS..Hα-helixtrans-63.8-39.6177.9-65.4-56.3-21.200112.5N95 T96 K102 T103N95-Q99 WeakPolarHBondContact O-CG 3.22Å; N95-Q99 PolarHBondContact O-N 3.46Å; T96-Q99 PolarHBondContact O-N 3.31Å; Q99-K102 PolarHBondContact O-N 3.22Å; Q99-T103 VanDerWaalsContact O-CB 3.32Å; Q99-T103 WeakPolarHBondContact O-CB 3.47Å; Q99-T103 PolarHBondContact O-N 2.97Å; Q99-T103 PolarHBondContact O-OG1 3.28Å
100I98.4Very high97.7Very high101 Ų10196.8 Ų96.852%0.51849%0.489SS..Hα-helixtrans-58.2-53.7173-70.6167.1000109.6T96 R97 Y98 K102 T103 T104T96-I100 HydrophobicContact CG2-CD1 4.02Å; T96-I100 WeakPolarHBondContact O-CG1 3.47Å; T96-I100 PolarHBondContact O-N 3.38Å; R97-I100 PolarHBondContact O-N 2.96Å; Y98-I100 PolarHBondContact O-N 3.09Å; I100-K102 VanDerWaalsContact C-N 3.33Å; I100-K102 PolarHBondContact O-N 3.44Å; I100-T103 PolarHBondContact O-N 3.43Å; I100-T103 VanDerWaalsContact O-N 3.16Å; I100-T104 WeakPolarHBondContact O-CB 3.4Å; I100-T104 PolarHBondContact O-N 3.12Å; I100-T104 PolarHBondContact O-OG1 3.5Å
101S98.3Very high97.5Very high51 Ų5198.4 Ų98.436%0.35749%0.494SS..Hα-helixtrans-58.3-43.7-179.4-177.60000112.6R97 Y98 R105R97-S101 PolarHBondContact O-N 3.44Å; Y98-S101 PolarHBondContact O-N 3.41Å; S101-R105 WeakPolarHBondContact O-CG 3.46Å; S101-R105 PolarHBondContact O-N 3.16Å
102K98.3Very high97.1Very high120 Ų12098.6 Ų98.652%0.52250%0.498SS..Hα-helixtrans-61-46.2176.7-177.4-177.5176-174.10111.7Y98 Q99 I100 R105 A106Y98-K102 WeakPolarHBondContact O-CB 3.29Å; Y98-K102 PolarHBondContact O-N 2.79Å; Q99-K102 PolarHBondContact O-N 3.22Å; I100-K102 VanDerWaalsContact C-N 3.33Å; I100-K102 PolarHBondContact O-N 3.44Å; K102-R105 PolarHBondContact O-N 3.49Å; K102-A106 PolarHBondContact O-N 2.85Å; K102-A106 VanDerWaalsContact O-N 3.12Å
103T98.1Very high96.7Very high90 Ų90103.2 Ų103.255%0.55252%0.515SS*.Hα-helixtrans-69.6-41.6-177.4-55.10000111.2Q99 I100 R105 A106 L107Q99-T103 VanDerWaalsContact O-CB 3.32Å; Q99-T103 WeakPolarHBondContact O-CB 3.47Å; Q99-T103 PolarHBondContact O-N 2.97Å; Q99-T103 PolarHBondContact O-OG1 3.28Å; I100-T103 PolarHBondContact O-N 3.43Å; I100-T103 VanDerWaalsContact O-N 3.16Å; T103-R105 PolarHBondContact O-N 2.89Å; T103-A106 PolarHBondContact O-N 2.76Å; T103-L107 WeakPolarHBondContact O-CB 3.32Å; T103-L107 PolarHBondContact O-N 2.91Å
104T98.1Very high96.2Very high67 Ų67108 Ų10841%0.41153%0.527SS..Hα-helixtrans-60.6-44.9175.4-58.30000111.4I100 A106 L107 D108I100-T104 WeakPolarHBondContact O-CB 3.4Å; I100-T104 PolarHBondContact O-N 3.12Å; I100-T104 PolarHBondContact O-OG1 3.5Å; T104-A106 PolarHBondContact O-N 3.16Å; T104-L107 WeakPolarHBondContact O-CB 3.45Å; T104-L107 PolarHBondContact O-N 3.31Å; T104-D108 VanDerWaalsContact O-CG 3.3Å; T104-D108 PolarHBondContact O-N 3.42Å
105R97.6Very high95.7Very high171 Ų171108 Ų10865%0.64553%0.526SS*.Hα-helixtrans-59.7-45.2175.1-75.4179.6-175.9168.22.8112.5S101 K102 T103 L107 D108 E109S101-R105 WeakPolarHBondContact O-CG 3.46Å; S101-R105 PolarHBondContact O-N 3.16Å; K102-R105 PolarHBondContact O-N 3.49Å; T103-R105 PolarHBondContact O-N 2.89Å; R105-L107 VanDerWaalsContact C-N 3.29Å; R105-L107 PolarHBondContact O-N 3.2Å; R105-D108 PolarHBondContact O-N 3.01Å; R105-E109 WeakPolarHBondContact O-CG 3.43Å; R105-E109 PolarHBondContact O-N 3.29Å
106A97.2Very high95.2Very high55 Ų55110.2 Ų110.246%0.45554%0.537SS..Hα-helixtrans-63.3-37177.800000112.2K102 T103 T104 A110K102-A106 PolarHBondContact O-N 2.85Å; K102-A106 VanDerWaalsContact O-N 3.12Å; T103-A106 PolarHBondContact O-N 2.76Å; T104-A106 PolarHBondContact O-N 3.16Å; A106-A110 WeakPolarHBondContact O-CB 3.38Å; A106-A110 PolarHBondContact O-N 2.93Å
107L96.7Very high94.9Very high99 Ų99109 Ų10952%0.51853%0.53SS..Hα-helixtrans-65-47.5174.6179.963.1000111.2T103 T104 R105 E109 A110 L111T103-L107 WeakPolarHBondContact O-CB 3.32Å; T103-L107 PolarHBondContact O-N 2.91Å; T104-L107 WeakPolarHBondContact O-CB 3.45Å; T104-L107 PolarHBondContact O-N 3.31Å; R105-L107 VanDerWaalsContact C-N 3.29Å; R105-L107 PolarHBondContact O-N 3.2Å; L107-E109 VanDerWaalsContact C-N 3.35Å; L107-E109 PolarHBondContact O-N 3.25Å; L107-A110 PolarHBondContact O-N 3.37Å; L107-A110 VanDerWaalsContact O-N 3.15Å; L107-L111 HydrophobicContact CD1-CD1 4.14Å; L107-L111 HydrophobicContact CD1-CG 4.17Å; L107-L111 HydrophobicContact CG-CD1 3.9Å; L107-L111 HydrophobicContact CG-CG 4.35Å; L107-L111 WeakPolarHBondContact O-CB 3.39Å; L107-L111 VanDerWaalsContact O-CG 3.31Å; L107-L111 WeakPolarHBondContact O-CG 3.37Å; L107-L111 PolarHBondContact O-N 3.45Å
108D95.9Very high94.7Very high83 Ų83109.1 Ų109.144%0.44454%0.538SS..Hα-helixtrans-61.1-43.2179-68.1-24.3000111.5T104 R105 A110 L111 L112T104-D108 VanDerWaalsContact O-CG 3.3Å; T104-D108 PolarHBondContact O-N 3.42Å; R105-D108 PolarHBondContact O-N 3.01Å; D108-A110 VanDerWaalsContact C-N 3.34Å; D108-A110 PolarHBondContact O-N 3.27Å; D108-L111 PolarHBondContact O-N 3.48Å; D108-L112 WeakPolarHBondContact O-CB 3.31Å; D108-L112 WeakPolarHBondContact O-CG 3.44Å; D108-L112 PolarHBondContact O-N 2.86Å
109E96.2Very high94.5Very high114 Ų114108.4 Ų108.453%0.53354%0.54SS..Hα-helixtrans-61.3-40.2174.1-74.6178-164.700112.5R105 L107 K113R105-E109 WeakPolarHBondContact O-CG 3.43Å; R105-E109 PolarHBondContact O-N 3.29Å; L107-E109 VanDerWaalsContact C-N 3.35Å; L107-E109 PolarHBondContact O-N 3.25Å; E109-K113 WeakPolarHBondContact O-CG 3.44Å; E109-K113 PolarHBondContact O-N 3.06Å
110A94.2Very high94.3Very high44 Ų44108.3 Ų108.336%0.36454%0.536SS..Hα-helixtrans-69.2-41.4177.800000111.9A106 L107 D108 K113 R114A106-A110 WeakPolarHBondContact O-CB 3.38Å; A106-A110 PolarHBondContact O-N 2.93Å; L107-A110 PolarHBondContact O-N 3.37Å; L107-A110 VanDerWaalsContact O-N 3.15Å; D108-A110 VanDerWaalsContact C-N 3.34Å; D108-A110 PolarHBondContact O-N 3.27Å; A110-K113 PolarHBondContact O-N 3.15Å; A110-R114 WeakPolarHBondContact O-CB 3.46Å; A110-R114 PolarHBondContact O-N 2.93Å
111L92.6Very high94.1Very high98 Ų98106.5 Ų106.551%0.51353%0.527SS..Hα-helixtrans-66-37.3177.2-72.1173.4000111.8L107 D108 K113 R114 K115L107-L111 HydrophobicContact CD1-CD1 4.14Å; L107-L111 HydrophobicContact CD1-CG 4.17Å; L107-L111 HydrophobicContact CG-CD1 3.9Å; L107-L111 HydrophobicContact CG-CG 4.35Å; L107-L111 WeakPolarHBondContact O-CB 3.39Å; L107-L111 VanDerWaalsContact O-CG 3.31Å; L107-L111 WeakPolarHBondContact O-CG 3.37Å; L107-L111 PolarHBondContact O-N 3.45Å; D108-L111 PolarHBondContact O-N 3.48Å; L111-K113 VanDerWaalsContact C-N 3.34Å; L111-K113 PolarHBondContact O-N 2.9Å; L111-R114 CarbonylContact O-C 3.35Å; L111-R114 PolarHBondContact O-N 3.36Å; L111-K115 WeakPolarHBondContact O-CG 3.41Å; L111-K115 PolarHBondContact O-N 3.3Å; L111-K115 VanDerWaalsContact O-N 3.14Å
112L90.9Very high94Very high118 Ų118111.5 Ų111.562%0.61854%0.538SS*.Hα-helixtrans-62.7-39.3173.6-81164.8000112.5D108D108-L112 WeakPolarHBondContact O-CB 3.31Å; D108-L112 WeakPolarHBondContact O-CG 3.44Å; D108-L112 PolarHBondContact O-N 2.86Å
