A0A5K4FD01_SCHMA Loading...

MFS domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FD01, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 551 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
1M45.7Very low60.8Low199 Ų199118.1 Ų118.198%0.9859%0.589SS**  0-64.70-93.2171135.200112.3K3 C4 D5M1-K3 VanDerWaalsContact C-N 3.29Å; M1-K3 PolarHBondContact O-N 3.26Å; M1-C4 PolarHBondContact O-N 2.98Å; M1-D5 PolarHBondContact O-N 3.47Å
2L43.3Very low62.7Low145 Ų145112.1 Ų112.176%0.75956%0.561SS**Hα-helixtrans-51.6-31.9-177.4-77.4154.6000117N6L2-N6 PolarHBondContact O-ND2 3.32Å
3K49.7Very low64.6Low177 Ų177113.3 Ų113.377%0.7756%0.56SS**Hα-helixtrans-74-37.5176.8-79.7-174.7177.1-179.20113.4M1 N6 I7M1-K3 VanDerWaalsContact C-N 3.29Å; M1-K3 PolarHBondContact O-N 3.26Å; K3-N6 PolarHBondContact O-N 3.36Å; K3-I7 WeakPolarHBondContact O-CG1 3.46Å; K3-I7 PolarHBondContact O-N 3.04Å
4C48.8Very low66.3Low89 Ų89105.9 Ų105.960%0.60152%0.523SS*.Hα-helixtrans-69.2-39.5179.8-67.60000111.4M1 N6 I7 W8M1-C4 PolarHBondContact O-N 2.98Å; C4-N6 VanDerWaalsContact C-N 3.29Å; C4-N6 PolarHBondContact O-N 3.02Å; C4-I7 PolarHBondContact O-N 3.39Å; C4-W8 PolarHBondContact O-N 3.03Å
5D56.5Low67.9Low98 Ų98100.3 Ų100.352%0.52450%0.496SS..Hα-helixtrans-62.8-38.4178.3-60.4-30.1000111.5M1 N9M1-D5 PolarHBondContact O-N 3.47Å; D5-N9 VanDerWaalsContact O-CB 3.25Å; D5-N9 WeakPolarHBondContact O-CB 3.3Å; D5-N9 PolarHBondContact O-N 3.17Å
6N63.9Low69.4Low112 Ų11298.6 Ų98.660%0.59949%0.493SS*.Hα-helixtrans-66.8-39.8177.2-78.3-15.5000112.9L2 K3 C4 L10L2-N6 PolarHBondContact O-ND2 3.32Å; K3-N6 PolarHBondContact O-N 3.36Å; C4-N6 VanDerWaalsContact C-N 3.29Å; C4-N6 PolarHBondContact O-N 3.02Å; N6-L10 WeakPolarHBondContact O-CB 3.15Å; N6-L10 PolarHBondContact O-N 3.48Å
7I65.2Low70.7Confident74 Ų7494.4 Ų94.438%0.37947%0.472SS..Hα-helixtrans-69.1-44.3178.6-65.9168.3000110.3K3 C4 N9 L10 K11 D176K3-I7 WeakPolarHBondContact O-CG1 3.46Å; K3-I7 PolarHBondContact O-N 3.04Å; C4-I7 PolarHBondContact O-N 3.39Å; I7-N9 PolarHBondContact O-N 2.68Å; I7-L10 PolarHBondContact O-N 3.02Å; I7-K11 WeakPolarHBondContact O-CB 3.35Å; I7-K11 PolarHBondContact O-N 3.28Å; I7-D176 VanDerWaalsContact CD1-OD2 3.3Å; I7-D176 WeakPolarHBondContact CD1-OD2 3.25Å
8W64Low71.9Confident166 Ų16689.1 Ų89.163%0.62945%0.446SS*.Hα-helixtrans-63.1-42.4178.6-16983.4000111.9C4 K11 N12C4-W8 PolarHBondContact O-N 3.03Å; W8-K11 PolarHBondContact O-N 3.46Å; W8-N12 VanDerWaalsContact CD2-ND2 3.32Å; W8-N12 VanDerWaalsContact CE3-ND2 3.29Å; W8-N12 WeakPolarHBondContact CH2-ND2 3.22Å; W8-N12 WeakPolarHBondContact CZ2-ND2 3.32Å; W8-N12 WeakPolarHBondContact CZ3-ND2 3.35Å; W8-N12 WeakPolarHBondContact O-CB 3.07Å; W8-N12 PolarHBondContact O-N 3.43Å
9N74.4Confident73.1Confident105 Ų10585.4 Ų85.456%0.56143%0.431SS*.Hα-helixtrans-65.7-39.3176.2-161.54.2000111.8D5 I7 K13D5-N9 VanDerWaalsContact O-CB 3.25Å; D5-N9 WeakPolarHBondContact O-CB 3.3Å; D5-N9 PolarHBondContact O-N 3.17Å; I7-N9 PolarHBondContact O-N 2.68Å; N9-K13 WeakPolarHBondContact O-CB 3.11Å; N9-K13 PolarHBondContact O-N 2.98Å
10L77.5Confident74.2Confident108 Ų10885.6 Ų85.657%0.56543%0.431SS*.Hα-helixtrans-66-41.8175.5-172.767.3000112.2N6 I7 K13 F14N6-L10 WeakPolarHBondContact O-CB 3.15Å; N6-L10 PolarHBondContact O-N 3.48Å; I7-L10 PolarHBondContact O-N 3.02Å; L10-K13 PolarHBondContact O-N 2.86Å; L10-F14 WeakPolarHBondContact O-CB 3.17Å; L10-F14 PolarHBondContact O-N 3.23Å
11K80.2Confident75.1Confident26 Ų2681.5 Ų81.511%0.11341%0.411CS..Hα-helixtrans-59-53.6175.5-179-177.5-177.6173.20110.6I7 W8 K13 F14 L15 L169 E173I7-K11 WeakPolarHBondContact O-CB 3.35Å; I7-K11 PolarHBondContact O-N 3.28Å; W8-K11 PolarHBondContact O-N 3.46Å; K11-K13 VanDerWaalsContact C-N 3.34Å; K11-K13 PolarHBondContact O-N 2.63Å; K11-F14 PolarHBondContact O-N 3.17Å; K11-L15 HydrophobicContact CG-CD1 3.98Å; K11-L15 VanDerWaalsContact O-CG 3.28Å; K11-L15 WeakPolarHBondContact O-CG 3.07Å; K11-L15 PolarHBondContact O-N 3.27Å; K11-L169 HydrophobicContact CB-CD1 4.35Å; K11-L169 HydrophobicContact CG-CD1 4.11Å; K11-L169 HydrophobicContact CG-CD2 3.67Å; K11-L169 HydrophobicContact CG-CG 3.91Å; K11-E173 IonicContact NZ-OE2 2.74Å; K11-E173 PolarHBondContact NZ-OE2 3.18Å
12N83.8Confident77.5Confident46 Ų4672.1 Ų72.125%0.24636%0.364CS..Hα-helixtrans-62.5-42.4179.6-72.7-11.7000111.7W8 F14 L15 T16W8-N12 VanDerWaalsContact CD2-ND2 3.32Å; W8-N12 VanDerWaalsContact CE3-ND2 3.29Å; W8-N12 WeakPolarHBondContact CH2-ND2 3.22Å; W8-N12 WeakPolarHBondContact CZ2-ND2 3.32Å; W8-N12 WeakPolarHBondContact CZ3-ND2 3.35Å; W8-N12 WeakPolarHBondContact O-CB 3.07Å; W8-N12 PolarHBondContact O-N 3.43Å; N12-F14 PolarHBondContact O-N 2.85Å; N12-L15 PolarHBondContact O-N 2.91Å; N12-T16 WeakPolarHBondContact O-CB 3.49Å; N12-T16 PolarHBondContact O-N 3.26Å; N12-T16 PolarHBondContact O-OG1 3Å
13K87Confident80Confident128 Ų12868.4 Ų68.456%0.55734%0.344SS*.Hα-helixtrans-58.9-45.3175.1-176176.7178.9178.90112.1N9 L10 K11 L17N9-K13 WeakPolarHBondContact O-CB 3.11Å; N9-K13 PolarHBondContact O-N 2.98Å; L10-K13 PolarHBondContact O-N 2.86Å; K11-K13 VanDerWaalsContact C-N 3.34Å; K11-K13 PolarHBondContact O-N 2.63Å; K13-L17 HydrophobicContact CG-CD1 3.97Å; K13-L17 WeakPolarHBondContact O-CB 3.29Å; K13-L17 VanDerWaalsContact O-CG 3.29Å; K13-L17 WeakPolarHBondContact O-CG 3.41Å; K13-L17 PolarHBondContact O-N 2.75Å
14F88.3Confident82.2Confident10 Ų1060.5 Ų60.54%0.04431%0.311CS..Hα-helixtrans-61.6-48.4176.4179.2-89.5000111.3L10 K11 N12 T16 L17 L18 L169 L243 P244L10-F14 WeakPolarHBondContact O-CB 3.17Å; L10-F14 PolarHBondContact O-N 3.23Å; K11-F14 PolarHBondContact O-N 3.17Å; N12-F14 PolarHBondContact O-N 2.85Å; F14-T16 PolarHBondContact O-N 2.95Å; F14-L17 PolarHBondContact O-N 3.06Å; F14-L18 HydrophobicContact CE1-CD2 3.89Å; F14-L18 HydrophobicContact CZ-CD2 4.41Å; F14-L18 VanDerWaalsContact O-CB 3.3Å; F14-L18 WeakPolarHBondContact O-CB 3.46Å; F14-L18 PolarHBondContact O-N 3.37Å; F14-L169 HydrophobicContact CD1-CD2 4.15Å; F14-L243 HydrophobicContact CD2-CD1 4.14Å; F14-L243 HydrophobicContact CE2-CD1 3.87Å; F14-L243 HydrophobicContact CE2-CG 4.08Å; F14-L243 HydrophobicContact CZ-CD1 4.36Å; F14-P244 HydrophobicContact CD2-CB 4.47Å; F14-P244 HydrophobicContact CD2-CG 3.93Å; F14-P244 WeakPolarHBondContact CE2-O 3.39Å
15L90.8Very high84.4Confident22 Ų2256.3 Ų56.312%0.11528%0.283CS..Hα-helixtrans-62.3-41.9-179.7-66.7170.5000112.1K11 N12 L18 A19 L166 L169 L194 F198K11-L15 HydrophobicContact CG-CD1 3.98Å; K11-L15 VanDerWaalsContact O-CG 3.28Å; K11-L15 WeakPolarHBondContact O-CG 3.07Å; K11-L15 PolarHBondContact O-N 3.27Å; N12-L15 PolarHBondContact O-N 2.91Å; L15-L18 PolarHBondContact O-N 3.14Å; L15-A19 WeakPolarHBondContact O-CB 3.28Å; L15-A19 PolarHBondContact O-N 2.98Å; L15-L166 HydrophobicContact CD2-CD2 3.56Å; L15-L169 HydrophobicContact CD1-CD2 4.07Å; L15-L169 HydrophobicContact CD2-CD2 3.55Å; L15-L169 HydrophobicContact CG-CD2 3.71Å; L15-L194 HydrophobicContact CD1-CD2 3.84Å; L15-L194 HydrophobicContact CD2-CD2 4.01Å; L15-F198 HydrophobicContact CB-CZ 4.39Å; L15-F198 HydrophobicContact CD2-CE2 3.62Å; L15-F198 HydrophobicContact CD2-CZ 3.89Å
16T90.8Very high86.3Confident73 Ų7351.9 Ų51.945%0.44826%0.259SS..Hα-helixtrans-65-44.9176.8-60.60000111.8N12 F14 L18 A19 M20N12-T16 WeakPolarHBondContact O-CB 3.49Å; N12-T16 PolarHBondContact O-N 3.26Å; N12-T16 PolarHBondContact O-OG1 3Å; F14-T16 PolarHBondContact O-N 2.95Å; T16-L18 VanDerWaalsContact C-N 3.35Å; T16-A19 PolarHBondContact O-N 3.37Å; T16-M20 HydrophobicContact CG2-CE 3.57Å; T16-M20 HydrophobicContact CG2-SD 4.24Å; T16-M20 WeakPolarHBondContact O-CG 3.42Å; T16-M20 PolarHBondContact O-N 3.49Å
17L92.2Very high87.8Confident26 Ų2647.5 Ų47.514%0.13624%0.235CC..Hα-helixtrans-64.5-40.4176.8-73.9168.5000111.8K13 F14 M20 L21 F239 F242 L243K13-L17 HydrophobicContact CG-CD1 3.97Å; K13-L17 WeakPolarHBondContact O-CB 3.29Å; K13-L17 VanDerWaalsContact O-CG 3.29Å; K13-L17 WeakPolarHBondContact O-CG 3.41Å; K13-L17 PolarHBondContact O-N 2.75Å; F14-L17 PolarHBondContact O-N 3.06Å; L17-M20 PolarHBondContact O-N 2.71Å; L17-L21 WeakPolarHBondContact O-CB 3Å; L17-L21 PolarHBondContact O-N 3.39Å; L17-F239 HydrophobicContact CD2-CD1 4.43Å; L17-F242 HydrophobicContact CD2-CB 4.22Å; L17-L243 HydrophobicContact CB-CD1 4.18Å
18L93.1Very high89.2Confident0 Ų044 Ų440%022%0.217CC..Hα-helixtrans-63.5-41.8175.5-172.163.4000111.1F14 L15 T16 L21 L22 L114 V162 F198 L243F14-L18 HydrophobicContact CE1-CD2 3.89Å; F14-L18 HydrophobicContact CZ-CD2 4.41Å; F14-L18 VanDerWaalsContact O-CB 3.3Å; F14-L18 WeakPolarHBondContact O-CB 3.46Å; F14-L18 PolarHBondContact O-N 3.37Å; L15-L18 PolarHBondContact O-N 3.14Å; T16-L18 VanDerWaalsContact C-N 3.35Å; L18-L21 HydrophobicContact CD1-CD2 4.33Å; L18-L21 WeakPolarHBondContact O-CB 3.15Å; L18-L21 PolarHBondContact O-N 3.01Å; L18-L22 HydrophobicContact CD1-CD1 4.07Å; L18-L22 HydrophobicContact CD1-CG 4.23Å; L18-L22 HydrophobicContact CG-CD1 3.82Å; L18-L22 HydrophobicContact CG-CG 4.34Å; L18-L22 WeakPolarHBondContact O-CB 3.45Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 2.92Å; L18-L114 HydrophobicContact CD1-CD1 4.42Å; L18-V162 HydrophobicContact CD1-CG2 4.49Å; L18-V162 HydrophobicContact CD2-CG1 4.26Å; L18-F198 HydrophobicContact CB-CE1 4.12Å; L18-F198 HydrophobicContact CB-CZ 4.33Å; L18-F198 HydrophobicContact CD2-CD1 4.33Å; L18-F198 HydrophobicContact CD2-CE1 3.64Å; L18-F198 HydrophobicContact CD2-CZ 4Å; L18-F198 HydrophobicContact CG-CE1 3.73Å; L18-F198 HydrophobicContact CG-CZ 4.32Å; L18-L243 HydrophobicContact CB-CD1 4.19Å; L18-L243 HydrophobicContact CD1-CD1 4.33Å; L18-L243 HydrophobicContact CD1-CD2 4.29Å
19A94.1Very high90.6Very high19 Ų1936 Ų3616%0.15719%0.187CC..Hα-helixtrans-63.3-45.6174.300000112.2L15 T16 L21 L22 I23 L201L15-A19 WeakPolarHBondContact O-CB 3.28Å; L15-A19 PolarHBondContact O-N 2.98Å; T16-A19 PolarHBondContact O-N 3.37Å; A19-L21 PolarHBondContact O-N 3.16Å; A19-L22 PolarHBondContact O-N 3.01Å; A19-I23 VanDerWaalsContact O-CG1 3.26Å; A19-I23 WeakPolarHBondContact O-CG1 3.44Å; A19-I23 PolarHBondContact O-N 2.98Å; A19-L201 HydrophobicContact CB-CD1 3.77Å
20M94.1Very high91.4Very high88 Ų8832 Ų3243%0.43317%0.165SC..Hα-helixtrans-61.9-31.4177-73177.5-178.200113T16 L17 P24 F239T16-M20 HydrophobicContact CG2-CE 3.57Å; T16-M20 HydrophobicContact CG2-SD 4.24Å; T16-M20 WeakPolarHBondContact O-CG 3.42Å; T16-M20 PolarHBondContact O-N 3.49Å; L17-M20 PolarHBondContact O-N 2.71Å; M20-P24 WeakPolarHBondContact O-CD 3.43Å; M20-P24 WeakPolarHBondContact O-CG 3.34Å; M20-F239 HydrophobicContact CB-CD1 4.15Å; M20-F239 HydrophobicContact CB-CE1 3.95Å; M20-F239 HydrophobicContact CB-CE2 4.34Å; M20-F239 HydrophobicContact CB-CG 4.45Å; M20-F239 HydrophobicContact CB-CZ 4.06Å; M20-F239 HydrophobicContact SD-CE1 3.92Å; M20-F239 HydrophobicContact SD-CZ 4.18Å
21L94.6Very high92.2Very high1 Ų126.8 Ų26.81%0.00514%0.138CC..Hα-helixtrans-70.9-48.4172.5178.772000111.8L17 L18 A19 L25 I118 S236 F239 I240 L243L17-L21 WeakPolarHBondContact O-CB 3Å; L17-L21 PolarHBondContact O-N 3.39Å; L18-L21 HydrophobicContact CD1-CD2 4.33Å; L18-L21 WeakPolarHBondContact O-CB 3.15Å; L18-L21 PolarHBondContact O-N 3.01Å; A19-L21 PolarHBondContact O-N 3.16Å; L21-L25 WeakPolarHBondContact O-CB 3.42Å; L21-L25 PolarHBondContact O-N 3.43Å; L21-I118 HydrophobicContact CD1-CD1 3.9Å; L21-I118 HydrophobicContact CD2-CD1 4.05Å; L21-I118 HydrophobicContact CG-CD1 4.23Å; L21-S236 WeakPolarHBondContact CD1-O 3.25Å; L21-S236 PolarHBondContact O-OG 3.23Å; L21-F239 HydrophobicContact CB-CB 4.09Å; L21-F239 HydrophobicContact CD1-CB 3.68Å; L21-I240 HydrophobicContact CD1-CB 4.19Å; L21-I240 HydrophobicContact CD2-CD1 4.07Å; L21-L243 HydrophobicContact CD2-CD2 4.25Å
22L95Very high92.8Very high1 Ų125.6 Ų25.61%0.00513%0.133CC..Hα-helixtrans-78.1-35.4-168.5-70176.3000113.8L18 A19 L25 Y26 I158 V162 F198 L201L18-L22 HydrophobicContact CD1-CD1 4.07Å; L18-L22 HydrophobicContact CD1-CG 4.23Å; L18-L22 HydrophobicContact CG-CD1 3.82Å; L18-L22 HydrophobicContact CG-CG 4.34Å; L18-L22 WeakPolarHBondContact O-CB 3.45Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 2.92Å; A19-L22 PolarHBondContact O-N 3.01Å; L22-L25 HydrophobicContact CD2-CD2 4.18Å; L22-L25 PolarHBondContact O-N 3.44Å; L22-Y26 HydrophobicContact CB-CD2 4.07Å; L22-Y26 HydrophobicContact CB-CE2 3.76Å; L22-Y26 HydrophobicContact CD1-CE2 4.22Å; L22-Y26 HydrophobicContact CD2-CE1 4.3Å; L22-Y26 HydrophobicContact CD2-CE2 4.2Å; L22-Y26 HydrophobicContact CG-CE2 4.28Å; L22-Y26 WeakPolarHBondContact O-CB 3.5Å; L22-Y26 VanDerWaalsContact O-CD2 3.27Å; L22-Y26 WeakPolarHBondContact O-CD2 2.96Å; L22-Y26 VanDerWaalsContact O-CG 3.3Å; L22-Y26 PolarHBondContact O-N 3.45Å; L22-I158 HydrophobicContact CD2-CG2 4Å; L22-V162 HydrophobicContact CD1-CB 4.43Å; L22-V162 HydrophobicContact CD1-CG1 3.92Å; L22-V162 HydrophobicContact CD1-CG2 3.59Å; L22-V162 HydrophobicContact CD2-CG2 3.76Å; L22-V162 HydrophobicContact CG-CG2 4.27Å; L22-F198 HydrophobicContact CD1-CD1 3.84Å; L22-F198 HydrophobicContact CD1-CE1 3.99Å; L22-L201 HydrophobicContact CB-CD2 4.33Å
23I95.7Very high93.1Very high67 Ų6724.4 Ų24.434%0.34413%0.125SC..Hα-helixtrans-55.9-59.6179.7-67.7166.3000111.4A19 L25 Y26 I27 L201A19-I23 VanDerWaalsContact O-CG1 3.26Å; A19-I23 WeakPolarHBondContact O-CG1 3.44Å; A19-I23 PolarHBondContact O-N 2.98Å; I23-L25 VanDerWaalsContact C-N 3.29Å; I23-L25 PolarHBondContact O-N 2.85Å; I23-Y26 PolarHBondContact O-N 3.29Å; I23-I27 HydrophobicContact CG2-CD1 3.88Å; I23-I27 VanDerWaalsContact O-CG1 3.3Å; I23-I27 WeakPolarHBondContact O-CG1 2.96Å; I23-I27 PolarHBondContact O-N 2.74Å; I23-I27 VanDerWaalsContact O-N 3.12Å; I23-L201 HydrophobicContact CD1-CD1 4.01Å; I23-L201 HydrophobicContact CD1-CG 4.41Å; I23-L201 HydrophobicContact CG1-CD1 3.91Å; I23-L201 HydrophobicContact CG1-CD2 3.73Å; I23-L201 HydrophobicContact CG1-CG 3.88Å
24P95.9Very high93.1Very high12 Ų1218.9 Ų18.98%0.07810%0.101CC..Hα-helixtrans-64.6-34.4179.624.6-32.8000112.1M20 A28 L232 I235M20-P24 WeakPolarHBondContact O-CD 3.43Å; M20-P24 WeakPolarHBondContact O-CG 3.34Å; P24-A28 VanDerWaalsContact O-CB 3.31Å; P24-A28 WeakPolarHBondContact O-CB 3.15Å; P24-A28 PolarHBondContact O-N 3.44Å; P24-L232 HydrophobicContact CB-CB 4.31Å; P24-L232 HydrophobicContact CB-CD2 3.9Å; P24-I235 HydrophobicContact CB-CB 4.39Å; P24-I235 HydrophobicContact CB-CG2 4.26Å; P24-I235 HydrophobicContact CG-CB 4.48Å; P24-I235 HydrophobicContact CG-CG2 3.91Å
25L95.7Very high93.2Very high1 Ų118.5 Ų18.51%0.00510%0.1CC..Hα-helixtrans-60.3-54.4176.918062.1000111.4L21 L22 I23 I27 A28 L29 I118 I158 I233 S236L21-L25 WeakPolarHBondContact O-CB 3.42Å; L21-L25 PolarHBondContact O-N 3.43Å; L22-L25 HydrophobicContact CD2-CD2 4.18Å; L22-L25 PolarHBondContact O-N 3.44Å; I23-L25 VanDerWaalsContact C-N 3.29Å; I23-L25 PolarHBondContact O-N 2.85Å; L25-I27 VanDerWaalsContact C-N 3.32Å; L25-I27 PolarHBondContact O-N 3.13Å; L25-A28 PolarHBondContact O-N 3.47Å; L25-L29 HydrophobicContact CD1-CD1 4.09Å; L25-L29 HydrophobicContact CD1-CG 4.21Å; L25-L29 HydrophobicContact CG-CD1 4.02Å; L25-L29 HydrophobicContact CG-CG 4.48Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.4Å; L25-L29 PolarHBondContact O-N 2.93Å; L25-I118 HydrophobicContact CD1-CG1 4.42Å; L25-I118 HydrophobicContact CD1-CG2 4.47Å; L25-I118 HydrophobicContact CD2-CD1 4.36Å; L25-I118 HydrophobicContact CD2-CG1 3.92Å; L25-I158 HydrophobicContact CD2-CD1 4.1Å; L25-I158 HydrophobicContact CD2-CG2 4.19Å; L25-I233 HydrophobicContact CD1-CD1 3.52Å; L25-S236 VanDerWaalsContact CA-OG 3.32Å; L25-S236 WeakPolarHBondContact CA-OG 3.42Å; L25-S236 WeakPolarHBondContact CB-OG 3.32Å; L25-S236 PolarHBondContact N-OG 2.85Å
26Y95.2Very high93.3Very high4 Ų417.9 Ų17.92%0.01610%0.097CC..Hα-helixtrans-63.6-38.2-178.8-67.7-32000112.2L22 I23 L29 E30 L155 I158 L201 A202L22-Y26 HydrophobicContact CB-CD2 4.07Å; L22-Y26 HydrophobicContact CB-CE2 3.76Å; L22-Y26 HydrophobicContact CD1-CE2 4.22Å; L22-Y26 HydrophobicContact CD2-CE1 4.3Å; L22-Y26 HydrophobicContact CD2-CE2 4.2Å; L22-Y26 HydrophobicContact CG-CE2 4.28Å; L22-Y26 WeakPolarHBondContact O-CB 3.5Å; L22-Y26 VanDerWaalsContact O-CD2 3.27Å; L22-Y26 WeakPolarHBondContact O-CD2 2.96Å; L22-Y26 VanDerWaalsContact O-CG 3.3Å; L22-Y26 PolarHBondContact O-N 3.45Å; I23-Y26 PolarHBondContact O-N 3.29Å; Y26-L29 PolarHBondContact O-N 3.17Å; Y26-E30 PolarHBondContact O-N 3.12Å; Y26-E30 VanDerWaalsContact O-N 3.15Å; Y26-L155 HydrophobicContact CD1-CD1 3.38Å; Y26-L155 HydrophobicContact CE1-CD1 3.45Å; Y26-L155 VanDerWaalsContact CE1-CD1 3.45Å; Y26-I158 HydrophobicContact CE1-CG2 4.02Å; Y26-L201 HydrophobicContact CD2-CD2 4.4Å; Y26-L201 HydrophobicContact CE2-CD2 4.46Å; Y26-A202 HydrophobicContact CD2-CB 3.79Å; Y26-A202 HydrophobicContact CE2-CB 3.4Å; Y26-A202 VanDerWaalsContact CE2-CB 3.4Å
27I95.5Very high93Very high20 Ų2015.8 Ų15.810%0.1038%0.083CC..Hα-helixtrans-62.7-46.5174.4-62.6164.8000110.4I23 L25 L29 L31 S205 L208 S209 L232I23-I27 HydrophobicContact CG2-CD1 3.88Å; I23-I27 VanDerWaalsContact O-CG1 3.3Å; I23-I27 WeakPolarHBondContact O-CG1 2.96Å; I23-I27 PolarHBondContact O-N 2.74Å; I23-I27 VanDerWaalsContact O-N 3.12Å; L25-I27 VanDerWaalsContact C-N 3.32Å; L25-I27 PolarHBondContact O-N 3.13Å; I27-L29 PolarHBondContact O-N 3.29Å; I27-L31 WeakPolarHBondContact O-CB 3.34Å; I27-L31 PolarHBondContact O-N 3.36Å; I27-S205 VanDerWaalsContact CG1-O 3.27Å; I27-S205 WeakPolarHBondContact CG1-O 3.41Å; I27-L208 HydrophobicContact CD1-CD2 4.33Å; I27-S209 VanDerWaalsContact CA-OG 3.3Å; I27-S209 WeakPolarHBondContact CA-OG 3.31Å; I27-S209 PolarHBondContact O-OG 2.99Å; I27-S209 VanDerWaalsContact O-OG 3.06Å; I27-L232 HydrophobicContact CB-CD1 4.01Å; I27-L232 HydrophobicContact CG2-CD1 3.49Å; I27-L232 VanDerWaalsContact CG2-CD1 3.49Å
28A95.5Very high92.8Very high0 Ų015.7 Ų15.70%08%0.082CC..Hα-helixtrans-61.3-43.9179.700000112.2P24 L25 C32 I125 C229 L232 I233P24-A28 VanDerWaalsContact O-CB 3.31Å; P24-A28 WeakPolarHBondContact O-CB 3.15Å; P24-A28 PolarHBondContact O-N 3.44Å; L25-A28 PolarHBondContact O-N 3.47Å; A28-C32 WeakPolarHBondContact O-CB 3.28Å; A28-C32 PolarHBondContact O-N 3.37Å; A28-I125 HydrophobicContact CB-CD1 3.97Å; A28-C229 PolarHBondContact O-SG 3.18Å; A28-L232 HydrophobicContact CB-CB 3.78Å; A28-I233 HydrophobicContact CB-CB 4.29Å
29L93.6Very high92.6Very high0 Ų016 Ų160%08%0.083CC..Hα-helixtrans-63.1-51.3-178.5-71178.6000112.6L25 Y26 I27 C32 F33 E121 I125 L155 I158L25-L29 HydrophobicContact CD1-CD1 4.09Å; L25-L29 HydrophobicContact CD1-CG 4.21Å; L25-L29 HydrophobicContact CG-CD1 4.02Å; L25-L29 HydrophobicContact CG-CG 4.48Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.4Å; L25-L29 PolarHBondContact O-N 2.93Å; Y26-L29 PolarHBondContact O-N 3.17Å; I27-L29 PolarHBondContact O-N 3.29Å; L29-C32 VanDerWaalsContact O-CB 3.32Å; L29-C32 WeakPolarHBondContact O-CB 3.32Å; L29-C32 PolarHBondContact O-N 3.08Å; L29-F33 WeakPolarHBondContact O-CD2 3.25Å; L29-F33 WeakPolarHBondContact O-CG 3.04Å; L29-F33 PolarHBondContact O-N 3.36Å; L29-E121 HydrophobicContact CD1-CG 4.4Å; L29-E121 HydrophobicContact CD2-CB 3.77Å; L29-E121 VanDerWaalsContact CD2-CD 3.41Å; L29-E121 HydrophobicContact CD2-CG 3.8Å; L29-E121 WeakPolarHBondContact CD2-OE2 3.13Å; L29-I125 HydrophobicContact CD2-CD1 4.34Å; L29-L155 HydrophobicContact CD1-CD1 3.9Å; L29-I158 HydrophobicContact CD1-CD1 3.96Å
30E91.6Very high92.4Very high19 Ų1915.2 Ų15.29%0.0898%0.077CC..Hα-helixtrans-69.4-37.8-179.2-17169.3-176.400111.1Y26 C32 F33 F34 L206Y26-E30 PolarHBondContact O-N 3.12Å; Y26-E30 VanDerWaalsContact O-N 3.15Å; E30-C32 VanDerWaalsContact C-N 3.29Å; E30-C32 PolarHBondContact O-N 3.3Å; E30-F33 PolarHBondContact O-N 2.99Å; E30-F34 WeakPolarHBondContact O-CB 3.26Å; E30-F34 PolarHBondContact O-N 3.36Å; E30-L206 HydrophobicContact CB-CB 4.39Å; E30-L206 HydrophobicContact CB-CD2 3.81Å; E30-L206 HydrophobicContact CG-CB 4.45Å; E30-L206 WeakPolarHBondContact CG-O 3.35Å
31L93Very high92Very high0 Ų013 Ų130%07%0.065CC..Hα-helixtrans-61.3-39.4173.5-175.860.3000111.4I27 F34 I35 G213 I228 C229I27-L31 WeakPolarHBondContact O-CB 3.34Å; I27-L31 PolarHBondContact O-N 3.36Å; L31-F34 PolarHBondContact O-N 3.21Å; L31-I35 HydrophobicContact CD1-CD1 4.23Å; L31-I35 HydrophobicContact CD1-CG1 4.41Å; L31-I35 HydrophobicContact CG-CD1 3.88Å; L31-I35 WeakPolarHBondContact O-CB 3.48Å; L31-I35 WeakPolarHBondContact O-CD1 3.34Å; L31-I35 WeakPolarHBondContact O-CG1 3.26Å; L31-I35 PolarHBondContact O-N 3.39Å; L31-G213 VanDerWaalsContact CD1-CA 3.44Å; L31-I228 HydrophobicContact CD2-CB 4.44Å; L31-I228 HydrophobicContact CD2-CG2 4.05Å; L31-C229 HydrophobicContact CD2-CB 4.11Å; L31-C229 HydrophobicContact CG-CB 4.49Å
32C93.4Very high91.6Very high1 Ų114 Ų141%0.0077%0.068CC..Hα-helixtrans-61.1-46.9174.3-179.10000111.8A28 L29 E30 I35 S36 I125 L128A28-C32 WeakPolarHBondContact O-CB 3.28Å; A28-C32 PolarHBondContact O-N 3.37Å; L29-C32 VanDerWaalsContact O-CB 3.32Å; L29-C32 WeakPolarHBondContact O-CB 3.32Å; L29-C32 PolarHBondContact O-N 3.08Å; E30-C32 VanDerWaalsContact C-N 3.29Å; E30-C32 PolarHBondContact O-N 3.3Å; C32-I35 PolarHBondContact O-N 3.07Å; C32-S36 WeakPolarHBondContact O-CB 3.41Å; C32-S36 PolarHBondContact O-N 3.48Å; C32-I125 HydrophobicContact CB-CG1 3.91Å; C32-L128 WeakPolarHBondContact O-CD2 3.34Å; C32-L128 WeakPolarHBondContact SG-CD2 3.24Å
33F89.4Confident91.3Very high21 Ų2116.6 Ų16.69%0.0928%0.078CC..Hα-helixtrans-62.1-45.4175.7-65-40.6000111.8L29 E30 I35 S36 D37L29-F33 WeakPolarHBondContact O-CD2 3.25Å; L29-F33 WeakPolarHBondContact O-CG 3.04Å; L29-F33 PolarHBondContact O-N 3.36Å; E30-F33 PolarHBondContact O-N 2.99Å; F33-I35 PolarHBondContact O-N 3.24Å; F33-S36 WeakPolarHBondContact O-CB 3.46Å; F33-S36 PolarHBondContact O-N 3.46Å; F33-D37 PolarHBondContact O-N 2.65Å
34F88.5Confident90.9Very high12 Ų1213.4 Ų13.45%0.0536%0.062CC..Hα-helixtrans-58.7-47.9176.7-169.5-95.7000111.7E30 L31 S36 D37 Q38 N210 G213 G214 L217E30-F34 WeakPolarHBondContact O-CB 3.26Å; E30-F34 PolarHBondContact O-N 3.36Å; L31-F34 PolarHBondContact O-N 3.21Å; F34-S36 VanDerWaalsContact C-N 3.34Å; F34-S36 PolarHBondContact O-N 3.43Å; F34-D37 PolarHBondContact O-N 3.29Å; F34-Q38 HydrophobicContact CD1-CG 4.09Å; F34-Q38 HydrophobicContact CE1-CG 3.82Å; F34-Q38 HydrophobicContact CZ-CG 4.1Å; F34-Q38 WeakPolarHBondContact O-CB 3.25Å; F34-Q38 VanDerWaalsContact O-CG 3.22Å; F34-Q38 WeakPolarHBondContact O-CG 3.4Å; F34-Q38 PolarHBondContact O-N 3.35Å; F34-N210 WeakPolarHBondContact CD2-OD1 3.16Å; F34-G213 VanDerWaalsContact CE1-C 3.45Å; F34-G214 VanDerWaalsContact CE1-N 3.34Å; F34-L217 HydrophobicContact CD1-CD1 3.6Å; F34-L217 HydrophobicContact CE1-CD1 3.47Å; F34-L217 VanDerWaalsContact CE1-CD1 3.47Å
35I90.5Very high90.4Very high2 Ų212.9 Ų12.91%0.016%0.058CC..Hα-helixtrans-59.5-44.9176.2-71.2163000111.1L31 C32 F33 Y39 L128 V132 F222 P225 I226L31-I35 HydrophobicContact CD1-CD1 4.23Å; L31-I35 HydrophobicContact CD1-CG1 4.41Å; L31-I35 HydrophobicContact CG-CD1 3.88Å; L31-I35 WeakPolarHBondContact O-CB 3.48Å; L31-I35 WeakPolarHBondContact O-CD1 3.34Å; L31-I35 WeakPolarHBondContact O-CG1 3.26Å; L31-I35 PolarHBondContact O-N 3.39Å; C32-I35 PolarHBondContact O-N 3.07Å; F33-I35 PolarHBondContact O-N 3.24Å; I35-Y39 WeakPolarHBondContact O-CB 3.34Å; I35-Y39 PolarHBondContact O-N 3.12Å; I35-L128 HydrophobicContact CG2-CD2 4.47Å; I35-V132 HydrophobicContact CG2-CG2 4.38Å; I35-F222 HydrophobicContact CG2-CD1 4.15Å; I35-P225 HydrophobicContact CD1-CB 3.5Å; I35-P225 VanDerWaalsContact CD1-CB 3.5Å; I35-P225 HydrophobicContact CG1-CB 3.85Å; I35-I226 HydrophobicContact CD1-CG1 4.17Å; I35-I226 HydrophobicContact CG2-CD1 4.48Å; I35-I226 HydrophobicContact CG2-CG1 4.16Å
36S91Very high89.9Confident8 Ų815.7 Ų15.76%0.0567%0.073CC..Hα-helixtrans-60.4-49.9179.5-179.10000111.5C32 F33 F34 Y39 V40C32-S36 WeakPolarHBondContact O-CB 3.41Å; C32-S36 PolarHBondContact O-N 3.48Å; F33-S36 WeakPolarHBondContact O-CB 3.46Å; F33-S36 PolarHBondContact O-N 3.46Å; F34-S36 VanDerWaalsContact C-N 3.34Å; F34-S36 PolarHBondContact O-N 3.43Å; S36-Y39 PolarHBondContact O-N 3.17Å; S36-V40 WeakPolarHBondContact O-CG2 3.31Å; S36-V40 PolarHBondContact O-N 3.44Å
37D86.2Confident89.5Confident30 Ų3018.7 Ų18.716%0.169%0.089CC..Hα-helixtrans-64.3-43.2-177.9-73.2-15.5000111F33 F34 F41 H87F33-D37 PolarHBondContact O-N 2.65Å; F34-D37 PolarHBondContact O-N 3.29Å; D37-F41 WeakPolarHBondContact O-CB 3.33Å; D37-F41 PolarHBondContact O-N 3.07Å; D37-F41 VanDerWaalsContact O-N 3.12Å; D37-H87 IonicContact OD1-CE1 3.98Å; D37-H87 IonicContact OD1-NE2 3.66Å; D37-H87 PolarHBondContact OD1-NE2 2.67Å; D37-H87 IonicContact OD2-CE1 2.71Å; D37-H87 IonicContact OD2-NE2 2.74Å
38Q86.6Confident89Confident23 Ų2320.3 Ų20.311%0.10710%0.096CC..Hα-helixtrans-63.4-46.6174.4-65.8-59.3-44.500110.8F34 V40 F41 Y42 L217 F222F34-Q38 HydrophobicContact CD1-CG 4.09Å; F34-Q38 HydrophobicContact CE1-CG 3.82Å; F34-Q38 HydrophobicContact CZ-CG 4.1Å; F34-Q38 WeakPolarHBondContact O-CB 3.25Å; F34-Q38 VanDerWaalsContact O-CG 3.22Å; F34-Q38 WeakPolarHBondContact O-CG 3.4Å; F34-Q38 PolarHBondContact O-N 3.35Å; Q38-V40 PolarHBondContact O-N 3.18Å; Q38-F41 WeakPolarHBondContact O-CB 3.46Å; Q38-F41 PolarHBondContact O-N 2.81Å; Q38-F41 VanDerWaalsContact O-N 3.12Å; Q38-Y42 HydrophobicContact CB-CD2 4.22Å; Q38-Y42 HydrophobicContact CB-CE2 4.26Å; Q38-Y42 WeakPolarHBondContact O-CD2 3.12Å; Q38-Y42 PolarHBondContact O-N 3.38Å; Q38-L217 HydrophobicContact CB-CD1 4.04Å; Q38-L217 HydrophobicContact CG-CD1 3.91Å; Q38-F222 HydrophobicContact CB-CE1 4.18Å; Q38-F222 HydrophobicContact CB-CZ 4.44Å
39Y90Very high88.3Confident6 Ų623.1 Ų23.12%0.02413%0.125CC..Hα-helixtrans-57.5-46.8-179.4-179.9-101.9000112.7I35 S36 F41 Y42 R43 I131 V132 Q135 A136 T141 F222I35-Y39 WeakPolarHBondContact O-CB 3.34Å; I35-Y39 PolarHBondContact O-N 3.12Å; S36-Y39 PolarHBondContact O-N 3.17Å; Y39-F41 VanDerWaalsContact C-N 3.31Å; Y39-F41 PolarHBondContact O-N 2.88Å; Y39-Y42 PolarHBondContact O-N 2.84Å; Y39-R43 HydrophobicContact CD1-CG 4.22Å; Y39-R43 HydrophobicContact CD2-CG 4.18Å; Y39-R43 HydrophobicContact CE1-CG 3.73Å; Y39-R43 HydrophobicContact CE2-CG 3.7Å; Y39-R43 HydrophobicContact CG-CG 4.43Å; Y39-R43 VanDerWaalsContact CZ-CG 3.43Å; Y39-R43 WeakPolarHBondContact O-CB 3.37Å; Y39-R43 WeakPolarHBondContact O-CG 3.44Å; Y39-R43 PolarHBondContact O-N 3.37Å; Y39-I131 HydrophobicContact CE1-CG2 4.16Å; Y39-V132 HydrophobicContact CD1-CG2 4.03Å; Y39-V132 HydrophobicContact CD2-CB 4.12Å; Y39-V132 HydrophobicContact CD2-CG1 3.58Å; Y39-V132 HydrophobicContact CD2-CG2 3.82Å; Y39-V132 HydrophobicContact CE1-CG2 4.42Å; Y39-V132 HydrophobicContact CE2-CB 4.21Å; Y39-V132 HydrophobicContact CE2-CG1 3.84Å; Y39-V132 HydrophobicContact CE2-CG2 4.22Å; Y39-V132 HydrophobicContact CG-CB 4.5Å; Y39-V132 HydrophobicContact CG-CG1 4.28Å; Y39-V132 HydrophobicContact CG-CG2 3.7Å; Y39-Q135 VanDerWaalsContact OH-CA 3.26Å; Y39-Q135 WeakPolarHBondContact OH-CA 3.4Å; Y39-A136 PolarHBondContact OH-N 3.08Å; Y39-A136 PolarHBondContact OH-O 2.93Å; Y39-T141 HydrophobicContact CD1-CG2 3.94Å; Y39-T141 HydrophobicContact CE1-CG2 4.31Å; Y39-F222 HydrophobicContact CD2-CD1 4.36Å; Y39-F222 HydrophobicContact CD2-CE1 4.18Å; Y39-F222 HydrophobicContact CD2-CZ 4.25Å
40V89.8Confident87.6Confident4 Ų423.5 Ų23.52%0.02413%0.127CC..Hα-helixtrans-59-46.7176.4171.60000110.2S36 Q38 R43 C44 A79 I82 P138 T141S36-V40 WeakPolarHBondContact O-CG2 3.31Å; S36-V40 PolarHBondContact O-N 3.44Å; Q38-V40 PolarHBondContact O-N 3.18Å; V40-R43 PolarHBondContact O-N 2.68Å; V40-C44 WeakPolarHBondContact O-CB 3.42Å; V40-C44 PolarHBondContact O-N 3.44Å; V40-C44 PolarHBondContact O-SG 3.45Å; V40-A79 HydrophobicContact CG1-CB 4.09Å; V40-I82 HydrophobicContact CG1-CB 3.89Å; V40-I82 HydrophobicContact CG1-CG2 3.76Å; V40-I82 HydrophobicContact CG2-CG2 4.29Å; V40-P138 HydrophobicContact CG2-CB 4.5Å; V40-T141 HydrophobicContact CG2-CG2 3.82Å
41F85.9Confident86.6Confident41 Ų4126.5 Ų26.518%0.1815%0.15CC..Hα-helixtrans-59.7-51.9178.1176.4-111.1000112.8D37 Q38 Y39 R43 C44 A45 L61 L72 Q76 A79D37-F41 WeakPolarHBondContact O-CB 3.33Å; D37-F41 PolarHBondContact O-N 3.07Å; D37-F41 VanDerWaalsContact O-N 3.12Å; Q38-F41 WeakPolarHBondContact O-CB 3.46Å; Q38-F41 PolarHBondContact O-N 2.81Å; Q38-F41 VanDerWaalsContact O-N 3.12Å; Y39-F41 VanDerWaalsContact C-N 3.31Å; Y39-F41 PolarHBondContact O-N 2.88Å; F41-R43 PolarHBondContact O-N 3.33Å; F41-C44 PolarHBondContact O-N 3.5Å; F41-A45 WeakPolarHBondContact O-CB 3.45Å; F41-A45 PolarHBondContact O-N 3.4Å; F41-L61 HydrophobicContact CD1-CD1 4.42Å; F41-L61 HydrophobicContact CE1-CD1 3.45Å; F41-L61 VanDerWaalsContact CE1-CD1 3.45Å; F41-L61 HydrophobicContact CZ-CD1 3.7Å; F41-L72 HydrophobicContact CE2-CD1 4.35Å; F41-L72 HydrophobicContact CZ-CD1 3.84Å; F41-Q76 HydrophobicContact CD2-CG 4.28Å; F41-Q76 HydrophobicContact CE2-CB 4.41Å; F41-Q76 HydrophobicContact CE2-CG 3.43Å; F41-Q76 VanDerWaalsContact CE2-CG 3.43Å; F41-Q76 HydrophobicContact CZ-CG 4.2Å; F41-A79 HydrophobicContact CB-CB 4.26Å; F41-A79 HydrophobicContact CD2-CB 4.11Å
42Y85Confident85.4Confident21 Ų2132.4 Ų32.48%0.08217%0.173CC..Hα-helixtrans-62.1-42.6180-82.6-78.3000112.2Q38 Y39 A45 I46 F59 L61 F222Q38-Y42 HydrophobicContact CB-CD2 4.22Å; Q38-Y42 HydrophobicContact CB-CE2 4.26Å; Q38-Y42 WeakPolarHBondContact O-CD2 3.12Å; Q38-Y42 PolarHBondContact O-N 3.38Å; Y39-Y42 PolarHBondContact O-N 2.84Å; Y42-A45 PolarHBondContact O-N 3.39Å; Y42-I46 VanDerWaalsContact O-CG1 3.3Å; Y42-I46 WeakPolarHBondContact O-CG1 2.96Å; Y42-I46 PolarHBondContact O-N 3.49Å; Y42-F59 PolarHBondContact OH-O 3.21Å; Y42-L61 HydrophobicContact CD1-CG 4.47Å; Y42-L61 HydrophobicContact CE1-CG 4.35Å; Y42-F222 HydrophobicContact CD2-CE2 4.05Å; Y42-F222 AromaticContact CD2-CZ 3.52Å; Y42-F222 HydrophobicContact CD2-CZ 3.52Å; Y42-F222 HydrophobicContact CE2-CZ 4.16Å; Y42-F222 HydrophobicContact CG-CE2 4.25Å; Y42-F222 HydrophobicContact CG-CZ 4.07Å
43R89.2Confident83.7Confident57 Ų5734.7 Ų34.722%0.21519%0.186CC..Hα-helixtrans-65.8-42.3177.6-75.3-57.5-51.6-157.40.2112.4Y39 V40 F41 I46 D47 Q135 P138Y39-R43 HydrophobicContact CD1-CG 4.22Å; Y39-R43 HydrophobicContact CD2-CG 4.18Å; Y39-R43 HydrophobicContact CE1-CG 3.73Å; Y39-R43 HydrophobicContact CE2-CG 3.7Å; Y39-R43 HydrophobicContact CG-CG 4.43Å; Y39-R43 VanDerWaalsContact CZ-CG 3.43Å; Y39-R43 WeakPolarHBondContact O-CB 3.37Å; Y39-R43 WeakPolarHBondContact O-CG 3.44Å; Y39-R43 PolarHBondContact O-N 3.37Å; V40-R43 PolarHBondContact O-N 2.68Å; F41-R43 PolarHBondContact O-N 3.33Å; R43-I46 PolarHBondContact O-N 3.1Å; R43-D47 IonicContact NH2-OD1 3.21Å; R43-D47 WeakPolarHBondContact O-CB 3.3Å; R43-D47 VanDerWaalsContact O-CG 3.26Å; R43-D47 PolarHBondContact O-N 3.36Å; R43-Q135 PolarHBondContact NH1-O 2.98Å; R43-P138 HydrophobicContact CB-CB 4.12Å; R43-P138 HydrophobicContact CB-CG 4.07Å
44C88.1Confident82.3Confident0 Ų037.3 Ų37.30%020%0.203CC..Hα-helixtrans-63.2-43.4176.1-72.80000111.5V40 F41 I46 D47 E48 A79V40-C44 WeakPolarHBondContact O-CB 3.42Å; V40-C44 PolarHBondContact O-N 3.44Å; V40-C44 PolarHBondContact O-SG 3.45Å; F41-C44 PolarHBondContact O-N 3.5Å; C44-I46 VanDerWaalsContact C-N 3.33Å; C44-I46 PolarHBondContact O-N 3.4Å; C44-D47 PolarHBondContact O-N 3.31Å; C44-E48 WeakPolarHBondContact O-CG 3.5Å; C44-E48 PolarHBondContact O-N 2.9Å; C44-E48 VanDerWaalsContact O-N 3.1Å; C44-A79 HydrophobicContact CB-CB 4.2Å
45A84.1Confident80.5Confident0 Ų043.2 Ų43.20%023%0.229CC..Hα-helixtrans-59.7-42.5176.600000112.4F41 Y42 E48 G49 L50 L61F41-A45 WeakPolarHBondContact O-CB 3.45Å; F41-A45 PolarHBondContact O-N 3.4Å; Y42-A45 PolarHBondContact O-N 3.39Å; A45-E48 PolarHBondContact O-N 3.45Å; A45-G49 PolarHBondContact O-N 3.05Å; A45-L50 HydrophobicContact CB-CD1 4Å; A45-L50 WeakPolarHBondContact O-CB 3.35Å; A45-L50 PolarHBondContact O-N 3.33Å; A45-L50 VanDerWaalsContact O-N 3.14Å; A45-L61 HydrophobicContact CB-CD1 4.13Å; A45-L61 HydrophobicContact CB-CD2 3.83Å
46I85.6Confident78.7Confident60 Ų6050.6 Ų50.631%0.30827%0.268SS..Hα-helixtrans-64.7-42.8176.3-68.6167.1000111.4Y42 R43 C44 E48 G49 Y52Y42-I46 VanDerWaalsContact O-CG1 3.3Å; Y42-I46 WeakPolarHBondContact O-CG1 2.96Å; Y42-I46 PolarHBondContact O-N 3.49Å; R43-I46 PolarHBondContact O-N 3.1Å; C44-I46 VanDerWaalsContact C-N 3.33Å; C44-I46 PolarHBondContact O-N 3.4Å; I46-E48 PolarHBondContact O-N 3.34Å; I46-G49 PolarHBondContact O-N 2.91Å; I46-Y52 HydrophobicContact CD1-CD1 4Å; I46-Y52 HydrophobicContact CG1-CD1 4.48Å
47D87.1Confident77Confident68 Ų6852.2 Ų52.236%0.36429%0.286SS..Hα-helixtrans-62.7-29.8178.4-72.6-2000112.2R43 C44 G49 R78R43-D47 IonicContact NH2-OD1 3.21Å; R43-D47 WeakPolarHBondContact O-CB 3.3Å; R43-D47 VanDerWaalsContact O-CG 3.26Å; R43-D47 PolarHBondContact O-N 3.36Å; C44-D47 PolarHBondContact O-N 3.31Å; D47-G49 VanDerWaalsContact C-N 3.26Å; D47-G49 PolarHBondContact O-N 3.01Å; D47-R78 IonicContact OD2-CZ 2.67Å; D47-R78 IonicContact OD2-NH2 3.81Å; D47-R78 PolarHBondContact OD2-NH2 3.46Å
48E85.7Confident75.7Confident53 Ų5354.8 Ų54.825%0.24830%0.296CS..THydrogen-bonded Turntrans-80.2-2.4173.9-59.9-50.1137.100113.5C44 A45 I46 L71 R78C44-E48 WeakPolarHBondContact O-CG 3.5Å; C44-E48 PolarHBondContact O-N 2.9Å; C44-E48 VanDerWaalsContact O-N 3.1Å; A45-E48 PolarHBondContact O-N 3.45Å; I46-E48 PolarHBondContact O-N 3.34Å; E48-L71 WeakPolarHBondContact O-CD2 3.47Å; E48-R78 IonicContact OE1-CZ 3.72Å; E48-R78 IonicContact OE1-NH1 3.48Å; E48-R78 PolarHBondContact OE1-NH1 2.91Å
49G80.3Confident74.5Confident59 Ų5956 Ų5661%0.60830%0.301SS*.THydrogen-bonded Turntrans100.68.1174.200000115.7A45 I46 D47A45-G49 PolarHBondContact O-N 3.05Å; I46-G49 PolarHBondContact O-N 2.91Å; D47-G49 VanDerWaalsContact C-N 3.26Å; D47-G49 PolarHBondContact O-N 3.01Å
50L78.7Confident73.3Confident9 Ų960.8 Ų60.85%0.04732%0.324CS..PPolyproline II helixtrans-74.6128.1171.1-69.6165.2000110.3A45 L61 D68 L71 L72A45-L50 HydrophobicContact CB-CD1 4Å; A45-L50 WeakPolarHBondContact O-CB 3.35Å; A45-L50 PolarHBondContact O-N 3.33Å; A45-L50 VanDerWaalsContact O-N 3.14Å; L50-L61 HydrophobicContact CB-CD2 4.26Å; L50-D68 HydrophobicContact CD2-CB 3.82Å; L50-L71 HydrophobicContact CD1-CB 4.42Å; L50-L71 HydrophobicContact CD2-CB 4.39Å; L50-L71 HydrophobicContact CG-CB 4.17Å; L50-L72 HydrophobicContact CD1-CB 3.99Å; L50-L72 HydrophobicContact CD1-CD1 3.88Å
51S70.1Confident72.2Confident81 Ų8162 Ų6257%0.56633%0.33SS*.PPolyproline II helixtrans-83137.2170.356.30000110.6
52Y68.3Low71.1Confident125 Ų12562.4 Ų62.449%0.4933%0.333SS..EExtended strand (participates in β ladder)trans-85.1141.9162.970.7-87.2000108.5I46 T54 F59I46-Y52 HydrophobicContact CD1-CD1 4Å; I46-Y52 HydrophobicContact CG1-CD1 4.48Å; Y52-T54 HydrophobicContact CD2-CG2 4.17Å; Y52-T54 HydrophobicContact CE2-CG2 4.18Å; Y52-F59 HydrophobicContact CD2-CE1 4.24Å
53D57.4Low69.9Low49 Ų4962.8 Ų62.826%0.26234%0.341SS..EExtended strand (participates in β ladder)trans-120.6119.2170.7-161.2-8.8000107.8K55 K58 I62D53-K55 PolarHBondContact O-N 3.37Å; D53-K55 WeakPolarHBondContact OD2-CD 3.49Å; D53-K55 WeakPolarHBondContact OD2-CE 3.49Å; D53-K55 WeakPolarHBondContact OD2-CG 3.25Å; D53-K55 IonicContact OD2-NZ 3.42Å; D53-K55 PolarHBondContact OD2-NZ 3.05Å; D53-K58 VanDerWaalsContact O-O 3.05Å; D53-I62 HydrophobicContact CB-CD1 3.31Å; D53-I62 HydrophobicContact CB-CG1 4Å
54T60Low68.9Low75 Ų7566.1 Ų66.146%0.4636%0.363SS..EExtended strand (participates in β ladder)trans-79.25916854.10000108.8Y52 F59Y52-T54 HydrophobicContact CD2-CG2 4.17Å; Y52-T54 HydrophobicContact CE2-CG2 4.18Å; T54-F59 HydrophobicContact CG2-CD2 4.36Å; T54-F59 HydrophobicContact CG2-CE1 4.48Å; T54-F59 HydrophobicContact CG2-CE2 3.97Å; T54-F59 HydrophobicContact CG2-CZ 4.04Å
55K51.2Low68.4Low136 Ų13671 Ų7159%0.59139%0.389SS*.EExtended strand (participates in β ladder)trans-78.1128.7170.8-94.1173.9-174.4140.20108.6D53 G57 K58D53-K55 PolarHBondContact O-N 3.37Å; D53-K55 WeakPolarHBondContact OD2-CD 3.49Å; D53-K55 WeakPolarHBondContact OD2-CE 3.49Å; D53-K55 WeakPolarHBondContact OD2-CG 3.25Å; D53-K55 IonicContact OD2-NZ 3.42Å; D53-K55 PolarHBondContact OD2-NZ 3.05Å; K55-G57 PolarHBondContact O-N 3.48Å; K55-K58 WeakPolarHBondContact O-CB 3.38Å; K55-K58 PolarHBondContact O-N 2.82Å; K55-K58 VanDerWaalsContact O-N 3.14Å
56D53.4Low67.9Low157 Ų15779 Ų7984%0.8443%0.427SS*.THydrogen-bonded Turntrans57.326.6-177.6-53.8-32.5000115.1K58D56-K58 VanDerWaalsContact C-N 3.3Å; D56-K58 HydrophobicContact CB-CD 4.42Å; D56-K58 PolarHBondContact O-N 3.2Å
57G53.9Low67.7Low42 Ų4279.4 Ų79.443%0.43344%0.435SS..THydrogen-bonded Turntrans69.826.7-178.500000113.4K55 R219K55-G57 PolarHBondContact O-N 3.48Å; G57-R219 CarbonylContact O-C 3.55Å; G57-R219 WeakPolarHBondContact O-CA 3.26Å
58K59.9Low67.3Low85 Ų8577.7 Ų77.737%0.3743%0.425SS..EExtended strand (participates in β ladder)trans-111127.1179.9-65.6166.9157.9-151.40110.6D53 K55 D56 E60 Y218D53-K58 VanDerWaalsContact O-O 3.05Å; K55-K58 WeakPolarHBondContact O-CB 3.38Å; K55-K58 PolarHBondContact O-N 2.82Å; K55-K58 VanDerWaalsContact O-N 3.14Å; D56-K58 VanDerWaalsContact C-N 3.3Å; D56-K58 HydrophobicContact CB-CD 4.42Å; D56-K58 PolarHBondContact O-N 3.2Å; K58-E60 PolarHBondContact O-N 3.03Å; K58-Y218 CarbonylContact C-O 3.47Å; K58-Y218 VanDerWaalsContact CA-O 3.31Å; K58-Y218 WeakPolarHBondContact CA-O 3.48Å; K58-Y218 HydrophobicContact CB-CE1 4.07Å; K58-Y218 HydrophobicContact CB-CE2 4.03Å; K58-Y218 HydrophobicContact CD-CE1 3.88Å; K58-Y218 WeakPolarHBondContact CD-OH 2.9Å; K58-Y218 WeakPolarHBondContact CE-OH 3.31Å; K58-Y218 HydrophobicContact CG-CD1 4.31Å; K58-Y218 HydrophobicContact CG-CE1 3.55Å; K58-Y218 HydrophobicContact CG-CE2 4.41Å; K58-Y218 PolarHBondContact NZ-OH 3.42Å
59F60.8Low66.8Low48 Ų4881 Ų8121%0.21144%0.439CS..EExtended strand (participates in β ladder)trans-8479.9174.4-97.3-89.5000110.3Y42 Y52 T54 L217 Y218 G221Y42-F59 PolarHBondContact OH-O 3.21Å; Y52-F59 HydrophobicContact CD2-CE1 4.24Å; T54-F59 HydrophobicContact CG2-CD2 4.36Å; T54-F59 HydrophobicContact CG2-CE1 4.48Å; T54-F59 HydrophobicContact CG2-CE2 3.97Å; T54-F59 HydrophobicContact CG2-CZ 4.04Å; F59-L217 WeakPolarHBondContact CB-O 3.19Å; F59-Y218 PolarHBondContact N-O 3.22Å; F59-G221 VanDerWaalsContact CE2-CA 3.47Å
60E65.2Low66.8Low106 Ų10684 Ų8450%0.49544%0.44SS..EExtended strand (participates in β ladder)trans-117141.8-179.2-161.3166.1165.700111.6K58 Y218K58-E60 PolarHBondContact O-N 3.03Å; E60-Y218 HydrophobicContact CB-CE2 4.43Å; E60-Y218 PolarHBondContact OE2-OH 3.25Å
61L65.5Low67Low29 Ų2986 Ų8615%0.15245%0.451CS..EExtended strand (participates in β ladder)trans-79.4119.5171.4-75.3163.8000108.2F41 Y42 A45 L50 A63 L72F41-L61 HydrophobicContact CD1-CD1 4.42Å; F41-L61 HydrophobicContact CE1-CD1 3.45Å; F41-L61 VanDerWaalsContact CE1-CD1 3.45Å; F41-L61 HydrophobicContact CZ-CD1 3.7Å; Y42-L61 HydrophobicContact CD1-CG 4.47Å; Y42-L61 HydrophobicContact CE1-CG 4.35Å; A45-L61 HydrophobicContact CB-CD1 4.13Å; A45-L61 HydrophobicContact CB-CD2 3.83Å; L50-L61 HydrophobicContact CB-CD2 4.26Å; L61-A63 PolarHBondContact O-N 3.31Å; L61-L72 HydrophobicContact CD1-CD1 3.84Å
62I62.8Low67.5Low51 Ų5184 Ų8426%0.26243%0.434SS..  trans-78.9106.7172.6-59.3-173.5000107.9D53 N64D53-I62 HydrophobicContact CB-CD1 3.31Å; D53-I62 HydrophobicContact CB-CG1 4Å; I62-N64 HydrophobicContact CG2-CB 4.33Å; I62-N64 WeakPolarHBondContact CG2-ND2 3.27Å
63A61.6Low68.1Low29 Ų2984.6 Ų84.624%0.2444%0.439CS..  trans-121.875.9169.600000109.6L61 D68 L72L61-A63 PolarHBondContact O-N 3.31Å; A63-D68 HydrophobicContact CB-CB 3.91Å; A63-L72 HydrophobicContact CB-CD2 4.34Å
64N68.1Low69.3Low127 Ų12786 Ų8668%0.67944%0.444SS*.  trans-87.8-34.4-175.1-70.7-12.4000111.6I62 D68I62-N64 HydrophobicContact CG2-CB 4.33Å; I62-N64 WeakPolarHBondContact CG2-ND2 3.27Å; N64-D68 PolarHBondContact N-OD2 3.21Å
65N75.7Confident70.5Confident101 Ų10182.4 Ų82.454%0.5442%0.422SS..SBendtrans-98.7160.5-175.2-64.2-22000112.1S67 D68 K69N65-S67 WeakPolarHBondContact CB-OG 3.48Å; N65-S67 PolarHBondContact O-N 3.46Å; N65-D68 PolarHBondContact N-OD2 3.26Å; N65-D68 WeakPolarHBondContact O-CB 3.41Å; N65-D68 PolarHBondContact O-N 2.95Å; N65-D68 VanDerWaalsContact O-N 3.08Å; N65-K69 PolarHBondContact O-N 3.32Å; N65-K69 VanDerWaalsContact O-N 3.16Å
66E75.1Confident71.9Confident170 Ų17079.1 Ų79.179%0.79441%0.409SS*.Hα-helixtrans-62.1-33.3176.6-167.7174.2-171.800112.4D68 K69 L70E66-D68 VanDerWaalsContact C-N 3.33Å; E66-D68 PolarHBondContact O-N 2.87Å; E66-K69 PolarHBondContact O-N 3.05Å; E66-L70 PolarHBondContact O-N 3.37Å
67S80.3Confident73.4Confident68 Ų6879.4 Ų79.448%0.47640%0.398SS..Hα-helixtrans-56.8-45.9170.1520000112N65 K69 L70 L71N65-S67 WeakPolarHBondContact CB-OG 3.48Å; N65-S67 PolarHBondContact O-N 3.46Å; S67-K69 VanDerWaalsContact C-N 3.28Å; S67-K69 PolarHBondContact O-N 3.21Å; S67-L70 WeakPolarHBondContact O-CB 3.14Å; S67-L70 PolarHBondContact O-N 3.36Å; S67-L70 VanDerWaalsContact O-N 3.08Å; S67-L71 WeakPolarHBondContact O-CG 3.43Å; S67-L71 PolarHBondContact O-N 3.27Å
68D79.1Confident74.9Confident31 Ų3181 Ų8117%0.16639%0.391CS..Hα-helixtrans-69-34-175.1-49.6-14.6000110.3L50 A63 N64 N65 E66 L70 L71 L72L50-D68 HydrophobicContact CD2-CB 3.82Å; A63-D68 HydrophobicContact CB-CB 3.91Å; N64-D68 PolarHBondContact N-OD2 3.21Å; N65-D68 PolarHBondContact N-OD2 3.26Å; N65-D68 WeakPolarHBondContact O-CB 3.41Å; N65-D68 PolarHBondContact O-N 2.95Å; N65-D68 VanDerWaalsContact O-N 3.08Å; E66-D68 VanDerWaalsContact C-N 3.33Å; E66-D68 PolarHBondContact O-N 2.87Å; D68-L70 VanDerWaalsContact C-N 3.3Å; D68-L70 PolarHBondContact O-N 3.22Å; D68-L71 PolarHBondContact O-N 3.28Å; D68-L72 VanDerWaalsContact O-CB 3.26Å; D68-L72 WeakPolarHBondContact O-CB 3.35Å; D68-L72 PolarHBondContact O-N 3.21Å
69K74.4Confident76.1Confident122 Ų12277.2 Ų77.253%0.5338%0.375SS..Hα-helixtrans-63.5-36.6172.8-66.6178.4-177176.90112N65 E66 S67 K73N65-K69 PolarHBondContact O-N 3.32Å; N65-K69 VanDerWaalsContact O-N 3.16Å; E66-K69 PolarHBondContact O-N 3.05Å; S67-K69 VanDerWaalsContact C-N 3.28Å; S67-K69 PolarHBondContact O-N 3.21Å; K69-K73 WeakPolarHBondContact O-CG 3.35Å; K69-K73 PolarHBondContact O-N 3.17Å; K69-K73 VanDerWaalsContact O-N 3.1Å
70L81Confident77.1Confident122 Ų12275.9 Ų75.964%0.63937%0.373SS*.Hα-helixtrans-70.7-43.8176.4-171.8139.8000111.1E66 S67 D68 L72 K73 E74E66-L70 PolarHBondContact O-N 3.37Å; S67-L70 WeakPolarHBondContact O-CB 3.14Å; S67-L70 PolarHBondContact O-N 3.36Å; S67-L70 VanDerWaalsContact O-N 3.08Å; D68-L70 VanDerWaalsContact C-N 3.3Å; D68-L70 PolarHBondContact O-N 3.22Å; L70-L72 VanDerWaalsContact C-N 3.31Å; L70-L72 PolarHBondContact O-N 3.38Å; L70-K73 PolarHBondContact O-N 3.38Å; L70-E74 PolarHBondContact O-N 3.1Å; L70-E74 VanDerWaalsContact O-N 3.09Å
