A0A096MYW8_PAPAN Loading...

Transmembrane protein 19

AlphaFold DB (A0A2K5Z875), UniProt , Accession A0A096MYW8, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM19, Length 336 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
1M58.5Low71.7Confident211 Ų211121.2 Ų121.2100%1.03961%0.613SS**  0-39.40-94.2174.8167.300112.3L4 N5M1-L4 PolarHBondContact O-N 2.78Å; M1-N5 PolarHBondContact O-N 3.42Å
2T62.5Low72.4Confident116 Ų116122.6 Ų122.671%0.71261%0.607SS**Hα-helixtrans-60-45.8176.735.90000114.2L4 N5 D6T2-L4 VanDerWaalsContact C-N 3.28Å; T2-L4 PolarHBondContact O-N 3.22Å; T2-N5 PolarHBondContact O-N 2.89Å; T2-D6 PolarHBondContact O-N 3.38Å
3D65.1Low72.7Confident124 Ų124120.7 Ų120.766%0.66360%0.599SS**Hα-helixtrans-67-25.5179-71.9-32.9000114.6N7D3-N7 WeakPolarHBondContact O-CB 3.17Å; D3-N7 PolarHBondContact O-N 2.8Å; D3-N7 PolarHBondContact O-ND2 2.92Å
4L67.1Low72.5Confident118 Ų118121.9 Ų121.962%0.61860%0.599SS**Hα-helixtrans-75.1-44.5177.3-169.370.6000110.3M1 T2 N7 I8M1-L4 PolarHBondContact O-N 2.78Å; T2-L4 VanDerWaalsContact C-N 3.28Å; T2-L4 PolarHBondContact O-N 3.22Å; L4-N7 PolarHBondContact O-N 3.5Å; L4-I8 HydrophobicContact CG-CD1 4.12Å; L4-I8 WeakPolarHBondContact O-CD1 3.2Å; L4-I8 WeakPolarHBondContact O-CG1 3.39Å; L4-I8 PolarHBondContact O-N 2.96Å
5N72.8Confident72.7Confident114 Ų114120.1 Ų120.161%0.6159%0.59SS**Hα-helixtrans-64.9-38.1175.8-87.51.2000112.4M1 T2 I8 C9M1-N5 PolarHBondContact O-N 3.42Å; T2-N5 PolarHBondContact O-N 2.89Å; N5-I8 PolarHBondContact O-N 3.35Å; N5-C9 WeakPolarHBondContact O-CB 3.48Å; N5-C9 PolarHBondContact O-N 3.34Å
6D74.9Confident72.9Confident82 Ų82118.6 Ų118.644%0.43958%0.584SS.*Hα-helixtrans-69.4-37.5179.8-153.752.6000111.9T2 C9 K10T2-D6 PolarHBondContact O-N 3.38Å; D6-C9 PolarHBondContact O-N 2.84Å; D6-K10 WeakPolarHBondContact O-CB 3.44Å; D6-K10 WeakPolarHBondContact O-CG 3.33Å; D6-K10 PolarHBondContact O-N 3.46Å; D6-K10 IonicContact OD2-NZ 3.89Å; D6-K10 PolarHBondContact OD2-NZ 3.21Å
7N77.4Confident72.9Confident101 Ų101115.6 Ų115.654%0.5458%0.575SS.*Hα-helixtrans-67.9-37.9172.3-86.2-47.2000113.2D3 L4 R11D3-N7 WeakPolarHBondContact O-CB 3.17Å; D3-N7 PolarHBondContact O-N 2.8Å; D3-N7 PolarHBondContact O-ND2 2.92Å; L4-N7 PolarHBondContact O-N 3.5Å; N7-R11 WeakPolarHBondContact O-CB 3.34Å; N7-R11 PolarHBondContact O-N 2.93Å
8I79.1Confident72.7Confident74 Ų74114.4 Ų114.438%0.37957%0.57SS.*Hα-helixtrans-65.1-46.7174.6-70.2165.7000109.7L4 N5 K10 R11 Y12L4-I8 HydrophobicContact CG-CD1 4.12Å; L4-I8 WeakPolarHBondContact O-CD1 3.2Å; L4-I8 WeakPolarHBondContact O-CG1 3.39Å; L4-I8 PolarHBondContact O-N 2.96Å; N5-I8 PolarHBondContact O-N 3.35Å; I8-K10 PolarHBondContact O-N 3.47Å; I8-R11 WeakPolarHBondContact O-CB 3.37Å; I8-R11 PolarHBondContact O-N 2.96Å; I8-R11 VanDerWaalsContact O-N 3.17Å; I8-Y12 HydrophobicContact CG2-CD2 3.69Å; I8-Y12 HydrophobicContact CG2-CE2 3.84Å; I8-Y12 WeakPolarHBondContact O-CD2 3.01Å; I8-Y12 PolarHBondContact O-N 2.99Å
9C77.8Confident72.8Confident64 Ų64113.1 Ų113.143%0.43257%0.565SS.*Hα-helixtrans-59.8-47.3178-167.60000111.6N5 D6 R11 Y12 I13N5-C9 WeakPolarHBondContact O-CB 3.48Å; N5-C9 PolarHBondContact O-N 3.34Å; D6-C9 PolarHBondContact O-N 2.84Å; C9-R11 VanDerWaalsContact C-N 3.32Å; C9-R11 PolarHBondContact O-N 3.19Å; C9-Y12 PolarHBondContact O-N 3.47Å; C9-I13 WeakPolarHBondContact O-CG1 3.47Å; C9-I13 PolarHBondContact O-N 2.84Å
10K77.3Confident72.8Confident125 Ų125111.3 Ų111.354%0.54356%0.559SS.*Hα-helixtrans-59.2-39.8174.4-78.1169.2176.7148.20112.9D6 I8 K14D6-K10 WeakPolarHBondContact O-CB 3.44Å; D6-K10 WeakPolarHBondContact O-CG 3.33Å; D6-K10 PolarHBondContact O-N 3.46Å; D6-K10 IonicContact OD2-NZ 3.89Å; D6-K10 PolarHBondContact OD2-NZ 3.21Å; I8-K10 PolarHBondContact O-N 3.47Å; K10-K14 VanDerWaalsContact O-CB 3.28Å; K10-K14 WeakPolarHBondContact O-CB 3.39Å; K10-K14 PolarHBondContact O-N 3.49Å
11R75.7Confident72.6Confident204 Ų204110 Ų11077%0.7755%0.553SS**Hα-helixtrans-65.1-44.1174.4-88.3-178168.5-174.4-2.4112N7 I8 C9 K14 M15N7-R11 WeakPolarHBondContact O-CB 3.34Å; N7-R11 PolarHBondContact O-N 2.93Å; I8-R11 WeakPolarHBondContact O-CB 3.37Å; I8-R11 PolarHBondContact O-N 2.96Å; I8-R11 VanDerWaalsContact O-N 3.17Å; C9-R11 VanDerWaalsContact C-N 3.32Å; C9-R11 PolarHBondContact O-N 3.19Å; R11-K14 PolarHBondContact O-N 3.5Å; R11-M15 WeakPolarHBondContact O-CB 3.48Å; R11-M15 PolarHBondContact O-N 2.78Å
12Y80.1Confident73.1Confident138 Ų138103.9 Ų103.954%0.54152%0.524SS..Hα-helixtrans-63.9-46.6177.6-96-83.3000112.1I8 C9 K14 M15 I16I8-Y12 HydrophobicContact CG2-CD2 3.69Å; I8-Y12 HydrophobicContact CG2-CE2 3.84Å; I8-Y12 WeakPolarHBondContact O-CD2 3.01Å; I8-Y12 PolarHBondContact O-N 2.99Å; C9-Y12 PolarHBondContact O-N 3.47Å; Y12-K14 VanDerWaalsContact C-N 3.35Å; Y12-K14 PolarHBondContact O-N 3.25Å; Y12-M15 HydrophobicContact CD1-CE 3.95Å; Y12-M15 HydrophobicContact CE1-CE 3.96Å; Y12-M15 PolarHBondContact O-N 2.83Å; Y12-I16 WeakPolarHBondContact O-CG1 3.34Å; Y12-I16 PolarHBondContact O-N 2.76Å
13I76.1Confident73.6Confident98 Ų98101.2 Ų101.250%0.50351%0.51SS..Hα-helixtrans-58.1-49.4175.9-69.1168.7000109.8C9 M15 I16 T17C9-I13 WeakPolarHBondContact O-CG1 3.47Å; C9-I13 PolarHBondContact O-N 2.84Å; I13-M15 VanDerWaalsContact C-N 3.3Å; I13-M15 PolarHBondContact O-N 2.97Å; I13-I16 PolarHBondContact O-N 3.24Å; I13-T17 WeakPolarHBondContact O-CB 3.42Å; I13-T17 PolarHBondContact O-N 2.82Å; I13-T17 PolarHBondContact O-OG1 3.37Å
14K71Confident73.9Confident138 Ų138100.1 Ų100.160%0.650%0.504SS*.Hα-helixtrans-59.7-39.4177.4-173.1173.2-176172.30112.7K10 R11 Y12 N18K10-K14 VanDerWaalsContact O-CB 3.28Å; K10-K14 WeakPolarHBondContact O-CB 3.39Å; K10-K14 PolarHBondContact O-N 3.49Å; R11-K14 PolarHBondContact O-N 3.5Å; Y12-K14 VanDerWaalsContact C-N 3.35Å; Y12-K14 PolarHBondContact O-N 3.25Å; K14-N18 WeakPolarHBondContact O-CB 3.48Å; K14-N18 PolarHBondContact O-N 3.5Å; K14-N18 PolarHBondContact O-ND2 3.49Å; K14-N18 PolarHBondContact O-OD1 3Å
15M75.5Confident74.1Confident94 Ų9496.2 Ų96.246%0.46348%0.484SS..Hα-helixtrans-65.8-47.2177.1-172.1176.974.500111.5R11 Y12 I13 N18 I19R11-M15 WeakPolarHBondContact O-CB 3.48Å; R11-M15 PolarHBondContact O-N 2.78Å; Y12-M15 HydrophobicContact CD1-CE 3.95Å; Y12-M15 HydrophobicContact CE1-CE 3.96Å; Y12-M15 PolarHBondContact O-N 2.83Å; I13-M15 VanDerWaalsContact C-N 3.3Å; I13-M15 PolarHBondContact O-N 2.97Å; M15-N18 PolarHBondContact O-N 3.09Å; M15-I19 HydrophobicContact CG-CD1 4.13Å; M15-I19 VanDerWaalsContact O-CG1 3.31Å; M15-I19 WeakPolarHBondContact O-CG1 3.24Å; M15-I19 PolarHBondContact O-N 3.42Å
16I75.8Confident74Confident97 Ų9793.9 Ų93.950%0.49747%0.47SS..Hα-helixtrans-62.6-45.2177.3-68.2169.7000110.5Y12 I13 N18 I19 V20Y12-I16 WeakPolarHBondContact O-CG1 3.34Å; Y12-I16 PolarHBondContact O-N 2.76Å; I13-I16 PolarHBondContact O-N 3.24Å; I16-N18 VanDerWaalsContact C-N 3.32Å; I16-N18 PolarHBondContact O-N 2.91Å; I16-I19 PolarHBondContact O-N 3.48Å; I16-I19 VanDerWaalsContact O-N 3.16Å; I16-V20 HydrophobicContact CG2-CG2 4.37Å; I16-V20 WeakPolarHBondContact O-CG2 3.46Å; I16-V20 PolarHBondContact O-N 2.93Å
17T71.8Confident73.9Confident68 Ų6893.7 Ų93.742%0.41748%0.475SS..Hα-helixtrans-57.7-44.5175.2-57.70000111.4I13 I19 V20 I21I13-T17 WeakPolarHBondContact O-CB 3.42Å; I13-T17 PolarHBondContact O-N 2.82Å; I13-T17 PolarHBondContact O-OG1 3.37Å; T17-I19 PolarHBondContact O-N 3.41Å; T17-V20 PolarHBondContact O-N 3.39Å; T17-I21 HydrophobicContact CG2-CD1 3.79Å; T17-I21 HydrophobicContact CG2-CG1 4.44Å; T17-I21 WeakPolarHBondContact O-CB 3.37Å; T17-I21 VanDerWaalsContact O-CG1 3.25Å; T17-I21 WeakPolarHBondContact O-CG1 3.33Å; T17-I21 PolarHBondContact O-N 2.82Å
18N69.6Low73.6Confident93 Ų9393.4 Ų93.450%0.49747%0.472SS..Hα-helixtrans-63.2-40.4176.5-70.1-15.8000112.4K14 M15 I16 I21 L22K14-N18 WeakPolarHBondContact O-CB 3.48Å; K14-N18 PolarHBondContact O-N 3.5Å; K14-N18 PolarHBondContact O-ND2 3.49Å; K14-N18 PolarHBondContact O-OD1 3Å; M15-N18 PolarHBondContact O-N 3.09Å; I16-N18 VanDerWaalsContact C-N 3.32Å; I16-N18 PolarHBondContact O-N 2.91Å; N18-I21 PolarHBondContact O-N 2.67Å; N18-L22 VanDerWaalsContact O-CB 3.3Å; N18-L22 WeakPolarHBondContact O-CB 3.27Å; N18-L22 PolarHBondContact O-N 3.36Å
19I74.6Confident73.1Confident90 Ų9090.1 Ų90.146%0.46246%0.456SS..Hα-helixtrans-63.7-46.2176.9-69165.1000110.3M15 I16 T17 I21 L22 S23M15-I19 HydrophobicContact CG-CD1 4.13Å; M15-I19 VanDerWaalsContact O-CG1 3.31Å; M15-I19 WeakPolarHBondContact O-CG1 3.24Å; M15-I19 PolarHBondContact O-N 3.42Å; I16-I19 PolarHBondContact O-N 3.48Å; I16-I19 VanDerWaalsContact O-N 3.16Å; T17-I19 PolarHBondContact O-N 3.41Å; I19-I21 PolarHBondContact O-N 2.95Å; I19-L22 PolarHBondContact O-N 3.4Å; I19-S23 WeakPolarHBondContact O-CB 3.26Å; I19-S23 PolarHBondContact O-N 3.44Å; I19-S23 PolarHBondContact O-OG 3.12Å
20V72.4Confident72.8Confident76 Ų7690.5 Ų90.546%0.46145%0.453SS..Hα-helixtrans-61.7-46.1178.1172.10000111I16 T17 L22 S23 L24I16-V20 HydrophobicContact CG2-CG2 4.37Å; I16-V20 WeakPolarHBondContact O-CG2 3.46Å; I16-V20 PolarHBondContact O-N 2.93Å; T17-V20 PolarHBondContact O-N 3.39Å; V20-L22 PolarHBondContact O-N 2.88Å; V20-S23 PolarHBondContact O-N 3.16Å; V20-L24 HydrophobicContact CG1-CD1 4Å; V20-L24 HydrophobicContact CG1-CG 4.49Å; V20-L24 WeakPolarHBondContact O-CB 3.29Å; V20-L24 VanDerWaalsContact O-CG 3.31Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.02Å
21I69.8Low72.6Confident85 Ų8586.8 Ų86.844%0.43645%0.446SS..Hα-helixtrans-60.1-47.1176.7-69.9168.7000110.5T17 N18 I19 S23 L24 I25T17-I21 HydrophobicContact CG2-CD1 3.79Å; T17-I21 HydrophobicContact CG2-CG1 4.44Å; T17-I21 WeakPolarHBondContact O-CB 3.37Å; T17-I21 VanDerWaalsContact O-CG1 3.25Å; T17-I21 WeakPolarHBondContact O-CG1 3.33Å; T17-I21 PolarHBondContact O-N 2.82Å; N18-I21 PolarHBondContact O-N 2.67Å; I19-I21 PolarHBondContact O-N 2.95Å; I21-S23 PolarHBondContact O-N 3.27Å; I21-L24 PolarHBondContact O-N 3.1Å; I21-I25 HydrophobicContact CG2-CD1 3.72Å; I21-I25 HydrophobicContact CG2-CG1 4.41Å; I21-I25 VanDerWaalsContact O-CG1 3.27Å; I21-I25 WeakPolarHBondContact O-CG1 3.41Å; I21-I25 PolarHBondContact O-N 3.27Å
22L68.8Low72.4Confident82 Ų8281.3 Ų81.343%0.42943%0.428SS..Hα-helixtrans-61.8-45.7179.6-175.567.5000111.5N18 I19 V20 L24 I25 I26 L55 V59N18-L22 VanDerWaalsContact O-CB 3.3Å; N18-L22 WeakPolarHBondContact O-CB 3.27Å; N18-L22 PolarHBondContact O-N 3.36Å; I19-L22 PolarHBondContact O-N 3.4Å; V20-L22 PolarHBondContact O-N 2.88Å; L22-L24 VanDerWaalsContact C-N 3.34Å; L22-L24 PolarHBondContact O-N 3.13Å; L22-I25 PolarHBondContact O-N 2.87Å; L22-I26 HydrophobicContact CD1-CD1 4.49Å; L22-I26 HydrophobicContact CG-CD1 4.03Å; L22-I26 VanDerWaalsContact O-CG1 3.3Å; L22-I26 WeakPolarHBondContact O-CG1 3.48Å; L22-I26 PolarHBondContact O-N 3.24Å; L22-L55 HydrophobicContact CD1-CD1 4.26Å; L22-V59 HydrophobicContact CD1-CG2 4.37Å
23S72.9Confident71.9Confident60 Ų6079 Ų7942%0.4242%0.418SS..Hα-helixtrans-60.3-42.7176.6-64.80000111.9I19 V20 I21 I26 C27I19-S23 WeakPolarHBondContact O-CB 3.26Å; I19-S23 PolarHBondContact O-N 3.44Å; I19-S23 PolarHBondContact O-OG 3.12Å; V20-S23 PolarHBondContact O-N 3.16Å; I21-S23 PolarHBondContact O-N 3.27Å; S23-I26 PolarHBondContact O-N 3.14Å; S23-C27 PolarHBondContact O-N 3.16Å; S23-C27 PolarHBondContact O-SG 3Å
24L71.4Confident71.8Confident101 Ų10179.1 Ų79.153%0.52942%0.419SS..Hα-helixtrans-63.2-43.7175.7-73.9170.4000112V20 I21 L22 I26 C27 I28V20-L24 HydrophobicContact CG1-CD1 4Å; V20-L24 HydrophobicContact CG1-CG 4.49Å; V20-L24 WeakPolarHBondContact O-CB 3.29Å; V20-L24 VanDerWaalsContact O-CG 3.31Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.02Å; I21-L24 PolarHBondContact O-N 3.1Å; L22-L24 VanDerWaalsContact C-N 3.34Å; L22-L24 PolarHBondContact O-N 3.13Å; L24-I26 VanDerWaalsContact C-N 3.33Å; L24-I26 PolarHBondContact O-N 3.46Å; L24-C27 PolarHBondContact O-N 2.88Å; L24-I28 WeakPolarHBondContact O-CB 3.28Å; L24-I28 VanDerWaalsContact O-CG1 3.27Å; L24-I28 WeakPolarHBondContact O-CG1 3.48Å; L24-I28 PolarHBondContact O-N 2.92Å
25I70.3Confident71.8Confident37 Ų3777.7 Ų77.719%0.1942%0.416CS..Hα-helixtrans-62.1-42.2176.9-66.1166.3000110.6I21 L22 I28 S29 L55 V58I21-I25 HydrophobicContact CG2-CD1 3.72Å; I21-I25 HydrophobicContact CG2-CG1 4.41Å; I21-I25 VanDerWaalsContact O-CG1 3.27Å; I21-I25 WeakPolarHBondContact O-CG1 3.41Å; I21-I25 PolarHBondContact O-N 3.27Å; L22-I25 PolarHBondContact O-N 2.87Å; I25-I28 PolarHBondContact O-N 3.46Å; I25-S29 WeakPolarHBondContact O-CB 3.27Å; I25-S29 PolarHBondContact O-N 2.86Å; I25-L55 HydrophobicContact CB-CD1 4.4Å; I25-L55 HydrophobicContact CG2-CD1 3.6Å; I25-V58 HydrophobicContact CD1-CG1 4.11Å; I25-V58 HydrophobicContact CG2-CB 4.33Å; I25-V58 HydrophobicContact CG2-CG1 4.29Å
26I71Confident71.5Confident64 Ų6474.5 Ų74.533%0.32840%0.402SS..Hα-helixtrans-61.5-46.8176-69166.2000110.5L22 S23 L24 I28 S29 L30 L55L22-I26 HydrophobicContact CD1-CD1 4.49Å; L22-I26 HydrophobicContact CG-CD1 4.03Å; L22-I26 VanDerWaalsContact O-CG1 3.3Å; L22-I26 WeakPolarHBondContact O-CG1 3.48Å; L22-I26 PolarHBondContact O-N 3.24Å; S23-I26 PolarHBondContact O-N 3.14Å; L24-I26 VanDerWaalsContact C-N 3.33Å; L24-I26 PolarHBondContact O-N 3.46Å; I26-I28 PolarHBondContact O-N 3.28Å; I26-S29 WeakPolarHBondContact O-CB 3.48Å; I26-S29 PolarHBondContact O-N 2.89Å; I26-L30 HydrophobicContact CG2-CD1 3.87Å; I26-L30 HydrophobicContact CG2-CG 4.42Å; I26-L30 WeakPolarHBondContact O-CB 3.34Å; I26-L30 VanDerWaalsContact O-CG 3.31Å; I26-L30 WeakPolarHBondContact O-CG 3.47Å; I26-L30 PolarHBondContact O-N 3.28Å; I26-L55 HydrophobicContact CG1-CD1 3.9Å; I26-L55 HydrophobicContact CG1-CD2 4.19Å
27C72.8Confident71.2Confident79 Ų7973.4 Ų73.453%0.53440%0.396SS..Hα-helixtrans-60.9-45177.7-700000112.4S23 L24 L30 A31S23-C27 PolarHBondContact O-N 3.16Å; S23-C27 PolarHBondContact O-SG 3Å; L24-C27 PolarHBondContact O-N 2.88Å; C27-L30 PolarHBondContact O-N 3.1Å; C27-A31 WeakPolarHBondContact O-CB 3.1Å; C27-A31 PolarHBondContact O-N 3.39Å
28I72.9Confident71.3Confident95 Ų9574.3 Ų74.349%0.48740%0.402SS..Hα-helixtrans-63.3-44.4177.4-70.2166.7000110.6L24 I25 I26 A31 F32L24-I28 WeakPolarHBondContact O-CB 3.28Å; L24-I28 VanDerWaalsContact O-CG1 3.27Å; L24-I28 WeakPolarHBondContact O-CG1 3.48Å; L24-I28 PolarHBondContact O-N 2.92Å; I25-I28 PolarHBondContact O-N 3.46Å; I26-I28 PolarHBondContact O-N 3.28Å; I28-A31 PolarHBondContact O-N 2.86Å; I28-F32 HydrophobicContact CG2-CD2 3.57Å; I28-F32 HydrophobicContact CG2-CE2 3.42Å; I28-F32 VanDerWaalsContact CG2-CE2 3.42Å; I28-F32 VanDerWaalsContact O-CD2 3.28Å; I28-F32 WeakPolarHBondContact O-CD2 3.1Å; I28-F32 PolarHBondContact O-N 3.28Å
29S67Low71.2Confident5 Ų571.2 Ų71.24%0.03539%0.389CS..Hα-helixtrans-58.6-47.3175.9166.70000112I25 I26 A31 F32 W33 P51 W54I25-S29 WeakPolarHBondContact O-CB 3.27Å; I25-S29 PolarHBondContact O-N 2.86Å; I26-S29 WeakPolarHBondContact O-CB 3.48Å; I26-S29 PolarHBondContact O-N 2.89Å; S29-A31 VanDerWaalsContact C-N 3.33Å; S29-A31 PolarHBondContact O-N 3.26Å; S29-F32 PolarHBondContact O-N 3.21Å; S29-W33 PolarHBondContact O-N 3.44Å; S29-P51 VanDerWaalsContact OG-C 3.3Å; S29-P51 VanDerWaalsContact OG-CA 3.24Å; S29-P51 WeakPolarHBondContact OG-CA 3.47Å; S29-P51 PolarHBondContact OG-O 2.69Å; S29-W54 WeakPolarHBondContact OG-CB 3.36Å
30L72.1Confident71.2Confident71 Ų7168.2 Ų68.237%0.37238%0.376SS..Hα-helixtrans-61.9-40.7176-72.7168.4000111.6I26 C27 W33 I34 P51I26-L30 HydrophobicContact CG2-CD1 3.87Å; I26-L30 HydrophobicContact CG2-CG 4.42Å; I26-L30 WeakPolarHBondContact O-CB 3.34Å; I26-L30 VanDerWaalsContact O-CG 3.31Å; I26-L30 WeakPolarHBondContact O-CG 3.47Å; I26-L30 PolarHBondContact O-N 3.28Å; C27-L30 PolarHBondContact O-N 3.1Å; L30-W33 PolarHBondContact O-N 2.96Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.33Å; L30-I34 PolarHBondContact O-N 3.48Å; L30-P51 HydrophobicContact CD2-CB 3.85Å; L30-P51 HydrophobicContact CD2-CG 3.85Å; L30-P51 HydrophobicContact CG-CB 4.5Å
31A72.8Confident71.3Confident47 Ų4770.4 Ų70.439%0.38839%0.389SS..Hα-helixtrans-63.7-46.4176.400000112C27 I28 S29 W33 I34 M35C27-A31 WeakPolarHBondContact O-CB 3.1Å; C27-A31 PolarHBondContact O-N 3.39Å; I28-A31 PolarHBondContact O-N 2.86Å; S29-A31 VanDerWaalsContact C-N 3.33Å; S29-A31 PolarHBondContact O-N 3.26Å; A31-W33 VanDerWaalsContact C-N 3.29Å; A31-W33 PolarHBondContact O-N 2.78Å; A31-I34 PolarHBondContact O-N 3.36Å; A31-M35 WeakPolarHBondContact O-CG 3.45Å; A31-M35 PolarHBondContact O-N 3.1Å
32F71.3Confident71.5Confident89 Ų8975.3 Ų75.339%0.3940%0.404SS..Hα-helixtrans-60.6-38.8174.4-82.3-61.1000112.3I28 S29 M35 S36 W54I28-F32 HydrophobicContact CG2-CD2 3.57Å; I28-F32 HydrophobicContact CG2-CE2 3.42Å; I28-F32 VanDerWaalsContact CG2-CE2 3.42Å; I28-F32 VanDerWaalsContact O-CD2 3.28Å; I28-F32 WeakPolarHBondContact O-CD2 3.1Å; I28-F32 PolarHBondContact O-N 3.28Å; S29-F32 PolarHBondContact O-N 3.21Å; F32-M35 HydrophobicContact CD1-CE 3.25Å; F32-M35 HydrophobicContact CE1-CE 3.6Å; F32-M35 HydrophobicContact CG-CE 4.07Å; F32-M35 PolarHBondContact O-N 3.22Å; F32-S36 VanDerWaalsContact O-CB 3.22Å; F32-S36 WeakPolarHBondContact O-CB 3.4Å; F32-S36 PolarHBondContact O-N 2.9Å; F32-W54 HydrophobicContact CB-CD2 4.33Å; F32-W54 HydrophobicContact CB-CZ2 4.26Å; F32-W54 HydrophobicContact CG-CZ2 4.37Å
33W70.3Confident71.7Confident90 Ų9078.9 Ų78.934%0.34141%0.413SS..Hα-helixtrans-65.1-45.2174.8178.655.9000112.4S29 L30 A31 M35 S36 M37 P51S29-W33 PolarHBondContact O-N 3.44Å; L30-W33 PolarHBondContact O-N 2.96Å; A31-W33 VanDerWaalsContact C-N 3.29Å; A31-W33 PolarHBondContact O-N 2.78Å; W33-M35 VanDerWaalsContact C-N 3.33Å; W33-M35 PolarHBondContact O-N 2.82Å; W33-S36 PolarHBondContact O-N 2.93Å; W33-S36 VanDerWaalsContact O-N 3.15Å; W33-M37 HydrophobicContact CD2-CG 4.19Å; W33-M37 HydrophobicContact CG-CG 4.36Å; W33-M37 HydrophobicContact CZ2-CG 4.12Å; W33-M37 HydrophobicContact CZ2-SD 4.24Å; W33-M37 WeakPolarHBondContact O-CB 3.37Å; W33-M37 WeakPolarHBondContact O-CG 3.27Å; W33-M37 PolarHBondContact O-N 3.2Å; W33-P51 HydrophobicContact CB-CB 4.47Å; W33-P51 HydrophobicContact CB-CG 3.69Å; W33-P51 HydrophobicContact CD2-CG 3.41Å; W33-P51 VanDerWaalsContact CD2-CG 3.41Å; W33-P51 HydrophobicContact CE3-CG 3.54Å; W33-P51 VanDerWaalsContact CG-CD 3.48Å; W33-P51 HydrophobicContact CG-CG 3.5Å; W33-P51 VanDerWaalsContact CG-CG 3.5Å; W33-P51 HydrophobicContact CZ3-CG 4.32Å
34I73.4Confident71.2Confident101 Ų10178.9 Ų78.952%0.51842%0.422SS..Hα-helixtrans-59.8-44.7176.3-69.3164.6000110.5L30 A31 S36 M37 T38L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.33Å; L30-I34 PolarHBondContact O-N 3.48Å; A31-I34 PolarHBondContact O-N 3.36Å; I34-S36 VanDerWaalsContact C-N 3.35Å; I34-S36 PolarHBondContact O-N 3.09Å; I34-M37 PolarHBondContact O-N 3.4Å; I34-T38 WeakPolarHBondContact O-CB 3.18Å; I34-T38 PolarHBondContact O-N 3.16Å; I34-T38 PolarHBondContact O-OG1 3.26Å
35M70.9Confident70.8Confident108 Ų10881.4 Ų81.453%0.53244%0.436SS..Hα-helixtrans-61.5-43.4174.9-69.9-169-5700111.8A31 F32 W33 T38 A39A31-M35 WeakPolarHBondContact O-CG 3.45Å; A31-M35 PolarHBondContact O-N 3.1Å; F32-M35 HydrophobicContact CD1-CE 3.25Å; F32-M35 HydrophobicContact CE1-CE 3.6Å; F32-M35 HydrophobicContact CG-CE 4.07Å; F32-M35 PolarHBondContact O-N 3.22Å; W33-M35 VanDerWaalsContact C-N 3.33Å; W33-M35 PolarHBondContact O-N 2.82Å; M35-T38 PolarHBondContact O-N 2.91Å; M35-A39 WeakPolarHBondContact O-CB 3.38Å; M35-A39 PolarHBondContact O-N 3.48Å
36S70.2Confident70.6Confident27 Ų2783.6 Ų83.619%0.18945%0.448CS..Hα-helixtrans-66.4-40.4179.7-172.80000112.4F32 W33 I34 T38 A39 S40 P48F32-S36 VanDerWaalsContact O-CB 3.22Å; F32-S36 WeakPolarHBondContact O-CB 3.4Å; F32-S36 PolarHBondContact O-N 2.9Å; W33-S36 PolarHBondContact O-N 2.93Å; W33-S36 VanDerWaalsContact O-N 3.15Å; I34-S36 VanDerWaalsContact C-N 3.35Å; I34-S36 PolarHBondContact O-N 3.09Å; S36-T38 VanDerWaalsContact C-N 3.34Å; S36-A39 PolarHBondContact O-N 3.48Å; S36-S40 WeakPolarHBondContact O-CB 3.36Å; S36-S40 PolarHBondContact O-N 2.87Å; S36-P48 VanDerWaalsContact OG-CA 3.32Å; S36-P48 WeakPolarHBondContact OG-CA 3.39Å
37M68.9Low70.5Confident73 Ų7388 Ų8836%0.3646%0.46SS..Hα-helixtrans-61.4-42.3170.6-75-68.6-58.700111.3W33 I34 S40 T41 P48W33-M37 HydrophobicContact CD2-CG 4.19Å; W33-M37 HydrophobicContact CG-CG 4.36Å; W33-M37 HydrophobicContact CZ2-CG 4.12Å; W33-M37 HydrophobicContact CZ2-SD 4.24Å; W33-M37 WeakPolarHBondContact O-CB 3.37Å; W33-M37 WeakPolarHBondContact O-CG 3.27Å; W33-M37 PolarHBondContact O-N 3.2Å; I34-M37 PolarHBondContact O-N 3.4Å; M37-S40 WeakPolarHBondContact O-CB 3.35Å; M37-S40 PolarHBondContact O-N 2.82Å; M37-T41 PolarHBondContact O-N 2.98Å; M37-T41 PolarHBondContact O-OG1 3.44Å; M37-P48 HydrophobicContact CG-CB 3.98Å; M37-P48 HydrophobicContact CG-CG 4.43Å; M37-P48 HydrophobicContact SD-CB 3.53Å; M37-P48 VanDerWaalsContact SD-CB 3.53Å; M37-P48 HydrophobicContact SD-CG 3.34Å; M37-P48 WeakPolarHBondContact SD-CG 3.38Å
38T73.8Confident70.7Confident88 Ų8886.5 Ų86.554%0.5445%0.45SS..Hα-helixtrans-66.3-43.9179.2-55.40000111I34 M35 S36 T41 Y42I34-T38 WeakPolarHBondContact O-CB 3.18Å; I34-T38 PolarHBondContact O-N 3.16Å; I34-T38 PolarHBondContact O-OG1 3.26Å; M35-T38 PolarHBondContact O-N 2.91Å; S36-T38 VanDerWaalsContact C-N 3.34Å; T38-T41 PolarHBondContact O-N 3.24Å; T38-Y42 WeakPolarHBondContact O-CB 3.48Å; T38-Y42 PolarHBondContact O-N 2.73Å
39A68.3Low71.1Confident28 Ų2883.2 Ų83.223%0.23143%0.433CS..Hα-helixtrans-64.1-39.3174.200000111.9M35 S36 Y42 Y43 L46M35-A39 WeakPolarHBondContact O-CB 3.38Å; M35-A39 PolarHBondContact O-N 3.48Å; S36-A39 PolarHBondContact O-N 3.48Å; A39-Y42 PolarHBondContact O-N 3.39Å; A39-Y43 HydrophobicContact CB-CD2 4.28Å; A39-Y43 WeakPolarHBondContact O-CB 3.29Å; A39-Y43 VanDerWaalsContact O-CD2 3.29Å; A39-Y43 WeakPolarHBondContact O-CD2 3Å; A39-Y43 PolarHBondContact O-N 2.84Å; A39-L46 HydrophobicContact CB-CD1 3.74Å
40S74.3Confident71.9Confident26 Ų2685.3 Ų85.318%0.18245%0.447CS..Hα-helixtrans-60.4-47.8173177.60000111.8S36 M37 Y42 G44 L46S36-S40 WeakPolarHBondContact O-CB 3.36Å; S36-S40 PolarHBondContact O-N 2.87Å; M37-S40 WeakPolarHBondContact O-CB 3.35Å; M37-S40 PolarHBondContact O-N 2.82Å; S40-Y42 VanDerWaalsContact C-N 3.25Å; S40-Y42 PolarHBondContact O-N 3.31Å; S40-G44 VanDerWaalsContact O-CA 3.24Å; S40-G44 WeakPolarHBondContact O-CA 3.31Å; S40-G44 PolarHBondContact O-N 3.23Å; S40-L46 WeakPolarHBondContact CB-O 3.41Å; S40-L46 PolarHBondContact OG-O 3.36Å
41T74.4Confident72.3Confident122 Ų12282.9 Ų82.975%0.74844%0.436SS*.Hα-helixtrans-61.1-34.1176.1-54.20000112.4M37 T38M37-T41 PolarHBondContact O-N 2.98Å; M37-T41 PolarHBondContact O-OG1 3.44Å; T38-T41 PolarHBondContact O-N 3.24Å
42Y74.7Confident72.9Confident188 Ų18889 Ų8974%0.73745%0.449SS*.Hα-helixtrans-82.4-41.7-177.8-160.2-94.5000113.6T38 A39 S40T38-Y42 WeakPolarHBondContact O-CB 3.48Å; T38-Y42 PolarHBondContact O-N 2.73Å; A39-Y42 PolarHBondContact O-N 3.39Å; S40-Y42 VanDerWaalsContact C-N 3.25Å; S40-Y42 PolarHBondContact O-N 3.31Å
43Y73.1Confident73.8Confident158 Ų15885.7 Ų85.762%0.6243%0.434SS*.Hα-helixtrans-98.8-8.4-175.7-66.6-74.3000113.7A39 N45 L46A39-Y43 HydrophobicContact CB-CD2 4.28Å; A39-Y43 WeakPolarHBondContact O-CB 3.29Å; A39-Y43 VanDerWaalsContact O-CD2 3.29Å; A39-Y43 WeakPolarHBondContact O-CD2 3Å; A39-Y43 PolarHBondContact O-N 2.84Å; Y43-N45 PolarHBondContact O-N 3.07Å; Y43-L46 HydrophobicContact CD2-CD1 4.15Å
44G62.1Low74.7Confident60 Ų6083.6 Ų83.662%0.61943%0.426SS*.SBendtrans69.9-24.3175.300000116.4S40S40-G44 VanDerWaalsContact O-CA 3.24Å; S40-G44 WeakPolarHBondContact O-CA 3.31Å; S40-G44 PolarHBondContact O-N 3.23Å
45N63.2Low75.4Confident153 Ų15379.8 Ų79.882%0.81841%0.407SS*.  trans-109.2-5.2-168.8-68.8-19.7000114.6Y43Y43-N45 PolarHBondContact O-N 3.07Å
46L65.3Low76.4Confident84 Ų8479.7 Ų79.744%0.4440%0.404SS..PPolyproline II helixtrans-86.5128.5-178.4-65.8166.7000110.6A39 S40 Y43 P48A39-L46 HydrophobicContact CB-CD1 3.74Å; S40-L46 WeakPolarHBondContact CB-O 3.41Å; S40-L46 PolarHBondContact OG-O 3.36Å; Y43-L46 HydrophobicContact CD2-CD1 4.15Å; L46-P48 WeakPolarHBondContact O-CD 3.17Å
47R69.3Low77.5Confident155 Ų15578.4 Ų78.459%0.58540%0.395SS*.PPolyproline II helixtrans-84.9117.5169.8-70.7-176.6179176.7-0.9109.5I49R47-I49 PolarHBondContact O-N 2.87Å
48P75.7Confident78.6Confident48 Ų4877.1 Ų77.131%0.31239%0.391SS..PPolyproline II helixtrans-71.5131.6-176.726.9-31.9000111.7S36 M37 L46 S50S36-P48 VanDerWaalsContact OG-CA 3.32Å; S36-P48 WeakPolarHBondContact OG-CA 3.39Å; M37-P48 HydrophobicContact CG-CB 3.98Å; M37-P48 HydrophobicContact CG-CG 4.43Å; M37-P48 HydrophobicContact SD-CB 3.53Å; M37-P48 VanDerWaalsContact SD-CB 3.53Å; M37-P48 HydrophobicContact SD-CG 3.34Å; M37-P48 WeakPolarHBondContact SD-CG 3.38Å; L46-P48 WeakPolarHBondContact O-CD 3.17Å; P48-S50 PolarHBondContact O-N 3.43Å
49I82.2Confident79.5Confident26 Ų2674.9 Ų74.913%0.13338%0.377CS..PPolyproline II helixtrans-76.5122.5177.4-64.6162000109.3R47 R53 W54 I91 P156R47-I49 PolarHBondContact O-N 2.87Å; I49-R53 HydrophobicContact CG2-CB 3.83Å; I49-R53 HydrophobicContact CG2-CG 3.95Å; I49-W54 HydrophobicContact CD1-CZ2 4.03Å; I49-W54 VanDerWaalsContact CG2-CD1 3.42Å; I49-W54 HydrophobicContact CG2-CD2 4.5Å; I49-W54 HydrophobicContact CG2-CG 4.08Å; I49-I91 HydrophobicContact CD1-CG2 3.76Å; I49-P156 HydrophobicContact CD1-CG 3.99Å; I49-P156 HydrophobicContact CG1-CB 4.09Å; I49-P156 HydrophobicContact CG1-CG 3.38Å