113K90.3Very high93.9Very high171 Ų171109.3 Ų109.374%0.74353%0.534SS*.Hα-helixtrans-77-26.6177.7-69.4173.1-175.2172.20113.2E109 A110 L111E109-K113 WeakPolarHBondContact O-CG 3.44Å; E109-K113 PolarHBondContact O-N 3.06Å; A110-K113 PolarHBondContact O-N 3.15Å; L111-K113 VanDerWaalsContact C-N 3.34Å; L111-K113 PolarHBondContact O-N 2.9Å
114R88.2Confident93.8Very high178 Ų178108.2 Ų108.267%0.67253%0.525SS*.THydrogen-bonded Turntrans-123.349.7-174.8-62-178.2176.1-179.1-0.6111.2A110 L111 D116A110-R114 WeakPolarHBondContact O-CB 3.46Å; A110-R114 PolarHBondContact O-N 2.93Å; L111-R114 CarbonylContact O-C 3.35Å; L111-R114 PolarHBondContact O-N 3.36Å; R114-D116 PolarHBondContact O-N 3.14Å
115K87.6Confident93.8Very high126 Ų126109.6 Ų109.655%0.54853%0.53SS..  trans-56.4130.8178.5-72.8-175.8179.4-178.10110.3L111 T117 R120L111-K115 WeakPolarHBondContact O-CG 3.41Å; L111-K115 PolarHBondContact O-N 3.3Å; L111-K115 VanDerWaalsContact O-N 3.14Å; K115-T117 HydrophobicContact CB-CG2 4Å; K115-T117 PolarHBondContact O-N 3.26Å; K115-T117 VanDerWaalsContact O-N 3.08Å; K115-R120 WeakPolarHBondContact O-CD 3.49Å
116D87.6Confident93.8Very high126 Ų126106.2 Ų106.267%0.67452%0.521SS*.  trans-72.8101.2172.5-164.410000108.3R114 N121R114-D116 PolarHBondContact O-N 3.14Å; D116-N121 PolarHBondContact OD1-ND2 3.09Å; D116-N121 PolarHBondContact OD1-OD1 3.47Å
117T92.1Very high93.8Very high60 Ų60108.1 Ų108.137%0.36852%0.523SS..  trans-128.3149.7-177.252.90000107.7K115 E119 R120 N121K115-T117 HydrophobicContact CB-CG2 4Å; K115-T117 PolarHBondContact O-N 3.26Å; K115-T117 VanDerWaalsContact O-N 3.08Å; T117-E119 PolarHBondContact O-N 3.25Å; T117-R120 PolarHBondContact O-N 3.32Å; T117-R120 VanDerWaalsContact O-N 3.09Å; T117-R120 VanDerWaalsContact OG1-CB 3.28Å; T117-R120 WeakPolarHBondContact OG1-CB 3.28Å; T117-R120 PolarHBondContact OG1-N 3.08Å; T117-N121 PolarHBondContact O-N 3.27Å; T117-N121 PolarHBondContact O-ND2 3.39Å
118E93.9Very high93.9Very high178 Ų178106.9 Ų106.983%0.83252%0.52SS*.Hα-helixtrans-56.2-38175.9-69.1-177.2168.300111.7N121 R122E118-N121 PolarHBondContact O-N 2.86Å; E118-R122 WeakPolarHBondContact O-CB 3.19Å; E118-R122 PolarHBondContact O-N 2.85Å
119E94Very high94Very high130 Ų130109.1 Ų109.161%0.60753%0.527SS*.Hα-helixtrans-60.5-47.4175.3-174.7178.1-167.600112T117 N121 R122 V123T117-E119 PolarHBondContact O-N 3.25Å; E119-N121 VanDerWaalsContact C-N 3.31Å; E119-N121 PolarHBondContact O-N 3.42Å; E119-R122 WeakPolarHBondContact O-CB 3.34Å; E119-R122 PolarHBondContact O-N 2.89Å; E119-V123 WeakPolarHBondContact O-CG2 3.23Å; E119-V123 PolarHBondContact O-N 3.43Å
120R93.1Very high94.1Very high95 Ų95108.6 Ų108.636%0.35853%0.525SS..Hα-helixtrans-59.8-44.3176.6177.6178.8175.2-109.9-5.7111.2K115 T117 R122 V123 I124K115-R120 WeakPolarHBondContact O-CD 3.49Å; T117-R120 PolarHBondContact O-N 3.32Å; T117-R120 VanDerWaalsContact O-N 3.09Å; T117-R120 VanDerWaalsContact OG1-CB 3.28Å; T117-R120 WeakPolarHBondContact OG1-CB 3.28Å; T117-R120 PolarHBondContact OG1-N 3.08Å; R120-R122 VanDerWaalsContact C-N 3.34Å; R120-V123 PolarHBondContact O-N 3Å; R120-I124 HydrophobicContact CG-CD1 3.79Å; R120-I124 HydrophobicContact CG-CG1 4.42Å; R120-I124 WeakPolarHBondContact O-CB 3.26Å; R120-I124 VanDerWaalsContact O-CG1 3.26Å; R120-I124 WeakPolarHBondContact O-CG1 3.48Å; R120-I124 PolarHBondContact O-N 2.92Å
121N94.7Very high94.3Very high63 Ų63112.8 Ų112.834%0.33754%0.535SS..Hα-helixtrans-66-39.2-179.9-68.4-26.1000111.3D116 T117 E118 E119 I124 N125D116-N121 PolarHBondContact OD1-ND2 3.09Å; D116-N121 PolarHBondContact OD1-OD1 3.47Å; T117-N121 PolarHBondContact O-N 3.27Å; T117-N121 PolarHBondContact O-ND2 3.39Å; E118-N121 PolarHBondContact O-N 2.86Å; E119-N121 VanDerWaalsContact C-N 3.31Å; E119-N121 PolarHBondContact O-N 3.42Å; N121-I124 PolarHBondContact O-N 3.31Å; N121-N125 VanDerWaalsContact O-CG 3.23Å; N121-N125 PolarHBondContact O-N 3.02Å; N121-N125 PolarHBondContact O-ND2 2.91Å
122R96.4Very high94.6Very high156 Ų156113.1 Ų113.159%0.58954%0.537SS*.Hα-helixtrans-59.7-49.2172-170.6-173.971.3-163.7-2.8111.8E118 E119 R120 I124 N125 E126E118-R122 WeakPolarHBondContact O-CB 3.19Å; E118-R122 PolarHBondContact O-N 2.85Å; E119-R122 WeakPolarHBondContact O-CB 3.34Å; E119-R122 PolarHBondContact O-N 2.89Å; R120-R122 VanDerWaalsContact C-N 3.34Å; R122-I124 VanDerWaalsContact C-N 3.32Å; R122-I124 PolarHBondContact O-N 2.87Å; R122-N125 PolarHBondContact O-N 3.22Å; R122-E126 WeakPolarHBondContact O-CB 3.43Å; R122-E126 PolarHBondContact O-N 3.42Å
123V96.4Very high94.9Very high73 Ų73111.4 Ų111.444%0.44253%0.528SS..Hα-helixtrans-63.8-37.1179.81730000111.6E119 R120 L127E119-V123 WeakPolarHBondContact O-CG2 3.23Å; E119-V123 PolarHBondContact O-N 3.43Å; R120-V123 PolarHBondContact O-N 3Å; V123-L127 VanDerWaalsContact O-CB 3.23Å; V123-L127 WeakPolarHBondContact O-CB 3.45Å; V123-L127 PolarHBondContact O-N 3.39Å
124I96.6Very high95.3Very high67 Ų67109.1 Ų109.134%0.34452%0.523SS..Hα-helixtrans-65.1-42.7175.5-72.3169.5000111R120 N121 R122 T128R120-I124 HydrophobicContact CG-CD1 3.79Å; R120-I124 HydrophobicContact CG-CG1 4.42Å; R120-I124 WeakPolarHBondContact O-CB 3.26Å; R120-I124 VanDerWaalsContact O-CG1 3.26Å; R120-I124 WeakPolarHBondContact O-CG1 3.48Å; R120-I124 PolarHBondContact O-N 2.92Å; N121-I124 PolarHBondContact O-N 3.31Å; R122-I124 VanDerWaalsContact C-N 3.32Å; R122-I124 PolarHBondContact O-N 2.87Å; I124-T128 PolarHBondContact O-N 3.4Å; I124-T128 PolarHBondContact O-OG1 2.87Å
125N97.1Very high95.7Very high97 Ų97106.9 Ų106.952%0.51952%0.52SS..Hα-helixtrans-66.2-47.2177.5-69.1-14.3000111N121 R122 L127 T128 E129N121-N125 VanDerWaalsContact O-CG 3.23Å; N121-N125 PolarHBondContact O-N 3.02Å; N121-N125 PolarHBondContact O-ND2 2.91Å; R122-N125 PolarHBondContact O-N 3.22Å; N125-L127 VanDerWaalsContact C-N 3.34Å; N125-L127 PolarHBondContact O-N 3.07Å; N125-T128 WeakPolarHBondContact O-CA 3.42Å; N125-T128 WeakPolarHBondContact O-CB 3.24Å; N125-T128 PolarHBondContact O-N 3.27Å; N125-E129 WeakPolarHBondContact O-CG 3.41Å; N125-E129 PolarHBondContact O-N 3.3Å
126E97.8Very high96.2Very high99 Ų99103.9 Ų103.946%0.46352%0.515SS..Hα-helixtrans-59.3-44176.6-175.3176.6-171.900111.6R122 T128 E129 Q130R122-E126 WeakPolarHBondContact O-CB 3.43Å; R122-E126 PolarHBondContact O-N 3.42Å; E126-T128 PolarHBondContact O-N 2.91Å; E126-E129 PolarHBondContact O-N 3.01Å; E126-Q130 HydrophobicContact CG-CG 4.37Å; E126-Q130 WeakPolarHBondContact O-CB 3.5Å; E126-Q130 VanDerWaalsContact O-CG 3.24Å; E126-Q130 WeakPolarHBondContact O-CG 3.45Å; E126-Q130 PolarHBondContact O-N 2.79Å
127L98.1Very high96.7Very high95 Ų95101.6 Ų101.650%0.49750%0.503SS..Hα-helixtrans-59.4-37.2174.617964.3000111.9V123 N125 K131V123-L127 VanDerWaalsContact O-CB 3.23Å; V123-L127 WeakPolarHBondContact O-CB 3.45Å; V123-L127 PolarHBondContact O-N 3.39Å; N125-L127 VanDerWaalsContact C-N 3.34Å; N125-L127 PolarHBondContact O-N 3.07Å; L127-K131 WeakPolarHBondContact O-CB 3.33Å; L127-K131 VanDerWaalsContact O-CG 3.28Å; L127-K131 WeakPolarHBondContact O-CG 3.34Å; L127-K131 PolarHBondContact O-N 2.9Å; L127-K131 VanDerWaalsContact O-N 3.08Å