71L82.8Confident78Confident53 Ų5378.4 Ų78.428%0.27738%0.378SS..Hα-helixtrans-61.1-40174-64.8177.3000111.9E48 L50 S67 D68 K73 E74 G75E48-L71 WeakPolarHBondContact O-CD2 3.47Å; L50-L71 HydrophobicContact CD1-CB 4.42Å; L50-L71 HydrophobicContact CD2-CB 4.39Å; L50-L71 HydrophobicContact CG-CB 4.17Å; S67-L71 WeakPolarHBondContact O-CG 3.43Å; S67-L71 PolarHBondContact O-N 3.27Å; D68-L71 PolarHBondContact O-N 3.28Å; L71-K73 PolarHBondContact O-N 3.24Å; L71-E74 PolarHBondContact O-N 3.3Å; L71-G75 PolarHBondContact O-N 3.1Å
72L81.2Confident79.1Confident38 Ų3877 Ų7720%0.19937%0.371CS..Hα-helixtrans-62.9-43176.6-174.265.6000111.7F41 L50 L61 A63 D68 L70 E74 G75 Q76F41-L72 HydrophobicContact CE2-CD1 4.35Å; F41-L72 HydrophobicContact CZ-CD1 3.84Å; L50-L72 HydrophobicContact CD1-CB 3.99Å; L50-L72 HydrophobicContact CD1-CD1 3.88Å; L61-L72 HydrophobicContact CD1-CD1 3.84Å; A63-L72 HydrophobicContact CB-CD2 4.34Å; D68-L72 VanDerWaalsContact O-CB 3.26Å; D68-L72 WeakPolarHBondContact O-CB 3.35Å; D68-L72 PolarHBondContact O-N 3.21Å; L70-L72 VanDerWaalsContact C-N 3.31Å; L70-L72 PolarHBondContact O-N 3.38Å; L72-E74 VanDerWaalsContact C-N 3.3Å; L72-E74 PolarHBondContact O-N 2.94Å; L72-G75 PolarHBondContact O-N 3.01Å; L72-Q76 WeakPolarHBondContact O-CB 3.39Å; L72-Q76 VanDerWaalsContact O-CG 3.29Å; L72-Q76 WeakPolarHBondContact O-CG 3.28Å; L72-Q76 PolarHBondContact O-N 3.3Å
73K79.8Confident80.1Confident137 Ų13774.8 Ų74.860%0.59636%0.36SS*.Hα-helixtrans-60.8-40.4175.3-78.1178.4179.4-179.80111.8K69 L70 L71 Q76 R77K69-K73 WeakPolarHBondContact O-CG 3.35Å; K69-K73 PolarHBondContact O-N 3.17Å; K69-K73 VanDerWaalsContact O-N 3.1Å; L70-K73 PolarHBondContact O-N 3.38Å; L71-K73 PolarHBondContact O-N 3.24Å; K73-Q76 PolarHBondContact O-N 2.72Å; K73-R77 WeakPolarHBondContact O-CB 3.44Å; K73-R77 PolarHBondContact O-N 2.95Å
74E83.9Confident81.1Confident79 Ų7974.3 Ų74.337%0.36936%0.355SS..Hα-helixtrans-70.2-42.1177.9-164.657.5-148.100111.5L70 L71 L72 Q76 R77 R78L70-E74 PolarHBondContact O-N 3.1Å; L70-E74 VanDerWaalsContact O-N 3.09Å; L71-E74 PolarHBondContact O-N 3.3Å; L72-E74 VanDerWaalsContact C-N 3.3Å; L72-E74 PolarHBondContact O-N 2.94Å; E74-Q76 VanDerWaalsContact C-N 3.33Å; E74-Q76 PolarHBondContact O-N 2.95Å; E74-R77 WeakPolarHBondContact O-CB 3.38Å; E74-R77 PolarHBondContact O-N 3.46Å; E74-R77 IonicContact OE1-NH1 2.8Å; E74-R77 IonicContact OE2-NH1 3.91Å; E74-R78 WeakPolarHBondContact O-CB 3.09Å; E74-R78 PolarHBondContact O-N 3.21Å
75G84.2Confident82.1Confident0 Ų070 Ų700%033%0.334CS..Hα-helixtrans-58.7-42172.100000112.6L71 L72 R78 A79L71-G75 PolarHBondContact O-N 3.1Å; L72-G75 PolarHBondContact O-N 3.01Å; G75-R78 PolarHBondContact O-N 3.44Å; G75-A79 WeakPolarHBondContact O-CB 3.23Å; G75-A79 PolarHBondContact O-N 2.93Å
76Q82.1Confident82.6Confident67 Ų6765.4 Ų65.431%0.31331%0.31SS..Hα-helixtrans-61.6-46.5173.2-78.2179.6-14.100111.9F41 L72 K73 E74 R78 A79 A80F41-Q76 HydrophobicContact CD2-CG 4.28Å; F41-Q76 HydrophobicContact CE2-CB 4.41Å; F41-Q76 HydrophobicContact CE2-CG 3.43Å; F41-Q76 VanDerWaalsContact CE2-CG 3.43Å; F41-Q76 HydrophobicContact CZ-CG 4.2Å; L72-Q76 WeakPolarHBondContact O-CB 3.39Å; L72-Q76 VanDerWaalsContact O-CG 3.29Å; L72-Q76 WeakPolarHBondContact O-CG 3.28Å; L72-Q76 PolarHBondContact O-N 3.3Å; K73-Q76 PolarHBondContact O-N 2.72Å; E74-Q76 VanDerWaalsContact C-N 3.33Å; E74-Q76 PolarHBondContact O-N 2.95Å; Q76-R78 VanDerWaalsContact C-N 3.35Å; Q76-R78 PolarHBondContact O-N 2.91Å; Q76-A79 PolarHBondContact O-N 3.33Å; Q76-A80 VanDerWaalsContact O-CB 3.31Å; Q76-A80 WeakPolarHBondContact O-CB 3.33Å; Q76-A80 PolarHBondContact O-N 3.47Å
77R83.2Confident83.1Confident163 Ų16357.5 Ų57.562%0.61527%0.273SS*.Hα-helixtrans-59.5-47.4178.3-179.4-172.8177.2-179.80.6110.9K73 E74 A80 W81K73-R77 WeakPolarHBondContact O-CB 3.44Å; K73-R77 PolarHBondContact O-N 2.95Å; E74-R77 WeakPolarHBondContact O-CB 3.38Å; E74-R77 PolarHBondContact O-N 3.46Å; E74-R77 IonicContact OE1-NH1 2.8Å; E74-R77 IonicContact OE2-NH1 3.91Å; R77-A80 PolarHBondContact O-N 2.93Å; R77-W81 PolarHBondContact O-N 3.39Å
78R85.8Confident83.3Confident76 Ų7655.5 Ų55.529%0.28726%0.259SS..Hα-helixtrans-66.1-42.3179-172.7172169.5-162.8-10.8111.9D47 E48 E74 G75 Q76 A80 W81 I82D47-R78 IonicContact OD2-CZ 2.67Å; D47-R78 IonicContact OD2-NH2 3.81Å; D47-R78 PolarHBondContact OD2-NH2 3.46Å; E48-R78 IonicContact OE1-CZ 3.72Å; E48-R78 IonicContact OE1-NH1 3.48Å; E48-R78 PolarHBondContact OE1-NH1 2.91Å; E74-R78 WeakPolarHBondContact O-CB 3.09Å; E74-R78 PolarHBondContact O-N 3.21Å; G75-R78 PolarHBondContact O-N 3.44Å; Q76-R78 VanDerWaalsContact C-N 3.35Å; Q76-R78 PolarHBondContact O-N 2.91Å; R78-A80 VanDerWaalsContact C-N 3.35Å; R78-A80 PolarHBondContact O-N 3.34Å; R78-W81 WeakPolarHBondContact O-CB 3.26Å; R78-W81 PolarHBondContact O-N 2.53Å; R78-I82 HydrophobicContact CG-CD1 4.3Å; R78-I82 WeakPolarHBondContact O-CG1 3.47Å; R78-I82 PolarHBondContact O-N 3.31Å
79A86.1Confident83.7Confident5 Ų556.2 Ų56.24%0.04126%0.264CS..Hα-helixtrans-62.5-41.3174.900000112V40 F41 C44 G75 Q76 W81 I82 G83V40-A79 HydrophobicContact CG1-CB 4.09Å; F41-A79 HydrophobicContact CB-CB 4.26Å; F41-A79 HydrophobicContact CD2-CB 4.11Å; C44-A79 HydrophobicContact CB-CB 4.2Å; G75-A79 WeakPolarHBondContact O-CB 3.23Å; G75-A79 PolarHBondContact O-N 2.93Å; Q76-A79 PolarHBondContact O-N 3.33Å; A79-W81 VanDerWaalsContact C-N 3.32Å; A79-W81 PolarHBondContact O-N 2.84Å; A79-I82 PolarHBondContact O-N 3.2Å; A79-G83 PolarHBondContact O-N 3.05Å
80A80.7Confident84.4Confident20 Ų2051.3 Ų51.317%0.16524%0.243CC..Hα-helixtrans-64.4-37.3176.300000112.7Q76 R77 R78 S84 Y326Q76-A80 VanDerWaalsContact O-CB 3.31Å; Q76-A80 WeakPolarHBondContact O-CB 3.33Å; Q76-A80 PolarHBondContact O-N 3.47Å; R77-A80 PolarHBondContact O-N 2.93Å; R78-A80 VanDerWaalsContact C-N 3.35Å; R78-A80 PolarHBondContact O-N 3.34Å; A80-S84 VanDerWaalsContact O-CB 3.25Å; A80-S84 WeakPolarHBondContact O-CB 3.33Å; A80-S84 PolarHBondContact O-N 3.07Å; A80-Y326 VanDerWaalsContact CA-OH 3.3Å; A80-Y326 WeakPolarHBondContact CA-OH 2.94Å
81W84.8Confident84.8Confident159 Ų15945.9 Ų45.960%0.60221%0.214SC*.Hα-helixtrans-64.3-51.4173.5-174.9-104000112R77 R78 A79 G83 S84 C85R77-W81 PolarHBondContact O-N 3.39Å; R78-W81 WeakPolarHBondContact O-CB 3.26Å; R78-W81 PolarHBondContact O-N 2.53Å; A79-W81 VanDerWaalsContact C-N 3.32Å; A79-W81 PolarHBondContact O-N 2.84Å; W81-G83 PolarHBondContact O-N 3.16Å; W81-S84 PolarHBondContact O-N 3.33Å; W81-C85 PolarHBondContact O-N 3.22Å; W81-C85 PolarHBondContact O-SG 3.29Å; W81-C85 VanDerWaalsContact O-SG 3.41Å
82I87.7Confident85.1Confident0 Ų048.3 Ų48.30%023%0.227CC..Hα-helixtrans-62.7-43.8178.8-66174.5000110.9V40 R78 A79 S84 C85 N86 P138 W139V40-I82 HydrophobicContact CG1-CB 3.89Å; V40-I82 HydrophobicContact CG1-CG2 3.76Å; V40-I82 HydrophobicContact CG2-CG2 4.29Å; R78-I82 HydrophobicContact CG-CD1 4.3Å; R78-I82 WeakPolarHBondContact O-CG1 3.47Å; R78-I82 PolarHBondContact O-N 3.31Å; A79-I82 PolarHBondContact O-N 3.2Å; I82-S84 PolarHBondContact O-N 2.82Å; I82-C85 PolarHBondContact O-N 2.76Å; I82-N86 WeakPolarHBondContact O-CB 3.41Å; I82-N86 PolarHBondContact O-N 2.72Å; I82-P138 HydrophobicContact CD1-CB 4.34Å; I82-P138 HydrophobicContact CD1-CG 4.35Å; I82-W139 HydrophobicContact CD1-CD2 4.21Å; I82-W139 HydrophobicContact CD1-CZ2 4.1Å; I82-W139 HydrophobicContact CG1-CD2 4.22Å; I82-W139 HydrophobicContact CG1-CE3 4.26Å; I82-W139 HydrophobicContact CG1-CH2 3.87Å; I82-W139 HydrophobicContact CG1-CZ2 3.82Å; I82-W139 HydrophobicContact CG1-CZ3 4.09Å
83G84.6Confident85.5Confident3 Ų348.8 Ų48.83%0.03123%0.229CC..Hα-helixtrans-59.2-46175.700000111.7A79 W81 C85 N86 H87A79-G83 PolarHBondContact O-N 3.05Å; W81-G83 PolarHBondContact O-N 3.16Å; G83-C85 VanDerWaalsContact C-N 3.35Å; G83-C85 PolarHBondContact O-N 3.3Å; G83-N86 PolarHBondContact O-N 2.98Å; G83-H87 WeakPolarHBondContact O-CB 3.44Å; G83-H87 PolarHBondContact O-CD2 3.1Å; G83-H87 PolarHBondContact O-N 3.42Å
84S83.6Confident85.8Confident20 Ų2042.2 Ų42.214%0.1420%0.201CC..Hα-helixtrans-60-43.6175.3-176.90000111.8A80 W81 I82 S88 F488A80-S84 VanDerWaalsContact O-CB 3.25Å; A80-S84 WeakPolarHBondContact O-CB 3.33Å; A80-S84 PolarHBondContact O-N 3.07Å; W81-S84 PolarHBondContact O-N 3.33Å; I82-S84 PolarHBondContact O-N 2.82Å; S84-S88 WeakPolarHBondContact O-CB 3.5Å; S84-S88 PolarHBondContact O-N 3.37Å; S84-S88 PolarHBondContact O-OG 3.41Å; S84-F488 PolarHBondContact OG-O 3.02Å
85C87.3Confident85.9Confident36 Ų3639.1 Ų39.124%0.24319%0.187CC..Hα-helixtrans-61.3-47.1174.6-690000112.1W81 I82 G83 S88 V89 I142W81-C85 PolarHBondContact O-N 3.22Å; W81-C85 PolarHBondContact O-SG 3.29Å; W81-C85 VanDerWaalsContact O-SG 3.41Å; I82-C85 PolarHBondContact O-N 2.76Å; G83-C85 VanDerWaalsContact C-N 3.35Å; G83-C85 PolarHBondContact O-N 3.3Å; C85-S88 PolarHBondContact O-N 2.9Å; C85-V89 WeakPolarHBondContact O-CG2 3.37Å; C85-V89 PolarHBondContact O-N 3.42Å; C85-I142 HydrophobicContact CB-CD1 4.5Å
86N86.8Confident85.8Confident4 Ų442.9 Ų42.92%0.02121%0.206CC..Hα-helixtrans-60-53.7179.7-173.58.1000111.5I82 G83 S88 V89 R90 T141 I142I82-N86 WeakPolarHBondContact O-CB 3.41Å; I82-N86 PolarHBondContact O-N 2.72Å; G83-N86 PolarHBondContact O-N 2.98Å; N86-S88 VanDerWaalsContact C-N 3.32Å; N86-S88 PolarHBondContact O-N 2.93Å; N86-V89 PolarHBondContact O-N 2.88Å; N86-R90 VanDerWaalsContact O-CB 3.31Å; N86-R90 WeakPolarHBondContact O-CB 3.2Å; N86-R90 PolarHBondContact O-N 3.35Å; N86-R90 VanDerWaalsContact O-N 3.09Å; N86-T141 PolarHBondContact ND2-O 3.47Å; N86-T141 PolarHBondContact OD1-O 3.21Å; N86-I142 HydrophobicContact CB-CG1 4.33Å
87H85.6Confident86Confident5 Ų540.5 Ų40.52%0.02320%0.196CC..Hα-helixtrans-61.2-39.4177.7-70.8-66000111.4D37 G83 R90 L91 F488D37-H87 IonicContact OD1-CE1 3.98Å; D37-H87 IonicContact OD1-NE2 3.66Å; D37-H87 PolarHBondContact OD1-NE2 2.67Å; D37-H87 IonicContact OD2-CE1 2.71Å; D37-H87 IonicContact OD2-NE2 2.74Å; G83-H87 WeakPolarHBondContact O-CB 3.44Å; G83-H87 PolarHBondContact O-CD2 3.1Å; G83-H87 PolarHBondContact O-N 3.42Å; H87-R90 PolarHBondContact CE1-NH1 3.3Å; H87-R90 PolarHBondContact CE1-NH2 3.01Å; H87-R90 PolarHBondContact ND1-NH1 2.9Å; H87-R90 PolarHBondContact ND1-NH2 2.92Å; H87-L91 VanDerWaalsContact O-CB 3.26Å; H87-L91 WeakPolarHBondContact O-CB 3.35Å; H87-L91 WeakPolarHBondContact O-CD1 3.43Å; H87-L91 WeakPolarHBondContact O-CG 3.49Å; H87-L91 PolarHBondContact O-N 3.44Å; H87-F488 HydrophobicContact CB-CB 4.17Å; H87-F488 HydrophobicContact CB-CD1 3.71Å; H87-F488 HydrophobicContact CB-CD2 4.48Å; H87-F488 HydrophobicContact CB-CE1 4.23Å; H87-F488 HydrophobicContact CB-CG 3.88Å; H87-F488 AromaticContact CD2-CD1 3.79Å; H87-F488 AromaticContact CD2-CE1 3.69Å; H87-F488 AromaticContact CG-CD1 3.74Å; H87-F488 AromaticContact CG-CE1 3.77Å
88S85.8Confident86.1Confident26 Ų2632.8 Ų32.818%0.18217%0.167CC..Hα-helixtrans-65.9-46.8179.6-62.70000112.8S84 C85 N86 R90 L91 L92 S489S84-S88 WeakPolarHBondContact O-CB 3.5Å; S84-S88 PolarHBondContact O-N 3.37Å; S84-S88 PolarHBondContact O-OG 3.41Å; C85-S88 PolarHBondContact O-N 2.9Å; N86-S88 VanDerWaalsContact C-N 3.32Å; N86-S88 PolarHBondContact O-N 2.93Å; S88-R90 VanDerWaalsContact C-N 3.34Å; S88-R90 PolarHBondContact O-N 3.22Å; S88-L91 PolarHBondContact O-N 3.08Å; S88-L92 WeakPolarHBondContact O-CB 3.39Å; S88-L92 PolarHBondContact O-N 3.44Å; S88-S489 PolarHBondContact OG-OG 3.02Å
89V87.4Confident85.9Confident46 Ų4629.8 Ų29.828%0.27916%0.157SC..Hα-helixtrans-60.4-47.1177.7169.60000110.3C85 N86 L91 L92 L93 I142 L146C85-V89 WeakPolarHBondContact O-CG2 3.37Å; C85-V89 PolarHBondContact O-N 3.42Å; N86-V89 PolarHBondContact O-N 2.88Å; V89-L91 PolarHBondContact O-N 3.18Å; V89-L92 PolarHBondContact O-N 2.75Å; V89-L93 HydrophobicContact CG1-CD1 3.93Å; V89-L93 WeakPolarHBondContact O-CB 3.46Å; V89-L93 WeakPolarHBondContact O-CG 3.28Å; V89-L93 PolarHBondContact O-N 3.49Å; V89-I142 HydrophobicContact CB-CG2 4.34Å; V89-I142 HydrophobicContact CG1-CG2 4.15Å; V89-I142 HydrophobicContact CG2-CG2 4.29Å; V89-L146 HydrophobicContact CG1-CD2 3.61Å
90R88.6Confident85.9Confident19 Ų1931.1 Ų31.17%0.07216%0.163CC..Hα-helixtrans-57.8-48.7177.5-172.8175.884.6-143.2-3.7112.1N86 H87 S88 G94 D148 R481N86-R90 VanDerWaalsContact O-CB 3.31Å; N86-R90 WeakPolarHBondContact O-CB 3.2Å; N86-R90 PolarHBondContact O-N 3.35Å; N86-R90 VanDerWaalsContact O-N 3.09Å; H87-R90 PolarHBondContact CE1-NH1 3.3Å; H87-R90 PolarHBondContact CE1-NH2 3.01Å; H87-R90 PolarHBondContact ND1-NH1 2.9Å; H87-R90 PolarHBondContact ND1-NH2 2.92Å; S88-R90 VanDerWaalsContact C-N 3.34Å; S88-R90 PolarHBondContact O-N 3.22Å; R90-G94 PolarHBondContact O-N 3.22Å; R90-G94 VanDerWaalsContact O-N 3.1Å; R90-D148 WeakPolarHBondContact CD-OD2 3.4Å; R90-D148 HydrophobicContact CG-CB 3.82Å; R90-D148 WeakPolarHBondContact CG-OD2 3.43Å; R90-D148 IonicContact NE-OD2 3.01Å; R90-D148 PolarHBondContact NE-OD2 3.13Å; R90-R481 PolarHBondContact O-NH2 2.9Å
91L89.2Confident86.1Confident7 Ų730.6 Ų30.64%0.03716%0.157CC..Hα-helixtrans-69.2-43.5-177.9-71.2167000111.8H87 S88 V89 G94 L95 R481 V484 L485 F488H87-L91 VanDerWaalsContact O-CB 3.26Å; H87-L91 WeakPolarHBondContact O-CB 3.35Å; H87-L91 WeakPolarHBondContact O-CD1 3.43Å; H87-L91 WeakPolarHBondContact O-CG 3.49Å; H87-L91 PolarHBondContact O-N 3.44Å; S88-L91 PolarHBondContact O-N 3.08Å; V89-L91 PolarHBondContact O-N 3.18Å; L91-G94 PolarHBondContact O-N 3.41Å; L91-L95 WeakPolarHBondContact O-CG 3.41Å; L91-L95 PolarHBondContact O-N 3.44Å; L91-L95 VanDerWaalsContact O-N 3.09Å; L91-R481 HydrophobicContact CD2-CG 3.88Å; L91-R481 PolarHBondContact O-NE 2.99Å; L91-V484 HydrophobicContact CD1-CB 4.38Å; L91-V484 HydrophobicContact CD1-CG1 3.75Å; L91-V484 HydrophobicContact CD2-CB 4.2Å; L91-V484 HydrophobicContact CD2-CG1 3.86Å; L91-V484 HydrophobicContact CG-CG1 4.49Å; L91-L485 HydrophobicContact CB-CB 4.24Å; L91-L485 HydrophobicContact CB-CD1 3.89Å; L91-L485 HydrophobicContact CD1-CB 4.44Å; L91-F488 HydrophobicContact CD1-CB 4.3Å; L91-F488 HydrophobicContact CD1-CD2 3.73Å; L91-F488 HydrophobicContact CD1-CE2 4.49Å; L91-F488 HydrophobicContact CD1-CG 4.3Å
92L88.4Confident85.9Confident104 Ų10423 Ų2355%0.54513%0.129SC..Hα-helixtrans-61.3-49.5179.6-177.168.2000111.9S88 V89 G94 L95 L485S88-L92 WeakPolarHBondContact O-CB 3.39Å; S88-L92 PolarHBondContact O-N 3.44Å; V89-L92 PolarHBondContact O-N 2.75Å; L92-G94 VanDerWaalsContact C-N 3.32Å; L92-G94 PolarHBondContact O-N 2.98Å; L92-L95 WeakPolarHBondContact O-CB 3.04Å; L92-L95 PolarHBondContact O-N 3.06Å; L92-L485 HydrophobicContact CD1-CD2 4.48Å
93L89Confident85.6Confident48 Ų4827.2 Ų27.225%0.25115%0.145SC..Hα-helixtrans-65.4-38.9178.8-69.4174.6000111.5V89 L95 L96 L146 G149 I150V89-L93 HydrophobicContact CG1-CD1 3.93Å; V89-L93 WeakPolarHBondContact O-CB 3.46Å; V89-L93 WeakPolarHBondContact O-CG 3.28Å; V89-L93 PolarHBondContact O-N 3.49Å; L93-L95 VanDerWaalsContact C-N 3.25Å; L93-L95 PolarHBondContact O-N 2.93Å; L93-L96 PolarHBondContact O-N 3.48Å; L93-L146 HydrophobicContact CD1-CD2 3.38Å; L93-G149 CarbonylContact C-O 3.47Å; L93-I150 HydrophobicContact CB-CG1 4.44Å; L93-I150 HydrophobicContact CD1-CD1 4.27Å; L93-I150 HydrophobicContact CD1-CG1 4.08Å
94G86.7Confident85.6Confident0 Ų029 Ų290%015%0.153CC..Hα-helixtrans-71.5-13.8178.300000115.5R90 L91 L92 L96 T97 T98 G149 R481R90-G94 PolarHBondContact O-N 3.22Å; R90-G94 VanDerWaalsContact O-N 3.1Å; L91-G94 PolarHBondContact O-N 3.41Å; L92-G94 VanDerWaalsContact C-N 3.32Å; L92-G94 PolarHBondContact O-N 2.98Å; G94-L96 VanDerWaalsContact C-N 3.31Å; G94-T97 VanDerWaalsContact CA-OG1 3.3Å; G94-T97 WeakPolarHBondContact CA-OG1 3.35Å; G94-T97 PolarHBondContact O-OG1 3.49Å; G94-T98 WeakPolarHBondContact O-CB 3.16Å; G94-T98 WeakPolarHBondContact O-CG2 3.31Å; G94-T98 PolarHBondContact O-N 3.28Å; G94-T98 PolarHBondContact O-OG1 3.43Å; G94-G149 VanDerWaalsContact CA-O 3.31Å; G94-G149 WeakPolarHBondContact CA-O 3.36Å; G94-G149 PolarHBondContact N-O 3.23Å; G94-R481 VanDerWaalsContact C-NE 3.26Å; G94-R481 VanDerWaalsContact CA-CZ 3.42Å
95L86.4Confident85.7Confident14 Ų1428 Ų287%0.07315%0.147CC..Hα-helixtrans-64.2-40170.8-77.3167.3000111.2L91 L92 L93 T98 F478 R481 L482 L485L91-L95 WeakPolarHBondContact O-CG 3.41Å; L91-L95 PolarHBondContact O-N 3.44Å; L91-L95 VanDerWaalsContact O-N 3.09Å; L92-L95 WeakPolarHBondContact O-CB 3.04Å; L92-L95 PolarHBondContact O-N 3.06Å; L93-L95 VanDerWaalsContact C-N 3.25Å; L93-L95 PolarHBondContact O-N 2.93Å; L95-T98 PolarHBondContact O-OG1 3.01Å; L95-F478 HydrophobicContact CB-CD2 4.27Å; L95-F478 HydrophobicContact CB-CE2 4Å; L95-F478 HydrophobicContact CD2-CD2 3.7Å; L95-F478 HydrophobicContact CD2-CE2 3.76Å; L95-F478 HydrophobicContact CD2-CG 4.31Å; L95-F478 HydrophobicContact CD2-CZ 4.41Å; L95-F478 WeakPolarHBondContact CD2-O 3.2Å; L95-F478 HydrophobicContact CG-CE2 4.43Å; L95-F478 WeakPolarHBondContact O-CD2 3.04Å; L95-R481 HydrophobicContact CD2-CB 3.72Å; L95-R481 HydrophobicContact CD2-CG 3.86Å; L95-R481 HydrophobicContact CG-CG 4.15Å; L95-L482 HydrophobicContact CD1-CD2 3.6Å; L95-L482 HydrophobicContact CD1-CG 4.37Å; L95-L482 HydrophobicContact CD2-CD2 3.94Å; L95-L482 HydrophobicContact CD2-CG 3.78Å; L95-L482 HydrophobicContact CG-CD2 4.45Å; L95-L485 HydrophobicContact CD1-CD2 3.89Å
96L81.8Confident85.3Confident78 Ų7828 Ų2841%0.40815%0.145SC..Hα-helixtrans-69.4-40.7179.8-65.3173.5000110.9L93 G94 I100L93-L96 PolarHBondContact O-N 3.48Å; G94-L96 VanDerWaalsContact C-N 3.31Å; L96-I100 WeakPolarHBondContact O-CD1 3.35Å; L96-I100 WeakPolarHBondContact O-CG1 3.45Å
97T87Confident85Confident17 Ų1734.3 Ų34.310%0.10417%0.168CC..Hα-helixtrans-78.9-32.5-173.357.90000112.8G94 M99 I100 I101 G149 I150 G153G94-T97 VanDerWaalsContact CA-OG1 3.3Å; G94-T97 WeakPolarHBondContact CA-OG1 3.35Å; G94-T97 PolarHBondContact O-OG1 3.49Å; T97-M99 PolarHBondContact O-N 3.37Å; T97-I100 PolarHBondContact O-N 3.29Å; T97-I100 VanDerWaalsContact O-N 3.13Å; T97-I101 VanDerWaalsContact O-CB 3.32Å; T97-I101 WeakPolarHBondContact O-CB 3.42Å; T97-I101 WeakPolarHBondContact O-CD1 3.33Å; T97-I101 WeakPolarHBondContact O-CG1 3.33Å; T97-I101 PolarHBondContact O-N 3.13Å; T97-G149 WeakPolarHBondContact CB-O 3.41Å; T97-G149 WeakPolarHBondContact CG2-O 3.31Å; T97-G149 PolarHBondContact OG1-O 3.43Å; T97-I150 VanDerWaalsContact CG2-O 3.22Å; T97-I150 WeakPolarHBondContact CG2-O 3.27Å; T97-G153 WeakPolarHBondContact OG1-CA 3.41Å
98T85.9Confident84.8Confident1 Ų139.5 Ų39.51%0.00619%0.191CC..Hα-helixtrans-54.6-40.7176.853.20000112.4G94 L95 G102 G153G94-T98 WeakPolarHBondContact O-CB 3.16Å; G94-T98 WeakPolarHBondContact O-CG2 3.31Å; G94-T98 PolarHBondContact O-N 3.28Å; G94-T98 PolarHBondContact O-OG1 3.43Å; L95-T98 PolarHBondContact O-OG1 3.01Å; T98-G102 PolarHBondContact O-N 3.37Å; T98-G102 VanDerWaalsContact O-N 3.16Å; T98-G153 WeakPolarHBondContact CG2-O 3.31Å
99M81.7Confident84.7Confident13 Ų1338.4 Ų38.46%0.06418%0.183CC..Hα-helixtrans-73-40.4177.8-65.6-166.766.100113T97 I101 G102 Y103 I293 F478T97-M99 PolarHBondContact O-N 3.37Å; M99-I101 VanDerWaalsContact C-N 3.34Å; M99-G102 PolarHBondContact O-N 3.4Å; M99-Y103 PolarHBondContact O-N 3.3Å; M99-Y103 VanDerWaalsContact O-N 3.1Å; M99-I293 HydrophobicContact CE-CB 4.2Å; M99-I293 HydrophobicContact CE-CG1 3.51Å; M99-I293 HydrophobicContact SD-CD1 4.41Å; M99-I293 HydrophobicContact SD-CG1 3.67Å; M99-F478 HydrophobicContact CG-CB 4.24Å; M99-F478 HydrophobicContact CG-CD2 3.9Å; M99-F478 HydrophobicContact CG-CG 4.25Å; M99-F478 HydrophobicContact SD-CD2 3.82Å; M99-F478 HydrophobicContact SD-CE2 4.09Å; M99-F478 HydrophobicContact SD-CG 4.14Å
100I84.3Confident84.6Confident33 Ų3336.4 Ų36.417%0.16917%0.171CC..Hα-helixtrans-62.6-44.5177-66162.6000110.3L96 T97 G102 Y103 I104 F285L96-I100 WeakPolarHBondContact O-CD1 3.35Å; L96-I100 WeakPolarHBondContact O-CG1 3.45Å; T97-I100 PolarHBondContact O-N 3.29Å; T97-I100 VanDerWaalsContact O-N 3.13Å; I100-G102 VanDerWaalsContact C-N 3.3Å; I100-G102 PolarHBondContact O-N 2.97Å; I100-Y103 WeakPolarHBondContact O-CB 3.44Å; I100-Y103 PolarHBondContact O-N 2.86Å; I100-I104 HydrophobicContact CG2-CD1 3.74Å; I100-I104 HydrophobicContact CG2-CG1 4.3Å; I100-I104 WeakPolarHBondContact O-CG1 3.25Å; I100-I104 PolarHBondContact O-N 3.32Å; I100-F285 HydrophobicContact CD1-CE1 4.18Å; I100-F285 HydrophobicContact CD1-CE2 4.09Å; I100-F285 HydrophobicContact CD1-CZ 3.47Å; I100-F285 VanDerWaalsContact CD1-CZ 3.47Å
101I85.8Confident84.7Confident9 Ų941 Ų415%0.04619%0.188CC..Hα-helixtrans-57.8-44.9175.4-73.3165.3000110.1T97 M99 Y103 I104 S105 S113 M117 Q161T97-I101 VanDerWaalsContact O-CB 3.32Å; T97-I101 WeakPolarHBondContact O-CB 3.42Å; T97-I101 WeakPolarHBondContact O-CD1 3.33Å; T97-I101 WeakPolarHBondContact O-CG1 3.33Å; T97-I101 PolarHBondContact O-N 3.13Å; M99-I101 VanDerWaalsContact C-N 3.34Å; I101-Y103 VanDerWaalsContact C-N 3.34Å; I101-Y103 PolarHBondContact O-N 2.64Å; I101-I104 PolarHBondContact O-N 2.87Å; I101-S105 WeakPolarHBondContact O-CB 3.32Å; I101-S105 PolarHBondContact O-N 2.94Å; I101-S113 WeakPolarHBondContact CG2-OG 3.35Å; I101-M117 HydrophobicContact CD1-CG 3.74Å; I101-M117 HydrophobicContact CD1-SD 4.24Å; I101-M117 HydrophobicContact CG1-CG 4.28Å; I101-M117 HydrophobicContact CG2-CE 4.23Å; I101-M117 HydrophobicContact CG2-CG 4.09Å; I101-M117 HydrophobicContact CG2-SD 3.28Å; I101-M117 WeakPolarHBondContact CG2-SD 3.41Å; I101-Q161 HydrophobicContact CG2-CG 4Å
102G80.9Confident84.7Confident1 Ų144.7 Ų44.71%0.0121%0.207CC..Hα-helixtrans-55-46.7174.300000113.5T98 M99 I100 S105 D106 S474T98-G102 PolarHBondContact O-N 3.37Å; T98-G102 VanDerWaalsContact O-N 3.16Å; M99-G102 PolarHBondContact O-N 3.4Å; I100-G102 VanDerWaalsContact C-N 3.3Å; I100-G102 PolarHBondContact O-N 2.97Å; G102-S105 WeakPolarHBondContact O-CB 3.42Å; G102-S105 PolarHBondContact O-N 3.28Å; G102-D106 PolarHBondContact O-N 2.91Å; G102-D106 VanDerWaalsContact O-N 3.1Å; G102-S474 WeakPolarHBondContact CA-OG 3.42Å
103Y81.9Confident84.8Confident87 Ų8739.8 Ų39.834%0.34118%0.182SC..Hα-helixtrans-64.6-45.5176.7176.2-95.2000112.8M99 I100 I101 S105 D106 R107 V288M99-Y103 PolarHBondContact O-N 3.3Å; M99-Y103 VanDerWaalsContact O-N 3.1Å; I100-Y103 WeakPolarHBondContact O-CB 3.44Å; I100-Y103 PolarHBondContact O-N 2.86Å; I101-Y103 VanDerWaalsContact C-N 3.34Å; I101-Y103 PolarHBondContact O-N 2.64Å; Y103-S105 VanDerWaalsContact C-N 3.26Å; Y103-S105 PolarHBondContact O-N 2.86Å; Y103-D106 PolarHBondContact O-N 2.77Å; Y103-R107 PolarHBondContact O-N 2.95Å; Y103-R107 PolarHBondContact OH-NH1 3.37Å; Y103-V288 HydrophobicContact CE1-CG1 4.27Å
104I83.8Confident85Confident40 Ų4037.6 Ų37.621%0.20517%0.17CC..Hα-helixtrans-59.5-42.9176.3-70.8171.2000110I100 I101 R107 F108 I116I100-I104 HydrophobicContact CG2-CD1 3.74Å; I100-I104 HydrophobicContact CG2-CG1 4.3Å; I100-I104 WeakPolarHBondContact O-CG1 3.25Å; I100-I104 PolarHBondContact O-N 3.32Å; I101-I104 PolarHBondContact O-N 2.87Å; I104-R107 PolarHBondContact O-N 3.44Å; I104-F108 HydrophobicContact CB-CD2 4.47Å; I104-F108 HydrophobicContact CG2-CB 4.5Å; I104-F108 HydrophobicContact CG2-CD2 4.02Å; I104-F108 WeakPolarHBondContact O-CB 3.27Å; I104-F108 PolarHBondContact O-N 3.41Å; I104-I116 HydrophobicContact CG2-CD1 4.34Å
105S86.3Confident85.3Confident0 Ų038.2 Ų38.20%018%0.176CC..Hα-helixtrans-62.7-43.2-178.2-167.70000112.7I101 G102 Y103 R107 G109 R110 Q161I101-S105 WeakPolarHBondContact O-CB 3.32Å; I101-S105 PolarHBondContact O-N 2.94Å; G102-S105 WeakPolarHBondContact O-CB 3.42Å; G102-S105 PolarHBondContact O-N 3.28Å; Y103-S105 VanDerWaalsContact C-N 3.26Å; Y103-S105 PolarHBondContact O-N 2.86Å; S105-R107 VanDerWaalsContact C-N 3.32Å; S105-R107 PolarHBondContact O-N 3.5Å; S105-G109 CarbonylContact O-C 3.52Å; S105-G109 VanDerWaalsContact O-C 3.23Å; S105-G109 WeakPolarHBondContact O-CA 3.48Å; S105-G109 PolarHBondContact O-N 2.97Å; S105-R110 VanDerWaalsContact CB-NH1 3.34Å; S105-R110 WeakPolarHBondContact OG-CD 3.38Å; S105-R110 PolarHBondContact OG-NH1 2.93Å; S105-Q161 PolarHBondContact OG-OE1 3.44Å
106D79.1Confident85.5Confident37 Ų3740.3 Ų40.320%0.19819%0.187CC..Hα-helixtrans-68.8-28.8177-73.7-19.2000112.5G102 Y103 R110 G470 M471G102-D106 PolarHBondContact O-N 2.91Å; G102-D106 VanDerWaalsContact O-N 3.1Å; Y103-D106 PolarHBondContact O-N 2.77Å; D106-R110 IonicContact OD1-CZ 3.75Å; D106-R110 IonicContact OD1-NH1 2.95Å; D106-R110 PolarHBondContact OD1-NH1 3.32Å; D106-R110 IonicContact OD1-NH2 3.67Å; D106-R110 PolarHBondContact OD1-NH2 3.48Å; D106-G470 VanDerWaalsContact OD1-CA 3.31Å; D106-G470 WeakPolarHBondContact OD1-CA 3.49Å; D106-M471 PolarHBondContact OD2-N 2.67Å
107R79Confident86.1Confident136 Ų13636.6 Ų36.651%0.51317%0.167SC..Hα-helixtrans-94.7-42.5-174.3-171.5172-176.4177.8-1.7114.6Y103 I104 S105Y103-R107 PolarHBondContact O-N 2.95Å; Y103-R107 PolarHBondContact OH-NH1 3.37Å; I104-R107 PolarHBondContact O-N 3.44Å; S105-R107 VanDerWaalsContact C-N 3.32Å; S105-R107 PolarHBondContact O-N 3.5Å
108F81.5Confident86.4Confident114 Ų11435.8 Ų35.850%0.516%0.163SC..Hα-helixtrans-108-7-172.7-62.9-77.2000113.2I104 L112I104-F108 HydrophobicContact CB-CD2 4.47Å; I104-F108 HydrophobicContact CG2-CB 4.5Å; I104-F108 HydrophobicContact CG2-CD2 4.02Å; I104-F108 WeakPolarHBondContact O-CB 3.27Å; I104-F108 PolarHBondContact O-N 3.41Å; F108-L112 HydrophobicContact CB-CD2 3.57Å; F108-L112 HydrophobicContact CG-CD2 4.21Å
109G83.3Confident86.8Confident2 Ų240.1 Ų40.12%0.02119%0.185CC..  trans107.2155.5-179.200000113.5S105 S113 E245S105-G109 CarbonylContact O-C 3.52Å; S105-G109 VanDerWaalsContact O-C 3.23Å; S105-G109 WeakPolarHBondContact O-CA 3.48Å; S105-G109 PolarHBondContact O-N 2.97Å; G109-S113 PolarHBondContact O-N 3.02Å; G109-E245 VanDerWaalsContact C-OE1 3.26Å; G109-E245 VanDerWaalsContact CA-OE1 3.25Å; G109-E245 WeakPolarHBondContact CA-OE1 3.5Å
110R87.4Confident87.4Confident5 Ų539.5 Ų39.52%0.01918%0.181CC..Hα-helixtrans-68.4-37.5179.2-54.5-49.8-172.3-163.9-10.7112.1S105 D106 L112 S113 L114 D168 E245 S246S105-R110 VanDerWaalsContact CB-NH1 3.34Å; S105-R110 WeakPolarHBondContact OG-CD 3.38Å; S105-R110 PolarHBondContact OG-NH1 2.93Å; D106-R110 IonicContact OD1-CZ 3.75Å; D106-R110 IonicContact OD1-NH1 2.95Å; D106-R110 PolarHBondContact OD1-NH1 3.32Å; D106-R110 IonicContact OD1-NH2 3.67Å; D106-R110 PolarHBondContact OD1-NH2 3.48Å; R110-L112 PolarHBondContact O-N 2.98Å; R110-S113 WeakPolarHBondContact O-CB 3.49Å; R110-S113 PolarHBondContact O-N 3.03Å; R110-L114 WeakPolarHBondContact O-CG 3.48Å; R110-L114 PolarHBondContact O-N 2.92Å; R110-D168 IonicContact CZ-OD2 3.23Å; R110-D168 IonicContact NE-OD2 2.7Å; R110-D168 PolarHBondContact NE-OD2 3.17Å; R110-D168 IonicContact NH2-OD1 3.05Å; R110-D168 IonicContact NH2-OD2 3.25Å; R110-E245 PolarHBondContact N-OE1 2.98Å; R110-S246 WeakPolarHBondContact CB-OG 3.28Å; R110-S246 WeakPolarHBondContact CG-OG 3.13Å
111R90.1Very high87.9Confident116 Ų11637.9 Ų37.944%0.43817%0.173SC..Hα-helixtrans-62.4-44.9-178.7-170.6-174.678.21723.7111.2L114 G115 I240 L243 E245R111-L114 PolarHBondContact O-N 2.93Å; R111-G115 PolarHBondContact O-N 3.48Å; R111-I240 HydrophobicContact CG-CD1 4.27Å; R111-L243 WeakPolarHBondContact CD-O 3.33Å; R111-L243 HydrophobicContact CG-CB 4.47Å; R111-E245 WeakPolarHBondContact CB-OE2 3.28Å; R111-E245 PolarHBondContact N-OE1 3.4Å; R111-E245 PolarHBondContact N-OE2 3.3Å
112L89.6Confident88.3Confident84 Ų8437.7 Ų37.744%0.4417%0.173SC..Hα-helixtrans-62.5-46.8178.9-178.367.1000110.6F108 R110 G115 I116F108-L112 HydrophobicContact CB-CD2 3.57Å; F108-L112 HydrophobicContact CG-CD2 4.21Å; R110-L112 PolarHBondContact O-N 2.98Å; L112-G115 PolarHBondContact O-N 3.47Å; L112-I116 HydrophobicContact CD1-CD1 4.46Å; L112-I116 HydrophobicContact CG-CD1 4.11Å; L112-I116 WeakPolarHBondContact O-CG1 3.23Å; L112-I116 PolarHBondContact O-N 3.49Å
113S90.3Very high89Confident1 Ų140.5 Ų40.51%0.00719%0.188CC..Hα-helixtrans-54.9-54.3176.3-177.40000111.5I101 G109 R110 G115 I116 M117I101-S113 WeakPolarHBondContact CG2-OG 3.35Å; G109-S113 PolarHBondContact O-N 3.02Å; R110-S113 WeakPolarHBondContact O-CB 3.49Å; R110-S113 PolarHBondContact O-N 3.03Å; S113-G115 VanDerWaalsContact C-N 3.28Å; S113-G115 PolarHBondContact O-N 2.99Å; S113-I116 PolarHBondContact O-N 3.33Å; S113-M117 WeakPolarHBondContact O-CG 3.28Å; S113-M117 PolarHBondContact O-N 2.72Å
114L92.2Very high89.6Confident2 Ų236.7 Ų36.71%0.0117%0.173CC..Hα-helixtrans-58.5-39.4177.7-75.2171.5000112.1L18 R110 R111 M117 I118 I158 Q161 V162 I240 L243L18-L114 HydrophobicContact CD1-CD1 4.42Å; R110-L114 WeakPolarHBondContact O-CG 3.48Å; R110-L114 PolarHBondContact O-N 2.92Å; R111-L114 PolarHBondContact O-N 2.93Å; L114-M117 PolarHBondContact O-N 3.07Å; L114-I118 WeakPolarHBondContact O-CD1 3.46Å; L114-I118 VanDerWaalsContact O-CG1 3.23Å; L114-I118 WeakPolarHBondContact O-CG1 3.27Å; L114-I118 PolarHBondContact O-N 3.47Å; L114-I158 HydrophobicContact CD2-CG2 4.37Å; L114-Q161 HydrophobicContact CD2-CB 3.66Å; L114-Q161 HydrophobicContact CG-CB 4.11Å; L114-V162 HydrophobicContact CD2-CG2 4.47Å; L114-I240 HydrophobicContact CB-CD1 3.98Å; L114-L243 HydrophobicContact CD1-CD2 4Å
115G92.4Very high90.1Very high12 Ų1234.8 Ų34.812%0.12416%0.163CC..Hα-helixtrans-62.7-46.5177.700000113.5R111 L112 S113 M117 I118 I119R111-G115 PolarHBondContact O-N 3.48Å; L112-G115 PolarHBondContact O-N 3.47Å; S113-G115 VanDerWaalsContact C-N 3.28Å; S113-G115 PolarHBondContact O-N 2.99Å; G115-M117 PolarHBondContact O-N 3.2Å; G115-I118 PolarHBondContact O-N 3.19Å; G115-I119 WeakPolarHBondContact O-CD1 3.41Å; G115-I119 VanDerWaalsContact O-CG1 3.27Å; G115-I119 WeakPolarHBondContact O-CG1 3.44Å; G115-I119 PolarHBondContact O-N 2.95Å
116I92.4Very high90.6Very high58 Ų5838.8 Ų38.830%0.29718%0.184SC..Hα-helixtrans-57.1-42.8176-68.4166.8000110.3I104 L112 S113 I119 G120 I151I104-I116 HydrophobicContact CG2-CD1 4.34Å; L112-I116 HydrophobicContact CD1-CD1 4.46Å; L112-I116 HydrophobicContact CG-CD1 4.11Å; L112-I116 WeakPolarHBondContact O-CG1 3.23Å; L112-I116 PolarHBondContact O-N 3.49Å; S113-I116 PolarHBondContact O-N 3.33Å; I116-I119 PolarHBondContact O-N 3.45Å; I116-G120 PolarHBondContact O-N 3.22Å; I116-G120 VanDerWaalsContact O-N 3.08Å; I116-I151 HydrophobicContact CG2-CG2 4.29Å
117M93.2Very high91.3Very high0 Ų038.6 Ų38.60%018%0.184CC..Hα-helixtrans-68-47-176.6-63.5159.161.900111.8I101 S113 L114 G115 I119 G120 E121 G152 S157 I158 Q161I101-M117 HydrophobicContact CD1-CG 3.74Å; I101-M117 HydrophobicContact CD1-SD 4.24Å; I101-M117 HydrophobicContact CG1-CG 4.28Å; I101-M117 HydrophobicContact CG2-CE 4.23Å; I101-M117 HydrophobicContact CG2-CG 4.09Å; I101-M117 HydrophobicContact CG2-SD 3.28Å; I101-M117 WeakPolarHBondContact CG2-SD 3.41Å; S113-M117 WeakPolarHBondContact O-CG 3.28Å; S113-M117 PolarHBondContact O-N 2.72Å; L114-M117 PolarHBondContact O-N 3.07Å; G115-M117 PolarHBondContact O-N 3.2Å; M117-I119 PolarHBondContact O-N 2.91Å; M117-G120 PolarHBondContact O-N 3.06Å; M117-E121 WeakPolarHBondContact O-CG 3.34Å; M117-E121 PolarHBondContact O-N 3.03Å; M117-G152 WeakPolarHBondContact CB-O 2.96Å; M117-G152 WeakPolarHBondContact CG-O 3.33Å; M117-S157 WeakPolarHBondContact CE-OG 3.07Å; M117-I158 HydrophobicContact CB-CG1 4.25Å; M117-I158 HydrophobicContact CE-CB 3.95Å; M117-I158 HydrophobicContact CE-CG1 3.38Å; M117-Q161 HydrophobicContact CE-CG 4.02Å; M117-Q161 HydrophobicContact SD-CG 3.72Å
118I94Very high92.1Very high1 Ų132.3 Ų32.31%0.00516%0.16CC..Hα-helixtrans-60.7-35.8176.7-64.9164.4000111L21 L25 L114 G115 E121 A122 I233 L237 I240L21-I118 HydrophobicContact CD1-CD1 3.9Å; L21-I118 HydrophobicContact CD2-CD1 4.05Å; L21-I118 HydrophobicContact CG-CD1 4.23Å; L25-I118 HydrophobicContact CD1-CG1 4.42Å; L25-I118 HydrophobicContact CD1-CG2 4.47Å; L25-I118 HydrophobicContact CD2-CD1 4.36Å; L25-I118 HydrophobicContact CD2-CG1 3.92Å; L114-I118 WeakPolarHBondContact O-CD1 3.46Å; L114-I118 VanDerWaalsContact O-CG1 3.23Å; L114-I118 WeakPolarHBondContact O-CG1 3.27Å; L114-I118 PolarHBondContact O-N 3.47Å; G115-I118 PolarHBondContact O-N 3.19Å; I118-E121 PolarHBondContact O-N 3.43Å; I118-A122 WeakPolarHBondContact O-CB 3.19Å; I118-A122 PolarHBondContact O-N 3.25Å; I118-I233 HydrophobicContact CG2-CD1 4.17Å; I118-L237 HydrophobicContact CG2-CD2 3.67Å; I118-L237 HydrophobicContact CG2-CG 4.02Å; I118-I240 HydrophobicContact CD1-CB 4.3Å; I118-I240 HydrophobicContact CD1-CD1 4.07Å; I118-I240 HydrophobicContact CD1-CG1 4.3Å
119I94Very high92.7Very high91 Ų9127.3 Ų27.347%0.46714%0.14SC..Hα-helixtrans-63.8-43.8174.3-68.9164.7000110.9G115 I116 M117 E121 A122 L123 L237G115-I119 WeakPolarHBondContact O-CD1 3.41Å; G115-I119 VanDerWaalsContact O-CG1 3.27Å; G115-I119 WeakPolarHBondContact O-CG1 3.44Å; G115-I119 PolarHBondContact O-N 2.95Å; I116-I119 PolarHBondContact O-N 3.45Å; M117-I119 PolarHBondContact O-N 2.91Å; I119-E121 VanDerWaalsContact C-N 3.34Å; I119-E121 PolarHBondContact O-N 3Å; I119-A122 PolarHBondContact O-N 3.47Å; I119-L123 HydrophobicContact CG2-CD1 4.35Å; I119-L123 WeakPolarHBondContact O-CG 3.46Å; I119-L123 PolarHBondContact O-N 3.23Å; I119-L237 HydrophobicContact CG1-CD2 4.17Å
120G93.7Very high93.3Very high0 Ų030.9 Ų30.90%016%0.161CC..Hα-helixtrans-60.1-43.8176.100000112.8I116 M117 L123 Q124I116-G120 PolarHBondContact O-N 3.22Å; I116-G120 VanDerWaalsContact O-N 3.08Å; M117-G120 PolarHBondContact O-N 3.06Å; G120-L123 PolarHBondContact O-N 2.94Å; G120-Q124 PolarHBondContact O-N 3.48Å
121E94Very high93.6Very high0 Ų031.3 Ų31.30%016%0.163CC..Hα-helixtrans-65.4-38.1175.5-65.7-64.6-174.600112.8L29 M117 I118 I119 Q124 I125 G154 L155 I158L29-E121 HydrophobicContact CD1-CG 4.4Å; L29-E121 HydrophobicContact CD2-CB 3.77Å; L29-E121 VanDerWaalsContact CD2-CD 3.41Å; L29-E121 HydrophobicContact CD2-CG 3.8Å; L29-E121 WeakPolarHBondContact CD2-OE2 3.13Å; M117-E121 WeakPolarHBondContact O-CG 3.34Å; M117-E121 PolarHBondContact O-N 3.03Å; I118-E121 PolarHBondContact O-N 3.43Å; I119-E121 VanDerWaalsContact C-N 3.34Å; I119-E121 PolarHBondContact O-N 3Å; E121-Q124 WeakPolarHBondContact O-CB 3.13Å; E121-Q124 PolarHBondContact O-N 3.44Å; E121-Q124 PolarHBondContact OE2-OE1 3.01Å; E121-I125 WeakPolarHBondContact O-CG1 3.47Å; E121-I125 PolarHBondContact O-N 3.1Å; E121-G154 VanDerWaalsContact OE1-CA 3.24Å; E121-G154 WeakPolarHBondContact OE1-CA 3.42Å; E121-L155 PolarHBondContact OE1-N 3.22Å; E121-I158 HydrophobicContact CG-CD1 3.94Å
122A95Very high93.7Very high5 Ų526 Ų264%0.04114%0.144CC..Hα-helixtrans-63.8-42.2174.400000112I118 I119 Q124 I125 I126 I233 L237I118-A122 WeakPolarHBondContact O-CB 3.19Å; I118-A122 PolarHBondContact O-N 3.25Å; I119-A122 PolarHBondContact O-N 3.47Å; A122-Q124 VanDerWaalsContact C-N 3.32Å; A122-Q124 PolarHBondContact O-N 3.23Å; A122-I125 PolarHBondContact O-N 3.15Å; A122-I126 WeakPolarHBondContact O-CB 3.22Å; A122-I126 WeakPolarHBondContact O-CD1 3.48Å; A122-I126 WeakPolarHBondContact O-CG1 3.4Å; A122-I126 PolarHBondContact O-N 2.88Å; A122-I233 HydrophobicContact CB-CD1 4.35Å; A122-I233 HydrophobicContact CB-CG1 3.7Å; A122-L237 HydrophobicContact CB-CD1 3.78Å; A122-L237 HydrophobicContact CB-CD2 4.45Å; A122-L237 HydrophobicContact CB-CG 4.37Å
123L95.3Very high93.8Very high60 Ų6026.6 Ų26.631%0.31415%0.147SC..Hα-helixtrans-61.8-40.2174.7-71.7171.5000111.7I119 G120 T127 F147 I151I119-L123 HydrophobicContact CG2-CD1 4.35Å; I119-L123 WeakPolarHBondContact O-CG 3.46Å; I119-L123 PolarHBondContact O-N 3.23Å; G120-L123 PolarHBondContact O-N 2.94Å; L123-T127 VanDerWaalsContact O-CB 3.28Å; L123-T127 WeakPolarHBondContact O-CB 3.32Å; L123-T127 PolarHBondContact O-N 3.24Å; L123-T127 PolarHBondContact O-OG1 3.23Å; L123-F147 HydrophobicContact CB-CB 3.98Å; L123-F147 HydrophobicContact CB-CD1 3.97Å; L123-F147 HydrophobicContact CB-CD2 4.38Å; L123-F147 HydrophobicContact CB-CG 3.86Å; L123-F147 HydrophobicContact CD1-CD1 4.05Å; L123-F147 HydrophobicContact CD1-CE1 4.39Å; L123-I151 HydrophobicContact CD1-CD1 3.8Å
124Q94.5Very high93.9Very high6 Ų632.7 Ų32.73%0.02818%0.179CC..Hα-helixtrans-58.5-53.9173176.9-166.2-13.700110.9G120 E121 A122 I126 T127 L128 P144 F147 D148G120-Q124 PolarHBondContact O-N 3.48Å; E121-Q124 WeakPolarHBondContact O-CB 3.13Å; E121-Q124 PolarHBondContact O-N 3.44Å; E121-Q124 PolarHBondContact OE2-OE1 3.01Å; A122-Q124 VanDerWaalsContact C-N 3.32Å; A122-Q124 PolarHBondContact O-N 3.23Å; Q124-I126 PolarHBondContact O-N 3.48Å; Q124-T127 PolarHBondContact O-N 2.86Å; Q124-L128 WeakPolarHBondContact O-CB 3.29Å; Q124-L128 PolarHBondContact O-N 3.17Å; Q124-P144 HydrophobicContact CG-CB 3.77Å; Q124-P144 WeakPolarHBondContact CG-O 3.47Å; Q124-F147 HydrophobicContact CB-CB 4.4Å; Q124-D148 VanDerWaalsContact OE1-CB 3.26Å
125I95.1Very high93.8Very high1 Ų138.6 Ų38.61%0.00521%0.206CC..Hα-helixtrans-60.6-46.3-176.6-70.7168.2000110.9A28 L29 C32 E121 A122 T127 L128 S129 C229 I233A28-I125 HydrophobicContact CB-CD1 3.97Å; L29-I125 HydrophobicContact CD2-CD1 4.34Å; C32-I125 HydrophobicContact CB-CG1 3.91Å; E121-I125 WeakPolarHBondContact O-CG1 3.47Å; E121-I125 PolarHBondContact O-N 3.1Å; A122-I125 PolarHBondContact O-N 3.15Å; I125-T127 PolarHBondContact O-N 2.86Å; I125-L128 PolarHBondContact O-N 3.14Å; I125-S129 WeakPolarHBondContact O-CB 3.44Å; I125-S129 PolarHBondContact O-N 3.21Å; I125-S129 PolarHBondContact O-OG 2.97Å; I125-C229 HydrophobicContact CG2-CB 4.49Å; I125-C229 VanDerWaalsContact CG2-SG 3.55Å; I125-I233 HydrophobicContact CD1-CB 3.8Å; I125-I233 HydrophobicContact CD1-CD1 4.18Å; I125-I233 HydrophobicContact CD1-CG1 3.92Å; I125-I233 HydrophobicContact CD1-CG2 4.18Å; I125-I233 HydrophobicContact CG2-CG2 4.12Å
126I95.8Very high93.7Very high84 Ų8439.1 Ų39.143%0.43121%0.209SC..Hα-helixtrans-62.3-45179.7-68165.1000110.3A122 Q124 S129 V130A122-I126 WeakPolarHBondContact O-CB 3.22Å; A122-I126 WeakPolarHBondContact O-CD1 3.48Å; A122-I126 WeakPolarHBondContact O-CG1 3.4Å; A122-I126 PolarHBondContact O-N 2.88Å; Q124-I126 PolarHBondContact O-N 3.48Å; I126-S129 WeakPolarHBondContact O-CB 3.38Å; I126-S129 PolarHBondContact O-N 3.39Å; I126-V130 WeakPolarHBondContact O-CG2 3.26Å; I126-V130 PolarHBondContact O-N 3.18Å
127T95.1Very high93.7Very high32 Ų3240.2 Ų40.220%0.19622%0.216CC..Hα-helixtrans-64.5-43.7179.7-54.80000111.5L123 Q124 I125 S129 V130 I131 I143 P144 F147L123-T127 VanDerWaalsContact O-CB 3.28Å; L123-T127 WeakPolarHBondContact O-CB 3.32Å; L123-T127 PolarHBondContact O-N 3.24Å; L123-T127 PolarHBondContact O-OG1 3.23Å; Q124-T127 PolarHBondContact O-N 2.86Å; I125-T127 PolarHBondContact O-N 2.86Å; T127-S129 VanDerWaalsContact C-N 3.3Å; T127-S129 PolarHBondContact O-N 2.88Å; T127-V130 PolarHBondContact O-N 3.41Å; T127-I131 HydrophobicContact CG2-CD1 4.14Å; T127-I131 WeakPolarHBondContact O-CG1 3.24Å; T127-I131 PolarHBondContact O-N 2.92Å; T127-I131 VanDerWaalsContact O-N 3.1Å; T127-I143 HydrophobicContact CG2-CG2 4.04Å; T127-P144 HydrophobicContact CG2-CG 3.94Å; T127-F147 HydrophobicContact CG2-CD2 4.47Å; T127-F147 HydrophobicContact CG2-CE2 4.14Å; T127-F147 VanDerWaalsContact OG1-CE2 3.3Å; T127-F147 WeakPolarHBondContact OG1-CE2 3.1Å
128L94.6Very high93.6Very high5 Ų540.2 Ų40.23%0.02622%0.216CC..Hα-helixtrans-62.1-41.5175.6-177.869.2000110.9C32 I35 Q124 I125 V130 I131 V132 T141 P144C32-L128 WeakPolarHBondContact O-CD2 3.34Å; C32-L128 WeakPolarHBondContact SG-CD2 3.24Å; I35-L128 HydrophobicContact CG2-CD2 4.47Å; Q124-L128 WeakPolarHBondContact O-CB 3.29Å; Q124-L128 PolarHBondContact O-N 3.17Å; I125-L128 PolarHBondContact O-N 3.14Å; L128-V130 VanDerWaalsContact C-N 3.31Å; L128-V130 PolarHBondContact O-N 3.33Å; L128-I131 PolarHBondContact O-N 3.49Å; L128-I131 VanDerWaalsContact O-N 3.17Å; L128-V132 HydrophobicContact CD1-CG2 4.09Å; L128-V132 HydrophobicContact CG-CG2 4.2Å; L128-V132 WeakPolarHBondContact O-CG2 3.19Å; L128-V132 PolarHBondContact O-N 3.12Å; L128-T141 HydrophobicContact CD1-CG2 4.34Å; L128-P144 HydrophobicContact CB-CB 4.19Å; L128-P144 HydrophobicContact CB-CG 3.9Å; L128-P144 HydrophobicContact CD1-CG 4.24Å
129S95.1Very high93.4Very high9 Ų945.4 Ų45.46%0.06324%0.236CC..Hα-helixtrans-58-44.8178.3-58.30000111.4I125 I126 T127 L133 I226 N230I125-S129 WeakPolarHBondContact O-CB 3.44Å; I125-S129 PolarHBondContact O-N 3.21Å; I125-S129 PolarHBondContact O-OG 2.97Å; I126-S129 WeakPolarHBondContact O-CB 3.38Å; I126-S129 PolarHBondContact O-N 3.39Å; T127-S129 VanDerWaalsContact C-N 3.3Å; T127-S129 PolarHBondContact O-N 2.88Å; S129-L133 VanDerWaalsContact O-CB 3.22Å; S129-L133 WeakPolarHBondContact O-CB 3.39Å; S129-L133 WeakPolarHBondContact O-CG 3.32Å; S129-L133 PolarHBondContact O-N 3.44Å; S129-I226 WeakPolarHBondContact OG-CG2 3.36Å; S129-N230 PolarHBondContact OG-ND2 3.48Å
130V95.3Very high93.4Very high77 Ų7744.4 Ų44.447%0.46723%0.231SC..Hα-helixtrans-61.7-46.5175.7173.50000111.2I126 T127 L128 V132 L133 L134I126-V130 WeakPolarHBondContact O-CG2 3.26Å; I126-V130 PolarHBondContact O-N 3.18Å; T127-V130 PolarHBondContact O-N 3.41Å; L128-V130 VanDerWaalsContact C-N 3.31Å; L128-V130 PolarHBondContact O-N 3.33Å; V130-V132 PolarHBondContact O-N 3.36Å; V130-L133 PolarHBondContact O-N 2.94Å; V130-L134 HydrophobicContact CG1-CD1 3.63Å; V130-L134 HydrophobicContact CG1-CG 4.31Å; V130-L134 VanDerWaalsContact O-CB 3.3Å; V130-L134 WeakPolarHBondContact O-CB 3.48Å; V130-L134 VanDerWaalsContact O-CG 3.25Å; V130-L134 WeakPolarHBondContact O-CG 3.29Å; V130-L134 PolarHBondContact O-N 2.67Å
131I94.6Very high93.3Very high13 Ų1344.4 Ų44.47%0.06723%0.231CC..Hα-helixtrans-58.9-47.8-179.7-71.5161.4000111.3Y39 T127 L128 Q135 A136 L140 T141 P144Y39-I131 HydrophobicContact CE1-CG2 4.16Å; T127-I131 HydrophobicContact CG2-CD1 4.14Å; T127-I131 WeakPolarHBondContact O-CG1 3.24Å; T127-I131 PolarHBondContact O-N 2.92Å; T127-I131 VanDerWaalsContact O-N 3.1Å; L128-I131 PolarHBondContact O-N 3.49Å; L128-I131 VanDerWaalsContact O-N 3.17Å; I131-Q135 PolarHBondContact O-N 3.04Å; I131-A136 HydrophobicContact CG2-CB 4.27Å; I131-A136 PolarHBondContact O-N 3.44Å; I131-L140 HydrophobicContact CD1-CB 4.13Å; I131-L140 WeakPolarHBondContact CD1-O 3.29Å; I131-L140 HydrophobicContact CG1-CB 4.22Å; I131-L140 HydrophobicContact CG2-CB 4.32Å; I131-T141 HydrophobicContact CG2-CG2 4.25Å; I131-P144 VanDerWaalsContact CD1-CD 3.49Å; I131-P144 HydrophobicContact CD1-CG 3.6Å
132V92.6Very high93.2Very high6 Ų646.2 Ų46.24%0.03624%0.24CC..Hα-helixtrans-73.7-40.2-176.3178.80000111.5I35 Y39 L128 V130 L134 Q135 F222 I226I35-V132 HydrophobicContact CG2-CG2 4.38Å; Y39-V132 HydrophobicContact CD1-CG2 4.03Å; Y39-V132 HydrophobicContact CD2-CB 4.12Å; Y39-V132 HydrophobicContact CD2-CG1 3.58Å; Y39-V132 HydrophobicContact CD2-CG2 3.82Å; Y39-V132 HydrophobicContact CE1-CG2 4.42Å; Y39-V132 HydrophobicContact CE2-CB 4.21Å; Y39-V132 HydrophobicContact CE2-CG1 3.84Å; Y39-V132 HydrophobicContact CE2-CG2 4.22Å; Y39-V132 HydrophobicContact CG-CB 4.5Å; Y39-V132 HydrophobicContact CG-CG1 4.28Å; Y39-V132 HydrophobicContact CG-CG2 3.7Å; L128-V132 HydrophobicContact CD1-CG2 4.09Å; L128-V132 HydrophobicContact CG-CG2 4.2Å; L128-V132 WeakPolarHBondContact O-CG2 3.19Å; L128-V132 PolarHBondContact O-N 3.12Å; V130-V132 PolarHBondContact O-N 3.36Å; V132-L134 VanDerWaalsContact C-N 3.32Å; V132-L134 PolarHBondContact O-N 3.35Å; V132-Q135 PolarHBondContact O-N 3.48Å; V132-F222 HydrophobicContact CG1-CB 3.6Å; V132-F222 HydrophobicContact CG1-CD1 3.9Å; V132-F222 HydrophobicContact CG1-CG 3.85Å; V132-I226 HydrophobicContact CB-CD1 3.48Å; V132-I226 VanDerWaalsContact CB-CD1 3.48Å; V132-I226 HydrophobicContact CG1-CD1 3.35Å; V132-I226 HydrophobicContact CG2-CD1 4.32Å