50S83.4Confident80.8Confident49 Ų4975.2 Ų75.234%0.34338%0.376SS..PPolyproline II helixtrans-59.2147.4-179.372.80000112.6P48 W52 R53 W54P48-S50 PolarHBondContact O-N 3.43Å; S50-W52 PolarHBondContact O-N 2.81Å; S50-R53 WeakPolarHBondContact O-CB 3.48Å; S50-R53 PolarHBondContact O-N 3.32Å; S50-R53 PolarHBondContact OG-N 2.86Å; S50-W54 PolarHBondContact O-N 2.94Å
51P81.8Confident81.8Confident20 Ų2074.2 Ų74.213%0.1337%0.369CS..Hα-helixtrans-58-33177.3-22.931.8000112.7S29 L30 W33 W54 L55S29-P51 VanDerWaalsContact OG-C 3.3Å; S29-P51 VanDerWaalsContact OG-CA 3.24Å; S29-P51 WeakPolarHBondContact OG-CA 3.47Å; S29-P51 PolarHBondContact OG-O 2.69Å; L30-P51 HydrophobicContact CD2-CB 3.85Å; L30-P51 HydrophobicContact CD2-CG 3.85Å; L30-P51 HydrophobicContact CG-CB 4.5Å; W33-P51 HydrophobicContact CB-CB 4.47Å; W33-P51 HydrophobicContact CB-CG 3.69Å; W33-P51 HydrophobicContact CD2-CG 3.41Å; W33-P51 VanDerWaalsContact CD2-CG 3.41Å; W33-P51 HydrophobicContact CE3-CG 3.54Å; W33-P51 VanDerWaalsContact CG-CD 3.48Å; W33-P51 HydrophobicContact CG-CG 3.5Å; W33-P51 VanDerWaalsContact CG-CG 3.5Å; W33-P51 HydrophobicContact CZ3-CG 4.32Å; P51-W54 PolarHBondContact O-N 2.93Å; P51-L55 WeakPolarHBondContact O-CB 3.45Å; P51-L55 PolarHBondContact O-N 2.93Å
52W84.8Confident82.8Confident175 Ų17571.4 Ų71.466%0.66335%0.352SS*.Hα-helixtrans-61.5-47.3174.9-60120.3000110.7S50 W54 L55 F56S50-W52 PolarHBondContact O-N 2.81Å; W52-W54 VanDerWaalsContact C-N 3.33Å; W52-W54 PolarHBondContact O-N 2.96Å; W52-L55 HydrophobicContact CE3-CD2 4.09Å; W52-L55 HydrophobicContact CZ3-CD2 4.09Å; W52-L55 WeakPolarHBondContact O-CB 3.22Å; W52-L55 PolarHBondContact O-N 3.06Å; W52-L55 VanDerWaalsContact O-N 3.09Å; W52-F56 HydrophobicContact CB-CD2 4.42Å; W52-F56 WeakPolarHBondContact O-CD2 3.3Å; W52-F56 PolarHBondContact O-N 2.67Å
53R90.3Very high83.7Confident20 Ų2067.7 Ų67.78%0.07534%0.344CS..Hα-helixtrans-59.8-42.9179.1-176.3169.8-61.5-143.7-1.6112.4I49 S50 F56 S57 I91 A92 F94 E158I49-R53 HydrophobicContact CG2-CB 3.83Å; I49-R53 HydrophobicContact CG2-CG 3.95Å; S50-R53 WeakPolarHBondContact O-CB 3.48Å; S50-R53 PolarHBondContact O-N 3.32Å; S50-R53 PolarHBondContact OG-N 2.86Å; R53-F56 PolarHBondContact O-N 3.44Å; R53-S57 WeakPolarHBondContact O-CB 3.5Å; R53-S57 PolarHBondContact O-N 2.95Å; R53-S57 PolarHBondContact O-OG 2.84Å; R53-I91 VanDerWaalsContact CD-O 3.24Å; R53-I91 WeakPolarHBondContact CD-O 3.4Å; R53-I91 PolarHBondContact NH1-O 3.36Å; R53-A92 PolarHBondContact NH1-O 2.77Å; R53-F94 HydrophobicContact CB-CZ 4.27Å; R53-F94 HydrophobicContact CG-CE1 4.22Å; R53-F94 HydrophobicContact CG-CZ 4.13Å; R53-E158 IonicContact CZ-OE1 2.78Å; R53-E158 IonicContact CZ-OE2 2.71Å; R53-E158 IonicContact NH1-OE1 2.78Å; R53-E158 PolarHBondContact NH1-OE1 3.4Å; R53-E158 IonicContact NH2-OE1 3.44Å; R53-E158 PolarHBondContact NH2-OE1 3.45Å; R53-E158 IonicContact NH2-OE2 3.42Å; R53-E158 PolarHBondContact NH2-OE2 2.92Å
54W88.1Confident84.8Confident46 Ų4662 Ų6217%0.17432%0.324CS..Hα-helixtrans-60.4-42173-86114.2000113.2S29 F32 I49 S50 P51 W52 S57 V58 F87 I91S29-W54 WeakPolarHBondContact OG-CB 3.36Å; F32-W54 HydrophobicContact CB-CD2 4.33Å; F32-W54 HydrophobicContact CB-CZ2 4.26Å; F32-W54 HydrophobicContact CG-CZ2 4.37Å; I49-W54 HydrophobicContact CD1-CZ2 4.03Å; I49-W54 VanDerWaalsContact CG2-CD1 3.42Å; I49-W54 HydrophobicContact CG2-CD2 4.5Å; I49-W54 HydrophobicContact CG2-CG 4.08Å; S50-W54 PolarHBondContact O-N 2.94Å; P51-W54 PolarHBondContact O-N 2.93Å; W52-W54 VanDerWaalsContact C-N 3.33Å; W52-W54 PolarHBondContact O-N 2.96Å; W54-S57 PolarHBondContact O-OG 3.22Å; W54-V58 PolarHBondContact O-N 3.31Å; W54-F87 HydrophobicContact CE3-CE2 4.28Å; W54-F87 HydrophobicContact CE3-CZ 4.33Å; W54-F87 HydrophobicContact CH2-CZ 4.32Å; W54-F87 AromaticContact CZ3-CE2 3.96Å; W54-F87 HydrophobicContact CZ3-CE2 3.96Å; W54-F87 AromaticContact CZ3-CZ 3.59Å; W54-F87 HydrophobicContact CZ3-CZ 3.59Å; W54-I91 HydrophobicContact CD2-CD1 4.34Å; W54-I91 HydrophobicContact CE3-CD1 3.83Å; W54-I91 HydrophobicContact CH2-CD1 3.82Å; W54-I91 HydrophobicContact CZ2-CD1 4.32Å; W54-I91 HydrophobicContact CZ3-CD1 3.59Å
55L89.1Confident86.3Confident22 Ų2259.7 Ų59.712%0.11530%0.298CS..Hα-helixtrans-65.4-47.8177.2-179.864.6000111L22 I25 I26 P51 W52 V58 V59L22-L55 HydrophobicContact CD1-CD1 4.26Å; I25-L55 HydrophobicContact CB-CD1 4.4Å; I25-L55 HydrophobicContact CG2-CD1 3.6Å; I26-L55 HydrophobicContact CG1-CD1 3.9Å; I26-L55 HydrophobicContact CG1-CD2 4.19Å; P51-L55 WeakPolarHBondContact O-CB 3.45Å; P51-L55 PolarHBondContact O-N 2.93Å; W52-L55 HydrophobicContact CE3-CD2 4.09Å; W52-L55 HydrophobicContact CZ3-CD2 4.09Å; W52-L55 WeakPolarHBondContact O-CB 3.22Å; W52-L55 PolarHBondContact O-N 3.06Å; W52-L55 VanDerWaalsContact O-N 3.09Å; L55-V58 PolarHBondContact O-N 2.65Å; L55-V59 HydrophobicContact CD1-CG2 3.7Å; L55-V59 HydrophobicContact CG-CG2 4.25Å; L55-V59 WeakPolarHBondContact O-CB 3.46Å; L55-V59 WeakPolarHBondContact O-CG2 3.39Å; L55-V59 PolarHBondContact O-N 2.87Å
56F92.2Very high87.7Confident105 Ų10554.7 Ų54.746%0.46128%0.275SS..Hα-helixtrans-64.6-39.2-179.3-86-85.6000112.2W52 R53 V58 V60 P61W52-F56 HydrophobicContact CB-CD2 4.42Å; W52-F56 WeakPolarHBondContact O-CD2 3.3Å; W52-F56 PolarHBondContact O-N 2.67Å; R53-F56 PolarHBondContact O-N 3.44Å; F56-V58 PolarHBondContact O-N 3.32Å; F56-V60 HydrophobicContact CD1-CG2 3.64Å; F56-V60 HydrophobicContact CE1-CG2 4.38Å; F56-V60 WeakPolarHBondContact O-CB 3.32Å; F56-V60 WeakPolarHBondContact O-CG2 3.39Å; F56-V60 PolarHBondContact O-N 3.18Å; F56-P61 WeakPolarHBondContact O-CD 3.47Å
57S93.1Very high89.1Confident1 Ų153.6 Ų53.61%0.00727%0.269CS..Hα-helixtrans-66.3-22.2179.269.10000114R53 W54 P61 F87 T90 I91R53-S57 WeakPolarHBondContact O-CB 3.5Å; R53-S57 PolarHBondContact O-N 2.95Å; R53-S57 PolarHBondContact O-OG 2.84Å; W54-S57 PolarHBondContact O-OG 3.22Å; S57-P61 VanDerWaalsContact O-CD 3.24Å; S57-P61 WeakPolarHBondContact O-CD 3.26Å; S57-P61 WeakPolarHBondContact O-CG 3.2Å; S57-F87 WeakPolarHBondContact O-CD2 3.31Å; S57-F87 WeakPolarHBondContact OG-CE2 3.38Å; S57-T90 VanDerWaalsContact CA-CG2 3.49Å; S57-I91 VanDerWaalsContact CB-CG1 3.46Å; S57-I91 WeakPolarHBondContact OG-CG1 3.42Å
58V91.6Very high90.1Very high46 Ų4646.4 Ų46.428%0.27924%0.243SC..Hα-helixtrans-92.4-54.3173.41780000110.5I25 W54 L55 F56 V62 F87I25-V58 HydrophobicContact CD1-CG1 4.11Å; I25-V58 HydrophobicContact CG2-CB 4.33Å; I25-V58 HydrophobicContact CG2-CG1 4.29Å; W54-V58 PolarHBondContact O-N 3.31Å; L55-V58 PolarHBondContact O-N 2.65Å; F56-V58 PolarHBondContact O-N 3.32Å; V58-V62 WeakPolarHBondContact O-CB 3.33Å; V58-V62 WeakPolarHBondContact O-CG2 3.16Å; V58-V62 PolarHBondContact O-N 3.06Å; V58-F87 HydrophobicContact CG2-CD2 4.13Å; V58-F87 HydrophobicContact CG2-CE2 3.97Å
59V92.9Very high90.9Very high40 Ų4046.7 Ų46.724%0.24224%0.242CC..Hα-helixtrans-66.4-45.9-169.7173.20000111.5L22 L55 V62 L63L22-V59 HydrophobicContact CD1-CG2 4.37Å; L55-V59 HydrophobicContact CD1-CG2 3.7Å; L55-V59 HydrophobicContact CG-CG2 4.25Å; L55-V59 WeakPolarHBondContact O-CB 3.46Å; L55-V59 WeakPolarHBondContact O-CG2 3.39Å; L55-V59 PolarHBondContact O-N 2.87Å; V59-V62 PolarHBondContact O-N 3.38Å; V59-L63 HydrophobicContact CG1-CD1 3.87Å; V59-L63 HydrophobicContact CG1-CG 4.34Å; V59-L63 VanDerWaalsContact O-CG 3.29Å; V59-L63 WeakPolarHBondContact O-CG 3.32Å; V59-L63 PolarHBondContact O-N 2.67Å
60V95Very high91.4Very high36 Ų3653.7 Ų53.722%0.21827%0.271CS..Hα-helixtrans-69.3-50.4-173.7-174.10000111.6F56 V62 L63 I64 F97F56-V60 HydrophobicContact CD1-CG2 3.64Å; F56-V60 HydrophobicContact CE1-CG2 4.38Å; F56-V60 WeakPolarHBondContact O-CB 3.32Å; F56-V60 WeakPolarHBondContact O-CG2 3.39Å; F56-V60 PolarHBondContact O-N 3.18Å; V60-V62 VanDerWaalsContact C-N 3.28Å; V60-V62 PolarHBondContact O-N 2.88Å; V60-L63 PolarHBondContact O-N 2.95Å; V60-L63 VanDerWaalsContact O-N 3.13Å; V60-I64 HydrophobicContact CG1-CG1 4.18Å; V60-I64 WeakPolarHBondContact O-CG1 3.36Å; V60-I64 PolarHBondContact O-N 2.89Å; V60-F97 HydrophobicContact CB-CE1 4.37Å; V60-F97 HydrophobicContact CB-CZ 4.28Å; V60-F97 HydrophobicContact CG1-CE1 3.67Å; V60-F97 HydrophobicContact CG1-CZ 3.6Å
61P95.6Very high91.7Very high4 Ų456.8 Ų56.83%0.02628%0.278CS..Hα-helixtrans-56.9-40175.2-29.840.3000113.2F56 S57 L63 I64 V65 L83 F97F56-P61 WeakPolarHBondContact O-CD 3.47Å; S57-P61 VanDerWaalsContact O-CD 3.24Å; S57-P61 WeakPolarHBondContact O-CD 3.26Å; S57-P61 WeakPolarHBondContact O-CG 3.2Å; P61-L63 PolarHBondContact O-N 3.17Å; P61-I64 PolarHBondContact O-N 2.95Å; P61-V65 WeakPolarHBondContact O-CB 3.15Å; P61-V65 WeakPolarHBondContact O-CG2 3.24Å; P61-V65 PolarHBondContact O-N 2.88Å; P61-L83 HydrophobicContact CB-CD2 4.29Å; P61-F97 HydrophobicContact CG-CE2 4.03Å; P61-F97 HydrophobicContact CG-CZ 4.46Å
62V94.8Very high92.1Very high64 Ų6460.7 Ų60.739%0.38829%0.293SS..Hα-helixtrans-59.9-45.2175.5169.50000111.9V58 V59 V60 S66 L83V58-V62 WeakPolarHBondContact O-CB 3.33Å; V58-V62 WeakPolarHBondContact O-CG2 3.16Å; V58-V62 PolarHBondContact O-N 3.06Å; V59-V62 PolarHBondContact O-N 3.38Å; V60-V62 VanDerWaalsContact C-N 3.28Å; V60-V62 PolarHBondContact O-N 2.88Å; V62-S66 WeakPolarHBondContact O-CB 3.31Å; V62-S66 PolarHBondContact O-N 2.63Å; V62-S66 PolarHBondContact O-OG 2.8Å; V62-L83 HydrophobicContact CB-CD2 4.3Å; V62-L83 HydrophobicContact CG2-CD2 3.73Å
63L95.1Very high92.3Very high109 Ų10952.5 Ų52.557%0.57126%0.263SS*.Hα-helixtrans-63.5-43177.3-71.3174.3000111.8V59 V60 P61 N67V59-L63 HydrophobicContact CG1-CD1 3.87Å; V59-L63 HydrophobicContact CG1-CG 4.34Å; V59-L63 VanDerWaalsContact O-CG 3.29Å; V59-L63 WeakPolarHBondContact O-CG 3.32Å; V59-L63 PolarHBondContact O-N 2.67Å; V60-L63 PolarHBondContact O-N 2.95Å; V60-L63 VanDerWaalsContact O-N 3.13Å; P61-L63 PolarHBondContact O-N 3.17Å; L63-N67 WeakPolarHBondContact O-CB 3.14Å; L63-N67 PolarHBondContact O-N 3.13Å
64I95.3Very high92.3Very high39 Ų3952 Ų5220%0.226%0.262CS..Hα-helixtrans-68.5-46.7-178.1-62.5-59.5000111.4V60 P61 N67 G68 L101 F104V60-I64 HydrophobicContact CG1-CG1 4.18Å; V60-I64 WeakPolarHBondContact O-CG1 3.36Å; V60-I64 PolarHBondContact O-N 2.89Å; P61-I64 PolarHBondContact O-N 2.95Å; I64-N67 WeakPolarHBondContact O-CB 3.48Å; I64-N67 PolarHBondContact O-N 3.33Å; I64-G68 PolarHBondContact O-N 3.48Å; I64-L101 HydrophobicContact CD1-CD1 3.77Å; I64-L101 HydrophobicContact CG1-CD1 3.87Å; I64-L101 HydrophobicContact CG2-CD1 3.96Å; I64-F104 HydrophobicContact CG2-CD1 3.95Å; I64-F104 HydrophobicContact CG2-CE1 3.96Å
65V94.1Very high92.5Very high12 Ų1252 Ų527%0.07327%0.265CS..Hα-helixtrans-63.3-43176.4166.70000111.1P61 N67 G68 L69 A79 L83P61-V65 WeakPolarHBondContact O-CB 3.15Å; P61-V65 WeakPolarHBondContact O-CG2 3.24Å; P61-V65 PolarHBondContact O-N 2.88Å; V65-N67 VanDerWaalsContact C-N 3.29Å; V65-N67 PolarHBondContact O-N 3.29Å; V65-G68 WeakPolarHBondContact O-CA 3.32Å; V65-G68 PolarHBondContact O-N 3.32Å; V65-G68 VanDerWaalsContact O-N 3.08Å; V65-L69 HydrophobicContact CG1-CD1 4.42Å; V65-L69 PolarHBondContact O-N 3.26Å; V65-A79 VanDerWaalsContact CG1-CA 3.47Å; V65-A79 HydrophobicContact CG1-CB 3.26Å; V65-L83 HydrophobicContact CB-CD2 3.92Å; V65-L83 HydrophobicContact CB-CG 4.23Å; V65-L83 HydrophobicContact CG1-CD2 4.32Å; V65-L83 HydrophobicContact CG1-CG 4.18Å; V65-L83 HydrophobicContact CG2-CD2 3.86Å; V65-L83 HydrophobicContact CG2-CG 4.01Å
66S93.1Very high92.7Very high48 Ų4858.4 Ų58.434%0.33629%0.294SS..Hα-helixtrans-59.5-40.4175.2-65.20000112.1V62 K70V62-S66 WeakPolarHBondContact O-CB 3.31Å; V62-S66 PolarHBondContact O-N 2.63Å; V62-S66 PolarHBondContact O-OG 2.8Å; S66-K70 VanDerWaalsContact O-CG 3.3Å; S66-K70 WeakPolarHBondContact O-CG 3.44Å; S66-K70 PolarHBondContact O-N 3.16Å
67N92.9Very high92.7Very high61 Ų6155.3 Ų55.333%0.32629%0.286SS..Hα-helixtrans-69.1-38.2174.6-165.225.1000111.6L63 I64 V65 K70 K71L63-N67 WeakPolarHBondContact O-CB 3.14Å; L63-N67 PolarHBondContact O-N 3.13Å; I64-N67 WeakPolarHBondContact O-CB 3.48Å; I64-N67 PolarHBondContact O-N 3.33Å; V65-N67 VanDerWaalsContact C-N 3.29Å; V65-N67 PolarHBondContact O-N 3.29Å; N67-K70 PolarHBondContact O-N 3.18Å; N67-K71 PolarHBondContact ND2-NZ 3.01Å; N67-K71 VanDerWaalsContact O-CB 3.23Å; N67-K71 WeakPolarHBondContact O-CB 3.5Å; N67-K71 VanDerWaalsContact O-CG 3.31Å; N67-K71 WeakPolarHBondContact O-CG 3.26Å; N67-K71 PolarHBondContact O-N 3.17Å; N67-K71 WeakPolarHBondContact OD1-CE 3.3Å
68G91.6Very high92.7Very high3 Ų355.3 Ų55.33%0.03129%0.285CS..Hα-helixtrans-58.9-47.1175.700000112.4I64 V65 K71 K72 S73 L74I64-G68 PolarHBondContact O-N 3.48Å; V65-G68 WeakPolarHBondContact O-CA 3.32Å; V65-G68 PolarHBondContact O-N 3.32Å; V65-G68 VanDerWaalsContact O-N 3.08Å; G68-K71 CarbonylContact O-C 3.56Å; G68-K71 PolarHBondContact O-N 3.2Å; G68-K72 PolarHBondContact O-N 3.25Å; G68-K72 VanDerWaalsContact O-N 3.1Å; G68-S73 PolarHBondContact O-N 2.83Å; G68-L74 PolarHBondContact O-N 3.45Å
69L92.8Very high92.7Very high55 Ų5553.4 Ų53.429%0.28827%0.274SS..Hα-helixtrans-60.9-51174.5-73.6172.1000111.8V65 K71 K72 D75 A79V65-L69 HydrophobicContact CG1-CD1 4.42Å; V65-L69 PolarHBondContact O-N 3.26Å; L69-K71 PolarHBondContact O-N 3.1Å; L69-K72 PolarHBondContact O-N 2.97Å; L69-D75 WeakPolarHBondContact CD2-O 3.38Å; L69-A79 HydrophobicContact CD1-CB 3.84Å; L69-A79 HydrophobicContact CD2-CB 3.82Å; L69-A79 HydrophobicContact CG-CB 3.87Å
70K91.4Very high92.7Very high172 Ų17257.1 Ų57.175%0.74829%0.292SS*.Hα-helixtrans-57.7-36.7178.6-74.1174.6-173.6175.60112.6S66 N67 K72S66-K70 VanDerWaalsContact O-CG 3.3Å; S66-K70 WeakPolarHBondContact O-CG 3.44Å; S66-K70 PolarHBondContact O-N 3.16Å; N67-K70 PolarHBondContact O-N 3.18Å; K70-K72 VanDerWaalsContact C-N 3.3Å
71K90.4Very high92.5Very high114 Ų11456.4 Ų56.450%0.49629%0.292SS..THydrogen-bonded Turntrans-86.94.5179.6-72-177.2175.8177.50112.9N67 G68 L69 S73 K112N67-K71 PolarHBondContact ND2-NZ 3.01Å; N67-K71 VanDerWaalsContact O-CB 3.23Å; N67-K71 WeakPolarHBondContact O-CB 3.5Å; N67-K71 VanDerWaalsContact O-CG 3.31Å; N67-K71 WeakPolarHBondContact O-CG 3.26Å; N67-K71 PolarHBondContact O-N 3.17Å; N67-K71 WeakPolarHBondContact OD1-CE 3.3Å; G68-K71 CarbonylContact O-C 3.56Å; G68-K71 PolarHBondContact O-N 3.2Å; L69-K71 PolarHBondContact O-N 3.1Å; K71-S73 PolarHBondContact O-N 3.3Å; K71-S73 VanDerWaalsContact O-N 3.17Å; K71-K112 VanDerWaalsContact O-CE 3.31Å; K71-K112 WeakPolarHBondContact O-CE 3.36Å; K71-K112 PolarHBondContact O-NZ 2.96Å
72K90.1Very high92.4Very high102 Ų10257 Ų5744%0.44330%0.299SS..THydrogen-bonded Turntrans5427.1-174.8-56.8-178.4176.4-1800114.4G68 L69 K70 E127 G128 Q130G68-K72 PolarHBondContact O-N 3.25Å; G68-K72 VanDerWaalsContact O-N 3.1Å; L69-K72 PolarHBondContact O-N 2.97Å; K70-K72 VanDerWaalsContact C-N 3.3Å; K72-E127 IonicContact NZ-OE2 3Å; K72-E127 PolarHBondContact NZ-OE2 3.22Å; K72-G128 CarbonylContact O-C 3.59Å; K72-G128 VanDerWaalsContact O-C 3.23Å; K72-G128 VanDerWaalsContact O-O 3.07Å; K72-Q130 HydrophobicContact CB-CG 4.21Å; K72-Q130 VanDerWaalsContact O-CG 3.23Å; K72-Q130 WeakPolarHBondContact O-CG 3.35Å; K72-Q130 PolarHBondContact O-N 3.47Å
73S88.9Confident92.5Very high3 Ų356.5 Ų56.52%0.02129%0.294CS..SBendtrans-86.8-19.6176.2-68.30000113.2G68 K71 K112 G128 R131G68-S73 PolarHBondContact O-N 2.83Å; K71-S73 PolarHBondContact O-N 3.3Å; K71-S73 VanDerWaalsContact O-N 3.17Å; S73-K112 WeakPolarHBondContact OG-CE 3.21Å; S73-K112 PolarHBondContact OG-NZ 3Å; S73-G128 WeakPolarHBondContact CA-O 3.44Å; S73-R131 PolarHBondContact O-N 3.13Å; S73-R131 VanDerWaalsContact O-N 3.15Å
74L90.4Very high92.4Very high11 Ų1155.1 Ų55.16%0.05829%0.29CS..BIsolated β-bridgetrans-131.7147.8173.6-79.4154.4000107.8G68 F104 R131 V136G68-L74 PolarHBondContact O-N 3.45Å; L74-F104 HydrophobicContact CD1-CE1 4.3Å; L74-F104 HydrophobicContact CD1-CE2 3.48Å; L74-F104 VanDerWaalsContact CD1-CE2 3.48Å; L74-F104 HydrophobicContact CD1-CZ 3.33Å; L74-F104 HydrophobicContact CD2-CE2 4.27Å; L74-F104 HydrophobicContact CG-CE2 3.71Å; L74-F104 HydrophobicContact CG-CZ 3.88Å; L74-R131 HydrophobicContact CD2-CB 4.02Å; L74-V136 HydrophobicContact CD2-CG2 3.84Å
75D92.9Very high92.5Very high44 Ų4454 Ų5424%0.23529%0.285CS..  trans-88.3179.1163.375.325.4000111L69 S77 G78 A79 R131 N132L69-D75 WeakPolarHBondContact CD2-O 3.38Å; D75-S77 VanDerWaalsContact C-N 3.29Å; D75-S77 PolarHBondContact O-N 3.11Å; D75-S77 WeakPolarHBondContact OD1-CA 3.27Å; D75-S77 WeakPolarHBondContact OD1-CB 3.49Å; D75-S77 PolarHBondContact OD1-N 3.35Å; D75-S77 PolarHBondContact OD1-OG 2.96Å; D75-S77 PolarHBondContact OD2-OG 3.42Å; D75-G78 PolarHBondContact O-N 2.79Å; D75-G78 PolarHBondContact OD1-N 2.83Å; D75-A79 VanDerWaalsContact O-CB 3.24Å; D75-A79 WeakPolarHBondContact O-CB 3.48Å; D75-A79 PolarHBondContact O-N 3.23Å; D75-R131 PolarHBondContact N-O 3.23Å; D75-N132 VanDerWaalsContact OD2-CA 3.3Å; D75-N132 WeakPolarHBondContact OD2-CA 3.34Å; D75-N132 WeakPolarHBondContact OD2-CB 3.31Å
76H92.8Very high92.6Very high158 Ų15853.5 Ų53.573%0.73128%0.282SS*.Hα-helixtrans-62.4-33.1-179.5-70.8-73.5000113.8A79 L80H76-A79 WeakPolarHBondContact O-CB 3.37Å; H76-L80 PolarHBondContact O-N 3.36Å
77S92.4Very high92.8Very high40 Ų4054.5 Ų54.528%0.2828%0.28SS..Hα-helixtrans-75.3-43.5178.875.30000111.3D75 A79 L80 G81 W133D75-S77 VanDerWaalsContact C-N 3.29Å; D75-S77 PolarHBondContact O-N 3.11Å; D75-S77 WeakPolarHBondContact OD1-CA 3.27Å; D75-S77 WeakPolarHBondContact OD1-CB 3.49Å; D75-S77 PolarHBondContact OD1-N 3.35Å; D75-S77 PolarHBondContact OD1-OG 2.96Å; D75-S77 PolarHBondContact OD2-OG 3.42Å; S77-A79 VanDerWaalsContact C-N 3.28Å; S77-A79 PolarHBondContact O-N 3.4Å; S77-L80 PolarHBondContact O-N 3.04Å; S77-G81 PolarHBondContact O-N 3.06Å; S77-G81 VanDerWaalsContact O-N 3.09Å; S77-W133 PolarHBondContact OG-N 3.41Å
78G91.8Very high92.9Very high0 Ų052.9 Ų52.90%027%0.271CS..Hα-helixtrans-64.4-35.317400000111.4D75 G81 G82D75-G78 PolarHBondContact O-N 2.79Å; D75-G78 PolarHBondContact OD1-N 2.83Å; G78-G81 PolarHBondContact O-N 2.86Å; G78-G82 PolarHBondContact O-N 2.86Å
79A92.9Very high93.2Very high6 Ų652.7 Ų52.75%0.0527%0.27CS..Hα-helixtrans-58-48172.600000112V65 L69 D75 H76 S77 G82 L83V65-A79 VanDerWaalsContact CG1-CA 3.47Å; V65-A79 HydrophobicContact CG1-CB 3.26Å; L69-A79 HydrophobicContact CD1-CB 3.84Å; L69-A79 HydrophobicContact CD2-CB 3.82Å; L69-A79 HydrophobicContact CG-CB 3.87Å; D75-A79 VanDerWaalsContact O-CB 3.24Å; D75-A79 WeakPolarHBondContact O-CB 3.48Å; D75-A79 PolarHBondContact O-N 3.23Å; H76-A79 WeakPolarHBondContact O-CB 3.37Å; S77-A79 VanDerWaalsContact C-N 3.28Å; S77-A79 PolarHBondContact O-N 3.4Å; A79-G82 PolarHBondContact O-N 3.48Å; A79-L83 WeakPolarHBondContact O-CG 3.34Å; A79-L83 PolarHBondContact O-N 3Å
80L92.6Very high93.4Very high119 Ų11950.2 Ų50.262%0.62326%0.257SS*.Hα-helixtrans-62.6-46.9177.7-176.263.6000111.7H76 S77 G82 L83 V84H76-L80 PolarHBondContact O-N 3.36Å; S77-L80 PolarHBondContact O-N 3.04Å; L80-G82 VanDerWaalsContact C-N 3.31Å; L80-G82 PolarHBondContact O-N 2.87Å; L80-L83 PolarHBondContact O-N 3.09Å; L80-V84 PolarHBondContact O-N 3.45Å
81G90.4Very high93.5Very high20 Ų2042.5 Ų42.521%0.20622%0.224CC..Hα-helixtrans-59.2-42.6175.300000112.2S77 G78 L83 V84 V85S77-G81 PolarHBondContact O-N 3.06Å; S77-G81 VanDerWaalsContact O-N 3.09Å; G78-G81 PolarHBondContact O-N 2.86Å; G81-L83 VanDerWaalsContact C-N 3.32Å; G81-L83 PolarHBondContact O-N 3.44Å; G81-V84 PolarHBondContact O-N 2.91Å; G81-V85 WeakPolarHBondContact O-CG2 3.45Å; G81-V85 PolarHBondContact O-N 3.33Å
82G94.1Very high93.7Very high17 Ų1737 Ų3718%0.17520%0.2CC..Hα-helixtrans-66.6-31.7-179.600000113.2G78 A79 L80 G86G78-G82 PolarHBondContact O-N 2.86Å; A79-G82 PolarHBondContact O-N 3.48Å; L80-G82 VanDerWaalsContact C-N 3.31Å; L80-G82 PolarHBondContact O-N 2.87Å; G82-G86 WeakPolarHBondContact O-CA 3.28Å; G82-G86 PolarHBondContact O-N 3.24Å
83L95.8Very high94Very high54 Ų5432.2 Ų32.228%0.28318%0.179SC..Hα-helixtrans-64.3-47.2172-72.5175.7000111.2P61 V62 V65 A79 L80 G81 F87P61-L83 HydrophobicContact CB-CD2 4.29Å; V62-L83 HydrophobicContact CB-CD2 4.3Å; V62-L83 HydrophobicContact CG2-CD2 3.73Å; V65-L83 HydrophobicContact CB-CD2 3.92Å; V65-L83 HydrophobicContact CB-CG 4.23Å; V65-L83 HydrophobicContact CG1-CD2 4.32Å; V65-L83 HydrophobicContact CG1-CG 4.18Å; V65-L83 HydrophobicContact CG2-CD2 3.86Å; V65-L83 HydrophobicContact CG2-CG 4.01Å; A79-L83 WeakPolarHBondContact O-CG 3.34Å; A79-L83 PolarHBondContact O-N 3Å; L80-L83 PolarHBondContact O-N 3.09Å; G81-L83 VanDerWaalsContact C-N 3.32Å; G81-L83 PolarHBondContact O-N 3.44Å; L83-F87 WeakPolarHBondContact O-CB 3.3Å; L83-F87 PolarHBondContact O-N 3.17Å
84V93.9Very high94.3Very high80 Ų8033.5 Ų33.549%0.48518%0.184SC..Hα-helixtrans-64-52.4-179.2175.50000110.6L80 G81 G86 F87 I88L80-V84 PolarHBondContact O-N 3.45Å; G81-V84 PolarHBondContact O-N 2.91Å; V84-G86 PolarHBondContact O-N 3.09Å; V84-F87 PolarHBondContact O-N 3.24Å; V84-I88 HydrophobicContact CG1-CD1 3.84Å; V84-I88 WeakPolarHBondContact O-CG1 3.37Å; V84-I88 PolarHBondContact O-N 3.21Å
85V96.4Very high94.6Very high15 Ų1533 Ų339%0.09118%0.182CC..Hα-helixtrans-59.9-48.7179.1174.20000110.4G81 F87 I88 L89 L100 V136G81-V85 WeakPolarHBondContact O-CG2 3.45Å; G81-V85 PolarHBondContact O-N 3.33Å; V85-F87 VanDerWaalsContact C-N 3.35Å; V85-F87 PolarHBondContact O-N 3.41Å; V85-I88 PolarHBondContact O-N 2.95Å; V85-L89 HydrophobicContact CG1-CD1 4.15Å; V85-L89 WeakPolarHBondContact O-CB 3.45Å; V85-L89 WeakPolarHBondContact O-CD1 3.16Å; V85-L89 PolarHBondContact O-N 2.97Å; V85-L100 HydrophobicContact CG1-CD1 4.4Å; V85-L100 HydrophobicContact CG1-CD2 3.8Å; V85-V136 HydrophobicContact CG2-CG1 4.2Å
86G97.3Very high94.9Very high2 Ų230.9 Ų30.92%0.02117%0.171CC..Hα-helixtrans-61.5-41.618000000112.9G82 V84 T90G82-G86 WeakPolarHBondContact O-CA 3.28Å; G82-G86 PolarHBondContact O-N 3.24Å; V84-G86 PolarHBondContact O-N 3.09Å; G86-T90 WeakPolarHBondContact O-CB 3.36Å; G86-T90 PolarHBondContact O-N 3.43Å; G86-T90 PolarHBondContact O-OG1 3.09Å
87F96.1Very high95.1Very high68 Ų6824.2 Ų24.230%0.29814%0.139SC..Hα-helixtrans-62.4-51.4177.1171-93.2000111.7W54 S57 V58 L83 V84 V85 L89 T90 I91W54-F87 HydrophobicContact CE3-CE2 4.28Å; W54-F87 HydrophobicContact CE3-CZ 4.33Å; W54-F87 HydrophobicContact CH2-CZ 4.32Å; W54-F87 AromaticContact CZ3-CE2 3.96Å; W54-F87 HydrophobicContact CZ3-CE2 3.96Å; W54-F87 AromaticContact CZ3-CZ 3.59Å; W54-F87 HydrophobicContact CZ3-CZ 3.59Å; S57-F87 WeakPolarHBondContact O-CD2 3.31Å; S57-F87 WeakPolarHBondContact OG-CE2 3.38Å; V58-F87 HydrophobicContact CG2-CD2 4.13Å; V58-F87 HydrophobicContact CG2-CE2 3.97Å; L83-F87 WeakPolarHBondContact O-CB 3.3Å; L83-F87 PolarHBondContact O-N 3.17Å; V84-F87 PolarHBondContact O-N 3.24Å; V85-F87 VanDerWaalsContact C-N 3.35Å; V85-F87 PolarHBondContact O-N 3.41Å; F87-L89 PolarHBondContact O-N 3.33Å; F87-T90 PolarHBondContact O-N 2.84Å; F87-I91 HydrophobicContact CD1-CD1 4.3Å; F87-I91 HydrophobicContact CD2-CD1 4.26Å; F87-I91 HydrophobicContact CE1-CD1 3.61Å; F87-I91 HydrophobicContact CE2-CD1 3.56Å; F87-I91 HydrophobicContact CE2-CG1 4.35Å; F87-I91 HydrophobicContact CZ-CD1 3.2Å; F87-I91 HydrophobicContact CZ-CG1 4.31Å; F87-I91 PolarHBondContact O-N 3.37Å
88I95.6Very high95.4Very high27 Ų2723.8 Ų23.814%0.13814%0.135CC..Hα-helixtrans-60.2-49.2-178.6-68169.4000110.5V84 V85 T90 I91 A92 T144 A147 L148 M151V84-I88 HydrophobicContact CG1-CD1 3.84Å; V84-I88 WeakPolarHBondContact O-CG1 3.37Å; V84-I88 PolarHBondContact O-N 3.21Å; V85-I88 PolarHBondContact O-N 2.95Å; I88-T90 VanDerWaalsContact C-N 3.3Å; I88-T90 PolarHBondContact O-N 2.98Å; I88-I91 PolarHBondContact O-N 2.85Å; I88-A92 WeakPolarHBondContact O-CB 3.43Å; I88-A92 PolarHBondContact O-N 3.4Å; I88-T144 HydrophobicContact CB-CG2 4.22Å; I88-T144 HydrophobicContact CD1-CG2 3.51Å; I88-T144 HydrophobicContact CG1-CG2 4.46Å; I88-T144 HydrophobicContact CG2-CG2 3.96Å; I88-A147 HydrophobicContact CG2-CB 4.18Å; I88-L148 HydrophobicContact CD1-CD2 4.49Å; I88-L148 HydrophobicContact CG2-CD2 3.87Å; I88-L148 HydrophobicContact CG2-CG 3.95Å; I88-M151 HydrophobicContact CG2-CE 4.05Å
89L97.8Very high95.7Very high0 Ų023.8 Ų23.80%014%0.135CC..Hα-helixtrans-63.6-36.4-179.8-90.267.3000111.9V85 F87 A92 N93 F96 F97 L100 P143 A147 L180V85-L89 HydrophobicContact CG1-CD1 4.15Å; V85-L89 WeakPolarHBondContact O-CB 3.45Å; V85-L89 WeakPolarHBondContact O-CD1 3.16Å; V85-L89 PolarHBondContact O-N 2.97Å; F87-L89 PolarHBondContact O-N 3.33Å; L89-A92 PolarHBondContact O-N 2.9Å; L89-N93 CarbonylContact O-C 3.52Å; L89-N93 PolarHBondContact O-N 3.38Å; L89-N93 VanDerWaalsContact O-N 3.08Å; L89-F96 HydrophobicContact CB-CB 4.2Å; L89-F96 HydrophobicContact CD2-CB 4.24Å; L89-F96 HydrophobicContact CG-CB 4.04Å; L89-F97 HydrophobicContact CB-CB 4.4Å; L89-L100 HydrophobicContact CD2-CB 3.95Å; L89-L100 HydrophobicContact CD2-CD2 4.09Å; L89-L100 HydrophobicContact CD2-CG 4.5Å; L89-P143 HydrophobicContact CD2-CB 4.16Å; L89-A147 HydrophobicContact CD1-CB 3.94Å; L89-A147 HydrophobicContact CG-CB 4.23Å; L89-L180 HydrophobicContact CD2-CD1 4.48Å
90T96.8Very high95.9Very high2 Ų224.8 Ų24.81%0.01214%0.14CC..Hα-helixtrans-69.4-38.4178.4-52.40000112.2S57 G86 F87 I88 F94 F97S57-T90 VanDerWaalsContact CA-CG2 3.49Å; G86-T90 WeakPolarHBondContact O-CB 3.36Å; G86-T90 PolarHBondContact O-N 3.43Å; G86-T90 PolarHBondContact O-OG1 3.09Å; F87-T90 PolarHBondContact O-N 2.84Å; I88-T90 VanDerWaalsContact C-N 3.3Å; I88-T90 PolarHBondContact O-N 2.98Å; T90-F94 HydrophobicContact CG2-CD1 3.98Å; T90-F94 HydrophobicContact CG2-CE1 3.8Å; T90-F97 HydrophobicContact CG2-CG 4.45Å; T90-F97 WeakPolarHBondContact OG1-CD2 3.44Å; T90-F97 WeakPolarHBondContact OG1-CG 3.22Å