128T98Very high96.9Very high73 Ų73102.1 Ų102.145%0.44851%0.509SS..Hα-helixtrans-69.2-45.5178.9-56.70000110.7I124 N125 E126 K131 L132I124-T128 PolarHBondContact O-N 3.4Å; I124-T128 PolarHBondContact O-OG1 2.87Å; N125-T128 WeakPolarHBondContact O-CA 3.42Å; N125-T128 WeakPolarHBondContact O-CB 3.24Å; N125-T128 PolarHBondContact O-N 3.27Å; E126-T128 PolarHBondContact O-N 2.91Å; T128-K131 PolarHBondContact O-N 3.13Å; T128-L132 WeakPolarHBondContact O-CG 3.45Å; T128-L132 PolarHBondContact O-N 3.4Å; T128-L132 VanDerWaalsContact O-N 3.13Å
129E98.1Very high97.1Very high130 Ų13097.2 Ų97.261%0.60749%0.491SS*.Hα-helixtrans-60.8-46.2175.6-70.5175.2-178.800111.9N125 E126 K131 L132 L133N125-E129 WeakPolarHBondContact O-CG 3.41Å; N125-E129 PolarHBondContact O-N 3.3Å; E126-E129 PolarHBondContact O-N 3.01Å; E129-K131 VanDerWaalsContact C-N 3.32Å; E129-K131 PolarHBondContact O-N 2.95Å; E129-L132 PolarHBondContact O-N 3.34Å; E129-L133 PolarHBondContact O-N 3.5Å
130Q98.2Very high97.2Very high104 Ų10496.1 Ų96.149%0.48649%0.486SS..Hα-helixtrans-64-36.1178.8-69.6-64.1-22.500112.5E126 L133 L134E126-Q130 HydrophobicContact CG-CG 4.37Å; E126-Q130 WeakPolarHBondContact O-CB 3.5Å; E126-Q130 VanDerWaalsContact O-CG 3.24Å; E126-Q130 WeakPolarHBondContact O-CG 3.45Å; E126-Q130 PolarHBondContact O-N 2.79Å; Q130-L133 PolarHBondContact O-N 3.08Å; Q130-L134 WeakPolarHBondContact O-CB 3.28Å; Q130-L134 PolarHBondContact O-N 3.45Å
131K98.3Very high97.3Very high131 Ų13197.5 Ų97.557%0.5750%0.499SS*.Hα-helixtrans-64.8-43.3174.6-80.8178.5176.5-174.40112.1L127 T128 E129 L133 L134 E135L127-K131 WeakPolarHBondContact O-CB 3.33Å; L127-K131 VanDerWaalsContact O-CG 3.28Å; L127-K131 WeakPolarHBondContact O-CG 3.34Å; L127-K131 PolarHBondContact O-N 2.9Å; L127-K131 VanDerWaalsContact O-N 3.08Å; T128-K131 PolarHBondContact O-N 3.13Å; E129-K131 VanDerWaalsContact C-N 3.32Å; E129-K131 PolarHBondContact O-N 2.95Å; K131-L133 VanDerWaalsContact C-N 3.34Å; K131-L134 PolarHBondContact O-N 3.33Å; K131-E135 PolarHBondContact O-N 3.44Å
132L98Very high97.2Very high106 Ų106101.3 Ų101.356%0.55552%0.515SS*.Hα-helixtrans-64-41.8176.9-70.9169.2000111.2T128 E129 E135 S136T128-L132 WeakPolarHBondContact O-CG 3.45Å; T128-L132 PolarHBondContact O-N 3.4Å; T128-L132 VanDerWaalsContact O-N 3.13Å; E129-L132 PolarHBondContact O-N 3.34Å; L132-E135 PolarHBondContact O-N 3.32Å; L132-S136 PolarHBondContact O-N 3.49Å; L132-S136 PolarHBondContact O-OG 3.23Å
133L97.9Very high97Very high82 Ų8298.5 Ų98.543%0.42951%0.512SS..Hα-helixtrans-64-42.4176-178.762.3000112.1E129 Q130 K131 E135 S136 L137E129-L133 PolarHBondContact O-N 3.5Å; Q130-L133 PolarHBondContact O-N 3.08Å; K131-L133 VanDerWaalsContact C-N 3.34Å; L133-E135 VanDerWaalsContact C-N 3.3Å; L133-E135 PolarHBondContact O-N 3.01Å; L133-S136 PolarHBondContact O-N 3.38Å; L133-S136 PolarHBondContact O-OG 3.3Å; L133-L137 HydrophobicContact CD1-CD1 4.18Å; L133-L137 HydrophobicContact CD1-CG 4.23Å; L133-L137 HydrophobicContact CG-CD1 3.97Å; L133-L137 HydrophobicContact CG-CG 4.44Å; L133-L137 WeakPolarHBondContact O-CB 3.44Å; L133-L137 VanDerWaalsContact O-CG 3.31Å; L133-L137 WeakPolarHBondContact O-CG 3.41Å; L133-L137 PolarHBondContact O-N 2.91Å
134L98.1Very high96.8Very high123 Ų12399.2 Ų99.264%0.64451%0.513SS*.Hα-helixtrans-60.7-42.5176.1-178.367.4000111.2Q130 K131 L137 S138Q130-L134 WeakPolarHBondContact O-CB 3.28Å; Q130-L134 PolarHBondContact O-N 3.45Å; K131-L134 PolarHBondContact O-N 3.33Å; L134-L137 PolarHBondContact O-N 2.99Å; L134-S138 VanDerWaalsContact O-CB 3.31Å; L134-S138 WeakPolarHBondContact O-CB 3.31Å; L134-S138 PolarHBondContact O-N 2.85Å
135E98Very high96.4Very high130 Ų130103.9 Ų103.961%0.60753%0.531SS*.Hα-helixtrans-62.6-46.4176.9-172.8171.9-16700111.3K131 L132 L133 L137 S138 V139K131-E135 PolarHBondContact O-N 3.44Å; L132-E135 PolarHBondContact O-N 3.32Å; L133-E135 VanDerWaalsContact C-N 3.3Å; L133-E135 PolarHBondContact O-N 3.01Å; E135-L137 PolarHBondContact O-N 3.5Å; E135-S138 PolarHBondContact O-N 3.34Å; E135-V139 WeakPolarHBondContact O-CG2 3.31Å; E135-V139 PolarHBondContact O-N 3.31Å; E135-V139 VanDerWaalsContact O-N 3.09Å
136S97.8Very high95.7Very high64 Ų64105.9 Ų105.945%0.44854%0.535SS..Hα-helixtrans-63.3-43177.963.60000112.6L132 L133 S138 V139 E140L132-S136 PolarHBondContact O-N 3.49Å; L132-S136 PolarHBondContact O-OG 3.23Å; L133-S136 PolarHBondContact O-N 3.38Å; L133-S136 PolarHBondContact O-OG 3.3Å; S136-S138 VanDerWaalsContact C-N 3.34Å; S136-S138 PolarHBondContact O-N 3.47Å; S136-V139 PolarHBondContact O-N 2.88Å; S136-E140 PolarHBondContact O-N 2.93Å
137L97.6Very high95.2Very high78 Ų78107.4 Ų107.441%0.40854%0.537SS..Hα-helixtrans-66.5-36.7178-72.7172.4000111.8L133 L134 E135 V139 E140 L141L133-L137 HydrophobicContact CD1-CD1 4.18Å; L133-L137 HydrophobicContact CD1-CG 4.23Å; L133-L137 HydrophobicContact CG-CD1 3.97Å; L133-L137 HydrophobicContact CG-CG 4.44Å; L133-L137 WeakPolarHBondContact O-CB 3.44Å; L133-L137 VanDerWaalsContact O-CG 3.31Å; L133-L137 WeakPolarHBondContact O-CG 3.41Å; L133-L137 PolarHBondContact O-N 2.91Å; L134-L137 PolarHBondContact O-N 2.99Å; E135-L137 PolarHBondContact O-N 3.5Å; L137-V139 VanDerWaalsContact C-N 3.34Å; L137-E140 PolarHBondContact O-N 3.09Å; L137-L141 WeakPolarHBondContact O-CB 3.38Å; L137-L141 WeakPolarHBondContact O-CG 3.34Å; L137-L141 PolarHBondContact O-N 3.02Å
138S97.3Very high94.8Very high70 Ų70106.1 Ų106.149%0.4953%0.531SS..Hα-helixtrans-62.1-42.9175.2-177.90000111.6L134 E135 S136 Q142L134-S138 VanDerWaalsContact O-CB 3.31Å; L134-S138 WeakPolarHBondContact O-CB 3.31Å; L134-S138 PolarHBondContact O-N 2.85Å; E135-S138 PolarHBondContact O-N 3.34Å; S136-S138 VanDerWaalsContact C-N 3.34Å; S136-S138 PolarHBondContact O-N 3.47Å; S138-Q142 PolarHBondContact O-N 2.96Å
139V96.8Very high94.6Very high76 Ų76107.2 Ų107.246%0.46154%0.539SS..Hα-helixtrans-65.3-43.4176.1172.50000110.8E135 S136 L137 Q142 N143E135-V139 WeakPolarHBondContact O-CG2 3.31Å; E135-V139 PolarHBondContact O-N 3.31Å; E135-V139 VanDerWaalsContact O-N 3.09Å; S136-V139 PolarHBondContact O-N 2.88Å; L137-V139 VanDerWaalsContact C-N 3.34Å; V139-Q142 PolarHBondContact O-N 3.39Å; V139-N143 PolarHBondContact O-N 3.27Å; V139-N143 PolarHBondContact O-ND2 3.07Å
140E96.2Very high94.3Very high107 Ų107107 Ų10750%0.554%0.542SS..Hα-helixtrans-61-46.9176.8-171.7176.4-174.700111.7S136 L137 Q142 N143 L144S136-E140 PolarHBondContact O-N 2.93Å; L137-E140 PolarHBondContact O-N 3.09Å; E140-Q142 VanDerWaalsContact C-N 3.3Å; E140-Q142 PolarHBondContact O-N 2.98Å; E140-N143 WeakPolarHBondContact O-CB 3.46Å; E140-N143 PolarHBondContact O-N 3.48Å; E140-N143 VanDerWaalsContact O-N 3.12Å; E140-L144 HydrophobicContact CG-CD1 4.14Å; E140-L144 WeakPolarHBondContact O-CG 3.37Å; E140-L144 PolarHBondContact O-N 3.37Å
141L94.8Very high93.9Very high123 Ų123107.3 Ų107.364%0.64454%0.539SS*.Hα-helixtrans-58.9-41.2175.4-78.4172000112.2L137 N143 L144 K145L137-L141 WeakPolarHBondContact O-CB 3.38Å; L137-L141 WeakPolarHBondContact O-CG 3.34Å; L137-L141 PolarHBondContact O-N 3.02Å; L141-N143 VanDerWaalsContact C-N 3.33Å; L141-N143 PolarHBondContact O-N 3.28Å; L141-L144 PolarHBondContact O-N 3.12Å; L141-K145 PolarHBondContact O-N 2.89Å
