A0A087X8H3_POEFO Loading...

Hyccin PI4KA lipid kinase complex subunit 1

AlphaFold DB , UniProt , Accession A0A087X8H3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 427 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
1M49.5Very low77Confident190 Ų19088.7 Ų88.794%0.93648%0.479SS*.  0-51.70-147.9170.7-8600111.1A3 M4 D5M1-A3 PolarHBondContact O-N 2.92Å; M1-M4 PolarHBondContact O-N 2.77Å; M1-M4 VanDerWaalsContact O-N 3.11Å; M1-D5 PolarHBondContact O-N 2.99Å
2L52.7Low78.5Confident122 Ų12281.6 Ų81.664%0.63944%0.44SS*.Hα-helixtrans-53.2-46.5174.9-77.7155000114.9M4 D5 Q6L2-M4 VanDerWaalsContact C-N 3.29Å; L2-M4 PolarHBondContact O-N 3.21Å; L2-D5 PolarHBondContact O-N 3.25Å; L2-Q6 PolarHBondContact O-N 3.29Å
3A62.2Low79.8Confident82 Ų8276.2 Ų76.268%0.67841%0.411SS*.Hα-helixtrans-68.1-25.3178.700000114.1M1 G7M1-A3 PolarHBondContact O-N 2.92Å; A3-G7 PolarHBondContact O-N 3.28Å
4M63.3Low80.7Confident149 Ų14975.4 Ų75.473%0.73441%0.414SS*.Hα-helixtrans-76.1-41.1177.8-78.5174.3144.600111.1M1 L2 Q6 G7 V8M1-M4 PolarHBondContact O-N 2.77Å; M1-M4 VanDerWaalsContact O-N 3.11Å; L2-M4 VanDerWaalsContact C-N 3.29Å; L2-M4 PolarHBondContact O-N 3.21Å; M4-Q6 VanDerWaalsContact C-N 3.32Å; M4-Q6 PolarHBondContact O-N 3.38Å; M4-G7 PolarHBondContact O-N 2.9Å; M4-V8 WeakPolarHBondContact O-CG2 3.34Å; M4-V8 PolarHBondContact O-N 3.28Å
5D73.9Confident81.4Confident52 Ų5274.7 Ų74.728%0.27841%0.407SS..Hα-helixtrans-64.3-39.6177.4-58-24.4000111.2M1 L2 V9 A40 K43M1-D5 PolarHBondContact O-N 2.99Å; L2-D5 PolarHBondContact O-N 3.25Å; D5-V9 WeakPolarHBondContact O-CG2 3.35Å; D5-V9 PolarHBondContact O-N 3.4Å; D5-A40 HydrophobicContact CB-CB 4.24Å; D5-K43 IonicContact OD2-NZ 3.12Å; D5-K43 PolarHBondContact OD2-NZ 3.14Å
6Q82.8Confident82Confident92 Ų9272.1 Ų72.143%0.4339%0.391SS..Hα-helixtrans-64.7-45.8176.7175.6159.76.100111.9L2 M4 V8 V9 E10 L52L2-Q6 PolarHBondContact O-N 3.29Å; M4-Q6 VanDerWaalsContact C-N 3.32Å; M4-Q6 PolarHBondContact O-N 3.38Å; Q6-V8 VanDerWaalsContact C-N 3.32Å; Q6-V8 PolarHBondContact O-N 3.22Å; Q6-V9 PolarHBondContact O-N 2.88Å; Q6-E10 HydrophobicContact CG-CG 4.43Å; Q6-E10 WeakPolarHBondContact CG-OE1 3.5Å; Q6-E10 PolarHBondContact NE2-OE1 3.27Å; Q6-E10 WeakPolarHBondContact O-CG 3.16Å; Q6-E10 PolarHBondContact O-N 2.89Å; Q6-L52 HydrophobicContact CB-CD1 4.37Å; Q6-L52 HydrophobicContact CG-CD1 3.79Å
7G88.8Confident82.5Confident31 Ų3177.3 Ų77.332%0.3241%0.409SS..Hα-helixtrans-60.5-37.9177.900000113.5A3 M4 V9 E10 E11A3-G7 PolarHBondContact O-N 3.28Å; M4-G7 PolarHBondContact O-N 2.9Å; G7-V9 VanDerWaalsContact C-N 3.35Å; G7-V9 PolarHBondContact O-N 3.39Å; G7-E10 PolarHBondContact O-N 3.09Å; G7-E11 WeakPolarHBondContact O-CB 3.39Å; G7-E11 PolarHBondContact O-N 3.26Å
8V93.3Very high82.9Confident38 Ų3879.6 Ų79.623%0.2343%0.426CS..Hα-helixtrans-63.6-40.3176.5171.60000111.7M4 Q6 W12 L37M4-V8 WeakPolarHBondContact O-CG2 3.34Å; M4-V8 PolarHBondContact O-N 3.28Å; Q6-V8 VanDerWaalsContact C-N 3.32Å; Q6-V8 PolarHBondContact O-N 3.22Å; V8-W12 WeakPolarHBondContact O-CB 3.44Å; V8-W12 PolarHBondContact O-N 3.42Å; V8-W12 VanDerWaalsContact O-N 3.08Å; V8-L37 HydrophobicContact CG1-CB 4.4Å; V8-L37 HydrophobicContact CG1-CD1 4.35Å
9V93.7Very high83.2Confident0 Ų077.6 Ų77.60%042%0.415CS..Hα-helixtrans-71-42.2178.7177.40000110.7D5 Q6 G7 W12 L13 A40 L41 V44 L52 V56D5-V9 WeakPolarHBondContact O-CG2 3.35Å; D5-V9 PolarHBondContact O-N 3.4Å; Q6-V9 PolarHBondContact O-N 2.88Å; G7-V9 VanDerWaalsContact C-N 3.35Å; G7-V9 PolarHBondContact O-N 3.39Å; V9-W12 HydrophobicContact CG1-CE3 4.41Å; V9-W12 PolarHBondContact O-N 3.13Å; V9-L13 HydrophobicContact CG1-CD1 4.15Å; V9-L13 HydrophobicContact CG1-CG 4.4Å; V9-L13 VanDerWaalsContact O-CG 3.26Å; V9-L13 WeakPolarHBondContact O-CG 3.33Å; V9-L13 PolarHBondContact O-N 3.01Å; V9-A40 HydrophobicContact CG2-CB 3.69Å; V9-L41 HydrophobicContact CG1-CD2 4.22Å; V9-L41 HydrophobicContact CG2-CD2 4.29Å; V9-V44 HydrophobicContact CG2-CG2 4.27Å; V9-L52 HydrophobicContact CB-CD1 4.02Å; V9-L52 HydrophobicContact CG1-CD1 3.96Å; V9-V56 HydrophobicContact CG1-CG2 3.58Å
10E93.6Very high83.5Confident91 Ų9177.5 Ų77.543%0.42542%0.419SS..Hα-helixtrans-62.5-42.7176.9-72.3172.7-17500112.2Q6 G7 L13 S14 L52Q6-E10 HydrophobicContact CG-CG 4.43Å; Q6-E10 WeakPolarHBondContact CG-OE1 3.5Å; Q6-E10 PolarHBondContact NE2-OE1 3.27Å; Q6-E10 WeakPolarHBondContact O-CG 3.16Å; Q6-E10 PolarHBondContact O-N 2.89Å; G7-E10 PolarHBondContact O-N 3.09Å; E10-L13 PolarHBondContact O-N 3.18Å; E10-S14 WeakPolarHBondContact O-CB 3.26Å; E10-S14 PolarHBondContact O-N 3.01Å; E10-S14 PolarHBondContact O-OG 3.44Å; E10-L52 HydrophobicContact CG-CD2 3.82Å
11E93.2Very high83.7Confident129 Ų12980.5 Ų80.560%0.60344%0.435SS*.Hα-helixtrans-59.5-49.3173.7-174.7179.3-175.500110.7G7 L13 S14 E15G7-E11 WeakPolarHBondContact O-CB 3.39Å; G7-E11 PolarHBondContact O-N 3.26Å; E11-L13 VanDerWaalsContact C-N 3.31Å; E11-L13 PolarHBondContact O-N 3.1Å; E11-S14 PolarHBondContact O-N 3.13Å; E11-S14 VanDerWaalsContact O-N 3.08Å; E11-S14 PolarHBondContact O-OG 3.41Å; E11-E15 WeakPolarHBondContact O-CB 3.38Å; E11-E15 PolarHBondContact O-N 3.19Å
12W95.1Very high85.6Confident3 Ų376.6 Ų76.61%0.01143%0.426CS..Hα-helixtrans-58.7-39.2176.917074.7000113.3V8 V9 F16 Y27 L37 L41 V56 Q59 L60 F63 F74V8-W12 WeakPolarHBondContact O-CB 3.44Å; V8-W12 PolarHBondContact O-N 3.42Å; V8-W12 VanDerWaalsContact O-N 3.08Å; V9-W12 HydrophobicContact CG1-CE3 4.41Å; V9-W12 PolarHBondContact O-N 3.13Å; W12-F16 PolarHBondContact O-N 3.42Å; W12-Y27 PolarHBondContact NE1-OH 3.41Å; W12-L37 HydrophobicContact CB-CD1 3.71Å; W12-L37 HydrophobicContact CB-CD2 4.45Å; W12-L37 HydrophobicContact CD2-CD1 3.92Å; W12-L37 HydrophobicContact CD2-CD2 4.26Å; W12-L37 HydrophobicContact CE3-CD1 4.38Å; W12-L37 HydrophobicContact CG-CD1 3.61Å; W12-L37 HydrophobicContact CG-CD2 3.78Å; W12-L37 HydrophobicContact CG-CG 4.35Å; W12-L41 HydrophobicContact CE3-CD2 4.13Å; W12-L41 HydrophobicContact CH2-CD2 4.33Å; W12-L41 HydrophobicContact CZ3-CD2 3.86Å; W12-V56 HydrophobicContact CZ3-CG2 4.11Å; W12-Q59 VanDerWaalsContact CD2-NE2 3.32Å; W12-Q59 HydrophobicContact CH2-CB 3.81Å; W12-Q59 HydrophobicContact CH2-CG 3.56Å; W12-Q59 HydrophobicContact CZ2-CG 3.78Å; W12-Q59 HydrophobicContact CZ3-CB 4.19Å; W12-Q59 HydrophobicContact CZ3-CG 4.14Å; W12-Q59 PolarHBondContact O-NE2 2.92Å; W12-L60 HydrophobicContact CH2-CD2 4.38Å; W12-F63 AromaticContact CE2-CZ 3.83Å; W12-F63 HydrophobicContact CZ2-CD2 4.39Å; W12-F63 HydrophobicContact CZ2-CE1 4.34Å; W12-F63 AromaticContact CZ2-CE2 3.54Å; W12-F63 HydrophobicContact CZ2-CE2 3.54Å; W12-F63 AromaticContact CZ2-CZ 3.49Å; W12-F63 HydrophobicContact CZ2-CZ 3.49Å; W12-F63 VanDerWaalsContact CZ2-CZ 3.49Å; W12-F63 AromaticContact NE1-CE2 3.99Å; W12-F63 AromaticContact NE1-CZ 3.69Å; W12-F74 HydrophobicContact CZ2-CE1 4.17Å
13L95Very high87.4Confident12 Ų1272 Ų726%0.06341%0.406CS..Hα-helixtrans-65.7-40.9174.9-71.1170000111.5V9 E10 E11 K17 L52 P55 Q59V9-L13 HydrophobicContact CG1-CD1 4.15Å; V9-L13 HydrophobicContact CG1-CG 4.4Å; V9-L13 VanDerWaalsContact O-CG 3.26Å; V9-L13 WeakPolarHBondContact O-CG 3.33Å; V9-L13 PolarHBondContact O-N 3.01Å; E10-L13 PolarHBondContact O-N 3.18Å; E11-L13 VanDerWaalsContact C-N 3.31Å; E11-L13 PolarHBondContact O-N 3.1Å; L13-K17 VanDerWaalsContact O-CG 3.29Å; L13-K17 WeakPolarHBondContact O-CG 3.34Å; L13-K17 PolarHBondContact O-N 3.17Å; L13-L52 HydrophobicContact CD1-CD2 4.31Å; L13-P55 HydrophobicContact CD1-CB 3.94Å; L13-P55 HydrophobicContact CD1-CG 4.04Å; L13-P55 HydrophobicContact CD2-CB 4.17Å; L13-Q59 HydrophobicContact CD2-CB 3.99Å; L13-Q59 VanDerWaalsContact CD2-OE1 3.27Å