91I94.1Very high96.2Very high10 Ų1020.7 Ų20.75%0.05112%0.118CC..Hα-helixtrans-67.3-42.2174.9-68.3-169000110.5I49 R53 W54 S57 F87 I88 M151 P156I49-I91 HydrophobicContact CD1-CG2 3.76Å; R53-I91 VanDerWaalsContact CD-O 3.24Å; R53-I91 WeakPolarHBondContact CD-O 3.4Å; R53-I91 PolarHBondContact NH1-O 3.36Å; W54-I91 HydrophobicContact CD2-CD1 4.34Å; W54-I91 HydrophobicContact CE3-CD1 3.83Å; W54-I91 HydrophobicContact CH2-CD1 3.82Å; W54-I91 HydrophobicContact CZ2-CD1 4.32Å; W54-I91 HydrophobicContact CZ3-CD1 3.59Å; S57-I91 VanDerWaalsContact CB-CG1 3.46Å; S57-I91 WeakPolarHBondContact OG-CG1 3.42Å; F87-I91 HydrophobicContact CD1-CD1 4.3Å; F87-I91 HydrophobicContact CD2-CD1 4.26Å; F87-I91 HydrophobicContact CE1-CD1 3.61Å; F87-I91 HydrophobicContact CE2-CD1 3.56Å; F87-I91 HydrophobicContact CE2-CG1 4.35Å; F87-I91 HydrophobicContact CZ-CD1 3.2Å; F87-I91 HydrophobicContact CZ-CG1 4.31Å; F87-I91 PolarHBondContact O-N 3.37Å; I88-I91 PolarHBondContact O-N 2.85Å; I91-M151 HydrophobicContact CB-SD 4.29Å; I91-M151 HydrophobicContact CG2-SD 3.68Å; I91-P156 VanDerWaalsContact O-CB 3.27Å; I91-P156 WeakPolarHBondContact O-CB 3.31Å
92A94.5Very high96.5Very high0 Ų022.3 Ų22.30%012%0.121CC..Hα-helixtrans-62.3-58.3-177.700000112.1R53 I88 L89 F96 A147 M151 P156 G157R53-A92 PolarHBondContact NH1-O 2.77Å; I88-A92 WeakPolarHBondContact O-CB 3.43Å; I88-A92 PolarHBondContact O-N 3.4Å; L89-A92 PolarHBondContact O-N 2.9Å; A92-F96 HydrophobicContact CB-CD2 3.94Å; A92-F96 HydrophobicContact CB-CE2 4.23Å; A92-A147 HydrophobicContact CB-CB 3.81Å; A92-M151 VanDerWaalsContact CA-SD 3.55Å; A92-M151 HydrophobicContact CB-CE 4.28Å; A92-M151 HydrophobicContact CB-CG 3.57Å; A92-M151 HydrophobicContact CB-SD 3.75Å; A92-P156 WeakPolarHBondContact O-CA 3.46Å; A92-G157 PolarHBondContact O-N 2.99Å
93N95.6Very high96.7Very high0 Ų022.2 Ų22.20%012%0.115CC..  trans-165.9129.1-173.8-179.2-38.9000109.9L89 S95 F96 F97 Y150 G157L89-N93 CarbonylContact O-C 3.52Å; L89-N93 PolarHBondContact O-N 3.38Å; L89-N93 VanDerWaalsContact O-N 3.08Å; N93-S95 PolarHBondContact O-N 2.96Å; N93-S95 WeakPolarHBondContact OD1-CA 3.47Å; N93-S95 WeakPolarHBondContact OD1-CB 3.04Å; N93-S95 PolarHBondContact OD1-N 3.18Å; N93-F96 HydrophobicContact CB-CB 4.45Å; N93-F96 HydrophobicContact CB-CD1 4Å; N93-F96 HydrophobicContact CB-CD2 3.52Å; N93-F96 HydrophobicContact CB-CE1 4.08Å; N93-F96 HydrophobicContact CB-CE2 3.61Å; N93-F96 HydrophobicContact CB-CG 3.72Å; N93-F96 HydrophobicContact CB-CZ 3.89Å; N93-F96 WeakPolarHBondContact O-CB 3.34Å; N93-F96 PolarHBondContact O-N 3.06Å; N93-F97 PolarHBondContact O-N 3.18Å; N93-Y150 HydrophobicContact CB-CE1 4.3Å; N93-G157 PolarHBondContact ND2-O 3.44Å
94F96.5Very high96.7Very high30 Ų3021 Ų2113%0.13211%0.108CC..Hα-helixtrans-61-30-179.1-67-42000113.2R53 T90 F96 F97 T98 E158 T240 F244R53-F94 HydrophobicContact CB-CZ 4.27Å; R53-F94 HydrophobicContact CG-CE1 4.22Å; R53-F94 HydrophobicContact CG-CZ 4.13Å; T90-F94 HydrophobicContact CG2-CD1 3.98Å; T90-F94 HydrophobicContact CG2-CE1 3.8Å; F94-F96 VanDerWaalsContact C-N 3.26Å; F94-F96 PolarHBondContact O-N 3.37Å; F94-F97 PolarHBondContact O-N 2.92Å; F94-T98 WeakPolarHBondContact O-CB 3.16Å; F94-T98 VanDerWaalsContact O-CG2 3.28Å; F94-T98 WeakPolarHBondContact O-CG2 3.11Å; F94-T98 PolarHBondContact O-N 3.37Å; F94-T98 PolarHBondContact O-OG1 3.28Å; F94-E158 WeakPolarHBondContact CD2-OE1 3.46Å; F94-E158 PolarHBondContact N-OE1 3.07Å; F94-T240 HydrophobicContact CB-CG2 3.8Å; F94-F244 HydrophobicContact CB-CD2 4.36Å; F94-F244 HydrophobicContact CB-CE2 4.47Å; F94-F244 AromaticContact CD2-CD1 3.8Å; F94-F244 HydrophobicContact CD2-CD1 3.8Å; F94-F244 HydrophobicContact CD2-CD2 4.18Å; F94-F244 AromaticContact CD2-CE1 3.83Å; F94-F244 HydrophobicContact CD2-CE1 3.83Å; F94-F244 HydrophobicContact CD2-CE2 4.21Å; F94-F244 AromaticContact CD2-CG 3.98Å; F94-F244 HydrophobicContact CD2-CG 3.98Å; F94-F244 HydrophobicContact CD2-CZ 4.03Å; F94-F244 HydrophobicContact CE2-CD1 4.12Å; F94-F244 AromaticContact CE2-CE1 3.94Å; F94-F244 HydrophobicContact CE2-CE1 3.94Å; F94-F244 HydrophobicContact CE2-CZ 4.4Å
95S97.3Very high96.8Very high0 Ų020.4 Ų20.40%010%0.102CC..Hα-helixtrans-63.7-31.4173.8-65.20000112.2N93 T98 S99 Y237 T240 Q241N93-S95 PolarHBondContact O-N 2.96Å; N93-S95 WeakPolarHBondContact OD1-CA 3.47Å; N93-S95 WeakPolarHBondContact OD1-CB 3.04Å; N93-S95 PolarHBondContact OD1-N 3.18Å; S95-T98 WeakPolarHBondContact CA-OG1 3.49Å; S95-T98 PolarHBondContact O-OG1 3.36Å; S95-T98 VanDerWaalsContact O-OG1 3.1Å; S95-S99 WeakPolarHBondContact O-CB 3.42Å; S95-S99 PolarHBondContact O-N 3.03Å; S95-S99 VanDerWaalsContact O-N 3.17Å; S95-S99 PolarHBondContact O-OG 2.88Å; S95-Y237 PolarHBondContact OG-O 2.9Å; S95-T240 WeakPolarHBondContact OG-CB 3.26Å; S95-Q241 PolarHBondContact OG-NE2 3.49Å
96F98Very high96.8Very high1 Ų120.4 Ų20.40%0.00410%0.102CC..Hα-helixtrans-70.9-49176.1-57.7-11.1000110.4L89 A92 N93 F94 S99 L100 A147 Y150 C173 L176 Y237L89-F96 HydrophobicContact CB-CB 4.2Å; L89-F96 HydrophobicContact CD2-CB 4.24Å; L89-F96 HydrophobicContact CG-CB 4.04Å; A92-F96 HydrophobicContact CB-CD2 3.94Å; A92-F96 HydrophobicContact CB-CE2 4.23Å; N93-F96 HydrophobicContact CB-CB 4.45Å; N93-F96 HydrophobicContact CB-CD1 4Å; N93-F96 HydrophobicContact CB-CD2 3.52Å; N93-F96 HydrophobicContact CB-CE1 4.08Å; N93-F96 HydrophobicContact CB-CE2 3.61Å; N93-F96 HydrophobicContact CB-CG 3.72Å; N93-F96 HydrophobicContact CB-CZ 3.89Å; N93-F96 WeakPolarHBondContact O-CB 3.34Å; N93-F96 PolarHBondContact O-N 3.06Å; F94-F96 VanDerWaalsContact C-N 3.26Å; F94-F96 PolarHBondContact O-N 3.37Å; F96-S99 PolarHBondContact O-N 2.93Å; F96-L100 PolarHBondContact O-N 3.39Å; F96-A147 HydrophobicContact CD2-CB 4.12Å; F96-Y150 AromaticContact CE2-CD1 3.85Å; F96-Y150 HydrophobicContact CE2-CD1 3.85Å; F96-Y150 HydrophobicContact CE2-CD2 4.39Å; F96-Y150 HydrophobicContact CE2-CE1 4.28Å; F96-Y150 AromaticContact CE2-CG 3.9Å; F96-Y150 HydrophobicContact CE2-CG 3.9Å; F96-Y150 HydrophobicContact CZ-CD1 4.24Å; F96-Y150 HydrophobicContact CZ-CD2 4.08Å; F96-Y150 HydrophobicContact CZ-CE1 4.41Å; F96-Y150 HydrophobicContact CZ-CE2 4.24Å; F96-Y150 HydrophobicContact CZ-CG 4.06Å; F96-C173 HydrophobicContact CE1-CB 4.23Å; F96-L176 HydrophobicContact CB-CD1 3.9Å; F96-L176 HydrophobicContact CB-CD2 3.68Å; F96-L176 HydrophobicContact CB-CG 4.48Å; F96-L176 HydrophobicContact CD1-CD1 3.92Å; F96-L176 HydrophobicContact CD1-CD2 3.62Å; F96-L176 HydrophobicContact CD1-CG 4.27Å; F96-L176 HydrophobicContact CD2-CD1 3.39Å; F96-L176 HydrophobicContact CD2-CD2 4.48Å; F96-L176 HydrophobicContact CE1-CD1 4.28Å; F96-L176 HydrophobicContact CE1-CD2 4.39Å; F96-L176 HydrophobicContact CE2-CD1 3.82Å; F96-L176 HydrophobicContact CG-CD1 3.46Å; F96-L176 VanDerWaalsContact CG-CD1 3.46Å; F96-L176 HydrophobicContact CG-CD2 3.68Å; F96-L176 HydrophobicContact CG-CG 4.19Å; F96-L176 HydrophobicContact CZ-CD1 4.25Å; F96-Y237 AromaticContact CD1-CE2 3.8Å; F96-Y237 HydrophobicContact CD1-CE2 3.8Å; F96-Y237 AromaticContact CE1-CE2 3.93Å; F96-Y237 HydrophobicContact CE1-CE2 3.93Å
97F97.9Very high96.6Very high18 Ų1820.3 Ų20.38%0.07910%0.101CC..Hα-helixtrans-63.3-43.3179.1174.6-107.2000112.7V60 P61 L89 T90 N93 F94 S99 L100 L101V60-F97 HydrophobicContact CB-CE1 4.37Å; V60-F97 HydrophobicContact CB-CZ 4.28Å; V60-F97 HydrophobicContact CG1-CE1 3.67Å; V60-F97 HydrophobicContact CG1-CZ 3.6Å; P61-F97 HydrophobicContact CG-CE2 4.03Å; P61-F97 HydrophobicContact CG-CZ 4.46Å; L89-F97 HydrophobicContact CB-CB 4.4Å; T90-F97 HydrophobicContact CG2-CG 4.45Å; T90-F97 WeakPolarHBondContact OG1-CD2 3.44Å; T90-F97 WeakPolarHBondContact OG1-CG 3.22Å; N93-F97 PolarHBondContact O-N 3.18Å; F94-F97 PolarHBondContact O-N 2.92Å; F97-S99 VanDerWaalsContact C-N 3.33Å; F97-S99 PolarHBondContact O-N 3.41Å; F97-L100 WeakPolarHBondContact O-CB 3.15Å; F97-L100 PolarHBondContact O-N 2.92Å; F97-L101 HydrophobicContact CE1-CB 4.48Å; F97-L101 HydrophobicContact CE1-CD2 4.12Å; F97-L101 HydrophobicContact CZ-CB 4.43Å; F97-L101 HydrophobicContact CZ-CD2 4.41Å; F97-L101 VanDerWaalsContact O-CB 3.3Å; F97-L101 WeakPolarHBondContact O-CB 3.48Å; F97-L101 PolarHBondContact O-N 2.89Å
98T97.7Very high96.5Very high31 Ų3117.5 Ų17.519%0.199%0.09CC..Hα-helixtrans-64.6-38.4178.450.30000111.8F94 S95 L101 M102 T240F94-T98 WeakPolarHBondContact O-CB 3.16Å; F94-T98 VanDerWaalsContact O-CG2 3.28Å; F94-T98 WeakPolarHBondContact O-CG2 3.11Å; F94-T98 PolarHBondContact O-N 3.37Å; F94-T98 PolarHBondContact O-OG1 3.28Å; S95-T98 WeakPolarHBondContact CA-OG1 3.49Å; S95-T98 PolarHBondContact O-OG1 3.36Å; S95-T98 VanDerWaalsContact O-OG1 3.1Å; T98-L101 PolarHBondContact O-N 3.09Å; T98-M102 WeakPolarHBondContact O-CB 3.26Å; T98-M102 VanDerWaalsContact O-CG 3.29Å; T98-M102 WeakPolarHBondContact O-CG 3.49Å; T98-M102 PolarHBondContact O-N 3.15Å; T98-T240 WeakPolarHBondContact CB-OG1 3.24Å; T98-T240 HydrophobicContact CG2-CG2 4.17Å; T98-T240 WeakPolarHBondContact CG2-OG1 3.4Å; T98-T240 PolarHBondContact OG1-OG1 3.1Å
99S98.3Very high96.4Very high0 Ų024.1 Ų24.10%012%0.118CC..Hα-helixtrans-59.4-48.1172.5-61.50000111.7S95 F96 F97 L101 M102 F103 Y237S95-S99 WeakPolarHBondContact O-CB 3.42Å; S95-S99 PolarHBondContact O-N 3.03Å; S95-S99 VanDerWaalsContact O-N 3.17Å; S95-S99 PolarHBondContact O-OG 2.88Å; F96-S99 PolarHBondContact O-N 2.93Å; F97-S99 VanDerWaalsContact C-N 3.33Å; F97-S99 PolarHBondContact O-N 3.41Å; S99-L101 VanDerWaalsContact C-N 3.33Å; S99-L101 PolarHBondContact O-N 3.21Å; S99-M102 PolarHBondContact O-N 3.31Å; S99-F103 WeakPolarHBondContact O-CB 3.38Å; S99-F103 PolarHBondContact O-N 3.37Å; S99-Y237 WeakPolarHBondContact OG-CD2 3.3Å
100L98.2Very high96.2Very high27 Ų2725.5 Ų25.514%0.14113%0.125CC..Hα-helixtrans-60.3-44.8175.9173.272.2000111.1V85 L89 F96 F97 F103 F104 L180V85-L100 HydrophobicContact CG1-CD1 4.4Å; V85-L100 HydrophobicContact CG1-CD2 3.8Å; L89-L100 HydrophobicContact CD2-CB 3.95Å; L89-L100 HydrophobicContact CD2-CD2 4.09Å; L89-L100 HydrophobicContact CD2-CG 4.5Å; F96-L100 PolarHBondContact O-N 3.39Å; F97-L100 WeakPolarHBondContact O-CB 3.15Å; F97-L100 PolarHBondContact O-N 2.92Å; L100-F103 HydrophobicContact CD1-CD1 4.36Å; L100-F103 PolarHBondContact O-N 2.96Å; L100-F104 WeakPolarHBondContact O-CB 3.01Å; L100-F104 PolarHBondContact O-N 3.43Å; L100-L180 HydrophobicContact CB-CD1 4.17Å; L100-L180 HydrophobicContact CB-CD2 4.37Å; L100-L180 HydrophobicContact CD1-CD2 3.91Å
101L97.6Very high95.8Very high32 Ų3226 Ų2617%0.16813%0.129CC..Hα-helixtrans-62-46.4-179176.160.9000111.2I64 F97 T98 S99 F104 L105I64-L101 HydrophobicContact CD1-CD1 3.77Å; I64-L101 HydrophobicContact CG1-CD1 3.87Å; I64-L101 HydrophobicContact CG2-CD1 3.96Å; F97-L101 HydrophobicContact CE1-CB 4.48Å; F97-L101 HydrophobicContact CE1-CD2 4.12Å; F97-L101 HydrophobicContact CZ-CB 4.43Å; F97-L101 HydrophobicContact CZ-CD2 4.41Å; F97-L101 VanDerWaalsContact O-CB 3.3Å; F97-L101 WeakPolarHBondContact O-CB 3.48Å; F97-L101 PolarHBondContact O-N 2.89Å; T98-L101 PolarHBondContact O-N 3.09Å; S99-L101 VanDerWaalsContact C-N 3.33Å; S99-L101 PolarHBondContact O-N 3.21Å; L101-F104 PolarHBondContact O-N 3.49Å; L101-L105 HydrophobicContact CD1-CD1 3.71Å; L101-L105 HydrophobicContact CD1-CD2 4.39Å; L101-L105 HydrophobicContact CD1-CG 3.77Å; L101-L105 HydrophobicContact CG-CD1 3.9Å; L101-L105 HydrophobicContact CG-CG 4.31Å; L101-L105 WeakPolarHBondContact O-CB 3.36Å; L101-L105 VanDerWaalsContact O-CG 3.29Å; L101-L105 WeakPolarHBondContact O-CG 3.47Å; L101-L105 PolarHBondContact O-N 3.46Å
102M97.7Very high95.6Very high54 Ų5429.1 Ų29.127%0.26614%0.141SC..Hα-helixtrans-69.8-36.8-179.1-66.2-44.6-64.100112T98 S99 S106 F232 A236T98-M102 WeakPolarHBondContact O-CB 3.26Å; T98-M102 VanDerWaalsContact O-CG 3.29Å; T98-M102 WeakPolarHBondContact O-CG 3.49Å; T98-M102 PolarHBondContact O-N 3.15Å; S99-M102 PolarHBondContact O-N 3.31Å; M102-S106 VanDerWaalsContact O-CB 3.23Å; M102-S106 WeakPolarHBondContact O-CB 3.33Å; M102-S106 PolarHBondContact O-N 2.94Å; M102-S106 PolarHBondContact O-OG 2.92Å; M102-F232 HydrophobicContact CB-CD1 4.36Å; M102-F232 HydrophobicContact CB-CE1 3.94Å; M102-F232 HydrophobicContact CE-CE1 3.39Å; M102-F232 HydrophobicContact CE-CE2 4.12Å; M102-F232 HydrophobicContact CE-CZ 3.11Å; M102-A236 HydrophobicContact CB-CB 3.9Å; M102-A236 HydrophobicContact CG-CB 3.42Å; M102-A236 VanDerWaalsContact CG-CB 3.42Å
103F97.3Very high95.5Very high15 Ų1533.6 Ų33.67%0.06616%0.159CC..Hα-helixtrans-55.6-58166.1161.7-124.5000110.7S99 L100 L105 S106 S107 N139 L180 A184 V233S99-F103 WeakPolarHBondContact O-CB 3.38Å; S99-F103 PolarHBondContact O-N 3.37Å; L100-F103 HydrophobicContact CD1-CD1 4.36Å; L100-F103 PolarHBondContact O-N 2.96Å; F103-L105 PolarHBondContact O-N 3.2Å; F103-S106 PolarHBondContact O-N 2.88Å; F103-S106 PolarHBondContact O-OG 3.1Å; F103-S106 VanDerWaalsContact O-OG 3.13Å; F103-S107 VanDerWaalsContact CD2-OG 3.28Å; F103-S107 WeakPolarHBondContact CD2-OG 3.43Å; F103-S107 VanDerWaalsContact CE2-OG 3.26Å; F103-S107 WeakPolarHBondContact CE2-OG 3.32Å; F103-S107 WeakPolarHBondContact O-CB 3.47Å; F103-S107 PolarHBondContact O-N 3.42Å; F103-S107 PolarHBondContact O-OG 2.99Å; F103-S107 VanDerWaalsContact O-OG 3.07Å; F103-N139 HydrophobicContact CE1-CB 4.32Å; F103-N139 HydrophobicContact CZ-CB 4.47Å; F103-L180 HydrophobicContact CD1-CD2 4.45Å; F103-A184 HydrophobicContact CB-CB 4.33Å; F103-A184 VanDerWaalsContact CD2-CA 3.5Å; F103-A184 HydrophobicContact CD2-CB 3.62Å; F103-A184 HydrophobicContact CE2-CB 4.37Å; F103-A184 HydrophobicContact CG-CB 4.33Å; F103-V233 HydrophobicContact CB-CG2 4.2Å
104F96.4Very high95.2Very high30 Ų3038.5 Ų38.513%0.13218%0.18CC..Hα-helixtrans-58.6-45.9-176175.4-103.5000112.9I64 L74 L100 L101 S108I64-F104 HydrophobicContact CG2-CD1 3.95Å; I64-F104 HydrophobicContact CG2-CE1 3.96Å; L74-F104 HydrophobicContact CD1-CE1 4.3Å; L74-F104 HydrophobicContact CD1-CE2 3.48Å; L74-F104 VanDerWaalsContact CD1-CE2 3.48Å; L74-F104 HydrophobicContact CD1-CZ 3.33Å; L74-F104 HydrophobicContact CD2-CE2 4.27Å; L74-F104 HydrophobicContact CG-CE2 3.71Å; L74-F104 HydrophobicContact CG-CZ 3.88Å; L100-F104 WeakPolarHBondContact O-CB 3.01Å; L100-F104 PolarHBondContact O-N 3.43Å; L101-F104 PolarHBondContact O-N 3.49Å; F104-S108 WeakPolarHBondContact O-CB 3.14Å; F104-S108 PolarHBondContact O-N 2.83Å; F104-S108 PolarHBondContact O-OG 3.16Å
105L95.7Very high94.7Very high67 Ų6737.5 Ų37.535%0.35118%0.178SC..Hα-helixtrans-68.3-45.6-178.4-70.3179.9000112.1L101 F103 K109L101-L105 HydrophobicContact CD1-CD1 3.71Å; L101-L105 HydrophobicContact CD1-CD2 4.39Å; L101-L105 HydrophobicContact CD1-CG 3.77Å; L101-L105 HydrophobicContact CG-CD1 3.9Å; L101-L105 HydrophobicContact CG-CG 4.31Å; L101-L105 WeakPolarHBondContact O-CB 3.36Å; L101-L105 VanDerWaalsContact O-CG 3.29Å; L101-L105 WeakPolarHBondContact O-CG 3.47Å; L101-L105 PolarHBondContact O-N 3.46Å; F103-L105 PolarHBondContact O-N 3.2Å; L105-K109 WeakPolarHBondContact O-CB 3.4Å; L105-K109 PolarHBondContact O-N 2.65Å; L105-K109 VanDerWaalsContact O-N 3.08Å
106S96.5Very high94.1Very high14 Ų1444 Ų4410%0.09821%0.208CC..Hα-helixtrans-65.7-49.2179.761.80000111.1M102 F103 S108 K109 L110 W188M102-S106 VanDerWaalsContact O-CB 3.23Å; M102-S106 WeakPolarHBondContact O-CB 3.33Å; M102-S106 PolarHBondContact O-N 2.94Å; M102-S106 PolarHBondContact O-OG 2.92Å; F103-S106 PolarHBondContact O-N 2.88Å; F103-S106 PolarHBondContact O-OG 3.1Å; F103-S106 VanDerWaalsContact O-OG 3.13Å; S106-S108 PolarHBondContact O-N 2.74Å; S106-K109 WeakPolarHBondContact O-CB 3.23Å; S106-K109 PolarHBondContact O-N 3.45Å; S106-K109 VanDerWaalsContact O-N 3.08Å; S106-L110 WeakPolarHBondContact O-CG 3.37Å; S106-L110 PolarHBondContact O-N 3.08Å; S106-W188 PolarHBondContact OG-NE1 3.1Å
107S93.8Very high93.5Very high0 Ų048 Ų480%023%0.228CC..Hα-helixtrans-58.5-45.6176.3-67.40000111.7F103 K109 L110 T111 T187F103-S107 VanDerWaalsContact CD2-OG 3.28Å; F103-S107 WeakPolarHBondContact CD2-OG 3.43Å; F103-S107 VanDerWaalsContact CE2-OG 3.26Å; F103-S107 WeakPolarHBondContact CE2-OG 3.32Å; F103-S107 WeakPolarHBondContact O-CB 3.47Å; F103-S107 PolarHBondContact O-N 3.42Å; F103-S107 PolarHBondContact O-OG 2.99Å; F103-S107 VanDerWaalsContact O-OG 3.07Å; S107-K109 VanDerWaalsContact C-N 3.26Å; S107-K109 PolarHBondContact O-N 3.02Å; S107-L110 PolarHBondContact O-N 3.24Å; S107-T111 PolarHBondContact O-N 3.29Å; S107-T111 PolarHBondContact O-OG1 2.79Å; S107-T187 WeakPolarHBondContact OG-CG2 3.14Å
108S93.4Very high93Very high10 Ų1047.5 Ų47.57%0.0723%0.226CC..Hα-helixtrans-62.5-31.1176.6-61.30000113.6F104 S106 R131F104-S108 WeakPolarHBondContact O-CB 3.14Å; F104-S108 PolarHBondContact O-N 2.83Å; F104-S108 PolarHBondContact O-OG 3.16Å; S106-S108 PolarHBondContact O-N 2.74Å; S108-R131 PolarHBondContact OG-NH1 3.25Å
109K94.1Very high92.4Very high166 Ų16652.2 Ų52.272%0.72224%0.244SC*.Hα-helixtrans-74.5-41.7175.4-172.1177.1179.4-178.50111L105 S106 S107 K112 W113L105-K109 WeakPolarHBondContact O-CB 3.4Å; L105-K109 PolarHBondContact O-N 2.65Å; L105-K109 VanDerWaalsContact O-N 3.08Å; S106-K109 WeakPolarHBondContact O-CB 3.23Å; S106-K109 PolarHBondContact O-N 3.45Å; S106-K109 VanDerWaalsContact O-N 3.08Å; S107-K109 VanDerWaalsContact C-N 3.26Å; S107-K109 PolarHBondContact O-N 3.02Å; K109-K112 PolarHBondContact O-N 3.01Å; K109-W113 PolarHBondContact O-N 3.38Å; K109-W113 VanDerWaalsContact O-N 3.1Å
110L93Very high91.6Very high29 Ų2961.7 Ų61.715%0.15228%0.28CS..Hα-helixtrans-67.5-41.5178.9-71.3177.5000112.6S106 S107 K112 W113 K118 W188 E191 V192S106-L110 WeakPolarHBondContact O-CG 3.37Å; S106-L110 PolarHBondContact O-N 3.08Å; S107-L110 PolarHBondContact O-N 3.24Å; L110-K112 PolarHBondContact O-N 3.29Å; L110-W113 WeakPolarHBondContact O-CB 3.25Å; L110-W113 PolarHBondContact O-N 3.37Å; L110-K118 PolarHBondContact O-NZ 2.79Å; L110-W188 HydrophobicContact CD1-CB 4.19Å; L110-W188 HydrophobicContact CD1-CD2 3.6Å; L110-W188 HydrophobicContact CD1-CE3 4.38Å; L110-W188 HydrophobicContact CD1-CG 3.46Å; L110-W188 VanDerWaalsContact CD1-CG 3.46Å; L110-W188 HydrophobicContact CD1-CZ2 4.5Å; L110-E191 HydrophobicContact CB-CB 3.84Å; L110-E191 HydrophobicContact CB-CG 4.28Å; L110-V192 HydrophobicContact CD1-CG2 4.05Å; L110-V192 HydrophobicContact CD2-CG2 3.78Å
111T89.3Confident90.7Very high13 Ų1363.2 Ų63.28%0.0829%0.288CS..Hα-helixtrans-58.3-35.1176.2-54.40000112.6S107 R131 E191S107-T111 PolarHBondContact O-N 3.29Å; S107-T111 PolarHBondContact O-OG1 2.79Å; T111-R131 PolarHBondContact OG1-NH2 3.07Å; T111-E191 VanDerWaalsContact CA-OE1 3.25Å; T111-E191 WeakPolarHBondContact CA-OE1 3.48Å; T111-E191 WeakPolarHBondContact CB-OE1 3.19Å; T111-E191 WeakPolarHBondContact CG2-OE1 3.35Å; T111-E191 PolarHBondContact OG1-OE1 3.07Å
112K89.2Confident89.9Confident74 Ų7465 Ų6532%0.32230%0.297SS..Hα-helixtrans-81.1-24.4176.4-69.8174-179.3167.60113.7K71 S73 K109 L110 K114 G115K71-K112 VanDerWaalsContact O-CE 3.31Å; K71-K112 WeakPolarHBondContact O-CE 3.36Å; K71-K112 PolarHBondContact O-NZ 2.96Å; S73-K112 WeakPolarHBondContact OG-CE 3.21Å; S73-K112 PolarHBondContact OG-NZ 3Å; K109-K112 PolarHBondContact O-N 3.01Å; L110-K112 PolarHBondContact O-N 3.29Å; K112-K114 PolarHBondContact O-N 3.45Å; K112-G115 PolarHBondContact O-N 2.95Å
113W91.5Very high88.7Confident95 Ų9565.1 Ų65.136%0.3630%0.303SS..THydrogen-bonded Turntrans-66.6123.4-176.3178.565.7000110.1K109 L110 G115 K118 V195 L196K109-W113 PolarHBondContact O-N 3.38Å; K109-W113 VanDerWaalsContact O-N 3.1Å; L110-W113 WeakPolarHBondContact O-CB 3.25Å; L110-W113 PolarHBondContact O-N 3.37Å; W113-G115 VanDerWaalsContact C-N 3.26Å; W113-G115 PolarHBondContact O-N 3.3Å; W113-K118 VanDerWaalsContact O-CE 3.24Å; W113-K118 WeakPolarHBondContact O-CE 3.45Å; W113-K118 PolarHBondContact O-NZ 3.44Å; W113-V195 HydrophobicContact CE3-CB 4.44Å; W113-V195 HydrophobicContact CE3-CG1 4.17Å; W113-V195 HydrophobicContact CH2-CB 4.28Å; W113-V195 HydrophobicContact CH2-CG1 3.59Å; W113-V195 HydrophobicContact CZ2-CG1 4.28Å; W113-V195 HydrophobicContact CZ3-CB 3.78Å; W113-V195 HydrophobicContact CZ3-CG1 3.51Å; W113-V195 HydrophobicContact CZ3-CG2 4.32Å; W113-L196 HydrophobicContact CH2-CD1 3.99Å; W113-L196 HydrophobicContact CH2-CD2 3.72Å; W113-L196 HydrophobicContact CH2-CG 3.69Å; W113-L196 HydrophobicContact CZ2-CD2 4.44Å; W113-L196 HydrophobicContact CZ3-CG 4.27Å
114K89.3Confident87.9Confident103 Ų10369.6 Ų69.645%0.44832%0.324SS..THydrogen-bonded Turntrans53.539-175.9-70.8175.8163-172.80113.7K112 E116 M117 K118 V195K112-K114 PolarHBondContact O-N 3.45Å; K114-E116 VanDerWaalsContact C-N 3.27Å; K114-E116 PolarHBondContact O-N 2.57Å; K114-M117 WeakPolarHBondContact O-CB 3.44Å; K114-M117 PolarHBondContact O-N 3.19Å; K114-K118 PolarHBondContact O-N 3.03Å; K114-V195 HydrophobicContact CB-CG1 4.14Å; K114-V195 HydrophobicContact CB-CG2 4.44Å; K114-V195 HydrophobicContact CD-CG1 3.19Å; K114-V195 HydrophobicContact CG-CG1 4.29Å
115G86.3Confident87.1Confident9 Ų970.9 Ų70.99%0.09333%0.329CS..Hα-helixtrans-53.4-35.8179.100000115.1K112 W113 M117 K118 K119 Y125K112-G115 PolarHBondContact O-N 2.95Å; W113-G115 VanDerWaalsContact C-N 3.26Å; W113-G115 PolarHBondContact O-N 3.3Å; G115-M117 VanDerWaalsContact C-N 3.27Å; G115-M117 PolarHBondContact O-N 2.88Å; G115-K118 PolarHBondContact O-N 3.5Å; G115-K118 VanDerWaalsContact O-N 3.16Å; G115-K119 WeakPolarHBondContact O-CB 3.46Å; G115-K119 PolarHBondContact O-N 3.4Å; G115-Y125 WeakPolarHBondContact CA-OH 3.44Å
116E85.9Confident86.3Confident136 Ų13673.2 Ų73.264%0.63634%0.336SS*.Hα-helixtrans-61.2-33.5176.1-69.3-58.1137.900113.5K114K114-E116 VanDerWaalsContact C-N 3.27Å; K114-E116 PolarHBondContact O-N 2.57Å
117M85.1Confident85.4Confident84 Ų8478.1 Ų78.141%0.41436%0.358SS..Hα-helixtrans-73.9-42.2175.1-177174.5174.600110.4K114 G115 K119 R120 L121 V195K114-M117 WeakPolarHBondContact O-CB 3.44Å; K114-M117 PolarHBondContact O-N 3.19Å; G115-M117 VanDerWaalsContact C-N 3.27Å; G115-M117 PolarHBondContact O-N 2.88Å; M117-K119 PolarHBondContact O-N 2.9Å; M117-R120 PolarHBondContact O-N 3.11Å; M117-L121 HydrophobicContact CE-CD1 4.2Å; M117-L121 HydrophobicContact CG-CD1 4.14Å; M117-L121 WeakPolarHBondContact O-CG 3.4Å; M117-V195 HydrophobicContact SD-CG1 4.38Å
118K86.2Confident84.5Confident8 Ų878.5 Ų78.54%0.03536%0.361CS..Hα-helixtrans-64.2-39.5179.7-64.4178.4-178.5179.90112L110 W113 K114 G115 R120 L121 D122 Y125 E191 V195L110-K118 PolarHBondContact O-NZ 2.79Å; W113-K118 VanDerWaalsContact O-CE 3.24Å; W113-K118 WeakPolarHBondContact O-CE 3.45Å; W113-K118 PolarHBondContact O-NZ 3.44Å; K114-K118 PolarHBondContact O-N 3.03Å; G115-K118 PolarHBondContact O-N 3.5Å; G115-K118 VanDerWaalsContact O-N 3.16Å; K118-R120 PolarHBondContact O-N 3.22Å; K118-R120 VanDerWaalsContact O-N 3.13Å; K118-L121 PolarHBondContact O-N 3.49Å; K118-D122 PolarHBondContact O-N 3.36Å; K118-Y125 HydrophobicContact CB-CD2 3.95Å; K118-Y125 HydrophobicContact CB-CE2 3.98Å; K118-E191 WeakPolarHBondContact CE-O 3.32Å; K118-E191 WeakPolarHBondContact CE-OE2 3.33Å; K118-E191 PolarHBondContact NZ-O 3.37Å; K118-E191 IonicContact NZ-OE2 2.63Å; K118-E191 PolarHBondContact NZ-OE2 2.8Å; K118-V195 HydrophobicContact CD-CG2 4.4Å; K118-V195 HydrophobicContact CG-CG2 4.14Å
119K84.8Confident83.7Confident130 Ų13078.7 Ų78.757%0.56537%0.365SS*.THydrogen-bonded Turntrans-58.4-25.1175.2-171.8178178.3-175.80114G115 M117 Y125G115-K119 WeakPolarHBondContact O-CB 3.46Å; G115-K119 PolarHBondContact O-N 3.4Å; M117-K119 PolarHBondContact O-N 2.9Å; K119-Y125 HydrophobicContact CB-CD1 3.85Å; K119-Y125 HydrophobicContact CB-CE1 4.16Å; K119-Y125 HydrophobicContact CB-CG 4.25Å; K119-Y125 HydrophobicContact CD-CD1 4.5Å; K119-Y125 HydrophobicContact CG-CD1 4Å
120R82.8Confident83.3Confident200 Ų20074.3 Ų74.376%0.75535%0.347SS*.THydrogen-bonded Turntrans-88.1-13.6177-63.3178.1-174.4-171.1-0.6113.4M117 K118M117-R120 PolarHBondContact O-N 3.11Å; K118-R120 PolarHBondContact O-N 3.22Å; K118-R120 VanDerWaalsContact O-N 3.13Å
121L79.7Confident83.2Confident59 Ų5974.2 Ų74.231%0.30934%0.344SS..THydrogen-bonded Turntrans-109.7-25-174-65.3173.3000112.4M117 K118 T194M117-L121 HydrophobicContact CE-CD1 4.2Å; M117-L121 HydrophobicContact CG-CD1 4.14Å; M117-L121 WeakPolarHBondContact O-CG 3.4Å; K118-L121 PolarHBondContact O-N 3.49Å; L121-T194 HydrophobicContact CD1-CG2 3.84Å
122D79.3Confident83.3Confident69 Ų6975.2 Ų75.237%0.36935%0.349SS..  trans-121.7117.3-176179.58.4000110.2K118 E124 Y125K118-D122 PolarHBondContact O-N 3.36Å; D122-E124 PolarHBondContact O-N 2.97Å; D122-E124 PolarHBondContact OD1-N 3.32Å; D122-Y125 WeakPolarHBondContact O-CB 3.47Å; D122-Y125 PolarHBondContact O-N 2.72Å
123S73.9Confident83.3Confident57 Ų5778.7 Ų78.740%0.39936%0.36SS..THydrogen-bonded Turntrans-70.5-20.5179.157.70000112.8V291S123-V291 PolarHBondContact OG-O 3.46Å
124E78.9Confident83Confident108 Ų10877.1 Ų77.151%0.50536%0.358SS..THydrogen-bonded Turntrans-99.88.6-179.3-64.6-178.6-153.400113.2D122 K126 N293D122-E124 PolarHBondContact O-N 2.97Å; D122-E124 PolarHBondContact OD1-N 3.32Å; E124-K126 PolarHBondContact O-N 2.97Å; E124-N293 WeakPolarHBondContact OE1-CB 3.34Å; E124-N293 PolarHBondContact OE1-ND2 3.34Å
125Y80.8Confident83.1Confident58 Ų5874.9 Ų74.923%0.22735%0.35CS..PPolyproline II helixtrans-56.8122.3-175.9177.6-95000112.8G115 K118 K119 D122G115-Y125 WeakPolarHBondContact CA-OH 3.44Å; K118-Y125 HydrophobicContact CB-CD2 3.95Å; K118-Y125 HydrophobicContact CB-CE2 3.98Å; K119-Y125 HydrophobicContact CB-CD1 3.85Å; K119-Y125 HydrophobicContact CB-CE1 4.16Å; K119-Y125 HydrophobicContact CB-CG 4.25Å; K119-Y125 HydrophobicContact CD-CD1 4.5Å; K119-Y125 HydrophobicContact CG-CD1 4Å; D122-Y125 WeakPolarHBondContact O-CB 3.47Å; D122-Y125 PolarHBondContact O-N 2.72Å