142Q93.5Very high93.6Very high143 Ų143104.7 Ų104.767%0.66853%0.531SS*.Hα-helixtrans-63.3-41.2176.2-174175.6-1.800111.6S138 V139 E140 L144 K145S138-Q142 PolarHBondContact O-N 2.96Å; V139-Q142 PolarHBondContact O-N 3.39Å; E140-Q142 VanDerWaalsContact C-N 3.3Å; E140-Q142 PolarHBondContact O-N 2.98Å; Q142-L144 VanDerWaalsContact C-N 3.33Å; Q142-K145 WeakPolarHBondContact O-CB 3.32Å; Q142-K145 PolarHBondContact O-N 3.13Å
143N92Very high93.4Very high97 Ų97104.2 Ų104.252%0.51953%0.528SS..Hα-helixtrans-66.6-34.2176-74.9-30.7000112.5V139 E140 L141 K145 K146V139-N143 PolarHBondContact O-N 3.27Å; V139-N143 PolarHBondContact O-ND2 3.07Å; E140-N143 WeakPolarHBondContact O-CB 3.46Å; E140-N143 PolarHBondContact O-N 3.48Å; E140-N143 VanDerWaalsContact O-N 3.12Å; L141-N143 VanDerWaalsContact C-N 3.33Å; L141-N143 PolarHBondContact O-N 3.28Å; N143-K145 VanDerWaalsContact C-N 3.32Å; N143-K146 WeakPolarHBondContact O-CE 3.34Å; N143-K146 WeakPolarHBondContact O-CG 3.48Å
144L92.2Very high93.2Very high88 Ų88104.1 Ų104.146%0.46153%0.525SS..Hα-helixtrans-75.8-19.8178.2-70.6173.9000113.1E140 L141 Q142 K146 Y147E140-L144 HydrophobicContact CG-CD1 4.14Å; E140-L144 WeakPolarHBondContact O-CG 3.37Å; E140-L144 PolarHBondContact O-N 3.37Å; L141-L144 PolarHBondContact O-N 3.12Å; Q142-L144 VanDerWaalsContact C-N 3.33Å; L144-K146 PolarHBondContact O-N 3.43Å; L144-Y147 HydrophobicContact CD2-CD2 4.12Å; L144-Y147 WeakPolarHBondContact O-CB 3.36Å; L144-Y147 PolarHBondContact O-N 3.35Å
145K88.3Confident93Very high166 Ų166101.9 Ų101.972%0.72251%0.514SS*.G310 helixtrans-57-25.1179.3-164.2175.8-178.1178.50114L141 Q142 N143 Y147 D148L141-K145 PolarHBondContact O-N 2.89Å; Q142-K145 WeakPolarHBondContact O-CB 3.32Å; Q142-K145 PolarHBondContact O-N 3.13Å; N143-K145 VanDerWaalsContact C-N 3.32Å; K145-Y147 PolarHBondContact O-N 3.06Å; K145-D148 PolarHBondContact O-N 3.26Å
146K82.4Confident92.8Very high139 Ų139102.4 Ų102.460%0.60451%0.514SS*.G310 helixtrans-69.9-15.4174.470.4-172.1158.5159.90113.9N143 L144N143-K146 WeakPolarHBondContact O-CE 3.34Å; N143-K146 WeakPolarHBondContact O-CG 3.48Å; L144-K146 PolarHBondContact O-N 3.43Å
147Y87.6Confident92.7Very high130 Ų130105.1 Ų105.151%0.5152%0.52SS..G310 helixtrans-103.330.1177.9-54.3-66.2000111.8L144 K145 P149L144-Y147 HydrophobicContact CD2-CD2 4.12Å; L144-Y147 WeakPolarHBondContact O-CB 3.36Å; L144-Y147 PolarHBondContact O-N 3.35Å; K145-Y147 PolarHBondContact O-N 3.06Å; Y147-P149 WeakPolarHBondContact O-CD 3.45Å
148D90.1Very high92.6Very high69 Ų69105.8 Ų105.837%0.36952%0.521SS..  trans-55.9118.7175.7-172.8-26.2000110.1K145 D150 R151 L152K145-D148 PolarHBondContact O-N 3.26Å; D148-D150 VanDerWaalsContact C-N 3.25Å; D148-D150 PolarHBondContact O-N 3.34Å; D148-D150 PolarHBondContact OD1-N 2.7Å; D148-R151 HydrophobicContact CB-CB 4.01Å; D148-R151 PolarHBondContact O-N 3.27Å; D148-R151 VanDerWaalsContact O-N 3.13Å; D148-L152 WeakPolarHBondContact O-CG 3.13Å; D148-L152 PolarHBondContact O-N 3.35Å
149P92.9Very high92.5Very high95 Ų95108.2 Ų108.262%0.61752%0.524SS*.Hα-helixtrans-55.1-38.8-177.7-26.735.1000113.6Y147 L152 L153Y147-P149 WeakPolarHBondContact O-CD 3.45Å; P149-L152 PolarHBondContact O-N 2.9Å; P149-L153 WeakPolarHBondContact O-CB 3.32Å; P149-L153 PolarHBondContact O-N 2.91Å
150D91.6Very high92.5Very high126 Ų126109.5 Ų109.567%0.67453%0.532SS*.Hα-helixtrans-68.5-40.5-178.6-70.8-23000110.2D148 L153 E154D148-D150 VanDerWaalsContact C-N 3.25Å; D148-D150 PolarHBondContact O-N 3.34Å; D148-D150 PolarHBondContact OD1-N 2.7Å; D150-L153 PolarHBondContact O-N 3.34Å; D150-E154 WeakPolarHBondContact O-CB 3.4Å; D150-E154 PolarHBondContact O-N 3.13Å
151R89.3Confident92.4Very high111 Ų111108.7 Ų108.742%0.41953%0.534SS..Hα-helixtrans-66.9-39.6175.1-176.756.9-178.1170.65.2112.1D148 L153 E154 L155D148-R151 HydrophobicContact CB-CB 4.01Å; D148-R151 PolarHBondContact O-N 3.27Å; D148-R151 VanDerWaalsContact O-N 3.13Å; R151-L153 VanDerWaalsContact C-N 3.32Å; R151-E154 WeakPolarHBondContact CD-OE2 3.36Å; R151-E154 IonicContact CZ-OE2 3.73Å; R151-E154 IonicContact NH1-OE1 3.27Å; R151-E154 PolarHBondContact NH1-OE1 3.43Å; R151-E154 IonicContact NH1-OE2 2.7Å; R151-E154 PolarHBondContact NH1-OE2 3.42Å; R151-E154 PolarHBondContact O-N 3.06Å; R151-L155 HydrophobicContact CG-CD1 4.35Å; R151-L155 WeakPolarHBondContact O-CB 3.5Å; R151-L155 WeakPolarHBondContact O-CG 3.46Å; R151-L155 PolarHBondContact O-N 3.03Å
152L93Very high92.5Very high76 Ų76105.3 Ų105.340%0.39852%0.524SS..Hα-helixtrans-64.8-38176-69.8177.2000111.5D148 P149 L155 K156D148-L152 WeakPolarHBondContact O-CG 3.13Å; D148-L152 PolarHBondContact O-N 3.35Å; P149-L152 PolarHBondContact O-N 2.9Å; L152-L155 PolarHBondContact O-N 3.28Å; L152-K156 WeakPolarHBondContact O-CG 3.43Å; L152-K156 PolarHBondContact O-N 3.04Å
153L94.1Very high92.7Very high96 Ų9699.9 Ų99.950%0.50350%0.5SS..Hα-helixtrans-68.4-42.2176.1-170.7147000111.4P149 D150 R151 K156 Q157P149-L153 WeakPolarHBondContact O-CB 3.32Å; P149-L153 PolarHBondContact O-N 2.91Å; D150-L153 PolarHBondContact O-N 3.34Å; R151-L153 VanDerWaalsContact C-N 3.32Å; L153-K156 PolarHBondContact O-N 2.9Å; L153-Q157 HydrophobicContact CD2-CG 4.41Å; L153-Q157 VanDerWaalsContact CD2-NE2 3.33Å; L153-Q157 WeakPolarHBondContact O-CG 3.42Å; L153-Q157 PolarHBondContact O-N 2.87Å
154E94Very high92.9Very high79 Ų79100.2 Ų100.237%0.36950%0.502SS..Hα-helixtrans-59.8-45.4173.4-168.7-166.2171.700111.5D150 R151 K156 Q157 Q158D150-E154 WeakPolarHBondContact O-CB 3.4Å; D150-E154 PolarHBondContact O-N 3.13Å; R151-E154 WeakPolarHBondContact CD-OE2 3.36Å; R151-E154 IonicContact CZ-OE2 3.73Å; R151-E154 IonicContact NH1-OE1 3.27Å; R151-E154 PolarHBondContact NH1-OE1 3.43Å; R151-E154 IonicContact NH1-OE2 2.7Å; R151-E154 PolarHBondContact NH1-OE2 3.42Å; R151-E154 PolarHBondContact O-N 3.06Å; E154-K156 VanDerWaalsContact C-N 3.33Å; E154-K156 PolarHBondContact O-N 3.49Å; E154-Q157 PolarHBondContact O-N 2.93Å; E154-Q158 WeakPolarHBondContact O-CG 3.48Å; E154-Q158 PolarHBondContact O-N 3.18Å; E154-Q158 PolarHBondContact OE1-NE2 2.92Å; E154-Q158 VanDerWaalsContact OE1-NE2 3.13Å
155L93.3Very high93.1Very high76 Ų7697.9 Ų97.940%0.39849%0.494SS..Hα-helixtrans-61.2-40.1176.5-76.2171.6000112.2R151 L152 Q158 E159R151-L155 HydrophobicContact CG-CD1 4.35Å; R151-L155 WeakPolarHBondContact O-CB 3.5Å; R151-L155 WeakPolarHBondContact O-CG 3.46Å; R151-L155 PolarHBondContact O-N 3.03Å; L152-L155 PolarHBondContact O-N 3.28Å; L155-Q158 PolarHBondContact O-N 3.15Å; L155-E159 WeakPolarHBondContact O-CB 3.32Å; L155-E159 PolarHBondContact O-N 3.43Å
156K94.5Very high93.5Very high141 Ų14193.1 Ų93.161%0.61348%0.478SS*.Hα-helixtrans-63.7-38.6174.1-77.5-178.7175.9-175.30112.7L152 L153 E154 E159 V160L152-K156 WeakPolarHBondContact O-CG 3.43Å; L152-K156 PolarHBondContact O-N 3.04Å; L153-K156 PolarHBondContact O-N 2.9Å; E154-K156 VanDerWaalsContact C-N 3.33Å; E154-K156 PolarHBondContact O-N 3.49Å; K156-E159 WeakPolarHBondContact O-CB 3.43Å; K156-E159 PolarHBondContact O-N 2.85Å; K156-V160 WeakPolarHBondContact O-CG2 3.48Å; K156-V160 PolarHBondContact O-N 3.3Å; K156-V160 VanDerWaalsContact O-N 3.15Å