133L91.8Very high93.1Very high95 Ų9549.4 Ų49.450%0.49726%0.256SS..Hα-helixtrans-65.7-35.2177.8-71.4173.3000112.4S129 V130 Q135 R223 I226S129-L133 VanDerWaalsContact O-CB 3.22Å; S129-L133 WeakPolarHBondContact O-CB 3.39Å; S129-L133 WeakPolarHBondContact O-CG 3.32Å; S129-L133 PolarHBondContact O-N 3.44Å; V130-L133 PolarHBondContact O-N 2.94Å; L133-Q135 PolarHBondContact O-N 2.91Å; L133-R223 HydrophobicContact CD2-CG 4.25Å; L133-I226 HydrophobicContact CD1-CG2 4.26Å; L133-I226 HydrophobicContact CD2-CD1 4.44Å; L133-I226 HydrophobicContact CG-CD1 4.34Å; L133-I226 HydrophobicContact CG-CG2 4.35Å
134L92.2Very high93Very high129 Ų12946.7 Ų46.768%0.67524%0.242SC*.THydrogen-bonded Turntrans-80.3-0.9173.9-65.6177.9000113.3V130 V132 A136V130-L134 HydrophobicContact CG1-CD1 3.63Å; V130-L134 HydrophobicContact CG1-CG 4.31Å; V130-L134 VanDerWaalsContact O-CB 3.3Å; V130-L134 WeakPolarHBondContact O-CB 3.48Å; V130-L134 VanDerWaalsContact O-CG 3.25Å; V130-L134 WeakPolarHBondContact O-CG 3.29Å; V130-L134 PolarHBondContact O-N 2.67Å; V132-L134 VanDerWaalsContact C-N 3.32Å; V132-L134 PolarHBondContact O-N 3.35Å; L134-A136 PolarHBondContact O-N 3Å
135Q88.8Confident92.7Very high126 Ų12646.5 Ų46.559%0.58924%0.241SC*.THydrogen-bonded Turntrans5139-175.6-57.5-177.1-5.200112.8Y39 R43 I131 V132 L133Y39-Q135 VanDerWaalsContact OH-CA 3.26Å; Y39-Q135 WeakPolarHBondContact OH-CA 3.4Å; R43-Q135 PolarHBondContact NH1-O 2.98Å; I131-Q135 PolarHBondContact O-N 3.04Å; V132-Q135 PolarHBondContact O-N 3.48Å; L133-Q135 PolarHBondContact O-N 2.91Å
136A90.8Very high92.6Very high23 Ų2349.5 Ų49.519%0.1926%0.257CS..  trans-74.1170.4-172.600000112.8Y39 I131 L134 L140Y39-A136 PolarHBondContact OH-N 3.08Å; Y39-A136 PolarHBondContact OH-O 2.93Å; I131-A136 HydrophobicContact CG2-CB 4.27Å; I131-A136 PolarHBondContact O-N 3.44Å; L134-A136 PolarHBondContact O-N 3Å; A136-L140 HydrophobicContact CB-CD1 3.63Å
137N92Very high92.4Very high81 Ų8148.6 Ų48.643%0.43325%0.25SC..  trans-54.9134.3-177.9-174.2-39.4000111.9W139 L140N137-W139 PolarHBondContact O-N 3.36Å; N137-W139 VanDerWaalsContact O-N 3.1Å; N137-W139 WeakPolarHBondContact OD1-CB 3.48Å; N137-W139 PolarHBondContact OD1-N 3.27Å; N137-L140 HydrophobicContact CB-CD1 4.26Å; N137-L140 HydrophobicContact CB-CG 4.41Å; N137-L140 WeakPolarHBondContact O-CB 3.33Å; N137-L140 PolarHBondContact O-N 2.97Å
138P90.8Very high92.1Very high1 Ų147.1 Ų47.11%0.00624%0.241CC..G310 helixtrans-56.4-26.4179.521.8-34.4000114.3V40 R43 I82 L140 T141V40-P138 HydrophobicContact CG2-CB 4.5Å; R43-P138 HydrophobicContact CB-CB 4.12Å; R43-P138 HydrophobicContact CB-CG 4.07Å; I82-P138 HydrophobicContact CD1-CB 4.34Å; I82-P138 HydrophobicContact CD1-CG 4.35Å; P138-L140 PolarHBondContact O-N 3.48Å; P138-T141 WeakPolarHBondContact O-CB 3.31Å; P138-T141 WeakPolarHBondContact O-CG2 3.48Å; P138-T141 PolarHBondContact O-N 3.3Å; P138-T141 VanDerWaalsContact O-N 3.14Å; P138-T141 PolarHBondContact O-OG1 2.99Å
139W91.4Very high91.7Very high110 Ų11046.9 Ų46.942%0.41724%0.24SC..G310 helixtrans-62.8-24.8174.5-72.6106.7000113.8I82 N137 T141 I142I82-W139 HydrophobicContact CD1-CD2 4.21Å; I82-W139 HydrophobicContact CD1-CZ2 4.1Å; I82-W139 HydrophobicContact CG1-CD2 4.22Å; I82-W139 HydrophobicContact CG1-CE3 4.26Å; I82-W139 HydrophobicContact CG1-CH2 3.87Å; I82-W139 HydrophobicContact CG1-CZ2 3.82Å; I82-W139 HydrophobicContact CG1-CZ3 4.09Å; N137-W139 PolarHBondContact O-N 3.36Å; N137-W139 VanDerWaalsContact O-N 3.1Å; N137-W139 WeakPolarHBondContact OD1-CB 3.48Å; N137-W139 PolarHBondContact OD1-N 3.27Å; W139-T141 PolarHBondContact O-N 3.35Å; W139-I142 HydrophobicContact CE3-CD1 3.91Å; W139-I142 HydrophobicContact CZ3-CD1 4.32Å; W139-I142 PolarHBondContact O-N 3.19Å
140L93.8Very high91.5Very high70 Ų7051.3 Ų51.337%0.36626%0.262SS..G310 helixtrans-69.3-16.1177.3-65.8167.7000112.4I131 A136 N137 P138 I142 I143 P144I131-L140 HydrophobicContact CD1-CB 4.13Å; I131-L140 WeakPolarHBondContact CD1-O 3.29Å; I131-L140 HydrophobicContact CG1-CB 4.22Å; I131-L140 HydrophobicContact CG2-CB 4.32Å; A136-L140 HydrophobicContact CB-CD1 3.63Å; N137-L140 HydrophobicContact CB-CD1 4.26Å; N137-L140 HydrophobicContact CB-CG 4.41Å; N137-L140 WeakPolarHBondContact O-CB 3.33Å; N137-L140 PolarHBondContact O-N 2.97Å; P138-L140 PolarHBondContact O-N 3.48Å; L140-I142 PolarHBondContact O-N 3.05Å; L140-I142 VanDerWaalsContact O-N 3.1Å; L140-I143 HydrophobicContact CB-CD1 4.48Å; L140-I143 HydrophobicContact CD2-CD1 3.66Å; L140-I143 WeakPolarHBondContact O-CB 3.26Å; L140-I143 PolarHBondContact O-N 3.08Å; L140-P144 VanDerWaalsContact O-CD 3.3Å; L140-P144 WeakPolarHBondContact O-CD 3.46Å
141T91.8Very high91.2Very high0 Ų050.2 Ų50.20%025%0.253CS..G310 helixtrans-63.2-13.8176.462.30000113.9Y39 V40 N86 L128 I131 P138 W139 I143 P144Y39-T141 HydrophobicContact CD1-CG2 3.94Å; Y39-T141 HydrophobicContact CE1-CG2 4.31Å; V40-T141 HydrophobicContact CG2-CG2 3.82Å; N86-T141 PolarHBondContact ND2-O 3.47Å; N86-T141 PolarHBondContact OD1-O 3.21Å; L128-T141 HydrophobicContact CD1-CG2 4.34Å; I131-T141 HydrophobicContact CG2-CG2 4.25Å; P138-T141 WeakPolarHBondContact O-CB 3.31Å; P138-T141 WeakPolarHBondContact O-CG2 3.48Å; P138-T141 PolarHBondContact O-N 3.3Å; P138-T141 VanDerWaalsContact O-N 3.14Å; P138-T141 PolarHBondContact O-OG1 2.99Å; W139-T141 PolarHBondContact O-N 3.35Å; T141-I143 VanDerWaalsContact C-N 3.32Å; T141-P144 WeakPolarHBondContact O-CD 3.35Å
142I92Very high90.3Very high37 Ų3749.6 Ų49.619%0.1925%0.249CC..Hα-helixtrans-68.1-32.1171.6-61.2173.8000111.4C85 N86 V89 W139 L140 G145 L146C85-I142 HydrophobicContact CB-CD1 4.5Å; N86-I142 HydrophobicContact CB-CG1 4.33Å; V89-I142 HydrophobicContact CB-CG2 4.34Å; V89-I142 HydrophobicContact CG1-CG2 4.15Å; V89-I142 HydrophobicContact CG2-CG2 4.29Å; W139-I142 HydrophobicContact CE3-CD1 3.91Å; W139-I142 HydrophobicContact CZ3-CD1 4.32Å; W139-I142 PolarHBondContact O-N 3.19Å; L140-I142 PolarHBondContact O-N 3.05Å; L140-I142 VanDerWaalsContact O-N 3.1Å; I142-G145 WeakPolarHBondContact O-CA 3.38Å; I142-G145 PolarHBondContact O-N 2.84Å; I142-L146 PolarHBondContact O-N 3.18Å
143I92.9Very high89.7Confident72 Ų7249.3 Ų49.337%0.36925%0.248SC..Hα-helixtrans-61.8-48.7-176.3-58.8173.1000111.7T127 L140 T141 G145 L146 F147T127-I143 HydrophobicContact CG2-CG2 4.04Å; L140-I143 HydrophobicContact CB-CD1 4.48Å; L140-I143 HydrophobicContact CD2-CD1 3.66Å; L140-I143 WeakPolarHBondContact O-CB 3.26Å; L140-I143 PolarHBondContact O-N 3.08Å; T141-I143 VanDerWaalsContact C-N 3.32Å; I143-G145 PolarHBondContact O-N 3.1Å; I143-L146 VanDerWaalsContact O-CB 3.29Å; I143-L146 WeakPolarHBondContact O-CB 3.23Å; I143-L146 PolarHBondContact O-N 3.16Å; I143-F147 HydrophobicContact CG2-CE2 4.35Å
144P92.4Very high89.4Confident4 Ų444.9 Ų44.93%0.02622%0.224CC..Hα-helixtrans-49.7-41.3170-29.132.3000113.6Q124 T127 L128 I131 L140 T141 L146 F147 D148Q124-P144 HydrophobicContact CG-CB 3.77Å; Q124-P144 WeakPolarHBondContact CG-O 3.47Å; T127-P144 HydrophobicContact CG2-CG 3.94Å; L128-P144 HydrophobicContact CB-CB 4.19Å; L128-P144 HydrophobicContact CB-CG 3.9Å; L128-P144 HydrophobicContact CD1-CG 4.24Å; I131-P144 VanDerWaalsContact CD1-CD 3.49Å; I131-P144 HydrophobicContact CD1-CG 3.6Å; L140-P144 VanDerWaalsContact O-CD 3.3Å; L140-P144 WeakPolarHBondContact O-CD 3.46Å; T141-P144 WeakPolarHBondContact O-CD 3.35Å; P144-L146 PolarHBondContact O-N 3.43Å; P144-F147 PolarHBondContact O-N 3.24Å; P144-F147 VanDerWaalsContact O-N 3.11Å; P144-D148 PolarHBondContact O-N 3.4Å
145G88.8Confident89.3Confident1 Ų140 Ų401%0.0120%0.199CC..Hα-helixtrans-62.3-24.4178.200000114.2I142 I143 G149I142-G145 WeakPolarHBondContact O-CA 3.38Å; I142-G145 PolarHBondContact O-N 2.84Å; I143-G145 PolarHBondContact O-N 3.1Å; G145-G149 PolarHBondContact O-N 2.97Å
146L91.2Very high89.3Confident64 Ų6435.9 Ų35.934%0.33518%0.181SC..Hα-helixtrans-68.8-40.7173.2-59.9176.4000111.7V89 L93 I142 I143 P144 G149 I150V89-L146 HydrophobicContact CG1-CD2 3.61Å; L93-L146 HydrophobicContact CD1-CD2 3.38Å; I142-L146 PolarHBondContact O-N 3.18Å; I143-L146 VanDerWaalsContact O-CB 3.29Å; I143-L146 WeakPolarHBondContact O-CB 3.23Å; I143-L146 PolarHBondContact O-N 3.16Å; P144-L146 PolarHBondContact O-N 3.43Å; L146-G149 PolarHBondContact O-N 3.25Å; L146-I150 HydrophobicContact CB-CD1 4.39Å; L146-I150 VanDerWaalsContact O-CB 3.29Å; L146-I150 WeakPolarHBondContact O-CB 3.3Å; L146-I150 VanDerWaalsContact O-CG1 3.28Å; L146-I150 WeakPolarHBondContact O-CG1 3.44Å; L146-I150 PolarHBondContact O-N 2.9Å
147F91.9Very high89.3Confident65 Ų6534.9 Ų34.929%0.28517%0.172SC..Hα-helixtrans-66.9-42.2178.5-70.7-62.9000111.8L123 Q124 T127 I143 P144 I151 G152L123-F147 HydrophobicContact CB-CB 3.98Å; L123-F147 HydrophobicContact CB-CD1 3.97Å; L123-F147 HydrophobicContact CB-CD2 4.38Å; L123-F147 HydrophobicContact CB-CG 3.86Å; L123-F147 HydrophobicContact CD1-CD1 4.05Å; L123-F147 HydrophobicContact CD1-CE1 4.39Å; Q124-F147 HydrophobicContact CB-CB 4.4Å; T127-F147 HydrophobicContact CG2-CD2 4.47Å; T127-F147 HydrophobicContact CG2-CE2 4.14Å; T127-F147 VanDerWaalsContact OG1-CE2 3.3Å; T127-F147 WeakPolarHBondContact OG1-CE2 3.1Å; I143-F147 HydrophobicContact CG2-CE2 4.35Å; P144-F147 PolarHBondContact O-N 3.24Å; P144-F147 VanDerWaalsContact O-N 3.11Å; F147-I151 HydrophobicContact CD1-CD1 4.19Å; F147-I151 PolarHBondContact O-N 3.28Å; F147-G152 PolarHBondContact O-N 3.34Å; F147-G152 VanDerWaalsContact O-N 3.15Å
148D88.4Confident89.3Confident2 Ų231 Ų311%0.01115%0.152CC..Iπ-helixtrans-57.9-52.3171.9-179.227.5000111.3R90 Q124 P144 G152 G153 G154 R481R90-D148 WeakPolarHBondContact CD-OD2 3.4Å; R90-D148 HydrophobicContact CG-CB 3.82Å; R90-D148 WeakPolarHBondContact CG-OD2 3.43Å; R90-D148 IonicContact NE-OD2 3.01Å; R90-D148 PolarHBondContact NE-OD2 3.13Å; Q124-D148 VanDerWaalsContact OE1-CB 3.26Å; P144-D148 PolarHBondContact O-N 3.4Å; D148-G152 CarbonylContact O-C 3.23Å; D148-G152 WeakPolarHBondContact O-CA 3.27Å; D148-G152 PolarHBondContact O-N 3.21Å; D148-G152 VanDerWaalsContact O-N 3.11Å; D148-G153 PolarHBondContact O-N 3.36Å; D148-G154 WeakPolarHBondContact OD1-CA 3.29Å; D148-G154 PolarHBondContact OD1-N 3.06Å; D148-R481 IonicContact OD2-NH2 3.7Å
149G87.9Confident89.3Confident0 Ų032.1 Ų32.10%016%0.157CC..Iπ-helixtrans-61.5-49.5-177.300000113.2L93 G94 T97 G145 L146L93-G149 CarbonylContact C-O 3.47Å; G94-G149 VanDerWaalsContact CA-O 3.31Å; G94-G149 WeakPolarHBondContact CA-O 3.36Å; G94-G149 PolarHBondContact N-O 3.23Å; T97-G149 WeakPolarHBondContact CB-O 3.41Å; T97-G149 WeakPolarHBondContact CG2-O 3.31Å; T97-G149 PolarHBondContact OG1-O 3.43Å; G145-G149 PolarHBondContact O-N 2.97Å; L146-G149 PolarHBondContact O-N 3.25Å
150I89.7Confident89.3Confident102 Ų10227.1 Ų27.152%0.52314%0.139SC..Iπ-helixtrans-83.9-33.9-169.1-63.2170.7000113L93 T97 L146L93-I150 HydrophobicContact CB-CG1 4.44Å; L93-I150 HydrophobicContact CD1-CD1 4.27Å; L93-I150 HydrophobicContact CD1-CG1 4.08Å; T97-I150 VanDerWaalsContact CG2-O 3.22Å; T97-I150 WeakPolarHBondContact CG2-O 3.27Å; L146-I150 HydrophobicContact CB-CD1 4.39Å; L146-I150 VanDerWaalsContact O-CB 3.29Å; L146-I150 WeakPolarHBondContact O-CB 3.3Å; L146-I150 VanDerWaalsContact O-CG1 3.28Å; L146-I150 WeakPolarHBondContact O-CG1 3.44Å; L146-I150 PolarHBondContact O-N 2.9Å
151I88.7Confident89.2Confident54 Ų5423.9 Ų23.928%0.27712%0.122SC..Iπ-helixtrans-115-47.6-173.9-55176.9000110.7I116 L123 F147I116-I151 HydrophobicContact CG2-CG2 4.29Å; L123-I151 HydrophobicContact CD1-CD1 3.8Å; F147-I151 HydrophobicContact CD1-CD1 4.19Å; F147-I151 PolarHBondContact O-N 3.28Å
152G76.3Confident89.2Confident0 Ų024 Ų240%012%0.123CC..Iπ-helixtrans-69.9-35.7-172.600000113.6M117 F147 D148 G154 S157M117-G152 WeakPolarHBondContact CB-O 2.96Å; M117-G152 WeakPolarHBondContact CG-O 3.33Å; F147-G152 PolarHBondContact O-N 3.34Å; F147-G152 VanDerWaalsContact O-N 3.15Å; D148-G152 CarbonylContact O-C 3.23Å; D148-G152 WeakPolarHBondContact O-CA 3.27Å; D148-G152 PolarHBondContact O-N 3.21Å; D148-G152 VanDerWaalsContact O-N 3.11Å; G152-G154 PolarHBondContact O-N 2.7Å; G152-S157 PolarHBondContact O-OG 3.44Å
153G80.4Confident89.1Confident0 Ų022.2 Ų22.20%011%0.113CC..  trans67.63.4-169.700000113.5T97 T98 D148 S157 R481T97-G153 WeakPolarHBondContact OG1-CA 3.41Å; T98-G153 WeakPolarHBondContact CG2-O 3.31Å; D148-G153 PolarHBondContact O-N 3.36Å; G153-S157 WeakPolarHBondContact CA-OG 3.25Å; G153-S157 VanDerWaalsContact O-CB 3.23Å; G153-S157 WeakPolarHBondContact O-CB 3.47Å; G153-S157 PolarHBondContact O-OG 3.27Å; G153-R481 VanDerWaalsContact C-NH1 3.34Å; G153-R481 PolarHBondContact O-NH1 2.99Å
154G86.1Confident88.8Confident1 Ų118.8 Ų18.81%0.0110%0.096CC..Hα-helixtrans65.1167.9-177.400000116.7E121 D148 G152 L156 S157 I158E121-G154 VanDerWaalsContact OE1-CA 3.24Å; E121-G154 WeakPolarHBondContact OE1-CA 3.42Å; D148-G154 WeakPolarHBondContact OD1-CA 3.29Å; D148-G154 PolarHBondContact OD1-N 3.06Å; G152-G154 PolarHBondContact O-N 2.7Å; G154-L156 PolarHBondContact O-N 3.39Å; G154-S157 WeakPolarHBondContact O-CB 3.38Å; G154-S157 PolarHBondContact O-N 3.33Å; G154-S157 PolarHBondContact O-OG 2.97Å; G154-I158 PolarHBondContact O-N 3.27Å
155L89Confident88.6Confident28 Ų2818.6 Ų18.615%0.14710%0.095CC..Hα-helixtrans-43-41.5176.4-176.664.4000114.5Y26 L29 E121 S157 I158 Q159 L206Y26-L155 HydrophobicContact CD1-CD1 3.38Å; Y26-L155 HydrophobicContact CE1-CD1 3.45Å; Y26-L155 VanDerWaalsContact CE1-CD1 3.45Å; L29-L155 HydrophobicContact CD1-CD1 3.9Å; E121-L155 PolarHBondContact OE1-N 3.22Å; L155-S157 VanDerWaalsContact C-N 3.34Å; L155-S157 PolarHBondContact O-N 2.96Å; L155-I158 PolarHBondContact O-N 3.44Å; L155-Q159 WeakPolarHBondContact O-CG 3.48Å; L155-Q159 PolarHBondContact O-N 3.29Å; L155-L206 HydrophobicContact CD1-CD2 4.19Å; L155-L206 HydrophobicContact CD2-CD1 4Å; L155-L206 HydrophobicContact CD2-CD2 3.76Å
156L89.1Confident88.6Confident39 Ų3918.6 Ų18.620%0.2049%0.094CC..Hα-helixtrans-64.8-36.3179.8-68.2175.4000112.9G154 A160 A477 R481 V484G154-L156 PolarHBondContact O-N 3.39Å; L156-A160 PolarHBondContact O-N 3.34Å; L156-A477 HydrophobicContact CB-CB 4.48Å; L156-R481 HydrophobicContact CD1-CB 3.69Å; L156-R481 HydrophobicContact CD1-CG 4.15Å; L156-V484 HydrophobicContact CD1-CG2 3.98Å
157S90.4Very high88.3Confident1 Ų116 Ų161%0.0078%0.082CC..Hα-helixtrans-68.4-40.517568.70000110.5M117 G152 G153 G154 L155 Q159 A160 Q161M117-S157 WeakPolarHBondContact CE-OG 3.07Å; G152-S157 PolarHBondContact O-OG 3.44Å; G153-S157 WeakPolarHBondContact CA-OG 3.25Å; G153-S157 VanDerWaalsContact O-CB 3.23Å; G153-S157 WeakPolarHBondContact O-CB 3.47Å; G153-S157 PolarHBondContact O-OG 3.27Å; G154-S157 WeakPolarHBondContact O-CB 3.38Å; G154-S157 PolarHBondContact O-N 3.33Å; G154-S157 PolarHBondContact O-OG 2.97Å; L155-S157 VanDerWaalsContact C-N 3.34Å; L155-S157 PolarHBondContact O-N 2.96Å; S157-Q159 VanDerWaalsContact C-N 3.3Å; S157-Q159 PolarHBondContact O-N 3.06Å; S157-A160 WeakPolarHBondContact O-CB 3.48Å; S157-A160 PolarHBondContact O-N 3.3Å; S157-A160 VanDerWaalsContact O-N 3.14Å; S157-Q161 WeakPolarHBondContact O-CG 3.5Å; S157-Q161 PolarHBondContact O-N 3Å
158I92.7Very high87.8Confident0 Ų013.7 Ų13.70%07%0.072CC..Hα-helixtrans-59.3-47177.3-64.5163.9000109.4L22 L25 Y26 L29 L114 M117 E121 G154 L155 A160 Q161 V162L22-I158 HydrophobicContact CD2-CG2 4Å; L25-I158 HydrophobicContact CD2-CD1 4.1Å; L25-I158 HydrophobicContact CD2-CG2 4.19Å; Y26-I158 HydrophobicContact CE1-CG2 4.02Å; L29-I158 HydrophobicContact CD1-CD1 3.96Å; L114-I158 HydrophobicContact CD2-CG2 4.37Å; M117-I158 HydrophobicContact CB-CG1 4.25Å; M117-I158 HydrophobicContact CE-CB 3.95Å; M117-I158 HydrophobicContact CE-CG1 3.38Å; E121-I158 HydrophobicContact CG-CD1 3.94Å; G154-I158 PolarHBondContact O-N 3.27Å; L155-I158 PolarHBondContact O-N 3.44Å; I158-A160 VanDerWaalsContact C-N 3.33Å; I158-A160 PolarHBondContact O-N 3.31Å; I158-Q161 PolarHBondContact O-N 2.81Å; I158-V162 HydrophobicContact CG2-CG2 4.32Å; I158-V162 VanDerWaalsContact O-CG2 3.27Å; I158-V162 WeakPolarHBondContact O-CG2 3.31Å; I158-V162 PolarHBondContact O-N 3.02Å
159Q91.2Very high87.5Confident24 Ų2414.7 Ų14.711%0.1128%0.077CC..Hα-helixtrans-60.4-39176.4-73.1-178.7-1300113.2L155 S157 S163L155-Q159 WeakPolarHBondContact O-CG 3.48Å; L155-Q159 PolarHBondContact O-N 3.29Å; S157-Q159 VanDerWaalsContact C-N 3.3Å; S157-Q159 PolarHBondContact O-N 3.06Å; Q159-S163 WeakPolarHBondContact O-CB 3.26Å; Q159-S163 PolarHBondContact O-N 3.34Å; Q159-S163 PolarHBondContact O-OG 3.14Å
160A90.7Very high87.1Confident6 Ų615 Ų155%0.058%0.079CC..Hα-helixtrans-64.3-42.9173.900000112.5L156 S157 I158 S163 A164 H473 A477L156-A160 PolarHBondContact O-N 3.34Å; S157-A160 WeakPolarHBondContact O-CB 3.48Å; S157-A160 PolarHBondContact O-N 3.3Å; S157-A160 VanDerWaalsContact O-N 3.14Å; I158-A160 VanDerWaalsContact C-N 3.33Å; I158-A160 PolarHBondContact O-N 3.31Å; A160-S163 WeakPolarHBondContact O-CB 3.41Å; A160-S163 PolarHBondContact O-N 3.35Å; A160-A164 WeakPolarHBondContact O-CB 3.45Å; A160-A164 PolarHBondContact O-N 2.97Å; A160-H473 HydrophobicContact CB-CB 4.22Å; A160-H473 WeakPolarHBondContact CB-O 3.39Å; A160-A477 HydrophobicContact CB-CB 3.7Å
161Q91.4Very high86.2Confident1 Ų111.2 Ų11.21%0.0056%0.062CC..Hα-helixtrans-69.6-36.9179.3-64.1-47.3-38.500112.6I101 S105 L114 M117 S157 I158 S163 A164 S165 S474I101-Q161 HydrophobicContact CG2-CG 4Å; S105-Q161 PolarHBondContact OG-OE1 3.44Å; L114-Q161 HydrophobicContact CD2-CB 3.66Å; L114-Q161 HydrophobicContact CG-CB 4.11Å; M117-Q161 HydrophobicContact CE-CG 4.02Å; M117-Q161 HydrophobicContact SD-CG 3.72Å; S157-Q161 WeakPolarHBondContact O-CG 3.5Å; S157-Q161 PolarHBondContact O-N 3Å; I158-Q161 PolarHBondContact O-N 2.81Å; Q161-S163 VanDerWaalsContact C-N 3.32Å; Q161-A164 PolarHBondContact O-N 2.91Å; Q161-S165 WeakPolarHBondContact O-CB 3.29Å; Q161-S165 PolarHBondContact O-N 3.46Å; Q161-S165 PolarHBondContact O-OG 3.37Å; Q161-S474 PolarHBondContact NE2-OG 2.89Å
162V92.6Very high85.1Confident2 Ų212.8 Ų12.81%0.0127%0.067CC..Hα-helixtrans-60.4-45.8170170.40000109.8L18 L22 L114 I158 A164 S165 L166 F198L18-V162 HydrophobicContact CD1-CG2 4.49Å; L18-V162 HydrophobicContact CD2-CG1 4.26Å; L22-V162 HydrophobicContact CD1-CB 4.43Å; L22-V162 HydrophobicContact CD1-CG1 3.92Å; L22-V162 HydrophobicContact CD1-CG2 3.59Å; L22-V162 HydrophobicContact CD2-CG2 3.76Å; L22-V162 HydrophobicContact CG-CG2 4.27Å; L114-V162 HydrophobicContact CD2-CG2 4.47Å; I158-V162 HydrophobicContact CG2-CG2 4.32Å; I158-V162 VanDerWaalsContact O-CG2 3.27Å; I158-V162 WeakPolarHBondContact O-CG2 3.31Å; I158-V162 PolarHBondContact O-N 3.02Å; V162-A164 PolarHBondContact O-N 3.3Å; V162-S165 WeakPolarHBondContact O-CB 3.4Å; V162-S165 PolarHBondContact O-N 3.39Å; V162-L166 HydrophobicContact CG1-CD1 4.17Å; V162-L166 HydrophobicContact CG1-CG 4.5Å; V162-L166 VanDerWaalsContact O-CG 3.31Å; V162-L166 WeakPolarHBondContact O-CG 3.43Å; V162-L166 PolarHBondContact O-N 2.86Å; V162-F198 HydrophobicContact CG1-CB 4.5Å; V162-F198 HydrophobicContact CG1-CD1 4.01Å; V162-F198 HydrophobicContact CG1-CG 4.45Å
163S89.5Confident84.3Confident0 Ų016.2 Ų16.20%08%0.082CC..Hα-helixtrans-63-44.7179.7-57.40000112.2Q159 A160 Q161 S165 L166 T167 R457Q159-S163 WeakPolarHBondContact O-CB 3.26Å; Q159-S163 PolarHBondContact O-N 3.34Å; Q159-S163 PolarHBondContact O-OG 3.14Å; A160-S163 WeakPolarHBondContact O-CB 3.41Å; A160-S163 PolarHBondContact O-N 3.35Å; Q161-S163 VanDerWaalsContact C-N 3.32Å; S163-S165 VanDerWaalsContact C-N 3.34Å; S163-S165 PolarHBondContact O-N 2.71Å; S163-L166 PolarHBondContact O-N 2.96Å; S163-T167 PolarHBondContact O-N 3.46Å; S163-T167 PolarHBondContact O-OG1 2.83Å; S163-R457 VanDerWaalsContact OG-CD 3.29Å; S163-R457 WeakPolarHBondContact OG-CD 3.31Å; S163-R457 VanDerWaalsContact OG-CZ 3.31Å; S163-R457 PolarHBondContact OG-NE 3.11Å; S163-R457 PolarHBondContact OG-NH1 3.29Å
164A87.6Confident83.1Confident0 Ų017.5 Ų17.50%09%0.092CC..Hα-helixtrans-60-43.9174.200000111.7A160 Q161 V162 L166 T167 D168A160-A164 WeakPolarHBondContact O-CB 3.45Å; A160-A164 PolarHBondContact O-N 2.97Å; Q161-A164 PolarHBondContact O-N 2.91Å; V162-A164 PolarHBondContact O-N 3.3Å; A164-L166 VanDerWaalsContact C-N 3.31Å; A164-L166 PolarHBondContact O-N 2.88Å; A164-T167 PolarHBondContact O-N 2.84Å; A164-D168 PolarHBondContact O-N 3.36Å
165S87.8Confident81.8Confident1 Ų122.9 Ų22.91%0.00712%0.124CC..Hα-helixtrans-62.1-36.5177.6-57.30000112.8Q161 V162 S163 L169Q161-S165 WeakPolarHBondContact O-CB 3.29Å; Q161-S165 PolarHBondContact O-N 3.46Å; Q161-S165 PolarHBondContact O-OG 3.37Å; V162-S165 WeakPolarHBondContact O-CB 3.4Å; V162-S165 PolarHBondContact O-N 3.39Å; S163-S165 VanDerWaalsContact C-N 3.34Å; S163-S165 PolarHBondContact O-N 2.71Å; S165-L169 PolarHBondContact O-N 2.91Å
166L88.9Confident80.2Confident0 Ų026.9 Ų26.90%015%0.146CC..Hα-helixtrans-69.3-40.3175.8-68.3173.2000111.6L15 V162 S163 A164 D168 L169 V170 F195 F198L15-L166 HydrophobicContact CD2-CD2 3.56Å; V162-L166 HydrophobicContact CG1-CD1 4.17Å; V162-L166 HydrophobicContact CG1-CG 4.5Å; V162-L166 VanDerWaalsContact O-CG 3.31Å; V162-L166 WeakPolarHBondContact O-CG 3.43Å; V162-L166 PolarHBondContact O-N 2.86Å; S163-L166 PolarHBondContact O-N 2.96Å; A164-L166 VanDerWaalsContact C-N 3.31Å; A164-L166 PolarHBondContact O-N 2.88Å; L166-D168 VanDerWaalsContact C-N 3.35Å; L166-L169 WeakPolarHBondContact O-CB 3.44Å; L166-L169 PolarHBondContact O-N 2.67Å; L166-V170 PolarHBondContact O-N 3.23Å; L166-F195 HydrophobicContact CB-CD1 4.41Å; L166-F195 HydrophobicContact CB-CE1 4.01Å; L166-F195 HydrophobicContact CD1-CD1 3.86Å; L166-F195 HydrophobicContact CD1-CE1 4.19Å; L166-F198 HydrophobicContact CD1-CB 3.84Å; L166-F198 HydrophobicContact CD1-CD2 3.83Å; L166-F198 HydrophobicContact CD1-CG 3.81Å; L166-F198 HydrophobicContact CD2-CD2 3.81Å; L166-F198 HydrophobicContact CD2-CE2 3.8Å; L166-F198 HydrophobicContact CD2-CG 4.37Å; L166-F198 HydrophobicContact CD2-CZ 4.3Å; L166-F198 HydrophobicContact CG-CD2 4.46Å
167T83.9Confident78.6Confident11 Ų1127 Ų277%0.06715%0.15CC..Hα-helixtrans-64-41.3174.8-530000111.8S163 A164 L169 V170 S171 Q469S163-T167 PolarHBondContact O-N 3.46Å; S163-T167 PolarHBondContact O-OG1 2.83Å; A164-T167 PolarHBondContact O-N 2.84Å; T167-L169 PolarHBondContact O-N 3.03Å; T167-V170 PolarHBondContact O-N 2.98Å; T167-S171 PolarHBondContact O-N 3.14Å; T167-S171 PolarHBondContact O-OG 3.11Å; T167-Q469 HydrophobicContact CG2-CB 4.32Å; T167-Q469 HydrophobicContact CG2-CG 3.64Å
168D82.3Confident76.8Confident16 Ų1635 Ų359%0.08619%0.193CC..Hα-helixtrans-60.8-29.5175.9-66.5-21.3000112.2R110 A164 L166 S171 K172R110-D168 IonicContact CZ-OD2 3.23Å; R110-D168 IonicContact NE-OD2 2.7Å; R110-D168 PolarHBondContact NE-OD2 3.17Å; R110-D168 IonicContact NH2-OD1 3.05Å; R110-D168 IonicContact NH2-OD2 3.25Å; A164-D168 PolarHBondContact O-N 3.36Å; L166-D168 VanDerWaalsContact C-N 3.35Å; D168-S171 PolarHBondContact O-OG 3.39Å; D168-S171 VanDerWaalsContact O-OG 3.08Å; D168-K172 WeakPolarHBondContact O-CG 3.24Å
169L81.7Confident75.2Confident22 Ų2239.4 Ų39.412%0.11522%0.216CC..Hα-helixtrans-76.6-38.9179.6-16966000112.3K11 F14 L15 S165 L166 T167K11-L169 HydrophobicContact CB-CD1 4.35Å; K11-L169 HydrophobicContact CG-CD1 4.11Å; K11-L169 HydrophobicContact CG-CD2 3.67Å; K11-L169 HydrophobicContact CG-CG 3.91Å; F14-L169 HydrophobicContact CD1-CD2 4.15Å; L15-L169 HydrophobicContact CD1-CD2 4.07Å; L15-L169 HydrophobicContact CD2-CD2 3.55Å; L15-L169 HydrophobicContact CG-CD2 3.71Å; S165-L169 PolarHBondContact O-N 2.91Å; L166-L169 WeakPolarHBondContact O-CB 3.44Å; L166-L169 PolarHBondContact O-N 2.67Å; T167-L169 PolarHBondContact O-N 3.03Å
170V79.7Confident73.7Confident7 Ų742.5 Ų42.54%0.04224%0.236CC..Hα-helixtrans-75.4-36.9179177.10000111.3L166 T167 K172 E173 N187 L191 L194L166-V170 PolarHBondContact O-N 3.23Å; T167-V170 PolarHBondContact O-N 2.98Å; V170-K172 VanDerWaalsContact C-N 3.31Å; V170-K172 PolarHBondContact O-N 3Å; V170-E173 WeakPolarHBondContact O-CB 3.38Å; V170-E173 PolarHBondContact O-N 3.21Å; V170-E173 VanDerWaalsContact O-N 3.17Å; V170-N187 HydrophobicContact CG1-CB 3.73Å; V170-N187 WeakPolarHBondContact CG1-O 3.03Å; V170-L191 HydrophobicContact CB-CD1 4.37Å; V170-L191 HydrophobicContact CG2-CB 4.44Å; V170-L191 HydrophobicContact CG2-CD1 4Å; V170-L194 HydrophobicContact CG2-CD1 3.52Å
171S70.5Confident72Confident22 Ų2244.2 Ų44.215%0.15425%0.247CC..Hα-helixtrans-62.3-36.3179.561.10000112.9T167 D168 E173 S174T167-S171 PolarHBondContact O-N 3.14Å; T167-S171 PolarHBondContact O-OG 3.11Å; D168-S171 PolarHBondContact O-OG 3.39Å; D168-S171 VanDerWaalsContact O-OG 3.08Å; S171-E173 PolarHBondContact O-N 3.28Å; S171-S174 WeakPolarHBondContact O-CB 3.42Å; S171-S174 PolarHBondContact O-N 3.11Å; S171-S174 VanDerWaalsContact O-N 3.13Å; S171-S174 PolarHBondContact O-OG 2.94Å
172K64.6Low70.4Confident88 Ų8848.2 Ų48.238%0.38327%0.268SS..Hα-helixtrans-59.3-33.7175.3-73.9176.4-175.1177.90113.7D168 V170 S174 S246D168-K172 WeakPolarHBondContact O-CG 3.24Å; V170-K172 VanDerWaalsContact C-N 3.31Å; V170-K172 PolarHBondContact O-N 3Å; K172-S174 VanDerWaalsContact C-N 3.26Å; K172-S174 PolarHBondContact O-N 3.18Å; K172-S246 WeakPolarHBondContact CE-O 3.18Å; K172-S246 PolarHBondContact NZ-O 3.43Å
173E60.2Low68.8Low71 Ų7148.8 Ų48.833%0.33227%0.272SS..Hα-helixtrans-69.3-28.2-179.8-160.7167.9176.800111.4K11 V170 S171 V175K11-E173 IonicContact NZ-OE2 2.74Å; K11-E173 PolarHBondContact NZ-OE2 3.18Å; V170-E173 WeakPolarHBondContact O-CB 3.38Å; V170-E173 PolarHBondContact O-N 3.21Å; V170-E173 VanDerWaalsContact O-N 3.17Å; S171-E173 PolarHBondContact O-N 3.28Å; E173-V175 PolarHBondContact O-N 3.01Å
174S55.2Low67.4Low28 Ų2852.2 Ų52.220%0.19629%0.288CS..Hα-helixtrans-70.7-28.4-178.275.60000114.6S171 K172 D176 S177 N187S171-S174 WeakPolarHBondContact O-CB 3.42Å; S171-S174 PolarHBondContact O-N 3.11Å; S171-S174 VanDerWaalsContact O-N 3.13Å; S171-S174 PolarHBondContact O-OG 2.94Å; K172-S174 VanDerWaalsContact C-N 3.26Å; K172-S174 PolarHBondContact O-N 3.18Å; S174-D176 VanDerWaalsContact C-N 3.33Å; S174-S177 PolarHBondContact O-OG 3.12Å; S174-S177 VanDerWaalsContact O-OG 3.12Å; S174-N187 WeakPolarHBondContact CB-ND2 3.48Å
175V59.2Low66.1Low114 Ų11453.5 Ų53.569%0.69130%0.296SS*.Hα-helixtrans-75-26.8-175.3179.80000111.6E173E173-V175 PolarHBondContact O-N 3.01Å
176D55.6Low65.2Low111 Ų11155.8 Ų55.859%0.59431%0.31SS*.SBendtrans-92.4-7-175-71.4-21.7000113.5I7 S174I7-D176 VanDerWaalsContact CD1-OD2 3.3Å; I7-D176 WeakPolarHBondContact CD1-OD2 3.25Å; S174-D176 VanDerWaalsContact C-N 3.33Å
177S54.8Low64.3Low43 Ų4356.8 Ų56.830%0.30132%0.315SS..  trans-96.5117.6-179.1560000112.4S174 D179 S183S174-S177 PolarHBondContact O-OG 3.12Å; S174-S177 VanDerWaalsContact O-OG 3.12Å; S177-D179 PolarHBondContact O-N 3.39Å; S177-S183 WeakPolarHBondContact OG-CB 3.23Å
178N52.6Low63.6Low168 Ų16857.4 Ų57.490%0.89832%0.317SS*.SBendtrans-66.7-12.5177.5-70.5-13.7000114.3
179D58.6Low63.2Low93 Ų9356.9 Ų56.950%0.49732%0.315SS..  trans-101.194.5-177.3-118.714.5000110.2S177 T181 N182 S183S177-D179 PolarHBondContact O-N 3.39Å; D179-T181 VanDerWaalsContact C-N 3.34Å; D179-T181 PolarHBondContact O-N 3.41Å; D179-N182 HydrophobicContact CB-CB 4.37Å; D179-N182 PolarHBondContact OD2-ND2 3.38Å; D179-S183 WeakPolarHBondContact O-CB 3.47Å; D179-S183 PolarHBondContact O-N 3.46Å; D179-S183 PolarHBondContact O-OG 3.42Å
180V60.3Low63.2Low88 Ų8857.8 Ų57.853%0.53332%0.319SS..Hα-helixtrans-63.5-36.8-172.5-177.60000112.6S183 Q184V180-S183 WeakPolarHBondContact CA-OG 3.3Å; V180-S183 PolarHBondContact O-OG 3.33Å; V180-Q184 WeakPolarHBondContact O-CG 3.39Å; V180-Q184 PolarHBondContact O-N 3.12Å
181T54.4Low63.4Low43 Ų4358 Ų5826%0.26432%0.32SS..Hα-helixtrans-77.6-49-174.753.50000112.5D179 S183 D391 L395D179-T181 VanDerWaalsContact C-N 3.34Å; D179-T181 PolarHBondContact O-N 3.41Å; T181-S183 VanDerWaalsContact C-N 3.34Å; T181-S183 PolarHBondContact O-N 2.85Å; T181-D391 HydrophobicContact CG2-CB 4.29Å; T181-L395 HydrophobicContact CG2-CB 4.4Å
182N58Low64Low84 Ų8457.2 Ų57.245%0.44931%0.314SS..Hα-helixtrans-66.5-35.8177.2-74.8-33.3000112D179 T186D179-N182 HydrophobicContact CB-CB 4.37Å; D179-N182 PolarHBondContact OD2-ND2 3.38Å; N182-T186 VanDerWaalsContact O-CB 3.26Å; N182-T186 WeakPolarHBondContact O-CB 3.35Å; N182-T186 PolarHBondContact O-N 3.21Å; N182-T186 VanDerWaalsContact O-N 3.1Å; N182-T186 PolarHBondContact O-OG1 2.93Å
183S59.5Low65Low15 Ų1554.7 Ų54.711%0.10531%0.306CS..Hα-helixtrans-66-43.7179.7600000112.3S177 D179 V180 T181 T186 N187S177-S183 WeakPolarHBondContact OG-CB 3.23Å; D179-S183 WeakPolarHBondContact O-CB 3.47Å; D179-S183 PolarHBondContact O-N 3.46Å; D179-S183 PolarHBondContact O-OG 3.42Å; V180-S183 WeakPolarHBondContact CA-OG 3.3Å; V180-S183 PolarHBondContact O-OG 3.33Å; T181-S183 VanDerWaalsContact C-N 3.34Å; T181-S183 PolarHBondContact O-N 2.85Å; S183-T186 PolarHBondContact O-N 3.25Å; S183-N187 VanDerWaalsContact O-CB 3.31Å; S183-N187 WeakPolarHBondContact O-CB 3.44Å; S183-N187 PolarHBondContact O-N 3.4Å; S183-N187 PolarHBondContact O-ND2 3Å
184Q60.8Low66.4Low72 Ų7252.4 Ų52.434%0.33630%0.296SS..Hα-helixtrans-66.3-41.6-178.3-74.2-170.91300113.5V180 N187 Q188 L395V180-Q184 WeakPolarHBondContact O-CG 3.39Å; V180-Q184 PolarHBondContact O-N 3.12Å; Q184-N187 PolarHBondContact O-N 3.23Å; Q184-Q188 WeakPolarHBondContact O-CG 3.48Å; Q184-Q188 PolarHBondContact O-N 3.44Å; Q184-L395 HydrophobicContact CB-CD1 4.09Å
185V59.4Low68.1Low26 Ų2651 Ų5116%0.15829%0.286CS..Hα-helixtrans-66-42.9176.3179.20000110.5N187 Q188 N189 V398V185-N187 VanDerWaalsContact C-N 3.31Å; V185-N187 PolarHBondContact O-N 2.62Å; V185-Q188 PolarHBondContact O-N 2.9Å; V185-N189 PolarHBondContact O-N 2.9Å; V185-V398 HydrophobicContact CG1-CG1 4.33Å; V185-V398 HydrophobicContact CG2-CB 4.45Å; V185-V398 HydrophobicContact CG2-CG1 3.58Å
186T68.6Low69.5Low49 Ų4945.8 Ų45.830%0.30125%0.254SS..Hα-helixtrans-62.5-39.7176.2-55.60000111.2N182 S183 Q188 N189 N190N182-T186 VanDerWaalsContact O-CB 3.26Å; N182-T186 WeakPolarHBondContact O-CB 3.35Å; N182-T186 PolarHBondContact O-N 3.21Å; N182-T186 VanDerWaalsContact O-N 3.1Å; N182-T186 PolarHBondContact O-OG1 2.93Å; S183-T186 PolarHBondContact O-N 3.25Å; T186-Q188 PolarHBondContact O-N 2.91Å; T186-N189 PolarHBondContact O-N 3.22Å; T186-N190 VanDerWaalsContact O-CB 3.24Å; T186-N190 WeakPolarHBondContact O-CB 3.45Å; T186-N190 PolarHBondContact O-N 3.45Å; T186-N190 PolarHBondContact O-ND2 3.37Å; T186-N190 PolarHBondContact O-OD1 3.05Å
187N70.5Confident71.2Confident22 Ų2247.4 Ų47.412%0.11825%0.252CS..Hα-helixtrans-64.3-40.6176.6-71.7-25.9000112.5V170 S174 S183 Q184 V185 N190 L191V170-N187 HydrophobicContact CG1-CB 3.73Å; V170-N187 WeakPolarHBondContact CG1-O 3.03Å; S174-N187 WeakPolarHBondContact CB-ND2 3.48Å; S183-N187 VanDerWaalsContact O-CB 3.31Å; S183-N187 WeakPolarHBondContact O-CB 3.44Å; S183-N187 PolarHBondContact O-N 3.4Å; S183-N187 PolarHBondContact O-ND2 3Å; Q184-N187 PolarHBondContact O-N 3.23Å; V185-N187 VanDerWaalsContact C-N 3.31Å; V185-N187 PolarHBondContact O-N 2.62Å; N187-N190 PolarHBondContact O-N 3.19Å; N187-L191 VanDerWaalsContact O-CB 3.28Å; N187-L191 WeakPolarHBondContact O-CB 3.43Å; N187-L191 PolarHBondContact O-N 2.68Å
188Q69.2Low73Confident24 Ų2445.9 Ų45.911%0.11224%0.24CC..Hα-helixtrans-64-46.5176.5-70.9168.616.600111.4Q184 V185 T186 N190 L191 W192 M462Q184-Q188 WeakPolarHBondContact O-CG 3.48Å; Q184-Q188 PolarHBondContact O-N 3.44Å; V185-Q188 PolarHBondContact O-N 2.9Å; T186-Q188 PolarHBondContact O-N 2.91Å; Q188-N190 VanDerWaalsContact C-N 3.34Å; Q188-N190 PolarHBondContact O-N 3.42Å; Q188-L191 PolarHBondContact O-N 3.49Å; Q188-W192 PolarHBondContact O-N 3.45Å; Q188-M462 HydrophobicContact CG-CE 4.11Å; Q188-M462 HydrophobicContact CG-CG 4.3Å; Q188-M462 HydrophobicContact CG-SD 4.4Å
189N74.3Confident74.8Confident5 Ų538.5 Ų38.53%0.02720%0.201CC..Hα-helixtrans-64.6-39.9177.6-70.9-17.3000111.8V185 T186 T193 H371V185-N189 PolarHBondContact O-N 2.9Å; T186-N189 PolarHBondContact O-N 3.22Å; N189-T193 WeakPolarHBondContact O-CB 3.36Å; N189-T193 PolarHBondContact O-N 3.07Å; N189-T193 PolarHBondContact O-OG1 3.01Å; N189-H371 PolarHBondContact ND2-CD2 3.34Å; N189-H371 PolarHBondContact ND2-NE2 3.21Å
190N81Confident76.4Confident40 Ų4034.3 Ų34.321%0.21418%0.179CC..Hα-helixtrans-62.3-44.8174.5-75.5-13.3000111.2T186 N187 Q188 T193 L194T186-N190 VanDerWaalsContact O-CB 3.24Å; T186-N190 WeakPolarHBondContact O-CB 3.45Å; T186-N190 PolarHBondContact O-N 3.45Å; T186-N190 PolarHBondContact O-ND2 3.37Å; T186-N190 PolarHBondContact O-OD1 3.05Å; N187-N190 PolarHBondContact O-N 3.19Å; Q188-N190 VanDerWaalsContact C-N 3.34Å; Q188-N190 PolarHBondContact O-N 3.42Å; N190-T193 PolarHBondContact O-N 3.02Å; N190-L194 WeakPolarHBondContact O-CB 3.37Å; N190-L194 VanDerWaalsContact O-CG 3.23Å; N190-L194 WeakPolarHBondContact O-CG 3.01Å; N190-L194 PolarHBondContact O-N 3.28Å
191L84Confident78Confident12 Ų1231.1 Ų31.16%0.06316%0.159CC..Hα-helixtrans-65.4-45.3-179.6-170.269.3000111.6V170 N187 Q188 T193 L194 F195 S461V170-L191 HydrophobicContact CB-CD1 4.37Å; V170-L191 HydrophobicContact CG2-CB 4.44Å; V170-L191 HydrophobicContact CG2-CD1 4Å; N187-L191 VanDerWaalsContact O-CB 3.28Å; N187-L191 WeakPolarHBondContact O-CB 3.43Å; N187-L191 PolarHBondContact O-N 2.68Å; Q188-L191 PolarHBondContact O-N 3.49Å; L191-T193 VanDerWaalsContact C-N 3.35Å; L191-T193 PolarHBondContact O-N 3.29Å; L191-L194 PolarHBondContact O-N 3.44Å; L191-F195 HydrophobicContact CD1-CD2 4.3Å; L191-F195 HydrophobicContact CD1-CE1 4.21Å; L191-F195 HydrophobicContact CD1-CE2 3.69Å; L191-F195 HydrophobicContact CD1-CZ 3.63Å; L191-F195 HydrophobicContact CD2-CD2 4.42Å; L191-F195 HydrophobicContact CD2-CE2 3.62Å; L191-F195 HydrophobicContact CD2-CZ 4.17Å; L191-F195 HydrophobicContact CG-CD2 3.81Å; L191-F195 HydrophobicContact CG-CE2 3.36Å; L191-F195 HydrophobicContact CG-CZ 3.88Å; L191-F195 WeakPolarHBondContact O-CB 3.21Å; L191-F195 WeakPolarHBondContact O-CD2 3.28Å; L191-F195 WeakPolarHBondContact O-CG 3.41Å; L191-F195 PolarHBondContact O-N 3.19Å; L191-S461 VanDerWaalsContact CD2-CB 3.41Å
192W82.6Confident79.8Confident5 Ų529.2 Ų29.22%0.01915%0.148CC..Hα-helixtrans-60.8-45.9176-177.225.3000111.6Q188 L194 F195 T196 T363 M366 I370 L406 I409 T458Q188-W192 PolarHBondContact O-N 3.45Å; W192-L194 VanDerWaalsContact C-N 3.34Å; W192-L194 PolarHBondContact O-N 2.98Å; W192-F195 PolarHBondContact O-N 2.92Å; W192-T196 PolarHBondContact O-N 2.93Å; W192-T196 PolarHBondContact O-OG1 3.14Å; W192-T363 HydrophobicContact CD2-CG2 3.83Å; W192-T363 HydrophobicContact CE3-CG2 4.3Å; W192-T363 HydrophobicContact CG-CG2 4.12Å; W192-T363 HydrophobicContact CZ2-CG2 4.23Å; W192-M366 HydrophobicContact CH2-CB 3.28Å; W192-M366 HydrophobicContact CH2-CG 3.91Å; W192-M366 HydrophobicContact CZ2-CB 4.38Å; W192-M366 HydrophobicContact CZ3-CB 3.56Å; W192-I370 HydrophobicContact CE3-CD1 4.27Å; W192-I370 HydrophobicContact CZ3-CD1 3.76Å; W192-L406 HydrophobicContact CD2-CD2 3.86Å; W192-L406 HydrophobicContact CE3-CD2 4.1Å; W192-L406 HydrophobicContact CG-CD2 4.41Å; W192-L406 HydrophobicContact CH2-CD2 4.04Å; W192-L406 HydrophobicContact CZ2-CD2 3.85Å; W192-L406 HydrophobicContact CZ3-CD2 4.19Å; W192-I409 HydrophobicContact CH2-CD1 3.99Å; W192-I409 HydrophobicContact CZ2-CD1 4.36Å; W192-T458 WeakPolarHBondContact CA-OG1 3.5Å; W192-T458 HydrophobicContact CB-CG2 3.96Å; W192-T458 HydrophobicContact CG-CG2 4.45Å
193T86.1Confident81.4Confident35 Ų3527 Ų2722%0.21514%0.135CC..Hα-helixtrans-61.8-42.6178.2-56.20000111.4N189 N190 L191 T196 W197 L364N189-T193 WeakPolarHBondContact O-CB 3.36Å; N189-T193 PolarHBondContact O-N 3.07Å; N189-T193 PolarHBondContact O-OG1 3.01Å; N190-T193 PolarHBondContact O-N 3.02Å; L191-T193 VanDerWaalsContact C-N 3.35Å; L191-T193 PolarHBondContact O-N 3.29Å; T193-T196 PolarHBondContact O-N 3.42Å; T193-W197 WeakPolarHBondContact O-CB 3.39Å; T193-W197 PolarHBondContact O-N 3.38Å; T193-L364 HydrophobicContact CG2-CD2 4.22Å
194L88.7Confident83Confident23 Ų2328.9 Ų28.912%0.1214%0.144CC..Hα-helixtrans-66.6-44.2177.7-75.7171.8000112.1L15 V170 N190 L191 W192 W197 F198L15-L194 HydrophobicContact CD1-CD2 3.84Å; L15-L194 HydrophobicContact CD2-CD2 4.01Å; V170-L194 HydrophobicContact CG2-CD1 3.52Å; N190-L194 WeakPolarHBondContact O-CB 3.37Å; N190-L194 VanDerWaalsContact O-CG 3.23Å; N190-L194 WeakPolarHBondContact O-CG 3.01Å; N190-L194 PolarHBondContact O-N 3.28Å; L191-L194 PolarHBondContact O-N 3.44Å; W192-L194 VanDerWaalsContact C-N 3.34Å; W192-L194 PolarHBondContact O-N 2.98Å; L194-W197 PolarHBondContact O-N 3.27Å; L194-F198 WeakPolarHBondContact O-CD2 3.3Å; L194-F198 PolarHBondContact O-N 2.92Å
195F91.2Very high84.6Confident0 Ų025.8 Ų25.80%013%0.13CC..Hα-helixtrans-61.4-46.1175.2-73.6-35.8000111.4L166 L191 W192 W197 F198 D199 P454 R457 S461L166-F195 HydrophobicContact CB-CD1 4.41Å; L166-F195 HydrophobicContact CB-CE1 4.01Å; L166-F195 HydrophobicContact CD1-CD1 3.86Å; L166-F195 HydrophobicContact CD1-CE1 4.19Å; L191-F195 HydrophobicContact CD1-CD2 4.3Å; L191-F195 HydrophobicContact CD1-CE1 4.21Å; L191-F195 HydrophobicContact CD1-CE2 3.69Å; L191-F195 HydrophobicContact CD1-CZ 3.63Å; L191-F195 HydrophobicContact CD2-CD2 4.42Å; L191-F195 HydrophobicContact CD2-CE2 3.62Å; L191-F195 HydrophobicContact CD2-CZ 4.17Å; L191-F195 HydrophobicContact CG-CD2 3.81Å; L191-F195 HydrophobicContact CG-CE2 3.36Å; L191-F195 HydrophobicContact CG-CZ 3.88Å; L191-F195 WeakPolarHBondContact O-CB 3.21Å; L191-F195 WeakPolarHBondContact O-CD2 3.28Å; L191-F195 WeakPolarHBondContact O-CG 3.41Å; L191-F195 PolarHBondContact O-N 3.19Å; W192-F195 PolarHBondContact O-N 2.92Å; F195-W197 VanDerWaalsContact C-N 3.31Å; F195-W197 PolarHBondContact O-N 3.04Å; F195-F198 PolarHBondContact O-N 2.72Å; F195-D199 VanDerWaalsContact O-CB 3.26Å; F195-D199 WeakPolarHBondContact O-CB 3.5Å; F195-D199 PolarHBondContact O-N 3.43Å; F195-P454 HydrophobicContact CB-CB 4.31Å; F195-R457 HydrophobicContact CD1-CB 4.46Å; F195-R457 HydrophobicContact CD2-CB 3.82Å; F195-R457 HydrophobicContact CE2-CB 3.89Å; F195-R457 WeakPolarHBondContact CE2-O 3.45Å; F195-R457 HydrophobicContact CG-CB 4.12Å; F195-R457 HydrophobicContact CZ-CB 4.29Å; F195-S461 WeakPolarHBondContact CE2-OG 3.5Å; F195-S461 WeakPolarHBondContact CZ-OG 3.39Å
196T89.4Confident86.2Confident3 Ų325.6 Ų25.62%0.01813%0.128CC..Hα-helixtrans-62.1-39.9177-60.10000111.8W192 T193 G200 A359 I360 T363 P454W192-T196 PolarHBondContact O-N 2.93Å; W192-T196 PolarHBondContact O-OG1 3.14Å; T193-T196 PolarHBondContact O-N 3.42Å; T196-G200 WeakPolarHBondContact O-CA 3.23Å; T196-G200 PolarHBondContact O-N 2.7Å; T196-A359 HydrophobicContact CG2-CB 4.49Å; T196-I360 HydrophobicContact CG2-CG1 4.11Å; T196-T363 HydrophobicContact CG2-CG2 4.29Å; T196-T363 WeakPolarHBondContact CG2-OG1 3.5Å; T196-T363 WeakPolarHBondContact OG1-CG2 3.36Å; T196-T363 PolarHBondContact OG1-OG1 2.88Å; T196-P454 HydrophobicContact CG2-CG 4.44Å; T196-P454 VanDerWaalsContact OG1-CB 3.23Å; T196-P454 WeakPolarHBondContact OG1-CB 3.34Å
197W91.4Very high87.3Confident146 Ų14623.3 Ų23.355%0.55311%0.114SC*.Hα-helixtrans-62.7-49.4177.7-167.5-63000111.7T193 L194 F195 G200 L201T193-W197 WeakPolarHBondContact O-CB 3.39Å; T193-W197 PolarHBondContact O-N 3.38Å; L194-W197 PolarHBondContact O-N 3.27Å; F195-W197 VanDerWaalsContact C-N 3.31Å; F195-W197 PolarHBondContact O-N 3.04Å; W197-G200 PolarHBondContact O-N 3.27Å; W197-L201 VanDerWaalsContact O-CB 3.31Å; W197-L201 WeakPolarHBondContact O-CB 3.29Å; W197-L201 PolarHBondContact O-N 2.81Å
198F92.8Very high88.3Confident10 Ų1025.7 Ų25.74%0.04413%0.127CC..Hα-helixtrans-73-35.2-177.6-87.2-93.6000113.1L15 L18 L22 V162 L166 L194 F195 A202L15-F198 HydrophobicContact CB-CZ 4.39Å; L15-F198 HydrophobicContact CD2-CE2 3.62Å; L15-F198 HydrophobicContact CD2-CZ 3.89Å; L18-F198 HydrophobicContact CB-CE1 4.12Å; L18-F198 HydrophobicContact CB-CZ 4.33Å; L18-F198 HydrophobicContact CD2-CD1 4.33Å; L18-F198 HydrophobicContact CD2-CE1 3.64Å; L18-F198 HydrophobicContact CD2-CZ 4Å; L18-F198 HydrophobicContact CG-CE1 3.73Å; L18-F198 HydrophobicContact CG-CZ 4.32Å; L22-F198 HydrophobicContact CD1-CD1 3.84Å; L22-F198 HydrophobicContact CD1-CE1 3.99Å; V162-F198 HydrophobicContact CG1-CB 4.5Å; V162-F198 HydrophobicContact CG1-CD1 4.01Å; V162-F198 HydrophobicContact CG1-CG 4.45Å; L166-F198 HydrophobicContact CD1-CB 3.84Å; L166-F198 HydrophobicContact CD1-CD2 3.83Å; L166-F198 HydrophobicContact CD1-CG 3.81Å; L166-F198 HydrophobicContact CD2-CD2 3.81Å; L166-F198 HydrophobicContact CD2-CE2 3.8Å; L166-F198 HydrophobicContact CD2-CG 4.37Å; L166-F198 HydrophobicContact CD2-CZ 4.3Å; L166-F198 HydrophobicContact CG-CD2 4.46Å; L194-F198 WeakPolarHBondContact O-CD2 3.3Å; L194-F198 PolarHBondContact O-N 2.92Å; F195-F198 PolarHBondContact O-N 2.72Å; F198-A202 VanDerWaalsContact O-CB 3.31Å; F198-A202 WeakPolarHBondContact O-CB 3.07Å; F198-A202 PolarHBondContact O-N 3.29Å
199D90.3Very high89.3Confident14 Ų1424.5 Ų24.58%0.07512%0.121CC..Hα-helixtrans-69.8-37.8172.5-80.5-25000111.8F195 A202 L203 P454 R457F195-D199 VanDerWaalsContact O-CB 3.26Å; F195-D199 WeakPolarHBondContact O-CB 3.5Å; F195-D199 PolarHBondContact O-N 3.43Å; D199-A202 PolarHBondContact O-N 2.99Å; D199-L203 VanDerWaalsContact O-CB 3.31Å; D199-L203 WeakPolarHBondContact O-CB 3.43Å; D199-L203 PolarHBondContact O-N 2.99Å; D199-P454 HydrophobicContact CB-CG 3.89Å; D199-R457 IonicContact OD1-CZ 3.15Å; D199-R457 IonicContact OD1-NH1 2.72Å; D199-R457 PolarHBondContact OD1-NH1 2.98Å; D199-R457 IonicContact OD1-NH2 3.99Å; D199-R457 PolarHBondContact OD1-NH2 3.31Å; D199-R457 IonicContact OD2-CZ 3.99Å; D199-R457 IonicContact OD2-NE 3.56Å; D199-R457 IonicContact OD2-NH1 2.76Å; D199-R457 PolarHBondContact OD2-NH1 3.48Å
200G91.9Very high89.9Confident4 Ų424.4 Ų24.44%0.04112%0.121CC..Hα-helixtrans-64-43.6172.900000111.8T196 W197 L203 I204T196-G200 WeakPolarHBondContact O-CA 3.23Å; T196-G200 PolarHBondContact O-N 2.7Å; W197-G200 PolarHBondContact O-N 3.27Å; G200-L203 PolarHBondContact O-N 3.34Å; G200-I204 WeakPolarHBondContact O-CB 3.3Å; G200-I204 VanDerWaalsContact O-CG1 3.24Å; G200-I204 WeakPolarHBondContact O-CG1 3.37Å; G200-I204 PolarHBondContact O-N 2.67Å
201L93.8Very high90.3Very high22 Ų2223.8 Ų23.812%0.11512%0.119CC..Hα-helixtrans-61.4-44.3173.2178.2155.6000111.5A19 L22 I23 Y26 W197 S205A19-L201 HydrophobicContact CB-CD1 3.77Å; L22-L201 HydrophobicContact CB-CD2 4.33Å; I23-L201 HydrophobicContact CD1-CD1 4.01Å; I23-L201 HydrophobicContact CD1-CG 4.41Å; I23-L201 HydrophobicContact CG1-CD1 3.91Å; I23-L201 HydrophobicContact CG1-CD2 3.73Å; I23-L201 HydrophobicContact CG1-CG 3.88Å; Y26-L201 HydrophobicContact CD2-CD2 4.4Å; Y26-L201 HydrophobicContact CE2-CD2 4.46Å; W197-L201 VanDerWaalsContact O-CB 3.31Å; W197-L201 WeakPolarHBondContact O-CB 3.29Å; W197-L201 PolarHBondContact O-N 2.81Å; L201-S205 VanDerWaalsContact O-CB 3.29Å; L201-S205 WeakPolarHBondContact O-CB 3.22Å; L201-S205 PolarHBondContact O-N 2.98Å; L201-S205 PolarHBondContact O-OG 3.03Å