126K79.5Confident83.3Confident115 Ų11575.5 Ų75.550%0.535%0.352SS..PPolyproline II helixtrans-103126.6173.4-65.1-179.5-175.2174.10111.1E124 G128 G129E124-K126 PolarHBondContact O-N 2.97Å; K126-G128 PolarHBondContact O-N 3.35Å; K126-G128 VanDerWaalsContact O-N 3.11Å; K126-G129 PolarHBondContact O-N 3.23Å
127E77.1Confident83.2Confident118 Ų11874.4 Ų74.455%0.55135%0.345SS*.G310 helixtrans-57119.3178-166.8-165-166.100111.1K72 G129 Q130K72-E127 IonicContact NZ-OE2 3Å; K72-E127 PolarHBondContact NZ-OE2 3.22Å; E127-G129 VanDerWaalsContact C-N 3.27Å; E127-G129 PolarHBondContact O-N 2.98Å; E127-Q130 WeakPolarHBondContact O-CG 3.34Å; E127-Q130 PolarHBondContact O-NE2 2.85Å
128G74Confident83.2Confident7 Ų770.9 Ų70.97%0.07233%0.328CS..G310 helixtrans82.8-5179.500000115.2K72 S73 K126 Q130K72-G128 CarbonylContact O-C 3.59Å; K72-G128 VanDerWaalsContact O-C 3.23Å; K72-G128 VanDerWaalsContact O-O 3.07Å; S73-G128 WeakPolarHBondContact CA-O 3.44Å; K126-G128 PolarHBondContact O-N 3.35Å; K126-G128 VanDerWaalsContact O-N 3.11Å; G128-Q130 VanDerWaalsContact C-N 3.35Å
129G77.9Confident83.5Confident14 Ų1471.4 Ų71.414%0.14433%0.331CS..G310 helixtrans81.26.4178.800000115.5K126 E127 R131K126-G129 PolarHBondContact O-N 3.23Å; E127-G129 VanDerWaalsContact C-N 3.27Å; E127-G129 PolarHBondContact O-N 2.98Å; G129-R131 VanDerWaalsContact C-N 3.33Å; G129-R131 WeakPolarHBondContact O-CG 3.21Å; G129-R131 PolarHBondContact O-N 2.93Å
130Q85.8Confident83.7Confident74 Ų7465.3 Ų65.335%0.34631%0.306SS..  trans-13.777.8-179.9-67.6176.151.700115.6K72 E127 G128 N132K72-Q130 HydrophobicContact CB-CG 4.21Å; K72-Q130 VanDerWaalsContact O-CG 3.23Å; K72-Q130 WeakPolarHBondContact O-CG 3.35Å; K72-Q130 PolarHBondContact O-N 3.47Å; E127-Q130 WeakPolarHBondContact O-CG 3.34Å; E127-Q130 PolarHBondContact O-NE2 2.85Å; G128-Q130 VanDerWaalsContact C-N 3.35Å; Q130-N132 PolarHBondContact O-N 3.02Å
131R89.5Confident83.9Confident28 Ų2856.8 Ų56.811%0.10628%0.278CS..BIsolated β-bridgetrans-73130.9-174.5-58.2-171.1-176.891.25.9110.1S73 L74 D75 S108 T111 G129 Q135S73-R131 PolarHBondContact O-N 3.13Å; S73-R131 VanDerWaalsContact O-N 3.15Å; L74-R131 HydrophobicContact CD2-CB 4.02Å; D75-R131 PolarHBondContact N-O 3.23Å; S108-R131 PolarHBondContact OG-NH1 3.25Å; T111-R131 PolarHBondContact OG1-NH2 3.07Å; G129-R131 VanDerWaalsContact C-N 3.33Å; G129-R131 WeakPolarHBondContact O-CG 3.21Å; G129-R131 PolarHBondContact O-N 2.93Å; R131-Q135 HydrophobicContact CB-CB 4.32Å; R131-Q135 VanDerWaalsContact CB-OE1 3.3Å; R131-Q135 VanDerWaalsContact CG-OE1 3.31Å
132N92.2Very high84.4Confident33 Ų3354.7 Ų54.718%0.17627%0.268CS..  trans-92.617517968.213.1000111.6D75 Q130 I134 Q135 V136D75-N132 VanDerWaalsContact OD2-CA 3.3Å; D75-N132 WeakPolarHBondContact OD2-CA 3.34Å; D75-N132 WeakPolarHBondContact OD2-CB 3.31Å; Q130-N132 PolarHBondContact O-N 3.02Å; N132-I134 PolarHBondContact O-N 3.49Å; N132-I134 WeakPolarHBondContact OD1-CB 3.3Å; N132-I134 PolarHBondContact OD1-N 3.38Å; N132-Q135 PolarHBondContact O-N 2.89Å; N132-Q135 PolarHBondContact OD1-N 3.38Å; N132-V136 WeakPolarHBondContact O-CG2 3.49Å; N132-V136 PolarHBondContact O-N 3.35Å; N132-V136 VanDerWaalsContact O-N 3.09Å
133W87.9Confident85.1Confident147 Ų14751.5 Ų51.556%0.55725%0.251SS*.Hα-helixtrans-60.3-30.6179.674.7-89.7000113.2S77 V136 F137S77-W133 PolarHBondContact OG-N 3.41Å; W133-V136 PolarHBondContact O-N 3.11Å; W133-F137 HydrophobicContact CE3-CB 4.37Å; W133-F137 VanDerWaalsContact O-CB 3.26Å; W133-F137 WeakPolarHBondContact O-CB 3.46Å; W133-F137 PolarHBondContact O-N 3.38Å
134I87.1Confident86Confident62 Ų6249.6 Ų49.632%0.31824%0.237SC..Hα-helixtrans-66.1-47.3178.5-57.9174.6000109.7N132 V136 F137 C138 N311N132-I134 PolarHBondContact O-N 3.49Å; N132-I134 WeakPolarHBondContact OD1-CB 3.3Å; N132-I134 PolarHBondContact OD1-N 3.38Å; I134-V136 VanDerWaalsContact C-N 3.31Å; I134-V136 PolarHBondContact O-N 2.82Å; I134-F137 WeakPolarHBondContact O-CB 3.1Å; I134-F137 PolarHBondContact O-N 3.4Å; I134-C138 WeakPolarHBondContact O-CB 3.45Å; I134-C138 PolarHBondContact O-N 2.81Å; I134-C138 PolarHBondContact O-SG 3.23Å; I134-C138 VanDerWaalsContact O-SG 3.41Å; I134-N311 HydrophobicContact CG2-CB 4.11Å
135Q89.9Confident86.6Confident57 Ų5750.4 Ų50.427%0.26624%0.24SC..Hα-helixtrans-63.2-37.8176.2-79.1-178.1-16.300112.6R131 N132 N139 N311R131-Q135 HydrophobicContact CB-CB 4.32Å; R131-Q135 VanDerWaalsContact CB-OE1 3.3Å; R131-Q135 VanDerWaalsContact CG-OE1 3.31Å; N132-Q135 PolarHBondContact O-N 2.89Å; N132-Q135 PolarHBondContact OD1-N 3.38Å; Q135-N139 PolarHBondContact O-N 2.76Å; Q135-N139 PolarHBondContact O-ND2 3.42Å; Q135-N311 WeakPolarHBondContact CG-OD1 3.47Å
136V90.1Very high87.1Confident22 Ų2248.4 Ų48.413%0.13323%0.234CC..Hα-helixtrans-67.3-39.4174.9175.60000110.8L74 V85 N132 W133 I134 G140L74-V136 HydrophobicContact CD2-CG2 3.84Å; V85-V136 HydrophobicContact CG2-CG1 4.2Å; N132-V136 WeakPolarHBondContact O-CG2 3.49Å; N132-V136 PolarHBondContact O-N 3.35Å; N132-V136 VanDerWaalsContact O-N 3.09Å; W133-V136 PolarHBondContact O-N 3.11Å; I134-V136 VanDerWaalsContact C-N 3.31Å; I134-V136 PolarHBondContact O-N 2.82Å; V136-G140 WeakPolarHBondContact O-CA 3.43Å; V136-G140 PolarHBondContact O-N 3.07Å
137F84.3Confident87.9Confident113 Ų11343 Ų4350%0.49621%0.21SC..Hα-helixtrans-65.6-52.6176.1-179.8-94.4000111.3W133 I134 N139 G140 A141W133-F137 HydrophobicContact CE3-CB 4.37Å; W133-F137 VanDerWaalsContact O-CB 3.26Å; W133-F137 WeakPolarHBondContact O-CB 3.46Å; W133-F137 PolarHBondContact O-N 3.38Å; I134-F137 WeakPolarHBondContact O-CB 3.1Å; I134-F137 PolarHBondContact O-N 3.4Å; F137-N139 VanDerWaalsContact C-N 3.31Å; F137-N139 PolarHBondContact O-N 2.96Å; F137-G140 PolarHBondContact O-N 2.81Å; F137-G140 VanDerWaalsContact O-N 3.15Å; F137-A141 HydrophobicContact CD1-CB 4.43Å; F137-A141 HydrophobicContact CD2-CB 4.15Å; F137-A141 HydrophobicContact CE1-CB 4.25Å; F137-A141 HydrophobicContact CE2-CB 3.96Å; F137-A141 HydrophobicContact CG-CB 4.39Å; F137-A141 HydrophobicContact CZ-CB 4.01Å; F137-A141 WeakPolarHBondContact O-CA 3.42Å; F137-A141 WeakPolarHBondContact O-CB 3.29Å; F137-A141 PolarHBondContact O-N 3.4Å
138C86.1Confident88.5Confident9 Ų940.9 Ų40.96%0.06120%0.202CC..Hα-helixtrans-61.4-36-177-70.90000113.4I134 N311 L315I134-C138 WeakPolarHBondContact O-CB 3.45Å; I134-C138 PolarHBondContact O-N 2.81Å; I134-C138 PolarHBondContact O-SG 3.23Å; I134-C138 VanDerWaalsContact O-SG 3.41Å; C138-N311 HydrophobicContact CB-CB 4.14Å; C138-N311 VanDerWaalsContact CB-O 3.3Å; C138-N311 WeakPolarHBondContact CB-O 3.5Å; C138-N311 PolarHBondContact SG-O 2.95Å; C138-N311 VanDerWaalsContact SG-O 3.4Å; C138-L315 HydrophobicContact CB-CB 4.16Å; C138-L315 WeakPolarHBondContact O-CD1 3.3Å
139N91.8Very high89.1Confident19 Ų1943.8 Ų43.810%0.10222%0.216CC..Hα-helixtrans-89.2-19.6176.4-65.2-61.6000113.8F103 Q135 F137 S183F103-N139 HydrophobicContact CE1-CB 4.32Å; F103-N139 HydrophobicContact CZ-CB 4.47Å; Q135-N139 PolarHBondContact O-N 2.76Å; Q135-N139 PolarHBondContact O-ND2 3.42Å; F137-N139 VanDerWaalsContact C-N 3.31Å; F137-N139 PolarHBondContact O-N 2.96Å; N139-S183 WeakPolarHBondContact OD1-CB 3.39Å; N139-S183 PolarHBondContact OD1-OG 3.17Å
140G89.6Confident89.7Confident3 Ų343.1 Ų43.13%0.03121%0.209CC..Hα-helixtrans-108.6-18.9-171.400000114.8V136 F137 P143 T144V136-G140 WeakPolarHBondContact O-CA 3.43Å; V136-G140 PolarHBondContact O-N 3.07Å; F137-G140 PolarHBondContact O-N 2.81Å; F137-G140 VanDerWaalsContact O-N 3.15Å; G140-P143 WeakPolarHBondContact O-CD 3.17Å; G140-T144 VanDerWaalsContact O-CB 3.22Å; G140-T144 WeakPolarHBondContact O-CB 3.39Å; G140-T144 PolarHBondContact O-N 3.41Å; G140-T144 PolarHBondContact O-OG1 2.92Å
141A85.8Confident90Very high21 Ų2141.5 Ų41.517%0.17420%0.202CC..Hα-helixtrans-63.3-52.5-175.500000111.6F137 T144 E145F137-A141 HydrophobicContact CD1-CB 4.43Å; F137-A141 HydrophobicContact CD2-CB 4.15Å; F137-A141 HydrophobicContact CE1-CB 4.25Å; F137-A141 HydrophobicContact CE2-CB 3.96Å; F137-A141 HydrophobicContact CG-CB 4.39Å; F137-A141 HydrophobicContact CZ-CB 4.01Å; F137-A141 WeakPolarHBondContact O-CA 3.42Å; F137-A141 WeakPolarHBondContact O-CB 3.29Å; F137-A141 PolarHBondContact O-N 3.4Å; A141-T144 PolarHBondContact O-N 3.14Å; A141-T144 VanDerWaalsContact O-N 3.1Å; A141-E145 WeakPolarHBondContact O-CB 3.13Å; A141-E145 PolarHBondContact O-N 3.13Å
142V90.2Very high89.8Confident15 Ų1546.7 Ų46.79%0.09123%0.23CC..Hα-helixtrans-59.2-50.4179.4177.40000111.7T144 E145 L146 A179 L315 V319 A322V142-T144 VanDerWaalsContact C-N 3.3Å; V142-T144 PolarHBondContact O-N 3.39Å; V142-E145 PolarHBondContact O-N 3.48Å; V142-L146 HydrophobicContact CG1-CD1 3.87Å; V142-L146 WeakPolarHBondContact O-CB 3.47Å; V142-L146 WeakPolarHBondContact O-CG 3.19Å; V142-L146 PolarHBondContact O-N 3.48Å; V142-A179 HydrophobicContact CB-CB 4.35Å; V142-A179 HydrophobicContact CG1-CB 3.93Å; V142-L315 HydrophobicContact CG2-CD1 3.95Å; V142-V319 HydrophobicContact CG2-CG2 3.46Å; V142-V319 VanDerWaalsContact CG2-CG2 3.46Å; V142-A322 HydrophobicContact CG1-CB 3.91Å
143P95.4Very high89.4Confident1 Ų150.4 Ų50.41%0.00625%0.246CC..Hα-helixtrans-56.8-39.5172-26.733.6000114.2L89 G140 A147 L176 A179 L180L89-P143 HydrophobicContact CD2-CB 4.16Å; G140-P143 WeakPolarHBondContact O-CD 3.17Å; P143-A147 VanDerWaalsContact O-CB 3.25Å; P143-A147 WeakPolarHBondContact O-CB 3.48Å; P143-A147 PolarHBondContact O-N 3.02Å; P143-L176 HydrophobicContact CB-CD1 4.38Å; P143-L176 HydrophobicContact CB-CG 4.01Å; P143-L176 VanDerWaalsContact O-CD1 3.25Å; P143-L176 WeakPolarHBondContact O-CD1 3.43Å; P143-A179 HydrophobicContact CG-CB 3.95Å; P143-L180 HydrophobicContact CB-CD2 4.17Å; P143-L180 HydrophobicContact CB-CG 4.22Å; P143-L180 HydrophobicContact CG-CD2 3.63Å; P143-L180 HydrophobicContact CG-CG 3.8Å
144T93.1Very high89.4Confident17 Ų1744.8 Ų44.810%0.10423%0.227CC..Hα-helixtrans-69.1-44.3-177.8-59.30000111.5I88 G140 A141 V142 A147 L148I88-T144 HydrophobicContact CB-CG2 4.22Å; I88-T144 HydrophobicContact CD1-CG2 3.51Å; I88-T144 HydrophobicContact CG1-CG2 4.46Å; I88-T144 HydrophobicContact CG2-CG2 3.96Å; G140-T144 VanDerWaalsContact O-CB 3.22Å; G140-T144 WeakPolarHBondContact O-CB 3.39Å; G140-T144 PolarHBondContact O-N 3.41Å; G140-T144 PolarHBondContact O-OG1 2.92Å; A141-T144 PolarHBondContact O-N 3.14Å; A141-T144 VanDerWaalsContact O-N 3.1Å; V142-T144 VanDerWaalsContact C-N 3.3Å; V142-T144 PolarHBondContact O-N 3.39Å; T144-A147 PolarHBondContact O-N 3.17Å; T144-L148 HydrophobicContact CG2-CD1 4.39Å; T144-L148 WeakPolarHBondContact O-CG 3.39Å; T144-L148 PolarHBondContact O-N 2.71Å
145E90.5Very high89.4Confident125 Ų12542.5 Ų42.558%0.58422%0.219SC*.Hα-helixtrans-61.6-47.8176.1-176.8174.8-170.500111A141 V142 A147 L148 L149A141-E145 WeakPolarHBondContact O-CB 3.13Å; A141-E145 PolarHBondContact O-N 3.13Å; V142-E145 PolarHBondContact O-N 3.48Å; E145-A147 VanDerWaalsContact C-N 3.3Å; E145-A147 PolarHBondContact O-N 3.45Å; E145-L148 WeakPolarHBondContact O-CB 3.31Å; E145-L148 PolarHBondContact O-N 3.24Å; E145-L148 VanDerWaalsContact O-N 3.15Å; E145-L149 HydrophobicContact CG-CD1 4.26Å; E145-L149 WeakPolarHBondContact O-CG 3.19Å; E145-L149 PolarHBondContact O-N 3.49Å
146L91.6Very high89.4Confident17 Ų1741.1 Ų41.19%0.08922%0.215CC..Hα-helixtrans-61.3-37.5175.9-71.1167.2000112.3V142 Y150 W171 S175 L176 A322V142-L146 HydrophobicContact CG1-CD1 3.87Å; V142-L146 WeakPolarHBondContact O-CB 3.47Å; V142-L146 WeakPolarHBondContact O-CG 3.19Å; V142-L146 PolarHBondContact O-N 3.48Å; L146-Y150 WeakPolarHBondContact O-CB 3.45Å; L146-Y150 PolarHBondContact O-N 3.2Å; L146-W171 HydrophobicContact CD2-CZ3 4.15Å; L146-S175 VanDerWaalsContact CD1-CB 3.49Å; L146-L176 HydrophobicContact CB-CB 4.34Å; L146-L176 HydrophobicContact CB-CD1 4.4Å; L146-L176 HydrophobicContact CD1-CB 4.25Å; L146-A322 HydrophobicContact CD1-CB 4.5Å
147A95.2Very high89.5Confident0 Ų040.7 Ų40.70%022%0.215CC..Hα-helixtrans-66.3-39.3175.300000112.3I88 L89 A92 F96 P143 T144 E145 M151 L176I88-A147 HydrophobicContact CG2-CB 4.18Å; L89-A147 HydrophobicContact CD1-CB 3.94Å; L89-A147 HydrophobicContact CG-CB 4.23Å; A92-A147 HydrophobicContact CB-CB 3.81Å; F96-A147 HydrophobicContact CD2-CB 4.12Å; P143-A147 VanDerWaalsContact O-CB 3.25Å; P143-A147 WeakPolarHBondContact O-CB 3.48Å; P143-A147 PolarHBondContact O-N 3.02Å; T144-A147 PolarHBondContact O-N 3.17Å; E145-A147 VanDerWaalsContact C-N 3.3Å; E145-A147 PolarHBondContact O-N 3.45Å; A147-M151 WeakPolarHBondContact O-CG 3.26Å; A147-M151 PolarHBondContact O-N 3.03Å; A147-L176 HydrophobicContact CB-CD1 4.01Å
148L90.4Very high89.8Confident75 Ų7536.9 Ų36.939%0.39320%0.199SC..Hα-helixtrans-65-48174.6-70.7169.1000111.1I88 T144 E145 Y150 M151 I152I88-L148 HydrophobicContact CD1-CD2 4.49Å; I88-L148 HydrophobicContact CG2-CD2 3.87Å; I88-L148 HydrophobicContact CG2-CG 3.95Å; T144-L148 HydrophobicContact CG2-CD1 4.39Å; T144-L148 WeakPolarHBondContact O-CG 3.39Å; T144-L148 PolarHBondContact O-N 2.71Å; E145-L148 WeakPolarHBondContact O-CB 3.31Å; E145-L148 PolarHBondContact O-N 3.24Å; E145-L148 VanDerWaalsContact O-N 3.15Å; L148-Y150 VanDerWaalsContact C-N 3.33Å; L148-Y150 PolarHBondContact O-N 3.47Å; L148-M151 HydrophobicContact CD2-CE 3.69Å; L148-M151 HydrophobicContact CG-CE 4.48Å; L148-M151 PolarHBondContact O-N 3.3Å; L148-I152 VanDerWaalsContact O-CG1 3.29Å; L148-I152 WeakPolarHBondContact O-CG1 3.3Å; L148-I152 PolarHBondContact O-N 3.17Å
149L85.9Confident90.1Very high67 Ų6737.1 Ų37.135%0.35120%0.199SC..Hα-helixtrans-60.1-43.6176.6-69173.6000111.4E145 M151 I152 E153 M172E145-L149 HydrophobicContact CG-CD1 4.26Å; E145-L149 WeakPolarHBondContact O-CG 3.19Å; E145-L149 PolarHBondContact O-N 3.49Å; L149-M151 VanDerWaalsContact C-N 3.34Å; L149-M151 PolarHBondContact O-N 3.17Å; L149-I152 PolarHBondContact O-N 3.28Å; L149-I152 VanDerWaalsContact O-N 3.17Å; L149-E153 PolarHBondContact O-N 3.11Å; L149-M172 HydrophobicContact CB-CE 3.92Å; L149-M172 HydrophobicContact CB-SD 4.2Å
150Y92.3Very high90.1Very high0 Ų037.4 Ų37.40%020%0.202CC..Hα-helixtrans-57.9-45.4174.9176.7-89.5000111.9N93 F96 L146 L148 I152 N154 G155 G157 I159 A169 M172N93-Y150 HydrophobicContact CB-CE1 4.3Å; F96-Y150 AromaticContact CE2-CD1 3.85Å; F96-Y150 HydrophobicContact CE2-CD1 3.85Å; F96-Y150 HydrophobicContact CE2-CD2 4.39Å; F96-Y150 HydrophobicContact CE2-CE1 4.28Å; F96-Y150 AromaticContact CE2-CG 3.9Å; F96-Y150 HydrophobicContact CE2-CG 3.9Å; F96-Y150 HydrophobicContact CZ-CD1 4.24Å; F96-Y150 HydrophobicContact CZ-CD2 4.08Å; F96-Y150 HydrophobicContact CZ-CE1 4.41Å; F96-Y150 HydrophobicContact CZ-CE2 4.24Å; F96-Y150 HydrophobicContact CZ-CG 4.06Å; L146-Y150 WeakPolarHBondContact O-CB 3.45Å; L146-Y150 PolarHBondContact O-N 3.2Å; L148-Y150 VanDerWaalsContact C-N 3.33Å; L148-Y150 PolarHBondContact O-N 3.47Å; Y150-I152 VanDerWaalsContact C-N 3.35Å; Y150-I152 PolarHBondContact O-N 2.85Å; Y150-N154 HydrophobicContact CD2-CB 4.45Å; Y150-N154 HydrophobicContact CE2-CB 4.31Å; Y150-N154 WeakPolarHBondContact O-CA 3.4Å; Y150-N154 WeakPolarHBondContact O-CB 3.49Å; Y150-N154 PolarHBondContact O-N 3.27Å; Y150-N154 PolarHBondContact O-ND2 3Å; Y150-G155 WeakPolarHBondContact CE1-O 3.37Å; Y150-G155 PolarHBondContact O-N 3.44Å; Y150-G157 WeakPolarHBondContact CE1-O 3.46Å; Y150-G157 PolarHBondContact OH-O 3.36Å; Y150-I159 HydrophobicContact CE2-CD1 4.3Å; Y150-I159 WeakPolarHBondContact OH-CB 3.3Å; Y150-I159 VanDerWaalsContact OH-CD1 3.28Å; Y150-I159 WeakPolarHBondContact OH-CD1 3.49Å; Y150-I159 VanDerWaalsContact OH-CG1 3.22Å; Y150-I159 WeakPolarHBondContact OH-CG1 3.44Å; Y150-A169 HydrophobicContact CE2-CB 4.19Å; Y150-M172 VanDerWaalsContact CA-SD 3.57Å; Y150-M172 HydrophobicContact CD2-CB 4.33Å
151M90.8Very high90.3Very high41 Ų4137.3 Ų37.320%0.20220%0.201CC..Hα-helixtrans-65.2-36.6176.7-75.6-171.6-61.700113I88 I91 A92 A147 L148 L149 G155 P156I88-M151 HydrophobicContact CG2-CE 4.05Å; I91-M151 HydrophobicContact CB-SD 4.29Å; I91-M151 HydrophobicContact CG2-SD 3.68Å; A92-M151 VanDerWaalsContact CA-SD 3.55Å; A92-M151 HydrophobicContact CB-CE 4.28Å; A92-M151 HydrophobicContact CB-CG 3.57Å; A92-M151 HydrophobicContact CB-SD 3.75Å; A147-M151 WeakPolarHBondContact O-CG 3.26Å; A147-M151 PolarHBondContact O-N 3.03Å; L148-M151 HydrophobicContact CD2-CE 3.69Å; L148-M151 HydrophobicContact CG-CE 4.48Å; L148-M151 PolarHBondContact O-N 3.3Å; L149-M151 VanDerWaalsContact C-N 3.34Å; L149-M151 PolarHBondContact O-N 3.17Å; M151-G155 WeakPolarHBondContact O-CA 3.39Å; M151-G155 PolarHBondContact O-N 2.77Å; M151-G155 VanDerWaalsContact O-N 3.1Å; M151-P156 HydrophobicContact CG-CB 4.46Å
152I85.3Confident90.6Very high136 Ų13636.4 Ų36.470%0.69719%0.193SC*.Hα-helixtrans-68.4-44.9179.2-69.5164.4000110.6L148 L149 Y150L148-I152 VanDerWaalsContact O-CG1 3.29Å; L148-I152 WeakPolarHBondContact O-CG1 3.3Å; L148-I152 PolarHBondContact O-N 3.17Å; L149-I152 PolarHBondContact O-N 3.28Å; L149-I152 VanDerWaalsContact O-N 3.17Å; Y150-I152 VanDerWaalsContact C-N 3.35Å; Y150-I152 PolarHBondContact O-N 2.85Å
153E85.3Confident90.7Very high111 Ų11136.4 Ų36.452%0.51919%0.192SC..Hα-helixtrans-83.8-40.1-174.7-70.9-173-16800113.7L149 M172L149-E153 PolarHBondContact O-N 3.11Å; E153-M172 HydrophobicContact CG-CE 4.31Å; E153-M172 WeakPolarHBondContact OE1-CE 3.28Å; E153-M172 WeakPolarHBondContact OE2-CE 3.46Å
154N87.7Confident90.3Very high30 Ų3039.3 Ų39.316%0.1621%0.213CC..Hα-helixtrans-114.3-11.6-168.5-54.2-75.4000112.9Y150 I159Y150-N154 HydrophobicContact CD2-CB 4.45Å; Y150-N154 HydrophobicContact CE2-CB 4.31Å; Y150-N154 WeakPolarHBondContact O-CA 3.4Å; Y150-N154 WeakPolarHBondContact O-CB 3.49Å; Y150-N154 PolarHBondContact O-N 3.27Å; Y150-N154 PolarHBondContact O-ND2 3Å; N154-I159 HydrophobicContact CB-CD1 4.02Å
155G87.4Confident90Very high14 Ų1443.9 Ų43.914%0.14423%0.231CC..  trans76.4164.7-169.500000112.8Y150 M151Y150-G155 WeakPolarHBondContact CE1-O 3.37Å; Y150-G155 PolarHBondContact O-N 3.44Å; M151-G155 WeakPolarHBondContact O-CA 3.39Å; M151-G155 PolarHBondContact O-N 2.77Å; M151-G155 VanDerWaalsContact O-N 3.1Å
156P89.9Confident90Very high27 Ų2741.8 Ų41.818%0.17522%0.221CC..SBendtrans-69136.5174.427.8-31.1000110.5I49 I91 A92 M151I49-P156 HydrophobicContact CD1-CG 3.99Å; I49-P156 HydrophobicContact CG1-CB 4.09Å; I49-P156 HydrophobicContact CG1-CG 3.38Å; I91-P156 VanDerWaalsContact O-CB 3.27Å; I91-P156 WeakPolarHBondContact O-CB 3.31Å; A92-P156 WeakPolarHBondContact O-CA 3.46Å; M151-P156 HydrophobicContact CG-CB 4.46Å
157G90.7Very high90Very high13 Ų1345.5 Ų45.513%0.13424%0.235CC..SBendtrans151.3161.8179.300000112.9A92 N93 Y150A92-G157 PolarHBondContact O-N 2.99Å; N93-G157 PolarHBondContact ND2-O 3.44Å; Y150-G157 WeakPolarHBondContact CE1-O 3.46Å; Y150-G157 PolarHBondContact OH-O 3.36Å
158E92.1Very high89.7Confident33 Ų3347.8 Ų47.815%0.15425%0.251CS..  trans-86.8123.4175.1-6463.8-134.900109.3R53 F94 F244 V245R53-E158 IonicContact CZ-OE1 2.78Å; R53-E158 IonicContact CZ-OE2 2.71Å; R53-E158 IonicContact NH1-OE1 2.78Å; R53-E158 PolarHBondContact NH1-OE1 3.4Å; R53-E158 IonicContact NH2-OE1 3.44Å; R53-E158 PolarHBondContact NH2-OE1 3.45Å; R53-E158 IonicContact NH2-OE2 3.42Å; R53-E158 PolarHBondContact NH2-OE2 2.92Å; F94-E158 WeakPolarHBondContact CD2-OE1 3.46Å; F94-E158 PolarHBondContact N-OE1 3.07Å; E158-F244 HydrophobicContact CB-CB 4.39Å; E158-F244 HydrophobicContact CG-CB 3.8Å; E158-V245 HydrophobicContact CB-CG2 3.61Å
159I91.1Very high89.9Confident14 Ų1444.2 Ų44.27%0.07223%0.232CC..  trans-122.3136178.4-62.5175.3000107.6Y150 N154 A169 Q241Y150-I159 HydrophobicContact CE2-CD1 4.3Å; Y150-I159 WeakPolarHBondContact OH-CB 3.3Å; Y150-I159 VanDerWaalsContact OH-CD1 3.28Å; Y150-I159 WeakPolarHBondContact OH-CD1 3.49Å; Y150-I159 VanDerWaalsContact OH-CG1 3.22Å; Y150-I159 WeakPolarHBondContact OH-CG1 3.44Å; N154-I159 HydrophobicContact CB-CD1 4.02Å; I159-A169 HydrophobicContact CD1-CB 4.46Å; I159-Q241 PolarHBondContact O-OE1 3.13Å
160P92.4Very high90.3Very high26 Ų2641 Ų4117%0.16922%0.216CC..  trans-64144174.627.1-33000110.7D162 V245 S251P160-D162 PolarHBondContact O-N 2.7Å; P160-D162 VanDerWaalsContact O-N 3.11Å; P160-V245 HydrophobicContact CB-CG1 4.26Å; P160-V245 HydrophobicContact CG-CG1 4.27Å; P160-S251 WeakPolarHBondContact CG-OG 3.29Å
161V93.6Very high90.5Very high0 Ų043.3 Ų43.30%022%0.224CC..  trans-76.7103.1175.2-175.40000108.5F163 C173 L174 Q254 I257 W333V161-F163 HydrophobicContact CG1-CE2 4.43Å; V161-C173 HydrophobicContact CG2-CB 4.1Å; V161-L174 HydrophobicContact CG1-CD1 4Å; V161-L174 HydrophobicContact CG1-CD2 4.02Å; V161-L174 HydrophobicContact CG1-CG 3.82Å; V161-L174 HydrophobicContact CG2-CD2 4.3Å; V161-Q254 PolarHBondContact O-NE2 3.24Å; V161-I257 HydrophobicContact CB-CD1 4.36Å; V161-I257 HydrophobicContact CG2-CD1 3.88Å; V161-I257 HydrophobicContact CG2-CG1 4.38Å; V161-W333 HydrophobicContact CB-CZ2 3.94Å; V161-W333 HydrophobicContact CG1-CD2 4.45Å; V161-W333 HydrophobicContact CG1-CH2 4.32Å; V161-W333 HydrophobicContact CG1-CZ2 3.51Å; V161-W333 PolarHBondContact O-NE1 2.93Å; V161-W333 VanDerWaalsContact O-NE1 3.09Å
162D92.6Very high90.7Very high3 Ų342 Ų422%0.01622%0.217CC..  trans-145.798.4-179.6-172.3-14.4000110.4P160 S164 K165 Q166 S170 A252P160-D162 PolarHBondContact O-N 2.7Å; P160-D162 VanDerWaalsContact O-N 3.11Å; D162-S164 PolarHBondContact O-N 2.86Å; D162-S164 WeakPolarHBondContact OD1-CB 3.15Å; D162-S164 PolarHBondContact OD1-N 2.64Å; D162-S164 PolarHBondContact OD1-OG 2.93Å; D162-K165 PolarHBondContact O-N 2.86Å; D162-K165 WeakPolarHBondContact OD2-CD 3.29Å; D162-K165 WeakPolarHBondContact OD2-CE 3.47Å; D162-Q166 PolarHBondContact O-N 3.3Å; D162-S170 PolarHBondContact N-OG 3.33Å; D162-S170 PolarHBondContact O-OG 3.21Å; D162-A252 HydrophobicContact CB-CB 4.19Å
163F91Very high91.3Very high14 Ų1435.5 Ų35.56%0.06119%0.185CC..THydrogen-bonded Turntrans-65.5-16.3180-73.9-78.3000114.2V161 Y167 W171 L174 W330 W333V161-F163 HydrophobicContact CG1-CE2 4.43Å; F163-Y167 AromaticContact CD1-CD2 3.7Å; F163-Y167 HydrophobicContact CD1-CD2 3.7Å; F163-Y167 HydrophobicContact CD1-CE2 4.01Å; F163-Y167 HydrophobicContact CD1-CG 4.44Å; F163-Y167 HydrophobicContact CE1-CD2 4.37Å; F163-Y167 HydrophobicContact CE1-CE2 4.32Å; F163-W171 HydrophobicContact CE1-CB 4.04Å; F163-L174 HydrophobicContact CE2-CD1 3.65Å; F163-L174 HydrophobicContact CZ-CD1 3.73Å; F163-W330 HydrophobicContact CD1-CB 4.16Å; F163-W330 AromaticContact CD1-CD1 3.7Å; F163-W330 HydrophobicContact CD1-CG 4.17Å; F163-W330 HydrophobicContact CE1-CB 4.04Å; F163-W330 HydrophobicContact CE1-CG 4.49Å; F163-W330 HydrophobicContact CE2-CB 4.47Å; F163-W330 HydrophobicContact CG-CB 4.42Å; F163-W330 AromaticContact CG-CD1 3.65Å; F163-W330 HydrophobicContact CG-CG 4.39Å; F163-W330 HydrophobicContact CZ-CB 4.18Å; F163-W333 HydrophobicContact CD2-CB 3.55Å; F163-W333 AromaticContact CD2-CD1 3.81Å; F163-W333 HydrophobicContact CD2-CD2 4.22Å; F163-W333 AromaticContact CD2-CG 3.57Å; F163-W333 HydrophobicContact CD2-CG 3.57Å; F163-W333 HydrophobicContact CE2-CB 3.92Å; F163-W333 HydrophobicContact CE2-CD2 4.01Å; F163-W333 HydrophobicContact CE2-CE3 4.33Å; F163-W333 AromaticContact CE2-CG 3.82Å; F163-W333 HydrophobicContact CE2-CG 3.82Å
164S87.4Confident91.9Very high63 Ų6330.2 Ų30.244%0.44116%0.16SC..THydrogen-bonded Turntrans-77.1-33.7178.572.80000112.1D162D162-S164 PolarHBondContact O-N 2.86Å; D162-S164 WeakPolarHBondContact OD1-CB 3.15Å; D162-S164 PolarHBondContact OD1-N 2.64Å; D162-S164 PolarHBondContact OD1-OG 2.93Å
165K87.6Confident92.3Very high113 Ų11328.8 Ų28.849%0.49115%0.152SC..THydrogen-bonded Turntrans-95.9-43.3-178.5-62.7-179.3-171.5173.20112D162 I250D162-K165 PolarHBondContact O-N 2.86Å; D162-K165 WeakPolarHBondContact OD2-CD 3.29Å; D162-K165 WeakPolarHBondContact OD2-CE 3.47Å; K165-I250 PolarHBondContact NZ-O 3Å
166Q89.4Confident92.8Very high81 Ų8128.1 Ų28.138%0.37915%0.145SC..  trans-14283.7-171.9-62.1-176.720.200110.7D162 A169 S170D162-Q166 PolarHBondContact O-N 3.3Å; Q166-A169 HydrophobicContact CB-CB 4.06Å; Q166-S170 WeakPolarHBondContact O-CB 3.31Å; Q166-S170 PolarHBondContact O-N 3.39Å; Q166-S170 VanDerWaalsContact O-N 3.09Å; Q166-S170 PolarHBondContact O-OG 2.96Å
167Y91.2Very high93.3Very high94 Ų9426.9 Ų26.937%0.36914%0.137SC..Hα-helixtrans-59.6-52.9-178.4178.5-90.8000112.6F163 S170 W171 W330F163-Y167 AromaticContact CD1-CD2 3.7Å; F163-Y167 HydrophobicContact CD1-CD2 3.7Å; F163-Y167 HydrophobicContact CD1-CE2 4.01Å; F163-Y167 HydrophobicContact CD1-CG 4.44Å; F163-Y167 HydrophobicContact CE1-CD2 4.37Å; F163-Y167 HydrophobicContact CE1-CE2 4.32Å; Y167-S170 PolarHBondContact O-N 3.03Å; Y167-W171 VanDerWaalsContact O-CB 3.28Å; Y167-W171 WeakPolarHBondContact O-CB 3.33Å; Y167-W171 PolarHBondContact O-N 3.41Å; Y167-W330 AromaticContact CD2-CD1 3.99Å; Y167-W330 HydrophobicContact CD2-CD2 4.35Å; Y167-W330 HydrophobicContact CD2-CG 4.29Å; Y167-W330 AromaticContact CD2-NE1 3.8Å; Y167-W330 HydrophobicContact CE2-CB 4.35Å; Y167-W330 AromaticContact CE2-CD1 3.82Å; Y167-W330 AromaticContact CE2-CD2 3.58Å; Y167-W330 HydrophobicContact CE2-CD2 3.58Å; Y167-W330 AromaticContact CE2-CE2 3.68Å; Y167-W330 HydrophobicContact CE2-CE3 4.1Å; Y167-W330 AromaticContact CE2-CG 3.67Å; Y167-W330 HydrophobicContact CE2-CG 3.67Å; Y167-W330 HydrophobicContact CE2-CZ2 4.29Å; Y167-W330 AromaticContact CE2-NE1 3.81Å