157Q94.8Very high94.2Very high122 Ų12288 Ų8857%0.5746%0.457SS*.Hα-helixtrans-67-40.9175.1-70.7177.6-3.600111.3L153 E154 E159 V160 V161L153-Q157 HydrophobicContact CD2-CG 4.41Å; L153-Q157 VanDerWaalsContact CD2-NE2 3.33Å; L153-Q157 WeakPolarHBondContact O-CG 3.42Å; L153-Q157 PolarHBondContact O-N 2.87Å; E154-Q157 PolarHBondContact O-N 2.93Å; Q157-E159 VanDerWaalsContact C-N 3.33Å; Q157-V160 PolarHBondContact O-N 3.14Å; Q157-V161 WeakPolarHBondContact O-CG2 3.49Å; Q157-V161 PolarHBondContact O-N 3Å; Q157-V161 VanDerWaalsContact O-N 3.14Å
158Q95.8Very high94.6Very high91 Ų9188.3 Ų88.343%0.42546%0.457SS..Hα-helixtrans-63.4-38.7175-70.9175.1600111.9E154 L155 V161 A162E154-Q158 WeakPolarHBondContact O-CG 3.48Å; E154-Q158 PolarHBondContact O-N 3.18Å; E154-Q158 PolarHBondContact OE1-NE2 2.92Å; E154-Q158 VanDerWaalsContact OE1-NE2 3.13Å; L155-Q158 PolarHBondContact O-N 3.15Å; Q158-V161 PolarHBondContact O-N 3.49Å; Q158-A162 VanDerWaalsContact O-CB 3.24Å; Q158-A162 WeakPolarHBondContact O-CB 3.42Å; Q158-A162 PolarHBondContact O-N 3.39Å
159E95.8Very high94.9Very high122 Ų12292.6 Ų92.657%0.5747%0.469SS*.Hα-helixtrans-58.3-49.7174.1178.8179.6-152.200111.2L155 K156 Q157 V161 A162 V163L155-E159 WeakPolarHBondContact O-CB 3.32Å; L155-E159 PolarHBondContact O-N 3.43Å; K156-E159 WeakPolarHBondContact O-CB 3.43Å; K156-E159 PolarHBondContact O-N 2.85Å; Q157-E159 VanDerWaalsContact C-N 3.33Å; E159-V161 VanDerWaalsContact C-N 3.34Å; E159-V161 PolarHBondContact O-N 3.48Å; E159-A162 PolarHBondContact O-N 3.37Å; E159-V163 WeakPolarHBondContact O-CB 3.42Å; E159-V163 WeakPolarHBondContact O-CG2 3.36Å; E159-V163 PolarHBondContact O-N 3.37Å
160V95.3Very high95Very high102 Ų10288.3 Ų88.362%0.61844%0.44SS*.Hα-helixtrans-58.1-46.4177.5173.40000111.5K156 Q157 A162 V163 D164K156-V160 WeakPolarHBondContact O-CG2 3.48Å; K156-V160 PolarHBondContact O-N 3.3Å; K156-V160 VanDerWaalsContact O-N 3.15Å; Q157-V160 PolarHBondContact O-N 3.14Å; V160-A162 VanDerWaalsContact C-N 3.34Å; V160-A162 PolarHBondContact O-N 2.84Å; V160-V163 PolarHBondContact O-N 2.75Å; V160-D164 WeakPolarHBondContact O-CB 3.24Å; V160-D164 PolarHBondContact O-N 2.94Å
161V95.9Very high95.2Very high91 Ų9185.8 Ų85.855%0.55243%0.427SS*.Hα-helixtrans-66.1-37.5179175.30000111.6Q157 Q158 E159 S165Q157-V161 WeakPolarHBondContact O-CG2 3.49Å; Q157-V161 PolarHBondContact O-N 3Å; Q157-V161 VanDerWaalsContact O-N 3.14Å; Q158-V161 PolarHBondContact O-N 3.49Å; E159-V161 VanDerWaalsContact C-N 3.34Å; E159-V161 PolarHBondContact O-N 3.48Å; V161-S165 VanDerWaalsContact O-CB 3.24Å; V161-S165 WeakPolarHBondContact O-CB 3.24Å; V161-S165 PolarHBondContact O-N 2.86Å; V161-S165 PolarHBondContact O-OG 2.89Å
162A96.5Very high95.5Very high52 Ų5283.6 Ų83.643%0.4342%0.424SS..Hα-helixtrans-67.8-45.2178.300000111.4Q158 E159 V160 S165 V166Q158-A162 VanDerWaalsContact O-CB 3.24Å; Q158-A162 WeakPolarHBondContact O-CB 3.42Å; Q158-A162 PolarHBondContact O-N 3.39Å; E159-A162 PolarHBondContact O-N 3.37Å; V160-A162 VanDerWaalsContact C-N 3.34Å; V160-A162 PolarHBondContact O-N 2.84Å; A162-S165 PolarHBondContact O-N 3.4Å; A162-V166 WeakPolarHBondContact O-CG2 3.33Å; A162-V166 PolarHBondContact O-N 3.45Å
163V96.7Very high95.5Very high28 Ų2882.3 Ų82.317%0.1742%0.417CS..Hα-helixtrans-61.3-48.3176.3168.70000111E159 V160 S165 V166 N167 I204E159-V163 WeakPolarHBondContact O-CB 3.42Å; E159-V163 WeakPolarHBondContact O-CG2 3.36Å; E159-V163 PolarHBondContact O-N 3.37Å; V160-V163 PolarHBondContact O-N 2.75Å; V163-S165 VanDerWaalsContact C-N 3.31Å; V163-S165 PolarHBondContact O-N 3.28Å; V163-V166 PolarHBondContact O-N 2.91Å; V163-N167 WeakPolarHBondContact O-CB 3.36Å; V163-N167 PolarHBondContact O-N 3.17Å; V163-N167 PolarHBondContact O-ND2 3.48Å; V163-I204 HydrophobicContact CG1-CG1 4.36Å; V163-I204 HydrophobicContact CG2-CD1 4.28Å
164D96Very high95.4Very high105 Ų10580.9 Ų80.956%0.56141%0.407SS*.Hα-helixtrans-58.8-43.6175.3-177.870.8000111.6V160 V166 N167 R168V160-D164 WeakPolarHBondContact O-CB 3.24Å; V160-D164 PolarHBondContact O-N 2.94Å; D164-V166 PolarHBondContact O-N 3.16Å; D164-N167 PolarHBondContact O-N 3.27Å; D164-R168 WeakPolarHBondContact O-CB 3.4Å; D164-R168 PolarHBondContact O-N 2.88Å
165S96.7Very high95.3Very high39 Ų3983.9 Ų83.927%0.27342%0.422SS..Hα-helixtrans-62.7-43.8177.7-650000112.6V161 A162 V163 W169V161-S165 VanDerWaalsContact O-CB 3.24Å; V161-S165 WeakPolarHBondContact O-CB 3.24Å; V161-S165 PolarHBondContact O-N 2.86Å; V161-S165 PolarHBondContact O-OG 2.89Å; A162-S165 PolarHBondContact O-N 3.4Å; V163-S165 VanDerWaalsContact C-N 3.31Å; V163-S165 PolarHBondContact O-N 3.28Å; S165-W169 PolarHBondContact O-N 3.38Å; S165-W169 VanDerWaalsContact O-N 3.16Å
166V96.7Very high95.2Very high65 Ų6584.4 Ų84.439%0.39443%0.425SS..Hα-helixtrans-63.9-48.6176.9171.50000109.9A162 V163 D164 R168 W169 T170 I204A162-V166 WeakPolarHBondContact O-CG2 3.33Å; A162-V166 PolarHBondContact O-N 3.45Å; V163-V166 PolarHBondContact O-N 2.91Å; D164-V166 PolarHBondContact O-N 3.16Å; V166-R168 VanDerWaalsContact C-N 3.29Å; V166-R168 PolarHBondContact O-N 2.91Å; V166-W169 CarbonylContact O-C 3.58Å; V166-W169 WeakPolarHBondContact O-CA 3.49Å; V166-W169 WeakPolarHBondContact O-CB 3.47Å; V166-W169 PolarHBondContact O-N 3.08Å; V166-T170 PolarHBondContact O-N 3.14Å; V166-T170 PolarHBondContact O-OG1 3.34Å; V166-I204 HydrophobicContact CB-CD1 3.73Å; V166-I204 HydrophobicContact CB-CG1 4.14Å; V166-I204 HydrophobicContact CG1-CD1 3.59Å; V166-I204 HydrophobicContact CG1-CG1 3.78Å; V166-I204 HydrophobicContact CG2-CD1 4.02Å
167N96.6Very high94.9Very high31 Ų3178.9 Ų78.917%0.16640%0.401CS..Hα-helixtrans-62.2-35.7-179.8-73.3-20.4000112.4V163 D164 W169 T170 D171 Y203 I204V163-N167 WeakPolarHBondContact O-CB 3.36Å; V163-N167 PolarHBondContact O-N 3.17Å; V163-N167 PolarHBondContact O-ND2 3.48Å; D164-N167 PolarHBondContact O-N 3.27Å; N167-W169 PolarHBondContact O-N 3.38Å; N167-T170 VanDerWaalsContact O-CB 3.29Å; N167-T170 WeakPolarHBondContact O-CB 3.36Å; N167-T170 PolarHBondContact O-N 3.22Å; N167-D171 PolarHBondContact O-N 3.43Å; N167-Y203 HydrophobicContact CB-CD1 3.81Å; N167-Y203 HydrophobicContact CB-CE1 4.43Å; N167-Y203 WeakPolarHBondContact OD1-CA 3.49Å; N167-I204 PolarHBondContact ND2-O 2.94Å; N167-I204 PolarHBondContact OD1-N 3.46Å; N167-I204 PolarHBondContact OD1-O 3.16Å
168R96.9Very high94.6Very high137 Ų13775.9 Ų75.952%0.51739%0.393SS..Hα-helixtrans-64.5-37.2171.7-171.8179.867.3172.4-1.9112.8D164 V166 D171 N172D164-R168 WeakPolarHBondContact O-CB 3.4Å; D164-R168 PolarHBondContact O-N 2.88Å; V166-R168 VanDerWaalsContact C-N 3.29Å; V166-R168 PolarHBondContact O-N 2.91Å; R168-D171 WeakPolarHBondContact O-CB 3.29Å; R168-N172 PolarHBondContact O-N 2.91Å; R168-N172 VanDerWaalsContact O-N 3.08Å; R168-N172 PolarHBondContact O-ND2 2.87Å
169W96.1Very high94.4Very high160 Ų16077.9 Ų77.961%0.60640%0.397SS*.Hα-helixtrans-70.8-35.5172.9-78.3111.9000111.9S165 V166 N167 N172 I173S165-W169 PolarHBondContact O-N 3.38Å; S165-W169 VanDerWaalsContact O-N 3.16Å; V166-W169 CarbonylContact O-C 3.58Å; V166-W169 WeakPolarHBondContact O-CA 3.49Å; V166-W169 WeakPolarHBondContact O-CB 3.47Å; V166-W169 PolarHBondContact O-N 3.08Å; N167-W169 PolarHBondContact O-N 3.38Å; W169-N172 HydrophobicContact CE3-CB 4.4Å; W169-N172 PolarHBondContact O-N 2.96Å; W169-I173 VanDerWaalsContact O-CG1 3.29Å; W169-I173 WeakPolarHBondContact O-CG1 3.2Å; W169-I173 PolarHBondContact O-N 3.34Å