202A92.6Very high90.6Very high2 Ų225.4 Ų25.42%0.01713%0.127CC..Hα-helixtrans-60.4-47.8176.200000111Y26 F198 D199 S205 L206Y26-A202 HydrophobicContact CD2-CB 3.79Å; Y26-A202 HydrophobicContact CE2-CB 3.4Å; Y26-A202 VanDerWaalsContact CE2-CB 3.4Å; F198-A202 VanDerWaalsContact O-CB 3.31Å; F198-A202 WeakPolarHBondContact O-CB 3.07Å; F198-A202 PolarHBondContact O-N 3.29Å; D199-A202 PolarHBondContact O-N 2.99Å; A202-S205 PolarHBondContact O-N 3.27Å; A202-L206 WeakPolarHBondContact O-CB 3.24Å; A202-L206 WeakPolarHBondContact O-CG 3.46Å; A202-L206 PolarHBondContact O-N 2.88Å
203L91.2Very high90.8Very high37 Ų3725.1 Ų25.119%0.19413%0.126CC..Hα-helixtrans-61.3-49.4179.4-172.457.6000111.2D199 G200 S205 L206 S207 D352 A356D199-L203 VanDerWaalsContact O-CB 3.31Å; D199-L203 WeakPolarHBondContact O-CB 3.43Å; D199-L203 PolarHBondContact O-N 2.99Å; G200-L203 PolarHBondContact O-N 3.34Å; L203-S205 VanDerWaalsContact C-N 3.31Å; L203-S205 PolarHBondContact O-N 3.45Å; L203-L206 PolarHBondContact O-N 3.43Å; L203-S207 WeakPolarHBondContact O-CB 3.31Å; L203-S207 PolarHBondContact O-N 3.23Å; L203-S207 PolarHBondContact O-OG 3.33Å; L203-D352 HydrophobicContact CD1-CB 3.9Å; L203-D352 WeakPolarHBondContact CD2-O 3.35Å; L203-D352 HydrophobicContact CG-CB 4.18Å; L203-A356 HydrophobicContact CB-CB 4.09Å; L203-A356 HydrophobicContact CD2-CB 3.87Å; L203-A356 HydrophobicContact CG-CB 4.12Å
204I93.6Very high90.7Very high56 Ų5623.5 Ų23.529%0.28712%0.116SC..Hα-helixtrans-57.6-45176.9-67.8164.7000111.1G200 S207 L208 A356G200-I204 WeakPolarHBondContact O-CB 3.3Å; G200-I204 VanDerWaalsContact O-CG1 3.24Å; G200-I204 WeakPolarHBondContact O-CG1 3.37Å; G200-I204 PolarHBondContact O-N 2.67Å; I204-S207 PolarHBondContact O-N 2.92Å; I204-L208 WeakPolarHBondContact O-CB 3.3Å; I204-L208 PolarHBondContact O-N 2.93Å; I204-A356 HydrophobicContact CD1-CB 4.07Å; I204-A356 HydrophobicContact CG1-CB 3.62Å
205S93.9Very high90.6Very high6 Ų625.3 Ų25.34%0.04213%0.125CC..Hα-helixtrans-66.1-47.4-177.5-56.70000111.7I27 L201 A202 L203 S209I27-S205 VanDerWaalsContact CG1-O 3.27Å; I27-S205 WeakPolarHBondContact CG1-O 3.41Å; L201-S205 VanDerWaalsContact O-CB 3.29Å; L201-S205 WeakPolarHBondContact O-CB 3.22Å; L201-S205 PolarHBondContact O-N 2.98Å; L201-S205 PolarHBondContact O-OG 3.03Å; A202-S205 PolarHBondContact O-N 3.27Å; L203-S205 VanDerWaalsContact C-N 3.31Å; L203-S205 PolarHBondContact O-N 3.45Å; S205-S209 PolarHBondContact O-OG 3.47Å
206L92.6Very high90.5Very high22 Ų2228.4 Ų28.412%0.11514%0.139CC..Hα-helixtrans-60.2-50.2175.6-66.8166.5000109.9E30 L155 A202 L203 L208 S209E30-L206 HydrophobicContact CB-CB 4.39Å; E30-L206 HydrophobicContact CB-CD2 3.81Å; E30-L206 HydrophobicContact CG-CB 4.45Å; E30-L206 WeakPolarHBondContact CG-O 3.35Å; L155-L206 HydrophobicContact CD1-CD2 4.19Å; L155-L206 HydrophobicContact CD2-CD1 4Å; L155-L206 HydrophobicContact CD2-CD2 3.76Å; A202-L206 WeakPolarHBondContact O-CB 3.24Å; A202-L206 WeakPolarHBondContact O-CG 3.46Å; A202-L206 PolarHBondContact O-N 2.88Å; L203-L206 PolarHBondContact O-N 3.43Å; L206-L208 VanDerWaalsContact C-N 3.33Å; L206-L208 PolarHBondContact O-N 3.4Å; L206-S209 WeakPolarHBondContact O-CB 3.34Å; L206-S209 PolarHBondContact O-N 3.21Å; L206-S209 VanDerWaalsContact O-N 3.08Å; L206-S209 PolarHBondContact O-OG 3.3Å
207S91.3Very high90.3Very high2 Ų228.5 Ų28.51%0.01414%0.139CC..Hα-helixtrans-64.8-31.1-176.1-60.50000114.2L203 I204 S209 N210 P211 G349 D352L203-S207 WeakPolarHBondContact O-CB 3.31Å; L203-S207 PolarHBondContact O-N 3.23Å; L203-S207 PolarHBondContact O-OG 3.33Å; I204-S207 PolarHBondContact O-N 2.92Å; S207-S209 PolarHBondContact O-N 3.33Å; S207-N210 PolarHBondContact O-N 3.39Å; S207-P211 WeakPolarHBondContact O-CD 3.35Å; S207-G349 WeakPolarHBondContact O-CA 3.24Å; S207-D352 WeakPolarHBondContact OG-CB 3.48Å
208L92.7Very high89.7Confident71 Ų7123 Ų2337%0.37212%0.118SC..Hα-helixtrans-64.1-26.4176.2-163.871.2000112.2I27 I204 L206 N210 P211 I212 I353I27-L208 HydrophobicContact CD1-CD2 4.33Å; I204-L208 WeakPolarHBondContact O-CB 3.3Å; I204-L208 PolarHBondContact O-N 2.93Å; L206-L208 VanDerWaalsContact C-N 3.33Å; L206-L208 PolarHBondContact O-N 3.4Å; L208-N210 VanDerWaalsContact C-N 3.34Å; L208-N210 PolarHBondContact O-N 2.92Å; L208-P211 WeakPolarHBondContact O-CD 3.46Å; L208-I212 HydrophobicContact CD2-CD1 3.95Å; L208-I212 HydrophobicContact CG-CD1 3.7Å; L208-I212 HydrophobicContact CG-CG1 4.41Å; L208-I212 WeakPolarHBondContact O-CB 3.39Å; L208-I212 WeakPolarHBondContact O-CD1 3.34Å; L208-I212 WeakPolarHBondContact O-CG1 3.24Å; L208-I212 PolarHBondContact O-N 2.7Å; L208-I353 HydrophobicContact CD1-CD1 4.43Å
209S90.8Very high89.2Confident0 Ų030.7 Ų30.70%015%0.147CC..Hα-helixtrans-66.2-33.4-179.7-470000113.1I27 S205 L206 S207 G213I27-S209 VanDerWaalsContact CA-OG 3.3Å; I27-S209 WeakPolarHBondContact CA-OG 3.31Å; I27-S209 PolarHBondContact O-OG 2.99Å; I27-S209 VanDerWaalsContact O-OG 3.06Å; S205-S209 PolarHBondContact O-OG 3.47Å; L206-S209 WeakPolarHBondContact O-CB 3.34Å; L206-S209 PolarHBondContact O-N 3.21Å; L206-S209 VanDerWaalsContact O-N 3.08Å; L206-S209 PolarHBondContact O-OG 3.3Å; S207-S209 PolarHBondContact O-N 3.33Å; S209-G213 WeakPolarHBondContact O-CA 3.5Å; S209-G213 PolarHBondContact O-N 3.3Å
210N86Confident88.7Confident3 Ų334.2 Ų34.22%0.01617%0.166CC..Hα-helixtrans-69.4-49.3-176.6-68.6-42000112.6F34 S207 L208 G214 Y329F34-N210 WeakPolarHBondContact CD2-OD1 3.16Å; S207-N210 PolarHBondContact O-N 3.39Å; L208-N210 VanDerWaalsContact C-N 3.34Å; L208-N210 PolarHBondContact O-N 2.92Å; N210-G214 PolarHBondContact O-N 3.24Å; N210-Y329 PolarHBondContact ND2-OH 3.04Å
211P89.5Confident88.3Confident26 Ų2634.1 Ų34.117%0.16917%0.165CC..Hα-helixtrans-61.6-43.7170.8-22.731.6000113S207 L208 G214 I215 G345S207-P211 WeakPolarHBondContact O-CD 3.35Å; L208-P211 WeakPolarHBondContact O-CD 3.46Å; P211-G214 PolarHBondContact O-N 2.91Å; P211-I215 WeakPolarHBondContact O-CB 3.45Å; P211-I215 WeakPolarHBondContact O-CD1 3.2Å; P211-I215 VanDerWaalsContact O-CG1 3.23Å; P211-I215 WeakPolarHBondContact O-CG1 3.35Å; P211-I215 PolarHBondContact O-N 3.45Å; P211-G345 WeakPolarHBondContact CD-O 3.5Å; P211-G345 WeakPolarHBondContact CG-O 3.5Å
212I90.4Very high88Confident46 Ų4634.8 Ų34.824%0.23617%0.167CC..Hα-helixtrans-60.4-51.9179.5-73.4176.1000110.4L208 F216L208-I212 HydrophobicContact CD2-CD1 3.95Å; L208-I212 HydrophobicContact CG-CD1 3.7Å; L208-I212 HydrophobicContact CG-CG1 4.41Å; L208-I212 WeakPolarHBondContact O-CB 3.39Å; L208-I212 WeakPolarHBondContact O-CD1 3.34Å; L208-I212 WeakPolarHBondContact O-CG1 3.24Å; L208-I212 PolarHBondContact O-N 2.7Å; I212-F216 HydrophobicContact CG2-CD2 3.62Å; I212-F216 HydrophobicContact CG2-CE2 3.69Å; I212-F216 WeakPolarHBondContact O-CB 3.37Å; I212-F216 WeakPolarHBondContact O-CD2 3.49Å; I212-F216 PolarHBondContact O-N 3.46Å; I212-F216 VanDerWaalsContact O-N 3.07Å
213G86.2Confident87.9Confident0 Ų043.5 Ų43.50%020%0.2CC..Hα-helixtrans-60.2-48178.500000111.5L31 F34 S209 L217L31-G213 VanDerWaalsContact CD1-CA 3.44Å; F34-G213 VanDerWaalsContact CE1-C 3.45Å; S209-G213 WeakPolarHBondContact O-CA 3.5Å; S209-G213 PolarHBondContact O-N 3.3Å; G213-L217 WeakPolarHBondContact O-CB 3.33Å; G213-L217 WeakPolarHBondContact O-CD1 3.4Å; G213-L217 VanDerWaalsContact O-CG 3.22Å; G213-L217 WeakPolarHBondContact O-CG 3.5Å; G213-L217 PolarHBondContact O-N 2.81Å
214G84.2Confident87.9Confident1 Ų144.6 Ų44.61%0.0121%0.205CC..Hα-helixtrans-59.8-48.3179.200000113.2F34 N210 P211 Y218F34-G214 VanDerWaalsContact CE1-N 3.34Å; N210-G214 PolarHBondContact O-N 3.24Å; P211-G214 PolarHBondContact O-N 2.91Å; G214-Y218 VanDerWaalsContact O-CB 3.29Å; G214-Y218 WeakPolarHBondContact O-CB 3.35Å; G214-Y218 PolarHBondContact O-N 2.95Å
215I87.7Confident87.8Confident60 Ų6041.9 Ų41.931%0.30819%0.192SC..Hα-helixtrans-65.3-47.6-178.9-68.6167000111.4P211 Y218 R219P211-I215 WeakPolarHBondContact O-CB 3.45Å; P211-I215 WeakPolarHBondContact O-CD1 3.2Å; P211-I215 VanDerWaalsContact O-CG1 3.23Å; P211-I215 WeakPolarHBondContact O-CG1 3.35Å; P211-I215 PolarHBondContact O-N 3.45Å; I215-Y218 PolarHBondContact O-N 2.67Å; I215-R219 PolarHBondContact O-N 3Å; I215-R219 VanDerWaalsContact O-N 3.12Å
216F88.6Confident87.7Confident65 Ų6541.9 Ų41.929%0.28519%0.191SC..Hα-helixtrans-71.8-37-177.7-72.1-47000112.4I212 Y218 R219 D220 G221 L224 P225 I228I212-F216 HydrophobicContact CG2-CD2 3.62Å; I212-F216 HydrophobicContact CG2-CE2 3.69Å; I212-F216 WeakPolarHBondContact O-CB 3.37Å; I212-F216 WeakPolarHBondContact O-CD2 3.49Å; I212-F216 PolarHBondContact O-N 3.46Å; I212-F216 VanDerWaalsContact O-N 3.07Å; F216-Y218 VanDerWaalsContact C-N 3.32Å; F216-Y218 PolarHBondContact O-N 3.05Å; F216-R219 PolarHBondContact O-N 3.32Å; F216-D220 PolarHBondContact O-N 3.11Å; F216-G221 PolarHBondContact O-N 3.15Å; F216-L224 HydrophobicContact CB-CD2 4.5Å; F216-L224 HydrophobicContact CD1-CD2 3.47Å; F216-L224 VanDerWaalsContact CD1-CD2 3.47Å; F216-L224 HydrophobicContact CD1-CG 4.47Å; F216-L224 HydrophobicContact CE1-CD2 3.75Å; F216-L224 HydrophobicContact CG-CD2 4.02Å; F216-L224 HydrophobicContact CZ-CD2 4.48Å; F216-P225 HydrophobicContact CB-CG 3.75Å; F216-I228 HydrophobicContact CD2-CD1 3.75Å; F216-I228 HydrophobicContact CE2-CD1 3.49Å; F216-I228 VanDerWaalsContact CE2-CD1 3.49Å; F216-I228 HydrophobicContact CZ-CD1 4.16Å
217L84.7Confident87.8Confident6 Ų645.3 Ų45.33%0.03121%0.208CC..Hα-helixtrans-63.2-41.6173.6-78.3166.1000111.4F34 Q38 F59 G213 R219 G221 F222 P225F34-L217 HydrophobicContact CD1-CD1 3.6Å; F34-L217 HydrophobicContact CE1-CD1 3.47Å; F34-L217 VanDerWaalsContact CE1-CD1 3.47Å; Q38-L217 HydrophobicContact CB-CD1 4.04Å; Q38-L217 HydrophobicContact CG-CD1 3.91Å; F59-L217 WeakPolarHBondContact CB-O 3.19Å; G213-L217 WeakPolarHBondContact O-CB 3.33Å; G213-L217 WeakPolarHBondContact O-CD1 3.4Å; G213-L217 VanDerWaalsContact O-CG 3.22Å; G213-L217 WeakPolarHBondContact O-CG 3.5Å; G213-L217 PolarHBondContact O-N 2.81Å; L217-R219 VanDerWaalsContact C-N 3.35Å; L217-R219 PolarHBondContact O-N 3.04Å; L217-G221 WeakPolarHBondContact O-CA 3.31Å; L217-G221 PolarHBondContact O-N 3.21Å; L217-F222 HydrophobicContact CD2-CB 4.37Å; L217-F222 HydrophobicContact CD2-CD1 3.34Å; L217-F222 HydrophobicContact CD2-CD2 4.38Å; L217-F222 HydrophobicContact CD2-CE1 3.55Å; L217-F222 HydrophobicContact CD2-CG 3.8Å; L217-F222 HydrophobicContact CD2-CZ 4.17Å; L217-P225 HydrophobicContact CD2-CG 4.04Å; L217-P225 HydrophobicContact CG-CG 3.92Å
218Y78.1Confident87.9Confident30 Ų3047.2 Ų47.212%0.11822%0.218CC..Hα-helixtrans-65.1-36.1178.8-173.9-111.6000112.7K58 F59 E60 G214 I215 F216K58-Y218 CarbonylContact C-O 3.47Å; K58-Y218 VanDerWaalsContact CA-O 3.31Å; K58-Y218 WeakPolarHBondContact CA-O 3.48Å; K58-Y218 HydrophobicContact CB-CE1 4.07Å; K58-Y218 HydrophobicContact CB-CE2 4.03Å; K58-Y218 HydrophobicContact CD-CE1 3.88Å; K58-Y218 WeakPolarHBondContact CD-OH 2.9Å; K58-Y218 WeakPolarHBondContact CE-OH 3.31Å; K58-Y218 HydrophobicContact CG-CD1 4.31Å; K58-Y218 HydrophobicContact CG-CE1 3.55Å; K58-Y218 HydrophobicContact CG-CE2 4.41Å; K58-Y218 PolarHBondContact NZ-OH 3.42Å; F59-Y218 PolarHBondContact N-O 3.22Å; E60-Y218 HydrophobicContact CB-CE2 4.43Å; E60-Y218 PolarHBondContact OE2-OH 3.25Å; G214-Y218 VanDerWaalsContact O-CB 3.29Å; G214-Y218 WeakPolarHBondContact O-CB 3.35Å; G214-Y218 PolarHBondContact O-N 2.95Å; I215-Y218 PolarHBondContact O-N 2.67Å; F216-Y218 VanDerWaalsContact C-N 3.32Å; F216-Y218 PolarHBondContact O-N 3.05Å
219R83.3Confident88Confident171 Ų17144 Ų4465%0.64520%0.201SC*.Hα-helixtrans-93-46.9-175.8-69.6-177.2173.8-170.3-1.9114.8G57 I215 F216 L217G57-R219 CarbonylContact O-C 3.55Å; G57-R219 WeakPolarHBondContact O-CA 3.26Å; I215-R219 PolarHBondContact O-N 3Å; I215-R219 VanDerWaalsContact O-N 3.12Å; F216-R219 PolarHBondContact O-N 3.32Å; L217-R219 VanDerWaalsContact C-N 3.35Å; L217-R219 PolarHBondContact O-N 3.04Å
220D79.5Confident88.2Confident89 Ų8946.3 Ų46.348%0.47621%0.214SC..Hα-helixtrans-114.10.7-167.1-59.2-55.5000112.6F216 L224F216-D220 PolarHBondContact O-N 3.11Å; D220-L224 HydrophobicContact CB-CB 4.1Å; D220-L224 HydrophobicContact CB-CD2 4.2Å; D220-L224 VanDerWaalsContact OD2-CD2 3.29Å; D220-L224 WeakPolarHBondContact OD2-CD2 3.37Å
221G84.1Confident88.7Confident2 Ų251 Ų512%0.02124%0.237CC..THydrogen-bonded Turntrans66.5-154.9-173.200000112.4F59 F216 L217 R223 P225F59-G221 VanDerWaalsContact CE2-CA 3.47Å; F216-G221 PolarHBondContact O-N 3.15Å; L217-G221 WeakPolarHBondContact O-CA 3.31Å; L217-G221 PolarHBondContact O-N 3.21Å; G221-R223 PolarHBondContact O-N 2.88Å; G221-P225 WeakPolarHBondContact O-CD 3.36Å; G221-P225 WeakPolarHBondContact O-CG 3.5Å
222F88Confident89Confident35 Ų3551.2 Ų51.215%0.15424%0.237CC..THydrogen-bonded Turntrans-77.7-19.4-169.1-69.5-85.1000115.6I35 Q38 Y39 Y42 V132 L217 I226I35-F222 HydrophobicContact CG2-CD1 4.15Å; Q38-F222 HydrophobicContact CB-CE1 4.18Å; Q38-F222 HydrophobicContact CB-CZ 4.44Å; Y39-F222 HydrophobicContact CD2-CD1 4.36Å; Y39-F222 HydrophobicContact CD2-CE1 4.18Å; Y39-F222 HydrophobicContact CD2-CZ 4.25Å; Y42-F222 HydrophobicContact CD2-CE2 4.05Å; Y42-F222 AromaticContact CD2-CZ 3.52Å; Y42-F222 HydrophobicContact CD2-CZ 3.52Å; Y42-F222 HydrophobicContact CE2-CZ 4.16Å; Y42-F222 HydrophobicContact CG-CE2 4.25Å; Y42-F222 HydrophobicContact CG-CZ 4.07Å; V132-F222 HydrophobicContact CG1-CB 3.6Å; V132-F222 HydrophobicContact CG1-CD1 3.9Å; V132-F222 HydrophobicContact CG1-CG 3.85Å; L217-F222 HydrophobicContact CD2-CB 4.37Å; L217-F222 HydrophobicContact CD2-CD1 3.34Å; L217-F222 HydrophobicContact CD2-CD2 4.38Å; L217-F222 HydrophobicContact CD2-CE1 3.55Å; L217-F222 HydrophobicContact CD2-CG 3.8Å; L217-F222 HydrophobicContact CD2-CZ 4.17Å; F222-I226 HydrophobicContact CB-CD1 4.37Å; F222-I226 VanDerWaalsContact O-CD1 3.3Å; F222-I226 WeakPolarHBondContact O-CD1 3.46Å; F222-I226 VanDerWaalsContact O-CG1 3.24Å; F222-I226 WeakPolarHBondContact O-CG1 3.17Å; F222-I226 PolarHBondContact O-N 3.23Å
223R89.8Confident89.3Confident186 Ų18649.2 Ų49.270%0.70223%0.227SC*.Hα-helixtrans-67-50-169.8-69.1-178.2178.4175.10.6112.6L133 G221 I226 I227L133-R223 HydrophobicContact CD2-CG 4.25Å; G221-R223 PolarHBondContact O-N 2.88Å; R223-I226 PolarHBondContact O-N 2.86Å; R223-I227 WeakPolarHBondContact O-CG1 3.47Å; R223-I227 PolarHBondContact O-N 3.48Å
224L90.2Very high89.7Confident59 Ų5950.6 Ų50.631%0.30924%0.241SC..Hα-helixtrans-66.2-47.8-176-178.568.9000112.8F216 D220 I226 I227 I228F216-L224 HydrophobicContact CB-CD2 4.5Å; F216-L224 HydrophobicContact CD1-CD2 3.47Å; F216-L224 VanDerWaalsContact CD1-CD2 3.47Å; F216-L224 HydrophobicContact CD1-CG 4.47Å; F216-L224 HydrophobicContact CE1-CD2 3.75Å; F216-L224 HydrophobicContact CG-CD2 4.02Å; F216-L224 HydrophobicContact CZ-CD2 4.48Å; D220-L224 HydrophobicContact CB-CB 4.1Å; D220-L224 HydrophobicContact CB-CD2 4.2Å; D220-L224 VanDerWaalsContact OD2-CD2 3.29Å; D220-L224 WeakPolarHBondContact OD2-CD2 3.37Å; L224-I226 VanDerWaalsContact C-N 3.26Å; L224-I226 PolarHBondContact O-N 3.48Å; L224-I227 PolarHBondContact O-N 3.44Å; L224-I228 HydrophobicContact CD1-CD1 4.37Å; L224-I228 HydrophobicContact CG-CD1 4.05Å; L224-I228 WeakPolarHBondContact O-CG1 3.29Å; L224-I228 PolarHBondContact O-N 2.87Å
225P91.8Very high90.2Very high0 Ų053.6 Ų53.60%026%0.256CS..Hα-helixtrans-54.3-39.8174.6-25.331.5000113.7I35 F216 L217 G221 I228 C229I35-P225 HydrophobicContact CD1-CB 3.5Å; I35-P225 VanDerWaalsContact CD1-CB 3.5Å; I35-P225 HydrophobicContact CG1-CB 3.85Å; F216-P225 HydrophobicContact CB-CG 3.75Å; L217-P225 HydrophobicContact CD2-CG 4.04Å; L217-P225 HydrophobicContact CG-CG 3.92Å; G221-P225 WeakPolarHBondContact O-CD 3.36Å; G221-P225 WeakPolarHBondContact O-CG 3.5Å; P225-I228 PolarHBondContact O-N 2.71Å; P225-C229 VanDerWaalsContact O-CB 3.31Å; P225-C229 WeakPolarHBondContact O-CB 3.39Å; P225-C229 PolarHBondContact O-N 2.8Å
226I93.2Very high90.5Very high5 Ų550.8 Ų50.83%0.02624%0.242CC..Hα-helixtrans-65.5-44.3178.8-73.7170.8000111.6I35 S129 V132 L133 F222 R223 L224 I228 C229 N230I35-I226 HydrophobicContact CD1-CG1 4.17Å; I35-I226 HydrophobicContact CG2-CD1 4.48Å; I35-I226 HydrophobicContact CG2-CG1 4.16Å; S129-I226 WeakPolarHBondContact OG-CG2 3.36Å; V132-I226 HydrophobicContact CB-CD1 3.48Å; V132-I226 VanDerWaalsContact CB-CD1 3.48Å; V132-I226 HydrophobicContact CG1-CD1 3.35Å; V132-I226 HydrophobicContact CG2-CD1 4.32Å; L133-I226 HydrophobicContact CD1-CG2 4.26Å; L133-I226 HydrophobicContact CD2-CD1 4.44Å; L133-I226 HydrophobicContact CG-CD1 4.34Å; L133-I226 HydrophobicContact CG-CG2 4.35Å; F222-I226 HydrophobicContact CB-CD1 4.37Å; F222-I226 VanDerWaalsContact O-CD1 3.3Å; F222-I226 WeakPolarHBondContact O-CD1 3.46Å; F222-I226 VanDerWaalsContact O-CG1 3.24Å; F222-I226 WeakPolarHBondContact O-CG1 3.17Å; F222-I226 PolarHBondContact O-N 3.23Å; R223-I226 PolarHBondContact O-N 2.86Å; L224-I226 VanDerWaalsContact C-N 3.26Å; L224-I226 PolarHBondContact O-N 3.48Å; I226-I228 VanDerWaalsContact C-N 3.33Å; I226-I228 PolarHBondContact O-N 3.47Å; I226-C229 WeakPolarHBondContact O-CB 3.05Å; I226-C229 PolarHBondContact O-N 2.93Å; I226-N230 PolarHBondContact O-N 3.33Å; I226-N230 PolarHBondContact O-ND2 3.42Å
227I93.9Very high90.8Very high95 Ų9550.2 Ų50.249%0.48724%0.241SC..Hα-helixtrans-61.3-46.3178.2-67.4166000109.9R223 L224 C229 N230 I231R223-I227 WeakPolarHBondContact O-CG1 3.47Å; R223-I227 PolarHBondContact O-N 3.48Å; L224-I227 PolarHBondContact O-N 3.44Å; I227-C229 VanDerWaalsContact C-N 3.32Å; I227-C229 PolarHBondContact O-N 3.27Å; I227-N230 PolarHBondContact O-N 2.88Å; I227-I231 HydrophobicContact CG2-CD1 3.81Å; I227-I231 WeakPolarHBondContact O-CG1 3.3Å; I227-I231 PolarHBondContact O-N 3.03Å
228I94.3Very high91.2Very high42 Ų4255.2 Ų55.222%0.21527%0.268CS..Hα-helixtrans-58.1-46.5176.6-66.4169.2000110.4L31 F216 L224 P225 I226 N230 I231 L232L31-I228 HydrophobicContact CD2-CB 4.44Å; L31-I228 HydrophobicContact CD2-CG2 4.05Å; F216-I228 HydrophobicContact CD2-CD1 3.75Å; F216-I228 HydrophobicContact CE2-CD1 3.49Å; F216-I228 VanDerWaalsContact CE2-CD1 3.49Å; F216-I228 HydrophobicContact CZ-CD1 4.16Å; L224-I228 HydrophobicContact CD1-CD1 4.37Å; L224-I228 HydrophobicContact CG-CD1 4.05Å; L224-I228 WeakPolarHBondContact O-CG1 3.29Å; L224-I228 PolarHBondContact O-N 2.87Å; P225-I228 PolarHBondContact O-N 2.71Å; I226-I228 VanDerWaalsContact C-N 3.33Å; I226-I228 PolarHBondContact O-N 3.47Å; I228-N230 PolarHBondContact O-N 3.41Å; I228-I231 PolarHBondContact O-N 2.94Å; I228-L232 HydrophobicContact CG2-CD1 3.84Å; I228-L232 HydrophobicContact CG2-CG 4.36Å; I228-L232 VanDerWaalsContact O-CG 3.31Å; I228-L232 WeakPolarHBondContact O-CG 3.17Å; I228-L232 PolarHBondContact O-N 2.92Å
229C94.5Very high91.8Very high3 Ų356.6 Ų56.62%0.0227%0.274CS..Hα-helixtrans-58.5-45.7178.8-171.10000112.4A28 L31 I125 P225 I226 I227 L232 I233A28-C229 PolarHBondContact O-SG 3.18Å; L31-C229 HydrophobicContact CD2-CB 4.11Å; L31-C229 HydrophobicContact CG-CB 4.49Å; I125-C229 HydrophobicContact CG2-CB 4.49Å; I125-C229 VanDerWaalsContact CG2-SG 3.55Å; P225-C229 VanDerWaalsContact O-CB 3.31Å; P225-C229 WeakPolarHBondContact O-CB 3.39Å; P225-C229 PolarHBondContact O-N 2.8Å; I226-C229 WeakPolarHBondContact O-CB 3.05Å; I226-C229 PolarHBondContact O-N 2.93Å; I227-C229 VanDerWaalsContact C-N 3.32Å; I227-C229 PolarHBondContact O-N 3.27Å; C229-L232 PolarHBondContact O-N 3.47Å; C229-I233 WeakPolarHBondContact O-CG2 3.42Å; C229-I233 PolarHBondContact O-N 3.22Å; C229-I233 VanDerWaalsContact O-N 3.1Å
230N95.2Very high92.2Very high48 Ų4849.2 Ų49.226%0.25725%0.248SC..Hα-helixtrans-65.9-37.6177.7-77.6-81.6000113.2S129 I226 I227 I228 I233 G234S129-N230 PolarHBondContact OG-ND2 3.48Å; I226-N230 PolarHBondContact O-N 3.33Å; I226-N230 PolarHBondContact O-ND2 3.42Å; I227-N230 PolarHBondContact O-N 2.88Å; I228-N230 PolarHBondContact O-N 3.41Å; N230-I233 VanDerWaalsContact O-CG2 3.25Å; N230-I233 WeakPolarHBondContact O-CG2 3.22Å; N230-G234 PolarHBondContact O-N 2.81Å
231I96.2Very high92.6Very high101 Ų10152.4 Ų52.452%0.51826%0.258SS..Hα-helixtrans-64.6-46.1176.4-69167.2000110.2I227 I228 G234 I235I227-I231 HydrophobicContact CG2-CD1 3.81Å; I227-I231 WeakPolarHBondContact O-CG1 3.3Å; I227-I231 PolarHBondContact O-N 3.03Å; I228-I231 PolarHBondContact O-N 2.94Å; I231-G234 PolarHBondContact O-N 3.49Å; I231-I235 HydrophobicContact CG2-CD1 4.13Å; I231-I235 WeakPolarHBondContact O-CG1 3.45Å; I231-I235 PolarHBondContact O-N 3.37Å
232L96.4Very high92.8Very high31 Ų3158.9 Ų58.916%0.16229%0.286CS..Hα-helixtrans-63.1-44.7-178.6-71.1171.8000112.3P24 I27 A28 I228 C229 G234 I235 S236P24-L232 HydrophobicContact CB-CB 4.31Å; P24-L232 HydrophobicContact CB-CD2 3.9Å; I27-L232 HydrophobicContact CB-CD1 4.01Å; I27-L232 HydrophobicContact CG2-CD1 3.49Å; I27-L232 VanDerWaalsContact CG2-CD1 3.49Å; A28-L232 HydrophobicContact CB-CB 3.78Å; I228-L232 HydrophobicContact CG2-CD1 3.84Å; I228-L232 HydrophobicContact CG2-CG 4.36Å; I228-L232 VanDerWaalsContact O-CG 3.31Å; I228-L232 WeakPolarHBondContact O-CG 3.17Å; I228-L232 PolarHBondContact O-N 2.92Å; C229-L232 PolarHBondContact O-N 3.47Å; L232-G234 VanDerWaalsContact C-N 3.3Å; L232-G234 PolarHBondContact O-N 3.42Å; L232-I235 WeakPolarHBondContact O-CB 3.43Å; L232-I235 PolarHBondContact O-N 2.86Å; L232-S236 PolarHBondContact O-N 3.41Å; L232-S236 VanDerWaalsContact O-N 3.15Å; L232-S236 PolarHBondContact O-OG 3.33Å
233I95.2Very high92.8Very high4 Ų457.4 Ų57.42%0.02128%0.279CS..Hα-helixtrans-66.4-34175.6-169.861.9000112.2L25 A28 I118 A122 I125 C229 N230 I235 S236 L237L25-I233 HydrophobicContact CD1-CD1 3.52Å; A28-I233 HydrophobicContact CB-CB 4.29Å; I118-I233 HydrophobicContact CG2-CD1 4.17Å; A122-I233 HydrophobicContact CB-CD1 4.35Å; A122-I233 HydrophobicContact CB-CG1 3.7Å; I125-I233 HydrophobicContact CD1-CB 3.8Å; I125-I233 HydrophobicContact CD1-CD1 4.18Å; I125-I233 HydrophobicContact CD1-CG1 3.92Å; I125-I233 HydrophobicContact CD1-CG2 4.18Å; I125-I233 HydrophobicContact CG2-CG2 4.12Å; C229-I233 WeakPolarHBondContact O-CG2 3.42Å; C229-I233 PolarHBondContact O-N 3.22Å; C229-I233 VanDerWaalsContact O-N 3.1Å; N230-I233 VanDerWaalsContact O-CG2 3.25Å; N230-I233 WeakPolarHBondContact O-CG2 3.22Å; I233-I235 VanDerWaalsContact C-N 3.33Å; I233-I235 PolarHBondContact O-N 2.88Å; I233-S236 PolarHBondContact O-N 2.95Å; I233-L237 WeakPolarHBondContact O-CG 3.21Å; I233-L237 PolarHBondContact O-N 3.48Å
234G94.6Very high92.6Very high29 Ų2950.7 Ų50.730%0.29926%0.259SS..Hα-helixtrans-60.1-41.2172.600000112.5N230 I231 L232 L237 L238N230-G234 PolarHBondContact O-N 2.81Å; I231-G234 PolarHBondContact O-N 3.49Å; L232-G234 VanDerWaalsContact C-N 3.3Å; L232-G234 PolarHBondContact O-N 3.42Å; G234-L237 PolarHBondContact O-N 2.82Å; G234-L238 WeakPolarHBondContact O-CG 3.37Å; G234-L238 PolarHBondContact O-N 2.9Å; G234-L238 VanDerWaalsContact O-N 3.17Å
235I95.4Very high92.2Very high65 Ų6550.7 Ų50.733%0.33326%0.258SS..Hα-helixtrans-61.3-46.2174.4-67.2166.5000110.5P24 I231 L232 I233 L237 L238 F239P24-I235 HydrophobicContact CB-CB 4.39Å; P24-I235 HydrophobicContact CB-CG2 4.26Å; P24-I235 HydrophobicContact CG-CB 4.48Å; P24-I235 HydrophobicContact CG-CG2 3.91Å; I231-I235 HydrophobicContact CG2-CD1 4.13Å; I231-I235 WeakPolarHBondContact O-CG1 3.45Å; I231-I235 PolarHBondContact O-N 3.37Å; L232-I235 WeakPolarHBondContact O-CB 3.43Å; L232-I235 PolarHBondContact O-N 2.86Å; I233-I235 VanDerWaalsContact C-N 3.33Å; I233-I235 PolarHBondContact O-N 2.88Å; I235-L237 PolarHBondContact O-N 3.44Å; I235-L238 WeakPolarHBondContact O-CB 3.49Å; I235-L238 PolarHBondContact O-N 3.27Å; I235-L238 VanDerWaalsContact O-N 3.1Å; I235-F239 HydrophobicContact CG2-CD2 3.63Å; I235-F239 HydrophobicContact CG2-CE2 3.56Å; I235-F239 WeakPolarHBondContact O-CD2 3.5Å; I235-F239 PolarHBondContact O-N 2.95Å; I235-F239 VanDerWaalsContact O-N 3.1Å
236S94.1Very high91.4Very high0 Ų050.9 Ų50.90%026%0.26CS..Hα-helixtrans-61.9-41.3178.3-53.80000112.4L21 L25 L232 I233 L238 F239 I240L21-S236 WeakPolarHBondContact CD1-O 3.25Å; L21-S236 PolarHBondContact O-OG 3.23Å; L25-S236 VanDerWaalsContact CA-OG 3.32Å; L25-S236 WeakPolarHBondContact CA-OG 3.42Å; L25-S236 WeakPolarHBondContact CB-OG 3.32Å; L25-S236 PolarHBondContact N-OG 2.85Å; L232-S236 PolarHBondContact O-N 3.41Å; L232-S236 VanDerWaalsContact O-N 3.15Å; L232-S236 PolarHBondContact O-OG 3.33Å; I233-S236 PolarHBondContact O-N 2.95Å; S236-L238 PolarHBondContact O-N 3.02Å; S236-F239 PolarHBondContact O-N 2.91Å; S236-I240 PolarHBondContact O-N 3.47Å
237L93.6Very high90.1Very high53 Ų5353.3 Ų53.328%0.27727%0.271SS..Hα-helixtrans-62.5-27.5174.7-78.3170.1000113.2I118 I119 A122 I233 G234 I235 I240 F241I118-L237 HydrophobicContact CG2-CD2 3.67Å; I118-L237 HydrophobicContact CG2-CG 4.02Å; I119-L237 HydrophobicContact CG1-CD2 4.17Å; A122-L237 HydrophobicContact CB-CD1 3.78Å; A122-L237 HydrophobicContact CB-CD2 4.45Å; A122-L237 HydrophobicContact CB-CG 4.37Å; I233-L237 WeakPolarHBondContact O-CG 3.21Å; I233-L237 PolarHBondContact O-N 3.48Å; G234-L237 PolarHBondContact O-N 2.82Å; I235-L237 PolarHBondContact O-N 3.44Å; L237-I240 VanDerWaalsContact O-CG2 3.25Å; L237-I240 WeakPolarHBondContact O-CG2 3.22Å; L237-F241 WeakPolarHBondContact O-CD2 3.48Å; L237-F241 VanDerWaalsContact O-CE2 3.28Å; L237-F241 WeakPolarHBondContact O-CE2 3.31Å
238L93Very high88.4Confident112 Ų11257.4 Ų57.459%0.58629%0.285SS*.Hα-helixtrans-78-40.5174.8-68.7172.6000111.6G234 I235 S236 I240 F241 F242G234-L238 WeakPolarHBondContact O-CG 3.37Å; G234-L238 PolarHBondContact O-N 2.9Å; G234-L238 VanDerWaalsContact O-N 3.17Å; I235-L238 WeakPolarHBondContact O-CB 3.49Å; I235-L238 PolarHBondContact O-N 3.27Å; I235-L238 VanDerWaalsContact O-N 3.1Å; S236-L238 PolarHBondContact O-N 3.02Å; L238-I240 VanDerWaalsContact C-N 3.32Å; L238-I240 PolarHBondContact O-N 2.97Å; L238-F241 PolarHBondContact O-N 3.29Å; L238-F242 WeakPolarHBondContact O-CD2 3.32Å
239F92Very high86Confident58 Ų5859.9 Ų59.925%0.25430%0.298SS..Hα-helixtrans-68.3-26.5-176.5-86.1-69.4000114.2L17 M20 L21 I235 S236 F241 F242 L243L17-F239 HydrophobicContact CD2-CD1 4.43Å; M20-F239 HydrophobicContact CB-CD1 4.15Å; M20-F239 HydrophobicContact CB-CE1 3.95Å; M20-F239 HydrophobicContact CB-CE2 4.34Å; M20-F239 HydrophobicContact CB-CG 4.45Å; M20-F239 HydrophobicContact CB-CZ 4.06Å; M20-F239 HydrophobicContact SD-CE1 3.92Å; M20-F239 HydrophobicContact SD-CZ 4.18Å; L21-F239 HydrophobicContact CB-CB 4.09Å; L21-F239 HydrophobicContact CD1-CB 3.68Å; I235-F239 HydrophobicContact CG2-CD2 3.63Å; I235-F239 HydrophobicContact CG2-CE2 3.56Å; I235-F239 WeakPolarHBondContact O-CD2 3.5Å; I235-F239 PolarHBondContact O-N 2.95Å; I235-F239 VanDerWaalsContact O-N 3.1Å; S236-F239 PolarHBondContact O-N 2.91Å; F239-F241 PolarHBondContact O-N 3.29Å; F239-F242 PolarHBondContact O-N 2.91Å; F239-F242 VanDerWaalsContact O-N 3.07Å; F239-L243 PolarHBondContact O-N 3.06Å
240I90.4Very high83.3Confident16 Ų1668.3 Ų68.38%0.08234%0.335CS..G310 helixtrans-61.4-31.2179.7-168.660.8000112.6L21 R111 L114 I118 S236 L237 L238 F242 L243L21-I240 HydrophobicContact CD1-CB 4.19Å; L21-I240 HydrophobicContact CD2-CD1 4.07Å; R111-I240 HydrophobicContact CG-CD1 4.27Å; L114-I240 HydrophobicContact CB-CD1 3.98Å; I118-I240 HydrophobicContact CD1-CB 4.3Å; I118-I240 HydrophobicContact CD1-CD1 4.07Å; I118-I240 HydrophobicContact CD1-CG1 4.3Å; S236-I240 PolarHBondContact O-N 3.47Å; L237-I240 VanDerWaalsContact O-CG2 3.25Å; L237-I240 WeakPolarHBondContact O-CG2 3.22Å; L238-I240 VanDerWaalsContact C-N 3.32Å; L238-I240 PolarHBondContact O-N 2.97Å; I240-F242 VanDerWaalsContact C-N 3.27Å; I240-F242 PolarHBondContact O-N 2.92Å; I240-L243 HydrophobicContact CD1-CD2 4.06Å; I240-L243 WeakPolarHBondContact O-CB 3.35Å; I240-L243 PolarHBondContact O-N 3.23Å
241F89.1Confident80.2Confident156 Ų15674 Ų7468%0.68436%0.36SS*.G310 helixtrans-67.7-28.5177.8-67.6-73.1000112.8L237 L238 F239L237-F241 WeakPolarHBondContact O-CD2 3.48Å; L237-F241 VanDerWaalsContact O-CE2 3.28Å; L237-F241 WeakPolarHBondContact O-CE2 3.31Å; L238-F241 PolarHBondContact O-N 3.29Å; F239-F241 PolarHBondContact O-N 3.29Å
242F88.8Confident77Confident139 Ų13973.5 Ų73.561%0.6137%0.365SS*.G310 helixtrans-86.1-13.6178.9-62.8-72.6000113.1L17 L238 F239 I240 P244L17-F242 HydrophobicContact CD2-CB 4.22Å; L238-F242 WeakPolarHBondContact O-CD2 3.32Å; F239-F242 PolarHBondContact O-N 2.91Å; F239-F242 VanDerWaalsContact O-N 3.07Å; I240-F242 VanDerWaalsContact C-N 3.27Å; I240-F242 PolarHBondContact O-N 2.92Å; F242-P244 WeakPolarHBondContact O-CD 3.08Å
243L87.9Confident73.7Confident4 Ų476.7 Ų76.72%0.02138%0.383CS..PPolyproline II helixtrans-69.7123.8-178.9-166.570.5000110.2F14 L17 L18 L21 R111 L114 F239 I240F14-L243 HydrophobicContact CD2-CD1 4.14Å; F14-L243 HydrophobicContact CE2-CD1 3.87Å; F14-L243 HydrophobicContact CE2-CG 4.08Å; F14-L243 HydrophobicContact CZ-CD1 4.36Å; L17-L243 HydrophobicContact CB-CD1 4.18Å; L18-L243 HydrophobicContact CB-CD1 4.19Å; L18-L243 HydrophobicContact CD1-CD1 4.33Å; L18-L243 HydrophobicContact CD1-CD2 4.29Å; L21-L243 HydrophobicContact CD2-CD2 4.25Å; R111-L243 WeakPolarHBondContact CD-O 3.33Å; R111-L243 HydrophobicContact CG-CB 4.47Å; L114-L243 HydrophobicContact CD1-CD2 4Å; F239-L243 PolarHBondContact O-N 3.06Å; I240-L243 HydrophobicContact CD1-CD2 4.06Å; I240-L243 WeakPolarHBondContact O-CB 3.35Å; I240-L243 PolarHBondContact O-N 3.23Å
244P84.3Confident70.8Confident44 Ų4484.9 Ų84.929%0.28642%0.415SS..PPolyproline II helixtrans-71.5160.8172.24.66000111.4F14 F242 S246F14-P244 HydrophobicContact CD2-CB 4.47Å; F14-P244 HydrophobicContact CD2-CG 3.93Å; F14-P244 WeakPolarHBondContact CE2-O 3.39Å; F242-P244 WeakPolarHBondContact O-CD 3.08Å; P244-S246 PolarHBondContact O-N 3.43Å
245E82.5Confident67.7Low59 Ų5987.8 Ų87.828%0.27643%0.43SS..PPolyproline II helixtrans-73.9125.4174.3-166.359.7-118.900111G109 R110 R111 M247G109-E245 VanDerWaalsContact C-OE1 3.26Å; G109-E245 VanDerWaalsContact CA-OE1 3.25Å; G109-E245 WeakPolarHBondContact CA-OE1 3.5Å; R110-E245 PolarHBondContact N-OE1 2.98Å; R111-E245 WeakPolarHBondContact CB-OE2 3.28Å; R111-E245 PolarHBondContact N-OE1 3.4Å; R111-E245 PolarHBondContact N-OE2 3.3Å; E245-M247 WeakPolarHBondContact CG-O 3.46Å
246S75.2Confident64.7Low5 Ų589.8 Ų89.84%0.03544%0.442CS..SBendtrans-76.2-30.817766.20000111.6R110 K172 P244R110-S246 WeakPolarHBondContact CB-OG 3.28Å; R110-S246 WeakPolarHBondContact CG-OG 3.13Å; K172-S246 WeakPolarHBondContact CE-O 3.18Å; K172-S246 PolarHBondContact NZ-O 3.43Å; P244-S246 PolarHBondContact O-N 3.43Å
247M66Low61.9Low55 Ų5593.2 Ų93.227%0.27146%0.46SS..SBendtrans-106.3105.9177.7-172174.8177.600110.2E245 I249E245-M247 WeakPolarHBondContact CG-O 3.46Å; M247-I249 PolarHBondContact O-N 3.31Å
248K57.8Low59.1Low181 Ų18196.6 Ų96.679%0.78748%0.478SS*.  trans-71.6115.7164.7-74.3-172.8179.3-178.70106.5F250K248-F250 PolarHBondContact O-N 3.47Å
249I43.8Very low56.4Low95 Ų9596.8 Ų96.849%0.48748%0.484SS..  trans-47.1124.4178.1-59.3171.7000108.4M247 Q251M247-I249 PolarHBondContact O-N 3.31Å; I249-Q251 HydrophobicContact CG2-CB 3.94Å; I249-Q251 HydrophobicContact CG2-CG 4.28Å; I249-Q251 PolarHBondContact O-N 2.97Å
250F36.8Very low53.7Low180 Ų180100.4 Ų100.479%0.78951%0.505SS*.  trans-64.973.1171.6-114.7-87.5000108.6K248K248-F250 PolarHBondContact O-N 3.47Å
251Q30.5Very low51.1Low166 Ų166108.5 Ų108.578%0.77654%0.536SS*.  trans-113.417.5-177.4-134.8170-5.900113I249I249-Q251 HydrophobicContact CG2-CB 3.94Å; I249-Q251 HydrophobicContact CG2-CG 4.28Å; I249-Q251 PolarHBondContact O-N 2.97Å
252S28.8Very low48.7Very low91 Ų91109.6 Ų109.664%0.63654%0.543SS*.SBendtrans-113.3-9.2-174.4-175.50000116.4
253N28.1Very low46.1Very low98 Ų98109.9 Ų109.952%0.52455%0.551SS.*SBendtrans-123.4-5.9-172.3-77.20.9000116.7
254Y33.2Very low43.6Very low177 Ų177118.6 Ų118.669%0.69459%0.592SS**G310 helixtrans-80.6-20.2177.1-99.6-82.7000114N256Y254-N256 PolarHBondContact O-N 3.34Å
255S30.7Very low41Very low90 Ų90123.9 Ų123.963%0.62962%0.617SS**G310 helixtrans-74.2-11.6176.957.10000114.4
256N32.1Very low38.5Very low106 Ų106132 Ų13257%0.56765%0.647SS**G310 helixtrans-108.8-8.7178.9-71.1-8.3000113.4Y254 T259Y254-N256 PolarHBondContact O-N 3.34Å; N256-T259 PolarHBondContact O-OG1 3.29Å
257L35.2Very low36.4Very low73 Ų73140.4 Ų140.438%0.38268%0.683SS.*THydrogen-bonded Turntrans-88.6-31.5177-108.482.3000112.3T259 L260 Y261L257-T259 PolarHBondContact O-N 3.49Å; L257-L260 PolarHBondContact O-N 2.83Å; L257-Y261 HydrophobicContact CB-CD2 4.4Å; L257-Y261 HydrophobicContact CB-CE2 4.33Å; L257-Y261 HydrophobicContact CD2-CD2 4.23Å; L257-Y261 HydrophobicContact CD2-CE2 3.43Å; L257-Y261 VanDerWaalsContact CD2-CE2 3.43Å; L257-Y261 HydrophobicContact CG-CD2 4.21Å; L257-Y261 HydrophobicContact CG-CE2 3.68Å; L257-Y261 WeakPolarHBondContact O-CD2 3.33Å
258D35.3Very low34.5Very low124 Ų124144.9 Ų144.966%0.66371%0.708SS**THydrogen-bonded Turntrans-65.4-13.2179.2-69.8-20000113.5
259T36.4Very low33.3Very low116 Ų116146.3 Ų146.371%0.71271%0.714SS**THydrogen-bonded Turntrans-95.2-2.8173.540.60000114.9N256 L257N256-T259 PolarHBondContact O-OG1 3.29Å; L257-T259 PolarHBondContact O-N 3.49Å
260L35.2Very low32.6Very low133 Ų133148.8 Ų148.870%0.69673%0.729SS**THydrogen-bonded Turntrans-117.9-6.6-174-114.1142.7000114.3L257L257-L260 PolarHBondContact O-N 2.83Å
261Y35.8Very low32.3Very low186 Ų186147.4 Ų147.473%0.72973%0.729SS**SBendtrans-104.38.9-178.6-80.6-88.9000114.6L257L257-Y261 HydrophobicContact CB-CD2 4.4Å; L257-Y261 HydrophobicContact CB-CE2 4.33Å; L257-Y261 HydrophobicContact CD2-CD2 4.23Å; L257-Y261 HydrophobicContact CD2-CE2 3.43Å; L257-Y261 VanDerWaalsContact CD2-CE2 3.43Å; L257-Y261 HydrophobicContact CG-CD2 4.21Å; L257-Y261 HydrophobicContact CG-CE2 3.68Å; L257-Y261 WeakPolarHBondContact O-CD2 3.33Å
262H37.6Very low32.3Very low179 Ų179146.2 Ų146.283%0.82973%0.728SS**SBendtrans-90.8-4.4174-110.6-54000114.7
263D34.6Very low32.4Very low145 Ų145148.2 Ų148.278%0.77573%0.731SS**SBendtrans-126.790.8176.2-91.9-28.6000109.6
264Q35.4Very low32.5Very low188 Ų188151.5 Ų151.588%0.87974%0.743SS**  trans160.2101.7137.9-86.9176.11.300111.1Y266Q264-Y266 PolarHBondContact O-N 2.88Å
265D29.8Very low32.5Very low155 Ų155147.2 Ų147.283%0.82973%0.731SS**  trans-41.2126.3148.4-82.2-46000110.7
266Y30.7Very low32.5Very low229 Ų229149.4 Ų149.490%0.89873%0.734SS**  trans-155.7122.6137.5-104-74.2000112.4Q264Q264-Y266 PolarHBondContact O-N 2.88Å
267K29.9Very low32.7Very low181 Ų181150.3 Ų150.379%0.78773%0.733SS**  trans-54.5153.1171-69165.9171.8170.70113
268N27.8Very low32.6Very low150 Ų150152.5 Ų152.580%0.80275%0.75SS**  trans71.698152.5-63.8-9000117.8
269K32.4Very low32.7Very low210 Ų210151.8 Ų151.891%0.91375%0.751SS**  -166.5132.5123.5-105165.4-175.8178.80110.6
270D29.5Very low32.7Very low148 Ų148151.7 Ų151.779%0.79175%0.747SS**  trans-62.3147.2-173.9-63.9-62.1000114.3
271N28.5Very low33.3Very low150 Ų150155.1 Ų155.180%0.80276%0.756SS**  trans88.77.8151.8-64.6-24000122.9I273N271-I273 PolarHBondContact O-N 3.41Å
272D30.8Very low33.7Very low141 Ų141153.1 Ų153.175%0.75476%0.758SS**  trans-91.995.2167.5-73.9-37.1000111.4E274D272-E274 PolarHBondContact O-N 2.9Å
273I32.4Very low34Very low134 Ų134149.3 Ų149.369%0.68774%0.739SS**  trans-71.382.5169.6-63.3170.3000108.3N271 I275N271-I273 PolarHBondContact O-N 3.41Å; I273-I275 HydrophobicContact CG2-CD1 3.96Å; I273-I275 HydrophobicContact CG2-CG1 3.53Å; I273-I275 PolarHBondContact O-N 3.35Å
274E30.2Very low34.8Very low166 Ų166145.2 Ų145.278%0.77672%0.722SS**  trans-75.499.2160.2-86.2-167.9147.600108.9D272 I276D272-E274 PolarHBondContact O-N 2.9Å; E274-I276 PolarHBondContact O-N 2.84Å; E274-I276 VanDerWaalsContact O-N 3.12Å
275I33.3Very low35.3Very low87 Ų87142.6 Ų142.645%0.44671%0.708SS.*  trans-8093.2170.1-58.1170.9000107.6I273 F277 K298I273-I275 HydrophobicContact CG2-CD1 3.96Å; I273-I275 HydrophobicContact CG2-CG1 3.53Å; I273-I275 PolarHBondContact O-N 3.35Å; I275-F277 HydrophobicContact CG2-CD2 3.95Å; I275-F277 HydrophobicContact CG2-CE2 3.65Å; I275-F277 HydrophobicContact CG2-CZ 4.25Å; I275-F277 PolarHBondContact O-N 3.32Å; I275-K298 HydrophobicContact CD1-CD 4.36Å
276I30.9Very low36.1Very low137 Ų137143 Ų14370%0.70370%0.698SS**  trans-69.9115.1165.4-63.2171.8000107.7E274 V278E274-I276 PolarHBondContact O-N 2.84Å; E274-I276 VanDerWaalsContact O-N 3.12Å; I276-V278 PolarHBondContact O-N 3.37Å
277F35Very low37.2Very low124 Ų124136.3 Ų136.354%0.54468%0.675SS.*  trans-81.8104.8174.9-95.8-85.8000110.4I275 N295I275-F277 HydrophobicContact CG2-CD2 3.95Å; I275-F277 HydrophobicContact CG2-CE2 3.65Å; I275-F277 HydrophobicContact CG2-CZ 4.25Å; I275-F277 PolarHBondContact O-N 3.32Å; F277-N295 WeakPolarHBondContact CZ-ND2 2.96Å
278V33.6Very low38.4Very low120 Ų120130.2 Ų130.273%0.72765%0.652SS**  trans-81.5118.8163.5-177.90000108.1I276 N280I276-V278 PolarHBondContact O-N 3.37Å; V278-N280 PolarHBondContact O-N 3.39Å
279P36.9Very low39.6Very low108 Ų108123.6 Ų123.670%0.70162%0.617SS**  trans-75.1107.7-179.828.9-30.7000109.7
280N35.9Very low40.7Very low114 Ų114116.9 Ų116.961%0.6160%0.596SS**  trans-83.9126.6166.5-155.5-3.8000109.5V278 N282 F283V278-N280 PolarHBondContact O-N 3.39Å; N280-N282 PolarHBondContact O-N 2.89Å; N280-N282 VanDerWaalsContact O-N 3.08Å; N280-F283 HydrophobicContact CB-CD2 4.36Å; N280-F283 HydrophobicContact CB-CE2 4.31Å
281K47.8Very low42Very low205 Ų205113.3 Ų113.389%0.89157%0.574SS**THydrogen-bonded Turntrans-69.3-2-170.4-103.2-179.9176.9177.40115.4
282N44.8Very low43.3Very low144 Ų144107 Ų10777%0.7754%0.542SS*.THydrogen-bonded Turntrans-113.710.8-167.3-76.4-2.9000115.4N280 S284N280-N282 PolarHBondContact O-N 2.89Å; N280-N282 VanDerWaalsContact O-N 3.08Å; N282-S284 PolarHBondContact O-N 3.25Å
283F44.2Very low44.6Very low100 Ų100102.6 Ų102.644%0.43952%0.518SS..  trans-73.2128.5180-88.7-68.5000112.3N280 E287 V288N280-F283 HydrophobicContact CB-CD2 4.36Å; N280-F283 HydrophobicContact CB-CE2 4.31Å; F283-E287 HydrophobicContact CD1-CB 3.35Å; F283-E287 HydrophobicContact CD1-CG 4.04Å; F283-E287 WeakPolarHBondContact CD1-OE2 3.36Å; F283-E287 HydrophobicContact CE1-CB 3.89Å; F283-E287 HydrophobicContact CE1-CG 4.36Å; F283-E287 HydrophobicContact CG-CB 4.35Å; F283-V288 HydrophobicContact CB-CG2 3.89Å
284S51Low45.9Very low58 Ų58102.3 Ų102.341%0.40651%0.514SS..  trans-66152.417166.70000110.4N282 W286 E287 V288N282-S284 PolarHBondContact O-N 3.25Å; S284-W286 PolarHBondContact O-N 3.48Å; S284-E287 WeakPolarHBondContact CB-OE2 2.94Å; S284-E287 PolarHBondContact N-OE2 2.99Å; S284-E287 PolarHBondContact O-N 3.02Å; S284-E287 VanDerWaalsContact OG-CD 3.23Å; S284-E287 WeakPolarHBondContact OG-CG 3.34Å; S284-E287 PolarHBondContact OG-OE2 3.28Å; S284-V288 PolarHBondContact O-N 2.85Å
285F46.4Very low47.2Very low133 Ų13396 Ų9658%0.58349%0.485SS*.Hα-helixtrans-49.3-36.1-179.8174.8-97.6000113.5I100 N289I100-F285 HydrophobicContact CD1-CE1 4.18Å; I100-F285 HydrophobicContact CD1-CE2 4.09Å; I100-F285 HydrophobicContact CD1-CZ 3.47Å; I100-F285 VanDerWaalsContact CD1-CZ 3.47Å; F285-N289 PolarHBondContact O-N 3.25Å
286W45.2Very low48.4Very low163 Ų16392.1 Ų92.162%0.61747%0.466SS*.Hα-helixtrans-70.6-39.4178.5-77.699.9000113.6S284 N289 C290S284-W286 PolarHBondContact O-N 3.48Å; W286-N289 PolarHBondContact O-N 3.23Å; W286-C290 PolarHBondContact O-N 3.25Å
287E55.1Low49.7Very low90 Ų9091 Ų9142%0.42146%0.456SS..Hα-helixtrans-69.8-36.7179.6-69.9164.913800111.2F283 S284 N289 Q291F283-E287 HydrophobicContact CD1-CB 3.35Å; F283-E287 HydrophobicContact CD1-CG 4.04Å; F283-E287 WeakPolarHBondContact CD1-OE2 3.36Å; F283-E287 HydrophobicContact CE1-CB 3.89Å; F283-E287 HydrophobicContact CE1-CG 4.36Å; F283-E287 HydrophobicContact CG-CB 4.35Å; S284-E287 WeakPolarHBondContact CB-OE2 2.94Å; S284-E287 PolarHBondContact N-OE2 2.99Å; S284-E287 PolarHBondContact O-N 3.02Å; S284-E287 VanDerWaalsContact OG-CD 3.23Å; S284-E287 WeakPolarHBondContact OG-CG 3.34Å; S284-E287 PolarHBondContact OG-OE2 3.28Å; E287-N289 VanDerWaalsContact C-N 3.29Å; E287-N289 PolarHBondContact O-N 3.33Å; E287-Q291 WeakPolarHBondContact O-CB 3.22Å; E287-Q291 PolarHBondContact O-N 3.06Å
288V55.3Low50.6Low52 Ų5290.9 Ų90.932%0.31546%0.456SS..Hα-helixtrans-60.7-41.1171.5-179.70000110.9Y103 F283 S284 S292Y103-V288 HydrophobicContact CE1-CG1 4.27Å; F283-V288 HydrophobicContact CB-CG2 3.89Å; S284-V288 PolarHBondContact O-N 2.85Å; V288-S292 VanDerWaalsContact O-CB 3.24Å; V288-S292 WeakPolarHBondContact O-CB 3.3Å; V288-S292 PolarHBondContact O-N 2.76Å
289N51.6Low51.5Low12 Ų1287.8 Ų87.86%0.06443%0.434CS..Hα-helixtrans-67.5-50.5179.5-160.612.1000111.7F285 W286 E287 Q291 S292 I293F285-N289 PolarHBondContact O-N 3.25Å; W286-N289 PolarHBondContact O-N 3.23Å; E287-N289 VanDerWaalsContact C-N 3.29Å; E287-N289 PolarHBondContact O-N 3.33Å; N289-Q291 VanDerWaalsContact C-N 3.31Å; N289-Q291 PolarHBondContact O-N 2.99Å; N289-S292 PolarHBondContact O-N 3.24Å; N289-I293 WeakPolarHBondContact O-CD1 3.48Å; N289-I293 VanDerWaalsContact O-CG1 3.24Å; N289-I293 WeakPolarHBondContact O-CG1 3.38Å; N289-I293 PolarHBondContact O-N 2.95Å
290C56.5Low52.3Low69 Ų6983.5 Ų83.547%0.46641%0.405SS..Hα-helixtrans-58.8-42.4176.2-80.30000112W286 I293 Q294W286-C290 PolarHBondContact O-N 3.25Å; C290-I293 PolarHBondContact O-N 3.35Å; C290-Q294 WeakPolarHBondContact O-CB 3.39Å; C290-Q294 VanDerWaalsContact O-CG 3.3Å; C290-Q294 WeakPolarHBondContact O-CG 3.29Å; C290-Q294 PolarHBondContact O-N 3.16Å
291Q57.2Low53.1Low72 Ų7285.1 Ų85.134%0.33641%0.414SS..Hα-helixtrans-70.1-39.4179.7-163.2131.27.400111.7E287 N289 I293 Q294 N295E287-Q291 WeakPolarHBondContact O-CB 3.22Å; E287-Q291 PolarHBondContact O-N 3.06Å; N289-Q291 VanDerWaalsContact C-N 3.31Å; N289-Q291 PolarHBondContact O-N 2.99Å; Q291-I293 VanDerWaalsContact C-N 3.34Å; Q291-I293 PolarHBondContact O-N 2.96Å; Q291-Q294 PolarHBondContact O-N 3.03Å; Q291-N295 VanDerWaalsContact O-CB 3.29Å; Q291-N295 WeakPolarHBondContact O-CB 3.43Å; Q291-N295 PolarHBondContact O-N 3.24Å; Q291-N295 PolarHBondContact O-ND2 3.32Å
292S55.1Low53.4Low18 Ų1878.9 Ų78.913%0.12641%0.407CS..Hα-helixtrans-60.3-43.3173.1-173.20000112V288 N289 N295 S296V288-S292 VanDerWaalsContact O-CB 3.24Å; V288-S292 WeakPolarHBondContact O-CB 3.3Å; V288-S292 PolarHBondContact O-N 2.76Å; N289-S292 PolarHBondContact O-N 3.24Å; S292-N295 PolarHBondContact O-N 3.08Å; S292-S296 WeakPolarHBondContact O-CB 2.84Å; S292-S296 PolarHBondContact O-N 2.89Å; S292-S296 PolarHBondContact O-OG 3.17Å