14S92.6Very high88.8Confident65 Ų6569.5 Ų69.546%0.45538%0.381SS..Hα-helixtrans-71.1-39.3-179.4730000113E10 E11 K17 T18E10-S14 WeakPolarHBondContact O-CB 3.26Å; E10-S14 PolarHBondContact O-N 3.01Å; E10-S14 PolarHBondContact O-OG 3.44Å; E11-S14 PolarHBondContact O-N 3.13Å; E11-S14 VanDerWaalsContact O-N 3.08Å; E11-S14 PolarHBondContact O-OG 3.41Å; S14-K17 PolarHBondContact O-N 3.32Å; S14-T18 PolarHBondContact O-N 3.06Å; S14-T18 PolarHBondContact O-OG1 3.3Å
15E92.1Very high90.1Very high65 Ų6565.2 Ų65.230%0.30437%0.369SS..Hα-helixtrans-63.7-44.3-179.4-173-173.5165.300111.1E11 T18 L19 Y27 K34E11-E15 WeakPolarHBondContact O-CB 3.38Å; E11-E15 PolarHBondContact O-N 3.19Å; E15-T18 PolarHBondContact O-N 2.56Å; E15-T18 PolarHBondContact O-OG1 3.08Å; E15-T18 VanDerWaalsContact O-OG1 3.13Å; E15-L19 PolarHBondContact O-N 2.88Å; E15-Y27 HydrophobicContact CG-CE2 4.01Å; E15-Y27 WeakPolarHBondContact OE1-CE2 3.36Å; E15-K34 IonicContact OE1-NZ 2.87Å; E15-K34 PolarHBondContact OE1-NZ 3.36Å; E15-K34 IonicContact OE2-NZ 2.77Å; E15-K34 PolarHBondContact OE2-NZ 2.94Å
16F90.5Very high90.9Very high33 Ų3367.8 Ų67.815%0.14539%0.387CS..Hα-helixtrans-69.9-37.7179.9-172-106000112.8W12 T18 L19 Y27 Q59 E62 F63W12-F16 PolarHBondContact O-N 3.42Å; F16-T18 PolarHBondContact O-N 3.22Å; F16-L19 HydrophobicContact CD2-CD2 4.32Å; F16-L19 HydrophobicContact CE2-CD2 4.4Å; F16-L19 VanDerWaalsContact O-CB 3.26Å; F16-L19 WeakPolarHBondContact O-CB 3.43Å; F16-L19 PolarHBondContact O-N 2.73Å; F16-L19 VanDerWaalsContact O-N 3.1Å; F16-Y27 HydrophobicContact CD2-CD1 4.05Å; F16-Y27 AromaticContact CD2-CE1 3.73Å; F16-Y27 HydrophobicContact CD2-CE1 3.73Å; F16-Y27 HydrophobicContact CE2-CD1 4.41Å; F16-Y27 HydrophobicContact CE2-CE1 4.37Å; F16-Q59 VanDerWaalsContact CB-NE2 3.25Å; F16-Q59 HydrophobicContact CD1-CG 3.89Å; F16-Q59 HydrophobicContact CE1-CG 4.43Å; F16-Q59 HydrophobicContact CG-CG 4.38Å; F16-E62 HydrophobicContact CE1-CB 4.33Å; F16-F63 HydrophobicContact CB-CE1 4.4Å; F16-F63 HydrophobicContact CD1-CD1 4.36Å; F16-F63 AromaticContact CD1-CE1 3.72Å; F16-F63 HydrophobicContact CD1-CE1 3.72Å; F16-F63 HydrophobicContact CD2-CD1 4.31Å; F16-F63 AromaticContact CD2-CE1 3.39Å; F16-F63 HydrophobicContact CD2-CE1 3.39Å; F16-F63 HydrophobicContact CD2-CZ 4.04Å; F16-F63 AromaticContact CE1-CD1 3.91Å; F16-F63 HydrophobicContact CE1-CD1 3.91Å; F16-F63 AromaticContact CE1-CE1 3.69Å; F16-F63 HydrophobicContact CE1-CE1 3.69Å; F16-F63 AromaticContact CE2-CD1 3.85Å; F16-F63 HydrophobicContact CE2-CD1 3.85Å; F16-F63 AromaticContact CE2-CE1 3.37Å; F16-F63 HydrophobicContact CE2-CE1 3.37Å; F16-F63 HydrophobicContact CE2-CZ 4.29Å; F16-F63 AromaticContact CG-CE1 3.56Å; F16-F63 HydrophobicContact CG-CE1 3.56Å; F16-F63 HydrophobicContact CG-CZ 4.27Å; F16-F63 AromaticContact CZ-CD1 3.62Å; F16-F63 HydrophobicContact CZ-CD1 3.62Å; F16-F63 AromaticContact CZ-CE1 3.52Å; F16-F63 HydrophobicContact CZ-CE1 3.52Å
17K89.8Confident91.4Very high160 Ų16063.7 Ų63.770%0.69637%0.368SS*.Hα-helixtrans-60-27.6177.8-77.7175.2-177.9-178.60113.8L13 S14L13-K17 VanDerWaalsContact O-CG 3.29Å; L13-K17 WeakPolarHBondContact O-CG 3.34Å; L13-K17 PolarHBondContact O-N 3.17Å; S14-K17 PolarHBondContact O-N 3.32Å
18T89.4Confident91.5Very high119 Ų11962.7 Ų62.773%0.7336%0.356SS*.THydrogen-bonded Turntrans-97.2-0.9-178.858.70000112.8S14 E15 F16S14-T18 PolarHBondContact O-N 3.06Å; S14-T18 PolarHBondContact O-OG1 3.3Å; E15-T18 PolarHBondContact O-N 2.56Å; E15-T18 PolarHBondContact O-OG1 3.08Å; E15-T18 VanDerWaalsContact O-OG1 3.13Å; F16-T18 PolarHBondContact O-N 3.22Å
19L89.6Confident91.3Very high41 Ų4162.7 Ų62.722%0.21536%0.36CS..  trans-78.6128.3-173.9-15992000111E15 F16 A23 I24 Y27E15-L19 PolarHBondContact O-N 2.88Å; F16-L19 HydrophobicContact CD2-CD2 4.32Å; F16-L19 HydrophobicContact CE2-CD2 4.4Å; F16-L19 VanDerWaalsContact O-CB 3.26Å; F16-L19 WeakPolarHBondContact O-CB 3.43Å; F16-L19 PolarHBondContact O-N 2.73Å; F16-L19 VanDerWaalsContact O-N 3.1Å; L19-A23 HydrophobicContact CD1-CB 4.21Å; L19-A23 HydrophobicContact CD2-CB 4.29Å; L19-A23 HydrophobicContact CG-CB 4.03Å; L19-I24 HydrophobicContact CD2-CB 4.42Å; L19-I24 HydrophobicContact CD2-CG1 3.95Å; L19-Y27 HydrophobicContact CD1-CD2 3.95Å; L19-Y27 HydrophobicContact CD1-CG 4.24Å; L19-Y27 HydrophobicContact CD2-CD1 4.42Å; L19-Y27 HydrophobicContact CD2-CD2 4.42Å; L19-Y27 HydrophobicContact CD2-CG 3.93Å
20P89.9Confident91.2Very high76 Ų7664.2 Ų64.249%0.49437%0.371SS..  trans-72.5151.6172.230-34.2000111.3S22 A23P20-S22 PolarHBondContact O-N 3.48Å; P20-S22 VanDerWaalsContact O-N 3.09Å; P20-A23 HydrophobicContact CG-CB 3.91Å; P20-A23 PolarHBondContact O-N 3.08Å
21D86.3Confident90.9Very high141 Ų14160.1 Ų60.175%0.75435%0.352SS*.G310 helixtrans-54.8-33.8-178.6-67.9-19.6000113.5A23 I24D21-A23 PolarHBondContact O-N 2.95Å; D21-I24 HydrophobicContact CB-CD1 4.3Å; D21-I24 WeakPolarHBondContact O-CG1 3.39Å; D21-I24 PolarHBondContact O-N 3.34Å
22S89Confident90.4Very high107 Ų10761.9 Ų61.975%0.74836%0.357SS*.G310 helixtrans-66-21.8178.258.20000113.9P20P20-S22 PolarHBondContact O-N 3.48Å; P20-S22 VanDerWaalsContact O-N 3.09Å
23A91.8Very high89.9Confident27 Ų2768.7 Ų68.722%0.22339%0.39CS..G310 helixtrans-96.9-5.5-177.900000113.6L19 P20 D21 A25 T26 Y27L19-A23 HydrophobicContact CD1-CB 4.21Å; L19-A23 HydrophobicContact CD2-CB 4.29Å; L19-A23 HydrophobicContact CG-CB 4.03Å; P20-A23 HydrophobicContact CG-CB 3.91Å; P20-A23 PolarHBondContact O-N 3.08Å; D21-A23 PolarHBondContact O-N 2.95Å; A23-A25 VanDerWaalsContact C-N 3.32Å; A23-A25 PolarHBondContact O-N 3.37Å; A23-T26 PolarHBondContact O-N 3.48Å; A23-T26 VanDerWaalsContact O-N 3.14Å; A23-Y27 WeakPolarHBondContact O-CB 3.25Å; A23-Y27 PolarHBondContact O-N 3.35Å
24I91.3Very high89.4Confident29 Ų2970.4 Ų70.415%0.14940%0.397CS..Hα-helixtrans-56.2-44.3-175.8-65.7174.7000111.8L19 D21 Y27 A28 V68 L71L19-I24 HydrophobicContact CD2-CB 4.42Å; L19-I24 HydrophobicContact CD2-CG1 3.95Å; D21-I24 HydrophobicContact CB-CD1 4.3Å; D21-I24 WeakPolarHBondContact O-CG1 3.39Å; D21-I24 PolarHBondContact O-N 3.34Å; I24-Y27 PolarHBondContact O-N 2.92Å; I24-A28 WeakPolarHBondContact O-CB 3.49Å; I24-A28 PolarHBondContact O-N 2.97Å; I24-V68 HydrophobicContact CG2-CG2 3.96Å; I24-L71 HydrophobicContact CG2-CD1 3.53Å
25A90Very high89Confident58 Ų5870 Ų7048%0.47940%0.403SS..Hα-helixtrans-65.6-40.5-18000000112.4A23 A28 A29A23-A25 VanDerWaalsContact C-N 3.32Å; A23-A25 PolarHBondContact O-N 3.37Å; A25-A28 PolarHBondContact O-N 3.36Å; A25-A29 PolarHBondContact O-N 3.18Å
26T91.3Very high89Confident106 Ų10670.4 Ų70.465%0.6541%0.413SS*.Hα-helixtrans-66.6-41.6176.9-53.40000111A23 A29 S30A23-T26 PolarHBondContact O-N 3.48Å; A23-T26 VanDerWaalsContact O-N 3.14Å; T26-A29 WeakPolarHBondContact O-CB 3.49Å; T26-A29 PolarHBondContact O-N 3.4Å; T26-S30 PolarHBondContact O-N 3.17Å
27Y93.1Very high89.2Confident7 Ų769 Ų693%0.02741%0.406CS..Hα-helixtrans-62.7-42.7174.8177.1-93.1000112.1W12 E15 F16 L19 A23 I24 A29 S30 L31 F63W12-Y27 PolarHBondContact NE1-OH 3.41Å; E15-Y27 HydrophobicContact CG-CE2 4.01Å; E15-Y27 WeakPolarHBondContact OE1-CE2 3.36Å; F16-Y27 HydrophobicContact CD2-CD1 4.05Å; F16-Y27 AromaticContact CD2-CE1 3.73Å; F16-Y27 HydrophobicContact CD2-CE1 3.73Å; F16-Y27 HydrophobicContact CE2-CD1 4.41Å; F16-Y27 HydrophobicContact CE2-CE1 4.37Å; L19-Y27 HydrophobicContact CD1-CD2 3.95Å; L19-Y27 HydrophobicContact CD1-CG 4.24Å; L19-Y27 HydrophobicContact CD2-CD1 4.42Å; L19-Y27 HydrophobicContact CD2-CD2 4.42Å; L19-Y27 HydrophobicContact CD2-CG 3.93Å; A23-Y27 WeakPolarHBondContact O-CB 3.25Å; A23-Y27 PolarHBondContact O-N 3.35Å; I24-Y27 PolarHBondContact O-N 2.92Å; Y27-A29 PolarHBondContact O-N 3.19Å; Y27-S30 PolarHBondContact O-N 3.47Å; Y27-S30 PolarHBondContact O-OG 3.44Å; Y27-L31 HydrophobicContact CD1-CD1 4.47Å; Y27-L31 HydrophobicContact CD1-CG 4.35Å; Y27-L31 HydrophobicContact CE1-CD1 4.07Å; Y27-L31 HydrophobicContact CE1-CD2 3.76Å; Y27-L31 HydrophobicContact CE1-CG 3.94Å; Y27-L31 PolarHBondContact O-N 3.24Å; Y27-F63 HydrophobicContact CE1-CE1 4.29Å; Y27-F63 HydrophobicContact CE1-CE2 4.37Å; Y27-F63 AromaticContact CE1-CZ 3.67Å; Y27-F63 HydrophobicContact CE1-CZ 3.67Å