170T95.7Very high94Very high4 Ų473.7 Ų73.73%0.02538%0.378CS..Hα-helixtrans-57.4-47.6170-59.10000110.8V166 N167 N172 I173 F174 F201 Y203V166-T170 PolarHBondContact O-N 3.14Å; V166-T170 PolarHBondContact O-OG1 3.34Å; N167-T170 VanDerWaalsContact O-CB 3.29Å; N167-T170 WeakPolarHBondContact O-CB 3.36Å; N167-T170 PolarHBondContact O-N 3.22Å; T170-N172 PolarHBondContact O-N 2.86Å; T170-I173 PolarHBondContact O-N 3.48Å; T170-F174 HydrophobicContact CG2-CD2 3.94Å; T170-F174 HydrophobicContact CG2-CE2 3.44Å; T170-F174 VanDerWaalsContact CG2-CE2 3.44Å; T170-F174 HydrophobicContact CG2-CZ 3.96Å; T170-F174 PolarHBondContact O-N 3Å; T170-F201 HydrophobicContact CG2-CD1 4.38Å; T170-F201 HydrophobicContact CG2-CE1 3.65Å; T170-F201 HydrophobicContact CG2-CZ 4.16Å; T170-Y203 HydrophobicContact CG2-CD1 3.93Å; T170-Y203 HydrophobicContact CG2-CE1 3.95Å; T170-Y203 HydrophobicContact CG2-CG 4.34Å
171D95.9Very high93.6Very high74 Ų7471.4 Ų71.440%0.39636%0.362SS..Hα-helixtrans-56.5-49174-74.9-31.8000112N167 R168 I173 F174 M175 Y203N167-D171 PolarHBondContact O-N 3.43Å; R168-D171 WeakPolarHBondContact O-CB 3.29Å; D171-I173 VanDerWaalsContact C-N 3.27Å; D171-I173 PolarHBondContact O-N 2.5Å; D171-F174 PolarHBondContact O-N 3.45Å; D171-M175 WeakPolarHBondContact O-CB 3.47Å; D171-M175 PolarHBondContact O-N 2.83Å; D171-Y203 WeakPolarHBondContact OD1-CE1 3.45Å; D171-Y203 VanDerWaalsContact OD1-CZ 3.24Å; D171-Y203 PolarHBondContact OD1-OH 2.87Å
172N95.9Very high93.3Very high64 Ų6473.2 Ų73.234%0.34237%0.369SS..Hα-helixtrans-59.2-40.8179.2-70.5-20.3000111.4R168 W169 T170 M175 I176R168-N172 PolarHBondContact O-N 2.91Å; R168-N172 VanDerWaalsContact O-N 3.08Å; R168-N172 PolarHBondContact O-ND2 2.87Å; W169-N172 HydrophobicContact CE3-CB 4.4Å; W169-N172 PolarHBondContact O-N 2.96Å; T170-N172 PolarHBondContact O-N 2.86Å; N172-M175 PolarHBondContact O-N 3.29Å; N172-I176 VanDerWaalsContact O-CG1 3.25Å; N172-I176 WeakPolarHBondContact O-CG1 3.25Å; N172-I176 PolarHBondContact O-N 2.94Å
173I92.6Very high93Very high50 Ų5076.9 Ų76.926%0.25638%0.375SS..Hα-helixtrans-64.3-47176.7-70.9164.4000110.5W169 T170 D171 M175 I176 K177 I197 F201W169-I173 VanDerWaalsContact O-CG1 3.29Å; W169-I173 WeakPolarHBondContact O-CG1 3.2Å; W169-I173 PolarHBondContact O-N 3.34Å; T170-I173 PolarHBondContact O-N 3.48Å; D171-I173 VanDerWaalsContact C-N 3.27Å; D171-I173 PolarHBondContact O-N 2.5Å; I173-M175 VanDerWaalsContact C-N 3.32Å; I173-M175 PolarHBondContact O-N 2.95Å; I173-I176 PolarHBondContact O-N 3.2Å; I173-K177 HydrophobicContact CG2-CD 4.25Å; I173-K177 WeakPolarHBondContact O-CG 3.29Å; I173-K177 PolarHBondContact O-N 2.96Å; I173-I197 HydrophobicContact CG2-CD1 3.81Å; I173-F201 HydrophobicContact CB-CE1 4.39Å; I173-F201 HydrophobicContact CD1-CE1 4.13Å; I173-F201 HydrophobicContact CD1-CZ 3.67Å; I173-F201 HydrophobicContact CG2-CE1 4.15Å
174F92Very high92.6Very high66 Ų6681.3 Ų81.329%0.28939%0.392SS..Hα-helixtrans-63.1-38177-69.1-36000112.5T170 D171 K177 S178 F201 Y203T170-F174 HydrophobicContact CG2-CD2 3.94Å; T170-F174 HydrophobicContact CG2-CE2 3.44Å; T170-F174 VanDerWaalsContact CG2-CE2 3.44Å; T170-F174 HydrophobicContact CG2-CZ 3.96Å; T170-F174 PolarHBondContact O-N 3Å; D171-F174 PolarHBondContact O-N 3.45Å; F174-K177 HydrophobicContact CD1-CD 4.19Å; F174-K177 WeakPolarHBondContact O-CB 3.17Å; F174-K177 PolarHBondContact O-N 3.15Å; F174-S178 WeakPolarHBondContact O-CB 3.39Å; F174-S178 PolarHBondContact O-N 3.45Å; F174-F201 HydrophobicContact CE1-CD1 4.04Å; F174-F201 HydrophobicContact CE1-CE1 4.45Å; F174-F201 HydrophobicContact CZ-CD1 4.08Å; F174-F201 HydrophobicContact CZ-CE1 4.43Å; F174-Y203 HydrophobicContact CD2-CE2 4.47Å; F174-Y203 AromaticContact CE2-CE2 3.99Å; F174-Y203 HydrophobicContact CE2-CE2 3.99Å
175M92.3Very high92Very high141 Ų14181.4 Ų81.470%0.69540%0.401SS*.Hα-helixtrans-65.6-42.4176.4-171.4170.9-179.800112D171 N172 I173 S178 W179D171-M175 WeakPolarHBondContact O-CB 3.47Å; D171-M175 PolarHBondContact O-N 2.83Å; N172-M175 PolarHBondContact O-N 3.29Å; I173-M175 VanDerWaalsContact C-N 3.32Å; I173-M175 PolarHBondContact O-N 2.95Å; M175-S178 PolarHBondContact O-N 3.38Å; M175-W179 WeakPolarHBondContact O-CB 3.43Å; M175-W179 PolarHBondContact O-N 3.2Å
176I90.3Very high91.3Very high88 Ų8882.8 Ų82.845%0.45141%0.405SS..Hα-helixtrans-64-44.5175-69.6165.9000110.7N172 I173 S178 W179 L180 F191N172-I176 VanDerWaalsContact O-CG1 3.25Å; N172-I176 WeakPolarHBondContact O-CG1 3.25Å; N172-I176 PolarHBondContact O-N 2.94Å; I173-I176 PolarHBondContact O-N 3.2Å; I176-S178 PolarHBondContact O-N 2.93Å; I176-W179 PolarHBondContact O-N 3.33Å; I176-L180 HydrophobicContact CG2-CD1 3.76Å; I176-L180 HydrophobicContact CG2-CG 4.26Å; I176-L180 WeakPolarHBondContact O-CB 3.48Å; I176-L180 WeakPolarHBondContact O-CG 3.35Å; I176-L180 PolarHBondContact O-N 3.48Å; I176-F191 HydrophobicContact CG2-CE2 4.37Å; I176-F191 HydrophobicContact CG2-CZ 4.15Å
177K87.6Confident90.6Very high25 Ų2584.1 Ų84.111%0.10941%0.41CS..Hα-helixtrans-54-53.4174.8-77.9175.5176.9-172.80111.1I173 F174 W179 L180 N181 F191 C192 I197I173-K177 HydrophobicContact CG2-CD 4.25Å; I173-K177 WeakPolarHBondContact O-CG 3.29Å; I173-K177 PolarHBondContact O-N 2.96Å; F174-K177 HydrophobicContact CD1-CD 4.19Å; F174-K177 WeakPolarHBondContact O-CB 3.17Å; F174-K177 PolarHBondContact O-N 3.15Å; K177-W179 PolarHBondContact O-N 3.42Å; K177-L180 PolarHBondContact O-N 2.93Å; K177-N181 WeakPolarHBondContact O-CB 3.43Å; K177-N181 PolarHBondContact O-N 3.34Å; K177-N181 VanDerWaalsContact O-N 3.07Å; K177-F191 HydrophobicContact CD-CD1 4.25Å; K177-F191 HydrophobicContact CD-CE1 4.2Å; K177-F191 HydrophobicContact CG-CD1 3.49Å; K177-F191 VanDerWaalsContact CG-CD1 3.49Å; K177-F191 HydrophobicContact CG-CE1 3.36Å; K177-F191 HydrophobicContact CG-CG 4.49Å; K177-F191 HydrophobicContact CG-CZ 4.28Å; K177-C192 WeakPolarHBondContact CE-SG 3.32Å; K177-C192 PolarHBondContact NZ-SG 3.45Å; K177-I197 VanDerWaalsContact CE-CD1 3.42Å
178S89Confident89.9Confident58 Ų5887.2 Ų87.241%0.40642%0.424SS..Hα-helixtrans-62.4-42.5-179.9-174.70000112.4F174 M175 I176 N181 N182F174-S178 WeakPolarHBondContact O-CB 3.39Å; F174-S178 PolarHBondContact O-N 3.45Å; M175-S178 PolarHBondContact O-N 3.38Å; I176-S178 PolarHBondContact O-N 2.93Å; S178-N181 PolarHBondContact O-N 2.91Å; S178-N182 WeakPolarHBondContact O-CB 3.43Å; S178-N182 VanDerWaalsContact O-CG 3.27Å; S178-N182 PolarHBondContact O-N 3.14Å; S178-N182 PolarHBondContact O-ND2 3.28Å; S178-N182 PolarHBondContact OG-ND2 2.86Å