293I57.7Low53.9Low49 Ų4979.3 Ų79.325%0.25140%0.403SS..Hα-helixtrans-61.2-53.1174.1-67.7163.4000110.2M99 N289 C290 Q291 N295 S296 F297M99-I293 HydrophobicContact CE-CB 4.2Å; M99-I293 HydrophobicContact CE-CG1 3.51Å; M99-I293 HydrophobicContact SD-CD1 4.41Å; M99-I293 HydrophobicContact SD-CG1 3.67Å; N289-I293 WeakPolarHBondContact O-CD1 3.48Å; N289-I293 VanDerWaalsContact O-CG1 3.24Å; N289-I293 WeakPolarHBondContact O-CG1 3.38Å; N289-I293 PolarHBondContact O-N 2.95Å; C290-I293 PolarHBondContact O-N 3.35Å; Q291-I293 VanDerWaalsContact C-N 3.34Å; Q291-I293 PolarHBondContact O-N 2.96Å; I293-N295 VanDerWaalsContact C-N 3.3Å; I293-N295 PolarHBondContact O-N 3.46Å; I293-S296 WeakPolarHBondContact O-CB 3.47Å; I293-S296 PolarHBondContact O-N 3.45Å; I293-F297 HydrophobicContact CG2-CD2 3.75Å; I293-F297 HydrophobicContact CG2-CE2 3.89Å; I293-F297 WeakPolarHBondContact O-CD2 3.25Å; I293-F297 PolarHBondContact O-N 2.71Å
294Q60.9Low54.7Low128 Ų12876.8 Ų76.860%0.59839%0.39SS*.Hα-helixtrans-58.5-41.5179.7-77.4179-9.900112.1C290 Q291 F297 K298C290-Q294 WeakPolarHBondContact O-CB 3.39Å; C290-Q294 VanDerWaalsContact O-CG 3.3Å; C290-Q294 WeakPolarHBondContact O-CG 3.29Å; C290-Q294 PolarHBondContact O-N 3.16Å; Q291-Q294 PolarHBondContact O-N 3.03Å; Q294-F297 PolarHBondContact O-N 2.8Å; Q294-K298 VanDerWaalsContact O-CB 3.24Å; Q294-K298 WeakPolarHBondContact O-CB 3.39Å; Q294-K298 PolarHBondContact O-N 3.4Å
295N56.7Low55.8Low32 Ų3282.9 Ų82.917%0.17141%0.41CS..Hα-helixtrans-66.9-41.9177.8-66.4-28.4000111.7F277 Q291 S292 I293 F297 K298 I299F277-N295 WeakPolarHBondContact CZ-ND2 2.96Å; Q291-N295 VanDerWaalsContact O-CB 3.29Å; Q291-N295 WeakPolarHBondContact O-CB 3.43Å; Q291-N295 PolarHBondContact O-N 3.24Å; Q291-N295 PolarHBondContact O-ND2 3.32Å; S292-N295 PolarHBondContact O-N 3.08Å; I293-N295 VanDerWaalsContact C-N 3.3Å; I293-N295 PolarHBondContact O-N 3.46Å; N295-F297 VanDerWaalsContact C-N 3.34Å; N295-F297 PolarHBondContact O-N 3.26Å; N295-K298 PolarHBondContact O-N 3.18Å; N295-I299 WeakPolarHBondContact O-CB 3.37Å; N295-I299 WeakPolarHBondContact O-CD1 3.35Å; N295-I299 WeakPolarHBondContact O-CG1 3.41Å; N295-I299 PolarHBondContact O-N 3.25Å
296S57.9Low57.2Low6 Ų679.2 Ų79.24%0.04239%0.394CS..Hα-helixtrans-59.7-47.1175.6-59.30000110.4S292 I293 K298 I299 I300S292-S296 WeakPolarHBondContact O-CB 2.84Å; S292-S296 PolarHBondContact O-N 2.89Å; S292-S296 PolarHBondContact O-OG 3.17Å; I293-S296 WeakPolarHBondContact O-CB 3.47Å; I293-S296 PolarHBondContact O-N 3.45Å; S296-K298 PolarHBondContact O-N 3.03Å; S296-I299 PolarHBondContact O-N 3.2Å; S296-I300 WeakPolarHBondContact O-CD1 3.45Å; S296-I300 VanDerWaalsContact O-CG1 3.23Å; S296-I300 WeakPolarHBondContact O-CG1 3.3Å; S296-I300 PolarHBondContact O-N 3.43Å
297F58.8Low58.8Low114 Ų11471.8 Ų71.850%0.537%0.367SS..Hα-helixtrans-64-38.7174.9-87.3-80000112.9I293 Q294 N295 I300 N301I293-F297 HydrophobicContact CG2-CD2 3.75Å; I293-F297 HydrophobicContact CG2-CE2 3.89Å; I293-F297 WeakPolarHBondContact O-CD2 3.25Å; I293-F297 PolarHBondContact O-N 2.71Å; Q294-F297 PolarHBondContact O-N 2.8Å; N295-F297 VanDerWaalsContact C-N 3.34Å; N295-F297 PolarHBondContact O-N 3.26Å; F297-I300 PolarHBondContact O-N 2.86Å; F297-N301 WeakPolarHBondContact O-CB 3.34Å; F297-N301 PolarHBondContact O-N 2.99Å
298K54.3Low60.2Low122 Ų12271.3 Ų71.353%0.5337%0.369SS..Hα-helixtrans-68.7-38.2179.7-168.4176.2-178.4-179.30112.3I275 Q294 N295 S296 I300 N301I275-K298 HydrophobicContact CD1-CD 4.36Å; Q294-K298 VanDerWaalsContact O-CB 3.24Å; Q294-K298 WeakPolarHBondContact O-CB 3.39Å; Q294-K298 PolarHBondContact O-N 3.4Å; N295-K298 PolarHBondContact O-N 3.18Å; S296-K298 PolarHBondContact O-N 3.03Å; K298-I300 VanDerWaalsContact C-N 3.26Å; K298-I300 PolarHBondContact O-N 3.41Å; K298-N301 PolarHBondContact O-N 3.15Å
299I52.4Low61.8Low55 Ų5570.2 Ų70.228%0.28236%0.362SS..Hα-helixtrans-60.2-40.9173-69.7162.8000110N295 S296 Y304 K468 M471N295-I299 WeakPolarHBondContact O-CB 3.37Å; N295-I299 WeakPolarHBondContact O-CD1 3.35Å; N295-I299 WeakPolarHBondContact O-CG1 3.41Å; N295-I299 PolarHBondContact O-N 3.25Å; S296-I299 PolarHBondContact O-N 3.2Å; I299-Y304 HydrophobicContact CG2-CD2 4.21Å; I299-Y304 HydrophobicContact CG2-CE2 4.21Å; I299-Y304 WeakPolarHBondContact O-CD2 3.29Å; I299-K468 HydrophobicContact CD1-CD 4.31Å; I299-M471 HydrophobicContact CD1-SD 3.79Å
300I54.5Low63.5Low17 Ų1769.7 Ų69.79%0.08736%0.359CS..Hα-helixtrans-70.6-40.7-178.7-68.4166000112S296 F297 K298 G302 V308 F475S296-I300 WeakPolarHBondContact O-CD1 3.45Å; S296-I300 VanDerWaalsContact O-CG1 3.23Å; S296-I300 WeakPolarHBondContact O-CG1 3.3Å; S296-I300 PolarHBondContact O-N 3.43Å; F297-I300 PolarHBondContact O-N 2.86Å; K298-I300 VanDerWaalsContact C-N 3.26Å; K298-I300 PolarHBondContact O-N 3.41Å; I300-G302 PolarHBondContact O-N 3.02Å; I300-V308 HydrophobicContact CG2-CB 4.49Å; I300-V308 HydrophobicContact CG2-CG2 3.26Å; I300-F475 HydrophobicContact CD1-CD1 3.83Å; I300-F475 HydrophobicContact CD1-CD2 4.14Å; I300-F475 HydrophobicContact CD1-CE1 3.41Å; I300-F475 VanDerWaalsContact CD1-CE1 3.41Å; I300-F475 HydrophobicContact CD1-CE2 3.75Å; I300-F475 HydrophobicContact CD1-CG 4.17Å; I300-F475 HydrophobicContact CD1-CZ 3.38Å
301N52.3Low65.1Low149 Ų14966.8 Ų66.880%0.79734%0.34SS*.Hα-helixtrans-75.2-22.5-169.4-152.120.1000114.4F297 K298F297-N301 WeakPolarHBondContact O-CB 3.34Å; F297-N301 PolarHBondContact O-N 2.99Å; K298-N301 PolarHBondContact O-N 3.15Å
302G52.6Low66.8Low73 Ų7367.6 Ų67.675%0.75334%0.343SS*.Hα-helixtrans-96.6-39.8-172.300000115.9I300I300-G302 PolarHBondContact O-N 3.02Å
303K55.4Low68.6Low154 Ų15466.7 Ų66.767%0.6734%0.337SS*.Hα-helixtrans-122.5-11.3-164.3-141.3171.3-175.1171.70114.5
304Y62.9Low70.3Confident46 Ų4664.8 Ų64.818%0.1833%0.327CS..  trans-138.760.1-159-64.8-57.4000114.1I299 Q306 H307 D465I299-Y304 HydrophobicContact CG2-CD2 4.21Å; I299-Y304 HydrophobicContact CG2-CE2 4.21Å; I299-Y304 WeakPolarHBondContact O-CD2 3.29Å; Y304-Q306 PolarHBondContact O-N 3.48Å; Y304-H307 WeakPolarHBondContact CB-ND1 3.28Å; Y304-H307 AromaticContact CD1-CE1 3.4Å; Y304-H307 VanDerWaalsContact CD1-CE1 3.4Å; Y304-H307 WeakPolarHBondContact CD1-CE1 3.44Å; Y304-H307 AromaticContact CD1-ND1 3.87Å; Y304-H307 AromaticContact CG-CE1 3.65Å; Y304-H307 AromaticContact CG-ND1 3.83Å; Y304-H307 PolarHBondContact O-N 2.64Å; Y304-D465 PolarHBondContact OH-OD2 3.39Å
305K72.3Confident72Confident187 Ų18760.5 Ų60.581%0.81331%0.308SS*.Hα-helixtrans-49.9-32.9173.1-69-178.2179.7177.30112.8L309K305-L309 PolarHBondContact O-N 3.45Å
306Q77.2Confident73.8Confident56 Ų5659.4 Ų59.426%0.26230%0.302SS..Hα-helixtrans-65.5-35.5178.3-68.3177.9-18.600113.1Y304 L309 I310 W463 L524Y304-Q306 PolarHBondContact O-N 3.48Å; Q306-L309 PolarHBondContact O-N 2.95Å; Q306-I310 PolarHBondContact O-N 3.37Å; Q306-W463 HydrophobicContact CB-CD2 4.3Å; Q306-W463 HydrophobicContact CB-CE3 3.65Å; Q306-W463 HydrophobicContact CB-CH2 4.18Å; Q306-W463 HydrophobicContact CB-CZ3 3.54Å; Q306-W463 HydrophobicContact CG-CZ3 4.35Å; Q306-L524 HydrophobicContact CB-CD1 4.39Å; Q306-L524 HydrophobicContact CG-CD1 4.25Å
307H78.3Confident75.6Confident7 Ų759.4 Ų59.43%0.03230%0.302CS..Hα-helixtrans-72.6-35.5179.9-65.549000112.3Y304 L309 G311 W463 T464 M472Y304-H307 WeakPolarHBondContact CB-ND1 3.28Å; Y304-H307 AromaticContact CD1-CE1 3.4Å; Y304-H307 VanDerWaalsContact CD1-CE1 3.4Å; Y304-H307 WeakPolarHBondContact CD1-CE1 3.44Å; Y304-H307 AromaticContact CD1-ND1 3.87Å; Y304-H307 AromaticContact CG-CE1 3.65Å; Y304-H307 AromaticContact CG-ND1 3.83Å; Y304-H307 PolarHBondContact O-N 2.64Å; H307-L309 VanDerWaalsContact C-N 3.3Å; H307-G311 PolarHBondContact O-N 2.77Å; H307-W463 WeakPolarHBondContact CE1-CB 3.25Å; H307-W463 PolarHBondContact CE1-O 3.49Å; H307-W463 PolarHBondContact NE2-O 3.08Å; H307-T464 PolarHBondContact NE2-OG1 2.79Å; H307-M472 HydrophobicContact CB-CE 3.98Å; H307-M472 WeakPolarHBondContact CD2-CE 3.41Å
308V84.1Confident77.2Confident79 Ų7954.5 Ų54.548%0.47928%0.281SS..Hα-helixtrans-60-46.6172.1179.40000109.8I300 G311 F312I300-V308 HydrophobicContact CG2-CB 4.49Å; I300-V308 HydrophobicContact CG2-CG2 3.26Å; V308-G311 PolarHBondContact O-N 3.46Å; V308-F312 PolarHBondContact O-N 3.35Å
309L88.4Confident79.1Confident29 Ų2949.2 Ų49.215%0.15226%0.259CS..Hα-helixtrans-66.6-43.7-177.4-159.566.7000111.5K305 Q306 H307 F312 I313 T520 F523 L524 L527K305-L309 PolarHBondContact O-N 3.45Å; Q306-L309 PolarHBondContact O-N 2.95Å; H307-L309 VanDerWaalsContact C-N 3.3Å; L309-F312 PolarHBondContact O-N 3.35Å; L309-I313 VanDerWaalsContact O-CG1 3.31Å; L309-I313 WeakPolarHBondContact O-CG1 3.33Å; L309-I313 PolarHBondContact O-N 2.86Å; L309-T520 HydrophobicContact CD1-CG2 3.27Å; L309-T520 HydrophobicContact CG-CG2 3.71Å; L309-F523 HydrophobicContact CD1-CD1 4.4Å; L309-F523 HydrophobicContact CD2-CD1 3.88Å; L309-L524 HydrophobicContact CB-CD1 4.48Å; L309-L524 HydrophobicContact CD2-CB 3.43Å; L309-L524 VanDerWaalsContact CD2-CB 3.43Å; L309-L524 HydrophobicContact CD2-CD1 3.73Å; L309-L524 HydrophobicContact CD2-CG 4.04Å; L309-L524 HydrophobicContact CG-CB 4.35Å; L309-L527 HydrophobicContact CD2-CD1 4.44Å
310I88.6Confident81Confident2 Ų246.6 Ų46.61%0.0125%0.245CC..Hα-helixtrans-62.2-44172.2-79.3-169.8000111.6Q306 F312 I313 V314 L456 L459 I460 W463 L524Q306-I310 PolarHBondContact O-N 3.37Å; I310-F312 PolarHBondContact O-N 2.84Å; I310-I313 PolarHBondContact O-N 3.44Å; I310-I313 VanDerWaalsContact O-N 3.13Å; I310-V314 HydrophobicContact CG2-CG2 4.07Å; I310-V314 WeakPolarHBondContact O-CB 3.45Å; I310-V314 VanDerWaalsContact O-CG2 3.28Å; I310-V314 WeakPolarHBondContact O-CG2 3.41Å; I310-V314 PolarHBondContact O-N 3.35Å; I310-L456 HydrophobicContact CG2-CD2 4.44Å; I310-L459 HydrophobicContact CD1-CB 3.65Å; I310-L459 HydrophobicContact CD1-CD1 4.28Å; I310-I460 HydrophobicContact CD1-CG1 4.44Å; I310-I460 HydrophobicContact CG2-CD1 3.88Å; I310-I460 HydrophobicContact CG2-CG1 3.63Å; I310-W463 HydrophobicContact CD1-CE3 3.57Å; I310-W463 HydrophobicContact CD1-CH2 3.67Å; I310-W463 HydrophobicContact CD1-CZ3 2.98Å; I310-W463 HydrophobicContact CG1-CE3 4.41Å; I310-W463 HydrophobicContact CG1-CH2 4.27Å; I310-W463 HydrophobicContact CG1-CZ3 3.57Å; I310-L524 HydrophobicContact CD1-CD2 4.48Å; I310-L524 HydrophobicContact CG1-CD2 3.82Å
311G89.2Confident82.7Confident7 Ų747.2 Ų47.27%0.07225%0.25CS..Hα-helixtrans-55.9-43.8176.400000111.2H307 V308 V314 L315 V479H307-G311 PolarHBondContact O-N 2.77Å; V308-G311 PolarHBondContact O-N 3.46Å; G311-V314 PolarHBondContact O-N 3.17Å; G311-L315 WeakPolarHBondContact O-CB 3.27Å; G311-L315 PolarHBondContact O-N 2.98Å; G311-V479 WeakPolarHBondContact O-CG1 3.49Å
312F92.7Very high84.5Confident89 Ų8940.5 Ų40.539%0.3922%0.215SC..Hα-helixtrans-65.2-40.8175.8-172.3-114.1000113.1V308 L309 I310 L315 L316 I516 T520V308-F312 PolarHBondContact O-N 3.35Å; L309-F312 PolarHBondContact O-N 3.35Å; I310-F312 PolarHBondContact O-N 2.84Å; F312-L315 HydrophobicContact CD2-CD2 4.38Å; F312-L315 WeakPolarHBondContact O-CB 3.49Å; F312-L315 PolarHBondContact O-N 3.39Å; F312-L316 HydrophobicContact CD1-CD1 4.06Å; F312-L316 HydrophobicContact CE1-CD1 3.57Å; F312-L316 HydrophobicContact CE1-CG 4.32Å; F312-L316 HydrophobicContact CE2-CG 4.46Å; F312-L316 HydrophobicContact CZ-CD1 3.83Å; F312-L316 HydrophobicContact CZ-CD2 4.35Å; F312-L316 HydrophobicContact CZ-CG 4.21Å; F312-L316 WeakPolarHBondContact O-CG 3.31Å; F312-L316 PolarHBondContact O-N 3.32Å; F312-I516 HydrophobicContact CE1-CG2 4.06Å; F312-I516 HydrophobicContact CZ-CG2 4.32Å; F312-T520 HydrophobicContact CD1-CG2 3.88Å
313I93.9Very high86.1Confident0 Ų037 Ų370%018%0.179CC..Hα-helixtrans-61.1-45.9173.8-66.6161.8000110.5L309 I310 L315 L316 L317 I414 L456 T520 T521 L524L309-I313 VanDerWaalsContact O-CG1 3.31Å; L309-I313 WeakPolarHBondContact O-CG1 3.33Å; L309-I313 PolarHBondContact O-N 2.86Å; I310-I313 PolarHBondContact O-N 3.44Å; I310-I313 VanDerWaalsContact O-N 3.13Å; I313-L315 VanDerWaalsContact C-N 3.32Å; I313-L315 PolarHBondContact O-N 2.83Å; I313-L316 PolarHBondContact O-N 2.94Å; I313-L317 HydrophobicContact CG2-CD1 3.76Å; I313-L317 HydrophobicContact CG2-CG 4.29Å; I313-L317 WeakPolarHBondContact O-CB 3.48Å; I313-L317 WeakPolarHBondContact O-CG 3.44Å; I313-L317 PolarHBondContact O-N 3.03Å; I313-I414 HydrophobicContact CG2-CD1 4.39Å; I313-L456 HydrophobicContact CG2-CD2 4.13Å; I313-T520 HydrophobicContact CD1-CG2 4.14Å; I313-T520 HydrophobicContact CG1-CG2 3.72Å; I313-T521 WeakPolarHBondContact CD1-OG1 3.26Å; I313-L524 HydrophobicContact CD1-CD2 3.94Å
314V93.8Very high87.5Confident8 Ų829.9 Ų29.95%0.04815%0.148CC..Hα-helixtrans-60.1-42.2176.61690000111I310 G311 L317 S318 L456 V476 V479 S480I310-V314 HydrophobicContact CG2-CG2 4.07Å; I310-V314 WeakPolarHBondContact O-CB 3.45Å; I310-V314 VanDerWaalsContact O-CG2 3.28Å; I310-V314 WeakPolarHBondContact O-CG2 3.41Å; I310-V314 PolarHBondContact O-N 3.35Å; G311-V314 PolarHBondContact O-N 3.17Å; V314-L317 PolarHBondContact O-N 3.1Å; V314-S318 VanDerWaalsContact O-CB 3.28Å; V314-S318 WeakPolarHBondContact O-CB 3.39Å; V314-S318 PolarHBondContact O-N 3.49Å; V314-S318 PolarHBondContact O-OG 3.44Å; V314-L456 HydrophobicContact CG2-CD1 4.11Å; V314-L456 HydrophobicContact CG2-CD2 4.28Å; V314-V476 HydrophobicContact CG1-CG1 4.09Å; V314-V476 HydrophobicContact CG2-CG1 4.31Å; V314-V479 HydrophobicContact CG1-CG1 4.46Å; V314-S480 WeakPolarHBondContact CG1-OG 3.17Å
315L95.1Very high88.3Confident38 Ų3831.2 Ų31.220%0.19916%0.158CC..Hα-helixtrans-59.1-51.4176-176.272.9000111.1G311 F312 I313 L317 S318 I319 V479 L482G311-L315 WeakPolarHBondContact O-CB 3.27Å; G311-L315 PolarHBondContact O-N 2.98Å; F312-L315 HydrophobicContact CD2-CD2 4.38Å; F312-L315 WeakPolarHBondContact O-CB 3.49Å; F312-L315 PolarHBondContact O-N 3.39Å; I313-L315 VanDerWaalsContact C-N 3.32Å; I313-L315 PolarHBondContact O-N 2.83Å; L315-L317 PolarHBondContact O-N 2.95Å; L315-S318 WeakPolarHBondContact CA-OG 3.39Å; L315-S318 PolarHBondContact O-N 3.44Å; L315-S318 PolarHBondContact O-OG 2.9Å; L315-I319 HydrophobicContact CG-CD1 4.35Å; L315-I319 VanDerWaalsContact O-CG1 3.3Å; L315-I319 WeakPolarHBondContact O-CG1 3.23Å; L315-I319 PolarHBondContact O-N 3.11Å; L315-I319 VanDerWaalsContact O-N 3.09Å; L315-V479 HydrophobicContact CB-CG1 3.76Å; L315-V479 HydrophobicContact CD1-CG1 4.15Å; L315-V479 WeakPolarHBondContact CD1-O 3.38Å; L315-L482 HydrophobicContact CD1-CB 3.96Å
316L95.8Very high88.7Confident9 Ų923.5 Ų23.55%0.04712%0.124CC..Hα-helixtrans-63.8-43-179.3-68176.2000112.1F312 I313 I319 V320 L513 I516 A517F312-L316 HydrophobicContact CD1-CD1 4.06Å; F312-L316 HydrophobicContact CE1-CD1 3.57Å; F312-L316 HydrophobicContact CE1-CG 4.32Å; F312-L316 HydrophobicContact CE2-CG 4.46Å; F312-L316 HydrophobicContact CZ-CD1 3.83Å; F312-L316 HydrophobicContact CZ-CD2 4.35Å; F312-L316 HydrophobicContact CZ-CG 4.21Å; F312-L316 WeakPolarHBondContact O-CG 3.31Å; F312-L316 PolarHBondContact O-N 3.32Å; I313-L316 PolarHBondContact O-N 2.94Å; L316-I319 PolarHBondContact O-N 2.93Å; L316-V320 WeakPolarHBondContact O-CG2 2.99Å; L316-V320 PolarHBondContact O-N 3.24Å; L316-L513 HydrophobicContact CD2-CD2 4.11Å; L316-I516 HydrophobicContact CD1-CB 4.14Å; L316-I516 HydrophobicContact CD1-CG2 3.74Å; L316-A517 HydrophobicContact CB-CB 3.94Å; L316-A517 HydrophobicContact CD1-CB 3.82Å
317L94.5Very high89.1Confident7 Ų721 Ų214%0.03711%0.112CC..Hα-helixtrans-67.5-38178.5-69176.6000112.2I313 V314 L315 V320 T321 I414 L456I313-L317 HydrophobicContact CG2-CD1 3.76Å; I313-L317 HydrophobicContact CG2-CG 4.29Å; I313-L317 WeakPolarHBondContact O-CB 3.48Å; I313-L317 WeakPolarHBondContact O-CG 3.44Å; I313-L317 PolarHBondContact O-N 3.03Å; V314-L317 PolarHBondContact O-N 3.1Å; L315-L317 PolarHBondContact O-N 2.95Å; L317-V320 PolarHBondContact O-N 3.28Å; L317-T321 VanDerWaalsContact O-CB 3.31Å; L317-T321 WeakPolarHBondContact O-CB 3.44Å; L317-T321 VanDerWaalsContact O-CG2 3.25Å; L317-T321 WeakPolarHBondContact O-CG2 2.97Å; L317-T321 PolarHBondContact O-N 3.48Å; L317-T321 PolarHBondContact O-OG1 2.8Å; L317-I414 HydrophobicContact CD1-CD1 4.19Å; L317-I414 HydrophobicContact CD1-CG1 4.35Å; L317-I414 HydrophobicContact CD2-CD1 4.49Å; L317-I414 HydrophobicContact CD2-CG1 4.14Å; L317-L456 HydrophobicContact CD1-CD1 3.76Å
318S92.9Very high89.5Confident10 Ų1020.7 Ų20.77%0.0711%0.111CC..Hα-helixtrans-66.3-38.6176.654.20000112.4V314 L315 V320 T321 S322 S480 G483V314-S318 VanDerWaalsContact O-CB 3.28Å; V314-S318 WeakPolarHBondContact O-CB 3.39Å; V314-S318 PolarHBondContact O-N 3.49Å; V314-S318 PolarHBondContact O-OG 3.44Å; L315-S318 WeakPolarHBondContact CA-OG 3.39Å; L315-S318 PolarHBondContact O-N 3.44Å; L315-S318 PolarHBondContact O-OG 2.9Å; S318-V320 PolarHBondContact O-N 2.88Å; S318-T321 PolarHBondContact O-OG1 2.91Å; S318-S322 VanDerWaalsContact O-CB 3.3Å; S318-S322 WeakPolarHBondContact O-CB 3.49Å; S318-S322 PolarHBondContact O-N 3.1Å; S318-S322 PolarHBondContact O-OG 3.38Å; S318-S480 WeakPolarHBondContact CB-O 3.45Å; S318-S480 PolarHBondContact OG-O 3.47Å; S318-G483 WeakPolarHBondContact OG-CA 3.48Å
319I93.9Very high89.6Confident11 Ų1117.9 Ų17.96%0.0569%0.092CC..Hα-helixtrans-56.5-51.5171.9-65.6165.2000110.3L315 L316 G483 I486 L491 L513L315-I319 HydrophobicContact CG-CD1 4.35Å; L315-I319 VanDerWaalsContact O-CG1 3.3Å; L315-I319 WeakPolarHBondContact O-CG1 3.23Å; L315-I319 PolarHBondContact O-N 3.11Å; L315-I319 VanDerWaalsContact O-N 3.09Å; L316-I319 PolarHBondContact O-N 2.93Å; I319-G483 VanDerWaalsContact CG1-CA 3.42Å; I319-G483 VanDerWaalsContact CG1-O 3.29Å; I319-G483 WeakPolarHBondContact CG1-O 3.28Å; I319-I486 HydrophobicContact CD1-CB 4.38Å; I319-I486 HydrophobicContact CD1-CD1 4.13Å; I319-I486 HydrophobicContact CD1-CG2 4.12Å; I319-I486 HydrophobicContact CG1-CB 4.2Å; I319-I486 HydrophobicContact CG1-CG2 4.25Å; I319-L491 HydrophobicContact CG2-CD1 3.5Å; I319-L491 HydrophobicContact CG2-CG 4.44Å; I319-L513 HydrophobicContact CG2-CD1 3.83Å
320V93.2Very high89.3Confident0 Ų018.6 Ų18.60%010%0.095CC..Hα-helixtrans-77.6-37.5-171178.10000112.9L316 L317 S318 S322 T323 M417 R421 C510 L513 I514L316-V320 WeakPolarHBondContact O-CG2 2.99Å; L316-V320 PolarHBondContact O-N 3.24Å; L317-V320 PolarHBondContact O-N 3.28Å; S318-V320 PolarHBondContact O-N 2.88Å; V320-S322 VanDerWaalsContact C-N 3.3Å; V320-S322 PolarHBondContact O-N 3.27Å; V320-T323 PolarHBondContact O-N 2.88Å; V320-T323 PolarHBondContact O-OG1 3.18Å; V320-M417 HydrophobicContact CG1-CE 4.34Å; V320-R421 HydrophobicContact CG1-CG 4.1Å; V320-R421 PolarHBondContact O-NH2 3.3Å; V320-C510 HydrophobicContact CG1-CB 3.81Å; V320-C510 HydrophobicContact CG2-CB 4.13Å; V320-L513 HydrophobicContact CG2-CB 3.85Å; V320-L513 HydrophobicContact CG2-CD1 4.24Å; V320-I514 HydrophobicContact CB-CG1 4.23Å; V320-I514 HydrophobicContact CG1-CD1 3.59Å; V320-I514 HydrophobicContact CG1-CG1 3.77Å; V320-I514 HydrophobicContact CG2-CG1 4.06Å
321T90.3Very high89.3Confident31 Ų3118.6 Ų18.619%0.1910%0.095CC..Hα-helixtrans-68.5-30.2177.4520000112.3L317 S318 T323 D324 M417 K449L317-T321 VanDerWaalsContact O-CB 3.31Å; L317-T321 WeakPolarHBondContact O-CB 3.44Å; L317-T321 VanDerWaalsContact O-CG2 3.25Å; L317-T321 WeakPolarHBondContact O-CG2 2.97Å; L317-T321 PolarHBondContact O-N 3.48Å; L317-T321 PolarHBondContact O-OG1 2.8Å; S318-T321 PolarHBondContact O-OG1 2.91Å; T321-T323 PolarHBondContact O-N 2.96Å; T321-D324 WeakPolarHBondContact O-CB 3.5Å; T321-D324 PolarHBondContact O-N 3.44Å; T321-M417 HydrophobicContact CG2-CE 3.64Å; T321-M417 HydrophobicContact CG2-SD 4.4Å; T321-K449 HydrophobicContact CG2-CD 4.43Å; T321-K449 HydrophobicContact CG2-CG 4.41Å
322S88.6Confident89.3Confident7 Ų718.2 Ų18.25%0.0499%0.092CC..G310 helixtrans-65.9-20177.4-61.30000113.6S318 V320 D324 L325 V484S318-S322 VanDerWaalsContact O-CB 3.3Å; S318-S322 WeakPolarHBondContact O-CB 3.49Å; S318-S322 PolarHBondContact O-N 3.1Å; S318-S322 PolarHBondContact O-OG 3.38Å; V320-S322 VanDerWaalsContact C-N 3.3Å; V320-S322 PolarHBondContact O-N 3.27Å; S322-D324 PolarHBondContact O-N 2.98Å; S322-L325 WeakPolarHBondContact O-CB 3.39Å; S322-L325 PolarHBondContact O-N 3.4Å; S322-L325 VanDerWaalsContact O-N 3.1Å; S322-V484 VanDerWaalsContact OG-CG2 3.28Å; S322-V484 WeakPolarHBondContact OG-CG2 3.39Å
323T88.2Confident88.9Confident0 Ų016.6 Ų16.60%09%0.086CC..G310 helixtrans-62.9-23.3174.663.90000113V320 T321 L325 I327 I328 R421 L491V320-T323 PolarHBondContact O-N 2.88Å; V320-T323 PolarHBondContact O-OG1 3.18Å; T321-T323 PolarHBondContact O-N 2.96Å; T323-L325 VanDerWaalsContact C-N 3.26Å; T323-L325 PolarHBondContact O-N 3.01Å; T323-I327 HydrophobicContact CG2-CD1 4.08Å; T323-I327 PolarHBondContact O-N 3.35Å; T323-I328 PolarHBondContact O-N 3.47Å; T323-R421 PolarHBondContact OG1-NH2 3.23Å; T323-L491 HydrophobicContact CG2-CD1 3.79Å
324D83.9Confident88.3Confident5 Ų517.8 Ų17.83%0.02710%0.098CC..G310 helixtrans-71.9-18.5176.4-64.1-29.5000113.3T321 S322 I328 R421 K449T321-D324 WeakPolarHBondContact O-CB 3.5Å; T321-D324 PolarHBondContact O-N 3.44Å; S322-D324 PolarHBondContact O-N 2.98Å; D324-I328 WeakPolarHBondContact O-CG2 3.39Å; D324-R421 IonicContact OD1-CZ 3.34Å; D324-R421 IonicContact OD1-NH1 3.92Å; D324-R421 PolarHBondContact OD1-NH1 3.23Å; D324-R421 IonicContact OD1-NH2 2.89Å; D324-R421 PolarHBondContact OD1-NH2 3.05Å; D324-R421 IonicContact OD2-NH2 3.16Å; D324-R421 PolarHBondContact OD2-NH2 2.99Å; D324-K449 IonicContact OD2-NZ 3.97Å; D324-K449 PolarHBondContact OD2-NZ 3.19Å
325L79.6Confident87.4Confident73 Ų7325 Ų2538%0.38213%0.125SC..THydrogen-bonded Turntrans-78.7-33.1-177.2-62.5174.8000112.4S322 T323 Y329 F488S322-L325 WeakPolarHBondContact O-CB 3.39Å; S322-L325 PolarHBondContact O-N 3.4Å; S322-L325 VanDerWaalsContact O-N 3.1Å; T323-L325 VanDerWaalsContact C-N 3.26Å; T323-L325 PolarHBondContact O-N 3.01Å; L325-Y329 WeakPolarHBondContact O-CD2 3.45Å; L325-Y329 VanDerWaalsContact O-CE2 3.24Å; L325-Y329 WeakPolarHBondContact O-CE2 3.47Å; L325-F488 HydrophobicContact CB-CZ 4.35Å; L325-F488 HydrophobicContact CD1-CZ 4.48Å
326Y79.7Confident86.7Confident26 Ų2623.4 Ų23.410%0.10212%0.118CC..THydrogen-bonded Turntrans-138.7-51.3-169.9-173.5-101.6000113.4A80 I328 Y329 I330 F488 I492A80-Y326 VanDerWaalsContact CA-OH 3.3Å; A80-Y326 WeakPolarHBondContact CA-OH 2.94Å; Y326-I328 PolarHBondContact O-N 3.25Å; Y326-Y329 PolarHBondContact O-N 3.06Å; Y326-I330 HydrophobicContact CD1-CD1 4Å; Y326-I330 HydrophobicContact CE1-CD1 3.3Å; Y326-I330 HydrophobicContact CE1-CG1 4.46Å; Y326-I330 HydrophobicContact CE2-CD1 3.98Å; Y326-I330 PolarHBondContact O-N 3.3Å; Y326-I330 VanDerWaalsContact OH-CD1 3.31Å; Y326-I330 WeakPolarHBondContact OH-CD1 3.4Å; Y326-F488 HydrophobicContact CG-CE1 4.21Å; Y326-I492 HydrophobicContact CD1-CD1 3.5Å; Y326-I492 HydrophobicContact CD1-CG1 4.16Å; Y326-I492 HydrophobicContact CE1-CD1 3.8Å; Y326-I492 HydrophobicContact CG-CD1 4.42Å
327I85.8Confident86.3Confident3 Ų323.2 Ų23.22%0.01512%0.116CC..Hα-helixtrans-65.4-42-174.1-60.4-177.7000110.9T323 Y329 I330 Y331 L491 I492 Y495 V506 F507T323-I327 HydrophobicContact CG2-CD1 4.08Å; T323-I327 PolarHBondContact O-N 3.35Å; I327-Y329 PolarHBondContact O-N 3.27Å; I327-I330 PolarHBondContact O-N 3.44Å; I327-Y331 WeakPolarHBondContact O-CB 3.38Å; I327-Y331 PolarHBondContact O-N 2.97Å; I327-L491 HydrophobicContact CD1-CB 3.86Å; I327-I492 HydrophobicContact CD1-CG1 4Å; I327-I492 HydrophobicContact CG1-CG1 3.99Å; I327-Y495 HydrophobicContact CG2-CD2 4.14Å; I327-Y495 HydrophobicContact CG2-CG 4.17Å; I327-V506 HydrophobicContact CD1-CG2 4.07Å; I327-V506 HydrophobicContact CG2-CG1 3.8Å; I327-V506 HydrophobicContact CG2-CG2 4.33Å; I327-F507 HydrophobicContact CG2-CZ 4.31Å
328I87.8Confident85.7Confident0 Ų028.6 Ų28.60%014%0.144CC..Hα-helixtrans-62.5-33178.7-153.7172.4000112T323 D324 Y326 Y331 L332 Y347 L424 F507T323-I328 PolarHBondContact O-N 3.47Å; D324-I328 WeakPolarHBondContact O-CG2 3.39Å; Y326-I328 PolarHBondContact O-N 3.25Å; I328-Y331 PolarHBondContact O-N 3.29Å; I328-L332 HydrophobicContact CG1-CD1 3.93Å; I328-L332 HydrophobicContact CG1-CG 4.33Å; I328-L332 WeakPolarHBondContact O-CB 3.41Å; I328-L332 VanDerWaalsContact O-CG 3.23Å; I328-L332 WeakPolarHBondContact O-CG 3.44Å; I328-L332 PolarHBondContact O-N 3.41Å; I328-Y347 HydrophobicContact CD1-CE1 4.13Å; I328-L424 HydrophobicContact CD1-CD1 4.08Å; I328-F507 HydrophobicContact CG1-CZ 4.35Å
329Y85Confident85.5Confident20 Ų2029.1 Ų29.18%0.07815%0.145CC..Hα-helixtrans-67.5-49.9179.5-64-7.7000110.6N210 L325 Y326 I327 Y331 L332 M333 V344 S348N210-Y329 PolarHBondContact ND2-OH 3.04Å; L325-Y329 WeakPolarHBondContact O-CD2 3.45Å; L325-Y329 VanDerWaalsContact O-CE2 3.24Å; L325-Y329 WeakPolarHBondContact O-CE2 3.47Å; Y326-Y329 PolarHBondContact O-N 3.06Å; I327-Y329 PolarHBondContact O-N 3.27Å; Y329-Y331 VanDerWaalsContact C-N 3.29Å; Y329-Y331 PolarHBondContact O-N 3.09Å; Y329-L332 PolarHBondContact O-N 3.41Å; Y329-M333 WeakPolarHBondContact O-CB 3.27Å; Y329-M333 VanDerWaalsContact O-CG 3.25Å; Y329-M333 WeakPolarHBondContact O-CG 3.09Å; Y329-M333 PolarHBondContact O-N 3.49Å; Y329-V344 HydrophobicContact CD1-CG1 3.14Å; Y329-V344 HydrophobicContact CD2-CG1 4.47Å; Y329-V344 HydrophobicContact CE1-CG1 3.77Å; Y329-V344 HydrophobicContact CG-CG1 3.57Å; Y329-S348 WeakPolarHBondContact OH-CB 3.39Å; Y329-S348 PolarHBondContact OH-OG 2.91Å
330I83.7Confident84.8Confident44 Ų4431.9 Ų31.923%0.22616%0.16CC..Hα-helixtrans-66.6-35.4178.6-59.3-179.1000111.1Y326 I327 G334 Y495Y326-I330 HydrophobicContact CD1-CD1 4Å; Y326-I330 HydrophobicContact CE1-CD1 3.3Å; Y326-I330 HydrophobicContact CE1-CG1 4.46Å; Y326-I330 HydrophobicContact CE2-CD1 3.98Å; Y326-I330 PolarHBondContact O-N 3.3Å; Y326-I330 VanDerWaalsContact OH-CD1 3.31Å; Y326-I330 WeakPolarHBondContact OH-CD1 3.4Å; I327-I330 PolarHBondContact O-N 3.44Å; I330-G334 PolarHBondContact O-N 2.99Å; I330-G334 VanDerWaalsContact O-N 3.13Å; I330-Y495 HydrophobicContact CB-CE1 4.27Å; I330-Y495 HydrophobicContact CG2-CE1 3.69Å
331Y88.5Confident84Confident2 Ų232.9 Ų32.91%0.00817%0.166CC..Hα-helixtrans-62.8-46.7176.6178.4-109.5000112.7I327 I328 Y329 G334 F337 L424 S427 H428 Y495 P503 F507I327-Y331 WeakPolarHBondContact O-CB 3.38Å; I327-Y331 PolarHBondContact O-N 2.97Å; I328-Y331 PolarHBondContact O-N 3.29Å; Y329-Y331 VanDerWaalsContact C-N 3.29Å; Y329-Y331 PolarHBondContact O-N 3.09Å; Y331-G334 PolarHBondContact O-N 3.35Å; Y331-F337 HydrophobicContact CD1-CD2 4.49Å; Y331-F337 AromaticContact CD1-CE2 3.9Å; Y331-F337 HydrophobicContact CD1-CE2 3.9Å; Y331-F337 HydrophobicContact CD1-CZ 4.42Å; Y331-F337 HydrophobicContact CD2-CE2 4.48Å; Y331-F337 HydrophobicContact CE1-CD2 4.29Å; Y331-F337 AromaticContact CE1-CE2 3.32Å; Y331-F337 HydrophobicContact CE1-CE2 3.32Å; Y331-F337 AromaticContact CE1-CZ 3.51Å; Y331-F337 HydrophobicContact CE1-CZ 3.51Å; Y331-F337 AromaticContact CE2-CE2 3.99Å; Y331-F337 HydrophobicContact CE2-CE2 3.99Å; Y331-F337 HydrophobicContact CG-CE2 4.45Å; Y331-F337 AromaticContact CZ-CE2 3.38Å; Y331-F337 AromaticContact CZ-CZ 3.64Å; Y331-F337 WeakPolarHBondContact O-CD2 3.22Å; Y331-F337 WeakPolarHBondContact OH-CZ 3.16Å; Y331-L424 PolarHBondContact OH-O 2.84Å; Y331-S427 PolarHBondContact OH-OG 3.21Å; Y331-H428 HydrophobicContact CE2-CB 4.47Å; Y331-H428 WeakPolarHBondContact OH-CB 3.38Å; Y331-H428 PolarHBondContact OH-N 3.47Å; Y331-Y495 WeakPolarHBondContact CA-OH 3.24Å; Y331-Y495 HydrophobicContact CD2-CE2 4.15Å; Y331-P503 HydrophobicContact CD2-CB 4.44Å; Y331-P503 HydrophobicContact CE2-CB 4.33Å; Y331-F507 HydrophobicContact CD1-CD2 4.48Å; Y331-F507 AromaticContact CD1-CE2 3.47Å; Y331-F507 HydrophobicContact CD1-CE2 3.47Å; Y331-F507 VanDerWaalsContact CD1-CE2 3.47Å; Y331-F507 AromaticContact CD1-CZ 3.95Å; Y331-F507 HydrophobicContact CD1-CZ 3.95Å; Y331-F507 AromaticContact CD2-CE2 3.73Å; Y331-F507 HydrophobicContact CD2-CE2 3.73Å; Y331-F507 HydrophobicContact CE1-CD2 4.3Å; Y331-F507 AromaticContact CE1-CE2 3.69Å; Y331-F507 HydrophobicContact CE1-CE2 3.69Å; Y331-F507 HydrophobicContact CE1-CZ 4.48Å; Y331-F507 HydrophobicContact CE2-CD2 4.34Å; Y331-F507 AromaticContact CE2-CE2 3.93Å; Y331-F507 HydrophobicContact CE2-CE2 3.93Å; Y331-F507 AromaticContact CG-CE2 3.47Å; Y331-F507 HydrophobicContact CG-CE2 3.47Å; Y331-F507 VanDerWaalsContact CG-CE2 3.47Å; Y331-F507 HydrophobicContact CG-CZ 4.03Å; Y331-F507 AromaticContact CZ-CE2 3.9Å
332L89Confident83.8Confident0 Ų034.7 Ų34.70%017%0.173CC..Hα-helixtrans-76.4-27.3-178.9-65.9171.8000113I328 Y329 G334 F337 L338 W339 V344 Y347 V439I328-L332 HydrophobicContact CG1-CD1 3.93Å; I328-L332 HydrophobicContact CG1-CG 4.33Å; I328-L332 WeakPolarHBondContact O-CB 3.41Å; I328-L332 VanDerWaalsContact O-CG 3.23Å; I328-L332 WeakPolarHBondContact O-CG 3.44Å; I328-L332 PolarHBondContact O-N 3.41Å; Y329-L332 PolarHBondContact O-N 3.41Å; L332-G334 PolarHBondContact O-N 3.26Å; L332-F337 HydrophobicContact CD2-CD1 4.18Å; L332-F337 HydrophobicContact CD2-CD2 4.24Å; L332-F337 HydrophobicContact CD2-CG 4.05Å; L332-F337 WeakPolarHBondContact O-CB 3.41Å; L332-L338 PolarHBondContact O-N 2.9Å; L332-W339 HydrophobicContact CB-CB 4.49Å; L332-W339 HydrophobicContact CB-CD2 4.19Å; L332-W339 HydrophobicContact CB-CE3 4.01Å; L332-W339 HydrophobicContact CB-CG 4.42Å; L332-W339 HydrophobicContact CD1-CE3 3.87Å; L332-W339 HydrophobicContact CD1-CH2 4.28Å; L332-W339 HydrophobicContact CD1-CZ3 3.64Å; L332-W339 HydrophobicContact CG-CE3 4.37Å; L332-W339 HydrophobicContact CG-CZ3 4.47Å; L332-W339 WeakPolarHBondContact O-CB 3.45Å; L332-W339 PolarHBondContact O-N 3.41Å; L332-V344 HydrophobicContact CB-CG2 4.06Å; L332-Y347 HydrophobicContact CD1-CD1 3.93Å; L332-Y347 HydrophobicContact CD1-CE1 3.81Å; L332-V439 HydrophobicContact CD2-CB 4.5Å; L332-V439 HydrophobicContact CD2-CG1 3.89Å; L332-V439 HydrophobicContact CD2-CG2 3.83Å
333M84.9Confident83.7Confident55 Ų5537.6 Ų37.627%0.27119%0.188SC..Hα-helixtrans-71.5-19.1169-69.3178.5174.500112.3Y329 W339 V344Y329-M333 WeakPolarHBondContact O-CB 3.27Å; Y329-M333 VanDerWaalsContact O-CG 3.25Å; Y329-M333 WeakPolarHBondContact O-CG 3.09Å; Y329-M333 PolarHBondContact O-N 3.49Å; M333-W339 WeakPolarHBondContact CA-O 3.41Å; M333-W339 WeakPolarHBondContact CG-O 3.4Å; M333-V344 HydrophobicContact CE-CB 4.26Å; M333-V344 HydrophobicContact CE-CG2 4.1Å; M333-V344 HydrophobicContact CG-CG2 3.98Å
334G79.5Confident83.6Confident24 Ų2437.7 Ų37.725%0.24719%0.189CC..SBendtrans-79.7172.317800000114.3I330 Y331 L332 F337 L338I330-G334 PolarHBondContact O-N 2.99Å; I330-G334 VanDerWaalsContact O-N 3.13Å; Y331-G334 PolarHBondContact O-N 3.35Å; L332-G334 PolarHBondContact O-N 3.26Å; G334-F337 PolarHBondContact O-N 3.49Å; G334-L338 PolarHBondContact O-N 3.3Å
335Y76.6Confident83.6Confident160 Ų16037.5 Ų37.563%0.62719%0.187SC*.THydrogen-bonded Turntrans-70.5133.7168-174.4-96.3000109.7H428Y335-H428 PolarHBondContact O-CE1 3.1Å; Y335-H428 VanDerWaalsContact O-CE1 3.3Å; Y335-H428 PolarHBondContact O-ND1 3.35Å
336S78.8Confident84.1Confident5 Ų537 Ų374%0.03519%0.185CC..THydrogen-bonded Turncis-99.610.519.9-46.90000115.7T432S336-T432 WeakPolarHBondContact O-CA 3.47Å; S336-T432 VanDerWaalsContact O-CB 3.29Å; S336-T432 WeakPolarHBondContact O-CB 3.38Å; S336-T432 WeakPolarHBondContact O-CG2 3.32Å; S336-T432 PolarHBondContact O-OG1 2.85Å
337F87.6Confident84.6Confident5 Ų536.5 Ų36.52%0.02218%0.182CC..THydrogen-bonded Turntrans-95.5-43.8-169.6-50.4-80.7000113.6Y331 L332 G334 S427 A435 N436 V439Y331-F337 HydrophobicContact CD1-CD2 4.49Å; Y331-F337 AromaticContact CD1-CE2 3.9Å; Y331-F337 HydrophobicContact CD1-CE2 3.9Å; Y331-F337 HydrophobicContact CD1-CZ 4.42Å; Y331-F337 HydrophobicContact CD2-CE2 4.48Å; Y331-F337 HydrophobicContact CE1-CD2 4.29Å; Y331-F337 AromaticContact CE1-CE2 3.32Å; Y331-F337 HydrophobicContact CE1-CE2 3.32Å; Y331-F337 AromaticContact CE1-CZ 3.51Å; Y331-F337 HydrophobicContact CE1-CZ 3.51Å; Y331-F337 AromaticContact CE2-CE2 3.99Å; Y331-F337 HydrophobicContact CE2-CE2 3.99Å; Y331-F337 HydrophobicContact CG-CE2 4.45Å; Y331-F337 AromaticContact CZ-CE2 3.38Å; Y331-F337 AromaticContact CZ-CZ 3.64Å; Y331-F337 WeakPolarHBondContact O-CD2 3.22Å; Y331-F337 WeakPolarHBondContact OH-CZ 3.16Å; L332-F337 HydrophobicContact CD2-CD1 4.18Å; L332-F337 HydrophobicContact CD2-CD2 4.24Å; L332-F337 HydrophobicContact CD2-CG 4.05Å; L332-F337 WeakPolarHBondContact O-CB 3.41Å; G334-F337 PolarHBondContact O-N 3.49Å; F337-S427 VanDerWaalsContact CZ-OG 3.28Å; F337-S427 WeakPolarHBondContact CZ-OG 3.45Å; F337-A435 HydrophobicContact CD1-CB 4.06Å; F337-A435 HydrophobicContact CE1-CB 3.65Å; F337-A435 HydrophobicContact CZ-CB 4.37Å; F337-N436 WeakPolarHBondContact CD1-OD1 3.48Å; F337-V439 HydrophobicContact CD1-CG2 3.82Å; F337-V439 HydrophobicContact CE1-CG2 3.35Å; F337-V439 HydrophobicContact CZ-CG2 4.12Å
338L83.1Confident84.6Confident119 Ų11936.4 Ų36.462%0.62318%0.182SC*.  trans59.341.4176.9-57.5169.4000114.6L332 G334L332-L338 PolarHBondContact O-N 2.9Å; G334-L338 PolarHBondContact O-N 3.3Å
339W87.3Confident84.7Confident22 Ų2236.4 Ų36.48%0.08318%0.182CC..  trans-78.3148.2178.4-68.814.3000112.3L332 M333 D343 V344 Y347 N436 V439 Y440L332-W339 HydrophobicContact CB-CB 4.49Å; L332-W339 HydrophobicContact CB-CD2 4.19Å; L332-W339 HydrophobicContact CB-CE3 4.01Å; L332-W339 HydrophobicContact CB-CG 4.42Å; L332-W339 HydrophobicContact CD1-CE3 3.87Å; L332-W339 HydrophobicContact CD1-CH2 4.28Å; L332-W339 HydrophobicContact CD1-CZ3 3.64Å; L332-W339 HydrophobicContact CG-CE3 4.37Å; L332-W339 HydrophobicContact CG-CZ3 4.47Å; L332-W339 WeakPolarHBondContact O-CB 3.45Å; L332-W339 PolarHBondContact O-N 3.41Å; M333-W339 WeakPolarHBondContact CA-O 3.41Å; M333-W339 WeakPolarHBondContact CG-O 3.4Å; W339-D343 HydrophobicContact CB-CB 4.03Å; W339-D343 HydrophobicContact CD2-CB 4.37Å; W339-D343 HydrophobicContact CE3-CB 4.32Å; W339-D343 HydrophobicContact CG-CB 4.28Å; W339-V344 HydrophobicContact CB-CG2 3.73Å; W339-V344 HydrophobicContact CE3-CG2 3.89Å; W339-Y347 HydrophobicContact CH2-CD1 4.28Å; W339-Y347 AromaticContact CH2-CD2 3.65Å; W339-Y347 HydrophobicContact CH2-CD2 3.65Å; W339-Y347 HydrophobicContact CH2-CE2 4.11Å; W339-Y347 AromaticContact CH2-CG 3.75Å; W339-Y347 HydrophobicContact CH2-CG 3.75Å; W339-Y347 AromaticContact CZ3-CD1 3.73Å; W339-Y347 HydrophobicContact CZ3-CD1 3.73Å; W339-Y347 AromaticContact CZ3-CD2 3.82Å; W339-Y347 HydrophobicContact CZ3-CD2 3.82Å; W339-Y347 HydrophobicContact CZ3-CE1 4.42Å; W339-Y347 HydrophobicContact CZ3-CE2 4.5Å; W339-Y347 AromaticContact CZ3-CG 3.39Å; W339-Y347 HydrophobicContact CZ3-CG 3.39Å; W339-N436 PolarHBondContact NE1-OD1 3.05Å; W339-V439 HydrophobicContact CH2-CG1 3.76Å; W339-V439 HydrophobicContact CZ2-CG1 4.05Å; W339-Y440 HydrophobicContact CH2-CE1 4.39Å; W339-Y440 HydrophobicContact CZ2-CE2 4.42Å
340N81Confident85Confident69 Ų6938.8 Ų38.837%0.36920%0.199SC..  trans-88.8175.9172.567.739.6000111.8Q342 D343 V344N340-Q342 VanDerWaalsContact C-N 3.28Å; N340-Q342 PolarHBondContact O-N 3.28Å; N340-Q342 WeakPolarHBondContact OD1-CA 3.46Å; N340-Q342 VanDerWaalsContact OD1-CB 3.32Å; N340-Q342 WeakPolarHBondContact OD1-CB 3.17Å; N340-Q342 PolarHBondContact OD1-N 3.41Å; N340-D343 PolarHBondContact N-OD2 3.45Å; N340-D343 PolarHBondContact ND2-OD2 3.39Å; N340-D343 PolarHBondContact O-N 2.95Å; N340-D343 PolarHBondContact OD1-N 3.47Å; N340-D343 PolarHBondContact OD1-OD2 3.02Å; N340-V344 WeakPolarHBondContact O-CG2 3.48Å; N340-V344 PolarHBondContact O-N 3.3Å; N340-V344 VanDerWaalsContact O-N 3.11Å
341S75.7Confident85.4Confident20 Ų2037 Ų3714%0.1419%0.19CC..Hα-helixtrans-62.9-32179.957.40000113.7G345S341-G345 PolarHBondContact O-N 3.19Å
342Q85.4Confident85.5Confident70 Ų7037.5 Ų37.533%0.32719%0.193SC..Hα-helixtrans-68.8-46175.4178.1-178.8-12.600111.3N340 G345 I346N340-Q342 VanDerWaalsContact C-N 3.28Å; N340-Q342 PolarHBondContact O-N 3.28Å; N340-Q342 WeakPolarHBondContact OD1-CA 3.46Å; N340-Q342 VanDerWaalsContact OD1-CB 3.32Å; N340-Q342 WeakPolarHBondContact OD1-CB 3.17Å; N340-Q342 PolarHBondContact OD1-N 3.41Å; Q342-G345 PolarHBondContact O-N 3.15Å; Q342-I346 HydrophobicContact CG-CD1 3.65Å; Q342-I346 HydrophobicContact CG-CG1 4.36Å; Q342-I346 WeakPolarHBondContact O-CB 3.24Å; Q342-I346 VanDerWaalsContact O-CG1 3.22Å; Q342-I346 WeakPolarHBondContact O-CG1 3.38Å; Q342-I346 PolarHBondContact O-N 2.58Å
343D87.6Confident85.7Confident67 Ų6739.5 Ų39.536%0.35820%0.203SC..Hα-helixtrans-64-47.1-177.7-62.9-29.4000110.9W339 N340 I346 Y347W339-D343 HydrophobicContact CB-CB 4.03Å; W339-D343 HydrophobicContact CD2-CB 4.37Å; W339-D343 HydrophobicContact CE3-CB 4.32Å; W339-D343 HydrophobicContact CG-CB 4.28Å; N340-D343 PolarHBondContact N-OD2 3.45Å; N340-D343 PolarHBondContact ND2-OD2 3.39Å; N340-D343 PolarHBondContact O-N 2.95Å; N340-D343 PolarHBondContact OD1-N 3.47Å; N340-D343 PolarHBondContact OD1-OD2 3.02Å; D343-I346 PolarHBondContact O-N 3.17Å; D343-Y347 VanDerWaalsContact O-CB 3.26Å; D343-Y347 WeakPolarHBondContact O-CB 3.49Å; D343-Y347 PolarHBondContact O-N 3.24Å
344V85.3Confident86.1Confident3 Ų339.9 Ų39.92%0.01821%0.206CC..Hα-helixtrans-63.7-43.4176.21760000111.1Y329 L332 M333 W339 N340 Y347 S348Y329-V344 HydrophobicContact CD1-CG1 3.14Å; Y329-V344 HydrophobicContact CD2-CG1 4.47Å; Y329-V344 HydrophobicContact CE1-CG1 3.77Å; Y329-V344 HydrophobicContact CG-CG1 3.57Å; L332-V344 HydrophobicContact CB-CG2 4.06Å; M333-V344 HydrophobicContact CE-CB 4.26Å; M333-V344 HydrophobicContact CE-CG2 4.1Å; M333-V344 HydrophobicContact CG-CG2 3.98Å; W339-V344 HydrophobicContact CB-CG2 3.73Å; W339-V344 HydrophobicContact CE3-CG2 3.89Å; N340-V344 WeakPolarHBondContact O-CG2 3.48Å; N340-V344 PolarHBondContact O-N 3.3Å; N340-V344 VanDerWaalsContact O-N 3.11Å; V344-Y347 PolarHBondContact O-N 2.95Å; V344-S348 WeakPolarHBondContact O-CB 3.3Å; V344-S348 PolarHBondContact O-N 3.02Å
345G84.1Confident86.7Confident0 Ų038.8 Ų38.80%019%0.194CC..Hα-helixtrans-62.2-45.617800000112.5P211 S341 Q342 G349P211-G345 WeakPolarHBondContact CD-O 3.5Å; P211-G345 WeakPolarHBondContact CG-O 3.5Å; S341-G345 PolarHBondContact O-N 3.19Å; Q342-G345 PolarHBondContact O-N 3.15Å; G345-G349 PolarHBondContact O-N 3.23Å
346I90.3Very high87.4Confident64 Ų6431.2 Ų31.233%0.32816%0.164SC..Hα-helixtrans-64.7-47.7176.7-70.1170.7000110.6Q342 D343 G349 V350Q342-I346 HydrophobicContact CG-CD1 3.65Å; Q342-I346 HydrophobicContact CG-CG1 4.36Å; Q342-I346 WeakPolarHBondContact O-CB 3.24Å; Q342-I346 VanDerWaalsContact O-CG1 3.22Å; Q342-I346 WeakPolarHBondContact O-CG1 3.38Å; Q342-I346 PolarHBondContact O-N 2.58Å; D343-I346 PolarHBondContact O-N 3.17Å; I346-G349 PolarHBondContact O-N 3.09Å; I346-V350 HydrophobicContact CG2-CG2 4.02Å; I346-V350 VanDerWaalsContact O-CB 3.3Å; I346-V350 WeakPolarHBondContact O-CB 3.42Å; I346-V350 VanDerWaalsContact O-CG2 3.24Å; I346-V350 WeakPolarHBondContact O-CG2 3.46Å; I346-V350 PolarHBondContact O-N 3.12Å
347Y90.7Very high88.1Confident14 Ų1434.8 Ų34.86%0.05518%0.182CC..Hα-helixtrans-57.4-52.6177.3168.5-102.3000111.5I328 L332 W339 D343 V344 G349 T351 V439 T443I328-Y347 HydrophobicContact CD1-CE1 4.13Å; L332-Y347 HydrophobicContact CD1-CD1 3.93Å; L332-Y347 HydrophobicContact CD1-CE1 3.81Å; W339-Y347 HydrophobicContact CH2-CD1 4.28Å; W339-Y347 AromaticContact CH2-CD2 3.65Å; W339-Y347 HydrophobicContact CH2-CD2 3.65Å; W339-Y347 HydrophobicContact CH2-CE2 4.11Å; W339-Y347 AromaticContact CH2-CG 3.75Å; W339-Y347 HydrophobicContact CH2-CG 3.75Å; W339-Y347 AromaticContact CZ3-CD1 3.73Å; W339-Y347 HydrophobicContact CZ3-CD1 3.73Å; W339-Y347 AromaticContact CZ3-CD2 3.82Å; W339-Y347 HydrophobicContact CZ3-CD2 3.82Å; W339-Y347 HydrophobicContact CZ3-CE1 4.42Å; W339-Y347 HydrophobicContact CZ3-CE2 4.5Å; W339-Y347 AromaticContact CZ3-CG 3.39Å; W339-Y347 HydrophobicContact CZ3-CG 3.39Å; D343-Y347 VanDerWaalsContact O-CB 3.26Å; D343-Y347 WeakPolarHBondContact O-CB 3.49Å; D343-Y347 PolarHBondContact O-N 3.24Å; V344-Y347 PolarHBondContact O-N 2.95Å; Y347-G349 PolarHBondContact O-N 3.22Å; Y347-T351 HydrophobicContact CD2-CG2 3.86Å; Y347-T351 HydrophobicContact CE2-CG2 3.79Å; Y347-T351 HydrophobicContact CG-CG2 4.43Å; Y347-T351 WeakPolarHBondContact O-CB 3.16Å; Y347-T351 WeakPolarHBondContact O-CG2 3.44Å; Y347-T351 PolarHBondContact O-N 3.31Å; Y347-T351 PolarHBondContact O-OG1 3.29Å; Y347-V439 HydrophobicContact CE2-CG1 3.9Å; Y347-T443 VanDerWaalsContact CE2-OG1 3.26Å; Y347-T443 WeakPolarHBondContact CE2-OG1 3.37Å
348S85.9Confident88.4Confident2 Ų237.6 Ų37.61%0.01420%0.197CC..Hα-helixtrans-59.3-48179.6-164.90000111.3Y329 V344 T351 D352Y329-S348 WeakPolarHBondContact OH-CB 3.39Å; Y329-S348 PolarHBondContact OH-OG 2.91Å; V344-S348 WeakPolarHBondContact O-CB 3.3Å; V344-S348 PolarHBondContact O-N 3.02Å; S348-T351 PolarHBondContact O-OG1 2.9Å; S348-D352 WeakPolarHBondContact O-CB 3.31Å; S348-D352 PolarHBondContact O-N 3.49Å
349G89.1Confident88.8Confident0 Ų032.1 Ų32.10%017%0.169CC..Hα-helixtrans-60.1-52.7179.600000113.4S207 G345 I346 Y347 I353S207-G349 WeakPolarHBondContact O-CA 3.24Å; G345-G349 PolarHBondContact O-N 3.23Å; I346-G349 PolarHBondContact O-N 3.09Å; Y347-G349 PolarHBondContact O-N 3.22Å; G349-I353 WeakPolarHBondContact O-CB 3.49Å; G349-I353 WeakPolarHBondContact O-CD1 3.25Å; G349-I353 WeakPolarHBondContact O-CG1 3.42Å; G349-I353 PolarHBondContact O-N 2.99Å
350V91.3Very high89Confident70 Ų7032.8 Ų32.842%0.42417%0.174SC..Hα-helixtrans-65-44.7-177.1171.70000111.2I346 D352 I353 I354I346-V350 HydrophobicContact CG2-CG2 4.02Å; I346-V350 VanDerWaalsContact O-CB 3.3Å; I346-V350 WeakPolarHBondContact O-CB 3.42Å; I346-V350 VanDerWaalsContact O-CG2 3.24Å; I346-V350 WeakPolarHBondContact O-CG2 3.46Å; I346-V350 PolarHBondContact O-N 3.12Å; V350-D352 VanDerWaalsContact C-N 3.35Å; V350-D352 PolarHBondContact O-N 2.88Å; V350-I353 PolarHBondContact O-N 3.17Å; V350-I354 HydrophobicContact CG1-CD1 3.62Å; V350-I354 HydrophobicContact CG1-CG1 4.35Å; V350-I354 WeakPolarHBondContact O-CB 3.06Å; V350-I354 VanDerWaalsContact O-CG1 3.27Å; V350-I354 WeakPolarHBondContact O-CG1 3.28Å; V350-I354 PolarHBondContact O-N 3.18Å
351T91.4Very high89.5Confident6 Ų634 Ų344%0.03718%0.179CC..Hα-helixtrans-64.7-39.7-176.755.90000112.6Y347 S348 S355 T443 R446Y347-T351 HydrophobicContact CD2-CG2 3.86Å; Y347-T351 HydrophobicContact CE2-CG2 3.79Å; Y347-T351 HydrophobicContact CG-CG2 4.43Å; Y347-T351 WeakPolarHBondContact O-CB 3.16Å; Y347-T351 WeakPolarHBondContact O-CG2 3.44Å; Y347-T351 PolarHBondContact O-N 3.31Å; Y347-T351 PolarHBondContact O-OG1 3.29Å; S348-T351 PolarHBondContact O-OG1 2.9Å; T351-S355 VanDerWaalsContact O-CB 3.29Å; T351-S355 WeakPolarHBondContact O-CB 3.33Å; T351-S355 PolarHBondContact O-N 2.89Å; T351-T443 HydrophobicContact CG2-CG2 3.24Å; T351-R446 PolarHBondContact OG1-NH1 3.11Å