168S90.8Very high93.6Very high48 Ų4826.2 Ų26.234%0.33613%0.131SC..Hα-helixtrans-63.5-48.7-175.3530000112.3S170 W171 M172S168-S170 PolarHBondContact O-N 3.28Å; S168-W171 PolarHBondContact O-N 3.11Å; S168-M172 WeakPolarHBondContact O-CG 3.18Å; S168-M172 PolarHBondContact O-N 3.08Å
169A93.2Very high93.9Very high0 Ų024.7 Ų24.70%012%0.123CC..Hα-helixtrans-58.5-48.2177.100000111.9Y150 I159 Q166 W171 M172 C173Y150-A169 HydrophobicContact CE2-CB 4.19Å; I159-A169 HydrophobicContact CD1-CB 4.46Å; Q166-A169 HydrophobicContact CB-CB 4.06Å; A169-W171 VanDerWaalsContact C-N 3.33Å; A169-W171 PolarHBondContact O-N 2.96Å; A169-M172 PolarHBondContact O-N 3.43Å; A169-C173 WeakPolarHBondContact O-CB 3.39Å; A169-C173 PolarHBondContact O-N 2.67Å; A169-C173 PolarHBondContact O-SG 3.41Å
170S95.4Very high94.3Very high1 Ų124 Ų241%0.00712%0.12CC..Hα-helixtrans-62.5-41.9179.6-61.40000111.8D162 Q166 Y167 S168 C173 L174D162-S170 PolarHBondContact N-OG 3.33Å; D162-S170 PolarHBondContact O-OG 3.21Å; Q166-S170 WeakPolarHBondContact O-CB 3.31Å; Q166-S170 PolarHBondContact O-N 3.39Å; Q166-S170 VanDerWaalsContact O-N 3.09Å; Q166-S170 PolarHBondContact O-OG 2.96Å; Y167-S170 PolarHBondContact O-N 3.03Å; S168-S170 PolarHBondContact O-N 3.28Å; S170-C173 PolarHBondContact O-N 2.91Å; S170-L174 WeakPolarHBondContact O-CG 3.38Å; S170-L174 PolarHBondContact O-N 3.43Å
171W95.4Very high94.5Very high47 Ų4722.8 Ų22.818%0.17811%0.112CC..Hα-helixtrans-61.6-50.4176.1-170.795.2000110.9L146 F163 Y167 S168 A169 C173 L174 S175 L323 P326 T327L146-W171 HydrophobicContact CD2-CZ3 4.15Å; F163-W171 HydrophobicContact CE1-CB 4.04Å; Y167-W171 VanDerWaalsContact O-CB 3.28Å; Y167-W171 WeakPolarHBondContact O-CB 3.33Å; Y167-W171 PolarHBondContact O-N 3.41Å; S168-W171 PolarHBondContact O-N 3.11Å; A169-W171 VanDerWaalsContact C-N 3.33Å; A169-W171 PolarHBondContact O-N 2.96Å; W171-C173 PolarHBondContact O-N 2.91Å; W171-L174 PolarHBondContact O-N 2.96Å; W171-S175 VanDerWaalsContact CE3-OG 3.32Å; W171-S175 WeakPolarHBondContact CH2-OG 3.28Å; W171-S175 VanDerWaalsContact CZ3-OG 3.32Å; W171-S175 WeakPolarHBondContact CZ3-OG 3.32Å; W171-S175 WeakPolarHBondContact O-CB 3.35Å; W171-S175 PolarHBondContact O-N 2.91Å; W171-S175 PolarHBondContact O-OG 3.45Å; W171-L323 HydrophobicContact CH2-CD2 3.66Å; W171-L323 HydrophobicContact CZ2-CD2 4.06Å; W171-P326 HydrophobicContact CG-CB 4.21Å; W171-T327 PolarHBondContact NE1-OG1 2.9Å
172M95.4Very high94.8Very high13 Ų1322.9 Ų22.96%0.06411%0.113CC..Hα-helixtrans-61.1-42178.5-69.8178.7-179.400112.7L149 Y150 E153 S168 A169 L174 S175 L176L149-M172 HydrophobicContact CB-CE 3.92Å; L149-M172 HydrophobicContact CB-SD 4.2Å; Y150-M172 VanDerWaalsContact CA-SD 3.57Å; Y150-M172 HydrophobicContact CD2-CB 4.33Å; E153-M172 HydrophobicContact CG-CE 4.31Å; E153-M172 WeakPolarHBondContact OE1-CE 3.28Å; E153-M172 WeakPolarHBondContact OE2-CE 3.46Å; S168-M172 WeakPolarHBondContact O-CG 3.18Å; S168-M172 PolarHBondContact O-N 3.08Å; A169-M172 PolarHBondContact O-N 3.43Å; M172-L174 PolarHBondContact O-N 3.29Å; M172-S175 PolarHBondContact O-N 3.41Å; M172-L176 WeakPolarHBondContact O-CB 3.5Å; M172-L176 PolarHBondContact O-N 3.32Å
173C97.1Very high95Very high1 Ų122.8 Ų22.81%0.00711%0.112CC..Hα-helixtrans-57.5-48.3175.1-76.80000111.7F96 V161 A169 S170 W171 L177 Y237F96-C173 HydrophobicContact CE1-CB 4.23Å; V161-C173 HydrophobicContact CG2-CB 4.1Å; A169-C173 WeakPolarHBondContact O-CB 3.39Å; A169-C173 PolarHBondContact O-N 2.67Å; A169-C173 PolarHBondContact O-SG 3.41Å; S170-C173 PolarHBondContact O-N 2.91Å; W171-C173 PolarHBondContact O-N 2.91Å; C173-L177 PolarHBondContact O-N 3.47Å; C173-L177 VanDerWaalsContact O-N 3.07Å; C173-Y237 WeakPolarHBondContact CB-OH 3.13Å; C173-Y237 PolarHBondContact SG-OH 2.97Å; C173-Y237 VanDerWaalsContact SG-OH 3.4Å
174L97.8Very high95.3Very high0 Ų022.1 Ų22.10%011%0.109CC..Hα-helixtrans-71.4-36.6178.3-69.2-168.6000112.4V161 F163 S170 W171 M172 L176 L177 A178 F260 P326 A329 W333V161-L174 HydrophobicContact CG1-CD1 4Å; V161-L174 HydrophobicContact CG1-CD2 4.02Å; V161-L174 HydrophobicContact CG1-CG 3.82Å; V161-L174 HydrophobicContact CG2-CD2 4.3Å; F163-L174 HydrophobicContact CE2-CD1 3.65Å; F163-L174 HydrophobicContact CZ-CD1 3.73Å; S170-L174 WeakPolarHBondContact O-CG 3.38Å; S170-L174 PolarHBondContact O-N 3.43Å; W171-L174 PolarHBondContact O-N 2.96Å; M172-L174 PolarHBondContact O-N 3.29Å; L174-L176 VanDerWaalsContact C-N 3.31Å; L174-L176 PolarHBondContact O-N 2.75Å; L174-L177 PolarHBondContact O-N 3.16Å; L174-A178 WeakPolarHBondContact O-CB 3.37Å; L174-A178 PolarHBondContact O-N 3.09Å; L174-F260 HydrophobicContact CB-CE1 3.94Å; L174-F260 HydrophobicContact CB-CE2 4.32Å; L174-F260 HydrophobicContact CB-CZ 3.78Å; L174-F260 HydrophobicContact CD1-CD2 4.28Å; L174-F260 HydrophobicContact CD1-CE2 4.11Å; L174-F260 HydrophobicContact CD1-CZ 4.37Å; L174-F260 HydrophobicContact CD2-CD1 3.95Å; L174-F260 HydrophobicContact CD2-CE1 4.08Å; L174-F260 HydrophobicContact CD2-CG 4.27Å; L174-F260 HydrophobicContact CD2-CZ 4.5Å; L174-F260 HydrophobicContact CG-CE1 4.46Å; L174-F260 HydrophobicContact CG-CZ 4.44Å; L174-F260 VanDerWaalsContact O-CE1 3.29Å; L174-F260 WeakPolarHBondContact O-CE1 3.2Å; L174-P326 HydrophobicContact CB-CB 3.91Å; L174-P326 HydrophobicContact CB-CG 4Å; L174-A329 HydrophobicContact CD1-CB 4.25Å; L174-W333 HydrophobicContact CD1-CD2 4.34Å; L174-W333 HydrophobicContact CD1-CE3 3.83Å; L174-W333 HydrophobicContact CD1-CH2 3.77Å; L174-W333 HydrophobicContact CD1-CZ2 4.29Å; L174-W333 HydrophobicContact CD1-CZ3 3.52Å; L174-W333 HydrophobicContact CD2-CH2 3.67Å; L174-W333 HydrophobicContact CD2-CZ2 4.25Å; L174-W333 HydrophobicContact CD2-CZ3 4.17Å; L174-W333 HydrophobicContact CG-CH2 4.35Å
175S97.7Very high95.8Very high0 Ų019.1 Ų19.10%09%0.088CC..Hα-helixtrans-58.9-44.1174-65.70000111.5L146 W171 M172 A178 A179 A322 P326L146-S175 VanDerWaalsContact CD1-CB 3.49Å; W171-S175 VanDerWaalsContact CE3-OG 3.32Å; W171-S175 WeakPolarHBondContact CH2-OG 3.28Å; W171-S175 VanDerWaalsContact CZ3-OG 3.32Å; W171-S175 WeakPolarHBondContact CZ3-OG 3.32Å; W171-S175 WeakPolarHBondContact O-CB 3.35Å; W171-S175 PolarHBondContact O-N 2.91Å; W171-S175 PolarHBondContact O-OG 3.45Å; M172-S175 PolarHBondContact O-N 3.41Å; S175-A178 PolarHBondContact O-N 3.32Å; S175-A179 PolarHBondContact O-N 2.93Å; S175-A322 WeakPolarHBondContact CB-O 3.29Å; S175-A322 WeakPolarHBondContact O-CB 3.41Å; S175-A322 PolarHBondContact OG-O 2.97Å; S175-P326 WeakPolarHBondContact OG-CG 3.45Å
176L98.1Very high96.2Very high0 Ų014.8 Ų14.80%07%0.07CC..Hα-helixtrans-67-46.4179.4-174.3151.7000111.2F96 P143 L146 A147 M172 L174 A178 A179 L180F96-L176 HydrophobicContact CB-CD1 3.9Å; F96-L176 HydrophobicContact CB-CD2 3.68Å; F96-L176 HydrophobicContact CB-CG 4.48Å; F96-L176 HydrophobicContact CD1-CD1 3.92Å; F96-L176 HydrophobicContact CD1-CD2 3.62Å; F96-L176 HydrophobicContact CD1-CG 4.27Å; F96-L176 HydrophobicContact CD2-CD1 3.39Å; F96-L176 HydrophobicContact CD2-CD2 4.48Å; F96-L176 HydrophobicContact CE1-CD1 4.28Å; F96-L176 HydrophobicContact CE1-CD2 4.39Å; F96-L176 HydrophobicContact CE2-CD1 3.82Å; F96-L176 HydrophobicContact CG-CD1 3.46Å; F96-L176 VanDerWaalsContact CG-CD1 3.46Å; F96-L176 HydrophobicContact CG-CD2 3.68Å; F96-L176 HydrophobicContact CG-CG 4.19Å; F96-L176 HydrophobicContact CZ-CD1 4.25Å; P143-L176 HydrophobicContact CB-CD1 4.38Å; P143-L176 HydrophobicContact CB-CG 4.01Å; P143-L176 VanDerWaalsContact O-CD1 3.25Å; P143-L176 WeakPolarHBondContact O-CD1 3.43Å; L146-L176 HydrophobicContact CB-CB 4.34Å; L146-L176 HydrophobicContact CB-CD1 4.4Å; L146-L176 HydrophobicContact CD1-CB 4.25Å; A147-L176 HydrophobicContact CB-CD1 4.01Å; M172-L176 WeakPolarHBondContact O-CB 3.5Å; M172-L176 PolarHBondContact O-N 3.32Å; L174-L176 VanDerWaalsContact C-N 3.31Å; L174-L176 PolarHBondContact O-N 2.75Å; L176-A178 VanDerWaalsContact C-N 3.27Å; L176-A178 PolarHBondContact O-N 3.25Å; L176-A179 PolarHBondContact O-N 2.96Å; L176-L180 HydrophobicContact CD2-CD1 3.66Å; L176-L180 HydrophobicContact CD2-CG 4.46Å; L176-L180 PolarHBondContact O-N 3Å; L176-L180 VanDerWaalsContact O-N 3.14Å
177L98.6Very high96.5Very high0 Ų011.7 Ų11.70%06%0.057CC..Hα-helixtrans-59-42174.2175.258.4000111C173 L174 L180 A181 V233 Y237 I257 F260C173-L177 PolarHBondContact O-N 3.47Å; C173-L177 VanDerWaalsContact O-N 3.07Å; L174-L177 PolarHBondContact O-N 3.16Å; L177-L180 PolarHBondContact O-N 3.41Å; L177-A181 WeakPolarHBondContact O-CB 3.38Å; L177-A181 PolarHBondContact O-N 2.97Å; L177-V233 HydrophobicContact CD1-CG1 3.78Å; L177-Y237 HydrophobicContact CB-CD2 4.24Å; L177-Y237 HydrophobicContact CB-CE2 4.49Å; L177-Y237 HydrophobicContact CD1-CD2 4.26Å; L177-Y237 HydrophobicContact CD2-CD2 4.34Å; L177-Y237 HydrophobicContact CD2-CG 4.32Å; L177-I257 HydrophobicContact CD2-CG2 3.52Å; L177-F260 HydrophobicContact CD2-CD1 3.94Å; L177-F260 HydrophobicContact CD2-CE1 4.47Å; L177-F260 HydrophobicContact CG-CD1 4.3Å; L177-F260 HydrophobicContact CG-CE1 4.46Å
178A98.6Very high96.8Very high0 Ų09.2 Ų9.20%05%0.047CC..Hα-helixtrans-64.1-43-179.200000111.9L174 S175 L176 C182 F260 A264 I321L174-A178 WeakPolarHBondContact O-CB 3.37Å; L174-A178 PolarHBondContact O-N 3.09Å; S175-A178 PolarHBondContact O-N 3.32Å; L176-A178 VanDerWaalsContact C-N 3.27Å; L176-A178 PolarHBondContact O-N 3.25Å; A178-C182 WeakPolarHBondContact O-CB 3.32Å; A178-C182 PolarHBondContact O-N 3.4Å; A178-F260 HydrophobicContact CB-CE1 3.79Å; A178-F260 HydrophobicContact CB-CZ 3.88Å; A178-A264 HydrophobicContact CB-CB 4.09Å; A178-I321 HydrophobicContact CB-CG2 3.85Å
179A97.8Very high97Very high0 Ų07.8 Ų7.80%04%0.039CC..Hα-helixtrans-60.3-49.4175.100000111.9V142 P143 S175 L176 C182 S183 A322V142-A179 HydrophobicContact CB-CB 4.35Å; V142-A179 HydrophobicContact CG1-CB 3.93Å; P143-A179 HydrophobicContact CG-CB 3.95Å; S175-A179 PolarHBondContact O-N 2.93Å; L176-A179 PolarHBondContact O-N 2.96Å; A179-C182 WeakPolarHBondContact O-CB 3.47Å; A179-C182 PolarHBondContact O-N 3.15Å; A179-S183 PolarHBondContact O-N 3.26Å; A179-S183 VanDerWaalsContact O-N 3.13Å; A179-S183 PolarHBondContact O-OG 3.41Å; A179-A322 HydrophobicContact CB-CB 4.17Å
180L98.4Very high96.9Very high0 Ų010.4 Ų10.40%06%0.057CC..Hα-helixtrans-68-39.4-179.9-69175.2000112.6L89 L100 F103 P143 L176 L177 S183 A184 V233L89-L180 HydrophobicContact CD2-CD1 4.48Å; L100-L180 HydrophobicContact CB-CD1 4.17Å; L100-L180 HydrophobicContact CB-CD2 4.37Å; L100-L180 HydrophobicContact CD1-CD2 3.91Å; F103-L180 HydrophobicContact CD1-CD2 4.45Å; P143-L180 HydrophobicContact CB-CD2 4.17Å; P143-L180 HydrophobicContact CB-CG 4.22Å; P143-L180 HydrophobicContact CG-CD2 3.63Å; P143-L180 HydrophobicContact CG-CG 3.8Å; L176-L180 HydrophobicContact CD2-CD1 3.66Å; L176-L180 HydrophobicContact CD2-CG 4.46Å; L176-L180 PolarHBondContact O-N 3Å; L176-L180 VanDerWaalsContact O-N 3.14Å; L177-L180 PolarHBondContact O-N 3.41Å; L180-S183 PolarHBondContact O-N 2.82Å; L180-A184 VanDerWaalsContact O-CB 3.32Å; L180-A184 WeakPolarHBondContact O-CB 3.34Å; L180-A184 PolarHBondContact O-N 3.45Å; L180-V233 HydrophobicContact CB-CG1 4.34Å
181A98.6Very high96.8Very high0 Ų011.8 Ų11.80%06%0.063CC..Hα-helixtrans-67.6-37176.700000111.7L177 A184 G185 G261 A264 G265L177-A181 WeakPolarHBondContact O-CB 3.38Å; L177-A181 PolarHBondContact O-N 2.97Å; A181-A184 PolarHBondContact O-N 2.67Å; A181-G185 PolarHBondContact O-N 3.16Å; A181-G261 WeakPolarHBondContact CB-O 3.34Å; A181-A264 HydrophobicContact CB-CB 3.83Å; A181-G265 VanDerWaalsContact O-CA 3.22Å; A181-G265 WeakPolarHBondContact O-CA 3.39Å
182C98.1Very high96.7Very high3 Ų310.3 Ų10.32%0.026%0.059CC..Hα-helixtrans-57.1-55.1171.6176.30000110.8A178 A179 A184 G185 D186 G268 I321A178-C182 WeakPolarHBondContact O-CB 3.32Å; A178-C182 PolarHBondContact O-N 3.4Å; A179-C182 WeakPolarHBondContact O-CB 3.47Å; A179-C182 PolarHBondContact O-N 3.15Å; C182-A184 VanDerWaalsContact C-N 3.31Å; C182-A184 PolarHBondContact O-N 2.84Å; C182-G185 PolarHBondContact O-N 2.93Å; C182-D186 PolarHBondContact O-N 3.22Å; C182-G268 WeakPolarHBondContact SG-CA 3.37Å; C182-I321 HydrophobicContact CB-CB 4.44Å; C182-I321 HydrophobicContact CB-CG2 4.25Å
183S97.1Very high96.5Very high1 Ų110 Ų101%0.0076%0.059CC..Hα-helixtrans-61.3-37.7177.8-61.90000112.8N139 A179 L180 T187N139-S183 WeakPolarHBondContact OD1-CB 3.39Å; N139-S183 PolarHBondContact OD1-OG 3.17Å; A179-S183 PolarHBondContact O-N 3.26Å; A179-S183 VanDerWaalsContact O-N 3.13Å; A179-S183 PolarHBondContact O-OG 3.41Å; L180-S183 PolarHBondContact O-N 2.82Å; S183-T187 PolarHBondContact O-N 3.26Å; S183-T187 VanDerWaalsContact O-N 3.09Å; S183-T187 PolarHBondContact O-OG1 2.93Å
184A98Very high95.9Very high0 Ų012.1 Ų12.10%07%0.072CC..Hα-helixtrans-66.2-43.317500000112F103 L180 A181 C182 T187 W188 V233F103-A184 HydrophobicContact CB-CB 4.33Å; F103-A184 VanDerWaalsContact CD2-CA 3.5Å; F103-A184 HydrophobicContact CD2-CB 3.62Å; F103-A184 HydrophobicContact CE2-CB 4.37Å; F103-A184 HydrophobicContact CG-CB 4.33Å; L180-A184 VanDerWaalsContact O-CB 3.32Å; L180-A184 WeakPolarHBondContact O-CB 3.34Å; L180-A184 PolarHBondContact O-N 3.45Å; A181-A184 PolarHBondContact O-N 2.67Å; C182-A184 VanDerWaalsContact C-N 3.31Å; C182-A184 PolarHBondContact O-N 2.84Å; A184-T187 PolarHBondContact O-N 2.93Å; A184-W188 WeakPolarHBondContact O-CB 3.25Å; A184-W188 PolarHBondContact O-N 3.42Å; A184-V233 HydrophobicContact CB-CG2 3.61Å
185G97.6Very high95.5Very high0 Ų012.7 Ų12.70%08%0.076CC..Hα-helixtrans-61.1-48.6178.700000111.7A181 C182 W188 A189 S226A181-G185 PolarHBondContact O-N 3.16Å; C182-G185 PolarHBondContact O-N 2.93Å; G185-W188 PolarHBondContact O-N 2.8Å; G185-A189 WeakPolarHBondContact O-CB 3.45Å; G185-A189 PolarHBondContact O-N 3.21Å; G185-S226 WeakPolarHBondContact O-CA 3.46Å; G185-S226 WeakPolarHBondContact O-CB 3.44Å
186D95.9Very high95.1Very high21 Ų2116.8 Ų16.811%0.11210%0.097CC..Hα-helixtrans-57.5-49174.9173.351.6000112.1C182 W188 A189 S190 N314C182-D186 PolarHBondContact O-N 3.22Å; D186-W188 VanDerWaalsContact C-N 3.34Å; D186-W188 PolarHBondContact O-N 3.17Å; D186-A189 PolarHBondContact O-N 3.06Å; D186-S190 PolarHBondContact O-N 3.36Å; D186-S190 PolarHBondContact O-OG 3.47Å; D186-N314 PolarHBondContact OD2-ND2 2.96Å
187T95.2Very high94.6Very high16 Ų1618.2 Ų18.210%0.09811%0.107CC..Hα-helixtrans-62.8-41.1178.6-53.60000111.8S107 S183 A184 S190 E191S107-T187 WeakPolarHBondContact OG-CG2 3.14Å; S183-T187 PolarHBondContact O-N 3.26Å; S183-T187 VanDerWaalsContact O-N 3.09Å; S183-T187 PolarHBondContact O-OG1 2.93Å; A184-T187 PolarHBondContact O-N 2.93Å; T187-S190 PolarHBondContact O-OG 2.94Å; T187-E191 HydrophobicContact CG2-CG 3.75Å; T187-E191 WeakPolarHBondContact O-CB 3.21Å; T187-E191 WeakPolarHBondContact O-CG 3.49Å; T187-E191 PolarHBondContact O-N 3.39Å
188W97.2Very high93.8Very high42 Ų4228.2 Ų28.216%0.15915%0.151CC..Hα-helixtrans-67.6-39.6177.8-79.449000111.6S106 L110 A184 G185 D186 V192 S225 L228 F232S106-W188 PolarHBondContact OG-NE1 3.1Å; L110-W188 HydrophobicContact CD1-CB 4.19Å; L110-W188 HydrophobicContact CD1-CD2 3.6Å; L110-W188 HydrophobicContact CD1-CE3 4.38Å; L110-W188 HydrophobicContact CD1-CG 3.46Å; L110-W188 VanDerWaalsContact CD1-CG 3.46Å; L110-W188 HydrophobicContact CD1-CZ2 4.5Å; A184-W188 WeakPolarHBondContact O-CB 3.25Å; A184-W188 PolarHBondContact O-N 3.42Å; G185-W188 PolarHBondContact O-N 2.8Å; D186-W188 VanDerWaalsContact C-N 3.34Å; D186-W188 PolarHBondContact O-N 3.17Å; W188-V192 WeakPolarHBondContact O-CB 3.46Å; W188-V192 VanDerWaalsContact O-CG2 3.31Å; W188-V192 WeakPolarHBondContact O-CG2 3.5Å; W188-V192 PolarHBondContact O-N 3.17Å; W188-S225 WeakPolarHBondContact CB-O 3.28Å; W188-L228 HydrophobicContact CE3-CB 4.14Å; W188-L228 HydrophobicContact CZ3-CB 3.92Å; W188-F232 HydrophobicContact CH2-CB 4.17Å; W188-F232 HydrophobicContact CH2-CG 4.26Å; W188-F232 HydrophobicContact CZ2-CB 4.19Å; W188-F232 AromaticContact CZ2-CD1 3.94Å; W188-F232 HydrophobicContact CZ2-CD1 3.94Å; W188-F232 HydrophobicContact CZ2-CG 4.13Å
189A95.9Very high93.2Very high19 Ų1932.2 Ų32.216%0.15718%0.179CC..Hα-helixtrans-61.6-49.4176.700000112.2G185 D186 G193 G222G185-A189 WeakPolarHBondContact O-CB 3.45Å; G185-A189 PolarHBondContact O-N 3.21Å; D186-A189 PolarHBondContact O-N 3.06Å; A189-G193 WeakPolarHBondContact O-CA 3.49Å; A189-G193 PolarHBondContact O-N 3.27Å; A189-G222 WeakPolarHBondContact CA-O 3.38Å; A189-G222 WeakPolarHBondContact CB-O 3.19Å
190S91.8Very high92.8Very high54 Ų5435.3 Ų35.338%0.37820%0.199SC..Hα-helixtrans-68.1-44.2-179.753.50000111.9D186 T187 T194D186-S190 PolarHBondContact O-N 3.36Å; D186-S190 PolarHBondContact O-OG 3.47Å; T187-S190 PolarHBondContact O-OG 2.94Å; S190-T194 WeakPolarHBondContact O-CB 3.46Å; S190-T194 PolarHBondContact O-N 3.09Å; S190-T194 PolarHBondContact O-OG1 2.82Å
191E93Very high92.6Very high31 Ų3135.8 Ų35.815%0.14520%0.201CC..Hα-helixtrans-78.3-34-173.9-62.1-74.1-160.600113.6L110 T111 K118 T187 V195L110-E191 HydrophobicContact CB-CB 3.84Å; L110-E191 HydrophobicContact CB-CG 4.28Å; T111-E191 VanDerWaalsContact CA-OE1 3.25Å; T111-E191 WeakPolarHBondContact CA-OE1 3.48Å; T111-E191 WeakPolarHBondContact CB-OE1 3.19Å; T111-E191 WeakPolarHBondContact CG2-OE1 3.35Å; T111-E191 PolarHBondContact OG1-OE1 3.07Å; K118-E191 WeakPolarHBondContact CE-O 3.32Å; K118-E191 WeakPolarHBondContact CE-OE2 3.33Å; K118-E191 PolarHBondContact NZ-O 3.37Å; K118-E191 IonicContact NZ-OE2 2.63Å; K118-E191 PolarHBondContact NZ-OE2 2.8Å; T187-E191 HydrophobicContact CG2-CG 3.75Å; T187-E191 WeakPolarHBondContact O-CB 3.21Å; T187-E191 WeakPolarHBondContact O-CG 3.49Å; T187-E191 PolarHBondContact O-N 3.39Å; E191-V195 WeakPolarHBondContact O-CG2 3.46Å
192V93.9Very high92.4Very high15 Ų1540.4 Ų40.49%0.09122%0.219CC..Hα-helixtrans-90.4-42.9178.4-177.30000110.8L110 W188 T194 V195 L196 V221 S225L110-V192 HydrophobicContact CD1-CG2 4.05Å; L110-V192 HydrophobicContact CD2-CG2 3.78Å; W188-V192 WeakPolarHBondContact O-CB 3.46Å; W188-V192 VanDerWaalsContact O-CG2 3.31Å; W188-V192 WeakPolarHBondContact O-CG2 3.5Å; W188-V192 PolarHBondContact O-N 3.17Å; V192-T194 PolarHBondContact O-N 3.21Å; V192-V195 PolarHBondContact O-N 2.95Å; V192-V195 VanDerWaalsContact O-N 3.13Å; V192-L196 HydrophobicContact CG1-CB 4.37Å; V192-L196 HydrophobicContact CG1-CD1 3.55Å; V192-L196 HydrophobicContact CG1-CG 4.06Å; V192-L196 WeakPolarHBondContact O-CB 3.43Å; V192-L196 PolarHBondContact O-N 3.47Å; V192-V221 HydrophobicContact CG1-CG1 4.42Å; V192-S225 WeakPolarHBondContact CB-OG 3.22Å; V192-S225 VanDerWaalsContact CG1-OG 3.27Å; V192-S225 WeakPolarHBondContact CG1-OG 3.47Å
193G89.4Confident92.3Very high6 Ų640.9 Ų40.96%0.06222%0.221CC..Hα-helixtrans-59.6-44.6-179.200000112.3A189 V195 S197A189-G193 WeakPolarHBondContact O-CA 3.49Å; A189-G193 PolarHBondContact O-N 3.27Å; G193-V195 PolarHBondContact O-N 2.9Å; G193-V195 VanDerWaalsContact O-N 3.16Å; G193-S197 WeakPolarHBondContact O-CB 3.47Å; G193-S197 PolarHBondContact O-N 3.29Å
194T86.1Confident92.3Very high46 Ų4642.8 Ų42.828%0.28223%0.231SC..Hα-helixtrans-59.4-28.7177.9-59.70000113L121 S190 V192 V212L121-T194 HydrophobicContact CD1-CG2 3.84Å; S190-T194 WeakPolarHBondContact O-CB 3.46Å; S190-T194 PolarHBondContact O-N 3.09Å; S190-T194 PolarHBondContact O-OG1 2.82Å; V192-T194 PolarHBondContact O-N 3.21Å; T194-V212 HydrophobicContact CG2-CG1 3.94Å
195V87.6Confident92.1Very high13 Ų1345.7 Ų45.78%0.07925%0.249CC..Hα-helixtrans-100-36.5-171.9173.20000113.2W113 K114 M117 K118 E191 V192 G193W113-V195 HydrophobicContact CE3-CB 4.44Å; W113-V195 HydrophobicContact CE3-CG1 4.17Å; W113-V195 HydrophobicContact CH2-CB 4.28Å; W113-V195 HydrophobicContact CH2-CG1 3.59Å; W113-V195 HydrophobicContact CZ2-CG1 4.28Å; W113-V195 HydrophobicContact CZ3-CB 3.78Å; W113-V195 HydrophobicContact CZ3-CG1 3.51Å; W113-V195 HydrophobicContact CZ3-CG2 4.32Å; K114-V195 HydrophobicContact CB-CG1 4.14Å; K114-V195 HydrophobicContact CB-CG2 4.44Å; K114-V195 HydrophobicContact CD-CG1 3.19Å; K114-V195 HydrophobicContact CG-CG1 4.29Å; M117-V195 HydrophobicContact SD-CG1 4.38Å; K118-V195 HydrophobicContact CD-CG2 4.4Å; K118-V195 HydrophobicContact CG-CG2 4.14Å; E191-V195 WeakPolarHBondContact O-CG2 3.46Å; V192-V195 PolarHBondContact O-N 2.95Å; V192-V195 VanDerWaalsContact O-N 3.13Å; G193-V195 PolarHBondContact O-N 2.9Å; G193-V195 VanDerWaalsContact O-N 3.16Å
196L90.2Very high92Very high85 Ų8549.2 Ų49.245%0.44527%0.27SS..Hα-helixtrans-102.3-18.1-174.5-68.2-172.9000113.5W113 V192 K198 V221W113-L196 HydrophobicContact CH2-CD1 3.99Å; W113-L196 HydrophobicContact CH2-CD2 3.72Å; W113-L196 HydrophobicContact CH2-CG 3.69Å; W113-L196 HydrophobicContact CZ2-CD2 4.44Å; W113-L196 HydrophobicContact CZ3-CG 4.27Å; V192-L196 HydrophobicContact CG1-CB 4.37Å; V192-L196 HydrophobicContact CG1-CD1 3.55Å; V192-L196 HydrophobicContact CG1-CG 4.06Å; V192-L196 WeakPolarHBondContact O-CB 3.43Å; V192-L196 PolarHBondContact O-N 3.47Å; L196-K198 PolarHBondContact O-N 2.88Å; L196-V221 HydrophobicContact CB-CG1 3.78Å
197S86.9Confident91.9Very high30 Ų3055 Ų5521%0.2129%0.291CS..  trans-70.2117.2176.5-170.60000110.4G193 S199 T219G193-S197 WeakPolarHBondContact O-CB 3.47Å; G193-S197 PolarHBondContact O-N 3.29Å; S197-S199 PolarHBondContact OG-N 2.82Å; S197-S199 PolarHBondContact OG-O 2.88Å; S197-T219 WeakPolarHBondContact OG-CG2 3.42Å
198K83.4Confident91.9Very high211 Ų21160.6 Ų60.692%0.91732%0.316SS*.  trans-85.6-15.6170.9-62.2-177-179.1179.90112.6L196L196-K198 PolarHBondContact O-N 2.88Å
199S85.4Confident91.8Very high84 Ų8465.6 Ų65.659%0.58734%0.339SS*.SBendtrans-96.3144.4179.2-64.70000110.2S197S197-S199 PolarHBondContact OG-N 2.82Å; S197-S199 PolarHBondContact OG-O 2.88Å
200P88.8Confident91.7Very high65 Ų6565.4 Ų65.442%0.42234%0.336SS..PPolyproline II helixtrans-60.3139173.425.9-33000109.8K209P200-K209 HydrophobicContact CB-CB 4.48Å; P200-K209 HydrophobicContact CG-CB 4.43Å; P200-K209 HydrophobicContact CG-CD 3.76Å; P200-K209 HydrophobicContact CG-CG 4.05Å
201P93.6Very high91.6Very high9 Ų965.3 Ų65.36%0.05833%0.333CS..PPolyproline II helixtrans-60.2154.517522.8-28.3000110.9K209 V210 V212 V218 T219P201-K209 WeakPolarHBondContact O-CA 3.42Å; P201-V210 HydrophobicContact CB-CG2 4.3Å; P201-V210 WeakPolarHBondContact CD-O 3.48Å; P201-V210 HydrophobicContact CG-CG2 4.2Å; P201-V210 WeakPolarHBondContact CG-O 3.23Å; P201-V210 PolarHBondContact O-N 2.76Å; P201-V212 HydrophobicContact CG-CG2 4.3Å; P201-V218 WeakPolarHBondContact CA-O 3.23Å; P201-T219 HydrophobicContact CB-CG2 3.8Å
202R95.9Very high91.4Very high98 Ų9866.6 Ų66.637%0.3734%0.343SS..EExtended strand (participates in β ladder)trans-113.2136.1173.5-66.3-175.7-177.9-142.13.4109.7I204 W207 E208 V218R202-I204 PolarHBondContact O-N 3.15Å; R202-W207 HydrophobicContact CB-CD2 4.21Å; R202-W207 HydrophobicContact CB-CE3 3.97Å; R202-W207 HydrophobicContact CB-CZ3 4.25Å; R202-E208 CarbonylContact C-O 3.02Å; R202-E208 WeakPolarHBondContact CA-O 3.18Å; R202-V218 PolarHBondContact N-O 3.36Å; R202-V218 WeakPolarHBondContact O-CG2 3.28Å; R202-V218 PolarHBondContact O-N 3.32Å
203L96.1Very high90.9Very high13 Ų1368 Ų687%0.06836%0.36CS..EExtended strand (participates in β ladder)trans-65.9128.7175.6-168.865.3000109.2T205 T206 W207 E208 V210 T214 N215 A277 A303L203-T205 WeakPolarHBondContact CD2-OG1 3.3Å; L203-T205 PolarHBondContact O-N 3.46Å; L203-T206 HydrophobicContact CD2-CG2 4.29Å; L203-W207 WeakPolarHBondContact O-CA 3.39Å; L203-W207 PolarHBondContact O-N 3.1Å; L203-E208 PolarHBondContact N-O 2.85Å; L203-V210 HydrophobicContact CB-CG1 3.91Å; L203-V210 HydrophobicContact CB-CG2 4.44Å; L203-T214 HydrophobicContact CD1-CG2 4.12Å; L203-N215 WeakPolarHBondContact CD1-O 3.42Å; L203-A277 HydrophobicContact CD1-CB 3.82Å; L203-A277 HydrophobicContact CG-CB 4.36Å; L203-A303 HydrophobicContact CD1-CB 4.17Å; L203-A303 HydrophobicContact CD2-CB 4.12Å
204I96.3Very high91Very high40 Ų4068.1 Ų68.121%0.20536%0.36CS..THydrogen-bonded Turntrans-64.3-25.1-173.2-166.4168.5000113.8R202 G216 V218 I270 S273 A277R202-I204 PolarHBondContact O-N 3.15Å; I204-G216 PolarHBondContact N-O 3.45Å; I204-V218 HydrophobicContact CB-CG1 4.25Å; I204-V218 HydrophobicContact CB-CG2 4.31Å; I204-V218 HydrophobicContact CD1-CG1 4.17Å; I204-I270 HydrophobicContact CD1-CB 4.5Å; I204-I270 HydrophobicContact CD1-CG2 3.97Å; I204-I270 WeakPolarHBondContact CD1-O 3.38Å; I204-S273 WeakPolarHBondContact CG2-O 3.29Å; I204-A277 HydrophobicContact CG2-CB 3.97Å
205T94.9Very high91.3Very high62 Ų6267 Ų6738%0.3835%0.352SS..THydrogen-bonded Turntrans-85.1-40.9-177.850.90000113.5L203 Y274 A277 I278L203-T205 WeakPolarHBondContact CD2-OG1 3.3Å; L203-T205 PolarHBondContact O-N 3.46Å; T205-Y274 HydrophobicContact CG2-CD2 4.06Å; T205-Y274 HydrophobicContact CG2-CE2 4.06Å; T205-A277 HydrophobicContact CG2-CB 3.72Å; T205-I278 HydrophobicContact CG2-CD1 4.3Å; T205-I278 HydrophobicContact CG2-CG1 4.05Å
206T94.3Very high91.5Very high74 Ų7466.7 Ų66.745%0.45435%0.352SS..THydrogen-bonded Turntrans-106.9-15.6-176.363.30000113.7L203 E208L203-T206 HydrophobicContact CD2-CG2 4.29Å; T206-E208 PolarHBondContact O-N 2.83Å; T206-E208 PolarHBondContact OG1-N 3.17Å
207W95.1Very high91.6Very high143 Ų14363.9 Ų63.954%0.54234%0.343SS..  trans6313.1-173.7-153.4-124.8000115.4R202 L203 V218R202-W207 HydrophobicContact CB-CD2 4.21Å; R202-W207 HydrophobicContact CB-CE3 3.97Å; R202-W207 HydrophobicContact CB-CZ3 4.25Å; L203-W207 WeakPolarHBondContact O-CA 3.39Å; L203-W207 PolarHBondContact O-N 3.1Å; W207-V218 HydrophobicContact CZ3-CG2 3.86Å