179W91.2Very high89.3Confident133 Ų13383.3 Ų83.350%0.50442%0.42SS..Hα-helixtrans-66.7-41.5179.8-178.385.8000112.9M175 I176 K177 N182 K183 F184M175-W179 WeakPolarHBondContact O-CB 3.43Å; M175-W179 PolarHBondContact O-N 3.2Å; I176-W179 PolarHBondContact O-N 3.33Å; K177-W179 PolarHBondContact O-N 3.42Å; W179-N182 PolarHBondContact O-N 3.06Å; W179-K183 HydrophobicContact CD2-CD 4.46Å; W179-K183 HydrophobicContact CH2-CD 3.78Å; W179-K183 HydrophobicContact CZ2-CD 3.28Å; W179-K183 VanDerWaalsContact O-CB 3.25Å; W179-K183 WeakPolarHBondContact O-CB 3.39Å; W179-K183 PolarHBondContact O-N 3.42Å; W179-F184 AromaticContact CH2-CE2 3.86Å; W179-F184 HydrophobicContact CH2-CE2 3.86Å; W179-F184 HydrophobicContact CH2-CZ 4.48Å; W179-F184 HydrophobicContact CZ3-CD2 4.49Å; W179-F184 AromaticContact CZ3-CE2 3.75Å; W179-F184 HydrophobicContact CZ3-CE2 3.75Å
180L88.6Confident88.8Confident34 Ų3479 Ų7918%0.17841%0.412CS..Hα-helixtrans-65.6-42.2177-74.7173.4000111.8I176 K177 F184 F191I176-L180 HydrophobicContact CG2-CD1 3.76Å; I176-L180 HydrophobicContact CG2-CG 4.26Å; I176-L180 WeakPolarHBondContact O-CB 3.48Å; I176-L180 WeakPolarHBondContact O-CG 3.35Å; I176-L180 PolarHBondContact O-N 3.48Å; K177-L180 PolarHBondContact O-N 2.93Å; L180-F184 HydrophobicContact CD2-CD2 3.85Å; L180-F184 HydrophobicContact CD2-CE2 4.1Å; L180-F184 PolarHBondContact O-N 3.04Å; L180-F191 HydrophobicContact CD1-CD2 3.63Å; L180-F191 HydrophobicContact CD1-CE2 3.38Å; L180-F191 HydrophobicContact CD1-CZ 4.32Å
181N87Confident88.3Confident55 Ų5579.9 Ų79.929%0.29442%0.416SS..Hα-helixtrans-58.9-52.8173.8-173-18.3000110.3K177 S178 K183 S185 E188K177-N181 WeakPolarHBondContact O-CB 3.43Å; K177-N181 PolarHBondContact O-N 3.34Å; K177-N181 VanDerWaalsContact O-N 3.07Å; S178-N181 PolarHBondContact O-N 2.91Å; N181-K183 PolarHBondContact O-N 3.18Å; N181-S185 WeakPolarHBondContact O-CA 3.37Å; N181-S185 PolarHBondContact O-N 3.06Å; N181-E188 HydrophobicContact CB-CG 4.38Å; N181-E188 PolarHBondContact ND2-OE1 3.35Å
182N88.9Confident87.9Confident129 Ų12977.7 Ų77.769%0.6941%0.406SS*.Hα-helixtrans-65-36.7-177.5-73.3-36.7000114.4S178 W179S178-N182 WeakPolarHBondContact O-CB 3.43Å; S178-N182 VanDerWaalsContact O-CG 3.27Å; S178-N182 PolarHBondContact O-N 3.14Å; S178-N182 PolarHBondContact O-ND2 3.28Å; S178-N182 PolarHBondContact OG-ND2 2.86Å; W179-N182 PolarHBondContact O-N 3.06Å
183K90.2Very high87.6Confident128 Ų12883.9 Ų83.956%0.55742%0.424SS*.Hα-helixtrans-90.5-33.2-173.2-170172.1-177.6178.50113.8W179 N181W179-K183 HydrophobicContact CD2-CD 4.46Å; W179-K183 HydrophobicContact CH2-CD 3.78Å; W179-K183 HydrophobicContact CZ2-CD 3.28Å; W179-K183 VanDerWaalsContact O-CB 3.25Å; W179-K183 WeakPolarHBondContact O-CB 3.39Å; W179-K183 PolarHBondContact O-N 3.42Å; N181-K183 PolarHBondContact O-N 3.18Å
184F88.4Confident87.4Confident121 Ų12188.8 Ų88.853%0.53145%0.446SS..Hα-helixtrans-120.93.3-173.4-60.4-77.1000113.4W179 L180 L186W179-F184 AromaticContact CH2-CE2 3.86Å; W179-F184 HydrophobicContact CH2-CE2 3.86Å; W179-F184 HydrophobicContact CH2-CZ 4.48Å; W179-F184 HydrophobicContact CZ3-CD2 4.49Å; W179-F184 AromaticContact CZ3-CE2 3.75Å; W179-F184 HydrophobicContact CZ3-CE2 3.75Å; L180-F184 HydrophobicContact CD2-CD2 3.85Å; L180-F184 HydrophobicContact CD2-CE2 4.1Å; L180-F184 PolarHBondContact O-N 3.04Å; F184-L186 PolarHBondContact O-N 3.46Å
185S83.1Confident87.4Confident107 Ų10791.9 Ų91.975%0.74846%0.46SS*.  trans53.334.6-174.8-54.30000112.6N181N181-S185 WeakPolarHBondContact O-CA 3.37Å; N181-S185 PolarHBondContact O-N 3.06Å
186L81.3Confident87.4Confident69 Ų6993.6 Ų93.636%0.36147%0.466SS..  trans-81.8125.2-177-154.9147.9000109.3F184 E188 F191F184-L186 PolarHBondContact O-N 3.46Å; L186-E188 PolarHBondContact O-N 3.43Å; L186-F191 HydrophobicContact CD2-CB 3.96Å
187D83.4Confident87.4Confident92 Ų9290.7 Ų90.749%0.49245%0.451SS..  trans-63.8128-179.3169.965.1000111.9A189 T190 F191D187-A189 VanDerWaalsContact C-N 3.31Å; D187-A189 PolarHBondContact O-N 3.02Å; D187-A189 WeakPolarHBondContact OD2-CB 3.49Å; D187-A189 PolarHBondContact OD2-N 3.47Å; D187-T190 WeakPolarHBondContact O-CB 3.39Å; D187-T190 PolarHBondContact O-N 2.97Å; D187-T190 VanDerWaalsContact O-N 3.16Å; D187-T190 PolarHBondContact OD2-N 3.49Å; D187-T190 PolarHBondContact OD2-OG1 3.07Å; D187-F191 PolarHBondContact O-N 3.14Å; D187-F191 VanDerWaalsContact O-N 3.08Å
188E82Confident87.5Confident97 Ų9792.8 Ų92.845%0.45347%0.468SS..Hα-helixtrans-62.1-36.8-175.8-74.8176.7-166.500112.6N181 L186 T190 F191 C192N181-E188 HydrophobicContact CB-CG 4.38Å; N181-E188 PolarHBondContact ND2-OE1 3.35Å; L186-E188 PolarHBondContact O-N 3.43Å; E188-T190 VanDerWaalsContact C-N 3.31Å; E188-T190 PolarHBondContact O-N 3.45Å; E188-F191 PolarHBondContact O-N 3.29Å; E188-C192 WeakPolarHBondContact O-CB 3.48Å; E188-C192 PolarHBondContact O-N 3.29Å; E188-C192 PolarHBondContact O-SG 2.91Å
189A84.1Confident87.3Confident54 Ų54100 Ų10045%0.44650%0.495SS..Hα-helixtrans-65.9-37.1178.400000111.5D187 R193D187-A189 VanDerWaalsContact C-N 3.31Å; D187-A189 PolarHBondContact O-N 3.02Å; D187-A189 WeakPolarHBondContact OD2-CB 3.49Å; D187-A189 PolarHBondContact OD2-N 3.47Å; A189-R193 VanDerWaalsContact O-CB 3.3Å; A189-R193 WeakPolarHBondContact O-CB 3.48Å; A189-R193 PolarHBondContact O-N 2.92Å
190T84.6Confident87.3Confident71 Ų71100.1 Ų100.144%0.43651%0.506SS..Hα-helixtrans-66.4-42.9174.4-55.50000111.7D187 E188 R193 Q194D187-T190 WeakPolarHBondContact O-CB 3.39Å; D187-T190 PolarHBondContact O-N 2.97Å; D187-T190 VanDerWaalsContact O-N 3.16Å; D187-T190 PolarHBondContact OD2-N 3.49Å; D187-T190 PolarHBondContact OD2-OG1 3.07Å; E188-T190 VanDerWaalsContact C-N 3.31Å; E188-T190 PolarHBondContact O-N 3.45Å; T190-R193 PolarHBondContact O-N 3.38Å; T190-Q194 WeakPolarHBondContact O-CB 3.37Å; T190-Q194 PolarHBondContact O-N 2.98Å
191F86.1Confident87.5Confident21 Ų21101.4 Ų101.49%0.09251%0.51CS..Hα-helixtrans-61.6-50.7174.6178.1-90000112.1I176 K177 L180 L186 D187 E188 R193 Q194 F195 I197I176-F191 HydrophobicContact CG2-CE2 4.37Å; I176-F191 HydrophobicContact CG2-CZ 4.15Å; K177-F191 HydrophobicContact CD-CD1 4.25Å; K177-F191 HydrophobicContact CD-CE1 4.2Å; K177-F191 HydrophobicContact CG-CD1 3.49Å; K177-F191 VanDerWaalsContact CG-CD1 3.49Å; K177-F191 HydrophobicContact CG-CE1 3.36Å; K177-F191 HydrophobicContact CG-CG 4.49Å; K177-F191 HydrophobicContact CG-CZ 4.28Å; L180-F191 HydrophobicContact CD1-CD2 3.63Å; L180-F191 HydrophobicContact CD1-CE2 3.38Å; L180-F191 HydrophobicContact CD1-CZ 4.32Å; L186-F191 HydrophobicContact CD2-CB 3.96Å; D187-F191 PolarHBondContact O-N 3.14Å; D187-F191 VanDerWaalsContact O-N 3.08Å; E188-F191 PolarHBondContact O-N 3.29Å; F191-R193 VanDerWaalsContact C-N 3.28Å; F191-R193 PolarHBondContact O-N 3.45Å; F191-Q194 PolarHBondContact O-N 3.05Å; F191-Q194 VanDerWaalsContact O-N 3.14Å; F191-F195 HydrophobicContact CD1-CD2 4.3Å; F191-F195 AromaticContact CD2-CD2 3.65Å; F191-F195 HydrophobicContact CD2-CD2 3.65Å; F191-F195 AromaticContact CD2-CE2 3.63Å; F191-F195 HydrophobicContact CD2-CE2 3.63Å; F191-F195 HydrophobicContact CE1-CD2 4.07Å; F191-F195 AromaticContact CE2-CD2 3.37Å; F191-F195 HydrophobicContact CE2-CD2 3.37Å; F191-F195 AromaticContact CE2-CE2 3.22Å; F191-F195 HydrophobicContact CE2-CE2 3.22Å; F191-F195 HydrophobicContact CE2-CG 4.37Å; F191-F195 HydrophobicContact CE2-CZ 4.12Å; F191-F195 HydrophobicContact CG-CD2 4.12Å; F191-F195 AromaticContact CZ-CD2 3.61Å; F191-F195 HydrophobicContact CZ-CD2 3.61Å; F191-F195 AromaticContact CZ-CE2 3.84Å; F191-F195 HydrophobicContact CZ-CE2 3.84Å; F191-F195 HydrophobicContact CZ-CG 4.22Å; F191-F195 WeakPolarHBondContact O-CD2 3.25Å; F191-F195 PolarHBondContact O-N 2.99Å; F191-I197 HydrophobicContact CD1-CD1 4.25Å; F191-I197 HydrophobicContact CE1-CD1 3.67Å