352D90.4Very high90.2Very high13 Ų1335.9 Ų35.97%0.0719%0.185CC..Hα-helixtrans-77.4-33.5178.8-73.2-15.7000112.7L203 S207 S348 V350 S355 A356 R446L203-D352 HydrophobicContact CD1-CB 3.9Å; L203-D352 WeakPolarHBondContact CD2-O 3.35Å; L203-D352 HydrophobicContact CG-CB 4.18Å; S207-D352 WeakPolarHBondContact OG-CB 3.48Å; S348-D352 WeakPolarHBondContact O-CB 3.31Å; S348-D352 PolarHBondContact O-N 3.49Å; V350-D352 VanDerWaalsContact C-N 3.35Å; V350-D352 PolarHBondContact O-N 2.88Å; D352-S355 WeakPolarHBondContact O-CB 3.28Å; D352-S355 PolarHBondContact O-N 3.5Å; D352-A356 WeakPolarHBondContact O-CB 3.49Å; D352-A356 PolarHBondContact O-N 3.39Å; D352-R446 VanDerWaalsContact CG-NH2 3.27Å; D352-R446 IonicContact OD1-CZ 3.64Å; D352-R446 IonicContact OD1-NE 2.62Å; D352-R446 PolarHBondContact OD1-NE 2.92Å; D352-R446 IonicContact OD1-NH2 3.13Å; D352-R446 PolarHBondContact OD1-NH2 3.31Å; D352-R446 IonicContact OD2-NH2 3.44Å; D352-R446 PolarHBondContact OD2-NH2 2.95Å
353I92.8Very high90.3Very high42 Ų4232.7 Ų32.722%0.21517%0.17CC..Hα-helixtrans-62-46.5171.1-71.2166.3000110.6L208 G349 V350 S355 A356 I357L208-I353 HydrophobicContact CD1-CD1 4.43Å; G349-I353 WeakPolarHBondContact O-CB 3.49Å; G349-I353 WeakPolarHBondContact O-CD1 3.25Å; G349-I353 WeakPolarHBondContact O-CG1 3.42Å; G349-I353 PolarHBondContact O-N 2.99Å; V350-I353 PolarHBondContact O-N 3.17Å; I353-S355 VanDerWaalsContact C-N 3.34Å; I353-S355 PolarHBondContact O-N 2.84Å; I353-A356 WeakPolarHBondContact O-CB 3.34Å; I353-A356 PolarHBondContact O-N 3.42Å; I353-I357 HydrophobicContact CG2-CD1 3.89Å; I353-I357 WeakPolarHBondContact O-CG1 3.37Å; I353-I357 PolarHBondContact O-N 2.76Å
354I93.5Very high90.2Very high63 Ų6333 Ų3332%0.32317%0.171SC..Hα-helixtrans-63.5-42.5177.3-66.5169.6000110.4V350 A356 I357 I358 F447V350-I354 HydrophobicContact CG1-CD1 3.62Å; V350-I354 HydrophobicContact CG1-CG1 4.35Å; V350-I354 WeakPolarHBondContact O-CB 3.06Å; V350-I354 VanDerWaalsContact O-CG1 3.27Å; V350-I354 WeakPolarHBondContact O-CG1 3.28Å; V350-I354 PolarHBondContact O-N 3.18Å; I354-A356 VanDerWaalsContact C-N 3.32Å; I354-A356 PolarHBondContact O-N 3.07Å; I354-I357 PolarHBondContact O-N 2.9Å; I354-I358 HydrophobicContact CG2-CD1 3.61Å; I354-I358 HydrophobicContact CG2-CG1 4.25Å; I354-I358 WeakPolarHBondContact O-CB 3.47Å; I354-I358 WeakPolarHBondContact O-CG1 3.48Å; I354-I358 PolarHBondContact O-N 3.43Å; I354-F447 HydrophobicContact CB-CD1 4.12Å; I354-F447 HydrophobicContact CB-CE1 3.64Å; I354-F447 HydrophobicContact CB-CZ 4.16Å; I354-F447 HydrophobicContact CD1-CE1 4.35Å; I354-F447 HydrophobicContact CD1-CZ 4.26Å; I354-F447 HydrophobicContact CG2-CD1 3.72Å; I354-F447 HydrophobicContact CG2-CD2 4.32Å; I354-F447 HydrophobicContact CG2-CE1 3.38Å; I354-F447 HydrophobicContact CG2-CE2 4.03Å; I354-F447 HydrophobicContact CG2-CG 4.19Å; I354-F447 HydrophobicContact CG2-CZ 3.54Å
355S92.7Very high90.3Very high0 Ų037.3 Ų37.30%019%0.194CC..Hα-helixtrans-55.9-44.2174.1-175.40000112.1T351 D352 I353 A359 F447 G450T351-S355 VanDerWaalsContact O-CB 3.29Å; T351-S355 WeakPolarHBondContact O-CB 3.33Å; T351-S355 PolarHBondContact O-N 2.89Å; D352-S355 WeakPolarHBondContact O-CB 3.28Å; D352-S355 PolarHBondContact O-N 3.5Å; I353-S355 VanDerWaalsContact C-N 3.34Å; I353-S355 PolarHBondContact O-N 2.84Å; S355-A359 WeakPolarHBondContact O-CB 3.2Å; S355-A359 PolarHBondContact O-N 3.01Å; S355-F447 PolarHBondContact OG-O 2.86Å; S355-F447 VanDerWaalsContact OG-O 3.1Å; S355-G450 PolarHBondContact OG-N 3.23Å; S355-G450 VanDerWaalsContact OG-N 3.15Å
356A92.5Very high90.3Very high1 Ų138.4 Ų38.41%0.00820%0.199CC..Hα-helixtrans-63.2-46.8176.400000112.5L203 I204 D352 I353 I354 A359 I360L203-A356 HydrophobicContact CB-CB 4.09Å; L203-A356 HydrophobicContact CD2-CB 3.87Å; L203-A356 HydrophobicContact CG-CB 4.12Å; I204-A356 HydrophobicContact CD1-CB 4.07Å; I204-A356 HydrophobicContact CG1-CB 3.62Å; D352-A356 WeakPolarHBondContact O-CB 3.49Å; D352-A356 PolarHBondContact O-N 3.39Å; I353-A356 WeakPolarHBondContact O-CB 3.34Å; I353-A356 PolarHBondContact O-N 3.42Å; I354-A356 VanDerWaalsContact C-N 3.32Å; I354-A356 PolarHBondContact O-N 3.07Å; A356-A359 PolarHBondContact O-N 3.27Å; A356-I360 VanDerWaalsContact O-CG1 3.32Å; A356-I360 WeakPolarHBondContact O-CG1 3.43Å; A356-I360 PolarHBondContact O-N 3.49Å
357I93.1Very high89.6Confident80 Ų8036 Ų3641%0.4119%0.188SC..Hα-helixtrans-62.4-45.7179.6-67.5167.3000110.4I353 I354 A359 I360 I361I353-I357 HydrophobicContact CG2-CD1 3.89Å; I353-I357 WeakPolarHBondContact O-CG1 3.37Å; I353-I357 PolarHBondContact O-N 2.76Å; I354-I357 PolarHBondContact O-N 2.9Å; I357-A359 VanDerWaalsContact C-N 3.34Å; I357-A359 PolarHBondContact O-N 3.03Å; I357-I360 PolarHBondContact O-N 3.03Å; I357-I361 HydrophobicContact CG2-CD1 3.7Å; I357-I361 HydrophobicContact CG2-CG1 4.41Å; I357-I361 VanDerWaalsContact O-CG1 3.31Å; I357-I361 WeakPolarHBondContact O-CG1 3.26Å; I357-I361 PolarHBondContact O-N 3.16Å
358I92.6Very high89.1Confident65 Ų6544.4 Ų44.433%0.33322%0.22SC..Hα-helixtrans-61-44.5177-71.5171000110.4I354 I360 I361 F362 F447I354-I358 HydrophobicContact CG2-CD1 3.61Å; I354-I358 HydrophobicContact CG2-CG1 4.25Å; I354-I358 WeakPolarHBondContact O-CB 3.47Å; I354-I358 WeakPolarHBondContact O-CG1 3.48Å; I354-I358 PolarHBondContact O-N 3.43Å; I358-I360 PolarHBondContact O-N 3.34Å; I358-I361 PolarHBondContact O-N 3.47Å; I358-F362 WeakPolarHBondContact O-CB 3.45Å; I358-F362 PolarHBondContact O-N 2.97Å; I358-F447 HydrophobicContact CD1-CB 3.72Å; I358-F447 HydrophobicContact CD1-CD1 4.4Å; I358-F447 HydrophobicContact CD1-CD2 3.73Å; I358-F447 HydrophobicContact CD1-CE2 4.42Å; I358-F447 HydrophobicContact CD1-CG 3.71Å
359A91.3Very high88.6Confident3 Ų349 Ų493%0.02524%0.244CC..Hα-helixtrans-60.4-44.7177.900000112.3T196 S355 A356 I357 F362 T363 L451T196-A359 HydrophobicContact CG2-CB 4.49Å; S355-A359 WeakPolarHBondContact O-CB 3.2Å; S355-A359 PolarHBondContact O-N 3.01Å; A356-A359 PolarHBondContact O-N 3.27Å; I357-A359 VanDerWaalsContact C-N 3.34Å; I357-A359 PolarHBondContact O-N 3.03Å; A359-F362 PolarHBondContact O-N 3.25Å; A359-T363 PolarHBondContact O-N 3.04Å; A359-T363 PolarHBondContact O-OG1 3.46Å; A359-L451 HydrophobicContact CB-CD2 3.9Å; A359-L451 HydrophobicContact CB-CG 4.43Å
360I91.7Very high87.6Confident37 Ų3750.7 Ų50.719%0.1925%0.252CS..Hα-helixtrans-61.8-51.5176.7-67.3165000110.8T196 A356 I357 I358 F362 T363 L364T196-I360 HydrophobicContact CG2-CG1 4.11Å; A356-I360 VanDerWaalsContact O-CG1 3.32Å; A356-I360 WeakPolarHBondContact O-CG1 3.43Å; A356-I360 PolarHBondContact O-N 3.49Å; I357-I360 PolarHBondContact O-N 3.03Å; I358-I360 PolarHBondContact O-N 3.34Å; I360-F362 VanDerWaalsContact C-N 3.3Å; I360-F362 PolarHBondContact O-N 3.28Å; I360-T363 PolarHBondContact O-N 2.94Å; I360-L364 HydrophobicContact CG2-CD1 3.99Å; I360-L364 HydrophobicContact CG2-CG 4.44Å; I360-L364 VanDerWaalsContact O-CG 3.29Å; I360-L364 WeakPolarHBondContact O-CG 3.49Å; I360-L364 PolarHBondContact O-N 2.97Å
361I91.9Very high86.2Confident93 Ų9351.6 Ų51.648%0.47725%0.251SS..Hα-helixtrans-58.7-45.6179.5-68.2169.8000110.2I357 I358 L364 L365I357-I361 HydrophobicContact CG2-CD1 3.7Å; I357-I361 HydrophobicContact CG2-CG1 4.41Å; I357-I361 VanDerWaalsContact O-CG1 3.31Å; I357-I361 WeakPolarHBondContact O-CG1 3.26Å; I357-I361 PolarHBondContact O-N 3.16Å; I358-I361 PolarHBondContact O-N 3.47Å; I361-L364 PolarHBondContact O-N 3.4Å; I361-L365 HydrophobicContact CG2-CD1 4.05Å; I361-L365 HydrophobicContact CG2-CG 4.46Å; I361-L365 WeakPolarHBondContact O-CG 3.12Å; I361-L365 PolarHBondContact O-N 3.25Å
362F90.6Very high84.4Confident61 Ų6161 Ų6127%0.26829%0.286SS..Hα-helixtrans-62-47.4179.9-176.3-89.2000111.8I358 A359 I360 L364 L365 M366 I409 L451I358-F362 WeakPolarHBondContact O-CB 3.45Å; I358-F362 PolarHBondContact O-N 2.97Å; A359-F362 PolarHBondContact O-N 3.25Å; I360-F362 VanDerWaalsContact C-N 3.3Å; I360-F362 PolarHBondContact O-N 3.28Å; F362-L364 VanDerWaalsContact C-N 3.34Å; F362-L364 PolarHBondContact O-N 3.43Å; F362-L365 PolarHBondContact O-N 2.85Å; F362-M366 HydrophobicContact CD1-CG 3.93Å; F362-M366 HydrophobicContact CE1-CG 3.48Å; F362-M366 VanDerWaalsContact CE1-CG 3.48Å; F362-M366 HydrophobicContact CE1-SD 4.41Å; F362-M366 HydrophobicContact CE2-CG 4.36Å; F362-M366 HydrophobicContact CZ-CG 3.73Å; F362-M366 HydrophobicContact CZ-SD 4.07Å; F362-M366 WeakPolarHBondContact O-CB 3.32Å; F362-M366 WeakPolarHBondContact O-CG 3.37Å; F362-M366 PolarHBondContact O-N 2.8Å; F362-I409 HydrophobicContact CE1-CD1 3.91Å; F362-I409 HydrophobicContact CE1-CG1 4.09Å; F362-I409 HydrophobicContact CE1-CG2 3.58Å; F362-I409 HydrophobicContact CZ-CD1 4.25Å; F362-I409 HydrophobicContact CZ-CG1 4.1Å; F362-I409 HydrophobicContact CZ-CG2 4Å; F362-L451 HydrophobicContact CB-CD2 4.13Å; F362-L451 HydrophobicContact CD1-CD1 4.18Å; F362-L451 HydrophobicContact CD1-CD2 3.56Å; F362-L451 HydrophobicContact CE1-CD1 4.36Å; F362-L451 HydrophobicContact CE1-CD2 4.32Å; F362-L451 HydrophobicContact CG-CD2 4.08Å
363T86.9Confident82.3Confident2 Ų265.8 Ų65.81%0.01232%0.318CS..Hα-helixtrans-61.6-41.5176-68.30000111.8W192 T196 A359 I360 L365 M366 A367W192-T363 HydrophobicContact CD2-CG2 3.83Å; W192-T363 HydrophobicContact CE3-CG2 4.3Å; W192-T363 HydrophobicContact CG-CG2 4.12Å; W192-T363 HydrophobicContact CZ2-CG2 4.23Å; T196-T363 HydrophobicContact CG2-CG2 4.29Å; T196-T363 WeakPolarHBondContact CG2-OG1 3.5Å; T196-T363 WeakPolarHBondContact OG1-CG2 3.36Å; T196-T363 PolarHBondContact OG1-OG1 2.88Å; A359-T363 PolarHBondContact O-N 3.04Å; A359-T363 PolarHBondContact O-OG1 3.46Å; I360-T363 PolarHBondContact O-N 2.94Å; T363-L365 VanDerWaalsContact C-N 3.33Å; T363-L365 PolarHBondContact O-N 3.48Å; T363-M366 PolarHBondContact O-N 2.97Å; T363-A367 VanDerWaalsContact O-CB 3.26Å; T363-A367 WeakPolarHBondContact O-CB 3.31Å; T363-A367 PolarHBondContact O-N 3.47Å
364L86.4Confident79.8Confident75 Ų7569.9 Ų69.939%0.39335%0.345SS..Hα-helixtrans-62.2-40.4177-70.2173.9000112.3T193 I360 I361 F362 R368T193-L364 HydrophobicContact CG2-CD2 4.22Å; I360-L364 HydrophobicContact CG2-CD1 3.99Å; I360-L364 HydrophobicContact CG2-CG 4.44Å; I360-L364 VanDerWaalsContact O-CG 3.29Å; I360-L364 WeakPolarHBondContact O-CG 3.49Å; I360-L364 PolarHBondContact O-N 2.97Å; I361-L364 PolarHBondContact O-N 3.4Å; F362-L364 VanDerWaalsContact C-N 3.34Å; F362-L364 PolarHBondContact O-N 3.43Å; L364-R368 WeakPolarHBondContact O-CG 3.2Å; L364-R368 PolarHBondContact O-N 2.88Å
365L87.1Confident76.9Confident93 Ų9371.8 Ų71.849%0.48736%0.364SS..Hα-helixtrans-65.2-45.9175-70.8173.5000111.4I361 F362 T363 R368 I369I361-L365 HydrophobicContact CG2-CD1 4.05Å; I361-L365 HydrophobicContact CG2-CG 4.46Å; I361-L365 WeakPolarHBondContact O-CG 3.12Å; I361-L365 PolarHBondContact O-N 3.25Å; F362-L365 PolarHBondContact O-N 2.85Å; T363-L365 VanDerWaalsContact C-N 3.33Å; T363-L365 PolarHBondContact O-N 3.48Å; L365-R368 WeakPolarHBondContact O-CB 3.44Å; L365-R368 PolarHBondContact O-N 3.31Å; L365-I369 WeakPolarHBondContact O-CG1 3.34Å; L365-I369 PolarHBondContact O-N 2.93Å; L365-I369 VanDerWaalsContact O-N 3.14Å
366M83.3Confident74.2Confident23 Ų2380.5 Ų80.511%0.11340%0.402CS..Hα-helixtrans-67.8-39.5-179.7-70.2-53.4-52.500112.8W192 F362 T363 R368 I369 I370 L405 I409W192-M366 HydrophobicContact CH2-CB 3.28Å; W192-M366 HydrophobicContact CH2-CG 3.91Å; W192-M366 HydrophobicContact CZ2-CB 4.38Å; W192-M366 HydrophobicContact CZ3-CB 3.56Å; F362-M366 HydrophobicContact CD1-CG 3.93Å; F362-M366 HydrophobicContact CE1-CG 3.48Å; F362-M366 VanDerWaalsContact CE1-CG 3.48Å; F362-M366 HydrophobicContact CE1-SD 4.41Å; F362-M366 HydrophobicContact CE2-CG 4.36Å; F362-M366 HydrophobicContact CZ-CG 3.73Å; F362-M366 HydrophobicContact CZ-SD 4.07Å; F362-M366 WeakPolarHBondContact O-CB 3.32Å; F362-M366 WeakPolarHBondContact O-CG 3.37Å; F362-M366 PolarHBondContact O-N 2.8Å; T363-M366 PolarHBondContact O-N 2.97Å; M366-R368 VanDerWaalsContact C-N 3.25Å; M366-R368 PolarHBondContact O-N 3.44Å; M366-I369 HydrophobicContact CE-CD1 4.49Å; M366-I369 PolarHBondContact O-N 3.13Å; M366-I369 HydrophobicContact SD-CD1 3.97Å; M366-I370 WeakPolarHBondContact O-CG1 3.26Å; M366-I370 PolarHBondContact O-N 2.82Å; M366-L405 HydrophobicContact CE-CD1 3.77Å; M366-L405 HydrophobicContact CE-CD2 3.61Å; M366-L405 HydrophobicContact CE-CG 3.95Å; M366-I409 HydrophobicContact CE-CD1 4.2Å; M366-I409 HydrophobicContact CG-CD1 4.3Å
367A76.6Confident71.2Confident12 Ų1284.6 Ų84.610%0.09943%0.43CS..Hα-helixtrans-58.6-39.1174.700000111.4T363 H371T363-A367 VanDerWaalsContact O-CB 3.26Å; T363-A367 WeakPolarHBondContact O-CB 3.31Å; T363-A367 PolarHBondContact O-N 3.47Å; A367-H371 PolarHBondContact O-CD2 3.31Å; A367-H371 PolarHBondContact O-N 3.34Å
368R79.6Confident68.3Low192 Ų19285.7 Ų85.773%0.72545%0.445SS*.Hα-helixtrans-66.3-36.2173.9-72.6178.2-179.8-177.41.5113.1L364 L365 M366L364-R368 WeakPolarHBondContact O-CG 3.2Å; L364-R368 PolarHBondContact O-N 2.88Å; L365-R368 WeakPolarHBondContact O-CB 3.44Å; L365-R368 PolarHBondContact O-N 3.31Å; M366-R368 VanDerWaalsContact C-N 3.25Å; M366-R368 PolarHBondContact O-N 3.44Å
369I75.5Confident65.5Low99 Ų9989.7 Ų89.751%0.50847%0.467SS..Hα-helixtrans-68.9-43.4179.3-67.8165.7000110.6L365 M366 H371 R372L365-I369 WeakPolarHBondContact O-CG1 3.34Å; L365-I369 PolarHBondContact O-N 2.93Å; L365-I369 VanDerWaalsContact O-N 3.14Å; M366-I369 HydrophobicContact CE-CD1 4.49Å; M366-I369 PolarHBondContact O-N 3.13Å; M366-I369 HydrophobicContact SD-CD1 3.97Å; I369-H371 VanDerWaalsContact C-N 3.3Å; I369-H371 PolarHBondContact O-N 2.97Å; I369-R372 PolarHBondContact O-N 2.91Å
370I69.1Low62.8Low35 Ų3593.9 Ų93.918%0.17950%0.496CS..Hα-helixtrans-64.8-35.7178.5-62.2168.5000111W192 M366 R372 L405W192-I370 HydrophobicContact CE3-CD1 4.27Å; W192-I370 HydrophobicContact CZ3-CD1 3.76Å; M366-I370 WeakPolarHBondContact O-CG1 3.26Å; M366-I370 PolarHBondContact O-N 2.82Å; I370-R372 PolarHBondContact O-N 2.94Å; I370-L405 HydrophobicContact CD1-CD2 3.7Å; I370-L405 HydrophobicContact CG1-CD2 3.6Å
371H61.4Low60.2Low88 Ų88100.1 Ų100.141%0.40753%0.528SS..THydrogen-bonded Turntrans-73.40.9-180-97-69.3000115.6N189 A367 I369 P373N189-H371 PolarHBondContact ND2-CD2 3.34Å; N189-H371 PolarHBondContact ND2-NE2 3.21Å; A367-H371 PolarHBondContact O-CD2 3.31Å; A367-H371 PolarHBondContact O-N 3.34Å; I369-H371 VanDerWaalsContact C-N 3.3Å; I369-H371 PolarHBondContact O-N 2.97Å; H371-P373 WeakPolarHBondContact O-CD 3.35Å
372R53.7Low57.6Low204 Ų204100 Ų10077%0.7754%0.541SS*.  trans-64.9109.3173.8-77.7-172175.2-174-0.8108.6I369 I370 V374I369-R372 PolarHBondContact O-N 2.91Å; I370-R372 PolarHBondContact O-N 2.94Å; R372-V374 PolarHBondContact O-N 2.78Å
373P45.1Very low55Low114 Ų114104.8 Ų104.874%0.7456%0.564SS**  trans-60.9128.8-178.525.9-31.9000107.4H371 S375H371-P373 WeakPolarHBondContact O-CD 3.35Å; P373-S375 PolarHBondContact O-N 3.47Å
374V42.3Very low52.5Low128 Ų128110.1 Ų110.178%0.77659%0.593SS**  trans-52.2112.3159.2177.70000104.5R372 K376R372-V374 PolarHBondContact O-N 2.78Å; V374-K376 PolarHBondContact O-N 3.19Å
375S32.2Very low50.3Low103 Ų103115 Ų11572%0.7262%0.618SS**  trans-48.3110.4-17952.30000108.1P373 S377P373-S375 PolarHBondContact O-N 3.47Å; S375-S377 VanDerWaalsContact C-N 3.32Å; S375-S377 PolarHBondContact O-N 3.44Å
376K35.9Very low48.1Very low183 Ų183119.2 Ų119.280%0.79663%0.632SS**  trans-62.7103.7164.5-75.2-174.3176.1-175.90105V374 S378V374-K376 PolarHBondContact O-N 3.19Å; K376-S378 PolarHBondContact O-N 2.96Å; K376-S378 VanDerWaalsContact O-N 3.14Å
377S29.1Very low46.3Very low87 Ų87123 Ų12361%0.60865%0.653SS**  trans-53.2118.6161.6500000106.4S375 D379S375-S377 VanDerWaalsContact C-N 3.32Å; S375-S377 PolarHBondContact O-N 3.44Å; S377-D379 PolarHBondContact O-N 3.45Å
378S32.7Very low45.1Very low102 Ų102127.6 Ų127.671%0.71368%0.68SS**THydrogen-bonded Turntrans-69.829.5-171.944.40000114.7K376K376-S378 PolarHBondContact O-N 2.96Å; K376-S378 VanDerWaalsContact O-N 3.14Å
379D33.7Very low43.8Very low150 Ų150123.7 Ų123.780%0.80267%0.673SS**THydrogen-bonded Turntrans-119.66.4-169.5-68.7-17.7000114.9S377S377-D379 PolarHBondContact O-N 3.45Å
380S34.2Very low42.6Very low90 Ų90123.6 Ų123.663%0.62967%0.671SS**  trans-118.720.7-176.666.70000116.3A382S380-A382 PolarHBondContact O-N 3.08Å; S380-A382 VanDerWaalsContact O-N 3.17Å
381I37.7Very low42Very low168 Ų168126.1 Ų126.186%0.86269%0.685SS**THydrogen-bonded Turntrans-71.4-6.1179.5-64.7174.7000112.7
382A37Very low41.7Very low92 Ų92126 Ų12676%0.7669%0.687SS**THydrogen-bonded Turntrans-104.94.2-174.500000116.2S380S380-A382 PolarHBondContact O-N 3.08Å; S380-A382 VanDerWaalsContact O-N 3.17Å
383Q36.4Very low42Very low161 Ų161120.6 Ų120.675%0.75267%0.669SS**SBendtrans-122.196.7179.2-83.9179-27.800112.9
384N34Very low42.8Very low114 Ų114120.3 Ų120.361%0.6166%0.658SS**  61.895.7129.3-56.6-22.4000117.3F386N384-F386 PolarHBondContact O-N 3.24Å
385I40.5Very low43.6Very low178 Ų178115 Ų11591%0.91363%0.625SS**THydrogen-bonded Turn23.51.7110.4-62.3172.8000120.1
386F39.3Very low45.1Very low180 Ų180115.2 Ų115.279%0.78962%0.618SS**THydrogen-bonded Turntrans-126.33.1-169.2-99.9-81.6000117.2N384N384-F386 PolarHBondContact O-N 3.24Å
387D46.6Very low46.5Very low103 Ų103112.2 Ų112.255%0.55161%0.605SS**  trans-118.155.3-169.8-104.1-11.8000115.5N389 H390 D391D387-N389 PolarHBondContact O-N 3.16Å; D387-N389 VanDerWaalsContact O-N 3.16Å; D387-H390 HydrophobicContact CB-CB 3.84Å; D387-H390 PolarHBondContact O-N 3.47Å; D387-D391 PolarHBondContact O-N 3.32Å
388T51.3Low48.4Very low108 Ų108110.3 Ų110.366%0.66359%0.59SS**Hα-helixtrans-56.5-27.7168.844.60000112.9N392T388-N392 PolarHBondContact O-N 2.82Å; T388-N392 PolarHBondContact O-ND2 2.88Å
389N51.4Low50Low111 Ų111108.7 Ų108.759%0.59457%0.57SS**Hα-helixtrans-72.4-30175.2-81.1-21.7000113.3D387 K393D387-N389 PolarHBondContact O-N 3.16Å; D387-N389 VanDerWaalsContact O-N 3.16Å; N389-K393 WeakPolarHBondContact O-CB 3.21Å; N389-K393 VanDerWaalsContact O-CG 3.25Å; N389-K393 WeakPolarHBondContact O-CG 3.47Å; N389-K393 PolarHBondContact O-N 2.98Å
390H51Low51.8Low97 Ų97102.4 Ų102.445%0.44954%0.537SS..Hα-helixtrans-76.4-39.5-179-159.6-74.8000111.4D387 K393 Q394D387-H390 HydrophobicContact CB-CB 3.84Å; D387-H390 PolarHBondContact O-N 3.47Å; H390-K393 PolarHBondContact O-N 3.3Å; H390-Q394 PolarHBondContact CE1-NE2 2.9Å; H390-Q394 VanDerWaalsContact CE1-NE2 3.33Å; H390-Q394 PolarHBondContact O-N 2.92Å
391D56.4Low53.8Low88 Ų88103.4 Ų103.447%0.47153%0.532SS..Hα-helixtrans-64.7-42.8175.9-74-19.8000112T181 D387 K393 Q394 L395T181-D391 HydrophobicContact CG2-CB 4.29Å; D387-D391 PolarHBondContact O-N 3.32Å; D391-K393 VanDerWaalsContact C-N 3.35Å; D391-K393 PolarHBondContact O-N 3.28Å; D391-Q394 PolarHBondContact O-N 3.45Å; D391-L395 VanDerWaalsContact O-CB 3.26Å; D391-L395 WeakPolarHBondContact O-CB 3.42Å; D391-L395 PolarHBondContact O-N 3.07Å
392N55.5Low55.7Low86 Ų8695.9 Ų95.946%0.4649%0.494SS..Hα-helixtrans-64.2-36.9175.6-76.3-26.8000112.6T388 N396T388-N392 PolarHBondContact O-N 2.82Å; T388-N392 PolarHBondContact O-ND2 2.88Å; N392-N396 PolarHBondContact O-N 3.24Å; N392-N396 PolarHBondContact O-ND2 3.45Å
393K59.2Low57.8Low89 Ų8991.8 Ų91.839%0.38746%0.46SS..Hα-helixtrans-67.2-45.2176.9-79.7175.2179.9-177.70112.1N389 H390 D391 L395 K397 N539N389-K393 WeakPolarHBondContact O-CB 3.21Å; N389-K393 VanDerWaalsContact O-CG 3.25Å; N389-K393 WeakPolarHBondContact O-CG 3.47Å; N389-K393 PolarHBondContact O-N 2.98Å; H390-K393 PolarHBondContact O-N 3.3Å; D391-K393 VanDerWaalsContact C-N 3.35Å; D391-K393 PolarHBondContact O-N 3.28Å; K393-L395 VanDerWaalsContact C-N 3.34Å; K393-K397 PolarHBondContact O-N 3.25Å; K393-K397 VanDerWaalsContact O-N 3.13Å; K393-N539 WeakPolarHBondContact CE-OD1 3.38Å; K393-N539 PolarHBondContact NZ-OD1 3.25Å
394Q61.8Low60.2Low109 Ų10985.2 Ų85.251%0.50943%0.43SS..Hα-helixtrans-63.6-41.4175.8-73.8-168.9-5.400111.7H390 D391 K397 V398H390-Q394 PolarHBondContact CE1-NE2 2.9Å; H390-Q394 VanDerWaalsContact CE1-NE2 3.33Å; H390-Q394 PolarHBondContact O-N 2.92Å; D391-Q394 PolarHBondContact O-N 3.45Å; Q394-K397 PolarHBondContact O-N 3.27Å; Q394-V398 VanDerWaalsContact O-CG2 3.28Å; Q394-V398 WeakPolarHBondContact O-CG2 3.24Å; Q394-V398 PolarHBondContact O-N 2.89Å
395L59.7Low62.7Low15 Ų1582.2 Ų82.28%0.07941%0.413CS..Hα-helixtrans-59.8-47.6177.6-177.359.3000112.5T181 Q184 D391 K393 K397 V398 K399T181-L395 HydrophobicContact CG2-CB 4.4Å; Q184-L395 HydrophobicContact CB-CD1 4.09Å; D391-L395 VanDerWaalsContact O-CB 3.26Å; D391-L395 WeakPolarHBondContact O-CB 3.42Å; D391-L395 PolarHBondContact O-N 3.07Å; K393-L395 VanDerWaalsContact C-N 3.34Å; L395-K397 VanDerWaalsContact C-N 3.33Å; L395-K397 PolarHBondContact O-N 3.48Å; L395-V398 PolarHBondContact O-N 3.21Å; L395-K399 WeakPolarHBondContact O-CB 3.17Å; L395-K399 PolarHBondContact O-N 3.14Å
396N63Low65Low108 Ų10874 Ų7458%0.57837%0.371SS*.Hα-helixtrans-63.7-38.2177.7-76.9-20.7000112.3N392 C400N392-N396 PolarHBondContact O-N 3.24Å; N392-N396 PolarHBondContact O-ND2 3.45Å; N396-C400 WeakPolarHBondContact O-CB 3.3Å; N396-C400 PolarHBondContact O-N 2.98Å
397K67Low67.4Low120 Ų12065.4 Ų65.452%0.52233%0.334SS..Hα-helixtrans-63.9-46.2176.6-171.7175.8-179176.80111.8K393 Q394 L395 C400 Q401K393-K397 PolarHBondContact O-N 3.25Å; K393-K397 VanDerWaalsContact O-N 3.13Å; Q394-K397 PolarHBondContact O-N 3.27Å; L395-K397 VanDerWaalsContact C-N 3.33Å; L395-K397 PolarHBondContact O-N 3.48Å; K397-C400 PolarHBondContact O-N 3.36Å; K397-Q401 WeakPolarHBondContact O-CG 3.29Å; K397-Q401 PolarHBondContact O-N 3.1Å
398V67.8Low69.5Low48 Ų4866 Ų6629%0.29133%0.331SS..Hα-helixtrans-67.9-41.2179.6177.40000111.3V185 Q394 L395 C400 Q401 S402V185-V398 HydrophobicContact CG1-CG1 4.33Å; V185-V398 HydrophobicContact CG2-CB 4.45Å; V185-V398 HydrophobicContact CG2-CG1 3.58Å; Q394-V398 VanDerWaalsContact O-CG2 3.28Å; Q394-V398 WeakPolarHBondContact O-CG2 3.24Å; Q394-V398 PolarHBondContact O-N 2.89Å; L395-V398 PolarHBondContact O-N 3.21Å; V398-C400 VanDerWaalsContact C-N 3.33Å; V398-C400 PolarHBondContact O-N 3.27Å; V398-Q401 PolarHBondContact O-N 3.4Å; V398-S402 PolarHBondContact O-N 3.48Å; V398-S402 PolarHBondContact O-OG 2.96Å
399K67.3Low71.5Confident68 Ų6861.4 Ų61.430%0.29630%0.303SS..Hα-helixtrans-58.9-45.7174.4-174.7175.3-177.6179.70110.9L395 S402 V403 M462L395-K399 WeakPolarHBondContact O-CB 3.17Å; L395-K399 PolarHBondContact O-N 3.14Å; K399-S402 PolarHBondContact O-N 3.44Å; K399-V403 WeakPolarHBondContact O-CG2 3.32Å; K399-V403 PolarHBondContact O-N 2.99Å; K399-M462 HydrophobicContact CG-CE 3.99Å; K399-M462 PolarHBondContact NZ-O 2.92Å
400C71.4Confident73.5Confident18 Ų1856.2 Ų56.212%0.12228%0.275CS..Hα-helixtrans-67.6-41.3178.9-168.90000112.8N396 K397 V398 S402 V403 N404 V532N396-C400 WeakPolarHBondContact O-CB 3.3Å; N396-C400 PolarHBondContact O-N 2.98Å; K397-C400 PolarHBondContact O-N 3.36Å; V398-C400 VanDerWaalsContact C-N 3.33Å; V398-C400 PolarHBondContact O-N 3.27Å; C400-S402 PolarHBondContact O-N 3.48Å; C400-V403 PolarHBondContact O-N 3.26Å; C400-N404 WeakPolarHBondContact O-CB 3.43Å; C400-N404 VanDerWaalsContact O-CG 3.3Å; C400-N404 PolarHBondContact O-N 3.11Å; C400-V532 HydrophobicContact CB-CG2 3.75Å; C400-V532 WeakPolarHBondContact SG-CG2 3.4Å
401Q75.7Confident75.6Confident111 Ų11153.9 Ų53.952%0.51927%0.265SS..Hα-helixtrans-56.9-40.8174.5-76.2177.4-14.800112K397 V398 N404 L405K397-Q401 WeakPolarHBondContact O-CG 3.29Å; K397-Q401 PolarHBondContact O-N 3.1Å; V398-Q401 PolarHBondContact O-N 3.4Å; Q401-N404 PolarHBondContact O-N 3.09Å; Q401-L405 WeakPolarHBondContact O-CB 3.22Å; Q401-L405 PolarHBondContact O-N 2.95Å
402S77.1Confident77.4Confident10 Ų1054.7 Ų54.77%0.0727%0.265CS..Hα-helixtrans-66.6-45.2177.7-550000111.9V398 K399 C400 N404 L405 L406V398-S402 PolarHBondContact O-N 3.48Å; V398-S402 PolarHBondContact O-OG 2.96Å; K399-S402 PolarHBondContact O-N 3.44Å; C400-S402 PolarHBondContact O-N 3.48Å; S402-N404 PolarHBondContact O-N 2.87Å; S402-L405 WeakPolarHBondContact O-CB 3.38Å; S402-L405 PolarHBondContact O-N 3.32Å; S402-L406 WeakPolarHBondContact O-CG 3.33Å; S402-L406 PolarHBondContact O-N 3.46Å
403V82.4Confident79.3Confident6 Ų650.6 Ų50.64%0.03624%0.243CC..Hα-helixtrans-60.1-45.7174.5170.90000111.3K399 C400 L405 L406 L407 L459 M462 W463 T528K399-V403 WeakPolarHBondContact O-CG2 3.32Å; K399-V403 PolarHBondContact O-N 2.99Å; C400-V403 PolarHBondContact O-N 3.26Å; V403-L405 VanDerWaalsContact C-N 3.3Å; V403-L405 PolarHBondContact O-N 3.46Å; V403-L406 PolarHBondContact O-N 2.84Å; V403-L407 HydrophobicContact CG1-CD1 3.88Å; V403-L407 HydrophobicContact CG1-CG 4.37Å; V403-L407 WeakPolarHBondContact O-CB 3.4Å; V403-L407 WeakPolarHBondContact O-CG 3.45Å; V403-L407 PolarHBondContact O-N 2.93Å; V403-L459 HydrophobicContact CG1-CD2 3.99Å; V403-M462 HydrophobicContact CG2-CE 3.41Å; V403-M462 VanDerWaalsContact CG2-CE 3.41Å; V403-M462 HydrophobicContact CG2-SD 4.22Å; V403-W463 HydrophobicContact CG1-CZ2 3.88Å; V403-T528 HydrophobicContact CG1-CG2 4.13Å
404N85Confident81Confident22 Ų2246.3 Ų46.312%0.11822%0.224CC..Hα-helixtrans-63.5-36.9179.5-76.3-15.9000112.2C400 Q401 S402 K408 Y525 T528 N529C400-N404 WeakPolarHBondContact O-CB 3.43Å; C400-N404 VanDerWaalsContact O-CG 3.3Å; C400-N404 PolarHBondContact O-N 3.11Å; Q401-N404 PolarHBondContact O-N 3.09Å; S402-N404 PolarHBondContact O-N 2.87Å; N404-K408 VanDerWaalsContact O-CG 3.31Å; N404-K408 WeakPolarHBondContact O-CG 3.29Å; N404-K408 PolarHBondContact O-N 3.25Å; N404-Y525 HydrophobicContact CB-CE2 4.09Å; N404-T528 PolarHBondContact OD1-OG1 3.34Å; N404-N529 VanDerWaalsContact CG-OD1 3.24Å; N404-N529 PolarHBondContact ND2-OD1 3.36Å; N404-N529 PolarHBondContact OD1-OD1 3.36Å
405L86.8Confident82.6Confident51 Ų5145.8 Ų45.827%0.26722%0.22SC..Hα-helixtrans-65.1-47.6174-178.465000111.4M366 I370 Q401 S402 V403 L407 K408 I409M366-L405 HydrophobicContact CE-CD1 3.77Å; M366-L405 HydrophobicContact CE-CD2 3.61Å; M366-L405 HydrophobicContact CE-CG 3.95Å; I370-L405 HydrophobicContact CD1-CD2 3.7Å; I370-L405 HydrophobicContact CG1-CD2 3.6Å; Q401-L405 WeakPolarHBondContact O-CB 3.22Å; Q401-L405 PolarHBondContact O-N 2.95Å; S402-L405 WeakPolarHBondContact O-CB 3.38Å; S402-L405 PolarHBondContact O-N 3.32Å; V403-L405 VanDerWaalsContact C-N 3.3Å; V403-L405 PolarHBondContact O-N 3.46Å; L405-L407 VanDerWaalsContact C-N 3.33Å; L405-L407 PolarHBondContact O-N 2.87Å; L405-K408 PolarHBondContact O-N 2.84Å; L405-I409 HydrophobicContact CD1-CD1 4.47Å; L405-I409 HydrophobicContact CG-CD1 4.15Å; L405-I409 WeakPolarHBondContact O-CD1 3.5Å; L405-I409 WeakPolarHBondContact O-CG1 3.35Å; L405-I409 PolarHBondContact O-N 3.39Å
406L88.3Confident84.3Confident6 Ų646.9 Ų46.93%0.03123%0.226CC..Hα-helixtrans-58.3-43.9176-72.6174000111.7W192 S402 V403 I409 L410 I455 T458 L459 M462W192-L406 HydrophobicContact CD2-CD2 3.86Å; W192-L406 HydrophobicContact CE3-CD2 4.1Å; W192-L406 HydrophobicContact CG-CD2 4.41Å; W192-L406 HydrophobicContact CH2-CD2 4.04Å; W192-L406 HydrophobicContact CZ2-CD2 3.85Å; W192-L406 HydrophobicContact CZ3-CD2 4.19Å; S402-L406 WeakPolarHBondContact O-CG 3.33Å; S402-L406 PolarHBondContact O-N 3.46Å; V403-L406 PolarHBondContact O-N 2.84Å; L406-I409 PolarHBondContact O-N 2.9Å; L406-L410 WeakPolarHBondContact O-CB 3.19Å; L406-L410 PolarHBondContact O-N 2.8Å; L406-I455 HydrophobicContact CB-CG2 4.06Å; L406-I455 HydrophobicContact CD2-CG1 4.28Å; L406-I455 HydrophobicContact CD2-CG2 4.35Å; L406-T458 HydrophobicContact CD1-CG2 3.81Å; L406-L459 HydrophobicContact CB-CD2 4.14Å; L406-L459 HydrophobicContact CD1-CD2 4.12Å; L406-M462 HydrophobicContact CD1-SD 4.08Å
407L91Very high85.8Confident0 Ų042 Ų420%020%0.199CC..Hα-helixtrans-64.7-39.2177-73172.6000112.5V403 L405 I409 L410 I411 L459 T521 L524 Y525 T528V403-L407 HydrophobicContact CG1-CD1 3.88Å; V403-L407 HydrophobicContact CG1-CG 4.37Å; V403-L407 WeakPolarHBondContact O-CB 3.4Å; V403-L407 WeakPolarHBondContact O-CG 3.45Å; V403-L407 PolarHBondContact O-N 2.93Å; L405-L407 VanDerWaalsContact C-N 3.33Å; L405-L407 PolarHBondContact O-N 2.87Å; L407-I409 VanDerWaalsContact C-N 3.35Å; L407-I409 PolarHBondContact O-N 3.42Å; L407-L410 HydrophobicContact CD2-CD2 4.43Å; L407-L410 PolarHBondContact O-N 3.23Å; L407-I411 VanDerWaalsContact O-CG1 3.27Å; L407-I411 WeakPolarHBondContact O-CG1 3.09Å; L407-I411 PolarHBondContact O-N 3.36Å; L407-L459 HydrophobicContact CD2-CD1 3.77Å; L407-L459 HydrophobicContact CG-CD1 4.4Å; L407-T521 HydrophobicContact CD2-CG2 4.47Å; L407-L524 HydrophobicContact CD1-CG 4.4Å; L407-L524 HydrophobicContact CD2-CD2 3.75Å; L407-L524 HydrophobicContact CD2-CG 4.09Å; L407-Y525 HydrophobicContact CB-CD2 3.96Å; L407-Y525 HydrophobicContact CD1-CD2 4.37Å; L407-T528 HydrophobicContact CD1-CG2 3.89Å
408K91.5Very high87.2Confident114 Ų11438.9 Ų38.950%0.49619%0.186SC..Hα-helixtrans-61.9-42.4174.1-76.2174.4-177.2-178.70112.1N404 L405 L410 I411 F412 Y525N404-K408 VanDerWaalsContact O-CG 3.31Å; N404-K408 WeakPolarHBondContact O-CG 3.29Å; N404-K408 PolarHBondContact O-N 3.25Å; L405-K408 PolarHBondContact O-N 2.84Å; K408-L410 VanDerWaalsContact C-N 3.34Å; K408-I411 PolarHBondContact O-N 3.32Å; K408-F412 PolarHBondContact O-N 3.04Å; K408-Y525 HydrophobicContact CD-CE2 4.46Å; K408-Y525 WeakPolarHBondContact CE-OH 3.44Å; K408-Y525 HydrophobicContact CG-CE2 3.95Å
409I91.9Very high88.5Confident13 Ų1339.2 Ų39.27%0.06719%0.185CC..Hα-helixtrans-65.4-41.5176.7-62.1159.1000110.2W192 F362 M366 L405 L406 L407 F412 S413 L451 I455W192-I409 HydrophobicContact CH2-CD1 3.99Å; W192-I409 HydrophobicContact CZ2-CD1 4.36Å; F362-I409 HydrophobicContact CE1-CD1 3.91Å; F362-I409 HydrophobicContact CE1-CG1 4.09Å; F362-I409 HydrophobicContact CE1-CG2 3.58Å; F362-I409 HydrophobicContact CZ-CD1 4.25Å; F362-I409 HydrophobicContact CZ-CG1 4.1Å; F362-I409 HydrophobicContact CZ-CG2 4Å; M366-I409 HydrophobicContact CE-CD1 4.2Å; M366-I409 HydrophobicContact CG-CD1 4.3Å; L405-I409 HydrophobicContact CD1-CD1 4.47Å; L405-I409 HydrophobicContact CG-CD1 4.15Å; L405-I409 WeakPolarHBondContact O-CD1 3.5Å; L405-I409 WeakPolarHBondContact O-CG1 3.35Å; L405-I409 PolarHBondContact O-N 3.39Å; L406-I409 PolarHBondContact O-N 2.9Å; L407-I409 VanDerWaalsContact C-N 3.35Å; L407-I409 PolarHBondContact O-N 3.42Å; I409-F412 WeakPolarHBondContact O-CB 3.48Å; I409-F412 PolarHBondContact O-N 3.18Å; I409-S413 PolarHBondContact O-N 2.75Å; I409-S413 PolarHBondContact O-OG 3.34Å; I409-L451 HydrophobicContact CG2-CD1 4.16Å; I409-I455 HydrophobicContact CB-CD1 3.94Å; I409-I455 HydrophobicContact CG2-CD1 3.4Å; I409-I455 VanDerWaalsContact CG2-CD1 3.4Å
410L93.4Very high89.9Confident1 Ų136.1 Ų36.11%0.00517%0.172CC..Hα-helixtrans-62-42.7176.2-174.263.7000112L406 L407 K408 F412 S413 I414 N452 I455 L456 L459 T521L406-L410 WeakPolarHBondContact O-CB 3.19Å; L406-L410 PolarHBondContact O-N 2.8Å; L407-L410 HydrophobicContact CD2-CD2 4.43Å; L407-L410 PolarHBondContact O-N 3.23Å; K408-L410 VanDerWaalsContact C-N 3.34Å; L410-F412 VanDerWaalsContact C-N 3.31Å; L410-F412 PolarHBondContact O-N 3.25Å; L410-S413 WeakPolarHBondContact CA-OG 3.38Å; L410-S413 PolarHBondContact O-N 3.37Å; L410-S413 PolarHBondContact O-OG 3.45Å; L410-I414 HydrophobicContact CD1-CD1 4.08Å; L410-I414 HydrophobicContact CD1-CG1 4.29Å; L410-I414 HydrophobicContact CG-CD1 3.85Å; L410-I414 HydrophobicContact CG-CG1 4.42Å; L410-I414 WeakPolarHBondContact O-CB 3.4Å; L410-I414 WeakPolarHBondContact O-CG1 3.43Å; L410-I414 PolarHBondContact O-N 3.47Å; L410-N452 HydrophobicContact CD1-CB 4.46Å; L410-I455 HydrophobicContact CB-CG2 4.04Å; L410-I455 HydrophobicContact CD1-CG2 4.4Å; L410-L456 HydrophobicContact CD1-CD2 4.44Å; L410-L456 HydrophobicContact CD1-CG 4.22Å; L410-L456 HydrophobicContact CD2-CD2 3.85Å; L410-L456 HydrophobicContact CD2-CG 4.44Å; L410-L459 HydrophobicContact CD2-CD1 4.31Å; L410-T521 HydrophobicContact CD2-CG2 3.81Å; L410-T521 HydrophobicContact CG-CG2 4.09Å
411I95.1Very high91Very high48 Ų4835.3 Ų35.325%0.24617%0.166CC..Hα-helixtrans-59.7-45174.6-71.1166.7000110.2L407 K408 F415 L518 T521 Y525L407-I411 VanDerWaalsContact O-CG1 3.27Å; L407-I411 WeakPolarHBondContact O-CG1 3.09Å; L407-I411 PolarHBondContact O-N 3.36Å; K408-I411 PolarHBondContact O-N 3.32Å; I411-F415 VanDerWaalsContact O-CB 3.29Å; I411-F415 WeakPolarHBondContact O-CB 3.31Å; I411-F415 PolarHBondContact O-N 3.12Å; I411-L518 HydrophobicContact CG2-CD1 3.92Å; I411-L518 WeakPolarHBondContact O-CD1 3.29Å; I411-T521 HydrophobicContact CD1-CG2 4.47Å; I411-T521 HydrophobicContact CG1-CG2 3.66Å; I411-Y525 HydrophobicContact CD1-CG 4.36Å
412F94.8Very high91.9Very high105 Ų10531.7 Ų31.746%0.46115%0.152SC..Hα-helixtrans-61-46.4177172.4-99.8000112.2K408 I409 L410 F415 M416K408-F412 PolarHBondContact O-N 3.04Å; I409-F412 WeakPolarHBondContact O-CB 3.48Å; I409-F412 PolarHBondContact O-N 3.18Å; L410-F412 VanDerWaalsContact C-N 3.31Å; L410-F412 PolarHBondContact O-N 3.25Å; F412-F415 PolarHBondContact O-N 2.95Å; F412-M416 HydrophobicContact CD1-CG 4.47Å; F412-M416 HydrophobicContact CD2-CG 4.44Å; F412-M416 HydrophobicContact CE1-CG 4.04Å; F412-M416 HydrophobicContact CE2-CG 4.01Å; F412-M416 HydrophobicContact CE2-SD 4.3Å; F412-M416 HydrophobicContact CZ-CE 4.29Å; F412-M416 HydrophobicContact CZ-CG 3.8Å; F412-M416 HydrophobicContact CZ-SD 4.23Å; F412-M416 WeakPolarHBondContact O-CG 3.47Å; F412-M416 PolarHBondContact O-N 3Å
413S94.2Very high92.8Very high0 Ų033 Ų330%016%0.158CC..Hα-helixtrans-68.2-38.5-179.556.20000113I409 L410 F415 M416 M417 A448 N452I409-S413 PolarHBondContact O-N 2.75Å; I409-S413 PolarHBondContact O-OG 3.34Å; L410-S413 WeakPolarHBondContact CA-OG 3.38Å; L410-S413 PolarHBondContact O-N 3.37Å; L410-S413 PolarHBondContact O-OG 3.45Å; S413-F415 VanDerWaalsContact C-N 3.34Å; S413-M416 PolarHBondContact O-N 2.94Å; S413-M417 PolarHBondContact O-N 2.94Å; S413-A448 WeakPolarHBondContact CB-O 3.18Å; S413-N452 VanDerWaalsContact CB-OD1 3.24Å; S413-N452 WeakPolarHBondContact CB-OD1 3.48Å; S413-N452 PolarHBondContact OG-OD1 3.48Å
414I95.6Very high93.3Very high0 Ų032.7 Ų32.70%016%0.156CC..Hα-helixtrans-64.4-40.7173.7-66.4174.9000110.5I313 L317 L410 M417 F418 I514 L518 T521I313-I414 HydrophobicContact CG2-CD1 4.39Å; L317-I414 HydrophobicContact CD1-CD1 4.19Å; L317-I414 HydrophobicContact CD1-CG1 4.35Å; L317-I414 HydrophobicContact CD2-CD1 4.49Å; L317-I414 HydrophobicContact CD2-CG1 4.14Å; L410-I414 HydrophobicContact CD1-CD1 4.08Å; L410-I414 HydrophobicContact CD1-CG1 4.29Å; L410-I414 HydrophobicContact CG-CD1 3.85Å; L410-I414 HydrophobicContact CG-CG1 4.42Å; L410-I414 WeakPolarHBondContact O-CB 3.4Å; L410-I414 WeakPolarHBondContact O-CG1 3.43Å; L410-I414 PolarHBondContact O-N 3.47Å; I414-M417 WeakPolarHBondContact O-CB 3.25Å; I414-M417 PolarHBondContact O-N 3.03Å; I414-F418 PolarHBondContact O-N 3.05Å; I414-I514 HydrophobicContact CG2-CG2 3.66Å; I414-I514 WeakPolarHBondContact O-CG2 3.45Å; I414-L518 HydrophobicContact CB-CD1 4.14Å; I414-L518 HydrophobicContact CG2-CB 3.93Å; I414-L518 HydrophobicContact CG2-CD1 3.9Å; I414-T521 HydrophobicContact CD1-CG2 4.36Å; I414-T521 WeakPolarHBondContact CD1-OG1 3.14Å
415F96.3Very high93.7Very high97 Ų9731.6 Ų31.643%0.42515%0.15SC..Hα-helixtrans-63.9-41.7175.6179.5-106.2000112.4I411 F412 S413 M417 F418 I419 L518I411-F415 VanDerWaalsContact O-CB 3.29Å; I411-F415 WeakPolarHBondContact O-CB 3.31Å; I411-F415 PolarHBondContact O-N 3.12Å; F412-F415 PolarHBondContact O-N 2.95Å; S413-F415 VanDerWaalsContact C-N 3.34Å; F415-M417 VanDerWaalsContact C-N 3.31Å; F415-M417 PolarHBondContact O-N 3.27Å; F415-F418 VanDerWaalsContact O-CB 3.32Å; F415-F418 WeakPolarHBondContact O-CB 3.41Å; F415-F418 PolarHBondContact O-N 2.71Å; F415-F418 VanDerWaalsContact O-N 3.12Å; F415-I419 HydrophobicContact CD1-CD1 4.03Å; F415-I419 HydrophobicContact CE1-CD1 3.51Å; F415-I419 HydrophobicContact CE1-CG1 4.33Å; F415-I419 HydrophobicContact CZ-CD1 3.89Å; F415-I419 HydrophobicContact CZ-CG1 4.35Å; F415-I419 PolarHBondContact O-N 2.81Å; F415-I419 VanDerWaalsContact O-N 3.08Å; F415-L518 HydrophobicContact CB-CD1 4.29Å; F415-L518 HydrophobicContact CD2-CD2 4.18Å
416M95.4Very high94Very high39 Ų3932.7 Ų32.719%0.19216%0.156CC..Hα-helixtrans-62.5-38.6174-70.5-65.6-90.800111.7F412 S413 F418 I419 N420 P445 A448F412-M416 HydrophobicContact CD1-CG 4.47Å; F412-M416 HydrophobicContact CD2-CG 4.44Å; F412-M416 HydrophobicContact CE1-CG 4.04Å; F412-M416 HydrophobicContact CE2-CG 4.01Å; F412-M416 HydrophobicContact CE2-SD 4.3Å; F412-M416 HydrophobicContact CZ-CE 4.29Å; F412-M416 HydrophobicContact CZ-CG 3.8Å; F412-M416 HydrophobicContact CZ-SD 4.23Å; F412-M416 WeakPolarHBondContact O-CG 3.47Å; F412-M416 PolarHBondContact O-N 3Å; S413-M416 PolarHBondContact O-N 2.94Å; M416-F418 VanDerWaalsContact C-N 3.35Å; M416-F418 PolarHBondContact O-N 3.29Å; M416-I419 PolarHBondContact O-N 3.43Å; M416-I419 HydrophobicContact SD-CD1 4.35Å; M416-N420 PolarHBondContact O-N 2.88Å; M416-P445 HydrophobicContact CB-CB 4.18Å; M416-P445 HydrophobicContact CE-CB 4.11Å; M416-P445 WeakPolarHBondContact O-CB 3.24Å; M416-P445 HydrophobicContact SD-CB 4.29Å; M416-A448 HydrophobicContact CB-CB 3.58Å; M416-A448 HydrophobicContact CG-CB 4Å
417M93.8Very high94.2Very high4 Ų432.4 Ų32.42%0.0215%0.154CC..Hα-helixtrans-63.4-37.6171.6-77.3-172.960.500113.1V320 T321 S413 I414 F415 I419 N420 R421 K449 N452 I514V320-M417 HydrophobicContact CG1-CE 4.34Å; T321-M417 HydrophobicContact CG2-CE 3.64Å; T321-M417 HydrophobicContact CG2-SD 4.4Å; S413-M417 PolarHBondContact O-N 2.94Å; I414-M417 WeakPolarHBondContact O-CB 3.25Å; I414-M417 PolarHBondContact O-N 3.03Å; F415-M417 VanDerWaalsContact C-N 3.31Å; F415-M417 PolarHBondContact O-N 3.27Å; M417-I419 VanDerWaalsContact C-N 3.32Å; M417-I419 PolarHBondContact O-N 2.92Å; M417-N420 PolarHBondContact O-N 3.45Å; M417-R421 PolarHBondContact O-N 2.7Å; M417-K449 HydrophobicContact CG-CB 4.37Å; M417-K449 HydrophobicContact SD-CB 4.27Å; M417-K449 HydrophobicContact SD-CG 4.17Å; M417-N452 PolarHBondContact SD-ND2 2.74Å; M417-I514 HydrophobicContact CB-CD1 4.02Å; M417-I514 HydrophobicContact CE-CD1 4.38Å
418F96.2Very high94.1Very high56 Ų5634.2 Ų34.225%0.24616%0.163CC..Hα-helixtrans-59.7-44.5175173.5-98.2000111.2I414 F415 M416 R421 T422 S511 I514 L515I414-F418 PolarHBondContact O-N 3.05Å; F415-F418 VanDerWaalsContact O-CB 3.32Å; F415-F418 WeakPolarHBondContact O-CB 3.41Å; F415-F418 PolarHBondContact O-N 2.71Å; F415-F418 VanDerWaalsContact O-N 3.12Å; M416-F418 VanDerWaalsContact C-N 3.35Å; M416-F418 PolarHBondContact O-N 3.29Å; F418-R421 PolarHBondContact O-N 2.88Å; F418-T422 WeakPolarHBondContact O-CB 3.22Å; F418-T422 PolarHBondContact O-N 3Å; F418-T422 PolarHBondContact O-OG1 3.22Å; F418-S511 WeakPolarHBondContact CD2-O 3.23Å; F418-S511 WeakPolarHBondContact CE2-O 3.46Å; F418-I514 HydrophobicContact CB-CB 4.47Å; F418-I514 HydrophobicContact CB-CG2 3.69Å; F418-I514 HydrophobicContact CD2-CG2 4.48Å; F418-L515 HydrophobicContact CD2-CB 4.4Å; F418-L515 HydrophobicContact CE2-CB 4.21Å
419I96.4Very high94.1Very high54 Ų5434.1 Ų34.128%0.27717%0.167SC..Hα-helixtrans-61.6-49175.3-63.8172.1000110.2F415 M416 M417 R421 T422 I423 P445F415-I419 HydrophobicContact CD1-CD1 4.03Å; F415-I419 HydrophobicContact CE1-CD1 3.51Å; F415-I419 HydrophobicContact CE1-CG1 4.33Å; F415-I419 HydrophobicContact CZ-CD1 3.89Å; F415-I419 HydrophobicContact CZ-CG1 4.35Å; F415-I419 PolarHBondContact O-N 2.81Å; F415-I419 VanDerWaalsContact O-N 3.08Å; M416-I419 PolarHBondContact O-N 3.43Å; M416-I419 HydrophobicContact SD-CD1 4.35Å; M417-I419 VanDerWaalsContact C-N 3.32Å; M417-I419 PolarHBondContact O-N 2.92Å; I419-R421 PolarHBondContact O-N 3.44Å; I419-T422 PolarHBondContact O-N 3.44Å; I419-I423 HydrophobicContact CG2-CD1 3.63Å; I419-I423 HydrophobicContact CG2-CG1 4.25Å; I419-I423 WeakPolarHBondContact O-CG1 3.43Å; I419-I423 PolarHBondContact O-N 3.38Å; I419-P445 HydrophobicContact CB-CB 4.28Å; I419-P445 HydrophobicContact CB-CG 4.29Å; I419-P445 HydrophobicContact CG2-CB 4.32Å; I419-P445 HydrophobicContact CG2-CG 3.79Å
420N94.7Very high94.1Very high3 Ų338.1 Ų38.12%0.01618%0.184CC..Hα-helixtrans-52.7-52.4177.9164.9-97.2000112.1M416 M417 T422 I423 L424 A442 P445M416-N420 PolarHBondContact O-N 2.88Å; M417-N420 PolarHBondContact O-N 3.45Å; N420-T422 VanDerWaalsContact C-N 3.32Å; N420-T422 PolarHBondContact O-N 3.47Å; N420-I423 PolarHBondContact O-N 3.25Å; N420-L424 WeakPolarHBondContact O-CG 3.24Å; N420-L424 PolarHBondContact O-N 3.45Å; N420-A442 PolarHBondContact ND2-O 2.65Å; N420-P445 HydrophobicContact CB-CB 4.12Å
421R94.7Very high93.9Very high1 Ų144.4 Ų44.40%0.00422%0.218CC..Hα-helixtrans-66.3-35.3-177.7-68.2-55-171.9-151.7-7.8112.8V320 T323 D324 M417 F418 I419 L424 G425 F507 C510 S511 I514V320-R421 HydrophobicContact CG1-CG 4.1Å; V320-R421 PolarHBondContact O-NH2 3.3Å; T323-R421 PolarHBondContact OG1-NH2 3.23Å; D324-R421 IonicContact OD1-CZ 3.34Å; D324-R421 IonicContact OD1-NH1 3.92Å; D324-R421 PolarHBondContact OD1-NH1 3.23Å; D324-R421 IonicContact OD1-NH2 2.89Å; D324-R421 PolarHBondContact OD1-NH2 3.05Å; D324-R421 IonicContact OD2-NH2 3.16Å; D324-R421 PolarHBondContact OD2-NH2 2.99Å; M417-R421 PolarHBondContact O-N 2.7Å; F418-R421 PolarHBondContact O-N 2.88Å; I419-R421 PolarHBondContact O-N 3.44Å; R421-L424 PolarHBondContact O-N 2.69Å; R421-G425 PolarHBondContact O-N 2.88Å; R421-F507 WeakPolarHBondContact O-CB 3.35Å; R421-C510 HydrophobicContact CG-CB 4.33Å; R421-S511 VanDerWaalsContact C-OG 3.31Å; R421-S511 VanDerWaalsContact CB-OG 3.28Å; R421-S511 WeakPolarHBondContact CB-OG 3.44Å; R421-I514 HydrophobicContact CB-CD1 4.1Å; R421-I514 HydrophobicContact CG-CD1 3.49Å; R421-I514 VanDerWaalsContact CG-CD1 3.49Å
422T95.5Very high93.5Very high35 Ų3544.6 Ų44.622%0.21522%0.221CC..Hα-helixtrans-67.5-44177.4-55.50000111F418 I419 N420 G425 L426 S511F418-T422 WeakPolarHBondContact O-CB 3.22Å; F418-T422 PolarHBondContact O-N 3Å; F418-T422 PolarHBondContact O-OG1 3.22Å; I419-T422 PolarHBondContact O-N 3.44Å; N420-T422 VanDerWaalsContact C-N 3.32Å; N420-T422 PolarHBondContact O-N 3.47Å; T422-G425 PolarHBondContact O-N 3.1Å; T422-L426 HydrophobicContact CG2-CD1 4.07Å; T422-L426 VanDerWaalsContact O-CG 3.31Å; T422-L426 WeakPolarHBondContact O-CG 3.3Å; T422-L426 PolarHBondContact O-N 3.41Å; T422-S511 WeakPolarHBondContact CA-OG 3.39Å; T422-S511 PolarHBondContact N-OG 3.41Å; T422-S511 VanDerWaalsContact N-OG 3.1Å; T422-S511 PolarHBondContact OG1-OG 3.18Å
423I95.7Very high93.3Very high37 Ų3748.5 Ų48.519%0.1923%0.234CC..Hα-helixtrans-62.9-45.4175.7-62.7169.9000110.5I419 N420 G425 L426 S427 L438 I441 A442I419-I423 HydrophobicContact CG2-CD1 3.63Å; I419-I423 HydrophobicContact CG2-CG1 4.25Å; I419-I423 WeakPolarHBondContact O-CG1 3.43Å; I419-I423 PolarHBondContact O-N 3.38Å; N420-I423 PolarHBondContact O-N 3.25Å; I423-G425 PolarHBondContact O-N 3.19Å; I423-L426 PolarHBondContact O-N 3.48Å; I423-S427 WeakPolarHBondContact O-CB 3.31Å; I423-S427 PolarHBondContact O-N 3.47Å; I423-L438 HydrophobicContact CG2-CB 4.13Å; I423-L438 HydrophobicContact CG2-CD2 4.28Å; I423-L438 WeakPolarHBondContact CG2-O 3.39Å; I423-I441 HydrophobicContact CD1-CG2 4.36Å; I423-A442 HydrophobicContact CB-CB 3.99Å; I423-A442 HydrophobicContact CG2-CB 3.77Å