208E94.4Very high92.1Very high132 Ų13263.1 Ų63.162%0.61734%0.337SS*.  trans-77.8151.7175.5-65-177.8163.200111.5R202 L203 T206 V210R202-E208 CarbonylContact C-O 3.02Å; R202-E208 WeakPolarHBondContact CA-O 3.18Å; L203-E208 PolarHBondContact N-O 2.85Å; T206-E208 PolarHBondContact O-N 2.83Å; T206-E208 PolarHBondContact OG1-N 3.17Å; E208-V210 PolarHBondContact O-N 2.95Å
209K95.1Very high92.7Very high148 Ų14854.2 Ų54.264%0.64330%0.301SS*.BIsolated β-bridgetrans-72.5129.2177.2-69.2175.7177.8176.20109.7P200 P201P200-K209 HydrophobicContact CB-CB 4.48Å; P200-K209 HydrophobicContact CG-CB 4.43Å; P200-K209 HydrophobicContact CG-CD 3.76Å; P200-K209 HydrophobicContact CG-CG 4.05Å; P201-K209 WeakPolarHBondContact O-CA 3.42Å
210V92.9Very high93.2Very high15 Ų1555.8 Ų55.89%0.09131%0.307CS..  trans-124.9158.7179.9-66.50000111.2P201 L203 E208 T214 I302P201-V210 HydrophobicContact CB-CG2 4.3Å; P201-V210 WeakPolarHBondContact CD-O 3.48Å; P201-V210 HydrophobicContact CG-CG2 4.2Å; P201-V210 WeakPolarHBondContact CG-O 3.23Å; P201-V210 PolarHBondContact O-N 2.76Å; L203-V210 HydrophobicContact CB-CG1 3.91Å; L203-V210 HydrophobicContact CB-CG2 4.44Å; E208-V210 PolarHBondContact O-N 2.95Å; V210-T214 HydrophobicContact CB-CG2 3.92Å; V210-T214 HydrophobicContact CG1-CG2 4.27Å; V210-T214 HydrophobicContact CG2-CG2 3.77Å; V210-I302 HydrophobicContact CG1-CG2 4.24Å
211P90.1Very high93.6Very high51 Ų5155 Ų5533%0.33130%0.301SS..  trans-60.4152.2173.5-23.935.7000112.6T214 L284 V291 I302P211-T214 WeakPolarHBondContact O-CB 3.31Å; P211-T214 PolarHBondContact O-N 3.01Å; P211-T214 PolarHBondContact O-OG1 3.44Å; P211-L284 HydrophobicContact CG-CD1 4.44Å; P211-V291 HydrophobicContact CB-CG2 3.81Å; P211-I302 HydrophobicContact CG-CD1 4.07Å
212V88.1Confident93.7Very high59 Ų5954.8 Ų54.836%0.35830%0.3SS..THydrogen-bonded Turntrans-62.1135.6173.9179.20000109.6T194 P201 V291T194-V212 HydrophobicContact CG2-CG1 3.94Å; P201-V212 HydrophobicContact CG-CG2 4.3Å; V212-V291 VanDerWaalsContact O-CG2 3.27Å; V212-V291 WeakPolarHBondContact O-CG2 3.5Å
213G85.2Confident93.8Very high43 Ų4352.5 Ų52.544%0.44330%0.295SS..THydrogen-bonded Turntrans94.6-4.8-174.400000114.4N215 V291G213-N215 PolarHBondContact O-N 3.22Å; G213-V291 WeakPolarHBondContact O-CG1 3.19Å
214T90.9Very high93.9Very high10 Ų1055.5 Ų55.56%0.06131%0.314CS..  trans-64.9128.2174.7-61.50000111.3L203 V210 P211 G216 G217 T282 I302 A303L203-T214 HydrophobicContact CD1-CG2 4.12Å; V210-T214 HydrophobicContact CB-CG2 3.92Å; V210-T214 HydrophobicContact CG1-CG2 4.27Å; V210-T214 HydrophobicContact CG2-CG2 3.77Å; P211-T214 WeakPolarHBondContact O-CB 3.31Å; P211-T214 PolarHBondContact O-N 3.01Å; P211-T214 PolarHBondContact O-OG1 3.44Å; T214-G216 PolarHBondContact O-N 2.85Å; T214-G217 PolarHBondContact O-N 2.92Å; T214-T282 HydrophobicContact CG2-CG2 3.92Å; T214-I302 HydrophobicContact CG2-CG2 4.28Å; T214-A303 HydrophobicContact CG2-CB 4.44Å
215N91.8Very high94Very high21 Ų2154 Ų5411%0.11231%0.307CS..THydrogen-bonded Turntrans-61.7129.4175.7-63.9-46.7000109.7L203 G213 G217 Q280 Y281 T282 N293L203-N215 WeakPolarHBondContact CD1-O 3.42Å; G213-N215 PolarHBondContact O-N 3.22Å; N215-G217 VanDerWaalsContact C-N 3.3Å; N215-G217 PolarHBondContact O-N 2.94Å; N215-Q280 HydrophobicContact CB-CB 3.95Å; N215-Y281 PolarHBondContact ND2-O 3Å; N215-T282 VanDerWaalsContact CB-OG1 3.31Å; N215-T282 WeakPolarHBondContact CB-OG1 3.41Å; N215-T282 PolarHBondContact N-OG1 2.79Å; N215-T282 VanDerWaalsContact N-OG1 3.1Å; N215-T282 PolarHBondContact ND2-OG1 2.65Å; N215-T282 VanDerWaalsContact ND2-OG1 3.09Å; N215-N293 PolarHBondContact ND2-OD1 3.44Å
216G91.9Very high94.1Very high8 Ų851.1 Ų51.18%0.08229%0.289CS..THydrogen-bonded Turntrans76.49.2-173.600000116.3I204 T214 V218 S273I204-G216 PolarHBondContact N-O 3.45Å; T214-G216 PolarHBondContact O-N 2.85Å; G216-V218 PolarHBondContact O-N 3.3Å; G216-S273 WeakPolarHBondContact CA-O 3.49Å
217G93.7Very high94.3Very high25 Ų2550.9 Ų50.926%0.25829%0.285SS..EExtended strand (participates in β ladder)trans-75.311517000000111.9T214 N215T214-G217 PolarHBondContact O-N 2.92Å; N215-G217 VanDerWaalsContact C-N 3.3Å; N215-G217 PolarHBondContact O-N 2.94Å
218V96.1Very high94.5Very high14 Ų1448.4 Ų48.49%0.08528%0.282CS..EExtended strand (participates in β ladder)trans-106.1148.1179.6-62.50000112.5P201 R202 I204 W207 G216 S273P201-V218 WeakPolarHBondContact CA-O 3.23Å; R202-V218 PolarHBondContact N-O 3.36Å; R202-V218 WeakPolarHBondContact O-CG2 3.28Å; R202-V218 PolarHBondContact O-N 3.32Å; I204-V218 HydrophobicContact CB-CG1 4.25Å; I204-V218 HydrophobicContact CB-CG2 4.31Å; I204-V218 HydrophobicContact CD1-CG1 4.17Å; W207-V218 HydrophobicContact CZ3-CG2 3.86Å; G216-V218 PolarHBondContact O-N 3.3Å; V218-S273 WeakPolarHBondContact CG1-OG 3.18Å
219T96.3Very high94.7Very high24 Ų2442.1 Ų42.115%0.14725%0.252CS..  trans-129.9153.5172.164.90000109.5S197 P201 V221 G222 L223S197-T219 WeakPolarHBondContact OG-CG2 3.42Å; P201-T219 HydrophobicContact CB-CG2 3.8Å; T219-V221 PolarHBondContact O-N 3.44Å; T219-G222 PolarHBondContact O-N 3.34Å; T219-G222 VanDerWaalsContact O-N 3.1Å; T219-G222 PolarHBondContact OG1-N 3.1Å; T219-L223 WeakPolarHBondContact O-CG 3.46Å; T219-L223 PolarHBondContact O-N 2.93Å
220V95.9Very high94.8Very high117 Ų11735.1 Ų35.171%0.70922%0.221SC*.Hα-helixtrans-59.1-40.6175.6178.70000110.9G222 L223 V224V220-G222 VanDerWaalsContact C-N 3.33Å; V220-G222 PolarHBondContact O-N 3.03Å; V220-L223 PolarHBondContact O-N 2.91Å; V220-V224 HydrophobicContact CG1-CG2 4.48Å; V220-V224 WeakPolarHBondContact O-CG2 3.46Å; V220-V224 PolarHBondContact O-N 3.15Å
221V96.9Very high95.1Very high50 Ų5036 Ų3630%0.30323%0.227SC..Hα-helixtrans-62.9-41.1176.4178.80000111.1V192 L196 T219 S225V192-V221 HydrophobicContact CG1-CG1 4.42Å; L196-V221 HydrophobicContact CB-CG1 3.78Å; T219-V221 PolarHBondContact O-N 3.44Å; V221-S225 VanDerWaalsContact O-CB 3.28Å; V221-S225 WeakPolarHBondContact O-CB 3.4Å; V221-S225 PolarHBondContact O-N 2.71Å; V221-S225 PolarHBondContact O-OG 2.84Å
222G96.6Very high95.5Very high4 Ų436.9 Ų36.94%0.04123%0.226CC..Hα-helixtrans-61-48.3174.700000112.4A189 T219 V220 V224 S225 S226A189-G222 WeakPolarHBondContact CA-O 3.38Å; A189-G222 WeakPolarHBondContact CB-O 3.19Å; T219-G222 PolarHBondContact O-N 3.34Å; T219-G222 VanDerWaalsContact O-N 3.1Å; T219-G222 PolarHBondContact OG1-N 3.1Å; V220-G222 VanDerWaalsContact C-N 3.33Å; V220-G222 PolarHBondContact O-N 3.03Å; G222-V224 PolarHBondContact O-N 2.8Å; G222-S225 CarbonylContact O-C 3.46Å; G222-S225 WeakPolarHBondContact O-CA 3.45Å; G222-S225 WeakPolarHBondContact O-CB 3.5Å; G222-S225 PolarHBondContact O-N 2.82Å; G222-S225 VanDerWaalsContact O-N 3.09Å; G222-S226 PolarHBondContact O-N 2.67Å
223L97.5Very high96Very high49 Ų4934.1 Ų34.126%0.25721%0.209SC..Hα-helixtrans-64.1-40.2178.9-66.5174.6000112.9T219 V220 S225 S226 L227 L266 I270T219-L223 WeakPolarHBondContact O-CG 3.46Å; T219-L223 PolarHBondContact O-N 2.93Å; V220-L223 PolarHBondContact O-N 2.91Å; L223-S225 VanDerWaalsContact C-N 3.3Å; L223-S226 WeakPolarHBondContact CA-OG 3.25Å; L223-S226 PolarHBondContact O-N 2.63Å; L223-S226 PolarHBondContact O-OG 3.44Å; L223-L227 PolarHBondContact O-N 2.74Å; L223-L227 VanDerWaalsContact O-N 3.12Å; L223-L266 HydrophobicContact CB-CD1 4.05Å; L223-L266 HydrophobicContact CD2-CD1 4Å; L223-I270 HydrophobicContact CD2-CD1 4.38Å; L223-I270 HydrophobicContact CD2-CG1 3.84Å
224V97.9Very high96.6Very high77 Ų7732 Ų3247%0.46719%0.188SC..Hα-helixtrans-65.1-39.4172.71730000110.3V220 G222 S226 L227 L228V220-V224 HydrophobicContact CG1-CG2 4.48Å; V220-V224 WeakPolarHBondContact O-CG2 3.46Å; V220-V224 PolarHBondContact O-N 3.15Å; G222-V224 PolarHBondContact O-N 2.8Å; V224-S226 VanDerWaalsContact C-N 3.35Å; V224-S226 PolarHBondContact O-N 3.26Å; V224-L227 PolarHBondContact O-N 3.18Å; V224-L228 HydrophobicContact CG1-CD1 4.1Å; V224-L228 HydrophobicContact CG1-CG 4.44Å; V224-L228 VanDerWaalsContact O-CG 3.29Å; V224-L228 WeakPolarHBondContact O-CG 3.06Å; V224-L228 PolarHBondContact O-N 3.38Å
225S97.8Very high97Very high9 Ų934.7 Ų34.76%0.06320%0.201CC..Hα-helixtrans-66.3-36177.9-57.80000112W188 V192 V221 G222 L223 L228 G229W188-S225 WeakPolarHBondContact CB-O 3.28Å; V192-S225 WeakPolarHBondContact CB-OG 3.22Å; V192-S225 VanDerWaalsContact CG1-OG 3.27Å; V192-S225 WeakPolarHBondContact CG1-OG 3.47Å; V221-S225 VanDerWaalsContact O-CB 3.28Å; V221-S225 WeakPolarHBondContact O-CB 3.4Å; V221-S225 PolarHBondContact O-N 2.71Å; V221-S225 PolarHBondContact O-OG 2.84Å; G222-S225 CarbonylContact O-C 3.46Å; G222-S225 WeakPolarHBondContact O-CA 3.45Å; G222-S225 WeakPolarHBondContact O-CB 3.5Å; G222-S225 PolarHBondContact O-N 2.82Å; G222-S225 VanDerWaalsContact O-N 3.09Å; L223-S225 VanDerWaalsContact C-N 3.3Å; S225-L228 PolarHBondContact O-N 3.3Å; S225-G229 PolarHBondContact O-N 3.43Å
226S98.1Very high97.3Very high0 Ų034.3 Ų34.30%020%0.2CC..Hα-helixtrans-68.1-41.9175.759.10000112.6G185 G222 L223 V224 L228 G229 G230 S269G185-S226 WeakPolarHBondContact O-CA 3.46Å; G185-S226 WeakPolarHBondContact O-CB 3.44Å; G222-S226 PolarHBondContact O-N 2.67Å; L223-S226 WeakPolarHBondContact CA-OG 3.25Å; L223-S226 PolarHBondContact O-N 2.63Å; L223-S226 PolarHBondContact O-OG 3.44Å; V224-S226 VanDerWaalsContact C-N 3.35Å; V224-S226 PolarHBondContact O-N 3.26Å; S226-L228 VanDerWaalsContact C-N 3.32Å; S226-L228 PolarHBondContact O-N 3.38Å; S226-G229 PolarHBondContact O-N 3.02Å; S226-G230 PolarHBondContact O-N 2.78Å; S226-S269 WeakPolarHBondContact CB-OG 3.49Å; S226-S269 PolarHBondContact OG-OG 3.48Å
227L98.6Very high97.6Very high70 Ų7033.9 Ų33.937%0.36620%0.196SC..Hα-helixtrans-56.4-46.9171.2179.568.5000111.2L223 V224 T231 G262 L266L223-L227 PolarHBondContact O-N 2.74Å; L223-L227 VanDerWaalsContact O-N 3.12Å; V224-L227 PolarHBondContact O-N 3.18Å; L227-T231 VanDerWaalsContact O-CB 3.31Å; L227-T231 WeakPolarHBondContact O-CB 3.26Å; L227-T231 PolarHBondContact O-N 3.26Å; L227-T231 PolarHBondContact O-OG1 2.79Å; L227-G262 WeakPolarHBondContact CD1-O 3.37Å; L227-G262 WeakPolarHBondContact O-CA 3.35Å; L227-L266 HydrophobicContact CB-CB 4.35Å; L227-L266 HydrophobicContact CD1-CB 4.31Å
228L98.4Very high97.8Very high91 Ų9134.5 Ų34.548%0.47619%0.192SC..Hα-helixtrans-66.5-39.7179.3-69.5174.8000112.4W188 V224 S225 S226 T231 F232W188-L228 HydrophobicContact CE3-CB 4.14Å; W188-L228 HydrophobicContact CZ3-CB 3.92Å; V224-L228 HydrophobicContact CG1-CD1 4.1Å; V224-L228 HydrophobicContact CG1-CG 4.44Å; V224-L228 VanDerWaalsContact O-CG 3.29Å; V224-L228 WeakPolarHBondContact O-CG 3.06Å; V224-L228 PolarHBondContact O-N 3.38Å; S225-L228 PolarHBondContact O-N 3.3Å; S226-L228 VanDerWaalsContact C-N 3.32Å; S226-L228 PolarHBondContact O-N 3.38Å; L228-T231 PolarHBondContact O-N 3.41Å; L228-F232 WeakPolarHBondContact O-CB 3.35Å; L228-F232 PolarHBondContact O-N 3.08Å
229G98.3Very high97.8Very high0 Ų038 Ų380%021%0.21CC..Hα-helixtrans-62.7-47.6176.700000112.2S225 S226 F232 V233S225-G229 PolarHBondContact O-N 3.43Å; S226-G229 PolarHBondContact O-N 3.02Å; G229-F232 WeakPolarHBondContact O-CB 3.22Å; G229-F232 PolarHBondContact O-N 3.4Å; G229-V233 PolarHBondContact O-N 3.42Å
230G98.6Very high97.8Very high0 Ų037.3 Ų37.30%021%0.206CC..Hα-helixtrans-62.6-41.9174.300000112.7S226 F232 V233 G234 G261S226-G230 PolarHBondContact O-N 2.78Å; G230-F232 VanDerWaalsContact C-N 3.31Å; G230-F232 PolarHBondContact O-N 3.48Å; G230-V233 PolarHBondContact O-N 2.89Å; G230-G234 PolarHBondContact O-N 3.43Å; G230-G261 CarbonylContact C-O 3.58Å; G230-G261 VanDerWaalsContact C-O 3.23Å; G230-G261 WeakPolarHBondContact CA-O 3.39Å; G230-G261 CarbonylContact O-C 3.6Å; G230-G261 VanDerWaalsContact O-C 3.26Å
231T98.8Very high97.7Very high33 Ų3331.8 Ų31.820%0.20217%0.172CC..Hα-helixtrans-61.2-41.5176.9-58.80000110.9L227 L228 V233 G234 I235 I258 G262L227-T231 VanDerWaalsContact O-CB 3.31Å; L227-T231 WeakPolarHBondContact O-CB 3.26Å; L227-T231 PolarHBondContact O-N 3.26Å; L227-T231 PolarHBondContact O-OG1 2.79Å; L228-T231 PolarHBondContact O-N 3.41Å; T231-V233 PolarHBondContact O-N 3.3Å; T231-G234 CarbonylContact O-C 3.23Å; T231-G234 PolarHBondContact O-N 3.01Å; T231-I235 HydrophobicContact CG2-CD1 4.06Å; T231-I235 HydrophobicContact CG2-CG1 4.42Å; T231-I235 WeakPolarHBondContact O-CG1 3.47Å; T231-I235 PolarHBondContact O-N 3.36Å; T231-I258 HydrophobicContact CG2-CG2 3.73Å; T231-G262 VanDerWaalsContact OG1-CA 3.3Å; T231-G262 WeakPolarHBondContact OG1-CA 3.49Å
232F98.6Very high97.5Very high71 Ų7133.7 Ų33.731%0.31118%0.18SC..Hα-helixtrans-62-41.7178.8-177.6-109.8000112.4M102 W188 L228 G229 G230 I235 A236M102-F232 HydrophobicContact CB-CD1 4.36Å; M102-F232 HydrophobicContact CB-CE1 3.94Å; M102-F232 HydrophobicContact CE-CE1 3.39Å; M102-F232 HydrophobicContact CE-CE2 4.12Å; M102-F232 HydrophobicContact CE-CZ 3.11Å; W188-F232 HydrophobicContact CH2-CB 4.17Å; W188-F232 HydrophobicContact CH2-CG 4.26Å; W188-F232 HydrophobicContact CZ2-CB 4.19Å; W188-F232 AromaticContact CZ2-CD1 3.94Å; W188-F232 HydrophobicContact CZ2-CD1 3.94Å; W188-F232 HydrophobicContact CZ2-CG 4.13Å; L228-F232 WeakPolarHBondContact O-CB 3.35Å; L228-F232 PolarHBondContact O-N 3.08Å; G229-F232 WeakPolarHBondContact O-CB 3.22Å; G229-F232 PolarHBondContact O-N 3.4Å; G230-F232 VanDerWaalsContact C-N 3.31Å; G230-F232 PolarHBondContact O-N 3.48Å; F232-I235 PolarHBondContact O-N 2.86Å; F232-A236 PolarHBondContact O-N 3.04Å; F232-A236 VanDerWaalsContact O-N 3.16Å
233V98.4Very high97.2Very high0 Ų039.3 Ų39.30%021%0.208CC..Hα-helixtrans-66.5-41.6173.2179.60000110.9F103 L177 L180 A184 G229 G230 T231 I235 A236 Y237F103-V233 HydrophobicContact CB-CG2 4.2Å; L177-V233 HydrophobicContact CD1-CG1 3.78Å; L180-V233 HydrophobicContact CB-CG1 4.34Å; A184-V233 HydrophobicContact CB-CG2 3.61Å; G229-V233 PolarHBondContact O-N 3.42Å; G230-V233 PolarHBondContact O-N 2.89Å; T231-V233 PolarHBondContact O-N 3.3Å; V233-I235 PolarHBondContact O-N 2.76Å; V233-A236 WeakPolarHBondContact O-CB 3.46Å; V233-A236 PolarHBondContact O-N 3.42Å; V233-Y237 PolarHBondContact O-N 2.63Å
234G98.4Very high96.9Very high0 Ų041.3 Ų41.30%021%0.214CC..Hα-helixtrans-60.6-39.917500000113.7G230 T231 Y237 F238G230-G234 PolarHBondContact O-N 3.43Å; T231-G234 CarbonylContact O-C 3.23Å; T231-G234 PolarHBondContact O-N 3.01Å; G234-Y237 PolarHBondContact O-N 2.84Å; G234-F238 WeakPolarHBondContact O-CB 3.46Å; G234-F238 PolarHBondContact O-N 2.8Å
235I98.5Very high96.5Very high66 Ų6638.2 Ų38.234%0.33820%0.196SC..Hα-helixtrans-62.1-44.2173.4-69.9167.4000110.5T231 F232 V233 Y237 F238 L239 I258T231-I235 HydrophobicContact CG2-CD1 4.06Å; T231-I235 HydrophobicContact CG2-CG1 4.42Å; T231-I235 WeakPolarHBondContact O-CG1 3.47Å; T231-I235 PolarHBondContact O-N 3.36Å; F232-I235 PolarHBondContact O-N 2.86Å; V233-I235 PolarHBondContact O-N 2.76Å; I235-Y237 VanDerWaalsContact C-N 3.32Å; I235-Y237 PolarHBondContact O-N 3.23Å; I235-F238 PolarHBondContact O-N 2.89Å; I235-L239 HydrophobicContact CG2-CD1 3.78Å; I235-L239 HydrophobicContact CG2-CG 4.07Å; I235-L239 WeakPolarHBondContact O-CB 3.33Å; I235-L239 VanDerWaalsContact O-CG 3.3Å; I235-L239 WeakPolarHBondContact O-CG 3.5Å; I235-L239 PolarHBondContact O-N 3.36Å; I235-I258 HydrophobicContact CG1-CD1 4.24Å; I235-I258 HydrophobicContact CG1-CG1 4.14Å; I235-I258 HydrophobicContact CG1-CG2 3.83Å
236A98.2Very high95.7Very high12 Ų1244.8 Ų44.810%0.09923%0.23CC..Hα-helixtrans-60.2-43.7178.300000111.9M102 F232 V233 T240M102-A236 HydrophobicContact CB-CB 3.9Å; M102-A236 HydrophobicContact CG-CB 3.42Å; M102-A236 VanDerWaalsContact CG-CB 3.42Å; F232-A236 PolarHBondContact O-N 3.04Å; F232-A236 VanDerWaalsContact O-N 3.16Å; V233-A236 WeakPolarHBondContact O-CB 3.46Å; V233-A236 PolarHBondContact O-N 3.42Å; A236-T240 WeakPolarHBondContact O-CB 3.34Å; A236-T240 PolarHBondContact O-N 2.96Å; A236-T240 VanDerWaalsContact O-N 3.17Å; A236-T240 PolarHBondContact O-OG1 2.8Å
237Y98.1Very high94.7Very high0 Ų049.5 Ų49.50%026%0.256CS..Hα-helixtrans-59.3-52.4174.3-167.8-68.3000110.8S95 F96 S99 C173 L177 V233 G234 I235 T240 Q241 I257S95-Y237 PolarHBondContact OG-O 2.9Å; F96-Y237 AromaticContact CD1-CE2 3.8Å; F96-Y237 HydrophobicContact CD1-CE2 3.8Å; F96-Y237 AromaticContact CE1-CE2 3.93Å; F96-Y237 HydrophobicContact CE1-CE2 3.93Å; S99-Y237 WeakPolarHBondContact OG-CD2 3.3Å; C173-Y237 WeakPolarHBondContact CB-OH 3.13Å; C173-Y237 PolarHBondContact SG-OH 2.97Å; C173-Y237 VanDerWaalsContact SG-OH 3.4Å; L177-Y237 HydrophobicContact CB-CD2 4.24Å; L177-Y237 HydrophobicContact CB-CE2 4.49Å; L177-Y237 HydrophobicContact CD1-CD2 4.26Å; L177-Y237 HydrophobicContact CD2-CD2 4.34Å; L177-Y237 HydrophobicContact CD2-CG 4.32Å; V233-Y237 PolarHBondContact O-N 2.63Å; G234-Y237 PolarHBondContact O-N 2.84Å; I235-Y237 VanDerWaalsContact C-N 3.32Å; I235-Y237 PolarHBondContact O-N 3.23Å; Y237-T240 WeakPolarHBondContact O-CB 3.43Å; Y237-T240 PolarHBondContact O-N 3.41Å; Y237-T240 VanDerWaalsContact O-N 3.17Å; Y237-Q241 HydrophobicContact CD1-CG 3.69Å; Y237-Q241 HydrophobicContact CE1-CG 3.47Å; Y237-Q241 VanDerWaalsContact CE1-CG 3.47Å; Y237-Q241 WeakPolarHBondContact O-CG 3.5Å; Y237-Q241 PolarHBondContact O-N 3.27Å; Y237-I257 HydrophobicContact CD1-CD1 3.92Å; Y237-I257 HydrophobicContact CD1-CG2 3.69Å; Y237-I257 HydrophobicContact CE1-CD1 3.92Å; Y237-I257 HydrophobicContact CE1-CG2 4.49Å; Y237-I257 HydrophobicContact CG-CG2 4.02Å
238F97Very high93.9Very high37 Ų3748.1 Ų48.116%0.16225%0.248CC..Hα-helixtrans-60.6-46.6-177.4174.1-106.5000112.4G234 I235 T240 Q241 L242 Q254 W255 I257 I258G234-F238 WeakPolarHBondContact O-CB 3.46Å; G234-F238 PolarHBondContact O-N 2.8Å; I235-F238 PolarHBondContact O-N 2.89Å; F238-T240 PolarHBondContact O-N 3.18Å; F238-Q241 WeakPolarHBondContact O-CB 3.33Å; F238-Q241 PolarHBondContact O-N 3.08Å; F238-Q241 VanDerWaalsContact O-N 3.11Å; F238-L242 HydrophobicContact CD1-CD1 4.2Å; F238-L242 HydrophobicContact CE1-CD1 3.6Å; F238-L242 HydrophobicContact CE1-CG 4.13Å; F238-L242 HydrophobicContact CE2-CD2 4.12Å; F238-L242 HydrophobicContact CE2-CG 4.35Å; F238-L242 HydrophobicContact CZ-CD1 3.83Å; F238-L242 HydrophobicContact CZ-CD2 3.94Å; F238-L242 HydrophobicContact CZ-CG 4.04Å; F238-L242 WeakPolarHBondContact O-CG 3.46Å; F238-L242 PolarHBondContact O-N 2.87Å; F238-Q254 HydrophobicContact CD2-CB 3.93Å; F238-Q254 WeakPolarHBondContact CD2-O 3.34Å; F238-Q254 HydrophobicContact CE2-CB 3.8Å; F238-W255 HydrophobicContact CE2-CB 4.46Å; F238-I257 HydrophobicContact CB-CG2 4.41Å; F238-I258 HydrophobicContact CB-CD1 4.34Å; F238-I258 HydrophobicContact CB-CG1 3.93Å; F238-I258 HydrophobicContact CD1-CD1 3.74Å; F238-I258 HydrophobicContact CD1-CG1 4.27Å; F238-I258 HydrophobicContact CE1-CD1 4.2Å; F238-I258 HydrophobicContact CG-CD1 4.04Å; F238-I258 HydrophobicContact CG-CG1 4.1Å
239L96.8Very high92.8Very high88 Ų8850.3 Ų50.346%0.46126%0.26SS..Hα-helixtrans-60.3-36176.6-70.8177.4000111.9I235 L242 I243I235-L239 HydrophobicContact CG2-CD1 3.78Å; I235-L239 HydrophobicContact CG2-CG 4.07Å; I235-L239 WeakPolarHBondContact O-CB 3.33Å; I235-L239 VanDerWaalsContact O-CG 3.3Å; I235-L239 WeakPolarHBondContact O-CG 3.5Å; I235-L239 PolarHBondContact O-N 3.36Å; L239-L242 HydrophobicContact CD2-CD1 4.41Å; L239-L242 PolarHBondContact O-N 2.94Å; L239-I243 WeakPolarHBondContact O-CD1 3.1Å; L239-I243 VanDerWaalsContact O-CG1 3.31Å; L239-I243 WeakPolarHBondContact O-CG1 3.02Å; L239-I243 PolarHBondContact O-N 3.36Å
240T95.8Very high91.8Very high10 Ų1055.2 Ų55.26%0.06129%0.286CS..Hα-helixtrans-69.2-38.1177-53.40000111.4F94 S95 T98 A236 Y237 F238 L242 I243 F244F94-T240 HydrophobicContact CB-CG2 3.8Å; S95-T240 WeakPolarHBondContact OG-CB 3.26Å; T98-T240 WeakPolarHBondContact CB-OG1 3.24Å; T98-T240 HydrophobicContact CG2-CG2 4.17Å; T98-T240 WeakPolarHBondContact CG2-OG1 3.4Å; T98-T240 PolarHBondContact OG1-OG1 3.1Å; A236-T240 WeakPolarHBondContact O-CB 3.34Å; A236-T240 PolarHBondContact O-N 2.96Å; A236-T240 VanDerWaalsContact O-N 3.17Å; A236-T240 PolarHBondContact O-OG1 2.8Å; Y237-T240 WeakPolarHBondContact O-CB 3.43Å; Y237-T240 PolarHBondContact O-N 3.41Å; Y237-T240 VanDerWaalsContact O-N 3.17Å; F238-T240 PolarHBondContact O-N 3.18Å; T240-L242 VanDerWaalsContact C-N 3.34Å; T240-L242 PolarHBondContact O-N 3.49Å; T240-I243 PolarHBondContact O-N 3.17Å; T240-F244 HydrophobicContact CG2-CD2 3.64Å; T240-F244 HydrophobicContact CG2-CE2 4.07Å; T240-F244 WeakPolarHBondContact O-CD2 3.39Å; T240-F244 PolarHBondContact O-N 3.41Å
241Q93.6Very high91Very high0 Ų056.1 Ų56.10%029%0.292CS..Hα-helixtrans-59-46.2172.5-67.9-75.3-66.800110.9S95 I159 Y237 F238 I243 F244 V245 L248 I257S95-Q241 PolarHBondContact OG-NE2 3.49Å; I159-Q241 PolarHBondContact O-OE1 3.13Å; Y237-Q241 HydrophobicContact CD1-CG 3.69Å; Y237-Q241 HydrophobicContact CE1-CG 3.47Å; Y237-Q241 VanDerWaalsContact CE1-CG 3.47Å; Y237-Q241 WeakPolarHBondContact O-CG 3.5Å; Y237-Q241 PolarHBondContact O-N 3.27Å; F238-Q241 WeakPolarHBondContact O-CB 3.33Å; F238-Q241 PolarHBondContact O-N 3.08Å; F238-Q241 VanDerWaalsContact O-N 3.11Å; Q241-I243 PolarHBondContact O-N 2.96Å; Q241-I243 VanDerWaalsContact O-N 3.17Å; Q241-F244 PolarHBondContact O-N 3.2Å; Q241-V245 HydrophobicContact CB-CG2 4.31Å; Q241-V245 VanDerWaalsContact O-CB 3.32Å; Q241-V245 WeakPolarHBondContact O-CB 3.38Å; Q241-V245 PolarHBondContact O-N 3.01Å; Q241-L248 WeakPolarHBondContact O-CD1 3.3Å; Q241-I257 HydrophobicContact CG-CD1 4.45Å
242L92.8Very high90.2Very high91 Ų9154.6 Ų54.648%0.47628%0.283SS..Hα-helixtrans-59.2-27.6178.1-64.8-175.1000114.3F238 L239 T240 L248F238-L242 HydrophobicContact CD1-CD1 4.2Å; F238-L242 HydrophobicContact CE1-CD1 3.6Å; F238-L242 HydrophobicContact CE1-CG 4.13Å; F238-L242 HydrophobicContact CE2-CD2 4.12Å; F238-L242 HydrophobicContact CE2-CG 4.35Å; F238-L242 HydrophobicContact CZ-CD1 3.83Å; F238-L242 HydrophobicContact CZ-CD2 3.94Å; F238-L242 HydrophobicContact CZ-CG 4.04Å; F238-L242 WeakPolarHBondContact O-CG 3.46Å; F238-L242 PolarHBondContact O-N 2.87Å; L239-L242 HydrophobicContact CD2-CD1 4.41Å; L239-L242 PolarHBondContact O-N 2.94Å; T240-L242 VanDerWaalsContact C-N 3.34Å; T240-L242 PolarHBondContact O-N 3.49Å; L242-L248 HydrophobicContact CD2-CD1 3.97Å
243I92.1Very high89.8Confident121 Ų12154.3 Ų54.362%0.62129%0.288SS*.Hα-helixtrans-89.2-37-176.9-65.4165.2000111.7L239 T240 Q241L239-I243 WeakPolarHBondContact O-CD1 3.1Å; L239-I243 VanDerWaalsContact O-CG1 3.31Å; L239-I243 WeakPolarHBondContact O-CG1 3.02Å; L239-I243 PolarHBondContact O-N 3.36Å; T240-I243 PolarHBondContact O-N 3.17Å; Q241-I243 PolarHBondContact O-N 2.96Å; Q241-I243 VanDerWaalsContact O-N 3.17Å
244F90.9Very high89.5Confident91 Ų9154.7 Ų54.740%0.39929%0.29SS..Hα-helixtrans-114.8-13.3-166.1-68.3-76.1000114.9F94 E158 T240 Q241F94-F244 HydrophobicContact CB-CD2 4.36Å; F94-F244 HydrophobicContact CB-CE2 4.47Å; F94-F244 AromaticContact CD2-CD1 3.8Å; F94-F244 HydrophobicContact CD2-CD1 3.8Å; F94-F244 HydrophobicContact CD2-CD2 4.18Å; F94-F244 AromaticContact CD2-CE1 3.83Å; F94-F244 HydrophobicContact CD2-CE1 3.83Å; F94-F244 HydrophobicContact CD2-CE2 4.21Å; F94-F244 AromaticContact CD2-CG 3.98Å; F94-F244 HydrophobicContact CD2-CG 3.98Å; F94-F244 HydrophobicContact CD2-CZ 4.03Å; F94-F244 HydrophobicContact CE2-CD1 4.12Å; F94-F244 AromaticContact CE2-CE1 3.94Å; F94-F244 HydrophobicContact CE2-CE1 3.94Å; F94-F244 HydrophobicContact CE2-CZ 4.4Å; E158-F244 HydrophobicContact CB-CB 4.39Å; E158-F244 HydrophobicContact CG-CB 3.8Å; T240-F244 HydrophobicContact CG2-CD2 3.64Å; T240-F244 HydrophobicContact CG2-CE2 4.07Å; T240-F244 WeakPolarHBondContact O-CD2 3.39Å; T240-F244 PolarHBondContact O-N 3.41Å; Q241-F244 PolarHBondContact O-N 3.2Å
245V88.8Confident89.2Confident13 Ų1362.1 Ų62.18%0.07932%0.318CS..  trans-92.7121.9174.8-178.80000109.8E158 P160 Q241 L248E158-V245 HydrophobicContact CB-CG2 3.61Å; P160-V245 HydrophobicContact CB-CG1 4.26Å; P160-V245 HydrophobicContact CG-CG1 4.27Å; Q241-V245 HydrophobicContact CB-CG2 4.31Å; Q241-V245 VanDerWaalsContact O-CB 3.32Å; Q241-V245 WeakPolarHBondContact O-CB 3.38Å; Q241-V245 PolarHBondContact O-N 3.01Å; V245-L248 HydrophobicContact CB-CD1 4.07Å; V245-L248 HydrophobicContact CB-CD2 4.3Å; V245-L248 HydrophobicContact CB-CG 3.85Å; V245-L248 HydrophobicContact CG1-CD2 4.16Å; V245-L248 HydrophobicContact CG1-CG 3.79Å
246N80.3Confident89.1Confident147 Ų14759.6 Ų59.679%0.78631%0.306SS*.SBendtrans-79.6-34.2-176-62.5-48.1000113.4L248N246-L248 PolarHBondContact O-N 2.95Å
247D78.8Confident89.1Confident99 Ų9959 Ų5953%0.52930%0.301SS..  trans-101.735.3-168.7-54.5-44.8000113.2D249 I250 S251D247-D249 VanDerWaalsContact C-N 3.31Å; D247-D249 PolarHBondContact O-N 2.95Å; D247-I250 HydrophobicContact CB-CD1 4.12Å; D247-I250 HydrophobicContact CB-CG1 3.99Å; D247-I250 WeakPolarHBondContact O-CG1 3.49Å; D247-S251 WeakPolarHBondContact O-CB 3.18Å; D247-S251 PolarHBondContact O-OG 3.3Å
248L80.2Confident89.1Confident40 Ų4061.2 Ų61.221%0.20931%0.312CS..  trans-69.1-28.6-177.6-81.2166.5000113.6Q241 L242 V245 N246 I250 S251 Q254Q241-L248 WeakPolarHBondContact O-CD1 3.3Å; L242-L248 HydrophobicContact CD2-CD1 3.97Å; V245-L248 HydrophobicContact CB-CD1 4.07Å; V245-L248 HydrophobicContact CB-CD2 4.3Å; V245-L248 HydrophobicContact CB-CG 3.85Å; V245-L248 HydrophobicContact CG1-CD2 4.16Å; V245-L248 HydrophobicContact CG1-CG 3.79Å; N246-L248 PolarHBondContact O-N 2.95Å; L248-I250 VanDerWaalsContact C-N 3.31Å; L248-I250 PolarHBondContact O-N 3.18Å; L248-S251 PolarHBondContact O-N 2.96Å; L248-Q254 HydrophobicContact CD2-CB 4.36Å; L248-Q254 HydrophobicContact CD2-CG 3.35Å