28A91.8Very high89.4Confident9 Ų963 Ų637%0.07438%0.382CS..Hα-helixtrans-59.2-35.9176.900000112.3I24 A25 V68 Q70 L71I24-A28 WeakPolarHBondContact O-CB 3.49Å; I24-A28 PolarHBondContact O-N 2.97Å; A25-A28 PolarHBondContact O-N 3.36Å; A28-V68 HydrophobicContact CB-CG1 4.06Å; A28-Q70 HydrophobicContact CB-CB 3.88Å; A28-L71 HydrophobicContact CB-CD1 4.35Å; A28-L71 HydrophobicContact CB-CD2 3.51Å; A28-L71 HydrophobicContact CB-CG 3.64Å
29A89.2Confident89.6Confident39 Ų3961.2 Ų61.232%0.32237%0.372SS..Hα-helixtrans-69.8-28.9175.600000113.3A25 T26 Y27 K32A25-A29 PolarHBondContact O-N 3.18Å; T26-A29 WeakPolarHBondContact O-CB 3.49Å; T26-A29 PolarHBondContact O-N 3.4Å; Y27-A29 PolarHBondContact O-N 3.19Å; A29-K32 WeakPolarHBondContact O-CD 3.36Å; A29-K32 WeakPolarHBondContact O-CE 3.42Å; A29-K32 WeakPolarHBondContact O-CG 3.49Å
30S90.1Very high89.9Confident32 Ų3259.4 Ų59.422%0.22436%0.363CS..Hα-helixtrans-84.5-18.3-179.6740000113.8T26 Y27 K32 E33T26-S30 PolarHBondContact O-N 3.17Å; Y27-S30 PolarHBondContact O-N 3.47Å; Y27-S30 PolarHBondContact O-OG 3.44Å; S30-K32 PolarHBondContact O-N 2.73Å; S30-K32 VanDerWaalsContact O-N 3.13Å; S30-E33 WeakPolarHBondContact O-CB 3.4Å; S30-E33 PolarHBondContact O-N 3.27Å
31L88.4Confident90.1Very high5 Ų555.8 Ų55.83%0.02634%0.34CS..G310 helixtrans-55.9-32.7179.3-77.2175.7000113.8Y27 E33 K34 L37 F63 L71 F74Y27-L31 HydrophobicContact CD1-CD1 4.47Å; Y27-L31 HydrophobicContact CD1-CG 4.35Å; Y27-L31 HydrophobicContact CE1-CD1 4.07Å; Y27-L31 HydrophobicContact CE1-CD2 3.76Å; Y27-L31 HydrophobicContact CE1-CG 3.94Å; Y27-L31 PolarHBondContact O-N 3.24Å; L31-E33 PolarHBondContact O-N 3.11Å; L31-K34 HydrophobicContact CD2-CD 4.45Å; L31-K34 PolarHBondContact O-N 3.38Å; L31-L37 HydrophobicContact CD2-CD2 4.07Å; L31-F63 HydrophobicContact CD1-CD2 4.43Å; L31-F63 HydrophobicContact CD1-CE2 3.74Å; L31-F63 HydrophobicContact CD1-CZ 4.44Å; L31-L71 HydrophobicContact CD1-CD2 3.42Å; L31-L71 VanDerWaalsContact CD1-CD2 3.42Å; L31-F74 HydrophobicContact CB-CD2 4.22Å; L31-F74 HydrophobicContact CB-CE2 4.27Å; L31-F74 HydrophobicContact CD1-CB 4.45Å; L31-F74 HydrophobicContact CD1-CD1 4.34Å; L31-F74 HydrophobicContact CD1-CD2 3.99Å; L31-F74 HydrophobicContact CD1-CE2 4.31Å; L31-F74 HydrophobicContact CD1-CG 4Å; L31-F74 HydrophobicContact CD2-CE2 4.44Å; L31-F74 HydrophobicContact CD2-CZ 4.48Å
32K81.4Confident90.5Very high165 Ų16549.7 Ų49.772%0.71731%0.306SS*.G310 helixtrans-63.8-22.2177.171.2-168.8179.2-178.70113.3A29 S30A29-K32 WeakPolarHBondContact O-CD 3.36Å; A29-K32 WeakPolarHBondContact O-CE 3.42Å; A29-K32 WeakPolarHBondContact O-CG 3.49Å; S30-K32 PolarHBondContact O-N 2.73Å; S30-K32 VanDerWaalsContact O-N 3.13Å
33E84.6Confident90.7Very high147 Ų14746.9 Ų46.969%0.68728%0.28SS*.G310 helixtrans-84.8-16.9-178.5-56.9178.3178.700111.5S30 L31 G35S30-E33 WeakPolarHBondContact O-CB 3.4Å; S30-E33 PolarHBondContact O-N 3.27Å; L31-E33 PolarHBondContact O-N 3.11Å; E33-G35 VanDerWaalsContact C-N 3.29Å; E33-G35 PolarHBondContact O-N 3.36Å
34K86.2Confident90.8Very high48 Ų4846 Ų4621%0.20927%0.273CS..  trans-83.568.1179-61.5-176.9-178171.10111.4E15 L31 S36 L37E15-K34 IonicContact OE1-NZ 2.87Å; E15-K34 PolarHBondContact OE1-NZ 3.36Å; E15-K34 IonicContact OE2-NZ 2.77Å; E15-K34 PolarHBondContact OE2-NZ 2.94Å; L31-K34 HydrophobicContact CD2-CD 4.45Å; L31-K34 PolarHBondContact O-N 3.38Å; K34-S36 VanDerWaalsContact C-N 3.26Å; K34-S36 PolarHBondContact O-N 3.01Å; K34-L37 HydrophobicContact CB-CB 3.93Å; K34-L37 HydrophobicContact CB-CD2 4.29Å; K34-L37 HydrophobicContact CD-CD2 4.32Å; K34-L37 WeakPolarHBondContact O-CB 3.42Å; K34-L37 PolarHBondContact O-N 3.08Å
35G84.3Confident90.8Very high57 Ų5744.7 Ų44.759%0.58827%0.266SS*.THydrogen-bonded Turntrans-59.1-28.4-174.100000115.5E33 P39E33-G35 VanDerWaalsContact C-N 3.29Å; E33-G35 PolarHBondContact O-N 3.36Å; G35-P39 VanDerWaalsContact O-CD 3.25Å; G35-P39 WeakPolarHBondContact O-CD 3.29Å
36S92.1Very high90.8Very high73 Ų7347.8 Ų47.851%0.5127%0.265SS..THydrogen-bonded Turntrans-80.1-19.8177.552.40000114K34 P39 A40K34-S36 VanDerWaalsContact C-N 3.26Å; K34-S36 PolarHBondContact O-N 3.01Å; S36-P39 WeakPolarHBondContact O-CD 3.35Å; S36-A40 WeakPolarHBondContact O-CB 3.41Å; S36-A40 PolarHBondContact O-N 3.37Å
37L93.9Very high90.5Very high2 Ų245.9 Ų45.91%0.0125%0.249CC..Hα-helixtrans-69.2-46.7-174.817763.3000112V8 W12 L31 K34 A40 L41 F74V8-L37 HydrophobicContact CG1-CB 4.4Å; V8-L37 HydrophobicContact CG1-CD1 4.35Å; W12-L37 HydrophobicContact CB-CD1 3.71Å; W12-L37 HydrophobicContact CB-CD2 4.45Å; W12-L37 HydrophobicContact CD2-CD1 3.92Å; W12-L37 HydrophobicContact CD2-CD2 4.26Å; W12-L37 HydrophobicContact CE3-CD1 4.38Å; W12-L37 HydrophobicContact CG-CD1 3.61Å; W12-L37 HydrophobicContact CG-CD2 3.78Å; W12-L37 HydrophobicContact CG-CG 4.35Å; L31-L37 HydrophobicContact CD2-CD2 4.07Å; K34-L37 HydrophobicContact CB-CB 3.93Å; K34-L37 HydrophobicContact CB-CD2 4.29Å; K34-L37 HydrophobicContact CD-CD2 4.32Å; K34-L37 WeakPolarHBondContact O-CB 3.42Å; K34-L37 PolarHBondContact O-N 3.08Å; L37-A40 PolarHBondContact O-N 3.41Å; L37-L41 HydrophobicContact CD1-CD1 3.93Å; L37-L41 HydrophobicContact CD1-CD2 4.33Å; L37-L41 HydrophobicContact CD1-CG 3.88Å; L37-L41 HydrophobicContact CD2-CD1 4.39Å; L37-L41 HydrophobicContact CG-CD1 3.82Å; L37-L41 HydrophobicContact CG-CG 4.18Å; L37-L41 WeakPolarHBondContact O-CG 3.46Å; L37-L41 PolarHBondContact O-N 3.17Å; L37-F74 HydrophobicContact CD2-CE2 4.44Å; L37-F74 HydrophobicContact CD2-CZ 3.88Å; L37-F74 HydrophobicContact CG-CZ 4.44Å
38I93.8Very high89.6Confident36 Ų3647 Ų4719%0.18526%0.255CS..Hα-helixtrans-60.4-49.1-175.8-63.4171.2000111.5A40 L41 Y42 F74 F78I38-A40 VanDerWaalsContact C-N 3.32Å; I38-A40 PolarHBondContact O-N 3.1Å; I38-L41 PolarHBondContact O-N 3.31Å; I38-Y42 HydrophobicContact CG2-CD2 3.83Å; I38-Y42 HydrophobicContact CG2-CE2 3.7Å; I38-Y42 WeakPolarHBondContact O-CD2 3.17Å; I38-Y42 PolarHBondContact O-N 2.9Å; I38-F74 HydrophobicContact CG1-CE2 4.16Å; I38-F78 HydrophobicContact CG1-CZ 4.46Å; I38-F78 HydrophobicContact CG2-CE1 4.02Å; I38-F78 HydrophobicContact CG2-CZ 4.24Å
39P94.1Very high88.8Confident81 Ų8156 Ų5653%0.52629%0.288SS..Hα-helixtrans-58.9-40.2174.1-2534.7000113.5G35 S36 Y42 K43G35-P39 VanDerWaalsContact O-CD 3.25Å; G35-P39 WeakPolarHBondContact O-CD 3.29Å; S36-P39 WeakPolarHBondContact O-CD 3.35Å; P39-Y42 PolarHBondContact O-N 3.02Å; P39-K43 PolarHBondContact O-N 3.41Å; P39-K43 VanDerWaalsContact O-N 3.07Å
40A94.7Very high88.5Confident3 Ų355.5 Ų55.53%0.02528%0.283CS..Hα-helixtrans-65.1-41.5178.400000111.8D5 V9 S36 L37 I38 K43 V44D5-A40 HydrophobicContact CB-CB 4.24Å; V9-A40 HydrophobicContact CG2-CB 3.69Å; S36-A40 WeakPolarHBondContact O-CB 3.41Å; S36-A40 PolarHBondContact O-N 3.37Å; L37-A40 PolarHBondContact O-N 3.41Å; I38-A40 VanDerWaalsContact C-N 3.32Å; I38-A40 PolarHBondContact O-N 3.1Å; A40-K43 WeakPolarHBondContact O-CB 3.22Å; A40-K43 PolarHBondContact O-N 3.32Å; A40-V44 WeakPolarHBondContact O-CG2 3.37Å; A40-V44 PolarHBondContact O-N 2.87Å