424L93.1Very high93.2Very high0 Ų051.1 Ų51.10%025%0.25CS..Hα-helixtrans-59-46.4176.4-73.5174.4000111.5I328 Y331 N420 R421 L426 S427 V439 A442 F507I328-L424 HydrophobicContact CD1-CD1 4.08Å; Y331-L424 PolarHBondContact OH-O 2.84Å; N420-L424 WeakPolarHBondContact O-CG 3.24Å; N420-L424 PolarHBondContact O-N 3.45Å; R421-L424 PolarHBondContact O-N 2.69Å; L424-L426 VanDerWaalsContact C-N 3.3Å; L424-L426 PolarHBondContact O-N 2.64Å; L424-S427 PolarHBondContact O-N 3.34Å; L424-S427 PolarHBondContact O-OG 3.37Å; L424-V439 HydrophobicContact CD2-CG1 4.39Å; L424-V439 HydrophobicContact CD2-CG2 4.13Å; L424-A442 HydrophobicContact CD2-CB 4.08Å; L424-A442 HydrophobicContact CG-CB 4.05Å; L424-F507 HydrophobicContact CB-CB 4.42Å; L424-F507 HydrophobicContact CB-CD1 4.32Å; L424-F507 HydrophobicContact CB-CD2 4.28Å; L424-F507 HydrophobicContact CB-CG 4.08Å; L424-F507 HydrophobicContact CD1-CD1 4.45Å; L424-F507 HydrophobicContact CD1-CE1 4.38Å
425G93.1Very high93Very high0 Ų051.1 Ų51.10%025%0.25CS..Hα-helixtrans-59.6-38.3177.600000113.5R421 T422 I423 F502 G504R421-G425 PolarHBondContact O-N 2.88Å; T422-G425 PolarHBondContact O-N 3.1Å; I423-G425 PolarHBondContact O-N 3.19Å; G425-F502 WeakPolarHBondContact O-CZ 3.44Å; G425-G504 WeakPolarHBondContact CA-O 3.39Å
426L94.1Very high92.8Very high73 Ų7348 Ų4838%0.38224%0.238SC..Hα-helixtrans-82.2-21.2-179.9-65.3174.2000113.7T422 I423 L424 H428 L429 F430T422-L426 HydrophobicContact CG2-CD1 4.07Å; T422-L426 VanDerWaalsContact O-CG 3.31Å; T422-L426 WeakPolarHBondContact O-CG 3.3Å; T422-L426 PolarHBondContact O-N 3.41Å; I423-L426 PolarHBondContact O-N 3.48Å; L424-L426 VanDerWaalsContact C-N 3.3Å; L424-L426 PolarHBondContact O-N 2.64Å; L426-H428 PolarHBondContact O-N 3.45Å; L426-L429 HydrophobicContact CD2-CD1 4.01Å; L426-L429 WeakPolarHBondContact O-CB 3.44Å; L426-L429 PolarHBondContact O-N 2.71Å; L426-F430 WeakPolarHBondContact O-CD2 3.17Å
427S92.9Very high92.7Very high0 Ų048.8 Ų48.80%025%0.245CC..Hα-helixtrans-60.5-30.5-171.563.60000114.2Y331 F337 I423 L424 L429 F430 A435Y331-S427 PolarHBondContact OH-OG 3.21Å; F337-S427 VanDerWaalsContact CZ-OG 3.28Å; F337-S427 WeakPolarHBondContact CZ-OG 3.45Å; I423-S427 WeakPolarHBondContact O-CB 3.31Å; I423-S427 PolarHBondContact O-N 3.47Å; L424-S427 PolarHBondContact O-N 3.34Å; L424-S427 PolarHBondContact O-OG 3.37Å; S427-L429 PolarHBondContact O-N 2.93Å; S427-F430 PolarHBondContact O-N 3.29Å; S427-A435 VanDerWaalsContact O-CB 3.23Å; S427-A435 WeakPolarHBondContact O-CB 3.29Å
428H88.6Confident92.7Very high38 Ų3850.4 Ų50.418%0.17625%0.254CS..THydrogen-bonded Turntrans-64-22.7176.8178.278.3000114.1Y331 Y335 L426 F430 P503Y331-H428 HydrophobicContact CE2-CB 4.47Å; Y331-H428 WeakPolarHBondContact OH-CB 3.38Å; Y331-H428 PolarHBondContact OH-N 3.47Å; Y335-H428 PolarHBondContact O-CE1 3.1Å; Y335-H428 VanDerWaalsContact O-CE1 3.3Å; Y335-H428 PolarHBondContact O-ND1 3.35Å; L426-H428 PolarHBondContact O-N 3.45Å; H428-F430 PolarHBondContact O-N 2.81Å; H428-P503 WeakPolarHBondContact CE1-CG 3.34Å; H428-P503 WeakPolarHBondContact ND1-CG 3.44Å; H428-P503 WeakPolarHBondContact NE2-CD 3.17Å; H428-P503 WeakPolarHBondContact NE2-CG 3.49Å
429L90.7Very high92.6Very high112 Ų11247.7 Ų47.759%0.58624%0.242SC*.THydrogen-bonded Turntrans-72.4-9.8-177.7-65.8173.7000113.8L426 S427 F502L426-L429 HydrophobicContact CD2-CD1 4.01Å; L426-L429 WeakPolarHBondContact O-CB 3.44Å; L426-L429 PolarHBondContact O-N 2.71Å; S427-L429 PolarHBondContact O-N 2.93Å; L429-F502 HydrophobicContact CD1-CE2 4.33Å; L429-F502 HydrophobicContact CD2-CD2 4.21Å; L429-F502 HydrophobicContact CD2-CE2 3.56Å; L429-F502 HydrophobicContact CG-CE2 3.82Å; L429-F502 HydrophobicContact CG-CZ 4.42Å
430F91.2Very high92.4Very high98 Ų9851.8 Ų51.843%0.4326%0.255SS..SBendtrans-108.6163.6-174.9-58.8-88.3000111.7L426 S427 H428 T434 L438L426-F430 WeakPolarHBondContact O-CD2 3.17Å; S427-F430 PolarHBondContact O-N 3.29Å; H428-F430 PolarHBondContact O-N 2.81Å; F430-T434 HydrophobicContact CB-CG2 3.68Å; F430-T434 HydrophobicContact CD1-CG2 3.88Å; F430-T434 HydrophobicContact CG-CG2 3.86Å; F430-L438 HydrophobicContact CB-CD1 4.45Å; F430-L438 HydrophobicContact CD2-CD1 3.23Å; F430-L438 HydrophobicContact CE2-CD1 3.48Å; F430-L438 VanDerWaalsContact CE2-CD1 3.48Å; F430-L438 HydrophobicContact CG-CD1 3.89Å; F430-L438 HydrophobicContact CZ-CD1 4.3Å
431D89.5Confident92.4Very high132 Ų13255.4 Ų55.471%0.70627%0.273SS*.  trans-58.5152.8173.3-59.2-39.4000111.6Y433 T434 A435D431-Y433 VanDerWaalsContact C-N 3.27Å; D431-Y433 PolarHBondContact O-N 3.12Å; D431-T434 CarbonylContact O-C 3.56Å; D431-T434 WeakPolarHBondContact O-CA 3.35Å; D431-T434 PolarHBondContact O-N 3.36Å; D431-A435 WeakPolarHBondContact O-CB 3.46Å; D431-A435 PolarHBondContact O-N 3.12Å
432T87.9Confident92.3Very high53 Ų5355.4 Ų55.433%0.32527%0.273SS..Hα-helixtrans-46.7-43.9-174.5-62.20000114.5S336 N436S336-T432 WeakPolarHBondContact O-CA 3.47Å; S336-T432 VanDerWaalsContact O-CB 3.29Å; S336-T432 WeakPolarHBondContact O-CB 3.38Å; S336-T432 WeakPolarHBondContact O-CG2 3.32Å; S336-T432 PolarHBondContact O-OG1 2.85Å; T432-N436 WeakPolarHBondContact O-CB 3.3Å; T432-N436 PolarHBondContact O-N 3Å; T432-N436 PolarHBondContact O-ND2 3.12Å
433Y90.1Very high92.2Very high187 Ų18754.3 Ų54.373%0.73327%0.267SS*.Hα-helixtrans-63.5-47.4178.5-179.8-97.9000112D431 T437D431-Y433 VanDerWaalsContact C-N 3.27Å; D431-Y433 PolarHBondContact O-N 3.12Å; Y433-T437 WeakPolarHBondContact O-CB 3.39Å; Y433-T437 PolarHBondContact O-N 3.04Å; Y433-T437 PolarHBondContact O-OG1 3.04Å
434T92.5Very high92Very high55 Ų5557.7 Ų57.734%0.33728%0.284SS..Hα-helixtrans-69-40.6179.1-54.60000111F430 D431 T437 L438F430-T434 HydrophobicContact CB-CG2 3.68Å; F430-T434 HydrophobicContact CD1-CG2 3.88Å; F430-T434 HydrophobicContact CG-CG2 3.86Å; D431-T434 CarbonylContact O-C 3.56Å; D431-T434 WeakPolarHBondContact O-CA 3.35Å; D431-T434 PolarHBondContact O-N 3.36Å; T434-T437 PolarHBondContact O-N 3.34Å; T434-L438 HydrophobicContact CG2-CD1 4.28Å; T434-L438 VanDerWaalsContact O-CG 3.31Å; T434-L438 WeakPolarHBondContact O-CG 3.48Å; T434-L438 PolarHBondContact O-N 3.34Å
435A91.1Very high92Very high0 Ų058.3 Ų58.30%029%0.288CS..Hα-helixtrans-59.8-49.2176.700000111.4F337 S427 D431 T437 L438 V439F337-A435 HydrophobicContact CD1-CB 4.06Å; F337-A435 HydrophobicContact CE1-CB 3.65Å; F337-A435 HydrophobicContact CZ-CB 4.37Å; S427-A435 VanDerWaalsContact O-CB 3.23Å; S427-A435 WeakPolarHBondContact O-CB 3.29Å; D431-A435 WeakPolarHBondContact O-CB 3.46Å; D431-A435 PolarHBondContact O-N 3.12Å; A435-T437 VanDerWaalsContact C-N 3.34Å; A435-T437 PolarHBondContact O-N 3.44Å; A435-L438 PolarHBondContact O-N 3.32Å; A435-V439 WeakPolarHBondContact O-CG2 3.39Å; A435-V439 PolarHBondContact O-N 3.48Å
436N92.4Very high91.9Very high32 Ų3258.4 Ų58.417%0.17129%0.288CS..Hα-helixtrans-61.3-42.6175.4-77.2-30.9000111.8F337 W339 T432 L438 V439 Y440F337-N436 WeakPolarHBondContact CD1-OD1 3.48Å; W339-N436 PolarHBondContact NE1-OD1 3.05Å; T432-N436 WeakPolarHBondContact O-CB 3.3Å; T432-N436 PolarHBondContact O-N 3Å; T432-N436 PolarHBondContact O-ND2 3.12Å; N436-L438 VanDerWaalsContact C-N 3.31Å; N436-L438 PolarHBondContact O-N 3.01Å; N436-V439 PolarHBondContact O-N 3.41Å; N436-Y440 WeakPolarHBondContact O-CD2 3.32Å; N436-Y440 PolarHBondContact O-N 3.08Å
437T92.9Very high91.8Very high55 Ų5556.7 Ų56.734%0.33728%0.278SS..Hα-helixtrans-60.5-41.8176-56.90000111.4Y433 T434 A435 V439 Y440 I441Y433-T437 WeakPolarHBondContact O-CB 3.39Å; Y433-T437 PolarHBondContact O-N 3.04Å; Y433-T437 PolarHBondContact O-OG1 3.04Å; T434-T437 PolarHBondContact O-N 3.34Å; A435-T437 VanDerWaalsContact C-N 3.34Å; A435-T437 PolarHBondContact O-N 3.44Å; T437-V439 PolarHBondContact O-N 3.09Å; T437-Y440 PolarHBondContact O-N 3.04Å; T437-I441 HydrophobicContact CG2-CD1 4Å; T437-I441 VanDerWaalsContact O-CG1 3.31Å; T437-I441 WeakPolarHBondContact O-CG1 3.46Å; T437-I441 PolarHBondContact O-N 3.26Å
438L94.3Very high91.7Very high37 Ų3757.1 Ų57.119%0.19428%0.281CS..Hα-helixtrans-64.7-36.6176.2-73171.3000112.6I423 F430 T434 A435 N436 I441 A442I423-L438 HydrophobicContact CG2-CB 4.13Å; I423-L438 HydrophobicContact CG2-CD2 4.28Å; I423-L438 WeakPolarHBondContact CG2-O 3.39Å; F430-L438 HydrophobicContact CB-CD1 4.45Å; F430-L438 HydrophobicContact CD2-CD1 3.23Å; F430-L438 HydrophobicContact CE2-CD1 3.48Å; F430-L438 VanDerWaalsContact CE2-CD1 3.48Å; F430-L438 HydrophobicContact CG-CD1 3.89Å; F430-L438 HydrophobicContact CZ-CD1 4.3Å; T434-L438 HydrophobicContact CG2-CD1 4.28Å; T434-L438 VanDerWaalsContact O-CG 3.31Å; T434-L438 WeakPolarHBondContact O-CG 3.48Å; T434-L438 PolarHBondContact O-N 3.34Å; A435-L438 PolarHBondContact O-N 3.32Å; N436-L438 VanDerWaalsContact C-N 3.31Å; N436-L438 PolarHBondContact O-N 3.01Å; L438-I441 HydrophobicContact CD2-CD1 4.43Å; L438-I441 PolarHBondContact O-N 2.58Å; L438-A442 WeakPolarHBondContact O-CB 3.45Å; L438-A442 PolarHBondContact O-N 3.03Å
439V93Very high91.7Very high0 Ų057.1 Ų57.10%028%0.281CS..Hα-helixtrans-63-43173.3172.90000110.9L332 F337 W339 Y347 L424 A435 N436 T437 A442 T443L332-V439 HydrophobicContact CD2-CB 4.5Å; L332-V439 HydrophobicContact CD2-CG1 3.89Å; L332-V439 HydrophobicContact CD2-CG2 3.83Å; F337-V439 HydrophobicContact CD1-CG2 3.82Å; F337-V439 HydrophobicContact CE1-CG2 3.35Å; F337-V439 HydrophobicContact CZ-CG2 4.12Å; W339-V439 HydrophobicContact CH2-CG1 3.76Å; W339-V439 HydrophobicContact CZ2-CG1 4.05Å; Y347-V439 HydrophobicContact CE2-CG1 3.9Å; L424-V439 HydrophobicContact CD2-CG1 4.39Å; L424-V439 HydrophobicContact CD2-CG2 4.13Å; A435-V439 WeakPolarHBondContact O-CG2 3.39Å; A435-V439 PolarHBondContact O-N 3.48Å; N436-V439 PolarHBondContact O-N 3.41Å; T437-V439 PolarHBondContact O-N 3.09Å; V439-A442 WeakPolarHBondContact O-CB 3.16Å; V439-A442 PolarHBondContact O-N 2.93Å; V439-T443 PolarHBondContact O-N 3.07Å; V439-T443 PolarHBondContact O-OG1 2.88Å
440Y92.7Very high91.6Very high140 Ų14052.4 Ų52.455%0.54926%0.259SS..Hα-helixtrans-65.1-38.2173.8-69.2-61.1000112.4W339 N436 T437 T443W339-Y440 HydrophobicContact CH2-CE1 4.39Å; W339-Y440 HydrophobicContact CZ2-CE2 4.42Å; N436-Y440 WeakPolarHBondContact O-CD2 3.32Å; N436-Y440 PolarHBondContact O-N 3.08Å; T437-Y440 PolarHBondContact O-N 3.04Å; Y440-T443 WeakPolarHBondContact O-CB 3.26Å; Y440-T443 PolarHBondContact O-N 2.9Å; Y440-T443 PolarHBondContact O-OG1 3.25Å
441I94Very high91.6Very high79 Ų7948.1 Ų48.141%0.40524%0.241SC..Hα-helixtrans-65-41.2173.6-68.4166000110.9I423 T437 L438 T443 I444 P445I423-I441 HydrophobicContact CD1-CG2 4.36Å; T437-I441 HydrophobicContact CG2-CD1 4Å; T437-I441 VanDerWaalsContact O-CG1 3.31Å; T437-I441 WeakPolarHBondContact O-CG1 3.46Å; T437-I441 PolarHBondContact O-N 3.26Å; L438-I441 HydrophobicContact CD2-CD1 4.43Å; L438-I441 PolarHBondContact O-N 2.58Å; I441-T443 PolarHBondContact O-N 2.7Å; I441-T443 VanDerWaalsContact O-N 3.11Å; I441-I444 PolarHBondContact O-N 3.44Å; I441-P445 VanDerWaalsContact O-CD 3.24Å; I441-P445 WeakPolarHBondContact O-CD 3.25Å
442A93.5Very high91.6Very high0 Ų042 Ų420%021%0.208CC..Hα-helixtrans-61.3-21.2177.700000112.5N420 I423 L424 L438 V439 I444 P445 R446N420-A442 PolarHBondContact ND2-O 2.65Å; I423-A442 HydrophobicContact CB-CB 3.99Å; I423-A442 HydrophobicContact CG2-CB 3.77Å; L424-A442 HydrophobicContact CD2-CB 4.08Å; L424-A442 HydrophobicContact CG-CB 4.05Å; L438-A442 WeakPolarHBondContact O-CB 3.45Å; L438-A442 PolarHBondContact O-N 3.03Å; V439-A442 WeakPolarHBondContact O-CB 3.16Å; V439-A442 PolarHBondContact O-N 2.93Å; A442-I444 VanDerWaalsContact C-N 3.31Å; A442-I444 PolarHBondContact O-N 3.24Å; A442-P445 WeakPolarHBondContact O-CD 3.08Å; A442-R446 PolarHBondContact O-N 3.38Å
443T92.3Very high91.6Very high13 Ų1343.2 Ų43.28%0.0821%0.212CC..Hα-helixtrans-64-34.4174.9-61.30000112.6Y347 T351 V439 Y440 I441 R446 F447Y347-T443 VanDerWaalsContact CE2-OG1 3.26Å; Y347-T443 WeakPolarHBondContact CE2-OG1 3.37Å; T351-T443 HydrophobicContact CG2-CG2 3.24Å; V439-T443 PolarHBondContact O-N 3.07Å; V439-T443 PolarHBondContact O-OG1 2.88Å; Y440-T443 WeakPolarHBondContact O-CB 3.26Å; Y440-T443 PolarHBondContact O-N 2.9Å; Y440-T443 PolarHBondContact O-OG1 3.25Å; I441-T443 PolarHBondContact O-N 2.7Å; I441-T443 VanDerWaalsContact O-N 3.11Å; T443-R446 VanDerWaalsContact O-CB 3.25Å; T443-R446 WeakPolarHBondContact O-CB 3.14Å; T443-R446 PolarHBondContact O-N 2.97Å; T443-R446 VanDerWaalsContact O-N 3.08Å; T443-F447 HydrophobicContact CG2-CD1 4.44Å; T443-F447 HydrophobicContact CG2-CE1 3.55Å; T443-F447 HydrophobicContact CG2-CE2 4.37Å; T443-F447 HydrophobicContact CG2-CZ 3.52Å; T443-F447 PolarHBondContact O-N 3.1Å
444I92.7Very high91.6Very high108 Ų10834.4 Ų34.455%0.55418%0.178SC*.Hα-helixtrans-62.6-50.6-176-60.8166.7000110.8I441 A442 R446 F447I441-I444 PolarHBondContact O-N 3.44Å; A442-I444 VanDerWaalsContact C-N 3.31Å; A442-I444 PolarHBondContact O-N 3.24Å; I444-R446 VanDerWaalsContact C-N 3.26Å; I444-R446 PolarHBondContact O-N 3.35Å; I444-F447 WeakPolarHBondContact O-CD2 3.39Å; I444-F447 PolarHBondContact O-N 3.27Å
445P92.6Very high91.5Very high12 Ų1231.8 Ų31.88%0.07816%0.162CC..Hα-helixtrans-65.1-27.2173-18.729.5000114.1M416 I419 N420 I441 A442 F447 A448M416-P445 HydrophobicContact CB-CB 4.18Å; M416-P445 HydrophobicContact CE-CB 4.11Å; M416-P445 WeakPolarHBondContact O-CB 3.24Å; M416-P445 HydrophobicContact SD-CB 4.29Å; I419-P445 HydrophobicContact CB-CB 4.28Å; I419-P445 HydrophobicContact CB-CG 4.29Å; I419-P445 HydrophobicContact CG2-CB 4.32Å; I419-P445 HydrophobicContact CG2-CG 3.79Å; N420-P445 HydrophobicContact CB-CB 4.12Å; I441-P445 VanDerWaalsContact O-CD 3.24Å; I441-P445 WeakPolarHBondContact O-CD 3.25Å; A442-P445 WeakPolarHBondContact O-CD 3.08Å; P445-F447 PolarHBondContact O-N 2.94Å; P445-A448 PolarHBondContact O-N 2.98Å
446R90.9Very high91.5Very high3 Ų332.1 Ų32.11%0.01116%0.164CC..Hα-helixtrans-60.3-30.2177.9-175.5-179.4167.5163.91.8112.3T351 D352 A442 T443 I444 A448 K449T351-R446 PolarHBondContact OG1-NH1 3.11Å; D352-R446 VanDerWaalsContact CG-NH2 3.27Å; D352-R446 IonicContact OD1-CZ 3.64Å; D352-R446 IonicContact OD1-NE 2.62Å; D352-R446 PolarHBondContact OD1-NE 2.92Å; D352-R446 IonicContact OD1-NH2 3.13Å; D352-R446 PolarHBondContact OD1-NH2 3.31Å; D352-R446 IonicContact OD2-NH2 3.44Å; D352-R446 PolarHBondContact OD2-NH2 2.95Å; A442-R446 PolarHBondContact O-N 3.38Å; T443-R446 VanDerWaalsContact O-CB 3.25Å; T443-R446 WeakPolarHBondContact O-CB 3.14Å; T443-R446 PolarHBondContact O-N 2.97Å; T443-R446 VanDerWaalsContact O-N 3.08Å; I444-R446 VanDerWaalsContact C-N 3.26Å; I444-R446 PolarHBondContact O-N 3.35Å; R446-A448 PolarHBondContact O-N 3.27Å; R446-A448 VanDerWaalsContact O-N 3.11Å; R446-K449 WeakPolarHBondContact O-CB 3.32Å; R446-K449 PolarHBondContact O-N 3.39Å
447F91.9Very high91.2Very high37 Ų3731.8 Ų31.816%0.16216%0.16CC..G310 helixtrans-59.1-24.6179.6-61.9-34.4000114.4I354 S355 I358 T443 I444 P445 K449I354-F447 HydrophobicContact CB-CD1 4.12Å; I354-F447 HydrophobicContact CB-CE1 3.64Å; I354-F447 HydrophobicContact CB-CZ 4.16Å; I354-F447 HydrophobicContact CD1-CE1 4.35Å; I354-F447 HydrophobicContact CD1-CZ 4.26Å; I354-F447 HydrophobicContact CG2-CD1 3.72Å; I354-F447 HydrophobicContact CG2-CD2 4.32Å; I354-F447 HydrophobicContact CG2-CE1 3.38Å; I354-F447 HydrophobicContact CG2-CE2 4.03Å; I354-F447 HydrophobicContact CG2-CG 4.19Å; I354-F447 HydrophobicContact CG2-CZ 3.54Å; S355-F447 PolarHBondContact OG-O 2.86Å; S355-F447 VanDerWaalsContact OG-O 3.1Å; I358-F447 HydrophobicContact CD1-CB 3.72Å; I358-F447 HydrophobicContact CD1-CD1 4.4Å; I358-F447 HydrophobicContact CD1-CD2 3.73Å; I358-F447 HydrophobicContact CD1-CE2 4.42Å; I358-F447 HydrophobicContact CD1-CG 3.71Å; T443-F447 HydrophobicContact CG2-CD1 4.44Å; T443-F447 HydrophobicContact CG2-CE1 3.55Å; T443-F447 HydrophobicContact CG2-CE2 4.37Å; T443-F447 HydrophobicContact CG2-CZ 3.52Å; T443-F447 PolarHBondContact O-N 3.1Å; I444-F447 WeakPolarHBondContact O-CD2 3.39Å; I444-F447 PolarHBondContact O-N 3.27Å; P445-F447 PolarHBondContact O-N 2.94Å; F447-K449 PolarHBondContact O-N 3.24Å
448A91.1Very high90.9Very high9 Ų929.3 Ų29.37%0.07415%0.145CC..G310 helixtrans-72.3-15.9176.600000113S413 M416 P445 R446 G450 L451S413-A448 WeakPolarHBondContact CB-O 3.18Å; M416-A448 HydrophobicContact CB-CB 3.58Å; M416-A448 HydrophobicContact CG-CB 4Å; P445-A448 PolarHBondContact O-N 2.98Å; R446-A448 PolarHBondContact O-N 3.27Å; R446-A448 VanDerWaalsContact O-N 3.11Å; A448-G450 PolarHBondContact O-N 3.21Å; A448-L451 WeakPolarHBondContact O-CB 3.26Å; A448-L451 PolarHBondContact O-N 3.11Å; A448-L451 VanDerWaalsContact O-N 3.12Å
449K88.8Confident90.5Very high38 Ų3827.5 Ų27.517%0.16514%0.136CC..G310 helixtrans-55.4-37.5179.5178.3-174.2168.5-174.40112.2T321 D324 M417 R446 F447 L451 N452T321-K449 HydrophobicContact CG2-CD 4.43Å; T321-K449 HydrophobicContact CG2-CG 4.41Å; D324-K449 IonicContact OD2-NZ 3.97Å; D324-K449 PolarHBondContact OD2-NZ 3.19Å; M417-K449 HydrophobicContact CG-CB 4.37Å; M417-K449 HydrophobicContact SD-CB 4.27Å; M417-K449 HydrophobicContact SD-CG 4.17Å; R446-K449 WeakPolarHBondContact O-CB 3.32Å; R446-K449 PolarHBondContact O-N 3.39Å; F447-K449 PolarHBondContact O-N 3.24Å; K449-L451 PolarHBondContact O-N 3.08Å; K449-L451 VanDerWaalsContact O-N 3.09Å; K449-N452 PolarHBondContact O-N 3.46Å
450G88.1Confident90.2Very high13 Ų1327.7 Ų27.713%0.13414%0.136CC..G310 helixtrans-61-17.8-179.100000114.4S355 A448 P454S355-G450 PolarHBondContact OG-N 3.23Å; S355-G450 VanDerWaalsContact OG-N 3.15Å; A448-G450 PolarHBondContact O-N 3.21Å; G450-P454 WeakPolarHBondContact O-CD 3.39Å
451L90.3Very high89.7Confident7 Ų721.4 Ų21.44%0.03711%0.113CC..G310 helixtrans-80.5-25.4179.2-62.4173.4000113.5A359 F362 I409 A448 K449 P454 I455A359-L451 HydrophobicContact CB-CD2 3.9Å; A359-L451 HydrophobicContact CB-CG 4.43Å; F362-L451 HydrophobicContact CB-CD2 4.13Å; F362-L451 HydrophobicContact CD1-CD1 4.18Å; F362-L451 HydrophobicContact CD1-CD2 3.56Å; F362-L451 HydrophobicContact CE1-CD1 4.36Å; F362-L451 HydrophobicContact CE1-CD2 4.32Å; F362-L451 HydrophobicContact CG-CD2 4.08Å; I409-L451 HydrophobicContact CG2-CD1 4.16Å; A448-L451 WeakPolarHBondContact O-CB 3.26Å; A448-L451 PolarHBondContact O-N 3.11Å; A448-L451 VanDerWaalsContact O-N 3.12Å; K449-L451 PolarHBondContact O-N 3.08Å; K449-L451 VanDerWaalsContact O-N 3.09Å; L451-P454 WeakPolarHBondContact O-CD 3.44Å; L451-I455 HydrophobicContact CB-CD1 4.04Å; L451-I455 WeakPolarHBondContact O-CB 3.32Å; L451-I455 VanDerWaalsContact O-CD1 3.26Å; L451-I455 WeakPolarHBondContact O-CD1 3.5Å; L451-I455 WeakPolarHBondContact O-CG1 3.39Å; L451-I455 PolarHBondContact O-N 3.39Å
452N91Very high88.8Confident3 Ų318.6 Ų18.62%0.01610%0.099CC..Hα-helixtrans-64.3-52.3-168.8-69.3-31.3000112.9L410 S413 M417 K449 I455 L456L410-N452 HydrophobicContact CD1-CB 4.46Å; S413-N452 VanDerWaalsContact CB-OD1 3.24Å; S413-N452 WeakPolarHBondContact CB-OD1 3.48Å; S413-N452 PolarHBondContact OG-OD1 3.48Å; M417-N452 PolarHBondContact SD-ND2 2.74Å; K449-N452 PolarHBondContact O-N 3.46Å; N452-I455 PolarHBondContact O-N 2.75Å; N452-L456 WeakPolarHBondContact O-CB 3.41Å; N452-L456 WeakPolarHBondContact O-CD1 3.4Å; N452-L456 VanDerWaalsContact O-CG 3.25Å; N452-L456 WeakPolarHBondContact O-CG 3.36Å; N452-L456 PolarHBondContact O-N 3.07Å
453N88.1Confident88.1Confident79 Ų7920.1 Ų20.142%0.42210%0.104SC..Hα-helixtrans-63.4-48.2-174.4-71.6-7.4000112.7I455 L456 R457N453-I455 VanDerWaalsContact C-N 3.32Å; N453-I455 PolarHBondContact O-N 3.3Å; N453-L456 PolarHBondContact O-N 3.21Å; N453-R457 WeakPolarHBondContact O-CB 3.49Å; N453-R457 WeakPolarHBondContact O-CG 3.3Å; N453-R457 PolarHBondContact O-N 3.3Å
454P89.1Confident87.3Confident2 Ų220.3 Ų20.31%0.01311%0.106CC..Hα-helixtrans-60.1-41.5177.5-25.533.6000113F195 T196 D199 G450 L451 T458F195-P454 HydrophobicContact CB-CB 4.31Å; T196-P454 HydrophobicContact CG2-CG 4.44Å; T196-P454 VanDerWaalsContact OG1-CB 3.23Å; T196-P454 WeakPolarHBondContact OG1-CB 3.34Å; D199-P454 HydrophobicContact CB-CG 3.89Å; G450-P454 WeakPolarHBondContact O-CD 3.39Å; L451-P454 WeakPolarHBondContact O-CD 3.44Å; P454-T458 WeakPolarHBondContact O-CB 3.41Å; P454-T458 PolarHBondContact O-N 3.12Å; P454-T458 PolarHBondContact O-OG1 3.25Å
455I90Very high86.1Confident0 Ų019 Ų190%010%0.099CC..Hα-helixtrans-66.1-47.7-179.6-67.1168.8000110.4L406 I409 L410 L451 N452 N453 R457 T458 L459L406-I455 HydrophobicContact CB-CG2 4.06Å; L406-I455 HydrophobicContact CD2-CG1 4.28Å; L406-I455 HydrophobicContact CD2-CG2 4.35Å; I409-I455 HydrophobicContact CB-CD1 3.94Å; I409-I455 HydrophobicContact CG2-CD1 3.4Å; I409-I455 VanDerWaalsContact CG2-CD1 3.4Å; L410-I455 HydrophobicContact CB-CG2 4.04Å; L410-I455 HydrophobicContact CD1-CG2 4.4Å; L451-I455 HydrophobicContact CB-CD1 4.04Å; L451-I455 WeakPolarHBondContact O-CB 3.32Å; L451-I455 VanDerWaalsContact O-CD1 3.26Å; L451-I455 WeakPolarHBondContact O-CD1 3.5Å; L451-I455 WeakPolarHBondContact O-CG1 3.39Å; L451-I455 PolarHBondContact O-N 3.39Å; N452-I455 PolarHBondContact O-N 2.75Å; N453-I455 VanDerWaalsContact C-N 3.32Å; N453-I455 PolarHBondContact O-N 3.3Å; I455-R457 PolarHBondContact O-N 3.17Å; I455-T458 WeakPolarHBondContact O-CB 3.5Å; I455-T458 PolarHBondContact O-N 2.95Å; I455-L459 HydrophobicContact CG2-CD1 4Å; I455-L459 HydrophobicContact CG2-CG 4.39Å; I455-L459 WeakPolarHBondContact O-CG 3.31Å; I455-L459 PolarHBondContact O-N 3.31Å
456L90.8Very high85Confident7 Ų723.7 Ų23.74%0.03712%0.121CC..Hα-helixtrans-59.9-46.7178.4-72164.6000111.2I310 I313 V314 L317 L410 N452 N453 T458 L459 I460I310-L456 HydrophobicContact CG2-CD2 4.44Å; I313-L456 HydrophobicContact CG2-CD2 4.13Å; V314-L456 HydrophobicContact CG2-CD1 4.11Å; V314-L456 HydrophobicContact CG2-CD2 4.28Å; L317-L456 HydrophobicContact CD1-CD1 3.76Å; L410-L456 HydrophobicContact CD1-CD2 4.44Å; L410-L456 HydrophobicContact CD1-CG 4.22Å; L410-L456 HydrophobicContact CD2-CD2 3.85Å; L410-L456 HydrophobicContact CD2-CG 4.44Å; N452-L456 WeakPolarHBondContact O-CB 3.41Å; N452-L456 WeakPolarHBondContact O-CD1 3.4Å; N452-L456 VanDerWaalsContact O-CG 3.25Å; N452-L456 WeakPolarHBondContact O-CG 3.36Å; N452-L456 PolarHBondContact O-N 3.07Å; N453-L456 PolarHBondContact O-N 3.21Å; L456-T458 VanDerWaalsContact C-N 3.3Å; L456-T458 PolarHBondContact O-N 3.48Å; L456-L459 PolarHBondContact O-N 3.08Å; L456-I460 WeakPolarHBondContact O-CB 3.46Å; L456-I460 VanDerWaalsContact O-CD1 3.32Å; L456-I460 WeakPolarHBondContact O-CD1 3.3Å; L456-I460 WeakPolarHBondContact O-CG1 3.43Å; L456-I460 PolarHBondContact O-N 2.97Å
457R87.9Confident83.9Confident26 Ų2628.3 Ų28.310%0.09815%0.153CC..Hα-helixtrans-62.9-37177.4-72.2-178.2-176.4166.921.8112.7S163 F195 D199 N453 I455 S461S163-R457 VanDerWaalsContact OG-CD 3.29Å; S163-R457 WeakPolarHBondContact OG-CD 3.31Å; S163-R457 VanDerWaalsContact OG-CZ 3.31Å; S163-R457 PolarHBondContact OG-NE 3.11Å; S163-R457 PolarHBondContact OG-NH1 3.29Å; F195-R457 HydrophobicContact CD1-CB 4.46Å; F195-R457 HydrophobicContact CD2-CB 3.82Å; F195-R457 HydrophobicContact CE2-CB 3.89Å; F195-R457 WeakPolarHBondContact CE2-O 3.45Å; F195-R457 HydrophobicContact CG-CB 4.12Å; F195-R457 HydrophobicContact CZ-CB 4.29Å; D199-R457 IonicContact OD1-CZ 3.15Å; D199-R457 IonicContact OD1-NH1 2.72Å; D199-R457 PolarHBondContact OD1-NH1 2.98Å; D199-R457 IonicContact OD1-NH2 3.99Å; D199-R457 PolarHBondContact OD1-NH2 3.31Å; D199-R457 IonicContact OD2-CZ 3.99Å; D199-R457 IonicContact OD2-NE 3.56Å; D199-R457 IonicContact OD2-NH1 2.76Å; D199-R457 PolarHBondContact OD2-NH1 3.48Å; N453-R457 WeakPolarHBondContact O-CB 3.49Å; N453-R457 WeakPolarHBondContact O-CG 3.3Å; N453-R457 PolarHBondContact O-N 3.3Å; I455-R457 PolarHBondContact O-N 3.17Å; R457-S461 WeakPolarHBondContact O-CB 3.44Å; R457-S461 PolarHBondContact O-N 2.97Å; R457-S461 PolarHBondContact O-OG 3.17Å
458T85.5Confident82.9Confident2 Ų230.2 Ų30.21%0.01216%0.161CC..Hα-helixtrans-62.9-50.5174.1-56.10000110.4W192 L406 P454 I455 L456 I460 S461 M462W192-T458 WeakPolarHBondContact CA-OG1 3.5Å; W192-T458 HydrophobicContact CB-CG2 3.96Å; W192-T458 HydrophobicContact CG-CG2 4.45Å; L406-T458 HydrophobicContact CD1-CG2 3.81Å; P454-T458 WeakPolarHBondContact O-CB 3.41Å; P454-T458 PolarHBondContact O-N 3.12Å; P454-T458 PolarHBondContact O-OG1 3.25Å; I455-T458 WeakPolarHBondContact O-CB 3.5Å; I455-T458 PolarHBondContact O-N 2.95Å; L456-T458 VanDerWaalsContact C-N 3.3Å; L456-T458 PolarHBondContact O-N 3.48Å; T458-I460 PolarHBondContact O-N 2.98Å; T458-S461 PolarHBondContact O-N 3.43Å; T458-M462 HydrophobicContact CG2-CG 4.39Å; T458-M462 HydrophobicContact CG2-SD 4.03Å; T458-M462 WeakPolarHBondContact O-CB 3.38Å; T458-M462 VanDerWaalsContact O-CG 3.25Å; T458-M462 WeakPolarHBondContact O-CG 3.21Å; T458-M462 PolarHBondContact O-N 2.71Å
459L86.8Confident82.1Confident0 Ų030 Ų300%016%0.159CC..Hα-helixtrans-59.7-45.7178.8-69.8171.1000112.1I310 V403 L406 L407 L410 I455 L456 S461 M462 W463I310-L459 HydrophobicContact CD1-CB 3.65Å; I310-L459 HydrophobicContact CD1-CD1 4.28Å; V403-L459 HydrophobicContact CG1-CD2 3.99Å; L406-L459 HydrophobicContact CB-CD2 4.14Å; L406-L459 HydrophobicContact CD1-CD2 4.12Å; L407-L459 HydrophobicContact CD2-CD1 3.77Å; L407-L459 HydrophobicContact CG-CD1 4.4Å; L410-L459 HydrophobicContact CD2-CD1 4.31Å; I455-L459 HydrophobicContact CG2-CD1 4Å; I455-L459 HydrophobicContact CG2-CG 4.39Å; I455-L459 WeakPolarHBondContact O-CG 3.31Å; I455-L459 PolarHBondContact O-N 3.31Å; L456-L459 PolarHBondContact O-N 3.08Å; L459-S461 VanDerWaalsContact C-N 3.32Å; L459-S461 PolarHBondContact O-N 3.18Å; L459-M462 PolarHBondContact O-N 3Å; L459-W463 HydrophobicContact CD2-CZ2 4.18Å; L459-W463 PolarHBondContact O-N 3.14Å
460I85.8Confident81.3Confident3 Ų328.1 Ų28.12%0.01515%0.151CC..Hα-helixtrans-56.9-48176-70.5157.7000110.6I310 L456 T458 M462 W463 T464 M472 V476I310-I460 HydrophobicContact CD1-CG1 4.44Å; I310-I460 HydrophobicContact CG2-CD1 3.88Å; I310-I460 HydrophobicContact CG2-CG1 3.63Å; L456-I460 WeakPolarHBondContact O-CB 3.46Å; L456-I460 VanDerWaalsContact O-CD1 3.32Å; L456-I460 WeakPolarHBondContact O-CD1 3.3Å; L456-I460 WeakPolarHBondContact O-CG1 3.43Å; L456-I460 PolarHBondContact O-N 2.97Å; T458-I460 PolarHBondContact O-N 2.98Å; I460-M462 VanDerWaalsContact C-N 3.32Å; I460-M462 PolarHBondContact O-N 2.95Å; I460-W463 PolarHBondContact O-N 3.28Å; I460-T464 VanDerWaalsContact O-CB 3.28Å; I460-T464 WeakPolarHBondContact O-CB 3.23Å; I460-T464 PolarHBondContact O-N 3.39Å; I460-T464 VanDerWaalsContact O-N 3.14Å; I460-T464 PolarHBondContact O-OG1 2.98Å; I460-M472 HydrophobicContact CG2-CE 3.97Å; I460-M472 HydrophobicContact CG2-CG 3.53Å; I460-V476 HydrophobicContact CD1-CB 4.18Å; I460-V476 HydrophobicContact CD1-CG1 3.68Å; I460-V476 HydrophobicContact CD1-CG2 3.5Å; I460-V476 HydrophobicContact CG1-CG2 4.18Å; I460-V476 HydrophobicContact CG2-CG2 4.23Å
461S81.9Confident80.6Confident9 Ų930.2 Ų30.26%0.06316%0.157CC..Hα-helixtrans-68.9-32.3-177.2-54.70000111.9L191 F195 R457 T458 L459 W463 Q469 H473L191-S461 VanDerWaalsContact CD2-CB 3.41Å; F195-S461 WeakPolarHBondContact CE2-OG 3.5Å; F195-S461 WeakPolarHBondContact CZ-OG 3.39Å; R457-S461 WeakPolarHBondContact O-CB 3.44Å; R457-S461 PolarHBondContact O-N 2.97Å; R457-S461 PolarHBondContact O-OG 3.17Å; T458-S461 PolarHBondContact O-N 3.43Å; L459-S461 VanDerWaalsContact C-N 3.32Å; L459-S461 PolarHBondContact O-N 3.18Å; S461-W463 VanDerWaalsContact C-N 3.34Å; S461-Q469 PolarHBondContact O-NE2 3.31Å; S461-H473 PolarHBondContact OG-CE1 3.35Å; S461-H473 PolarHBondContact OG-NE2 2.74Å
462M76.8Confident80.2Confident20 Ų2030.7 Ų30.710%0.09916%0.16CC..Hα-helixtrans-69.8-27.5177.1-75.5-179.770.800114.1Q188 K399 V403 L406 T458 L459 I460Q188-M462 HydrophobicContact CG-CE 4.11Å; Q188-M462 HydrophobicContact CG-CG 4.3Å; Q188-M462 HydrophobicContact CG-SD 4.4Å; K399-M462 HydrophobicContact CG-CE 3.99Å; K399-M462 PolarHBondContact NZ-O 2.92Å; V403-M462 HydrophobicContact CG2-CE 3.41Å; V403-M462 VanDerWaalsContact CG2-CE 3.41Å; V403-M462 HydrophobicContact CG2-SD 4.22Å; L406-M462 HydrophobicContact CD1-SD 4.08Å; T458-M462 HydrophobicContact CG2-CG 4.39Å; T458-M462 HydrophobicContact CG2-SD 4.03Å; T458-M462 WeakPolarHBondContact O-CB 3.38Å; T458-M462 VanDerWaalsContact O-CG 3.25Å; T458-M462 WeakPolarHBondContact O-CG 3.21Å; T458-M462 PolarHBondContact O-N 2.71Å; L459-M462 PolarHBondContact O-N 3Å; I460-M462 VanDerWaalsContact C-N 3.32Å; I460-M462 PolarHBondContact O-N 2.95Å
463W77.4Confident80Confident31 Ų3130.7 Ų30.712%0.11716%0.16CC..Hα-helixtrans-101.2-2.4-179.4-57.6-27.3000113.5Q306 H307 I310 V403 L459 I460 S461 L524 T528Q306-W463 HydrophobicContact CB-CD2 4.3Å; Q306-W463 HydrophobicContact CB-CE3 3.65Å; Q306-W463 HydrophobicContact CB-CH2 4.18Å; Q306-W463 HydrophobicContact CB-CZ3 3.54Å; Q306-W463 HydrophobicContact CG-CZ3 4.35Å; H307-W463 WeakPolarHBondContact CE1-CB 3.25Å; H307-W463 PolarHBondContact CE1-O 3.49Å; H307-W463 PolarHBondContact NE2-O 3.08Å; I310-W463 HydrophobicContact CD1-CE3 3.57Å; I310-W463 HydrophobicContact CD1-CH2 3.67Å; I310-W463 HydrophobicContact CD1-CZ3 2.98Å; I310-W463 HydrophobicContact CG1-CE3 4.41Å; I310-W463 HydrophobicContact CG1-CH2 4.27Å; I310-W463 HydrophobicContact CG1-CZ3 3.57Å; V403-W463 HydrophobicContact CG1-CZ2 3.88Å; L459-W463 HydrophobicContact CD2-CZ2 4.18Å; L459-W463 PolarHBondContact O-N 3.14Å; I460-W463 PolarHBondContact O-N 3.28Å; S461-W463 VanDerWaalsContact C-N 3.34Å; W463-L524 HydrophobicContact CH2-CD1 3.78Å; W463-L524 HydrophobicContact CH2-CD2 3.98Å; W463-L524 HydrophobicContact CH2-CG 4.18Å; W463-L524 HydrophobicContact CZ3-CD1 4.2Å; W463-L524 HydrophobicContact CZ3-CD2 4.41Å; W463-T528 HydrophobicContact CZ2-CG2 4.31Å
464T76.2Confident79.7Confident18 Ų1827.1 Ų27.111%0.1114%0.141CC..SBendtrans-108.4137.3-179.2-55.30000110.3H307 I460 K468 Q469 M472H307-T464 PolarHBondContact NE2-OG1 2.79Å; I460-T464 VanDerWaalsContact O-CB 3.28Å; I460-T464 WeakPolarHBondContact O-CB 3.23Å; I460-T464 PolarHBondContact O-N 3.39Å; I460-T464 VanDerWaalsContact O-N 3.14Å; I460-T464 PolarHBondContact O-OG1 2.98Å; T464-K468 HydrophobicContact CG2-CB 4.29Å; T464-Q469 PolarHBondContact O-NE2 3.43Å; T464-M472 HydrophobicContact CG2-CB 3.65Å; T464-M472 HydrophobicContact CG2-CG 4Å; T464-M472 WeakPolarHBondContact OG1-CG 3.41Å
465D67.6Low79.6Confident79 Ų7928 Ų2842%0.42215%0.145SC..  trans-62144.1174.4-58.7-41.6000110.9Y304 S467 K468Y304-D465 PolarHBondContact OH-OD2 3.39Å; D465-S467 PolarHBondContact O-N 3.42Å; D465-S467 VanDerWaalsContact O-N 3.16Å; D465-K468 PolarHBondContact O-N 2.99Å
466Q68.6Low79.5Confident112 Ų11228.7 Ų28.752%0.52315%0.149SC..G310 helixtrans-57.8-32.8-176.1-68.2-179.9-6.600113.1K468 Q469Q466-K468 PolarHBondContact O-N 3.28Å; Q466-Q469 WeakPolarHBondContact O-CG 3.31Å
467S67.5Low79.4Confident99 Ų9928.7 Ų28.769%0.69215%0.15SC*.G310 helixtrans-71.6-13.5180580000114.5D465D465-S467 PolarHBondContact O-N 3.42Å; D465-S467 VanDerWaalsContact O-N 3.16Å
468K71.3Confident79.5Confident78 Ų7829.3 Ų29.334%0.33915%0.153SC..G310 helixtrans-12015.7-173.7-64.6179.4-179.9171.90113.4I299 T464 D465 Q466 G470 M472I299-K468 HydrophobicContact CD1-CD 4.31Å; T464-K468 HydrophobicContact CG2-CB 4.29Å; D465-K468 PolarHBondContact O-N 2.99Å; Q466-K468 PolarHBondContact O-N 3.28Å; K468-G470 PolarHBondContact O-N 2.98Å; K468-M472 WeakPolarHBondContact O-CB 3.06Å; K468-M472 PolarHBondContact O-N 3.35Å
469Q74.5Confident79.7Confident3 Ų329.9 Ų29.91%0.01416%0.157CC..Hα-helixtrans-63.3-42.8-175.8-68.5-72.3-22.800112.3T167 S461 T464 Q466 M472 H473T167-Q469 HydrophobicContact CG2-CB 4.32Å; T167-Q469 HydrophobicContact CG2-CG 3.64Å; S461-Q469 PolarHBondContact O-NE2 3.31Å; T464-Q469 PolarHBondContact O-NE2 3.43Å; Q466-Q469 WeakPolarHBondContact O-CG 3.31Å; Q469-M472 PolarHBondContact O-N 3.2Å; Q469-H473 WeakPolarHBondContact O-CB 3.47Å; Q469-H473 PolarHBondContact O-CD2 3.07Å; Q469-H473 VanDerWaalsContact O-CD2 3.24Å; Q469-H473 PolarHBondContact O-N 3.19Å
470G71.1Confident80Confident0 Ų030.8 Ų30.80%016%0.163CC..Hα-helixtrans-63.1-49.8179.100000112.7D106 K468 M472 H473 S474D106-G470 VanDerWaalsContact OD1-CA 3.31Å; D106-G470 WeakPolarHBondContact OD1-CA 3.49Å; K468-G470 PolarHBondContact O-N 2.98Å; G470-M472 PolarHBondContact O-N 3.17Å; G470-H473 PolarHBondContact O-N 3.28Å; G470-S474 VanDerWaalsContact O-CB 3.27Å; G470-S474 WeakPolarHBondContact O-CB 3.33Å; G470-S474 PolarHBondContact O-N 3.17Å; G470-S474 PolarHBondContact O-OG 3.35Å
471M74.6Confident80.2Confident56 Ų5630.9 Ų30.928%0.27616%0.163SC..Hα-helixtrans-54.6-47.6172.6-172.4-172.7-5700112.6D106 I299 S474 F475D106-M471 PolarHBondContact OD2-N 2.67Å; I299-M471 HydrophobicContact CD1-SD 3.79Å; M471-S474 PolarHBondContact O-N 3.43Å; M471-F475 PolarHBondContact O-N 3.46Å
472M82.5Confident80.7Confident17 Ų1733.2 Ų33.28%0.08418%0.175CC..Hα-helixtrans-67.8-44.9-177.7-174.963.4-170.200112.7H307 I460 T464 K468 Q469 G470 S474 F475 V476H307-M472 HydrophobicContact CB-CE 3.98Å; H307-M472 WeakPolarHBondContact CD2-CE 3.41Å; I460-M472 HydrophobicContact CG2-CE 3.97Å; I460-M472 HydrophobicContact CG2-CG 3.53Å; T464-M472 HydrophobicContact CG2-CB 3.65Å; T464-M472 HydrophobicContact CG2-CG 4Å; T464-M472 WeakPolarHBondContact OG1-CG 3.41Å; K468-M472 WeakPolarHBondContact O-CB 3.06Å; K468-M472 PolarHBondContact O-N 3.35Å; Q469-M472 PolarHBondContact O-N 3.2Å; G470-M472 PolarHBondContact O-N 3.17Å; M472-S474 VanDerWaalsContact C-N 3.25Å; M472-S474 PolarHBondContact O-N 3.43Å; M472-F475 HydrophobicContact CE-CD1 4.5Å; M472-F475 WeakPolarHBondContact O-CB 3.39Å; M472-F475 PolarHBondContact O-N 2.89Å; M472-F475 HydrophobicContact SD-CD1 4.41Å; M472-V476 HydrophobicContact CE-CG2 3.9Å; M472-V476 VanDerWaalsContact O-CG2 3.3Å; M472-V476 WeakPolarHBondContact O-CG2 3.32Å; M472-V476 PolarHBondContact O-N 3.02Å
473H85.2Confident81.4Confident3 Ų332.2 Ų32.21%0.01417%0.17CC..Hα-helixtrans-64-33.7175.5-81.4-71.4000111.7A160 S461 Q469 G470 V476 A477A160-H473 HydrophobicContact CB-CB 4.22Å; A160-H473 WeakPolarHBondContact CB-O 3.39Å; S461-H473 PolarHBondContact OG-CE1 3.35Å; S461-H473 PolarHBondContact OG-NE2 2.74Å; Q469-H473 WeakPolarHBondContact O-CB 3.47Å; Q469-H473 PolarHBondContact O-CD2 3.07Å; Q469-H473 VanDerWaalsContact O-CD2 3.24Å; Q469-H473 PolarHBondContact O-N 3.19Å; G470-H473 PolarHBondContact O-N 3.28Å; H473-V476 PolarHBondContact O-N 3.31Å; H473-A477 PolarHBondContact O-N 3.16Å
474S83.6Confident82.1Confident5 Ų531.5 Ų31.54%0.03517%0.169CC..Hα-helixtrans-68.7-38.6174-55.20000112.1G102 Q161 G470 M471 M472 A477 F478G102-S474 WeakPolarHBondContact CA-OG 3.42Å; Q161-S474 PolarHBondContact NE2-OG 2.89Å; G470-S474 VanDerWaalsContact O-CB 3.27Å; G470-S474 WeakPolarHBondContact O-CB 3.33Å; G470-S474 PolarHBondContact O-N 3.17Å; G470-S474 PolarHBondContact O-OG 3.35Å; M471-S474 PolarHBondContact O-N 3.43Å; M472-S474 VanDerWaalsContact C-N 3.25Å; M472-S474 PolarHBondContact O-N 3.43Å; S474-A477 PolarHBondContact O-N 3.41Å; S474-F478 WeakPolarHBondContact O-CB 3.45Å; S474-F478 PolarHBondContact O-N 2.97Å
475F85.8Confident82.8Confident21 Ų2132 Ų329%0.09217%0.17CC..Hα-helixtrans-63.3-42.6172.2176.9-100000111.8I300 M471 M472 A477 F478 V479I300-F475 HydrophobicContact CD1-CD1 3.83Å; I300-F475 HydrophobicContact CD1-CD2 4.14Å; I300-F475 HydrophobicContact CD1-CE1 3.41Å; I300-F475 VanDerWaalsContact CD1-CE1 3.41Å; I300-F475 HydrophobicContact CD1-CE2 3.75Å; I300-F475 HydrophobicContact CD1-CG 4.17Å; I300-F475 HydrophobicContact CD1-CZ 3.38Å; M471-F475 PolarHBondContact O-N 3.46Å; M472-F475 HydrophobicContact CE-CD1 4.5Å; M472-F475 WeakPolarHBondContact O-CB 3.39Å; M472-F475 PolarHBondContact O-N 2.89Å; M472-F475 HydrophobicContact SD-CD1 4.41Å; F475-A477 VanDerWaalsContact C-N 3.32Å; F475-A477 PolarHBondContact O-N 3.42Å; F475-F478 WeakPolarHBondContact O-CB 2.93Å; F475-F478 PolarHBondContact O-N 2.96Å; F475-V479 HydrophobicContact CD1-CG2 4.2Å; F475-V479 HydrophobicContact CE1-CG2 3.69Å; F475-V479 HydrophobicContact CE2-CG2 4.1Å; F475-V479 HydrophobicContact CZ-CG2 3.63Å; F475-V479 WeakPolarHBondContact O-CG2 3.36Å; F475-V479 PolarHBondContact O-N 3.5Å
476V87.9Confident84Confident14 Ų1431.4 Ų31.49%0.08517%0.167CC..Hα-helixtrans-64.2-38.8176.5171.20000111.2V314 I460 M472 H473 V479 S480V314-V476 HydrophobicContact CG1-CG1 4.09Å; V314-V476 HydrophobicContact CG2-CG1 4.31Å; I460-V476 HydrophobicContact CD1-CB 4.18Å; I460-V476 HydrophobicContact CD1-CG1 3.68Å; I460-V476 HydrophobicContact CD1-CG2 3.5Å; I460-V476 HydrophobicContact CG1-CG2 4.18Å; I460-V476 HydrophobicContact CG2-CG2 4.23Å; M472-V476 HydrophobicContact CE-CG2 3.9Å; M472-V476 VanDerWaalsContact O-CG2 3.3Å; M472-V476 WeakPolarHBondContact O-CG2 3.32Å; M472-V476 PolarHBondContact O-N 3.02Å; H473-V476 PolarHBondContact O-N 3.31Å; V476-V479 PolarHBondContact O-N 3.46Å; V476-S480 WeakPolarHBondContact O-CB 3.25Å; V476-S480 PolarHBondContact O-N 3.15Å; V476-S480 PolarHBondContact O-OG 3.5Å
477A88.2Confident85Confident6 Ų626.1 Ų26.15%0.0514%0.142CC..Hα-helixtrans-65.7-39.317200000112.5L156 A160 H473 S474 F475 S480 R481L156-A477 HydrophobicContact CB-CB 4.48Å; A160-A477 HydrophobicContact CB-CB 3.7Å; H473-A477 PolarHBondContact O-N 3.16Å; S474-A477 PolarHBondContact O-N 3.41Å; F475-A477 VanDerWaalsContact C-N 3.32Å; F475-A477 PolarHBondContact O-N 3.42Å; A477-S480 PolarHBondContact O-N 3.1Å; A477-R481 VanDerWaalsContact O-CB 3.29Å; A477-R481 WeakPolarHBondContact O-CB 3.48Å; A477-R481 PolarHBondContact O-N 2.97Å
478F89.8Confident85.9Confident39 Ų3921.6 Ų21.617%0.17111%0.11CC..Hα-helixtrans-58.7-49.3173172-90.2000111.2L95 M99 S474 F475 S480 R481 L482L95-F478 HydrophobicContact CB-CD2 4.27Å; L95-F478 HydrophobicContact CB-CE2 4Å; L95-F478 HydrophobicContact CD2-CD2 3.7Å; L95-F478 HydrophobicContact CD2-CE2 3.76Å; L95-F478 HydrophobicContact CD2-CG 4.31Å; L95-F478 HydrophobicContact CD2-CZ 4.41Å; L95-F478 WeakPolarHBondContact CD2-O 3.2Å; L95-F478 HydrophobicContact CG-CE2 4.43Å; L95-F478 WeakPolarHBondContact O-CD2 3.04Å; M99-F478 HydrophobicContact CG-CB 4.24Å; M99-F478 HydrophobicContact CG-CD2 3.9Å; M99-F478 HydrophobicContact CG-CG 4.25Å; M99-F478 HydrophobicContact SD-CD2 3.82Å; M99-F478 HydrophobicContact SD-CE2 4.09Å; M99-F478 HydrophobicContact SD-CG 4.14Å; S474-F478 WeakPolarHBondContact O-CB 3.45Å; S474-F478 PolarHBondContact O-N 2.97Å; F475-F478 WeakPolarHBondContact O-CB 2.93Å; F475-F478 PolarHBondContact O-N 2.96Å; F478-S480 PolarHBondContact O-N 2.78Å; F478-R481 PolarHBondContact O-N 3.37Å; F478-L482 HydrophobicContact CD1-CD1 4.06Å; F478-L482 HydrophobicContact CE1-CD1 3.43Å; F478-L482 VanDerWaalsContact CE1-CD1 3.43Å; F478-L482 HydrophobicContact CE1-CG 4.15Å; F478-L482 HydrophobicContact CZ-CD1 3.91Å; F478-L482 HydrophobicContact CZ-CG 4.31Å; F478-L482 PolarHBondContact O-N 3.37Å
479V91.3Very high86.6Confident14 Ų1420.2 Ų20.29%0.08511%0.11CC..Hα-helixtrans-62.7-42.2177.3174.90000111.5G311 V314 L315 F475 V476 R481 L482 G483G311-V479 WeakPolarHBondContact O-CG1 3.49Å; V314-V479 HydrophobicContact CG1-CG1 4.46Å; L315-V479 HydrophobicContact CB-CG1 3.76Å; L315-V479 HydrophobicContact CD1-CG1 4.15Å; L315-V479 WeakPolarHBondContact CD1-O 3.38Å; F475-V479 HydrophobicContact CD1-CG2 4.2Å; F475-V479 HydrophobicContact CE1-CG2 3.69Å; F475-V479 HydrophobicContact CE2-CG2 4.1Å; F475-V479 HydrophobicContact CZ-CG2 3.63Å; F475-V479 WeakPolarHBondContact O-CG2 3.36Å; F475-V479 PolarHBondContact O-N 3.5Å; V476-V479 PolarHBondContact O-N 3.46Å; V479-R481 VanDerWaalsContact C-N 3.31Å; V479-R481 PolarHBondContact O-N 2.84Å; V479-L482 WeakPolarHBondContact O-CB 3.45Å; V479-L482 PolarHBondContact O-N 3.29Å; V479-G483 PolarHBondContact O-N 3.28Å; V479-G483 VanDerWaalsContact O-N 3.16Å
480S92Very high87.3Confident20 Ų2023.5 Ų23.514%0.1413%0.13CC..Hα-helixtrans-60.1-43.9174.9-580000111.1V314 S318 V476 A477 F478 L482 G483 V484V314-S480 WeakPolarHBondContact CG1-OG 3.17Å; S318-S480 WeakPolarHBondContact CB-O 3.45Å; S318-S480 PolarHBondContact OG-O 3.47Å; V476-S480 WeakPolarHBondContact O-CB 3.25Å; V476-S480 PolarHBondContact O-N 3.15Å; V476-S480 PolarHBondContact O-OG 3.5Å; A477-S480 PolarHBondContact O-N 3.1Å; F478-S480 PolarHBondContact O-N 2.78Å; S480-L482 VanDerWaalsContact C-N 3.34Å; S480-L482 PolarHBondContact O-N 3.46Å; S480-G483 WeakPolarHBondContact O-CA 3.23Å; S480-G483 PolarHBondContact O-N 3.29Å; S480-G483 VanDerWaalsContact O-N 3.08Å; S480-V484 VanDerWaalsContact O-CG2 3.25Å; S480-V484 WeakPolarHBondContact O-CG2 3.5Å; S480-V484 PolarHBondContact O-N 3.03Å
481R90.9Very high88.1Confident4 Ų423.7 Ų23.72%0.01513%0.131CC..Hα-helixtrans-66.2-35.2-179.7-167.7173.7-169.91124.5112.1R90 L91 G94 L95 D148 G153 L156 A477 F478 V479 G483 V484 L485R90-R481 PolarHBondContact O-NH2 2.9Å; L91-R481 HydrophobicContact CD2-CG 3.88Å; L91-R481 PolarHBondContact O-NE 2.99Å; G94-R481 VanDerWaalsContact C-NE 3.26Å; G94-R481 VanDerWaalsContact CA-CZ 3.42Å; L95-R481 HydrophobicContact CD2-CB 3.72Å; L95-R481 HydrophobicContact CD2-CG 3.86Å; L95-R481 HydrophobicContact CG-CG 4.15Å; D148-R481 IonicContact OD2-NH2 3.7Å; G153-R481 VanDerWaalsContact C-NH1 3.34Å; G153-R481 PolarHBondContact O-NH1 2.99Å; L156-R481 HydrophobicContact CD1-CB 3.69Å; L156-R481 HydrophobicContact CD1-CG 4.15Å; A477-R481 VanDerWaalsContact O-CB 3.29Å; A477-R481 WeakPolarHBondContact O-CB 3.48Å; A477-R481 PolarHBondContact O-N 2.97Å; F478-R481 PolarHBondContact O-N 3.37Å; V479-R481 VanDerWaalsContact C-N 3.31Å; V479-R481 PolarHBondContact O-N 2.84Å; R481-G483 VanDerWaalsContact C-N 3.31Å; R481-V484 PolarHBondContact O-N 3.43Å; R481-L485 WeakPolarHBondContact O-CB 3.42Å; R481-L485 PolarHBondContact O-N 3.38Å
482L92Very high88.6Confident58 Ų5821.7 Ų21.730%0.30412%0.121SC..Hα-helixtrans-59.9-42.9169.9-77.4174.3000111.3L95 L315 F478 V479 S480 L485 I486L95-L482 HydrophobicContact CD1-CD2 3.6Å; L95-L482 HydrophobicContact CD1-CG 4.37Å; L95-L482 HydrophobicContact CD2-CD2 3.94Å; L95-L482 HydrophobicContact CD2-CG 3.78Å; L95-L482 HydrophobicContact CG-CD2 4.45Å; L315-L482 HydrophobicContact CD1-CB 3.96Å; F478-L482 HydrophobicContact CD1-CD1 4.06Å; F478-L482 HydrophobicContact CE1-CD1 3.43Å; F478-L482 VanDerWaalsContact CE1-CD1 3.43Å; F478-L482 HydrophobicContact CE1-CG 4.15Å; F478-L482 HydrophobicContact CZ-CD1 3.91Å; F478-L482 HydrophobicContact CZ-CG 4.31Å; F478-L482 PolarHBondContact O-N 3.37Å; V479-L482 WeakPolarHBondContact O-CB 3.45Å; V479-L482 PolarHBondContact O-N 3.29Å; S480-L482 VanDerWaalsContact C-N 3.34Å; S480-L482 PolarHBondContact O-N 3.46Å; L482-L485 PolarHBondContact O-N 3.41Å; L482-I486 WeakPolarHBondContact O-CG1 3.5Å; L482-I486 PolarHBondContact O-N 3.2Å
483G92.1Very high88.7Confident0 Ų026 Ų260%015%0.145CC..Hα-helixtrans-63.9-42.1176.400000112.8S318 I319 V479 S480 R481 L485 I486 C487S318-G483 WeakPolarHBondContact OG-CA 3.48Å; I319-G483 VanDerWaalsContact CG1-CA 3.42Å; I319-G483 VanDerWaalsContact CG1-O 3.29Å; I319-G483 WeakPolarHBondContact CG1-O 3.28Å; V479-G483 PolarHBondContact O-N 3.28Å; V479-G483 VanDerWaalsContact O-N 3.16Å; S480-G483 WeakPolarHBondContact O-CA 3.23Å; S480-G483 PolarHBondContact O-N 3.29Å; S480-G483 VanDerWaalsContact O-N 3.08Å; R481-G483 VanDerWaalsContact C-N 3.31Å; G483-L485 PolarHBondContact O-N 3.5Å; G483-I486 PolarHBondContact O-N 2.95Å; G483-C487 PolarHBondContact O-N 3.28Å