249D75.4Confident89.1Confident137 Ų13762.2 Ų62.273%0.73333%0.328SS*.THydrogen-bonded Turntrans-66.8-29.8-17961.1-34.2000113.2D247D247-D249 VanDerWaalsContact C-N 3.31Å; D247-D249 PolarHBondContact O-N 2.95Å
250I78.1Confident89.2Confident104 Ų10458.6 Ų58.653%0.53331%0.308SS..THydrogen-bonded Turntrans-104.88.6177.861.9167.8000113.5K165 D247 L248K165-I250 PolarHBondContact NZ-O 3Å; D247-I250 HydrophobicContact CB-CD1 4.12Å; D247-I250 HydrophobicContact CB-CG1 3.99Å; D247-I250 WeakPolarHBondContact O-CG1 3.49Å; L248-I250 VanDerWaalsContact C-N 3.31Å; L248-I250 PolarHBondContact O-N 3.18Å
251S81.3Confident89.3Confident18 Ų1858.1 Ų58.113%0.12631%0.305CS..SBendtrans-107.6164.2-177.6-65.70000111.9P160 D247 L248P160-S251 WeakPolarHBondContact CG-OG 3.29Å; D247-S251 WeakPolarHBondContact O-CB 3.18Å; D247-S251 PolarHBondContact O-OG 3.3Å; L248-S251 PolarHBondContact O-N 2.96Å
252A83.1Confident89.5Confident1 Ų158.2 Ų58.21%0.00831%0.306CS..  trans-52.3147.8171.900000111.8D162 Q254 P334D162-A252 HydrophobicContact CB-CB 4.19Å; A252-Q254 PolarHBondContact O-N 3Å; A252-Q254 PolarHBondContact O-NE2 3.37Å; A252-P334 WeakPolarHBondContact CB-O 3.33Å
253P88.6Confident89.8Confident65 Ų6557.5 Ų57.542%0.42230%0.302SS..  trans-54.8125.7174.5-25.932.3000112.1P256 P334P253-P256 WeakPolarHBondContact O-CD 3.43Å; P253-P334 HydrophobicContact CG-CB 4.28Å
254Q92.7Very high90.1Very high9 Ų951.8 Ų51.84%0.04227%0.273CS..SBendtrans-89.8-8.8-175.6-61.8-57.9-62.600114.3V161 F238 L248 A252 P256 I257V161-Q254 PolarHBondContact O-NE2 3.24Å; F238-Q254 HydrophobicContact CD2-CB 3.93Å; F238-Q254 WeakPolarHBondContact CD2-O 3.34Å; F238-Q254 HydrophobicContact CE2-CB 3.8Å; L248-Q254 HydrophobicContact CD2-CB 4.36Å; L248-Q254 HydrophobicContact CD2-CG 3.35Å; A252-Q254 PolarHBondContact O-N 3Å; A252-Q254 PolarHBondContact O-NE2 3.37Å; Q254-P256 VanDerWaalsContact C-N 3.3Å; Q254-I257 HydrophobicContact CB-CD1 4.14Å; Q254-I257 VanDerWaalsContact O-CB 3.26Å; Q254-I257 WeakPolarHBondContact O-CB 3.45Å; Q254-I257 WeakPolarHBondContact O-CD1 3.36Å; Q254-I257 WeakPolarHBondContact O-CG1 3.36Å; Q254-I257 PolarHBondContact O-N 3.02Å
255W92.5Very high90.5Very high155 Ų15547.4 Ų47.459%0.58725%0.254SS*.THydrogen-bonded Turntrans-56.5-29.2177.473.5-97.4000115.3F238 I257 I258F238-W255 HydrophobicContact CE2-CB 4.46Å; W255-I257 PolarHBondContact O-N 3.34Å; W255-I257 VanDerWaalsContact O-N 3.09Å; W255-I258 WeakPolarHBondContact O-CB 3.27Å; W255-I258 PolarHBondContact O-N 2.89Å
256P96.2Very high90.9Very high13 Ų1348.8 Ų48.88%0.08426%0.26CS..Hα-helixtrans-60-20.7177.3-22.833.9000113.7P253 Q254 I258 A259 F260 W333 P334P253-P256 WeakPolarHBondContact O-CD 3.43Å; Q254-P256 VanDerWaalsContact C-N 3.3Å; P256-I258 PolarHBondContact O-N 3.01Å; P256-A259 PolarHBondContact O-N 3.47Å; P256-F260 VanDerWaalsContact O-CB 3.26Å; P256-F260 WeakPolarHBondContact O-CB 3.24Å; P256-F260 PolarHBondContact O-N 2.97Å; P256-W333 HydrophobicContact CB-CE3 4.34Å; P256-W333 HydrophobicContact CB-CH2 3.85Å; P256-W333 HydrophobicContact CB-CZ2 4.08Å; P256-W333 HydrophobicContact CB-CZ3 4Å; P256-P334 HydrophobicContact CG-CG 3.64Å
257I97.4Very high91.8Very high0 Ų044.7 Ų44.70%024%0.238CC..Hα-helixtrans-53.9-38.2173.2-66176.3000111.4V161 L177 Y237 F238 Q241 Q254 W255 G261 W333V161-I257 HydrophobicContact CB-CD1 4.36Å; V161-I257 HydrophobicContact CG2-CD1 3.88Å; V161-I257 HydrophobicContact CG2-CG1 4.38Å; L177-I257 HydrophobicContact CD2-CG2 3.52Å; Y237-I257 HydrophobicContact CD1-CD1 3.92Å; Y237-I257 HydrophobicContact CD1-CG2 3.69Å; Y237-I257 HydrophobicContact CE1-CD1 3.92Å; Y237-I257 HydrophobicContact CE1-CG2 4.49Å; Y237-I257 HydrophobicContact CG-CG2 4.02Å; F238-I257 HydrophobicContact CB-CG2 4.41Å; Q241-I257 HydrophobicContact CG-CD1 4.45Å; Q254-I257 HydrophobicContact CB-CD1 4.14Å; Q254-I257 VanDerWaalsContact O-CB 3.26Å; Q254-I257 WeakPolarHBondContact O-CB 3.45Å; Q254-I257 WeakPolarHBondContact O-CD1 3.36Å; Q254-I257 WeakPolarHBondContact O-CG1 3.36Å; Q254-I257 PolarHBondContact O-N 3.02Å; W255-I257 PolarHBondContact O-N 3.34Å; W255-I257 VanDerWaalsContact O-N 3.09Å; I257-G261 PolarHBondContact O-N 3.41Å; I257-W333 HydrophobicContact CG1-CH2 3.85Å; I257-W333 HydrophobicContact CG1-CZ2 3.78Å
258I98.1Very high92.7Very high46 Ų4640 Ų4024%0.23621%0.213CC..Hα-helixtrans-66-50.8-179.9-61.2172.3000110.2T231 I235 F238 W255 P256 F260 G261 G262T231-I258 HydrophobicContact CG2-CG2 3.73Å; I235-I258 HydrophobicContact CG1-CD1 4.24Å; I235-I258 HydrophobicContact CG1-CG1 4.14Å; I235-I258 HydrophobicContact CG1-CG2 3.83Å; F238-I258 HydrophobicContact CB-CD1 4.34Å; F238-I258 HydrophobicContact CB-CG1 3.93Å; F238-I258 HydrophobicContact CD1-CD1 3.74Å; F238-I258 HydrophobicContact CD1-CG1 4.27Å; F238-I258 HydrophobicContact CE1-CD1 4.2Å; F238-I258 HydrophobicContact CG-CD1 4.04Å; F238-I258 HydrophobicContact CG-CG1 4.1Å; W255-I258 WeakPolarHBondContact O-CB 3.27Å; W255-I258 PolarHBondContact O-N 2.89Å; P256-I258 PolarHBondContact O-N 3.01Å; I258-F260 VanDerWaalsContact C-N 3.32Å; I258-F260 PolarHBondContact O-N 3.22Å; I258-G261 PolarHBondContact O-N 3.09Å; I258-G262 PolarHBondContact O-N 3.28Å
259A97.8Very high93.5Very high59 Ų5938.2 Ų38.249%0.48820%0.204SC..Hα-helixtrans-64.1-39.9179.200000111.4P256 G262 L263P256-A259 PolarHBondContact O-N 3.47Å; A259-G262 PolarHBondContact O-N 2.63Å; A259-L263 WeakPolarHBondContact O-CB 3.24Å; A259-L263 PolarHBondContact O-N 2.91Å
260F98.3Very high94.5Very high12 Ų1234.5 Ų34.55%0.05318%0.183CC..Hα-helixtrans-60.4-47.3175179.2-86.9000111.7L174 L177 A178 P256 I258 G262 L263 A264 L325 P326 A329 W333L174-F260 HydrophobicContact CB-CE1 3.94Å; L174-F260 HydrophobicContact CB-CE2 4.32Å; L174-F260 HydrophobicContact CB-CZ 3.78Å; L174-F260 HydrophobicContact CD1-CD2 4.28Å; L174-F260 HydrophobicContact CD1-CE2 4.11Å; L174-F260 HydrophobicContact CD1-CZ 4.37Å; L174-F260 HydrophobicContact CD2-CD1 3.95Å; L174-F260 HydrophobicContact CD2-CE1 4.08Å; L174-F260 HydrophobicContact CD2-CG 4.27Å; L174-F260 HydrophobicContact CD2-CZ 4.5Å; L174-F260 HydrophobicContact CG-CE1 4.46Å; L174-F260 HydrophobicContact CG-CZ 4.44Å; L174-F260 VanDerWaalsContact O-CE1 3.29Å; L174-F260 WeakPolarHBondContact O-CE1 3.2Å; L177-F260 HydrophobicContact CD2-CD1 3.94Å; L177-F260 HydrophobicContact CD2-CE1 4.47Å; L177-F260 HydrophobicContact CG-CD1 4.3Å; L177-F260 HydrophobicContact CG-CE1 4.46Å; A178-F260 HydrophobicContact CB-CE1 3.79Å; A178-F260 HydrophobicContact CB-CZ 3.88Å; P256-F260 VanDerWaalsContact O-CB 3.26Å; P256-F260 WeakPolarHBondContact O-CB 3.24Å; P256-F260 PolarHBondContact O-N 2.97Å; I258-F260 VanDerWaalsContact C-N 3.32Å; I258-F260 PolarHBondContact O-N 3.22Å; F260-G262 VanDerWaalsContact C-N 3.33Å; F260-G262 PolarHBondContact O-N 3.27Å; F260-L263 PolarHBondContact O-N 2.98Å; F260-A264 WeakPolarHBondContact O-CB 3.13Å; F260-A264 PolarHBondContact O-N 3.41Å; F260-L325 HydrophobicContact CD2-CG 4.36Å; F260-L325 HydrophobicContact CE2-CB 4.33Å; F260-L325 HydrophobicContact CE2-CD2 4Å; F260-L325 HydrophobicContact CE2-CG 3.63Å; F260-L325 HydrophobicContact CZ-CB 4.32Å; F260-L325 HydrophobicContact CZ-CD2 4.03Å; F260-L325 HydrophobicContact CZ-CG 3.95Å; F260-P326 HydrophobicContact CZ-CG 4Å; F260-A329 HydrophobicContact CD2-CB 3.85Å; F260-A329 HydrophobicContact CE2-CB 3.69Å; F260-W333 HydrophobicContact CB-CH2 4.32Å; F260-W333 HydrophobicContact CB-CZ3 4.06Å; F260-W333 HydrophobicContact CD2-CZ3 4.13Å; F260-W333 HydrophobicContact CG-CZ3 4.25Å
261G98.6Very high95.5Very high0 Ų031.3 Ų31.30%017%0.169CC..Hα-helixtrans-58.6-44.2175.400000112A181 G230 I257 I258 A264 G265A181-G261 WeakPolarHBondContact CB-O 3.34Å; G230-G261 CarbonylContact C-O 3.58Å; G230-G261 VanDerWaalsContact C-O 3.23Å; G230-G261 WeakPolarHBondContact CA-O 3.39Å; G230-G261 CarbonylContact O-C 3.6Å; G230-G261 VanDerWaalsContact O-C 3.26Å; I257-G261 PolarHBondContact O-N 3.41Å; I258-G261 PolarHBondContact O-N 3.09Å; G261-A264 PolarHBondContact O-N 3.28Å; G261-G265 PolarHBondContact O-N 3.13Å
262G98.6Very high96.2Very high1 Ų130.9 Ų30.91%0.0117%0.165CC..Hα-helixtrans-58.7-49.7174.300000112.9L227 T231 I258 A259 F260 A264 G265 L266L227-G262 WeakPolarHBondContact CD1-O 3.37Å; L227-G262 WeakPolarHBondContact O-CA 3.35Å; T231-G262 VanDerWaalsContact OG1-CA 3.3Å; T231-G262 WeakPolarHBondContact OG1-CA 3.49Å; I258-G262 PolarHBondContact O-N 3.28Å; A259-G262 PolarHBondContact O-N 2.63Å; F260-G262 VanDerWaalsContact C-N 3.33Å; F260-G262 PolarHBondContact O-N 3.27Å; G262-A264 VanDerWaalsContact C-N 3.32Å; G262-A264 PolarHBondContact O-N 3.44Å; G262-G265 PolarHBondContact O-N 3.24Å; G262-L266 PolarHBondContact O-N 3.3Å
263L98.3Very high96.8Very high77 Ų7731.7 Ų31.740%0.40317%0.17SC..Hα-helixtrans-62.2-40.7179-175.261.8000111.7A259 F260 L266 L267 L325A259-L263 WeakPolarHBondContact O-CB 3.24Å; A259-L263 PolarHBondContact O-N 2.91Å; F260-L263 PolarHBondContact O-N 2.98Å; L263-L266 PolarHBondContact O-N 3.02Å; L263-L267 HydrophobicContact CD1-CD1 3.78Å; L263-L267 HydrophobicContact CD1-CD2 4.44Å; L263-L267 HydrophobicContact CD1-CG 3.82Å; L263-L267 HydrophobicContact CD2-CD1 4.36Å; L263-L267 HydrophobicContact CG-CD1 3.76Å; L263-L267 HydrophobicContact CG-CG 4.16Å; L263-L267 WeakPolarHBondContact O-CB 3.2Å; L263-L267 WeakPolarHBondContact O-CG 3.4Å; L263-L267 PolarHBondContact O-N 3.01Å; L263-L325 HydrophobicContact CD2-CD1 3.98Å; L263-L325 HydrophobicContact CG-CD1 4.37Å
264A98.5Very high97.2Very high0 Ų034.5 Ų34.50%017%0.174CC..Hα-helixtrans-61.9-42175.400000112.3A178 A181 F260 G261 G262 G268 I321 L325A178-A264 HydrophobicContact CB-CB 4.09Å; A181-A264 HydrophobicContact CB-CB 3.83Å; F260-A264 WeakPolarHBondContact O-CB 3.13Å; F260-A264 PolarHBondContact O-N 3.41Å; G261-A264 PolarHBondContact O-N 3.28Å; G262-A264 VanDerWaalsContact C-N 3.32Å; G262-A264 PolarHBondContact O-N 3.44Å; A264-G268 WeakPolarHBondContact O-CA 3.48Å; A264-G268 PolarHBondContact O-N 3.45Å; A264-I321 HydrophobicContact CB-CG2 4.2Å; A264-L325 VanDerWaalsContact CA-CD2 3.49Å; A264-L325 HydrophobicContact CB-CD2 3.59Å
265G98.4Very high97.2Very high0 Ų035.5 Ų35.50%018%0.179CC..Hα-helixtrans-64.6-43.8175.100000112.9A181 G261 G262 S269A181-G265 VanDerWaalsContact O-CA 3.22Å; A181-G265 WeakPolarHBondContact O-CA 3.39Å; G261-G265 PolarHBondContact O-N 3.13Å; G262-G265 PolarHBondContact O-N 3.24Å; G265-S269 PolarHBondContact O-N 2.93Å; G265-S269 VanDerWaalsContact O-N 3.07Å; G265-S269 PolarHBondContact O-OG 3.26Å
266L98.6Very high97.2Very high42 Ų4228.1 Ų28.122%0.2215%0.151CC..Hα-helixtrans-65.2-57.2177.9177.461.2000111.8L223 L227 G262 L263 G268 S269 I270L223-L266 HydrophobicContact CB-CD1 4.05Å; L223-L266 HydrophobicContact CD2-CD1 4Å; L227-L266 HydrophobicContact CB-CB 4.35Å; L227-L266 HydrophobicContact CD1-CB 4.31Å; G262-L266 PolarHBondContact O-N 3.3Å; L263-L266 PolarHBondContact O-N 3.02Å; L266-G268 VanDerWaalsContact C-N 3.28Å; L266-G268 PolarHBondContact O-N 3.45Å; L266-S269 PolarHBondContact O-N 3.24Å; L266-S269 PolarHBondContact O-OG 3Å; L266-I270 HydrophobicContact CD1-CD1 4.06Å; L266-I270 HydrophobicContact CG-CD1 4.09Å; L266-I270 WeakPolarHBondContact O-CG1 3.29Å; L266-I270 PolarHBondContact O-N 3.18Å; L266-I270 VanDerWaalsContact O-N 3.1Å
267L98.2Very high97.1Very high61 Ų6127.8 Ų27.832%0.31915%0.15SC..Hα-helixtrans-62.7-37.5-179.2-66.7-179.5000111.5L263 I270 V271 I321 L325L263-L267 HydrophobicContact CD1-CD1 3.78Å; L263-L267 HydrophobicContact CD1-CD2 4.44Å; L263-L267 HydrophobicContact CD1-CG 3.82Å; L263-L267 HydrophobicContact CD2-CD1 4.36Å; L263-L267 HydrophobicContact CG-CD1 3.76Å; L263-L267 HydrophobicContact CG-CG 4.16Å; L263-L267 WeakPolarHBondContact O-CB 3.2Å; L263-L267 WeakPolarHBondContact O-CG 3.4Å; L263-L267 PolarHBondContact O-N 3.01Å; L267-I270 WeakPolarHBondContact O-CB 3.41Å; L267-I270 PolarHBondContact O-N 3.23Å; L267-V271 WeakPolarHBondContact O-CG2 3.15Å; L267-V271 PolarHBondContact O-N 3.29Å; L267-I321 HydrophobicContact CB-CD1 3.87Å; L267-L325 HydrophobicContact CD1-CD1 3.97Å
268G97.4Very high96.9Very high0 Ų030.7 Ų30.70%017%0.165CC..Hα-helixtrans-57.2-50.7173.300000112.8C182 A264 L266 I270 V271 D272C182-G268 WeakPolarHBondContact SG-CA 3.37Å; A264-G268 WeakPolarHBondContact O-CA 3.48Å; A264-G268 PolarHBondContact O-N 3.45Å; L266-G268 VanDerWaalsContact C-N 3.28Å; L266-G268 PolarHBondContact O-N 3.45Å; G268-I270 PolarHBondContact O-N 3.02Å; G268-V271 PolarHBondContact O-N 3.47Å; G268-D272 VanDerWaalsContact O-CB 3.3Å; G268-D272 WeakPolarHBondContact O-CB 3.21Å; G268-D272 PolarHBondContact O-N 2.71Å
269S97.1Very high96.5Very high2 Ų231.6 Ų31.61%0.01417%0.168CC..Hα-helixtrans-62.4-30.8176.969.80000113.6S226 G265 L266 S273S226-S269 WeakPolarHBondContact CB-OG 3.49Å; S226-S269 PolarHBondContact OG-OG 3.48Å; G265-S269 PolarHBondContact O-N 2.93Å; G265-S269 VanDerWaalsContact O-N 3.07Å; G265-S269 PolarHBondContact O-OG 3.26Å; L266-S269 PolarHBondContact O-N 3.24Å; L266-S269 PolarHBondContact O-OG 3Å; S269-S273 VanDerWaalsContact O-CB 3.29Å; S269-S273 WeakPolarHBondContact O-CB 3.42Å; S269-S273 PolarHBondContact O-N 3.42Å; S269-S273 PolarHBondContact O-OG 3.49Å
270I97.8Very high96.2Very high59 Ų5929.2 Ų29.230%0.30315%0.147SC..Hα-helixtrans-71.1-47.5176.7-72.1170.4000110.4I204 L223 L266 L267 G268 D272 S273 Y274I204-I270 HydrophobicContact CD1-CB 4.5Å; I204-I270 HydrophobicContact CD1-CG2 3.97Å; I204-I270 WeakPolarHBondContact CD1-O 3.38Å; L223-I270 HydrophobicContact CD2-CD1 4.38Å; L223-I270 HydrophobicContact CD2-CG1 3.84Å; L266-I270 HydrophobicContact CD1-CD1 4.06Å; L266-I270 HydrophobicContact CG-CD1 4.09Å; L266-I270 WeakPolarHBondContact O-CG1 3.29Å; L266-I270 PolarHBondContact O-N 3.18Å; L266-I270 VanDerWaalsContact O-N 3.1Å; L267-I270 WeakPolarHBondContact O-CB 3.41Å; L267-I270 PolarHBondContact O-N 3.23Å; G268-I270 PolarHBondContact O-N 3.02Å; I270-D272 VanDerWaalsContact C-N 3.32Å; I270-S273 PolarHBondContact O-N 3.28Å; I270-Y274 WeakPolarHBondContact O-CB 3.15Å; I270-Y274 PolarHBondContact O-N 3.33Å
271V97.4Very high95.8Very high38 Ų3829.7 Ų29.723%0.2315%0.149CC..Hα-helixtrans-61.7-43.8176.4171.10000110.2L267 G268 Y274 L275 L320 I321L267-V271 WeakPolarHBondContact O-CG2 3.15Å; L267-V271 PolarHBondContact O-N 3.29Å; G268-V271 PolarHBondContact O-N 3.47Å; V271-Y274 PolarHBondContact O-N 2.84Å; V271-L275 HydrophobicContact CG1-CD1 4.04Å; V271-L275 HydrophobicContact CG1-CG 4.36Å; V271-L275 WeakPolarHBondContact O-CB 3.48Å; V271-L275 WeakPolarHBondContact O-CG 3.33Å; V271-L275 PolarHBondContact O-N 2.94Å; V271-L320 HydrophobicContact CG1-CD1 3.93Å; V271-I321 HydrophobicContact CG2-CD1 4.06Å
272D96.1Very high95.5Very high8 Ų829.7 Ų29.74%0.04315%0.149CC..Hα-helixtrans-59.3-51.5176.9-16291.9000111.9G268 I270 Y274 L275 G276 V313 N314 S317G268-D272 VanDerWaalsContact O-CB 3.3Å; G268-D272 WeakPolarHBondContact O-CB 3.21Å; G268-D272 PolarHBondContact O-N 2.71Å; I270-D272 VanDerWaalsContact C-N 3.32Å; D272-Y274 VanDerWaalsContact C-N 3.27Å; D272-Y274 PolarHBondContact O-N 3.09Å; D272-L275 PolarHBondContact O-N 2.91Å; D272-G276 PolarHBondContact O-N 3.35Å; D272-V313 WeakPolarHBondContact OD1-CG1 3.39Å; D272-N314 WeakPolarHBondContact OD1-CA 3.35Å; D272-N314 PolarHBondContact OD1-OD1 3.43Å; D272-S317 WeakPolarHBondContact CA-OG 3.43Å; D272-S317 WeakPolarHBondContact CB-OG 3.31Å; D272-S317 PolarHBondContact N-OG 2.88Å; D272-S317 PolarHBondContact OD1-OG 3.36Å
273S95.9Very high95.1Very high18 Ų1829.7 Ų29.713%0.12615%0.148CC..Hα-helixtrans-59.7-38.4176.1-64.10000112.4I204 G216 V218 S269 I270 G276 A277I204-S273 WeakPolarHBondContact CG2-O 3.29Å; G216-S273 WeakPolarHBondContact CA-O 3.49Å; V218-S273 WeakPolarHBondContact CG1-OG 3.18Å; S269-S273 VanDerWaalsContact O-CB 3.29Å; S269-S273 WeakPolarHBondContact O-CB 3.42Å; S269-S273 PolarHBondContact O-N 3.42Å; S269-S273 PolarHBondContact O-OG 3.49Å; I270-S273 PolarHBondContact O-N 3.28Å; S273-G276 PolarHBondContact O-N 3.4Å; S273-A277 WeakPolarHBondContact O-CB 3.16Å; S273-A277 PolarHBondContact O-N 3.3Å
274Y97Very high94.8Very high124 Ų12428.3 Ų28.349%0.48614%0.141SC..Hα-helixtrans-67.9-46.4179-178.7-94.2000111.9T205 I270 V271 D272 G276 A277 I278T205-Y274 HydrophobicContact CG2-CD2 4.06Å; T205-Y274 HydrophobicContact CG2-CE2 4.06Å; I270-Y274 WeakPolarHBondContact O-CB 3.15Å; I270-Y274 PolarHBondContact O-N 3.33Å; V271-Y274 PolarHBondContact O-N 2.84Å; D272-Y274 VanDerWaalsContact C-N 3.27Å; D272-Y274 PolarHBondContact O-N 3.09Å; Y274-G276 VanDerWaalsContact C-N 3.31Å; Y274-A277 PolarHBondContact O-N 2.66Å; Y274-I278 HydrophobicContact CD1-CD1 3.99Å; Y274-I278 HydrophobicContact CD2-CD1 4.42Å; Y274-I278 HydrophobicContact CE1-CD1 3.44Å; Y274-I278 VanDerWaalsContact CE1-CD1 3.44Å; Y274-I278 HydrophobicContact CE2-CD1 3.93Å; Y274-I278 HydrophobicContact CG-CD1 4.45Å; Y274-I278 WeakPolarHBondContact O-CG1 3.42Å; Y274-I278 PolarHBondContact O-N 3.35Å
275L92.4Very high94.3Very high31 Ų3129.2 Ų29.216%0.16215%0.146CC..Hα-helixtrans-62.6-41.6174.5-71.2179000110.7V271 D272 I278 M279 V313 F316 L320V271-L275 HydrophobicContact CG1-CD1 4.04Å; V271-L275 HydrophobicContact CG1-CG 4.36Å; V271-L275 WeakPolarHBondContact O-CB 3.48Å; V271-L275 WeakPolarHBondContact O-CG 3.33Å; V271-L275 PolarHBondContact O-N 2.94Å; D272-L275 PolarHBondContact O-N 2.91Å; L275-I278 PolarHBondContact O-N 3Å; L275-M279 WeakPolarHBondContact O-CA 3.42Å; L275-M279 VanDerWaalsContact O-CB 3.27Å; L275-M279 WeakPolarHBondContact O-CB 3.28Å; L275-M279 PolarHBondContact O-N 3.01Å; L275-V313 HydrophobicContact CB-CG1 3.79Å; L275-F316 HydrophobicContact CD1-CB 4.09Å; L275-L320 HydrophobicContact CD1-CD1 4.34Å
276G93.3Very high93.6Very high0 Ų036 Ų360%018%0.178CC..Hα-helixtrans-62.4-44.2177.700000113.7D272 S273 Y274 I278 Q280D272-G276 PolarHBondContact O-N 3.35Å; S273-G276 PolarHBondContact O-N 3.4Å; Y274-G276 VanDerWaalsContact C-N 3.31Å; G276-I278 PolarHBondContact O-N 3.01Å; G276-I278 VanDerWaalsContact O-N 3.14Å; G276-Q280 WeakPolarHBondContact O-CB 3.38Å; G276-Q280 PolarHBondContact O-N 3.3Å
277A93.8Very high92.9Very high6 Ų638 Ų385%0.0520%0.196CC..Hα-helixtrans-59.8-26177.100000113.8L203 I204 T205 S273 Y274 G304L203-A277 HydrophobicContact CD1-CB 3.82Å; L203-A277 HydrophobicContact CG-CB 4.36Å; I204-A277 HydrophobicContact CG2-CB 3.97Å; T205-A277 HydrophobicContact CG2-CB 3.72Å; S273-A277 WeakPolarHBondContact O-CB 3.16Å; S273-A277 PolarHBondContact O-N 3.3Å; Y274-A277 PolarHBondContact O-N 2.66Å; A277-G304 WeakPolarHBondContact O-CA 3.24Å; A277-G304 PolarHBondContact O-N 2.87Å; A277-G304 VanDerWaalsContact O-N 3.16Å
278I93.2Very high92Very high61 Ų6138.5 Ų38.531%0.31320%0.201SC..Hα-helixtrans-102.3-41.2-174.8-60.5171.5000111.6T205 Y274 L275 G276 K305T205-I278 HydrophobicContact CG2-CD1 4.3Å; T205-I278 HydrophobicContact CG2-CG1 4.05Å; Y274-I278 HydrophobicContact CD1-CD1 3.99Å; Y274-I278 HydrophobicContact CD2-CD1 4.42Å; Y274-I278 HydrophobicContact CE1-CD1 3.44Å; Y274-I278 VanDerWaalsContact CE1-CD1 3.44Å; Y274-I278 HydrophobicContact CE2-CD1 3.93Å; Y274-I278 HydrophobicContact CG-CD1 4.45Å; Y274-I278 WeakPolarHBondContact O-CG1 3.42Å; Y274-I278 PolarHBondContact O-N 3.35Å; L275-I278 PolarHBondContact O-N 3Å; G276-I278 PolarHBondContact O-N 3.01Å; G276-I278 VanDerWaalsContact O-N 3.14Å; I278-K305 PolarHBondContact O-N 3.49Å
279M89.8Confident91.3Very high64 Ų6441.1 Ų41.132%0.31523%0.228SC..Hα-helixtrans-112.5-8.2-165.1-57.9-66.9-169.100114.4L275 K305 I307 L308L275-M279 WeakPolarHBondContact O-CA 3.42Å; L275-M279 VanDerWaalsContact O-CB 3.27Å; L275-M279 WeakPolarHBondContact O-CB 3.28Å; L275-M279 PolarHBondContact O-N 3.01Å; M279-K305 CarbonylContact C-O 3.53Å; M279-I307 PolarHBondContact O-N 3.3Å; M279-I307 HydrophobicContact SD-CB 4.38Å; M279-I307 HydrophobicContact SD-CD1 3.66Å; M279-I307 HydrophobicContact SD-CG2 4.32Å; M279-L308 HydrophobicContact CB-CB 4.29Å; M279-L308 HydrophobicContact CB-CD1 4.01Å; M279-L308 HydrophobicContact CB-CG 4.13Å; M279-L308 HydrophobicContact CG-CD1 4.41Å; M279-L308 PolarHBondContact O-N 3.4Å
280Q90.4Very high90.7Very high9 Ų943.6 Ų43.64%0.04224%0.24CC..SBendtrans-109.7135.6172.6-62.3174.1-76.600109.9N215 G276 G304 K305 N310 V313N215-Q280 HydrophobicContact CB-CB 3.95Å; G276-Q280 WeakPolarHBondContact O-CB 3.38Å; G276-Q280 PolarHBondContact O-N 3.3Å; Q280-G304 VanDerWaalsContact O-CA 3.27Å; Q280-G304 WeakPolarHBondContact O-CA 3.28Å; Q280-K305 CarbonylContact C-O 3.59Å; Q280-K305 WeakPolarHBondContact CA-O 3.31Å; Q280-K305 PolarHBondContact N-O 3.31Å; Q280-N310 PolarHBondContact NE2-OD1 2.85Å; Q280-V313 HydrophobicContact CG-CG2 3.6Å
281Y91.6Very high90.2Very high23 Ų2341.3 Ų41.39%0.0923%0.229CC..  trans-72.3139.7176.3176.8-88.1000110.4N215 N293 S294 P295 H301 K305N215-Y281 PolarHBondContact ND2-O 3Å; Y281-N293 WeakPolarHBondContact O-CA 3.46Å; Y281-S294 VanDerWaalsContact CE1-C 3.41Å; Y281-S294 WeakPolarHBondContact CE1-O 3.48Å; Y281-P295 HydrophobicContact CD1-CG 4.27Å; Y281-P295 HydrophobicContact CD2-CG 3.97Å; Y281-P295 HydrophobicContact CE1-CB 4.42Å; Y281-P295 HydrophobicContact CE1-CG 4.33Å; Y281-P295 HydrophobicContact CE2-CB 4.19Å; Y281-P295 HydrophobicContact CE2-CG 4Å; Y281-P295 HydrophobicContact CG-CG 4.1Å; Y281-H301 AromaticContact CD2-CD2 3.76Å; Y281-H301 HydrophobicContact CE2-CB 4.5Å; Y281-H301 AromaticContact CE2-CD2 3.38Å; Y281-H301 WeakPolarHBondContact CE2-CD2 3.22Å; Y281-K305 PolarHBondContact N-O 2.9Å; Y281-K305 VanDerWaalsContact N-O 3.09Å
282T91.4Very high89.8Confident0 Ų040.4 Ų40.40%022%0.224CC..EExtended strand (participates in β ladder)trans-132.8126.4166.3-60.20000109.6T214 N215 V291 I302 A303T214-T282 HydrophobicContact CG2-CG2 3.92Å; N215-T282 VanDerWaalsContact CB-OG1 3.31Å; N215-T282 WeakPolarHBondContact CB-OG1 3.41Å; N215-T282 PolarHBondContact N-OG1 2.79Å; N215-T282 VanDerWaalsContact N-OG1 3.1Å; N215-T282 PolarHBondContact ND2-OG1 2.65Å; N215-T282 VanDerWaalsContact ND2-OG1 3.09Å; T282-V291 HydrophobicContact CG2-CG1 3.36Å; T282-I302 HydrophobicContact CG2-CB 4.11Å; T282-I302 HydrophobicContact CG2-CD1 3.88Å; T282-I302 HydrophobicContact CG2-CG1 4.35Å; T282-I302 PolarHBondContact O-N 3.43Å; T282-A303 PolarHBondContact N-O 3.49Å; T282-A303 PolarHBondContact O-N 2.94Å
283G91.2Very high89.2Confident0 Ų042.3 Ų42.30%023%0.234CC..EExtended strand (participates in β ladder)trans-123.8158.7169.200000111.9V291 V292 K300G283-V291 CarbonylContact O-C 3.23Å; G283-V291 WeakPolarHBondContact O-CA 3.33Å; G283-V292 PolarHBondContact N-O 3.29Å; G283-V292 PolarHBondContact O-N 3.35Å; G283-K300 CarbonylContact C-O 3.51Å; G283-K300 VanDerWaalsContact CA-O 3.24Å; G283-K300 WeakPolarHBondContact CA-O 3.42Å
284L90.6Very high88.6Confident49 Ų4944.9 Ų44.926%0.25725%0.252SS..EExtended strand (participates in β ladder)trans-104.4116.6168.4-173.667.8000108.1P211 E286 V291 A299 K300 I302P211-L284 HydrophobicContact CG-CD1 4.44Å; L284-E286 PolarHBondContact O-N 2.85Å; L284-V291 HydrophobicContact CD1-CG2 4.38Å; L284-A299 CarbonylContact O-C 3.26Å; L284-A299 WeakPolarHBondContact O-CA 3.32Å; L284-K300 PolarHBondContact N-O 3.46Å; L284-K300 PolarHBondContact O-N 3.35Å; L284-I302 HydrophobicContact CB-CD1 3.85Å; L284-I302 HydrophobicContact CB-CG1 4.2Å
285D88.8Confident87.8Confident18 Ų1842.7 Ų42.710%0.09625%0.253CS..EExtended strand (participates in β ladder)trans-74.9115.8170.4172.88.7000109S287 T288 G289 M290 V292D285-S287 VanDerWaalsContact C-N 3.25Å; D285-S287 VanDerWaalsContact CG-OG 3.29Å; D285-S287 PolarHBondContact O-N 3.46Å; D285-S287 WeakPolarHBondContact OD1-CB 3.24Å; D285-S287 PolarHBondContact OD1-N 3.45Å; D285-S287 PolarHBondContact OD1-OG 3.15Å; D285-S287 PolarHBondContact OD2-OG 2.87Å; D285-T288 WeakPolarHBondContact CB-OG1 3.44Å; D285-T288 WeakPolarHBondContact OD2-CB 3.08Å; D285-T288 VanDerWaalsContact OD2-CG2 3.26Å; D285-T288 WeakPolarHBondContact OD2-CG2 3.44Å; D285-T288 PolarHBondContact OD2-OG1 3.48Å; D285-G289 VanDerWaalsContact O-CA 3.26Å; D285-G289 WeakPolarHBondContact O-CA 3.21Å; D285-G289 PolarHBondContact O-N 2.79Å; D285-M290 PolarHBondContact N-O 3.32Å; D285-V292 HydrophobicContact CB-CG1 3.98Å
286E83.6Confident87.2Confident142 Ų14244.7 Ų44.766%0.66427%0.266SS*.THydrogen-bonded Turntrans-70.3-22.4-177.1-64.8-169.5161.200112.6L284 E298L284-E286 PolarHBondContact O-N 2.85Å; E286-E298 PolarHBondContact N-O 3.43Å
287S83.1Confident86.5Confident86 Ų8653.2 Ų53.260%0.60131%0.312SS*.THydrogen-bonded Turntrans-77-39-179.474.80000112.4D285D285-S287 VanDerWaalsContact C-N 3.25Å; D285-S287 VanDerWaalsContact CG-OG 3.29Å; D285-S287 PolarHBondContact O-N 3.46Å; D285-S287 WeakPolarHBondContact OD1-CB 3.24Å; D285-S287 PolarHBondContact OD1-N 3.45Å; D285-S287 PolarHBondContact OD1-OG 3.15Å; D285-S287 PolarHBondContact OD2-OG 2.87Å
288T80.8Confident85.9Confident71 Ų7159.3 Ų59.344%0.43634%0.339SS..THydrogen-bonded Turntrans-100.7-18.6-178.561.10000113.2D285 M290D285-T288 WeakPolarHBondContact CB-OG1 3.44Å; D285-T288 WeakPolarHBondContact OD2-CB 3.08Å; D285-T288 VanDerWaalsContact OD2-CG2 3.26Å; D285-T288 WeakPolarHBondContact OD2-CG2 3.44Å; D285-T288 PolarHBondContact OD2-OG1 3.48Å; T288-M290 HydrophobicContact CG2-CE 4.13Å; T288-M290 PolarHBondContact O-N 2.93Å; T288-M290 PolarHBondContact OG1-N 3.4Å
289G83Confident85.5Confident55 Ų5557.1 Ų57.157%0.56733%0.33SS*.  trans69.212.8-172.400000113.6D285D285-G289 VanDerWaalsContact O-CA 3.26Å; D285-G289 WeakPolarHBondContact O-CA 3.21Å; D285-G289 PolarHBondContact O-N 2.79Å
290M84.4Confident85.5Confident53 Ų5360.3 Ų60.326%0.26134%0.342SS..  trans-101153.2-177.6-63.9-168.4-66.900111.7D285 T288D285-M290 PolarHBondContact N-O 3.32Å; T288-M290 HydrophobicContact CG2-CE 4.13Å; T288-M290 PolarHBondContact O-N 2.93Å; T288-M290 PolarHBondContact OG1-N 3.4Å