41L95.2Very high88.3Confident0 Ų061.2 Ų61.20%031%0.311CS..Hα-helixtrans-64.9-43175.3-69.8176.7000112.4V9 W12 L37 I38 K43 V44 I45 V56 F74 F78V9-L41 HydrophobicContact CG1-CD2 4.22Å; V9-L41 HydrophobicContact CG2-CD2 4.29Å; W12-L41 HydrophobicContact CE3-CD2 4.13Å; W12-L41 HydrophobicContact CH2-CD2 4.33Å; W12-L41 HydrophobicContact CZ3-CD2 3.86Å; L37-L41 HydrophobicContact CD1-CD1 3.93Å; L37-L41 HydrophobicContact CD1-CD2 4.33Å; L37-L41 HydrophobicContact CD1-CG 3.88Å; L37-L41 HydrophobicContact CD2-CD1 4.39Å; L37-L41 HydrophobicContact CG-CD1 3.82Å; L37-L41 HydrophobicContact CG-CG 4.18Å; L37-L41 WeakPolarHBondContact O-CG 3.46Å; L37-L41 PolarHBondContact O-N 3.17Å; I38-L41 PolarHBondContact O-N 3.31Å; L41-K43 PolarHBondContact O-N 3.07Å; L41-V44 PolarHBondContact O-N 3.19Å; L41-I45 VanDerWaalsContact O-CG1 3.3Å; L41-I45 WeakPolarHBondContact O-CG1 3.13Å; L41-I45 PolarHBondContact O-N 3.23Å; L41-V56 HydrophobicContact CD2-CG1 3.76Å; L41-V56 HydrophobicContact CD2-CG2 3.89Å; L41-F74 HydrophobicContact CD1-CE1 3.9Å; L41-F74 HydrophobicContact CD1-CZ 3.71Å; L41-F78 HydrophobicContact CB-CE1 3.77Å; L41-F78 HydrophobicContact CB-CZ 3.77Å; L41-F78 HydrophobicContact CD1-CE1 4.43Å; L41-F78 HydrophobicContact CD1-CE2 3.88Å; L41-F78 HydrophobicContact CD1-CZ 3.58Å; L41-F78 HydrophobicContact CG-CZ 4.34Å
42Y94.9Very high88.5Confident12 Ų1261.7 Ų61.75%0.04731%0.313CS..Hα-helixtrans-58.5-36.6172.9-89-67.1000112.3I38 P39 R46 Q77 F78 E81 A198 S199I38-Y42 HydrophobicContact CG2-CD2 3.83Å; I38-Y42 HydrophobicContact CG2-CE2 3.7Å; I38-Y42 WeakPolarHBondContact O-CD2 3.17Å; I38-Y42 PolarHBondContact O-N 2.9Å; P39-Y42 PolarHBondContact O-N 3.02Å; Y42-R46 WeakPolarHBondContact O-CB 3.26Å; Y42-R46 WeakPolarHBondContact O-CD 3.46Å; Y42-R46 WeakPolarHBondContact O-CG 3.35Å; Y42-R46 PolarHBondContact O-N 3.3Å; Y42-R46 VanDerWaalsContact O-N 3.07Å; Y42-Q77 PolarHBondContact OH-O 3.21Å; Y42-F78 HydrophobicContact CD1-CD1 4.11Å; Y42-F78 HydrophobicContact CD2-CD1 4.05Å; Y42-F78 AromaticContact CD2-CE1 3.8Å; Y42-F78 HydrophobicContact CD2-CE1 3.8Å; Y42-F78 AromaticContact CE1-CD1 3.91Å; Y42-F78 HydrophobicContact CE1-CD1 3.91Å; Y42-F78 AromaticContact CE2-CD1 3.86Å; Y42-F78 HydrophobicContact CE2-CD1 3.86Å; Y42-F78 AromaticContact CE2-CE1 3.76Å; Y42-F78 HydrophobicContact CE2-CE1 3.76Å; Y42-F78 HydrophobicContact CG-CD1 4.16Å; Y42-F78 HydrophobicContact CG-CE1 4.24Å; Y42-F78 AromaticContact CZ-CD1 3.77Å; Y42-E81 HydrophobicContact CD1-CB 4.05Å; Y42-E81 HydrophobicContact CD1-CG 4.22Å; Y42-E81 HydrophobicContact CE1-CB 4Å; Y42-A198 HydrophobicContact CE2-CB 4.2Å; Y42-S199 VanDerWaalsContact OH-CA 3.32Å; Y42-S199 WeakPolarHBondContact OH-CA 3.2Å
43K93.3Very high89Confident48 Ų4854 Ų5421%0.20928%0.28CS..Hα-helixtrans-67.1-48.1177.5-172.7-174-178.3-172.50111.5D5 P39 A40 L41 I45 R46 E47D5-K43 IonicContact OD2-NZ 3.12Å; D5-K43 PolarHBondContact OD2-NZ 3.14Å; P39-K43 PolarHBondContact O-N 3.41Å; P39-K43 VanDerWaalsContact O-N 3.07Å; A40-K43 WeakPolarHBondContact O-CB 3.22Å; A40-K43 PolarHBondContact O-N 3.32Å; L41-K43 PolarHBondContact O-N 3.07Å; K43-I45 VanDerWaalsContact C-N 3.3Å; K43-I45 PolarHBondContact O-N 3.47Å; K43-R46 PolarHBondContact O-N 3.44Å; K43-R46 VanDerWaalsContact O-N 3.12Å; K43-E47 VanDerWaalsContact CE-OE1 3.27Å; K43-E47 WeakPolarHBondContact CE-OE1 3.26Å; K43-E47 WeakPolarHBondContact CG-OE1 3.31Å; K43-E47 WeakPolarHBondContact O-CB 3.27Å; K43-E47 WeakPolarHBondContact O-CG 3.39Å; K43-E47 PolarHBondContact O-N 2.99Å
44V92.9Very high89.4Confident10 Ų1053.1 Ų53.16%0.06128%0.276CS..Hα-helixtrans-56.9-44.1175.41740000111.1V9 A40 L41 R46 E47 L52 L53 V56V9-V44 HydrophobicContact CG2-CG2 4.27Å; A40-V44 WeakPolarHBondContact O-CG2 3.37Å; A40-V44 PolarHBondContact O-N 2.87Å; L41-V44 PolarHBondContact O-N 3.19Å; V44-R46 VanDerWaalsContact C-N 3.31Å; V44-R46 PolarHBondContact O-N 2.93Å; V44-E47 CarbonylContact O-C 3.45Å; V44-E47 PolarHBondContact O-N 3.21Å; V44-L52 HydrophobicContact CG1-CB 4.03Å; V44-L52 HydrophobicContact CG2-CB 4.3Å; V44-L52 HydrophobicContact CG2-CD1 4.31Å; V44-L53 HydrophobicContact CG1-CB 4.26Å; V44-L53 HydrophobicContact CG1-CD1 4.22Å; V44-V56 HydrophobicContact CG1-CB 4.47Å; V44-V56 HydrophobicContact CG1-CG2 4.16Å
45I92.4Very high89.8Confident0 Ų052.9 Ų52.90%028%0.279CS..Hα-helixtrans-67.6-29.2179.5-65.5168000112.5L41 K43 N48 L53 L60 F78 E81 L82L41-I45 VanDerWaalsContact O-CG1 3.3Å; L41-I45 WeakPolarHBondContact O-CG1 3.13Å; L41-I45 PolarHBondContact O-N 3.23Å; K43-I45 VanDerWaalsContact C-N 3.3Å; K43-I45 PolarHBondContact O-N 3.47Å; I45-N48 PolarHBondContact O-OD1 2.68Å; I45-L53 HydrophobicContact CG1-CD1 4.47Å; I45-L60 HydrophobicContact CD1-CD1 4.43Å; I45-F78 HydrophobicContact CD1-CB 3.74Å; I45-F78 HydrophobicContact CD1-CD1 4.02Å; I45-F78 HydrophobicContact CD1-CG 3.93Å; I45-E81 HydrophobicContact CG2-CB 4.09Å; I45-E81 HydrophobicContact CG2-CG 3.82Å; I45-L82 HydrophobicContact CD1-CD2 4.15Å; I45-L82 HydrophobicContact CD1-CG 4.39Å; I45-L82 HydrophobicContact CG1-CD2 4.25Å; I45-L82 HydrophobicContact CG2-CD2 3.82Å; I45-L82 HydrophobicContact CG2-CG 4.23Å
46R89.3Confident90.3Very high124 Ų12450.1 Ų50.147%0.46825%0.251SS..Hα-helixtrans-78.5-32.8175.8-75.5171-178.3166.68.6112.5Y42 K43 V44 N48 E81Y42-R46 WeakPolarHBondContact O-CB 3.26Å; Y42-R46 WeakPolarHBondContact O-CD 3.46Å; Y42-R46 WeakPolarHBondContact O-CG 3.35Å; Y42-R46 PolarHBondContact O-N 3.3Å; Y42-R46 VanDerWaalsContact O-N 3.07Å; K43-R46 PolarHBondContact O-N 3.44Å; K43-R46 VanDerWaalsContact O-N 3.12Å; V44-R46 VanDerWaalsContact C-N 3.31Å; V44-R46 PolarHBondContact O-N 2.93Å; R46-N48 PolarHBondContact O-N 3.03Å; R46-E81 HydrophobicContact CG-CG 3.87Å; R46-E81 WeakPolarHBondContact CG-OE1 3.48Å; R46-E81 IonicContact CZ-OE2 2.56Å; R46-E81 VanDerWaalsContact NE-CD 3.34Å; R46-E81 IonicContact NE-OE1 3Å; R46-E81 IonicContact NE-OE2 3.42Å; R46-E81 PolarHBondContact NE-OE2 3.05Å; R46-E81 IonicContact NH2-OE2 2.73Å; R46-E81 PolarHBondContact NH2-OE2 3.02Å
47E85.6Confident90.5Very high66 Ų6646.9 Ų46.931%0.30823%0.228SC..  trans-8973.6178.5-67.3173.9-170.500109.3K43 V44 Y49 S50K43-E47 VanDerWaalsContact CE-OE1 3.27Å; K43-E47 WeakPolarHBondContact CE-OE1 3.26Å; K43-E47 WeakPolarHBondContact CG-OE1 3.31Å; K43-E47 WeakPolarHBondContact O-CB 3.27Å; K43-E47 WeakPolarHBondContact O-CG 3.39Å; K43-E47 PolarHBondContact O-N 2.99Å; V44-E47 CarbonylContact O-C 3.45Å; V44-E47 PolarHBondContact O-N 3.21Å; E47-Y49 HydrophobicContact CB-CE2 4.24Å; E47-Y49 PolarHBondContact O-N 3.42Å; E47-S50 VanDerWaalsContact O-CB 3.3Å; E47-S50 WeakPolarHBondContact O-CB 3.38Å; E47-S50 PolarHBondContact O-N 3.31Å
48N73.8Confident90.6Very high29 Ų2952.4 Ų52.416%0.15525%0.254CS..THydrogen-bonded Turntrans-56.9-4-173.8-72.2-15.7000116.9I45 R46 S85 V89I45-N48 PolarHBondContact O-OD1 2.68Å; R46-N48 PolarHBondContact O-N 3.03Å; N48-S85 PolarHBondContact ND2-OG 3.49Å; N48-S85 PolarHBondContact OD1-OG 2.96Å; N48-V89 WeakPolarHBondContact ND2-CG2 3.4Å
49Y75.8Confident90.8Very high198 Ų19851.1 Ų51.178%0.77625%0.247SC*.THydrogen-bonded Turntrans-111.911.6179.133.2-97.7000112.1E47E47-Y49 HydrophobicContact CB-CE2 4.24Å; E47-Y49 PolarHBondContact O-N 3.42Å
50S82.2Confident90.9Very high30 Ų3047.2 Ų47.221%0.2122%0.222CC..  trans-73.3134.1174.7-177.40000111.3E47 L52 L53E47-S50 VanDerWaalsContact O-CB 3.3Å; E47-S50 WeakPolarHBondContact O-CB 3.38Å; E47-S50 PolarHBondContact O-N 3.31Å; S50-L52 PolarHBondContact O-N 3.22Å; S50-L52 VanDerWaalsContact O-N 3.14Å; S50-L52 PolarHBondContact OG-N 3.4Å; S50-L53 VanDerWaalsContact O-CB 3.31Å; S50-L53 WeakPolarHBondContact O-CB 3.38Å; S50-L53 PolarHBondContact O-N 3.12Å
51D86.4Confident91.1Very high152 Ų15249.3 Ų49.381%0.81323%0.23SC*.THydrogen-bonded Turntrans-61.5-19.6172.6-60.6-36.9000112.6