484V91.3Very high88.8Confident15 Ų1528.3 Ų28.39%0.09116%0.156CC..Hα-helixtrans-61-44.3174-173.80000110.9L91 L156 S322 S480 R481 I486 C487 F488L91-V484 HydrophobicContact CD1-CB 4.38Å; L91-V484 HydrophobicContact CD1-CG1 3.75Å; L91-V484 HydrophobicContact CD2-CB 4.2Å; L91-V484 HydrophobicContact CD2-CG1 3.86Å; L91-V484 HydrophobicContact CG-CG1 4.49Å; L156-V484 HydrophobicContact CD1-CG2 3.98Å; S322-V484 VanDerWaalsContact OG-CG2 3.28Å; S322-V484 WeakPolarHBondContact OG-CG2 3.39Å; S480-V484 VanDerWaalsContact O-CG2 3.25Å; S480-V484 WeakPolarHBondContact O-CG2 3.5Å; S480-V484 PolarHBondContact O-N 3.03Å; R481-V484 PolarHBondContact O-N 3.43Å; V484-I486 PolarHBondContact O-N 2.82Å; V484-C487 WeakPolarHBondContact O-CB 3.5Å; V484-C487 PolarHBondContact O-N 2.8Å; V484-C487 VanDerWaalsContact O-N 3.12Å; V484-F488 HydrophobicContact CG1-CD2 3.63Å; V484-F488 HydrophobicContact CG1-CE2 3.55Å; V484-F488 VanDerWaalsContact O-CD2 3.32Å; V484-F488 WeakPolarHBondContact O-CD2 3.21Å; V484-F488 PolarHBondContact O-N 3.34Å
485L91.4Very high89Confident28 Ų2829.3 Ų29.315%0.14716%0.159CC..Hα-helixtrans-58.6-46.3176.5179.865.1000111.6L91 L92 L95 R481 L482 G483 C487 F488 S489L91-L485 HydrophobicContact CB-CB 4.24Å; L91-L485 HydrophobicContact CB-CD1 3.89Å; L91-L485 HydrophobicContact CD1-CB 4.44Å; L92-L485 HydrophobicContact CD1-CD2 4.48Å; L95-L485 HydrophobicContact CD1-CD2 3.89Å; R481-L485 WeakPolarHBondContact O-CB 3.42Å; R481-L485 PolarHBondContact O-N 3.38Å; L482-L485 PolarHBondContact O-N 3.41Å; G483-L485 PolarHBondContact O-N 3.5Å; L485-C487 VanDerWaalsContact C-N 3.27Å; L485-C487 PolarHBondContact O-N 3.28Å; L485-F488 PolarHBondContact O-N 3.48Å; L485-S489 WeakPolarHBondContact O-CB 3.46Å; L485-S489 PolarHBondContact O-N 3.42Å; L485-S489 PolarHBondContact O-OG 3.06Å; L485-S489 VanDerWaalsContact O-OG 3.11Å
486I91.8Very high88.8Confident68 Ų6831 Ų3135%0.34917%0.174SC..Hα-helixtrans-59-39.9176-67.6163.9000111I319 L482 G483 V484 V490 L491I319-I486 HydrophobicContact CD1-CB 4.38Å; I319-I486 HydrophobicContact CD1-CD1 4.13Å; I319-I486 HydrophobicContact CD1-CG2 4.12Å; I319-I486 HydrophobicContact CG1-CB 4.2Å; I319-I486 HydrophobicContact CG1-CG2 4.25Å; L482-I486 WeakPolarHBondContact O-CG1 3.5Å; L482-I486 PolarHBondContact O-N 3.2Å; G483-I486 PolarHBondContact O-N 2.95Å; V484-I486 PolarHBondContact O-N 2.82Å; I486-V490 HydrophobicContact CG2-CB 4.32Å; I486-V490 HydrophobicContact CG2-CG2 4.26Å; I486-V490 WeakPolarHBondContact O-CA 3.43Å; I486-V490 VanDerWaalsContact O-CB 3.23Å; I486-V490 WeakPolarHBondContact O-CB 3.38Å; I486-V490 PolarHBondContact O-N 3.34Å; I486-L491 PolarHBondContact O-N 2.83Å
487C90.7Very high88.7Confident1 Ų134.1 Ų34.11%0.00720%0.197CC..Iπ-helixtrans-60.6-52.6175.5179.90000111.8G483 V484 L485 S489 L491 I492G483-C487 PolarHBondContact O-N 3.28Å; V484-C487 WeakPolarHBondContact O-CB 3.5Å; V484-C487 PolarHBondContact O-N 2.8Å; V484-C487 VanDerWaalsContact O-N 3.12Å; L485-C487 VanDerWaalsContact C-N 3.27Å; L485-C487 PolarHBondContact O-N 3.28Å; C487-S489 VanDerWaalsContact C-N 3.33Å; C487-S489 PolarHBondContact O-N 2.87Å; C487-L491 HydrophobicContact CB-CD1 4.18Å; C487-L491 WeakPolarHBondContact O-CB 3.35Å; C487-L491 PolarHBondContact O-N 3.25Å; C487-L491 VanDerWaalsContact O-N 3.1Å; C487-I492 PolarHBondContact O-N 3.36Å; C487-I492 VanDerWaalsContact O-N 3.15Å
488F85.9Confident88.7Confident4 Ų435.1 Ų35.12%0.01820%0.202CC..Iπ-helixtrans-71.8-24-175.9-77.5-81.2000114.2S84 H87 L91 L325 Y326 V484 L485 I492S84-F488 PolarHBondContact OG-O 3.02Å; H87-F488 HydrophobicContact CB-CB 4.17Å; H87-F488 HydrophobicContact CB-CD1 3.71Å; H87-F488 HydrophobicContact CB-CD2 4.48Å; H87-F488 HydrophobicContact CB-CE1 4.23Å; H87-F488 HydrophobicContact CB-CG 3.88Å; H87-F488 AromaticContact CD2-CD1 3.79Å; H87-F488 AromaticContact CD2-CE1 3.69Å; H87-F488 AromaticContact CG-CD1 3.74Å; H87-F488 AromaticContact CG-CE1 3.77Å; L91-F488 HydrophobicContact CD1-CB 4.3Å; L91-F488 HydrophobicContact CD1-CD2 3.73Å; L91-F488 HydrophobicContact CD1-CE2 4.49Å; L91-F488 HydrophobicContact CD1-CG 4.3Å; L325-F488 HydrophobicContact CB-CZ 4.35Å; L325-F488 HydrophobicContact CD1-CZ 4.48Å; Y326-F488 HydrophobicContact CG-CE1 4.21Å; V484-F488 HydrophobicContact CG1-CD2 3.63Å; V484-F488 HydrophobicContact CG1-CE2 3.55Å; V484-F488 VanDerWaalsContact O-CD2 3.32Å; V484-F488 WeakPolarHBondContact O-CD2 3.21Å; V484-F488 PolarHBondContact O-N 3.34Å; L485-F488 PolarHBondContact O-N 3.48Å; F488-I492 HydrophobicContact CB-CD1 4.21Å; F488-I492 HydrophobicContact CD1-CD1 3.42Å; F488-I492 VanDerWaalsContact CD1-CD1 3.42Å; F488-I492 HydrophobicContact CE1-CD1 4.15Å; F488-I492 HydrophobicContact CG-CD1 4.16Å
489S85.5Confident88.3Confident49 Ų4935.8 Ų35.834%0.34321%0.209SC..Iπ-helixtrans-93.7-40.3177.6-53.90000113.2S88 L485 C487S88-S489 PolarHBondContact OG-OG 3.02Å; L485-S489 WeakPolarHBondContact O-CB 3.46Å; L485-S489 PolarHBondContact O-N 3.42Å; L485-S489 PolarHBondContact O-OG 3.06Å; L485-S489 VanDerWaalsContact O-OG 3.11Å; C487-S489 VanDerWaalsContact C-N 3.33Å; C487-S489 PolarHBondContact O-N 2.87Å
490V88.7Confident87.7Confident71 Ų7143.1 Ų43.143%0.4324%0.242SC..Iπ-helixtrans-103.2-53.2-172-175.20000112.1I486 I492 L493 I494I486-V490 HydrophobicContact CG2-CB 4.32Å; I486-V490 HydrophobicContact CG2-CG2 4.26Å; I486-V490 WeakPolarHBondContact O-CA 3.43Å; I486-V490 VanDerWaalsContact O-CB 3.23Å; I486-V490 WeakPolarHBondContact O-CB 3.38Å; I486-V490 PolarHBondContact O-N 3.34Å; V490-I492 VanDerWaalsContact C-N 3.33Å; V490-I492 PolarHBondContact O-N 2.95Å; V490-L493 WeakPolarHBondContact O-CB 3.29Å; V490-L493 PolarHBondContact O-N 3.39Å; V490-L493 VanDerWaalsContact O-N 3.1Å; V490-I494 HydrophobicContact CG1-CD1 3.91Å; V490-I494 HydrophobicContact CG1-CG1 4.48Å; V490-I494 WeakPolarHBondContact O-CG1 3.44Å; V490-I494 PolarHBondContact O-N 3.5Å
491L89.7Confident87.3Confident5 Ų549.8 Ų49.83%0.02628%0.275CS..Iπ-helixtrans-66.9-34.6-176.2-73.3173.2000112.3I319 T323 I327 I486 C487 L493 I494 Y495 V506 V509I319-L491 HydrophobicContact CG2-CD1 3.5Å; I319-L491 HydrophobicContact CG2-CG 4.44Å; T323-L491 HydrophobicContact CG2-CD1 3.79Å; I327-L491 HydrophobicContact CD1-CB 3.86Å; I486-L491 PolarHBondContact O-N 2.83Å; C487-L491 HydrophobicContact CB-CD1 4.18Å; C487-L491 WeakPolarHBondContact O-CB 3.35Å; C487-L491 PolarHBondContact O-N 3.25Å; C487-L491 VanDerWaalsContact O-N 3.1Å; L491-L493 VanDerWaalsContact C-N 3.31Å; L491-L493 PolarHBondContact O-N 2.97Å; L491-I494 HydrophobicContact CD2-CD1 4.26Å; L491-I494 PolarHBondContact O-N 3.45Å; L491-Y495 WeakPolarHBondContact O-CB 3.41Å; L491-Y495 PolarHBondContact O-N 2.94Å; L491-V506 HydrophobicContact CB-CG2 4.21Å; L491-V506 HydrophobicContact CD2-CG2 4.06Å; L491-V509 HydrophobicContact CD2-CG1 3.96Å
492I84.4Confident87.2Confident13 Ų1351.9 Ų51.97%0.06729%0.285CS..Hα-helixtrans-62.4-39.9172.3-67-175.9000111.1Y326 I327 C487 F488 V490 Y495 S496Y326-I492 HydrophobicContact CD1-CD1 3.5Å; Y326-I492 HydrophobicContact CD1-CG1 4.16Å; Y326-I492 HydrophobicContact CE1-CD1 3.8Å; Y326-I492 HydrophobicContact CG-CD1 4.42Å; I327-I492 HydrophobicContact CD1-CG1 4Å; I327-I492 HydrophobicContact CG1-CG1 3.99Å; C487-I492 PolarHBondContact O-N 3.36Å; C487-I492 VanDerWaalsContact O-N 3.15Å; F488-I492 HydrophobicContact CB-CD1 4.21Å; F488-I492 HydrophobicContact CD1-CD1 3.42Å; F488-I492 VanDerWaalsContact CD1-CD1 3.42Å; F488-I492 HydrophobicContact CE1-CD1 4.15Å; F488-I492 HydrophobicContact CG-CD1 4.16Å; V490-I492 VanDerWaalsContact C-N 3.33Å; V490-I492 PolarHBondContact O-N 2.95Å; I492-Y495 PolarHBondContact O-N 3.25Å; I492-S496 WeakPolarHBondContact O-CB 3.4Å; I492-S496 PolarHBondContact O-N 3.1Å
493L84.6Confident86.9Confident109 Ų10949.7 Ų49.757%0.57127%0.274SS*.Hα-helixtrans-68.1-39.8177.2-173.967000111.8V490 L491 S496 S497V490-L493 WeakPolarHBondContact O-CB 3.29Å; V490-L493 PolarHBondContact O-N 3.39Å; V490-L493 VanDerWaalsContact O-N 3.1Å; L491-L493 VanDerWaalsContact C-N 3.31Å; L491-L493 PolarHBondContact O-N 2.97Å; L493-S496 PolarHBondContact O-N 2.99Å; L493-S497 WeakPolarHBondContact O-CB 3.31Å; L493-S497 PolarHBondContact O-N 2.98Å; L493-S497 PolarHBondContact O-OG 3.5Å
494I88Confident86.7Confident50 Ų5049.7 Ų49.726%0.25627%0.274SS..Hα-helixtrans-61.3-47.1173-68.2168.5000109.9V490 L491 S497 T498V490-I494 HydrophobicContact CG1-CD1 3.91Å; V490-I494 HydrophobicContact CG1-CG1 4.48Å; V490-I494 WeakPolarHBondContact O-CG1 3.44Å; V490-I494 PolarHBondContact O-N 3.5Å; L491-I494 HydrophobicContact CD2-CD1 4.26Å; L491-I494 PolarHBondContact O-N 3.45Å; I494-S497 PolarHBondContact O-N 3.43Å; I494-S497 PolarHBondContact O-OG 2.74Å; I494-T498 HydrophobicContact CG2-CG2 4.37Å; I494-T498 WeakPolarHBondContact O-CB 3.44Å; I494-T498 WeakPolarHBondContact O-CG2 3.41Å; I494-T498 PolarHBondContact O-N 3.46Å; I494-T498 PolarHBondContact O-OG1 3.39Å
495Y86.5Confident86.7Confident26 Ų2649.9 Ų49.910%0.10228%0.277CS..Hα-helixtrans-58.4-51.7176179-106.1000110.9I327 I330 Y331 L491 I492 S497 T498 T499 P503 V506I327-Y495 HydrophobicContact CG2-CD2 4.14Å; I327-Y495 HydrophobicContact CG2-CG 4.17Å; I330-Y495 HydrophobicContact CB-CE1 4.27Å; I330-Y495 HydrophobicContact CG2-CE1 3.69Å; Y331-Y495 WeakPolarHBondContact CA-OH 3.24Å; Y331-Y495 HydrophobicContact CD2-CE2 4.15Å; L491-Y495 WeakPolarHBondContact O-CB 3.41Å; L491-Y495 PolarHBondContact O-N 2.94Å; I492-Y495 PolarHBondContact O-N 3.25Å; Y495-S497 VanDerWaalsContact C-N 3.29Å; Y495-S497 PolarHBondContact O-N 3.03Å; Y495-T498 PolarHBondContact O-N 3.42Å; Y495-T498 VanDerWaalsContact O-N 3.1Å; Y495-T498 PolarHBondContact O-OG1 3Å; Y495-T499 HydrophobicContact CD1-CG2 4.19Å; Y495-T499 HydrophobicContact CE1-CG2 3.92Å; Y495-T499 HydrophobicContact CE2-CG2 4.49Å; Y495-T499 WeakPolarHBondContact O-CG2 3.39Å; Y495-T499 PolarHBondContact O-N 3.49Å; Y495-P503 HydrophobicContact CE2-CB 4.24Å; Y495-V506 HydrophobicContact CD2-CB 4.28Å; Y495-V506 HydrophobicContact CD2-CG1 3.75Å
496S81.9Confident86.8Confident58 Ų5848.5 Ų48.541%0.40627%0.27SS..Hα-helixtrans-53.8-44178.7-175.60000112.5I492 L493 T499I492-S496 WeakPolarHBondContact O-CB 3.4Å; I492-S496 PolarHBondContact O-N 3.1Å; L493-S496 PolarHBondContact O-N 2.99Å; S496-T499 PolarHBondContact O-OG1 2.89Å
497S85.3Confident86.9Confident79 Ų7945.3 Ų45.355%0.55225%0.254SS*.Hα-helixtrans-75.4-27.4-178.957.20000113.6L493 I494 Y495L493-S497 WeakPolarHBondContact O-CB 3.31Å; L493-S497 PolarHBondContact O-N 2.98Å; L493-S497 PolarHBondContact O-OG 3.5Å; I494-S497 PolarHBondContact O-N 3.43Å; I494-S497 PolarHBondContact O-OG 2.74Å; Y495-S497 VanDerWaalsContact C-N 3.29Å; Y495-S497 PolarHBondContact O-N 3.03Å
498T88.3Confident87.1Confident27 Ų2748.1 Ų48.117%0.16627%0.268CS..Hα-helixtrans-94.1-9.3-177.954.60000113.9I494 Y495 H500 L501 F502 A505I494-T498 HydrophobicContact CG2-CG2 4.37Å; I494-T498 WeakPolarHBondContact O-CB 3.44Å; I494-T498 WeakPolarHBondContact O-CG2 3.41Å; I494-T498 PolarHBondContact O-N 3.46Å; I494-T498 PolarHBondContact O-OG1 3.39Å; Y495-T498 PolarHBondContact O-N 3.42Å; Y495-T498 VanDerWaalsContact O-N 3.1Å; Y495-T498 PolarHBondContact O-OG1 3Å; T498-H500 PolarHBondContact O-N 3.24Å; T498-H500 VanDerWaalsContact O-N 3.07Å; T498-L501 PolarHBondContact O-N 2.81Å; T498-F502 CarbonylContact O-C 3.23Å; T498-F502 VanDerWaalsContact O-C 3.23Å; T498-F502 PolarHBondContact O-N 3.29Å; T498-A505 HydrophobicContact CG2-CB 3.9Å
499T81.4Confident87.5Confident53 Ų5350.5 Ų50.533%0.32528%0.283SS..THydrogen-bonded Turntrans-48.3-38.5179.852.10000114.2Y495 S496Y495-T499 HydrophobicContact CD1-CG2 4.19Å; Y495-T499 HydrophobicContact CE1-CG2 3.92Å; Y495-T499 HydrophobicContact CE2-CG2 4.49Å; Y495-T499 WeakPolarHBondContact O-CG2 3.39Å; Y495-T499 PolarHBondContact O-N 3.49Å; S496-T499 PolarHBondContact O-OG1 2.89Å
500H79.6Confident88Confident168 Ų16848.2 Ų48.278%0.77827%0.267SS*.THydrogen-bonded Turntrans-80.1-26.1-179-70-75.4000114.6T498T498-H500 PolarHBondContact O-N 3.24Å; T498-H500 VanDerWaalsContact O-N 3.07Å
501L84.3Confident88.3Confident159 Ų15945 Ų4583%0.83225%0.248SC*.THydrogen-bonded Turntrans-99.8-54.6-174.9-74.7164.9000111.3T498T498-L501 PolarHBondContact O-N 2.81Å
502F89.1Confident88.6Confident48 Ų4848.1 Ų48.121%0.21127%0.27CS..  trans-157.587.9-175.9-171.8-115.9000109G425 L429 T498 G504 A505 L508G425-F502 WeakPolarHBondContact O-CZ 3.44Å; L429-F502 HydrophobicContact CD1-CE2 4.33Å; L429-F502 HydrophobicContact CD2-CD2 4.21Å; L429-F502 HydrophobicContact CD2-CE2 3.56Å; L429-F502 HydrophobicContact CG-CE2 3.82Å; L429-F502 HydrophobicContact CG-CZ 4.42Å; T498-F502 CarbonylContact O-C 3.23Å; T498-F502 VanDerWaalsContact O-C 3.23Å; T498-F502 PolarHBondContact O-N 3.29Å; F502-G504 VanDerWaalsContact CE1-C 3.42Å; F502-G504 PolarHBondContact O-N 3.23Å; F502-G504 VanDerWaalsContact O-N 3.12Å; F502-A505 HydrophobicContact CB-CB 4.48Å; F502-A505 VanDerWaalsContact CD1-CA 3.46Å; F502-A505 HydrophobicContact CD1-CB 3.71Å; F502-A505 HydrophobicContact CE1-CB 4.5Å; F502-A505 WeakPolarHBondContact O-CB 3.42Å; F502-A505 PolarHBondContact O-N 2.88Å; F502-L508 HydrophobicContact CD1-CD1 4.48Å; F502-L508 HydrophobicContact CE1-CD1 3.58Å; F502-L508 HydrophobicContact CE1-CG 4.21Å; F502-L508 HydrophobicContact CZ-CD1 4.26Å
503P84.6Confident89.2Confident12 Ų1249.4 Ų49.48%0.07828%0.277CS..THydrogen-bonded Turntrans-61.8-23.5-177.524.1-34000112.8Y331 H428 Y495 A505Y331-P503 HydrophobicContact CD2-CB 4.44Å; Y331-P503 HydrophobicContact CE2-CB 4.33Å; H428-P503 WeakPolarHBondContact CE1-CG 3.34Å; H428-P503 WeakPolarHBondContact ND1-CG 3.44Å; H428-P503 WeakPolarHBondContact NE2-CD 3.17Å; H428-P503 WeakPolarHBondContact NE2-CG 3.49Å; Y495-P503 HydrophobicContact CE2-CB 4.24Å; P503-A505 PolarHBondContact O-N 3.36Å
504G88.2Confident89.7Confident0 Ų044.3 Ų44.30%025%0.25CC..THydrogen-bonded Turntrans-69.9-9172.400000114.9G425 F502 V506 F507 L508G425-G504 WeakPolarHBondContact CA-O 3.39Å; F502-G504 VanDerWaalsContact CE1-C 3.42Å; F502-G504 PolarHBondContact O-N 3.23Å; F502-G504 VanDerWaalsContact O-N 3.12Å; G504-V506 VanDerWaalsContact C-N 3.26Å; G504-V506 PolarHBondContact O-N 3.38Å; G504-F507 PolarHBondContact O-N 3.23Å; G504-F507 VanDerWaalsContact O-N 3.11Å; G504-L508 PolarHBondContact O-N 3.17Å
505A92Very high90.1Very high19 Ų1945.6 Ų45.616%0.15726%0.257CS..Hα-helixtrans-56.4-40.7-17600000112.3T498 F502 P503 F507 L508 V509T498-A505 HydrophobicContact CG2-CB 3.9Å; F502-A505 HydrophobicContact CB-CB 4.48Å; F502-A505 VanDerWaalsContact CD1-CA 3.46Å; F502-A505 HydrophobicContact CD1-CB 3.71Å; F502-A505 HydrophobicContact CE1-CB 4.5Å; F502-A505 WeakPolarHBondContact O-CB 3.42Å; F502-A505 PolarHBondContact O-N 2.88Å; P503-A505 PolarHBondContact O-N 3.36Å; A505-F507 PolarHBondContact O-N 3.11Å; A505-L508 PolarHBondContact O-N 3Å; A505-V509 WeakPolarHBondContact O-CG2 3.46Å; A505-V509 PolarHBondContact O-N 3.28Å
506V92.4Very high90.5Very high0 Ų048 Ų480%027%0.271CS..Hα-helixtrans-58-36.5-178.670.30000111.9I327 L491 Y495 G504 V509 C510I327-V506 HydrophobicContact CD1-CG2 4.07Å; I327-V506 HydrophobicContact CG2-CG1 3.8Å; I327-V506 HydrophobicContact CG2-CG2 4.33Å; L491-V506 HydrophobicContact CB-CG2 4.21Å; L491-V506 HydrophobicContact CD2-CG2 4.06Å; Y495-V506 HydrophobicContact CD2-CB 4.28Å; Y495-V506 HydrophobicContact CD2-CG1 3.75Å; G504-V506 VanDerWaalsContact C-N 3.26Å; G504-V506 PolarHBondContact O-N 3.38Å; V506-V509 PolarHBondContact O-N 3.05Å; V506-C510 PolarHBondContact O-N 3.43Å; V506-C510 PolarHBondContact O-SG 3.4Å
507F94.3Very high91.2Very high0 Ų045.2 Ų45.20%025%0.252CS..Hα-helixtrans-76.2-29.9178.6-62.1-67.2000112.4I327 I328 Y331 R421 L424 G504 A505 C510 S511I327-F507 HydrophobicContact CG2-CZ 4.31Å; I328-F507 HydrophobicContact CG1-CZ 4.35Å; Y331-F507 HydrophobicContact CD1-CD2 4.48Å; Y331-F507 AromaticContact CD1-CE2 3.47Å; Y331-F507 HydrophobicContact CD1-CE2 3.47Å; Y331-F507 VanDerWaalsContact CD1-CE2 3.47Å; Y331-F507 AromaticContact CD1-CZ 3.95Å; Y331-F507 HydrophobicContact CD1-CZ 3.95Å; Y331-F507 AromaticContact CD2-CE2 3.73Å; Y331-F507 HydrophobicContact CD2-CE2 3.73Å; Y331-F507 HydrophobicContact CE1-CD2 4.3Å; Y331-F507 AromaticContact CE1-CE2 3.69Å; Y331-F507 HydrophobicContact CE1-CE2 3.69Å; Y331-F507 HydrophobicContact CE1-CZ 4.48Å; Y331-F507 HydrophobicContact CE2-CD2 4.34Å; Y331-F507 AromaticContact CE2-CE2 3.93Å; Y331-F507 HydrophobicContact CE2-CE2 3.93Å; Y331-F507 AromaticContact CG-CE2 3.47Å; Y331-F507 HydrophobicContact CG-CE2 3.47Å; Y331-F507 VanDerWaalsContact CG-CE2 3.47Å; Y331-F507 HydrophobicContact CG-CZ 4.03Å; Y331-F507 AromaticContact CZ-CE2 3.9Å; R421-F507 WeakPolarHBondContact O-CB 3.35Å; L424-F507 HydrophobicContact CB-CB 4.42Å; L424-F507 HydrophobicContact CB-CD1 4.32Å; L424-F507 HydrophobicContact CB-CD2 4.28Å; L424-F507 HydrophobicContact CB-CG 4.08Å; L424-F507 HydrophobicContact CD1-CD1 4.45Å; L424-F507 HydrophobicContact CD1-CE1 4.38Å; G504-F507 PolarHBondContact O-N 3.23Å; G504-F507 VanDerWaalsContact O-N 3.11Å; A505-F507 PolarHBondContact O-N 3.11Å; F507-C510 CarbonylContact O-C 3.53Å; F507-C510 WeakPolarHBondContact O-CB 3.31Å; F507-C510 PolarHBondContact O-N 3Å; F507-S511 PolarHBondContact O-N 3.47Å; F507-S511 PolarHBondContact O-OG 3.36Å
508L94.5Very high91.7Very high61 Ų6143 Ų4332%0.31923%0.233SC..Hα-helixtrans-69.5-37.7171.6-63-175.4000112.1F502 G504 A505 C510 S511 S512F502-L508 HydrophobicContact CD1-CD1 4.48Å; F502-L508 HydrophobicContact CE1-CD1 3.58Å; F502-L508 HydrophobicContact CE1-CG 4.21Å; F502-L508 HydrophobicContact CZ-CD1 4.26Å; G504-L508 PolarHBondContact O-N 3.17Å; A505-L508 PolarHBondContact O-N 3Å; L508-C510 VanDerWaalsContact C-N 3.29Å; L508-C510 PolarHBondContact O-N 3.04Å; L508-S511 PolarHBondContact O-N 3.46Å; L508-S512 PolarHBondContact O-N 3.49Å; L508-S512 PolarHBondContact O-OG 3.49Å
509V94.6Very high92Very high54 Ų5447.1 Ų47.133%0.32725%0.253SS..Hα-helixtrans-59.9-44.5169.8175.30000109.7L491 A505 V506 S511 S512 L513L491-V509 HydrophobicContact CD2-CG1 3.96Å; A505-V509 WeakPolarHBondContact O-CG2 3.46Å; A505-V509 PolarHBondContact O-N 3.28Å; V506-V509 PolarHBondContact O-N 3.05Å; V509-S511 PolarHBondContact O-N 2.84Å; V509-S512 WeakPolarHBondContact O-CB 3.45Å; V509-S512 PolarHBondContact O-N 2.98Å; V509-L513 PolarHBondContact O-N 3.5Å
510C95.2Very high92.6Very high0 Ų045.4 Ų45.40%024%0.242CC..Hα-helixtrans-62-42.1174.7-68.50000113V320 R421 V506 F507 L508 S512 L513 I514V320-C510 HydrophobicContact CG1-CB 3.81Å; V320-C510 HydrophobicContact CG2-CB 4.13Å; R421-C510 HydrophobicContact CG-CB 4.33Å; V506-C510 PolarHBondContact O-N 3.43Å; V506-C510 PolarHBondContact O-SG 3.4Å; F507-C510 CarbonylContact O-C 3.53Å; F507-C510 WeakPolarHBondContact O-CB 3.31Å; F507-C510 PolarHBondContact O-N 3Å; L508-C510 VanDerWaalsContact C-N 3.29Å; L508-C510 PolarHBondContact O-N 3.04Å; C510-S512 PolarHBondContact O-N 2.97Å; C510-L513 PolarHBondContact O-N 2.93Å; C510-I514 WeakPolarHBondContact O-CG1 3.31Å; C510-I514 PolarHBondContact O-N 2.83Å
511S95.5Very high93.2Very high5 Ų537.4 Ų37.44%0.03521%0.205CC..Hα-helixtrans-58.5-38.4174.1-69.80000111.7F418 R421 T422 F507 L508 V509 I514 L515F418-S511 WeakPolarHBondContact CD2-O 3.23Å; F418-S511 WeakPolarHBondContact CE2-O 3.46Å; R421-S511 VanDerWaalsContact C-OG 3.31Å; R421-S511 VanDerWaalsContact CB-OG 3.28Å; R421-S511 WeakPolarHBondContact CB-OG 3.44Å; T422-S511 WeakPolarHBondContact CA-OG 3.39Å; T422-S511 PolarHBondContact N-OG 3.41Å; T422-S511 VanDerWaalsContact N-OG 3.1Å; T422-S511 PolarHBondContact OG1-OG 3.18Å; F507-S511 PolarHBondContact O-N 3.47Å; F507-S511 PolarHBondContact O-OG 3.36Å; L508-S511 PolarHBondContact O-N 3.46Å; V509-S511 PolarHBondContact O-N 2.84Å; S511-I514 PolarHBondContact O-N 3.36Å; S511-L515 WeakPolarHBondContact O-CB 3.36Å; S511-L515 PolarHBondContact O-N 3.25Å
512S96Very high93.6Very high70 Ų7031.3 Ų31.349%0.4918%0.181SC..Hα-helixtrans-66.4-42177.1-54.30000111.7L508 V509 C510 L515 I516L508-S512 PolarHBondContact O-N 3.49Å; L508-S512 PolarHBondContact O-OG 3.49Å; V509-S512 WeakPolarHBondContact O-CB 3.45Å; V509-S512 PolarHBondContact O-N 2.98Å; C510-S512 PolarHBondContact O-N 2.97Å; S512-L515 WeakPolarHBondContact O-CB 3.48Å; S512-L515 PolarHBondContact O-N 3.42Å; S512-I516 WeakPolarHBondContact O-CG1 3.41Å; S512-I516 PolarHBondContact O-N 3.46Å; S512-I516 VanDerWaalsContact O-N 3.16Å
513L96.2Very high93.7Very high40 Ų4035 Ų3521%0.20920%0.197CC..Hα-helixtrans-64.6-39.9173.8-66.5175.4000112.3L316 I319 V320 V509 C510 L515 I516 A517L316-L513 HydrophobicContact CD2-CD2 4.11Å; I319-L513 HydrophobicContact CG2-CD1 3.83Å; V320-L513 HydrophobicContact CG2-CB 3.85Å; V320-L513 HydrophobicContact CG2-CD1 4.24Å; V509-L513 PolarHBondContact O-N 3.5Å; C510-L513 PolarHBondContact O-N 2.93Å; L513-L515 VanDerWaalsContact C-N 3.32Å; L513-L515 PolarHBondContact O-N 3.14Å; L513-I516 PolarHBondContact O-N 2.86Å; L513-A517 PolarHBondContact O-N 3.47Å
514I95.6Very high93.9Very high1 Ų134.4 Ų34.41%0.00519%0.194CC..Hα-helixtrans-63.4-40.3174.3-67.2169.6000110.5V320 I414 M417 F418 R421 C510 S511 I516 A517 L518V320-I514 HydrophobicContact CB-CG1 4.23Å; V320-I514 HydrophobicContact CG1-CD1 3.59Å; V320-I514 HydrophobicContact CG1-CG1 3.77Å; V320-I514 HydrophobicContact CG2-CG1 4.06Å; I414-I514 HydrophobicContact CG2-CG2 3.66Å; I414-I514 WeakPolarHBondContact O-CG2 3.45Å; M417-I514 HydrophobicContact CB-CD1 4.02Å; M417-I514 HydrophobicContact CE-CD1 4.38Å; F418-I514 HydrophobicContact CB-CB 4.47Å; F418-I514 HydrophobicContact CB-CG2 3.69Å; F418-I514 HydrophobicContact CD2-CG2 4.48Å; R421-I514 HydrophobicContact CB-CD1 4.1Å; R421-I514 HydrophobicContact CG-CD1 3.49Å; R421-I514 VanDerWaalsContact CG-CD1 3.49Å; C510-I514 WeakPolarHBondContact O-CG1 3.31Å; C510-I514 PolarHBondContact O-N 2.83Å; S511-I514 PolarHBondContact O-N 3.36Å; I514-I516 VanDerWaalsContact C-N 3.28Å; I514-I516 PolarHBondContact O-N 3.32Å; I514-A517 CarbonylContact O-C 3.58Å; I514-A517 WeakPolarHBondContact O-CA 3.28Å; I514-A517 WeakPolarHBondContact O-CB 3.32Å; I514-A517 PolarHBondContact O-N 3.34Å; I514-A517 VanDerWaalsContact O-N 3.08Å; I514-L518 WeakPolarHBondContact O-CB 3.37Å; I514-L518 PolarHBondContact O-N 3.1Å
515L96.2Very high93.9Very high77 Ų7737.3 Ų37.340%0.40321%0.205SC..Hα-helixtrans-60.3-41.2177.9-174.764.7000111.2F418 S511 S512 L513 L518 I519F418-L515 HydrophobicContact CD2-CB 4.4Å; F418-L515 HydrophobicContact CE2-CB 4.21Å; S511-L515 WeakPolarHBondContact O-CB 3.36Å; S511-L515 PolarHBondContact O-N 3.25Å; S512-L515 WeakPolarHBondContact O-CB 3.48Å; S512-L515 PolarHBondContact O-N 3.42Å; L513-L515 VanDerWaalsContact C-N 3.32Å; L513-L515 PolarHBondContact O-N 3.14Å; L515-L518 WeakPolarHBondContact O-CB 3.19Å; L515-L518 PolarHBondContact O-N 3.48Å; L515-I519 HydrophobicContact CG-CD1 4.27Å; L515-I519 VanDerWaalsContact O-CG1 3.31Å; L515-I519 WeakPolarHBondContact O-CG1 3.49Å; L515-I519 PolarHBondContact O-N 2.93Å
516I96.6Very high93.5Very high77 Ų7737.9 Ų37.940%0.39521%0.213SC..Hα-helixtrans-62.1-43.7173.1-61.9167.1000110.5F312 L316 S512 L513 I514 L518 I519 T520F312-I516 HydrophobicContact CE1-CG2 4.06Å; F312-I516 HydrophobicContact CZ-CG2 4.32Å; L316-I516 HydrophobicContact CD1-CB 4.14Å; L316-I516 HydrophobicContact CD1-CG2 3.74Å; S512-I516 WeakPolarHBondContact O-CG1 3.41Å; S512-I516 PolarHBondContact O-N 3.46Å; S512-I516 VanDerWaalsContact O-N 3.16Å; L513-I516 PolarHBondContact O-N 2.86Å; I514-I516 VanDerWaalsContact C-N 3.28Å; I514-I516 PolarHBondContact O-N 3.32Å; I516-L518 VanDerWaalsContact C-N 3.31Å; I516-L518 PolarHBondContact O-N 2.89Å; I516-I519 PolarHBondContact O-N 3.1Å; I516-T520 WeakPolarHBondContact O-CB 3.49Å; I516-T520 PolarHBondContact O-N 2.89Å; I516-T520 PolarHBondContact O-OG1 2.8Å
517A95.5Very high93Very high0 Ų040.9 Ų40.90%023%0.229CC..Hα-helixtrans-62.4-38.3176.800000112L316 L513 I514 T520 T521L316-A517 HydrophobicContact CB-CB 3.94Å; L316-A517 HydrophobicContact CD1-CB 3.82Å; L513-A517 PolarHBondContact O-N 3.47Å; I514-A517 CarbonylContact O-C 3.58Å; I514-A517 WeakPolarHBondContact O-CA 3.28Å; I514-A517 WeakPolarHBondContact O-CB 3.32Å; I514-A517 PolarHBondContact O-N 3.34Å; I514-A517 VanDerWaalsContact O-N 3.08Å; A517-T520 PolarHBondContact O-N 3.38Å; A517-T521 WeakPolarHBondContact O-CB 3.12Å; A517-T521 PolarHBondContact O-N 3.25Å; A517-T521 PolarHBondContact O-OG1 3.26Å
518L95.7Very high92.2Very high33 Ų3341.1 Ų41.117%0.17323%0.23CC..Hα-helixtrans-64.9-47.5177.3-172.467.6000111.3I411 I414 F415 I514 L515 I516 T520 T521 G522I411-L518 HydrophobicContact CG2-CD1 3.92Å; I411-L518 WeakPolarHBondContact O-CD1 3.29Å; I414-L518 HydrophobicContact CB-CD1 4.14Å; I414-L518 HydrophobicContact CG2-CB 3.93Å; I414-L518 HydrophobicContact CG2-CD1 3.9Å; F415-L518 HydrophobicContact CB-CD1 4.29Å; F415-L518 HydrophobicContact CD2-CD2 4.18Å; I514-L518 WeakPolarHBondContact O-CB 3.37Å; I514-L518 PolarHBondContact O-N 3.1Å; L515-L518 WeakPolarHBondContact O-CB 3.19Å; L515-L518 PolarHBondContact O-N 3.48Å; I516-L518 VanDerWaalsContact C-N 3.31Å; I516-L518 PolarHBondContact O-N 2.89Å; L518-T520 VanDerWaalsContact C-N 3.33Å; L518-T520 PolarHBondContact O-N 2.93Å; L518-T521 PolarHBondContact O-N 3.03Å; L518-G522 PolarHBondContact O-N 3.18Å
519I95.4Very high91.2Very high112 Ų11240.1 Ų40.157%0.57423%0.225SC*.Hα-helixtrans-60.7-45.1176.2-66.8165.1000110.2L515 I516 T521 G522 F523L515-I519 HydrophobicContact CG-CD1 4.27Å; L515-I519 VanDerWaalsContact O-CG1 3.31Å; L515-I519 WeakPolarHBondContact O-CG1 3.49Å; L515-I519 PolarHBondContact O-N 2.93Å; I516-I519 PolarHBondContact O-N 3.1Å; I519-T521 VanDerWaalsContact C-N 3.34Å; I519-T521 PolarHBondContact O-N 3.45Å; I519-G522 PolarHBondContact O-N 2.96Å; I519-F523 PolarHBondContact O-N 2.77Å
520T93.6Very high90Very high17 Ų1740.9 Ų40.910%0.10423%0.23CC..Hα-helixtrans-61.5-42.3178.4-55.90000111.5L309 F312 I313 I516 A517 L518 F523 L524L309-T520 HydrophobicContact CD1-CG2 3.27Å; L309-T520 HydrophobicContact CG-CG2 3.71Å; F312-T520 HydrophobicContact CD1-CG2 3.88Å; I313-T520 HydrophobicContact CD1-CG2 4.14Å; I313-T520 HydrophobicContact CG1-CG2 3.72Å; I516-T520 WeakPolarHBondContact O-CB 3.49Å; I516-T520 PolarHBondContact O-N 2.89Å; I516-T520 PolarHBondContact O-OG1 2.8Å; A517-T520 PolarHBondContact O-N 3.38Å; L518-T520 VanDerWaalsContact C-N 3.33Å; L518-T520 PolarHBondContact O-N 2.93Å; T520-F523 WeakPolarHBondContact O-CB 3.13Å; T520-F523 PolarHBondContact O-N 2.86Å; T520-L524 PolarHBondContact O-N 3.47Å
521T92.6Very high88.4Confident0 Ų044 Ų440%025%0.252CS..Hα-helixtrans-68.1-37.9177.1-52.20000111.4I313 L407 L410 I411 I414 A517 L518 I519 F523 L524 Y525I313-T521 WeakPolarHBondContact CD1-OG1 3.26Å; L407-T521 HydrophobicContact CD2-CG2 4.47Å; L410-T521 HydrophobicContact CD2-CG2 3.81Å; L410-T521 HydrophobicContact CG-CG2 4.09Å; I411-T521 HydrophobicContact CD1-CG2 4.47Å; I411-T521 HydrophobicContact CG1-CG2 3.66Å; I414-T521 HydrophobicContact CD1-CG2 4.36Å; I414-T521 WeakPolarHBondContact CD1-OG1 3.14Å; A517-T521 WeakPolarHBondContact O-CB 3.12Å; A517-T521 PolarHBondContact O-N 3.25Å; A517-T521 PolarHBondContact O-OG1 3.26Å; L518-T521 PolarHBondContact O-N 3.03Å; I519-T521 VanDerWaalsContact C-N 3.34Å; I519-T521 PolarHBondContact O-N 3.45Å; T521-F523 VanDerWaalsContact C-N 3.34Å; T521-L524 WeakPolarHBondContact O-CB 3.33Å; T521-L524 PolarHBondContact O-N 3.18Å; T521-Y525 PolarHBondContact O-N 2.88Å
522G92.4Very high86.6Confident32 Ų3245.6 Ų45.633%0.3326%0.261SS..Hα-helixtrans-61.9-40.817200000112.5L518 I519 Y525 G526L518-G522 PolarHBondContact O-N 3.18Å; I519-G522 PolarHBondContact O-N 2.96Å; G522-Y525 PolarHBondContact O-N 3.25Å; G522-G526 PolarHBondContact O-N 3.01Å
523F90.6Very high84.6Confident124 Ų12446.4 Ų46.454%0.54426%0.26SS..Hα-helixtrans-63.9-41.9173.4-176.8-106.7000111.9L309 I519 T520 T521 Y525 G526 L527L309-F523 HydrophobicContact CD1-CD1 4.4Å; L309-F523 HydrophobicContact CD2-CD1 3.88Å; I519-F523 PolarHBondContact O-N 2.77Å; T520-F523 WeakPolarHBondContact O-CB 3.13Å; T520-F523 PolarHBondContact O-N 2.86Å; T521-F523 VanDerWaalsContact C-N 3.34Å; F523-Y525 VanDerWaalsContact C-N 3.33Å; F523-Y525 PolarHBondContact O-N 3.46Å; F523-G526 PolarHBondContact O-N 3.21Å; F523-G526 VanDerWaalsContact O-N 3.16Å; F523-L527 HydrophobicContact CD1-CD1 3.92Å; F523-L527 HydrophobicContact CD1-CG 4.35Å; F523-L527 HydrophobicContact CE1-CD1 3.46Å; F523-L527 VanDerWaalsContact CE1-CD1 3.46Å; F523-L527 HydrophobicContact CE1-CD2 4.43Å; F523-L527 HydrophobicContact CE1-CG 4Å; F523-L527 HydrophobicContact CZ-CD1 3.99Å; F523-L527 HydrophobicContact CZ-CD2 4.12Å; F523-L527 HydrophobicContact CZ-CG 4.11Å; F523-L527 WeakPolarHBondContact O-CG 3.39Å; F523-L527 PolarHBondContact O-N 3.07Å
524L88.8Confident82.4Confident0 Ų049.4 Ų49.40%028%0.275CS..Hα-helixtrans-57.8-45.6174.2-175.755.3000111.6Q306 L309 I310 I313 L407 W463 T520 T521 G526 L527 T528Q306-L524 HydrophobicContact CB-CD1 4.39Å; Q306-L524 HydrophobicContact CG-CD1 4.25Å; L309-L524 HydrophobicContact CB-CD1 4.48Å; L309-L524 HydrophobicContact CD2-CB 3.43Å; L309-L524 VanDerWaalsContact CD2-CB 3.43Å; L309-L524 HydrophobicContact CD2-CD1 3.73Å; L309-L524 HydrophobicContact CD2-CG 4.04Å; L309-L524 HydrophobicContact CG-CB 4.35Å; I310-L524 HydrophobicContact CD1-CD2 4.48Å; I310-L524 HydrophobicContact CG1-CD2 3.82Å; I313-L524 HydrophobicContact CD1-CD2 3.94Å; L407-L524 HydrophobicContact CD1-CG 4.4Å; L407-L524 HydrophobicContact CD2-CD2 3.75Å; L407-L524 HydrophobicContact CD2-CG 4.09Å; W463-L524 HydrophobicContact CH2-CD1 3.78Å; W463-L524 HydrophobicContact CH2-CD2 3.98Å; W463-L524 HydrophobicContact CH2-CG 4.18Å; W463-L524 HydrophobicContact CZ3-CD1 4.2Å; W463-L524 HydrophobicContact CZ3-CD2 4.41Å; T520-L524 PolarHBondContact O-N 3.47Å; T521-L524 WeakPolarHBondContact O-CB 3.33Å; T521-L524 PolarHBondContact O-N 3.18Å; L524-G526 VanDerWaalsContact C-N 3.34Å; L524-G526 PolarHBondContact O-N 2.7Å; L524-L527 PolarHBondContact O-N 3.15Å; L524-T528 WeakPolarHBondContact O-CG2 3.41Å; L524-T528 PolarHBondContact O-N 3.26Å; L524-T528 PolarHBondContact O-OG1 3.33Å
525Y88.2Confident80.2Confident61 Ų6150.9 Ų50.924%0.23929%0.29CS..Hα-helixtrans-62.5-38.3175.8175.5-99.9000112.8N404 L407 K408 I411 T521 G522 F523 T528 N529N404-Y525 HydrophobicContact CB-CE2 4.09Å; L407-Y525 HydrophobicContact CB-CD2 3.96Å; L407-Y525 HydrophobicContact CD1-CD2 4.37Å; K408-Y525 HydrophobicContact CD-CE2 4.46Å; K408-Y525 WeakPolarHBondContact CE-OH 3.44Å; K408-Y525 HydrophobicContact CG-CE2 3.95Å; I411-Y525 HydrophobicContact CD1-CG 4.36Å; T521-Y525 PolarHBondContact O-N 2.88Å; G522-Y525 PolarHBondContact O-N 3.25Å; F523-Y525 VanDerWaalsContact C-N 3.33Å; F523-Y525 PolarHBondContact O-N 3.46Å; Y525-T528 PolarHBondContact O-N 3.05Å; Y525-T528 PolarHBondContact O-OG1 3.35Å; Y525-N529 WeakPolarHBondContact CE1-ND2 3.47Å; Y525-N529 PolarHBondContact O-N 3.12Å; Y525-N529 PolarHBondContact O-ND2 3.39Å; Y525-N529 PolarHBondContact OH-ND2 2.67Å
526G83.9Confident77.8Confident31 Ų3152.1 Ų52.132%0.3229%0.294SS..Hα-helixtrans-60.8-46.9172.700000112.2G522 F523 L524 T528 N529 T530G522-G526 PolarHBondContact O-N 3.01Å; F523-G526 PolarHBondContact O-N 3.21Å; F523-G526 VanDerWaalsContact O-N 3.16Å; L524-G526 VanDerWaalsContact C-N 3.34Å; L524-G526 PolarHBondContact O-N 2.7Å; G526-T528 PolarHBondContact O-N 2.89Å; G526-N529 PolarHBondContact O-N 3.32Å; G526-T530 WeakPolarHBondContact O-CG2 3.45Å; G526-T530 PolarHBondContact O-N 3.13Å; G526-T530 PolarHBondContact O-OG1 3.19Å
527L82.3Confident75.1Confident64 Ų6455.2 Ų55.234%0.33531%0.309SS..Hα-helixtrans-63.7-37.7178.5-70.6178.5000113.2L309 F523 L524 T530 S531L309-L527 HydrophobicContact CD2-CD1 4.44Å; F523-L527 HydrophobicContact CD1-CD1 3.92Å; F523-L527 HydrophobicContact CD1-CG 4.35Å; F523-L527 HydrophobicContact CE1-CD1 3.46Å; F523-L527 VanDerWaalsContact CE1-CD1 3.46Å; F523-L527 HydrophobicContact CE1-CD2 4.43Å; F523-L527 HydrophobicContact CE1-CG 4Å; F523-L527 HydrophobicContact CZ-CD1 3.99Å; F523-L527 HydrophobicContact CZ-CD2 4.12Å; F523-L527 HydrophobicContact CZ-CG 4.11Å; F523-L527 WeakPolarHBondContact O-CG 3.39Å; F523-L527 PolarHBondContact O-N 3.07Å; L524-L527 PolarHBondContact O-N 3.15Å; L527-T530 PolarHBondContact O-OG1 3.3Å; L527-S531 PolarHBondContact O-N 3.18Å
528T77.6Confident72.8Confident4 Ų461.3 Ų61.33%0.02534%0.337CS..Hα-helixtrans-68.6-37.2177.554.80000111.6V403 N404 L407 W463 L524 Y525 G526 S531V403-T528 HydrophobicContact CG1-CG2 4.13Å; N404-T528 PolarHBondContact OD1-OG1 3.34Å; L407-T528 HydrophobicContact CD1-CG2 3.89Å; W463-T528 HydrophobicContact CZ2-CG2 4.31Å; L524-T528 WeakPolarHBondContact O-CG2 3.41Å; L524-T528 PolarHBondContact O-N 3.26Å; L524-T528 PolarHBondContact O-OG1 3.33Å; Y525-T528 PolarHBondContact O-N 3.05Å; Y525-T528 PolarHBondContact O-OG1 3.35Å; G526-T528 PolarHBondContact O-N 2.89Å; T528-S531 PolarHBondContact O-OG 2.82Å
529N73.5Confident70.4Confident41 Ų4162.1 Ų62.122%0.21934%0.341CS..Hα-helixtrans-68.6-47176.4-71.8-31.9000112.9N404 Y525 G526 S531 V532 D533N404-N529 VanDerWaalsContact CG-OD1 3.24Å; N404-N529 PolarHBondContact ND2-OD1 3.36Å; N404-N529 PolarHBondContact OD1-OD1 3.36Å; Y525-N529 WeakPolarHBondContact CE1-ND2 3.47Å; Y525-N529 PolarHBondContact O-N 3.12Å; Y525-N529 PolarHBondContact O-ND2 3.39Å; Y525-N529 PolarHBondContact OH-ND2 2.67Å; G526-N529 PolarHBondContact O-N 3.32Å; N529-S531 PolarHBondContact O-N 3.24Å; N529-V532 WeakPolarHBondContact O-CB 3.48Å; N529-V532 PolarHBondContact O-N 2.9Å; N529-D533 PolarHBondContact O-N 3.5Å
530T68.1Low68.4Low69 Ų6960.3 Ų60.342%0.42334%0.336SS..Hα-helixtrans-62.9-32.1-179.153.30000112.3G526 L527 V532 D533 I534G526-T530 WeakPolarHBondContact O-CG2 3.45Å; G526-T530 PolarHBondContact O-N 3.13Å; G526-T530 PolarHBondContact O-OG1 3.19Å; L527-T530 PolarHBondContact O-OG1 3.3Å; T530-V532 PolarHBondContact O-N 3.1Å; T530-D533 PolarHBondContact O-N 3.36Å; T530-I534 WeakPolarHBondContact O-CG1 3.46Å; T530-I534 PolarHBondContact O-N 3.47Å
531S62.1Low66.3Low67 Ų6762.2 Ų62.247%0.46935%0.35SS..Hα-helixtrans-62.6-29.2174.573.30000113.4L527 T528 N529 G535L527-S531 PolarHBondContact O-N 3.18Å; T528-S531 PolarHBondContact O-OG 2.82Å; N529-S531 PolarHBondContact O-N 3.24Å; S531-G535 PolarHBondContact O-N 3.44Å
532V57.1Low64.3Low38 Ų3867 Ų6723%0.2337%0.372CS..Hα-helixtrans-74.2-44174.2-178.70000110.9C400 N529 T530 G535 Q536C400-V532 HydrophobicContact CB-CG2 3.75Å; C400-V532 WeakPolarHBondContact SG-CG2 3.4Å; N529-V532 WeakPolarHBondContact O-CB 3.48Å; N529-V532 PolarHBondContact O-N 2.9Å; T530-V532 PolarHBondContact O-N 3.1Å; V532-G535 PolarHBondContact O-N 3.26Å; V532-Q536 WeakPolarHBondContact O-CG 3.29Å; V532-Q536 PolarHBondContact O-N 2.9Å
533D54.8Low62.2Low87 Ų8769.7 Ų69.747%0.46538%0.379SS..Hα-helixtrans-66.4-41.7-175.3-64.3-27.2000111.2N529 T530 Q536 M537N529-D533 PolarHBondContact O-N 3.5Å; T530-D533 PolarHBondContact O-N 3.36Å; D533-Q536 PolarHBondContact O-N 2.96Å; D533-M537 WeakPolarHBondContact O-CG 3.21Å; D533-M537 PolarHBondContact O-N 3.4Å
534I50.3Low60.2Low103 Ų10369.3 Ų69.353%0.52838%0.38SS..Hα-helixtrans-64-44.1176.1-64.1167.7000110.6T530 Q536 M537 E538T530-I534 WeakPolarHBondContact O-CG1 3.46Å; T530-I534 PolarHBondContact O-N 3.47Å; I534-Q536 PolarHBondContact O-N 3.22Å; I534-M537 PolarHBondContact O-N 2.84Å; I534-M537 VanDerWaalsContact O-N 3.14Å; I534-E538 PolarHBondContact O-N 3.45Å
535G49Very low58.5Low31 Ų3176.2 Ų76.232%0.3241%0.41SS..Hα-helixtrans-62.6-28.7176.400000113.2S531 V532 N539S531-G535 PolarHBondContact O-N 3.44Å; V532-G535 PolarHBondContact O-N 3.26Å; G535-N539 PolarHBondContact O-ND2 2.87Å
536Q44.7Very low56.6Low104 Ų10480.1 Ų80.149%0.48643%0.426SS..Hα-helixtrans-76.2-39173.1-72.1-17711.400112.3V532 D533 I534 N539 T540V532-Q536 WeakPolarHBondContact O-CG 3.29Å; V532-Q536 PolarHBondContact O-N 2.9Å; D533-Q536 PolarHBondContact O-N 2.96Å; I534-Q536 PolarHBondContact O-N 3.22Å; Q536-N539 PolarHBondContact O-N 2.69Å; Q536-T540 PolarHBondContact O-N 3.1Å; Q536-T540 VanDerWaalsContact O-N 3.11Å; Q536-T540 PolarHBondContact O-OG1 2.98Å
537M40.5Very low55.2Low141 Ų14183 Ų8370%0.69544%0.438SS*.Hα-helixtrans-68.7-40.8-179.5-73.2-162.1178.500113.9D533 I534 N539 T540 S541D533-M537 WeakPolarHBondContact O-CG 3.21Å; D533-M537 PolarHBondContact O-N 3.4Å; I534-M537 PolarHBondContact O-N 2.84Å; I534-M537 VanDerWaalsContact O-N 3.14Å; M537-N539 VanDerWaalsContact C-N 3.28Å; M537-N539 PolarHBondContact O-N 2.96Å; M537-T540 WeakPolarHBondContact CA-OG1 3.37Å; M537-T540 PolarHBondContact O-N 3.09Å; M537-T540 PolarHBondContact O-OG1 2.97Å; M537-T540 VanDerWaalsContact O-OG1 3.12Å; M537-S541 PolarHBondContact O-N 2.94Å; M537-S541 VanDerWaalsContact O-N 3.11Å
538E47.8Very low53.8Low128 Ų12885.7 Ų85.760%0.59845%0.452SS*.Hα-helixtrans-62.2-39.5175.2-82.1-177.1155.600111.2I534 S541 E542I534-E538 PolarHBondContact O-N 3.45Å; E538-S541 WeakPolarHBondContact O-CB 3.43Å; E538-S541 PolarHBondContact O-N 2.93Å; E538-S541 PolarHBondContact O-OG 3.25Å; E538-E542 PolarHBondContact O-N 3.06Å
539N45.6Very low52.7Low50 Ų5092.8 Ų92.827%0.26749%0.485SS..Hα-helixtrans-67.8-37178.4-87.5-68.6000113.6K393 G535 Q536 M537 S541 E542 N543K393-N539 WeakPolarHBondContact CE-OD1 3.38Å; K393-N539 PolarHBondContact NZ-OD1 3.25Å; G535-N539 PolarHBondContact O-ND2 2.87Å; Q536-N539 PolarHBondContact O-N 2.69Å; M537-N539 VanDerWaalsContact C-N 3.28Å; M537-N539 PolarHBondContact O-N 2.96Å; N539-S541 VanDerWaalsContact C-N 3.29Å; N539-E542 PolarHBondContact O-N 3.35Å; N539-N543 WeakPolarHBondContact O-CB 3.47Å; N539-N543 VanDerWaalsContact O-CG 3.32Å; N539-N543 PolarHBondContact O-N 3.49Å
540T52.9Low51.9Low74 Ų7498.1 Ų98.145%0.45451%0.512SS..Hα-helixtrans-66.4-34.7171.916.90000111.4Q536 M537 M544Q536-T540 PolarHBondContact O-N 3.1Å; Q536-T540 VanDerWaalsContact O-N 3.11Å; Q536-T540 PolarHBondContact O-OG1 2.98Å; M537-T540 WeakPolarHBondContact CA-OG1 3.37Å; M537-T540 PolarHBondContact O-N 3.09Å; M537-T540 PolarHBondContact O-OG1 2.97Å; M537-T540 VanDerWaalsContact O-OG1 3.12Å; T540-M544 WeakPolarHBondContact O-CB 3.45Å; T540-M544 WeakPolarHBondContact O-CG 3.49Å; T540-M544 PolarHBondContact O-N 3.4Å
541S49.9Very low50.7Low57 Ų57101.5 Ų101.540%0.39954%0.538SS..Hα-helixtrans-68.7-39.6176.184.80000112.7M537 E538 N539 M544 K545M537-S541 PolarHBondContact O-N 2.94Å; M537-S541 VanDerWaalsContact O-N 3.11Å; E538-S541 WeakPolarHBondContact O-CB 3.43Å; E538-S541 PolarHBondContact O-N 2.93Å; E538-S541 PolarHBondContact O-OG 3.25Å; N539-S541 VanDerWaalsContact C-N 3.29Å; S541-M544 PolarHBondContact O-N 3.25Å; S541-K545 PolarHBondContact O-N 3.03Å
542E50.8Low50.1Low102 Ų102103.3 Ų103.348%0.47754%0.542SS..Hα-helixtrans-68.4-45.7174.8-78.4-170.5155.900111.4E538 N539 M544 K545 Y546E538-E542 PolarHBondContact O-N 3.06Å; N539-E542 PolarHBondContact O-N 3.35Å; E542-M544 VanDerWaalsContact C-N 3.27Å; E542-M544 PolarHBondContact O-N 3.26Å; E542-K545 WeakPolarHBondContact O-CA 3.49Å; E542-K545 WeakPolarHBondContact O-CB 3.48Å; E542-K545 PolarHBondContact O-N 3.23Å; E542-Y546 HydrophobicContact CB-CE2 4.46Å; E542-Y546 WeakPolarHBondContact O-CD2 3.46Å; E542-Y546 PolarHBondContact O-N 3.36Å
543N46.7Very low49.7Very low87 Ų87106.7 Ų106.747%0.46556%0.558SS.*Hα-helixtrans-60-38175.8-76.2-9.9000111.7N539 Y546 T547N539-N543 WeakPolarHBondContact O-CB 3.47Å; N539-N543 VanDerWaalsContact O-CG 3.32Å; N539-N543 PolarHBondContact O-N 3.49Å; N543-Y546 PolarHBondContact O-N 3.16Å; N543-T547 WeakPolarHBondContact O-CB 3.47Å; N543-T547 PolarHBondContact O-N 2.83Å; N543-T547 PolarHBondContact O-OG1 3.37Å
544M49.8Very low49.4Very low116 Ų116107.8 Ų107.857%0.57156%0.564SS**Hα-helixtrans-66-36.4173-80.1-172.3-117.500112.8T540 S541 E542 T547 N548T540-M544 WeakPolarHBondContact O-CB 3.45Å; T540-M544 WeakPolarHBondContact O-CG 3.49Å; T540-M544 PolarHBondContact O-N 3.4Å; S541-M544 PolarHBondContact O-N 3.25Å; E542-M544 VanDerWaalsContact C-N 3.27Å; E542-M544 PolarHBondContact O-N 3.26Å; M544-T547 PolarHBondContact O-N 2.84Å; M544-N548 WeakPolarHBondContact O-CB 3.46Å; M544-N548 VanDerWaalsContact O-CG 3.29Å; M544-N548 PolarHBondContact O-N 3.47Å; M544-N548 VanDerWaalsContact O-N 3.07Å; M544-N548 PolarHBondContact O-ND2 3.05Å
545K52.1Low49.4Very low146 Ų146108.1 Ų108.164%0.63557%0.566SS**Hα-helixtrans-63.9-42.2173.5-78.9179.1179.1175.40112.3S541 E542 Q549S541-K545 PolarHBondContact O-N 3.03Å; E542-K545 WeakPolarHBondContact O-CA 3.49Å; E542-K545 WeakPolarHBondContact O-CB 3.48Å; E542-K545 PolarHBondContact O-N 3.23Å; K545-Q549 PolarHBondContact O-N 3.08Å
546Y49.3Very low49.4Very low142 Ų142112.9 Ų112.956%0.55758%0.581SS**Hα-helixtrans-70.6-36.7177.4-73.3-69000112.5E542 N543 N548 Q549 I550E542-Y546 HydrophobicContact CB-CE2 4.46Å; E542-Y546 WeakPolarHBondContact O-CD2 3.46Å; E542-Y546 PolarHBondContact O-N 3.36Å; N543-Y546 PolarHBondContact O-N 3.16Å; Y546-N548 VanDerWaalsContact C-N 3.32Å; Y546-N548 PolarHBondContact O-N 3.08Å; Y546-Q549 PolarHBondContact O-N 3.22Å; Y546-I550 WeakPolarHBondContact O-CG1 3.4Å; Y546-I550 PolarHBondContact O-N 3.07Å
547T53.5Low49.7Very low93 Ų93113.5 Ų113.557%0.57159%0.587SS**Hα-helixtrans-65.6-37.8177.1-46.10000111.2N543 M544 Q549 I550 S551N543-T547 WeakPolarHBondContact O-CB 3.47Å; N543-T547 PolarHBondContact O-N 2.83Å; N543-T547 PolarHBondContact O-OG1 3.37Å; M544-T547 PolarHBondContact O-N 2.84Å; T547-Q549 VanDerWaalsContact C-N 3.29Å; T547-Q549 PolarHBondContact O-N 3Å; T547-I550 PolarHBondContact O-N 3.4Å; T547-S551 PolarHBondContact O-N 3Å
548N54.4Low50.4Low120 Ų120111.5 Ų111.564%0.64258%0.58SS**Hα-helixtrans-75.9-9176.5-70.9-12.2000114.5M544 Y546M544-N548 WeakPolarHBondContact O-CB 3.46Å; M544-N548 VanDerWaalsContact O-CG 3.29Å; M544-N548 PolarHBondContact O-N 3.47Å; M544-N548 VanDerWaalsContact O-N 3.07Å; M544-N548 PolarHBondContact O-ND2 3.05Å; Y546-N548 VanDerWaalsContact C-N 3.32Å; Y546-N548 PolarHBondContact O-N 3.08Å
549Q53.5Low50.6Low153 Ų153110.2 Ų110.272%0.71558%0.578SS**Hα-helixtrans-95.1-10.9173-79.4-174.1-22.100113.1K545 Y546 T547K545-Q549 PolarHBondContact O-N 3.08Å; Y546-Q549 PolarHBondContact O-N 3.22Å; T547-Q549 VanDerWaalsContact C-N 3.29Å; T547-Q549 PolarHBondContact O-N 3Å
550I56.1Low51Low152 Ų152115.3 Ų115.378%0.77960%0.604SS**Hα-helixtrans-104-16-178.8-62.5169.5000111.5Y546 T547Y546-I550 WeakPolarHBondContact O-CG1 3.4Å; Y546-I550 PolarHBondContact O-N 3.07Å; T547-I550 PolarHBondContact O-N 3.4Å
551S43.2Very low50.9Low141 Ų141119 Ų11999%0.98662%0.618SS**  trans-87.70165.162.20000111.5T547T547-S551 PolarHBondContact O-N 3Å

Retrieved 551 of 551 residues in 177.7 ms (Link to these results)

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