291V87.1Confident85.5Confident11 Ų1165 Ų657%0.06736%0.364CS..EExtended strand (participates in β ladder)trans-76.3137.7171.9176.10000109.8S123 P211 V212 G213 T282 G283 L284 I302S123-V291 PolarHBondContact OG-O 3.46Å; P211-V291 HydrophobicContact CB-CG2 3.81Å; V212-V291 VanDerWaalsContact O-CG2 3.27Å; V212-V291 WeakPolarHBondContact O-CG2 3.5Å; G213-V291 WeakPolarHBondContact O-CG1 3.19Å; T282-V291 HydrophobicContact CG2-CG1 3.36Å; G283-V291 CarbonylContact O-C 3.23Å; G283-V291 WeakPolarHBondContact O-CA 3.33Å; L284-V291 HydrophobicContact CD1-CG2 4.38Å; V291-I302 HydrophobicContact CG2-CD1 4.45Å
292V87.4Confident85.4Confident20 Ų2066.2 Ų66.212%0.12137%0.372CS..EExtended strand (participates in β ladder)trans-123.6142.8177.3-620000110.9G283 D285 A299G283-V292 PolarHBondContact N-O 3.29Å; G283-V292 PolarHBondContact O-N 3.35Å; D285-V292 HydrophobicContact CB-CG1 3.98Å; V292-A299 HydrophobicContact CG2-CB 3.54Å
293N83.9Confident85.3Confident48 Ų4866.6 Ų66.626%0.25738%0.375SS..SBendtrans-96.7-0.5-176.7-59.8-48.7000113.7E124 N215 Y281E124-N293 WeakPolarHBondContact OE1-CB 3.34Å; E124-N293 PolarHBondContact OE1-ND2 3.34Å; N215-N293 PolarHBondContact ND2-OD1 3.44Å; Y281-N293 WeakPolarHBondContact O-CA 3.46Å
294S82.8Confident85.3Confident72 Ų7267.3 Ų67.350%0.50338%0.382SS..SBendtrans-124.3143.9178.8-67.50000111Y281 T296Y281-S294 VanDerWaalsContact CE1-C 3.41Å; Y281-S294 WeakPolarHBondContact CE1-O 3.48Å; S294-T296 PolarHBondContact O-N 2.86Å
295P80.9Confident85.1Confident78 Ų7871.4 Ų71.451%0.50640%0.398SS..  trans-63.7121174.4-16.428.9000110.3Y281 P306Y281-P295 HydrophobicContact CD1-CG 4.27Å; Y281-P295 HydrophobicContact CD2-CG 3.97Å; Y281-P295 HydrophobicContact CE1-CB 4.42Å; Y281-P295 HydrophobicContact CE1-CG 4.33Å; Y281-P295 HydrophobicContact CE2-CB 4.19Å; Y281-P295 HydrophobicContact CE2-CG 4Å; Y281-P295 HydrophobicContact CG-CG 4.1Å; P295-P306 HydrophobicContact CG-CB 4.27Å; P295-P306 HydrophobicContact CG-CG 4.25Å
296T80.6Confident85Confident72 Ų7274.9 Ų74.944%0.44242%0.422SS..  trans-125.3159.5170.762.70000109.4S294 E298 A299S294-T296 PolarHBondContact O-N 2.86Å; T296-E298 PolarHBondContact O-N 3.4Å; T296-E298 VanDerWaalsContact O-N 3.16Å; T296-A299 PolarHBondContact O-N 2.9Å; T296-A299 WeakPolarHBondContact OG1-CB 3.32Å; T296-A299 PolarHBondContact OG1-N 3.49Å
297N78.6Confident84.8Confident180 Ų18073.1 Ų73.196%0.96342%0.416SS*.THydrogen-bonded Turntrans-63.2-21.2-179-68.2-19.2000113.2
298E80Confident84.8Confident133 Ų13371.3 Ų71.362%0.62140%0.399SS*.THydrogen-bonded Turntrans-101-4.5-176.6-62.4174.6179.500112.4E286 T296E286-E298 PolarHBondContact N-O 3.43Å; T296-E298 PolarHBondContact O-N 3.4Å; T296-E298 VanDerWaalsContact O-N 3.16Å
299A85.4Confident85.1Confident15 Ų1571.9 Ų71.912%0.12440%0.4CS..EExtended strand (participates in β ladder)trans-93.7121-177.700000112.4L284 V292 T296 H301L284-A299 CarbonylContact O-C 3.26Å; L284-A299 WeakPolarHBondContact O-CA 3.32Å; V292-A299 HydrophobicContact CG2-CB 3.54Å; T296-A299 PolarHBondContact O-N 2.9Å; T296-A299 WeakPolarHBondContact OG1-CB 3.32Å; T296-A299 PolarHBondContact OG1-N 3.49Å; A299-H301 PolarHBondContact O-N 2.94Å
300K89.4Confident85.4Confident132 Ų13272.7 Ų72.757%0.57439%0.391SS*.EExtended strand (participates in β ladder)trans-78.3119.6169.5-175.2176.6-177.9175.30109.9G283 L284 I302G283-K300 CarbonylContact C-O 3.51Å; G283-K300 VanDerWaalsContact CA-O 3.24Å; G283-K300 WeakPolarHBondContact CA-O 3.42Å; L284-K300 PolarHBondContact N-O 3.46Å; L284-K300 PolarHBondContact O-N 3.35Å; K300-I302 PolarHBondContact O-N 3.27Å
301H91.9Very high85.5Confident106 Ų10671.5 Ų71.549%0.49139%0.385SS..EExtended strand (participates in β ladder)trans-59136.8179.2-178.9-114000112.4Y281 A299 A303 G304Y281-H301 AromaticContact CD2-CD2 3.76Å; Y281-H301 HydrophobicContact CE2-CB 4.5Å; Y281-H301 AromaticContact CE2-CD2 3.38Å; Y281-H301 WeakPolarHBondContact CE2-CD2 3.22Å; A299-H301 PolarHBondContact O-N 2.94Å; H301-A303 VanDerWaalsContact NE2-C 3.31Å; H301-A303 PolarHBondContact NE2-O 3.39Å; H301-G304 PolarHBondContact NE2-O 3.46Å
302I88.8Confident85.4Confident50 Ų5071.9 Ų71.926%0.25639%0.39SS..EExtended strand (participates in β ladder)trans-113.5-54.7176.7-51.2179.5000110.4V210 P211 T214 T282 L284 V291 K300V210-I302 HydrophobicContact CG1-CG2 4.24Å; P211-I302 HydrophobicContact CG-CD1 4.07Å; T214-I302 HydrophobicContact CG2-CG2 4.28Å; T282-I302 HydrophobicContact CG2-CB 4.11Å; T282-I302 HydrophobicContact CG2-CD1 3.88Å; T282-I302 HydrophobicContact CG2-CG1 4.35Å; T282-I302 PolarHBondContact O-N 3.43Å; L284-I302 HydrophobicContact CB-CD1 3.85Å; L284-I302 HydrophobicContact CB-CG1 4.2Å; V291-I302 HydrophobicContact CG2-CD1 4.45Å; K300-I302 PolarHBondContact O-N 3.27Å
303A89.4Confident85.5Confident7 Ų771 Ų716%0.05838%0.384CS..EExtended strand (participates in β ladder)trans-154161.1-169.700000113.1L203 T214 T282 H301L203-A303 HydrophobicContact CD1-CB 4.17Å; L203-A303 HydrophobicContact CD2-CB 4.12Å; T214-A303 HydrophobicContact CG2-CB 4.44Å; T282-A303 PolarHBondContact N-O 3.49Å; T282-A303 PolarHBondContact O-N 2.94Å; H301-A303 VanDerWaalsContact NE2-C 3.31Å; H301-A303 PolarHBondContact NE2-O 3.39Å
304G90.4Very high85.8Confident16 Ų1669.2 Ų69.217%0.16538%0.375CS..  trans59.2-169.4173.300000116A277 Q280 H301A277-G304 WeakPolarHBondContact O-CA 3.24Å; A277-G304 PolarHBondContact O-N 2.87Å; A277-G304 VanDerWaalsContact O-N 3.16Å; Q280-G304 VanDerWaalsContact O-CA 3.27Å; Q280-G304 WeakPolarHBondContact O-CA 3.28Å; H301-G304 PolarHBondContact NE2-O 3.46Å
305K86.9Confident85.9Confident134 Ų13467.6 Ų67.658%0.58336%0.361SS*.  trans-133152.6-177.6-65.3179.9-178.2178.30109I278 M279 Q280 Y281 I307I278-K305 PolarHBondContact O-N 3.49Å; M279-K305 CarbonylContact C-O 3.53Å; Q280-K305 CarbonylContact C-O 3.59Å; Q280-K305 WeakPolarHBondContact CA-O 3.31Å; Q280-K305 PolarHBondContact N-O 3.31Å; Y281-K305 PolarHBondContact N-O 2.9Å; Y281-K305 VanDerWaalsContact N-O 3.09Å; K305-I307 HydrophobicContact CB-CD1 3.83Å; K305-I307 HydrophobicContact CB-CG1 3.82Å; K305-I307 HydrophobicContact CD-CD1 4.03Å; K305-I307 PolarHBondContact O-N 2.93Å
306P86.5Confident86.3Confident92 Ų9268.8 Ų68.860%0.59736%0.358SS*.THydrogen-bonded Turntrans-7959.6179.233.5-35.7000111P295P295-P306 HydrophobicContact CG-CB 4.27Å; P295-P306 HydrophobicContact CG-CG 4.25Å
307I80.1Confident86.9Confident104 Ų10465.4 Ų65.453%0.53334%0.337SS..THydrogen-bonded Turntrans-95-47.1-178.2-61.7172.2000110.1M279 K305M279-I307 PolarHBondContact O-N 3.3Å; M279-I307 HydrophobicContact SD-CB 4.38Å; M279-I307 HydrophobicContact SD-CD1 3.66Å; M279-I307 HydrophobicContact SD-CG2 4.32Å; K305-I307 HydrophobicContact CB-CD1 3.83Å; K305-I307 HydrophobicContact CB-CG1 3.82Å; K305-I307 HydrophobicContact CD-CD1 4.03Å; K305-I307 PolarHBondContact O-N 2.93Å
308L82.9Confident87.5Confident48 Ų4856.8 Ų56.825%0.25129%0.291SS..  trans-123.1151-178.3-61.5-177.9000110.7M279 A312 V313 F316M279-L308 HydrophobicContact CB-CB 4.29Å; M279-L308 HydrophobicContact CB-CD1 4.01Å; M279-L308 HydrophobicContact CB-CG 4.13Å; M279-L308 HydrophobicContact CG-CD1 4.41Å; M279-L308 PolarHBondContact O-N 3.4Å; L308-A312 HydrophobicContact CB-CB 4.2Å; L308-A312 HydrophobicContact CD2-CB 4.07Å; L308-V313 HydrophobicContact CB-CG2 3.89Å; L308-V313 HydrophobicContact CD1-CG2 4.07Å; L308-F316 HydrophobicContact CD1-CD2 3.9Å; L308-F316 HydrophobicContact CD1-CE2 4.08Å; L308-F316 HydrophobicContact CD2-CE2 4.17Å
309D87.3Confident87.9Confident84 Ų8452.9 Ų52.945%0.44928%0.276SS..  trans-90.8175.7166.379.1-20.2000110.8N311 A312 V313D309-N311 VanDerWaalsContact C-N 3.29Å; D309-N311 PolarHBondContact O-N 3.5Å; D309-N311 PolarHBondContact OD1-N 3.49Å; D309-N311 PolarHBondContact OD2-ND2 3.03Å; D309-A312 PolarHBondContact O-N 3.48Å; D309-A312 WeakPolarHBondContact OD1-CB 3.27Å; D309-A312 PolarHBondContact OD1-N 2.99Å; D309-V313 PolarHBondContact O-N 3.26Å; D309-V313 VanDerWaalsContact O-N 3.11Å
310N88.5Confident88.3Confident72 Ų7255.6 Ų55.639%0.38529%0.288SS..Hα-helixtrans-61.8-37179.6-162.182.3000113Q280 A312 V313 N314Q280-N310 PolarHBondContact NE2-OD1 2.85Å; N310-A312 PolarHBondContact O-N 3.39Å; N310-V313 PolarHBondContact O-N 3.37Å; N310-N314 PolarHBondContact ND2-OD1 2.94Å; N310-N314 PolarHBondContact O-N 2.84Å; N310-N314 PolarHBondContact O-OD1 3.16Å
311N87.6Confident88.7Confident27 Ų2749.9 Ų49.914%0.14426%0.264CS..Hα-helixtrans-68-39.8-177.8-54.2-61.9000111.2I134 Q135 C138 D309 L315I134-N311 HydrophobicContact CG2-CB 4.11Å; Q135-N311 WeakPolarHBondContact CG-OD1 3.47Å; C138-N311 HydrophobicContact CB-CB 4.14Å; C138-N311 VanDerWaalsContact CB-O 3.3Å; C138-N311 WeakPolarHBondContact CB-O 3.5Å; C138-N311 PolarHBondContact SG-O 2.95Å; C138-N311 VanDerWaalsContact SG-O 3.4Å; D309-N311 VanDerWaalsContact C-N 3.29Å; D309-N311 PolarHBondContact O-N 3.5Å; D309-N311 PolarHBondContact OD1-N 3.49Å; D309-N311 PolarHBondContact OD2-ND2 3.03Å; N311-L315 WeakPolarHBondContact O-CB 3.21Å; N311-L315 PolarHBondContact O-N 2.86Å
312A84.1Confident88.7Confident20 Ų2044.9 Ų44.917%0.16524%0.241CC..Hα-helixtrans-66.2-43175.800000111.8L308 D309 N310 L315 F316L308-A312 HydrophobicContact CB-CB 4.2Å; L308-A312 HydrophobicContact CD2-CB 4.07Å; D309-A312 PolarHBondContact O-N 3.48Å; D309-A312 WeakPolarHBondContact OD1-CB 3.27Å; D309-A312 PolarHBondContact OD1-N 2.99Å; N310-A312 PolarHBondContact O-N 3.39Å; A312-L315 WeakPolarHBondContact O-CB 3.3Å; A312-L315 PolarHBondContact O-N 3.26Å; A312-F316 HydrophobicContact CB-CE2 4.47Å; A312-F316 WeakPolarHBondContact O-CD2 3.25Å; A312-F316 PolarHBondContact O-N 3.33Å
313V89.7Confident88.8Confident0 Ų046.7 Ų46.70%025%0.25CS..Hα-helixtrans-60.7-49.5176.5174.30000110.9D272 L275 Q280 L308 D309 N310 L315 F316 S317D272-V313 WeakPolarHBondContact OD1-CG1 3.39Å; L275-V313 HydrophobicContact CB-CG1 3.79Å; Q280-V313 HydrophobicContact CG-CG2 3.6Å; L308-V313 HydrophobicContact CB-CG2 3.89Å; L308-V313 HydrophobicContact CD1-CG2 4.07Å; D309-V313 PolarHBondContact O-N 3.26Å; D309-V313 VanDerWaalsContact O-N 3.11Å; N310-V313 PolarHBondContact O-N 3.37Å; V313-L315 VanDerWaalsContact C-N 3.26Å; V313-L315 PolarHBondContact O-N 3.18Å; V313-F316 PolarHBondContact O-N 2.89Å; V313-F316 VanDerWaalsContact O-N 3.13Å; V313-S317 WeakPolarHBondContact O-CB 3.47Å; V313-S317 PolarHBondContact O-N 3.02Å; V313-S317 PolarHBondContact O-OG 3.17Å
314N89.6Confident89.1Confident11 Ų1151.9 Ų51.96%0.05928%0.277CS..Hα-helixtrans-55.6-41.4175.9-73.243.7000112.2D186 D272 N310 S318D186-N314 PolarHBondContact OD2-ND2 2.96Å; D272-N314 WeakPolarHBondContact OD1-CA 3.35Å; D272-N314 PolarHBondContact OD1-OD1 3.43Å; N310-N314 PolarHBondContact ND2-OD1 2.94Å; N310-N314 PolarHBondContact O-N 2.84Å; N310-N314 PolarHBondContact O-OD1 3.16Å; N314-S318 VanDerWaalsContact O-CB 3.31Å; N314-S318 WeakPolarHBondContact O-CB 3.36Å; N314-S318 PolarHBondContact O-N 2.87Å; N314-S318 PolarHBondContact O-OG 3.48Å
315L86.3Confident89.4Confident39 Ų3952 Ų5220%0.20427%0.273CS..Hα-helixtrans-61.6-53.2175.9177.663.1000111.2C138 V142 N311 A312 V313 S317 S318 V319C138-L315 HydrophobicContact CB-CB 4.16Å; C138-L315 WeakPolarHBondContact O-CD1 3.3Å; V142-L315 HydrophobicContact CG2-CD1 3.95Å; N311-L315 WeakPolarHBondContact O-CB 3.21Å; N311-L315 PolarHBondContact O-N 2.86Å; A312-L315 WeakPolarHBondContact O-CB 3.3Å; A312-L315 PolarHBondContact O-N 3.26Å; V313-L315 VanDerWaalsContact C-N 3.26Å; V313-L315 PolarHBondContact O-N 3.18Å; L315-S317 PolarHBondContact O-N 2.85Å; L315-S318 PolarHBondContact O-N 3.48Å; L315-S318 PolarHBondContact O-OG 2.95Å; L315-V319 HydrophobicContact CD1-CG2 4.4Å; L315-V319 WeakPolarHBondContact O-CG2 3.36Å; L315-V319 PolarHBondContact O-N 3.46Å
316F88.4Confident89.7Confident103 Ų10345.6 Ų45.645%0.45225%0.246SC..Hα-helixtrans-62.7-42.4-179.4-76.4-66.4000112.7L275 L308 A312 V313 S318 V319 L320L275-F316 HydrophobicContact CD1-CB 4.09Å; L308-F316 HydrophobicContact CD1-CD2 3.9Å; L308-F316 HydrophobicContact CD1-CE2 4.08Å; L308-F316 HydrophobicContact CD2-CE2 4.17Å; A312-F316 HydrophobicContact CB-CE2 4.47Å; A312-F316 WeakPolarHBondContact O-CD2 3.25Å; A312-F316 PolarHBondContact O-N 3.33Å; V313-F316 PolarHBondContact O-N 2.89Å; V313-F316 VanDerWaalsContact O-N 3.13Å; F316-S318 VanDerWaalsContact C-N 3.32Å; F316-S318 PolarHBondContact O-N 3.45Å; F316-V319 PolarHBondContact O-N 3.43Å; F316-L320 WeakPolarHBondContact O-CG 3.38Å; F316-L320 PolarHBondContact O-N 2.78Å
317S93.1Very high90Very high0 Ų044.3 Ų44.30%024%0.236CC..Hα-helixtrans-56.7-47.6174.2-56.90000111D272 V313 L315 V319 L320 I321D272-S317 WeakPolarHBondContact CA-OG 3.43Å; D272-S317 WeakPolarHBondContact CB-OG 3.31Å; D272-S317 PolarHBondContact N-OG 2.88Å; D272-S317 PolarHBondContact OD1-OG 3.36Å; V313-S317 WeakPolarHBondContact O-CB 3.47Å; V313-S317 PolarHBondContact O-N 3.02Å; V313-S317 PolarHBondContact O-OG 3.17Å; L315-S317 PolarHBondContact O-N 2.85Å; S317-V319 PolarHBondContact O-N 3.18Å; S317-L320 PolarHBondContact O-N 3.03Å; S317-I321 WeakPolarHBondContact O-CG1 3.43Å; S317-I321 PolarHBondContact O-N 2.83Å
318S91.1Very high90.6Very high0 Ų041.7 Ų41.70%023%0.23CC..Hα-helixtrans-63.7-40.8179.2770000112.4N314 L315 F316 A322N314-S318 VanDerWaalsContact O-CB 3.31Å; N314-S318 WeakPolarHBondContact O-CB 3.36Å; N314-S318 PolarHBondContact O-N 2.87Å; N314-S318 PolarHBondContact O-OG 3.48Å; L315-S318 PolarHBondContact O-N 3.48Å; L315-S318 PolarHBondContact O-OG 2.95Å; F316-S318 VanDerWaalsContact C-N 3.32Å; F316-S318 PolarHBondContact O-N 3.45Å; S318-A322 WeakPolarHBondContact O-CB 3.33Å; S318-A322 PolarHBondContact O-N 3.02Å
319V88.6Confident91.1Very high50 Ų5040 Ų4030%0.30322%0.223SC..Hα-helixtrans-61.2-50.8175.61710000110.5V142 L315 F316 S317 I321 A322 L323V142-V319 HydrophobicContact CG2-CG2 3.46Å; V142-V319 VanDerWaalsContact CG2-CG2 3.46Å; L315-V319 HydrophobicContact CD1-CG2 4.4Å; L315-V319 WeakPolarHBondContact O-CG2 3.36Å; L315-V319 PolarHBondContact O-N 3.46Å; F316-V319 PolarHBondContact O-N 3.43Å; S317-V319 PolarHBondContact O-N 3.18Å; V319-I321 VanDerWaalsContact C-N 3.35Å; V319-I321 PolarHBondContact O-N 3.28Å; V319-A322 PolarHBondContact O-N 3.22Å; V319-L323 HydrophobicContact CG1-CD1 3.84Å; V319-L323 HydrophobicContact CG1-CG 4.4Å; V319-L323 VanDerWaalsContact O-CG 3.3Å; V319-L323 WeakPolarHBondContact O-CG 3.4Å; V319-L323 PolarHBondContact O-N 2.93Å
320L93.3Very high91.2Very high73 Ų7341.5 Ų41.538%0.38222%0.223SC..Hα-helixtrans-59.5-46.1-178.2-71.9173.9000111.6V271 L275 F316 S317 L323 L324V271-L320 HydrophobicContact CG1-CD1 3.93Å; L275-L320 HydrophobicContact CD1-CD1 4.34Å; F316-L320 WeakPolarHBondContact O-CG 3.38Å; F316-L320 PolarHBondContact O-N 2.78Å; S317-L320 PolarHBondContact O-N 3.03Å; L320-L323 PolarHBondContact O-N 3.33Å; L320-L324 VanDerWaalsContact O-CB 3.3Å; L320-L324 WeakPolarHBondContact O-CB 3.37Å; L320-L324 VanDerWaalsContact O-CG 3.26Å; L320-L324 WeakPolarHBondContact O-CG 3.28Å; L320-L324 PolarHBondContact O-N 3.33Å
321I97.5Very high91.2Very high11 Ų1140.6 Ų40.66%0.05623%0.23CC..Hα-helixtrans-68-40.4179.4-66.9-61.6000111.7A178 C182 A264 L267 V271 S317 V319 L323 L325 P326A178-I321 HydrophobicContact CB-CG2 3.85Å; C182-I321 HydrophobicContact CB-CB 4.44Å; C182-I321 HydrophobicContact CB-CG2 4.25Å; A264-I321 HydrophobicContact CB-CG2 4.2Å; L267-I321 HydrophobicContact CB-CD1 3.87Å; V271-I321 HydrophobicContact CG2-CD1 4.06Å; S317-I321 WeakPolarHBondContact O-CG1 3.43Å; S317-I321 PolarHBondContact O-N 2.83Å; V319-I321 VanDerWaalsContact C-N 3.35Å; V319-I321 PolarHBondContact O-N 3.28Å; I321-L323 VanDerWaalsContact C-N 3.29Å; I321-L323 PolarHBondContact O-N 3.35Å; I321-L325 HydrophobicContact CG2-CB 4.43Å; I321-L325 HydrophobicContact CG2-CD2 4.31Å; I321-L325 VanDerWaalsContact O-CB 3.28Å; I321-L325 WeakPolarHBondContact O-CB 3.44Å; I321-L325 PolarHBondContact O-N 2.84Å; I321-L325 VanDerWaalsContact O-N 3.11Å; I321-P326 WeakPolarHBondContact O-CD 3.47Å
322A93.5Very high91.2Very high2 Ų247.7 Ų47.72%0.01726%0.26CS..Hα-helixtrans-64.8-29.5177.400000113.5V142 L146 S175 A179 S318 V319 P326V142-A322 HydrophobicContact CG1-CB 3.91Å; L146-A322 HydrophobicContact CD1-CB 4.5Å; S175-A322 WeakPolarHBondContact CB-O 3.29Å; S175-A322 WeakPolarHBondContact O-CB 3.41Å; S175-A322 PolarHBondContact OG-O 2.97Å; A179-A322 HydrophobicContact CB-CB 4.17Å; S318-A322 WeakPolarHBondContact O-CB 3.33Å; S318-A322 PolarHBondContact O-N 3.02Å; V319-A322 PolarHBondContact O-N 3.22Å; A322-P326 WeakPolarHBondContact O-CD 3.46Å; A322-P326 VanDerWaalsContact O-CG 3.31Å; A322-P326 WeakPolarHBondContact O-CG 3.39Å
323L91Very high91.6Very high87 Ų8747.5 Ų47.546%0.45526%0.255SS..Hα-helixtrans-87-45.1178.2-66178.6000112.7W171 V319 L320 I321 T327W171-L323 HydrophobicContact CH2-CD2 3.66Å; W171-L323 HydrophobicContact CZ2-CD2 4.06Å; V319-L323 HydrophobicContact CG1-CD1 3.84Å; V319-L323 HydrophobicContact CG1-CG 4.4Å; V319-L323 VanDerWaalsContact O-CG 3.3Å; V319-L323 WeakPolarHBondContact O-CG 3.4Å; V319-L323 PolarHBondContact O-N 2.93Å; L320-L323 PolarHBondContact O-N 3.33Å; I321-L323 VanDerWaalsContact C-N 3.29Å; I321-L323 PolarHBondContact O-N 3.35Å; L323-T327 PolarHBondContact O-OG1 3.22Å
324L94.6Very high91.5Very high117 Ų11749.4 Ų49.461%0.61327%0.267SS*.Hα-helixtrans-83-43.8-169.7-63.4176.5000112.7L320 T327 A328L320-L324 VanDerWaalsContact O-CB 3.3Å; L320-L324 WeakPolarHBondContact O-CB 3.37Å; L320-L324 VanDerWaalsContact O-CG 3.26Å; L320-L324 WeakPolarHBondContact O-CG 3.28Å; L320-L324 PolarHBondContact O-N 3.33Å; L324-T327 WeakPolarHBondContact O-CB 3.38Å; L324-T327 PolarHBondContact O-N 3.34Å; L324-A328 PolarHBondContact O-N 3.49Å
325L96.1Very high91.1Very high17 Ų1757.3 Ų57.39%0.08930%0.296CS..Hα-helixtrans-70.9-41.8-169.4-168.761.4000113.5F260 L263 A264 L267 I321 T327 A328 A329F260-L325 HydrophobicContact CD2-CG 4.36Å; F260-L325 HydrophobicContact CE2-CB 4.33Å; F260-L325 HydrophobicContact CE2-CD2 4Å; F260-L325 HydrophobicContact CE2-CG 3.63Å; F260-L325 HydrophobicContact CZ-CB 4.32Å; F260-L325 HydrophobicContact CZ-CD2 4.03Å; F260-L325 HydrophobicContact CZ-CG 3.95Å; L263-L325 HydrophobicContact CD2-CD1 3.98Å; L263-L325 HydrophobicContact CG-CD1 4.37Å; A264-L325 VanDerWaalsContact CA-CD2 3.49Å; A264-L325 HydrophobicContact CB-CD2 3.59Å; L267-L325 HydrophobicContact CD1-CD1 3.97Å; I321-L325 HydrophobicContact CG2-CB 4.43Å; I321-L325 HydrophobicContact CG2-CD2 4.31Å; I321-L325 VanDerWaalsContact O-CB 3.28Å; I321-L325 WeakPolarHBondContact O-CB 3.44Å; I321-L325 PolarHBondContact O-N 2.84Å; I321-L325 VanDerWaalsContact O-N 3.11Å; L325-T327 VanDerWaalsContact C-N 3.3Å; L325-T327 PolarHBondContact O-N 2.71Å; L325-A328 PolarHBondContact O-N 2.93Å; L325-A329 VanDerWaalsContact O-CB 3.32Å; L325-A329 WeakPolarHBondContact O-CB 3.27Å; L325-A329 PolarHBondContact O-N 3.26Å
326P94.3Very high90Very high0 Ų059.4 Ų59.40%033%0.327CS..Hα-helixtrans-61.7-38.3172.7-25.337.1000112.9W171 L174 S175 F260 I321 A322 A328 A329 W330W171-P326 HydrophobicContact CG-CB 4.21Å; L174-P326 HydrophobicContact CB-CB 3.91Å; L174-P326 HydrophobicContact CB-CG 4Å; S175-P326 WeakPolarHBondContact OG-CG 3.45Å; F260-P326 HydrophobicContact CZ-CG 4Å; I321-P326 WeakPolarHBondContact O-CD 3.47Å; A322-P326 WeakPolarHBondContact O-CD 3.46Å; A322-P326 VanDerWaalsContact O-CG 3.31Å; A322-P326 WeakPolarHBondContact O-CG 3.39Å; P326-A328 VanDerWaalsContact C-N 3.34Å; P326-A329 PolarHBondContact O-N 2.9Å; P326-W330 PolarHBondContact O-N 2.94Å
327T92.4Very high90.1Very high65 Ų6557.3 Ų57.340%0.39932%0.321SS..Hα-helixtrans-63.7-40.5177-54.70000111.3W171 L323 L324 L325W171-T327 PolarHBondContact NE1-OG1 2.9Å; L323-T327 PolarHBondContact O-OG1 3.22Å; L324-T327 WeakPolarHBondContact O-CB 3.38Å; L324-T327 PolarHBondContact O-N 3.34Å; L325-T327 VanDerWaalsContact C-N 3.3Å; L325-T327 PolarHBondContact O-N 2.71Å
328A93.3Very high90Very high50 Ų5060.3 Ų60.341%0.41334%0.338SS..Hα-helixtrans-67.8-44.6171.700000111.5L324 L325 P326 W330 G331 F332L324-A328 PolarHBondContact O-N 3.49Å; L325-A328 PolarHBondContact O-N 2.93Å; P326-A328 VanDerWaalsContact C-N 3.34Å; A328-W330 PolarHBondContact O-N 3.24Å; A328-G331 PolarHBondContact O-N 2.91Å; A328-G331 VanDerWaalsContact O-N 3.1Å; A328-F332 WeakPolarHBondContact O-CD2 3.31Å; A328-F332 WeakPolarHBondContact O-CE2 3.4Å
329A92.4Very high89.9Confident13 Ų1363.6 Ų63.611%0.10736%0.357CS..Hα-helixtrans-60-33.2-17800000112.8L174 F260 L325 P326 G331 F332 W333L174-A329 HydrophobicContact CD1-CB 4.25Å; F260-A329 HydrophobicContact CD2-CB 3.85Å; F260-A329 HydrophobicContact CE2-CB 3.69Å; L325-A329 VanDerWaalsContact O-CB 3.32Å; L325-A329 WeakPolarHBondContact O-CB 3.27Å; L325-A329 PolarHBondContact O-N 3.26Å; P326-A329 PolarHBondContact O-N 2.9Å; A329-G331 PolarHBondContact O-N 2.9Å; A329-G331 VanDerWaalsContact O-N 3.17Å; A329-F332 CarbonylContact O-C 3.18Å; A329-F332 PolarHBondContact O-N 2.95Å; A329-W333 HydrophobicContact CB-CE3 4.15Å; A329-W333 HydrophobicContact CB-CZ3 4.48Å; A329-W333 WeakPolarHBondContact O-CB 3.37Å; A329-W333 PolarHBondContact O-N 3.25Å
330W90.4Very high90Very high115 Ų11564.4 Ų64.444%0.43636%0.36SS..Hα-helixtrans-50.4-38.6174171.845.5000113.5F163 Y167 P326 A328 F332F163-W330 HydrophobicContact CD1-CB 4.16Å; F163-W330 AromaticContact CD1-CD1 3.7Å; F163-W330 HydrophobicContact CD1-CG 4.17Å; F163-W330 HydrophobicContact CE1-CB 4.04Å; F163-W330 HydrophobicContact CE1-CG 4.49Å; F163-W330 HydrophobicContact CE2-CB 4.47Å; F163-W330 HydrophobicContact CG-CB 4.42Å; F163-W330 AromaticContact CG-CD1 3.65Å; F163-W330 HydrophobicContact CG-CG 4.39Å; F163-W330 HydrophobicContact CZ-CB 4.18Å; Y167-W330 AromaticContact CD2-CD1 3.99Å; Y167-W330 HydrophobicContact CD2-CD2 4.35Å; Y167-W330 HydrophobicContact CD2-CG 4.29Å; Y167-W330 AromaticContact CD2-NE1 3.8Å; Y167-W330 HydrophobicContact CE2-CB 4.35Å; Y167-W330 AromaticContact CE2-CD1 3.82Å; Y167-W330 AromaticContact CE2-CD2 3.58Å; Y167-W330 HydrophobicContact CE2-CD2 3.58Å; Y167-W330 AromaticContact CE2-CE2 3.68Å; Y167-W330 HydrophobicContact CE2-CE3 4.1Å; Y167-W330 AromaticContact CE2-CG 3.67Å; Y167-W330 HydrophobicContact CE2-CG 3.67Å; Y167-W330 HydrophobicContact CE2-CZ2 4.29Å; Y167-W330 AromaticContact CE2-NE1 3.81Å; P326-W330 PolarHBondContact O-N 2.94Å; A328-W330 PolarHBondContact O-N 3.24Å; W330-F332 PolarHBondContact O-N 3.28Å
331G87.8Confident89.8Confident52 Ų5263.9 Ų63.954%0.53636%0.359SS..THydrogen-bonded Turntrans-66.6-22.1-179.100000114.4A328 A329A328-G331 PolarHBondContact O-N 2.91Å; A328-G331 VanDerWaalsContact O-N 3.1Å; A329-G331 PolarHBondContact O-N 2.9Å; A329-G331 VanDerWaalsContact O-N 3.17Å
332F87.5Confident89.3Confident177 Ų17767.4 Ų67.478%0.77638%0.379SS*.THydrogen-bonded Turntrans-126-2.8-171.3-38.5-78.5000113.2A328 A329 W330A328-F332 WeakPolarHBondContact O-CD2 3.31Å; A328-F332 WeakPolarHBondContact O-CE2 3.4Å; A329-F332 CarbonylContact O-C 3.18Å; A329-F332 PolarHBondContact O-N 2.95Å; W330-F332 PolarHBondContact O-N 3.28Å
333W92Very high88.9Confident16 Ų1672.1 Ų72.16%0.06141%0.405CS..  trans-65.8135.6-177.9-155.8-98.2000110.4V161 F163 L174 P256 I257 F260 A329 R335V161-W333 HydrophobicContact CB-CZ2 3.94Å; V161-W333 HydrophobicContact CG1-CD2 4.45Å; V161-W333 HydrophobicContact CG1-CH2 4.32Å; V161-W333 HydrophobicContact CG1-CZ2 3.51Å; V161-W333 PolarHBondContact O-NE1 2.93Å; V161-W333 VanDerWaalsContact O-NE1 3.09Å; F163-W333 HydrophobicContact CD2-CB 3.55Å; F163-W333 AromaticContact CD2-CD1 3.81Å; F163-W333 HydrophobicContact CD2-CD2 4.22Å; F163-W333 AromaticContact CD2-CG 3.57Å; F163-W333 HydrophobicContact CD2-CG 3.57Å; F163-W333 HydrophobicContact CE2-CB 3.92Å; F163-W333 HydrophobicContact CE2-CD2 4.01Å; F163-W333 HydrophobicContact CE2-CE3 4.33Å; F163-W333 AromaticContact CE2-CG 3.82Å; F163-W333 HydrophobicContact CE2-CG 3.82Å; L174-W333 HydrophobicContact CD1-CD2 4.34Å; L174-W333 HydrophobicContact CD1-CE3 3.83Å; L174-W333 HydrophobicContact CD1-CH2 3.77Å; L174-W333 HydrophobicContact CD1-CZ2 4.29Å; L174-W333 HydrophobicContact CD1-CZ3 3.52Å; L174-W333 HydrophobicContact CD2-CH2 3.67Å; L174-W333 HydrophobicContact CD2-CZ2 4.25Å; L174-W333 HydrophobicContact CD2-CZ3 4.17Å; L174-W333 HydrophobicContact CG-CH2 4.35Å; P256-W333 HydrophobicContact CB-CE3 4.34Å; P256-W333 HydrophobicContact CB-CH2 3.85Å; P256-W333 HydrophobicContact CB-CZ2 4.08Å; P256-W333 HydrophobicContact CB-CZ3 4Å; I257-W333 HydrophobicContact CG1-CH2 3.85Å; I257-W333 HydrophobicContact CG1-CZ2 3.78Å; F260-W333 HydrophobicContact CB-CH2 4.32Å; F260-W333 HydrophobicContact CB-CZ3 4.06Å; F260-W333 HydrophobicContact CD2-CZ3 4.13Å; F260-W333 HydrophobicContact CG-CZ3 4.25Å; A329-W333 HydrophobicContact CB-CE3 4.15Å; A329-W333 HydrophobicContact CB-CZ3 4.48Å; A329-W333 WeakPolarHBondContact O-CB 3.37Å; A329-W333 PolarHBondContact O-N 3.25Å; W333-R335 PolarHBondContact O-N 2.89Å
334P87.3Confident88.8Confident39 Ų3970.9 Ų70.925%0.25340%0.401SS..  trans-54.6139.5173.5-27.737.8000111.1A252 P253 P256A252-P334 WeakPolarHBondContact CB-O 3.33Å; P253-P334 HydrophobicContact CG-CB 4.28Å; P256-P334 HydrophobicContact CG-CG 3.64Å
335R81.8Confident88.3Confident178 Ų17867.1 Ų67.167%0.67238%0.383SS*.  trans-104.8135.5176.8-60.4-176-178179.8-0.3108.7W333W333-R335 PolarHBondContact O-N 2.89Å
336G64.4Low87.6Confident83 Ų8371.6 Ų71.686%0.85641%0.41SS*.  trans-87.80173.100000112.3

Retrieved 336 of 336 residues in 124.2 ms (Link to these results)

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