52L91.1Very high91.1Very high15 Ų1552 Ų528%0.07924%0.243CC..THydrogen-bonded Turntrans-82.6-11.3176.9-65.7-178.7000113.8Q6 V9 E10 L13 V44 S50 E54 P55 V56Q6-L52 HydrophobicContact CB-CD1 4.37Å; Q6-L52 HydrophobicContact CG-CD1 3.79Å; V9-L52 HydrophobicContact CB-CD1 4.02Å; V9-L52 HydrophobicContact CG1-CD1 3.96Å; E10-L52 HydrophobicContact CG-CD2 3.82Å; L13-L52 HydrophobicContact CD1-CD2 4.31Å; V44-L52 HydrophobicContact CG1-CB 4.03Å; V44-L52 HydrophobicContact CG2-CB 4.3Å; V44-L52 HydrophobicContact CG2-CD1 4.31Å; S50-L52 PolarHBondContact O-N 3.22Å; S50-L52 VanDerWaalsContact O-N 3.14Å; S50-L52 PolarHBondContact OG-N 3.4Å; L52-E54 PolarHBondContact O-N 3.07Å; L52-P55 VanDerWaalsContact O-CD 3.29Å; L52-P55 WeakPolarHBondContact O-CD 3.5Å; L52-P55 VanDerWaalsContact O-CG 3.29Å; L52-P55 WeakPolarHBondContact O-CG 3.34Å; L52-V56 VanDerWaalsContact O-CB 3.29Å; L52-V56 WeakPolarHBondContact O-CB 3.39Å; L52-V56 WeakPolarHBondContact O-CG2 3.47Å; L52-V56 PolarHBondContact O-N 3.1Å
53L92Very high91.2Very high3 Ų351.4 Ų51.42%0.01624%0.241CC..Hα-helixtrans-65.1-44.7-172.5-177.565.3000112.4V44 I45 S50 V56 C57 I101V44-L53 HydrophobicContact CG1-CB 4.26Å; V44-L53 HydrophobicContact CG1-CD1 4.22Å; I45-L53 HydrophobicContact CG1-CD1 4.47Å; S50-L53 VanDerWaalsContact O-CB 3.31Å; S50-L53 WeakPolarHBondContact O-CB 3.38Å; S50-L53 PolarHBondContact O-N 3.12Å; L53-V56 PolarHBondContact O-N 3.45Å; L53-C57 WeakPolarHBondContact O-CB 3.36Å; L53-C57 PolarHBondContact O-N 3.19Å; L53-C57 PolarHBondContact O-SG 3.08Å; L53-I101 HydrophobicContact CD1-CD1 4.25Å; L53-I101 HydrophobicContact CD1-CG1 4.37Å; L53-I101 HydrophobicContact CD2-CD1 4.13Å; L53-I101 HydrophobicContact CD2-CG1 4.36Å
54E92.7Very high91.3Very high129 Ų12949.3 Ų49.360%0.60323%0.231SC*.Hα-helixtrans-61.6-53179.1-177.1176.1175.800112.8L52 V56 C57 H58 C100L52-E54 PolarHBondContact O-N 3.07Å; E54-V56 VanDerWaalsContact C-N 3.29Å; E54-V56 PolarHBondContact O-N 3.27Å; E54-C57 PolarHBondContact O-N 3.28Å; E54-H58 PolarHBondContact O-N 3.44Å; E54-C100 HydrophobicContact CB-CB 4.33Å; E54-C100 HydrophobicContact CG-CB 4.32Å
55P95.1Very high91.5Very high42 Ų4256.1 Ų56.127%0.27326%0.256SS..Hα-helixtrans-64.8-33178.124.2-33.7000112.6L13 L52 H58 Q59L13-P55 HydrophobicContact CD1-CB 3.94Å; L13-P55 HydrophobicContact CD1-CG 4.04Å; L13-P55 HydrophobicContact CD2-CB 4.17Å; L52-P55 VanDerWaalsContact O-CD 3.29Å; L52-P55 WeakPolarHBondContact O-CD 3.5Å; L52-P55 VanDerWaalsContact O-CG 3.29Å; L52-P55 WeakPolarHBondContact O-CG 3.34Å; P55-H58 PolarHBondContact O-N 2.92Å; P55-Q59 WeakPolarHBondContact O-CB 3.5Å; P55-Q59 PolarHBondContact O-N 3.11Å
56V95.9Very high91.5Very high0 Ų058.4 Ų58.40%027%0.272CS..Hα-helixtrans-63-48.6172.6166.80000110.8V9 W12 L41 V44 L52 L53 E54 H58 Q59 L60V9-V56 HydrophobicContact CG1-CG2 3.58Å; W12-V56 HydrophobicContact CZ3-CG2 4.11Å; L41-V56 HydrophobicContact CD2-CG1 3.76Å; L41-V56 HydrophobicContact CD2-CG2 3.89Å; V44-V56 HydrophobicContact CG1-CB 4.47Å; V44-V56 HydrophobicContact CG1-CG2 4.16Å; L52-V56 VanDerWaalsContact O-CB 3.29Å; L52-V56 WeakPolarHBondContact O-CB 3.39Å; L52-V56 WeakPolarHBondContact O-CG2 3.47Å; L52-V56 PolarHBondContact O-N 3.1Å; L53-V56 PolarHBondContact O-N 3.45Å; E54-V56 VanDerWaalsContact C-N 3.29Å; E54-V56 PolarHBondContact O-N 3.27Å; V56-H58 VanDerWaalsContact C-N 3.31Å; V56-H58 PolarHBondContact O-N 2.94Å; V56-Q59 PolarHBondContact O-N 3.04Å; V56-L60 HydrophobicContact CG1-CD1 3.93Å; V56-L60 HydrophobicContact CG1-CG 4.27Å; V56-L60 WeakPolarHBondContact O-CB 3.45Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.41Å; V56-L60 PolarHBondContact O-N 3.31Å
57C96.1Very high91.6Very high4 Ų454.5 Ų54.53%0.02727%0.271CS..Hα-helixtrans-60.7-42178.4-70.40000111.5L53 E54 L60 F61 C100 L104L53-C57 WeakPolarHBondContact O-CB 3.36Å; L53-C57 PolarHBondContact O-N 3.19Å; L53-C57 PolarHBondContact O-SG 3.08Å; E54-C57 PolarHBondContact O-N 3.28Å; C57-L60 PolarHBondContact O-N 3.44Å; C57-F61 PolarHBondContact O-N 2.96Å; C57-C100 HydrophobicContact CB-CB 4.02Å; C57-L104 HydrophobicContact CB-CB 4.3Å; C57-L104 HydrophobicContact CB-CD2 4.16Å
58H95.9Very high92Very high119 Ų11952.9 Ų52.955%0.55127%0.265SS*.Hα-helixtrans-62.3-47176.8-171.176.8000112E54 P55 V56 L60 F61 E62E54-H58 PolarHBondContact O-N 3.44Å; P55-H58 PolarHBondContact O-N 2.92Å; V56-H58 VanDerWaalsContact C-N 3.31Å; V56-H58 PolarHBondContact O-N 2.94Å; H58-L60 PolarHBondContact O-N 2.9Å; H58-F61 WeakPolarHBondContact O-CB 3.41Å; H58-F61 PolarHBondContact O-N 3.38Å; H58-E62 PolarHBondContact O-N 2.92Å
59Q96.9Very high93Very high8 Ų854.7 Ų54.74%0.03728%0.279CS..Hα-helixtrans-65.9-37.8178.3-175.2157.1-42.400112.6W12 L13 F16 P55 V56 F61 E62 F63W12-Q59 VanDerWaalsContact CD2-NE2 3.32Å; W12-Q59 HydrophobicContact CH2-CB 3.81Å; W12-Q59 HydrophobicContact CH2-CG 3.56Å; W12-Q59 HydrophobicContact CZ2-CG 3.78Å; W12-Q59 HydrophobicContact CZ3-CB 4.19Å; W12-Q59 HydrophobicContact CZ3-CG 4.14Å; W12-Q59 PolarHBondContact O-NE2 2.92Å; L13-Q59 HydrophobicContact CD2-CB 3.99Å; L13-Q59 VanDerWaalsContact CD2-OE1 3.27Å; F16-Q59 VanDerWaalsContact CB-NE2 3.25Å; F16-Q59 HydrophobicContact CD1-CG 3.89Å; F16-Q59 HydrophobicContact CE1-CG 4.43Å; F16-Q59 HydrophobicContact CG-CG 4.38Å; P55-Q59 WeakPolarHBondContact O-CB 3.5Å; P55-Q59 PolarHBondContact O-N 3.11Å; V56-Q59 PolarHBondContact O-N 3.04Å; Q59-F61 VanDerWaalsContact C-N 3.29Å; Q59-F61 PolarHBondContact O-N 2.88Å; Q59-E62 PolarHBondContact O-N 3.38Å; Q59-F63 HydrophobicContact CG-CD1 3.99Å; Q59-F63 HydrophobicContact CG-CE1 3.51Å; Q59-F63 HydrophobicContact CG-CZ 4.01Å; Q59-F63 WeakPolarHBondContact O-CB 3.43Å; Q59-F63 WeakPolarHBondContact O-CD1 3.38Å; Q59-F63 WeakPolarHBondContact O-CG 3.35Å; Q59-F63 PolarHBondContact O-N 3.42Å
60L97.7Very high93.9Very high0 Ų049.8 Ų49.80%026%0.263CS..Hα-helixtrans-62.8-35.6173.3-72.8179.2000112.3W12 I45 V56 C57 H58 F63 Y64 F74 T75 F78 L104W12-L60 HydrophobicContact CH2-CD2 4.38Å; I45-L60 HydrophobicContact CD1-CD1 4.43Å; V56-L60 HydrophobicContact CG1-CD1 3.93Å; V56-L60 HydrophobicContact CG1-CG 4.27Å; V56-L60 WeakPolarHBondContact O-CB 3.45Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.41Å; V56-L60 PolarHBondContact O-N 3.31Å; C57-L60 PolarHBondContact O-N 3.44Å; H58-L60 PolarHBondContact O-N 2.9Å; L60-F63 WeakPolarHBondContact O-CB 3.5Å; L60-Y64 PolarHBondContact O-N 3.1Å; L60-Y64 VanDerWaalsContact O-N 3.11Å; L60-F74 HydrophobicContact CD2-CD1 4.21Å; L60-F74 HydrophobicContact CD2-CE1 4.11Å; L60-T75 HydrophobicContact CB-CG2 4.01Å; L60-T75 HydrophobicContact CD2-CG2 4.46Å; L60-T75 WeakPolarHBondContact O-CG2 3.5Å; L60-T75 PolarHBondContact O-OG1 3.27Å; L60-F78 HydrophobicContact CD1-CD2 4.4Å; L60-F78 HydrophobicContact CD2-CD2 4.14Å; L60-F78 HydrophobicContact CD2-CE2 4.25Å; L60-L104 HydrophobicContact CB-CD1 4.22Å; L60-L104 HydrophobicContact CB-CD2 4.2Å; L60-L104 HydrophobicContact CD1-CD2 4.27Å
61F97.8Very high94.5Very high47 Ų4748.4 Ų48.421%0.20625%0.253CS..Hα-helixtrans-67-47.2173.4179.1-109.7000111.4C57 H58 Q59 F63 Y64 R65 L104 L111C57-F61 PolarHBondContact O-N 2.96Å; H58-F61 WeakPolarHBondContact O-CB 3.41Å; H58-F61 PolarHBondContact O-N 3.38Å; Q59-F61 VanDerWaalsContact C-N 3.29Å; Q59-F61 PolarHBondContact O-N 2.88Å; F61-F63 VanDerWaalsContact C-N 3.29Å; F61-F63 PolarHBondContact O-N 3.13Å; F61-Y64 WeakPolarHBondContact O-CA 3.38Å; F61-Y64 WeakPolarHBondContact O-CB 3.38Å; F61-Y64 PolarHBondContact O-N 2.8Å; F61-R65 WeakPolarHBondContact O-CB 3.27Å; F61-R65 PolarHBondContact O-N 3.1Å; F61-L104 HydrophobicContact CB-CD1 3.64Å; F61-L104 HydrophobicContact CD2-CD1 4.41Å; F61-L111 HydrophobicContact CE2-CD1 3.67Å; F61-L111 HydrophobicContact CE2-CG 4.48Å; F61-L111 HydrophobicContact CZ-CD1 4.07Å
62E96.3Very high95Very high56 Ų5643.4 Ų43.426%0.26222%0.224SC..Hα-helixtrans-60.9-38.9176.8-72-58.2137.800112F16 H58 Q59 Y64 R65 S66F16-E62 HydrophobicContact CE1-CB 4.33Å; H58-E62 PolarHBondContact O-N 2.92Å; Q59-E62 PolarHBondContact O-N 3.38Å; E62-Y64 VanDerWaalsContact C-N 3.3Å; E62-Y64 PolarHBondContact O-N 3.18Å; E62-R65 PolarHBondContact O-N 3.47Å; E62-R65 IonicContact OE1-NH1 2.93Å; E62-R65 PolarHBondContact OE1-NH1 3.26Å; E62-S66 PolarHBondContact O-N 2.98Å