192C88.3Confident87.8Confident29 Ų29103.6 Ų103.620%0.19652%0.521CS..Hα-helixtrans-58.9-41.7179.6-69.10000111.5K177 E188 E196 I197K177-C192 WeakPolarHBondContact CE-SG 3.32Å; K177-C192 PolarHBondContact NZ-SG 3.45Å; E188-C192 WeakPolarHBondContact O-CB 3.48Å; E188-C192 PolarHBondContact O-N 3.29Å; E188-C192 PolarHBondContact O-SG 2.91Å; C192-E196 PolarHBondContact O-N 2.85Å; C192-I197 HydrophobicContact CB-CB 4.3Å; C192-I197 PolarHBondContact O-N 3.35Å
193R88.5Confident88Confident193 Ų193102.7 Ų102.773%0.72851%0.509SS*.Hα-helixtrans-64.6-40.9176-169.4-176-60.4152.54.1112.5A189 T190 F191 E196A189-R193 VanDerWaalsContact O-CB 3.3Å; A189-R193 WeakPolarHBondContact O-CB 3.48Å; A189-R193 PolarHBondContact O-N 2.92Å; T190-R193 PolarHBondContact O-N 3.38Å; F191-R193 VanDerWaalsContact C-N 3.28Å; F191-R193 PolarHBondContact O-N 3.45Å; R193-E196 PolarHBondContact O-N 3.35Å
194Q89.6Confident88.1Confident153 Ų153100.4 Ų100.472%0.71550%0.502SS*.Hα-helixtrans-66.7-35.9-179.1-170.576.911.400112.5T190 F191T190-Q194 WeakPolarHBondContact O-CB 3.37Å; T190-Q194 PolarHBondContact O-N 2.98Å; F191-Q194 PolarHBondContact O-N 3.05Å; F191-Q194 VanDerWaalsContact O-N 3.14Å
195F90.1Very high87.8Confident131 Ų131102.5 Ų102.558%0.57553%0.532SS*.THydrogen-bonded Turntrans-98.912180-73.7-83.8000113.4F191 I197F191-F195 HydrophobicContact CD1-CD2 4.3Å; F191-F195 AromaticContact CD2-CD2 3.65Å; F191-F195 HydrophobicContact CD2-CD2 3.65Å; F191-F195 AromaticContact CD2-CE2 3.63Å; F191-F195 HydrophobicContact CD2-CE2 3.63Å; F191-F195 HydrophobicContact CE1-CD2 4.07Å; F191-F195 AromaticContact CE2-CD2 3.37Å; F191-F195 HydrophobicContact CE2-CD2 3.37Å; F191-F195 AromaticContact CE2-CE2 3.22Å; F191-F195 HydrophobicContact CE2-CE2 3.22Å; F191-F195 HydrophobicContact CE2-CG 4.37Å; F191-F195 HydrophobicContact CE2-CZ 4.12Å; F191-F195 HydrophobicContact CG-CD2 4.12Å; F191-F195 AromaticContact CZ-CD2 3.61Å; F191-F195 HydrophobicContact CZ-CD2 3.61Å; F191-F195 AromaticContact CZ-CE2 3.84Å; F191-F195 HydrophobicContact CZ-CE2 3.84Å; F191-F195 HydrophobicContact CZ-CG 4.22Å; F191-F195 WeakPolarHBondContact O-CD2 3.25Å; F191-F195 PolarHBondContact O-N 2.99Å; F195-I197 HydrophobicContact CB-CD1 4Å; F195-I197 HydrophobicContact CB-CG1 3.93Å; F195-I197 PolarHBondContact O-N 3.08Å; F195-I197 VanDerWaalsContact O-N 3.14Å
196E92.4Very high88Confident177 Ų177102.3 Ų102.383%0.82752%0.521SS*.THydrogen-bonded Turntrans53.333.8179.1-57.1-178.7173.400113.5C192 R193 P198C192-E196 PolarHBondContact O-N 2.85Å; R193-E196 PolarHBondContact O-N 3.35Å; E196-P198 WeakPolarHBondContact O-CD 3.3Å
197I90.9Very high88.4Confident27 Ų27104.1 Ų104.114%0.13853%0.529CS..  trans-81.5118.5179.2-56.1173.2000108.1I173 K177 F191 C192 F195 F201I173-I197 HydrophobicContact CG2-CD1 3.81Å; K177-I197 VanDerWaalsContact CE-CD1 3.42Å; F191-I197 HydrophobicContact CD1-CD1 4.25Å; F191-I197 HydrophobicContact CE1-CD1 3.67Å; C192-I197 HydrophobicContact CB-CB 4.3Å; C192-I197 PolarHBondContact O-N 3.35Å; F195-I197 HydrophobicContact CB-CD1 4Å; F195-I197 HydrophobicContact CB-CG1 3.93Å; F195-I197 PolarHBondContact O-N 3.08Å; F195-I197 VanDerWaalsContact O-N 3.14Å; I197-F201 HydrophobicContact CG2-CB 3.55Å; I197-F201 HydrophobicContact CG2-CD1 3.98Å; I197-F201 HydrophobicContact CG2-CD2 4.11Å; I197-F201 HydrophobicContact CG2-CG 3.6Å
198P90.3Very high88.6Confident70 Ų70104.7 Ų104.746%0.45553%0.532SS..  trans-69.8156.4-176.429.6-34.6000111.5E196 N200 F201E196-P198 WeakPolarHBondContact O-CD 3.3Å; P198-N200 WeakPolarHBondContact CB-OD1 3.4Å; P198-N200 PolarHBondContact O-N 3.44Å; P198-F201 HydrophobicContact CG-CB 4.08Å; P198-F201 WeakPolarHBondContact O-CB 3.15Å; P198-F201 PolarHBondContact O-N 2.9Å
199E85.4Confident89Confident208 Ų208105.2 Ų105.297%0.97254%0.536SS*.THydrogen-bonded Turntrans-65.5-26.9-176.9-68-176174.200113.1F201E199-F201 VanDerWaalsContact C-N 3.3Å
200N90.2Very high89.3Confident137 Ų137108.4 Ų108.473%0.73354%0.542SS*.THydrogen-bonded Turntrans-92.317.7175.770.9-35.9000113P198 D202P198-N200 WeakPolarHBondContact CB-OD1 3.4Å; P198-N200 PolarHBondContact O-N 3.44Å; N200-D202 PolarHBondContact O-N 3.22Å; N200-D202 VanDerWaalsContact O-N 3.15Å
201F92.4Very high89.7Confident60 Ų60110.9 Ų110.926%0.26355%0.549SS..  trans-67.2112.2176.4-175.1-93.6000110.1T170 I173 F174 I197 P198 E199T170-F201 HydrophobicContact CG2-CD1 4.38Å; T170-F201 HydrophobicContact CG2-CE1 3.65Å; T170-F201 HydrophobicContact CG2-CZ 4.16Å; I173-F201 HydrophobicContact CB-CE1 4.39Å; I173-F201 HydrophobicContact CD1-CE1 4.13Å; I173-F201 HydrophobicContact CD1-CZ 3.67Å; I173-F201 HydrophobicContact CG2-CE1 4.15Å; F174-F201 HydrophobicContact CE1-CD1 4.04Å; F174-F201 HydrophobicContact CE1-CE1 4.45Å; F174-F201 HydrophobicContact CZ-CD1 4.08Å; F174-F201 HydrophobicContact CZ-CE1 4.43Å; I197-F201 HydrophobicContact CG2-CB 3.55Å; I197-F201 HydrophobicContact CG2-CD1 3.98Å; I197-F201 HydrophobicContact CG2-CD2 4.11Å; I197-F201 HydrophobicContact CG2-CG 3.6Å; P198-F201 HydrophobicContact CG-CB 4.08Å; P198-F201 WeakPolarHBondContact O-CB 3.15Å; P198-F201 PolarHBondContact O-N 2.9Å; E199-F201 VanDerWaalsContact C-N 3.3Å
202D93.2Very high89.9Confident101 Ų101117.3 Ų117.354%0.5458%0.582SS.*  trans-149.9178.5-177.9-154-6.9000110.3N200N200-D202 PolarHBondContact O-N 3.22Å; N200-D202 VanDerWaalsContact O-N 3.15Å
203Y93.8Very high90Very high111 Ų111124.1 Ų124.144%0.43561%0.611SS.*  trans-58.5146.4173.7-59.3-79.8000111.8N167 T170 D171 F174N167-Y203 HydrophobicContact CB-CD1 3.81Å; N167-Y203 HydrophobicContact CB-CE1 4.43Å; N167-Y203 WeakPolarHBondContact OD1-CA 3.49Å; T170-Y203 HydrophobicContact CG2-CD1 3.93Å; T170-Y203 HydrophobicContact CG2-CE1 3.95Å; T170-Y203 HydrophobicContact CG2-CG 4.34Å; D171-Y203 WeakPolarHBondContact OD1-CE1 3.45Å; D171-Y203 VanDerWaalsContact OD1-CZ 3.24Å; D171-Y203 PolarHBondContact OD1-OH 2.87Å; F174-Y203 HydrophobicContact CD2-CE2 4.47Å; F174-Y203 AromaticContact CE2-CE2 3.99Å; F174-Y203 HydrophobicContact CE2-CE2 3.99Å
204I92.3Very high90.2Very high80 Ų80118.3 Ų118.341%0.4160%0.601SS.*  trans-100.9141.517360.8165.9000109.9V163 V166 N167V163-I204 HydrophobicContact CG1-CG1 4.36Å; V163-I204 HydrophobicContact CG2-CD1 4.28Å; V166-I204 HydrophobicContact CB-CD1 3.73Å; V166-I204 HydrophobicContact CB-CG1 4.14Å; V166-I204 HydrophobicContact CG1-CD1 3.59Å; V166-I204 HydrophobicContact CG1-CG1 3.78Å; V166-I204 HydrophobicContact CG2-CD1 4.02Å; N167-I204 PolarHBondContact ND2-O 2.94Å; N167-I204 PolarHBondContact OD1-N 3.46Å; N167-I204 PolarHBondContact OD1-O 3.16Å
205S81.5Confident90.2Very high165 Ų165115.2 Ų115.2100%1.15459%0.591SS**  trans-92.70177.263.10000111.9

Retrieved 205 of 205 residues in 332.3 ms (Link to these results)

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