63F96.3Very high95.2Very high0 Ų046.6 Ų46.60%024%0.235CC..Hα-helixtrans-57.2-45.5171.4-83.425.6000111.4W12 F16 Y27 L31 Q59 L60 F61 S66 L71 F74W12-F63 AromaticContact CE2-CZ 3.83Å; W12-F63 HydrophobicContact CZ2-CD2 4.39Å; W12-F63 HydrophobicContact CZ2-CE1 4.34Å; W12-F63 AromaticContact CZ2-CE2 3.54Å; W12-F63 HydrophobicContact CZ2-CE2 3.54Å; W12-F63 AromaticContact CZ2-CZ 3.49Å; W12-F63 HydrophobicContact CZ2-CZ 3.49Å; W12-F63 VanDerWaalsContact CZ2-CZ 3.49Å; W12-F63 AromaticContact NE1-CE2 3.99Å; W12-F63 AromaticContact NE1-CZ 3.69Å; F16-F63 HydrophobicContact CB-CE1 4.4Å; F16-F63 HydrophobicContact CD1-CD1 4.36Å; F16-F63 AromaticContact CD1-CE1 3.72Å; F16-F63 HydrophobicContact CD1-CE1 3.72Å; F16-F63 HydrophobicContact CD2-CD1 4.31Å; F16-F63 AromaticContact CD2-CE1 3.39Å; F16-F63 HydrophobicContact CD2-CE1 3.39Å; F16-F63 HydrophobicContact CD2-CZ 4.04Å; F16-F63 AromaticContact CE1-CD1 3.91Å; F16-F63 HydrophobicContact CE1-CD1 3.91Å; F16-F63 AromaticContact CE1-CE1 3.69Å; F16-F63 HydrophobicContact CE1-CE1 3.69Å; F16-F63 AromaticContact CE2-CD1 3.85Å; F16-F63 HydrophobicContact CE2-CD1 3.85Å; F16-F63 AromaticContact CE2-CE1 3.37Å; F16-F63 HydrophobicContact CE2-CE1 3.37Å; F16-F63 HydrophobicContact CE2-CZ 4.29Å; F16-F63 AromaticContact CG-CE1 3.56Å; F16-F63 HydrophobicContact CG-CE1 3.56Å; F16-F63 HydrophobicContact CG-CZ 4.27Å; F16-F63 AromaticContact CZ-CD1 3.62Å; F16-F63 HydrophobicContact CZ-CD1 3.62Å; F16-F63 AromaticContact CZ-CE1 3.52Å; F16-F63 HydrophobicContact CZ-CE1 3.52Å; Y27-F63 HydrophobicContact CE1-CE1 4.29Å; Y27-F63 HydrophobicContact CE1-CE2 4.37Å; Y27-F63 AromaticContact CE1-CZ 3.67Å; Y27-F63 HydrophobicContact CE1-CZ 3.67Å; L31-F63 HydrophobicContact CD1-CD2 4.43Å; L31-F63 HydrophobicContact CD1-CE2 3.74Å; L31-F63 HydrophobicContact CD1-CZ 4.44Å; Q59-F63 HydrophobicContact CG-CD1 3.99Å; Q59-F63 HydrophobicContact CG-CE1 3.51Å; Q59-F63 HydrophobicContact CG-CZ 4.01Å; Q59-F63 WeakPolarHBondContact O-CB 3.43Å; Q59-F63 WeakPolarHBondContact O-CD1 3.38Å; Q59-F63 WeakPolarHBondContact O-CG 3.35Å; Q59-F63 PolarHBondContact O-N 3.42Å; L60-F63 WeakPolarHBondContact O-CB 3.5Å; F61-F63 VanDerWaalsContact C-N 3.29Å; F61-F63 PolarHBondContact O-N 3.13Å; F63-S66 PolarHBondContact O-OG 2.72Å; F63-L71 HydrophobicContact CB-CB 3.95Å; F63-L71 HydrophobicContact CD1-CD1 4.48Å; F63-L71 HydrophobicContact CD2-CB 4.38Å; F63-L71 HydrophobicContact CD2-CD2 3.86Å; F63-L71 HydrophobicContact CE2-CD2 4.03Å; F63-L71 HydrophobicContact CG-CB 4.24Å; F63-L71 HydrophobicContact CG-CD1 4.41Å; F63-L71 HydrophobicContact CG-CD2 4.18Å; F63-L71 WeakPolarHBondContact O-CB 3.42Å; F63-F74 AromaticContact CD2-CD1 3.77Å; F63-F74 HydrophobicContact CD2-CD1 3.77Å; F63-F74 HydrophobicContact CD2-CE1 4.26Å; F63-F74 AromaticContact CE2-CD1 3.87Å; F63-F74 HydrophobicContact CE2-CD1 3.87Å; F63-F74 AromaticContact CE2-CE1 3.97Å; F63-F74 HydrophobicContact CE2-CE1 3.97Å
64Y96.4Very high95.4Very high4 Ų447.2 Ų47.22%0.01624%0.238CC..Hα-helixtrans-67.2-42.6179.6-156.6-87.1000112.3L60 F61 E62 S66 G67 Q72 T75 L76 I108 L111 E112L60-Y64 PolarHBondContact O-N 3.1Å; L60-Y64 VanDerWaalsContact O-N 3.11Å; F61-Y64 WeakPolarHBondContact O-CA 3.38Å; F61-Y64 WeakPolarHBondContact O-CB 3.38Å; F61-Y64 PolarHBondContact O-N 2.8Å; E62-Y64 VanDerWaalsContact C-N 3.3Å; E62-Y64 PolarHBondContact O-N 3.18Å; Y64-S66 VanDerWaalsContact C-N 3.3Å; Y64-S66 PolarHBondContact O-N 2.78Å; Y64-G67 PolarHBondContact O-N 3.13Å; Y64-Q72 HydrophobicContact CD2-CB 4.11Å; Y64-Q72 HydrophobicContact CD2-CG 4.09Å; Y64-Q72 HydrophobicContact CE2-CB 4.02Å; Y64-Q72 HydrophobicContact CE2-CG 4.22Å; Y64-Q72 HydrophobicContact CG-CG 4.26Å; Y64-Q72 WeakPolarHBondContact O-CG 3.43Å; Y64-Q72 PolarHBondContact O-NE2 3.25Å; Y64-Q72 VanDerWaalsContact O-NE2 3.16Å; Y64-T75 HydrophobicContact CD2-CG2 4.1Å; Y64-L76 HydrophobicContact CE2-CD1 4.22Å; Y64-L76 HydrophobicContact CE2-CD2 4Å; Y64-L76 HydrophobicContact CE2-CG 3.86Å; Y64-I108 HydrophobicContact CD1-CB 4.48Å; Y64-I108 HydrophobicContact CD1-CG1 4.13Å; Y64-I108 HydrophobicContact CD1-CG2 4.18Å; Y64-I108 HydrophobicContact CD2-CD1 4.34Å; Y64-I108 HydrophobicContact CD2-CG1 4.21Å; Y64-I108 HydrophobicContact CD2-CG2 4.33Å; Y64-I108 HydrophobicContact CE1-CG2 3.82Å; Y64-I108 HydrophobicContact CE2-CG2 3.96Å; Y64-I108 HydrophobicContact CG-CD1 4.48Å; Y64-I108 HydrophobicContact CG-CG1 3.92Å; Y64-I108 HydrophobicContact CG-CG2 4.42Å; Y64-L111 HydrophobicContact CD1-CD1 4.03Å; Y64-E112 HydrophobicContact CE1-CG 3.91Å; Y64-E112 WeakPolarHBondContact CE1-OE1 3.5Å; Y64-E112 WeakPolarHBondContact OH-CG 3.26Å; Y64-E112 PolarHBondContact OH-OE1 3.48Å
65R95.1Very high95.6Very high152 Ų15241.1 Ų41.157%0.57421%0.21SC*.Hα-helixtrans-66-29.3-179.2-174.2-177.4178.1-171.60.1113.1F61 E62 G67 L111F61-R65 WeakPolarHBondContact O-CB 3.27Å; F61-R65 PolarHBondContact O-N 3.1Å; E62-R65 PolarHBondContact O-N 3.47Å; E62-R65 IonicContact OE1-NH1 2.93Å; E62-R65 PolarHBondContact OE1-NH1 3.26Å; R65-G67 PolarHBondContact O-N 3.14Å; R65-L111 HydrophobicContact CB-CD1 4.14Å; R65-L111 HydrophobicContact CG-CD1 4.46Å
66S93.3Very high95.8Very high48 Ų4839.6 Ų39.634%0.33620%0.199SC..THydrogen-bonded Turntrans-56.3-21.3178.874.20000114.5E62 F63 Y64 V68E62-S66 PolarHBondContact O-N 2.98Å; F63-S66 PolarHBondContact O-OG 2.72Å; Y64-S66 VanDerWaalsContact C-N 3.3Å; Y64-S66 PolarHBondContact O-N 2.78Å; S66-V68 PolarHBondContact O-N 2.8Å; S66-V68 PolarHBondContact OG-N 3.19Å
67G90.8Very high95.8Very high43 Ų4340 Ų4044%0.44320%0.201SC..  trans73.5-0.1-17600000114.2Y64 R65 P69Y64-G67 PolarHBondContact O-N 3.13Å; R65-G67 PolarHBondContact O-N 3.14Å; G67-P69 VanDerWaalsContact O-CD 3.31Å; G67-P69 WeakPolarHBondContact O-CD 3.26Å
68V94.4Very high95.8Very high31 Ų3139.9 Ų39.919%0.18820%0.2CC..  trans-74.8117.1176.6179.50000108.9I24 A28 S66 Q70 L71 Q72I24-V68 HydrophobicContact CG2-CG2 3.96Å; A28-V68 HydrophobicContact CB-CG1 4.06Å; S66-V68 PolarHBondContact O-N 2.8Å; S66-V68 PolarHBondContact OG-N 3.19Å; V68-Q70 HydrophobicContact CG1-CB 4.34Å; V68-Q70 PolarHBondContact O-N 3.42Å; V68-Q70 VanDerWaalsContact O-N 3.08Å; V68-L71 HydrophobicContact CB-CB 4.31Å; V68-L71 HydrophobicContact CB-CD1 4.15Å; V68-L71 HydrophobicContact CB-CG 4.14Å; V68-L71 HydrophobicContact CG1-CG 4.2Å; V68-L71 PolarHBondContact O-N 2.95Å; V68-Q72 PolarHBondContact O-N 3.4Å
69P93.9Very high96Very high68 Ų6834.3 Ų34.344%0.44217%0.174SC..Hα-helixtrans-59.1-31.5-172-27.735.5000114.2G67 R73G67-P69 VanDerWaalsContact O-CD 3.31Å; G67-P69 WeakPolarHBondContact O-CD 3.26Å; P69-R73 WeakPolarHBondContact O-CB 3.22Å; P69-R73 VanDerWaalsContact O-CD 3.26Å; P69-R73 WeakPolarHBondContact O-CD 3.47Å; P69-R73 WeakPolarHBondContact O-CG 3.22Å; P69-R73 PolarHBondContact O-N 2.9Å
70Q94.9Very high96Very high95 Ų9533.9 Ų33.944%0.44417%0.173SC..Hα-helixtrans-66.7-41.7177.8-68.8165.9-6.900111.8A28 V68 F74A28-Q70 HydrophobicContact CB-CB 3.88Å; V68-Q70 HydrophobicContact CG1-CB 4.34Å; V68-Q70 PolarHBondContact O-N 3.42Å; V68-Q70 VanDerWaalsContact O-N 3.08Å; Q70-F74 WeakPolarHBondContact O-CB 3.32Å; Q70-F74 PolarHBondContact O-N 3.3Å
71L95.9Very high96Very high0 Ų034.1 Ų34.10%017%0.174CC..Hα-helixtrans-71.5-40.5177.7-64.1-175.4000111.6I24 A28 L31 F63 V68 R73 F74 T75I24-L71 HydrophobicContact CG2-CD1 3.53Å; A28-L71 HydrophobicContact CB-CD1 4.35Å; A28-L71 HydrophobicContact CB-CD2 3.51Å; A28-L71 HydrophobicContact CB-CG 3.64Å; L31-L71 HydrophobicContact CD1-CD2 3.42Å; L31-L71 VanDerWaalsContact CD1-CD2 3.42Å; F63-L71 HydrophobicContact CB-CB 3.95Å; F63-L71 HydrophobicContact CD1-CD1 4.48Å; F63-L71 HydrophobicContact CD2-CB 4.38Å; F63-L71 HydrophobicContact CD2-CD2 3.86Å; F63-L71 HydrophobicContact CE2-CD2 4.03Å; F63-L71 HydrophobicContact CG-CB 4.24Å; F63-L71 HydrophobicContact CG-CD1 4.41Å; F63-L71 HydrophobicContact CG-CD2 4.18Å; F63-L71 WeakPolarHBondContact O-CB 3.42Å; V68-L71 HydrophobicContact CB-CB 4.31Å; V68-L71 HydrophobicContact CB-CD1 4.15Å; V68-L71 HydrophobicContact CB-CG 4.14Å; V68-L71 HydrophobicContact CG1-CG 4.2Å; V68-L71 PolarHBondContact O-N 2.95Å; L71-R73 VanDerWaalsContact C-N 3.34Å; L71-R73 PolarHBondContact O-N 3.36Å; L71-F74 WeakPolarHBondContact O-CB 3.4Å; L71-F74 PolarHBondContact O-N 3.07Å; L71-T75 PolarHBondContact O-N 2.86Å; L71-T75 PolarHBondContact O-OG1 2.96Å
72Q96.4Very high95.9Very high47 Ų4731.9 Ų31.922%0.2216%0.164CC..Hα-helixtrans-58.3-46.3173.3-71179.6-30.900111.7Y64 V68 T75 L76Y64-Q72 HydrophobicContact CD2-CB 4.11Å; Y64-Q72 HydrophobicContact CD2-CG 4.09Å; Y64-Q72 HydrophobicContact CE2-CB 4.02Å; Y64-Q72 HydrophobicContact CE2-CG 4.22Å; Y64-Q72 HydrophobicContact CG-CG 4.26Å; Y64-Q72 WeakPolarHBondContact O-CG 3.43Å; Y64-Q72 PolarHBondContact O-NE2 3.25Å; Y64-Q72 VanDerWaalsContact O-NE2 3.16Å; V68-Q72 PolarHBondContact O-N 3.4Å; Q72-T75 PolarHBondContact O-N 3.46Å; Q72-L76 WeakPolarHBondContact O-CG 3.43Å; Q72-L76 PolarHBondContact O-N 3.47Å
73R95.8Very high95.9Very high82 Ų8229.2 Ų29.231%0.30915%0.151SC..Hα-helixtrans-64.1-39.6175.6-69.6163-169.6179.11.2112.1P69 L71 T75 L76 Q77 Y194P69-R73 WeakPolarHBondContact O-CB 3.22Å; P69-R73 VanDerWaalsContact O-CD 3.26Å; P69-R73 WeakPolarHBondContact O-CD 3.47Å; P69-R73 WeakPolarHBondContact O-CG 3.22Å; P69-R73 PolarHBondContact O-N 2.9Å; L71-R73 VanDerWaalsContact C-N 3.34Å; L71-R73 PolarHBondContact O-N 3.36Å; R73-T75 VanDerWaalsContact C-N 3.31Å; R73-T75 PolarHBondContact O-N 3.15Å; R73-L76 PolarHBondContact O-N 3.03Å; R73-Q77 PolarHBondContact O-N 2.84Å; R73-Q77 VanDerWaalsContact O-N 3.08Å; R73-Y194 VanDerWaalsContact NH1-CD1 3.32Å
74F96.4Very high95.8Very high17 Ų1730.9 Ų30.98%0.07516%0.158CC..Hα-helixtrans-59.4-42174.9-177.8-89.3000111.6W12 L31 L37 I38 L41 L60 F63 Q70 L71 Q77 F78W12-F74 HydrophobicContact CZ2-CE1 4.17Å; L31-F74 HydrophobicContact CB-CD2 4.22Å; L31-F74 HydrophobicContact CB-CE2 4.27Å; L31-F74 HydrophobicContact CD1-CB 4.45Å; L31-F74 HydrophobicContact CD1-CD1 4.34Å; L31-F74 HydrophobicContact CD1-CD2 3.99Å; L31-F74 HydrophobicContact CD1-CE2 4.31Å; L31-F74 HydrophobicContact CD1-CG 4Å; L31-F74 HydrophobicContact CD2-CE2 4.44Å; L31-F74 HydrophobicContact CD2-CZ 4.48Å; L37-F74 HydrophobicContact CD2-CE2 4.44Å; L37-F74 HydrophobicContact CD2-CZ 3.88Å; L37-F74 HydrophobicContact CG-CZ 4.44Å; I38-F74 HydrophobicContact CG1-CE2 4.16Å; L41-F74 HydrophobicContact CD1-CE1 3.9Å; L41-F74 HydrophobicContact CD1-CZ 3.71Å; L60-F74 HydrophobicContact CD2-CD1 4.21Å; L60-F74 HydrophobicContact CD2-CE1 4.11Å; F63-F74 AromaticContact CD2-CD1 3.77Å; F63-F74 HydrophobicContact CD2-CD1 3.77Å; F63-F74 HydrophobicContact CD2-CE1 4.26Å; F63-F74 AromaticContact CE2-CD1 3.87Å; F63-F74 HydrophobicContact CE2-CD1 3.87Å; F63-F74 AromaticContact CE2-CE1 3.97Å; F63-F74 HydrophobicContact CE2-CE1 3.97Å; Q70-F74 WeakPolarHBondContact O-CB 3.32Å; Q70-F74 PolarHBondContact O-N 3.3Å; L71-F74 WeakPolarHBondContact O-CB 3.4Å; L71-F74 PolarHBondContact O-N 3.07Å; F74-Q77 WeakPolarHBondContact O-CG 3.3Å; F74-Q77 PolarHBondContact O-NE2 3.06Å; F74-Q77 VanDerWaalsContact O-NE2 3.1Å; F74-F78 HydrophobicContact CD1-CE2 4.08Å; F74-F78 AromaticContact CE1-CE2 3.73Å; F74-F78 HydrophobicContact CE1-CE2 3.73Å; F74-F78 HydrophobicContact CE1-CZ 4.38Å; F74-F78 HydrophobicContact CZ-CE2 4.02Å; F74-F78 HydrophobicContact CZ-CZ 4.23Å; F74-F78 VanDerWaalsContact O-CD2 3.27Å; F74-F78 WeakPolarHBondContact O-CD2 3.29Å; F74-F78 VanDerWaalsContact O-CE2 3.26Å; F74-F78 WeakPolarHBondContact O-CE2 3.29Å
75T97.3Very high95.6Very high1 Ų130.9 Ų30.91%0.00616%0.158CC..Hα-helixtrans-67.7-45.8174.1-630000111.8L60 Y64 L71 Q72 R73 Q77 F78 I108L60-T75 HydrophobicContact CB-CG2 4.01Å; L60-T75 HydrophobicContact CD2-CG2 4.46Å; L60-T75 WeakPolarHBondContact O-CG2 3.5Å; L60-T75 PolarHBondContact O-OG1 3.27Å; Y64-T75 HydrophobicContact CD2-CG2 4.1Å; L71-T75 PolarHBondContact O-N 2.86Å; L71-T75 PolarHBondContact O-OG1 2.96Å; Q72-T75 PolarHBondContact O-N 3.46Å; R73-T75 VanDerWaalsContact C-N 3.31Å; R73-T75 PolarHBondContact O-N 3.15Å; T75-Q77 PolarHBondContact O-N 2.87Å; T75-F78 PolarHBondContact O-N 3.37Å; T75-F78 VanDerWaalsContact O-N 3.14Å; T75-I108 HydrophobicContact CG2-CD1 3.84Å
76L97.4Very high95.4Very high10 Ų1024.1 Ų24.15%0.05213%0.133CC..Hα-helixtrans-61.2-27.2-178.3-74.7173.8000113.7Y64 Q72 R73 F78 L79 Y188 A191 M195Y64-L76 HydrophobicContact CE2-CD1 4.22Å; Y64-L76 HydrophobicContact CE2-CD2 4Å; Y64-L76 HydrophobicContact CE2-CG 3.86Å; Q72-L76 WeakPolarHBondContact O-CG 3.43Å; Q72-L76 PolarHBondContact O-N 3.47Å; R73-L76 PolarHBondContact O-N 3.03Å; L76-F78 PolarHBondContact O-N 3.44Å; L76-F78 VanDerWaalsContact O-N 3.13Å; L76-L79 HydrophobicContact CD2-CD2 4.41Å; L76-L79 WeakPolarHBondContact O-CB 3.29Å; L76-L79 PolarHBondContact O-N 3.48Å; L76-Y188 VanDerWaalsContact O-CD2 3.3Å; L76-Y188 WeakPolarHBondContact O-CD2 3.22Å; L76-Y188 WeakPolarHBondContact O-CE2 3.49Å; L76-A191 HydrophobicContact CD1-CB 4.34Å; L76-M195 HydrophobicContact CB-CE 3.88Å
77Q96.2Very high95.2Very high9 Ų922 Ų224%0.04212%0.118CC..THydrogen-bonded Turntrans-59.6-28.5178.789.2-170.5-43.200112.5Y42 R73 F74 T75 M195 S199Y42-Q77 PolarHBondContact OH-O 3.21Å; R73-Q77 PolarHBondContact O-N 2.84Å; R73-Q77 VanDerWaalsContact O-N 3.08Å; F74-Q77 WeakPolarHBondContact O-CG 3.3Å; F74-Q77 PolarHBondContact O-NE2 3.06Å; F74-Q77 VanDerWaalsContact O-NE2 3.1Å; T75-Q77 PolarHBondContact O-N 2.87Å; Q77-M195 HydrophobicContact CB-SD 4.19Å; Q77-S199 WeakPolarHBondContact CA-OG 3.4Å; Q77-S199 WeakPolarHBondContact O-CB 3.28Å; Q77-S199 PolarHBondContact O-OG 3.48Å
78F97.7Very high95Very high0 Ų020.6 Ų20.60%010%0.102CC..THydrogen-bonded Turntrans-88.7-8178.8-55.4-69.8000113.4I38 L41 Y42 I45 L60 F74 T75 L76 P80 E81 L82I38-F78 HydrophobicContact CG1-CZ 4.46Å; I38-F78 HydrophobicContact CG2-CE1 4.02Å; I38-F78 HydrophobicContact CG2-CZ 4.24Å; L41-F78 HydrophobicContact CB-CE1 3.77Å; L41-F78 HydrophobicContact CB-CZ 3.77Å; L41-F78 HydrophobicContact CD1-CE1 4.43Å; L41-F78 HydrophobicContact CD1-CE2 3.88Å; L41-F78 HydrophobicContact CD1-CZ 3.58Å; L41-F78 HydrophobicContact CG-CZ 4.34Å; Y42-F78 HydrophobicContact CD1-CD1 4.11Å; Y42-F78 HydrophobicContact CD2-CD1 4.05Å; Y42-F78 AromaticContact CD2-CE1 3.8Å; Y42-F78 HydrophobicContact CD2-CE1 3.8Å; Y42-F78 AromaticContact CE1-CD1 3.91Å; Y42-F78 HydrophobicContact CE1-CD1 3.91Å; Y42-F78 AromaticContact CE2-CD1 3.86Å; Y42-F78 HydrophobicContact CE2-CD1 3.86Å; Y42-F78 AromaticContact CE2-CE1 3.76Å; Y42-F78 HydrophobicContact CE2-CE1 3.76Å; Y42-F78 HydrophobicContact CG-CD1 4.16Å; Y42-F78 HydrophobicContact CG-CE1 4.24Å; Y42-F78 AromaticContact CZ-CD1 3.77Å; I45-F78 HydrophobicContact CD1-CB 3.74Å; I45-F78 HydrophobicContact CD1-CD1 4.02Å; I45-F78 HydrophobicContact CD1-CG 3.93Å; L60-F78 HydrophobicContact CD1-CD2 4.4Å; L60-F78 HydrophobicContact CD2-CD2 4.14Å; L60-F78 HydrophobicContact CD2-CE2 4.25Å; F74-F78 HydrophobicContact CD1-CE2 4.08Å; F74-F78 AromaticContact CE1-CE2 3.73Å; F74-F78 HydrophobicContact CE1-CE2 3.73Å; F74-F78 HydrophobicContact CE1-CZ 4.38Å; F74-F78 HydrophobicContact CZ-CE2 4.02Å; F74-F78 HydrophobicContact CZ-CZ 4.23Å; F74-F78 VanDerWaalsContact O-CD2 3.27Å; F74-F78 WeakPolarHBondContact O-CD2 3.29Å; F74-F78 VanDerWaalsContact O-CE2 3.26Å; F74-F78 WeakPolarHBondContact O-CE2 3.29Å; T75-F78 PolarHBondContact O-N 3.37Å; T75-F78 VanDerWaalsContact O-N 3.14Å; L76-F78 PolarHBondContact O-N 3.44Å; L76-F78 VanDerWaalsContact O-N 3.13Å; F78-P80 VanDerWaalsContact C-CD 3.46Å; F78-P80 VanDerWaalsContact C-N 3.33Å; F78-E81 PolarHBondContact O-N 2.93Å; F78-E81 VanDerWaalsContact O-N 3.09Å; F78-L82 HydrophobicContact CB-CD1 4.27Å; F78-L82 WeakPolarHBondContact O-CG 3.14Å; F78-L82 PolarHBondContact O-N 3.12Å
79L98.3Very high94.2Very high2 Ų220.4 Ų20.41%0.0110%0.1CC..Hα-helixtrans-50.6-46.4-176.9-175.375.6000112.4L76 E81 L82 L83 L105 L184 Y188L76-L79 HydrophobicContact CD2-CD2 4.41Å; L76-L79 WeakPolarHBondContact O-CB 3.29Å; L76-L79 PolarHBondContact O-N 3.48Å; L79-E81 VanDerWaalsContact C-N 3.29Å; L79-E81 PolarHBondContact O-N 3.37Å; L79-L82 PolarHBondContact O-N 2.95Å; L79-L82 VanDerWaalsContact O-N 3.17Å; L79-L83 HydrophobicContact CD1-CD2 4.27Å; L79-L83 HydrophobicContact CD1-CG 4.32Å; L79-L83 HydrophobicContact CG-CD1 4.33Å; L79-L83 HydrophobicContact CG-CG 4.13Å; L79-L83 VanDerWaalsContact O-CG 3.32Å; L79-L83 WeakPolarHBondContact O-CG 3.49Å; L79-L83 PolarHBondContact O-N 3.29Å; L79-L105 HydrophobicContact CD1-CD2 3.51Å; L79-L184 HydrophobicContact CD1-CB 4.21Å; L79-L184 HydrophobicContact CD1-CD1 4.45Å; L79-L184 HydrophobicContact CD2-CB 4.17Å; L79-L184 VanDerWaalsContact CD2-O 3.29Å; L79-L184 WeakPolarHBondContact CD2-O 3.23Å; L79-Y188 HydrophobicContact CB-CD2 4.19Å; L79-Y188 HydrophobicContact CD2-CD2 4.28Å; L79-Y188 HydrophobicContact CD2-CG 4.25Å
80P98.1Very high92.8Very high0 Ų020.1 Ų20.10%010%0.1CC..Hα-helixtrans-61.8-36.2-177.2-22.834000113.9F78 W84 Y188 L203 L206F78-P80 VanDerWaalsContact C-CD 3.46Å; F78-P80 VanDerWaalsContact C-N 3.33Å; P80-W84 PolarHBondContact O-N 3Å; P80-W84 VanDerWaalsContact O-N 3.1Å; P80-Y188 HydrophobicContact CG-CD2 4.44Å; P80-Y188 HydrophobicContact CG-CE2 3.87Å; P80-L203 HydrophobicContact CB-CB 4.25Å; P80-L203 HydrophobicContact CB-CD1 4.5Å; P80-L203 HydrophobicContact CG-CB 3.98Å; P80-L203 HydrophobicContact CG-CD1 4.26Å; P80-L206 HydrophobicContact CB-CB 4.26Å; P80-L206 HydrophobicContact CB-CD2 3.93Å
81E96.8Very high91.1Very high5 Ų516.8 Ų16.82%0.0239%0.089CC..Hα-helixtrans-74.6-37.8177-161.876.2-127.600111.3Y42 I45 R46 F78 L79 L83 W84 S85 S202 R209Y42-E81 HydrophobicContact CD1-CB 4.05Å; Y42-E81 HydrophobicContact CD1-CG 4.22Å; Y42-E81 HydrophobicContact CE1-CB 4Å; I45-E81 HydrophobicContact CG2-CB 4.09Å; I45-E81 HydrophobicContact CG2-CG 3.82Å; R46-E81 HydrophobicContact CG-CG 3.87Å; R46-E81 WeakPolarHBondContact CG-OE1 3.48Å; R46-E81 IonicContact CZ-OE2 2.56Å; R46-E81 VanDerWaalsContact NE-CD 3.34Å; R46-E81 IonicContact NE-OE1 3Å; R46-E81 IonicContact NE-OE2 3.42Å; R46-E81 PolarHBondContact NE-OE2 3.05Å; R46-E81 IonicContact NH2-OE2 2.73Å; R46-E81 PolarHBondContact NH2-OE2 3.02Å; F78-E81 PolarHBondContact O-N 2.93Å; F78-E81 VanDerWaalsContact O-N 3.09Å; L79-E81 VanDerWaalsContact C-N 3.29Å; L79-E81 PolarHBondContact O-N 3.37Å; E81-L83 VanDerWaalsContact C-N 3.34Å; E81-L83 PolarHBondContact O-N 3.39Å; E81-W84 PolarHBondContact O-N 2.96Å; E81-S85 WeakPolarHBondContact O-CB 3.19Å; E81-S85 PolarHBondContact O-N 3.28Å; E81-S202 PolarHBondContact OE2-OG 2.97Å; E81-R209 IonicContact OE1-NH1 2.76Å
82L96.6Very high89.4Confident0 Ų019.6 Ų19.60%011%0.112CC..Hα-helixtrans-60.1-43.3173.3-68.5166.9000111.5I45 F78 L79 S85 L86 I101 L104 L105I45-L82 HydrophobicContact CD1-CD2 4.15Å; I45-L82 HydrophobicContact CD1-CG 4.39Å; I45-L82 HydrophobicContact CG1-CD2 4.25Å; I45-L82 HydrophobicContact CG2-CD2 3.82Å; I45-L82 HydrophobicContact CG2-CG 4.23Å; F78-L82 HydrophobicContact CB-CD1 4.27Å; F78-L82 WeakPolarHBondContact O-CG 3.14Å; F78-L82 PolarHBondContact O-N 3.12Å; L79-L82 PolarHBondContact O-N 2.95Å; L79-L82 VanDerWaalsContact O-N 3.17Å; L82-S85 PolarHBondContact O-N 3.29Å; L82-L86 WeakPolarHBondContact O-CB 3.48Å; L82-L86 PolarHBondContact O-N 3.07Å; L82-I101 HydrophobicContact CB-CG2 4.31Å; L82-I101 HydrophobicContact CD2-CD1 4.35Å; L82-I101 HydrophobicContact CD2-CG1 4.08Å; L82-I101 HydrophobicContact CD2-CG2 4.07Å; L82-L104 HydrophobicContact CD1-CD2 3.71Å; L82-L104 HydrophobicContact CD2-CD2 4.04Å; L82-L105 HydrophobicContact CB-CD2 4.05Å
83L96.1Very high87.5Confident0 Ų028.3 Ų28.30%014%0.143CC..Hα-helixtrans-62.5-44.7175.6-67.1-168.8000111.8L79 E81 S85 L87 L105 L181 L206 F236L79-L83 HydrophobicContact CD1-CD2 4.27Å; L79-L83 HydrophobicContact CD1-CG 4.32Å; L79-L83 HydrophobicContact CG-CD1 4.33Å; L79-L83 HydrophobicContact CG-CG 4.13Å; L79-L83 VanDerWaalsContact O-CG 3.32Å; L79-L83 WeakPolarHBondContact O-CG 3.49Å; L79-L83 PolarHBondContact O-N 3.29Å; E81-L83 VanDerWaalsContact C-N 3.34Å; E81-L83 PolarHBondContact O-N 3.39Å; L83-S85 VanDerWaalsContact C-N 3.35Å; L83-L87 WeakPolarHBondContact O-CB 3.46Å; L83-L87 VanDerWaalsContact O-CG 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.22Å; L83-L87 PolarHBondContact O-N 3.3Å; L83-L87 VanDerWaalsContact O-N 3.09Å; L83-L105 HydrophobicContact CD2-CD1 4.02Å; L83-L105 HydrophobicContact CD2-CD2 3.99Å; L83-L181 HydrophobicContact CD2-CB 4.38Å; L83-L181 HydrophobicContact CD2-CD1 4.22Å; L83-L181 HydrophobicContact CD2-CD2 3.62Å; L83-L181 HydrophobicContact CD2-CG 4.23Å; L83-L206 HydrophobicContact CB-CD1 4.23Å; L83-L206 HydrophobicContact CB-CD2 4.1Å; L83-L206 HydrophobicContact CD1-CD2 4.15Å; L83-F236 HydrophobicContact CD1-CE2 4.33Å; L83-F236 HydrophobicContact CD1-CZ 4.47Å
84W94.3Very high85.6Confident34 Ų3428.6 Ų28.613%0.12915%0.15CC..Hα-helixtrans-61.9-46.3176.9174.6-112.1000110.9P80 E81 L86 L87 S88 L206 R209 V210 L230P80-W84 PolarHBondContact O-N 3Å; P80-W84 VanDerWaalsContact O-N 3.1Å; E81-W84 PolarHBondContact O-N 2.96Å; W84-L86 PolarHBondContact O-N 3.04Å; W84-L87 PolarHBondContact O-N 3.14Å; W84-S88 WeakPolarHBondContact O-CB 3.3Å; W84-S88 PolarHBondContact O-N 3.45Å; W84-S88 PolarHBondContact O-OG 2.51Å; W84-L206 HydrophobicContact CB-CD1 3.69Å; W84-L206 HydrophobicContact CE3-CD1 4.38Å; W84-R209 HydrophobicContact CD2-CB 4.31Å; W84-R209 HydrophobicContact CE3-CB 3.85Å; W84-R209 HydrophobicContact CH2-CB 3.76Å; W84-R209 HydrophobicContact CH2-CG 4.43Å; W84-R209 HydrophobicContact CZ2-CB 4.21Å; W84-R209 HydrophobicContact CZ2-CG 4.44Å; W84-R209 HydrophobicContact CZ3-CB 3.56Å; W84-R209 VanDerWaalsContact NE1-NH1 3.16Å; W84-V210 HydrophobicContact CE3-CG2 3.91Å; W84-V210 HydrophobicContact CZ3-CG2 4.09Å; W84-L230 HydrophobicContact CZ3-CD1 4.19Å
85S91.8Very high83.4Confident4 Ų433.3 Ų33.33%0.02818%0.183CC..Hα-helixtrans-57.1-50.9179.6177.90000111.4N48 E81 L82 L83 L87 S88 V89 I101N48-S85 PolarHBondContact ND2-OG 3.49Å; N48-S85 PolarHBondContact OD1-OG 2.96Å; E81-S85 WeakPolarHBondContact O-CB 3.19Å; E81-S85 PolarHBondContact O-N 3.28Å; L82-S85 PolarHBondContact O-N 3.29Å; L83-S85 VanDerWaalsContact C-N 3.35Å; S85-L87 PolarHBondContact O-N 3.16Å; S85-S88 PolarHBondContact O-N 2.84Å; S85-S88 PolarHBondContact O-OG 3.47Å; S85-V89 WeakPolarHBondContact O-CG2 3.31Å; S85-V89 PolarHBondContact O-N 3.08Å; S85-I101 WeakPolarHBondContact OG-CD1 3.36Å
86L91Very high81.3Confident10 Ų1041.3 Ų41.35%0.05222%0.22CC..Hα-helixtrans-54.6-52.4175.7174.665.3000112.7L82 W84 S88 V89 S90 I101 E102 L105 F172 L181L82-L86 WeakPolarHBondContact O-CB 3.48Å; L82-L86 PolarHBondContact O-N 3.07Å; W84-L86 PolarHBondContact O-N 3.04Å; L86-S88 VanDerWaalsContact C-N 3.27Å; L86-S88 PolarHBondContact O-N 2.95Å; L86-V89 PolarHBondContact O-N 3.29Å; L86-S90 WeakPolarHBondContact O-CB 3.16Å; L86-S90 PolarHBondContact O-N 3.32Å; L86-S90 VanDerWaalsContact O-N 3.1Å; L86-S90 PolarHBondContact O-OG 3.5Å; L86-S90 VanDerWaalsContact O-OG 3.11Å; L86-I101 HydrophobicContact CB-CG2 4.29Å; L86-E102 HydrophobicContact CD1-CG 3.25Å; L86-L105 HydrophobicContact CB-CD1 4.09Å; L86-L105 HydrophobicContact CD2-CD1 3.65Å; L86-L105 HydrophobicContact CG-CD1 4.44Å; L86-F172 HydrophobicContact CD2-CE1 4.28Å; L86-F172 HydrophobicContact CD2-CE2 4.11Å; L86-F172 HydrophobicContact CD2-CZ 3.96Å; L86-L181 HydrophobicContact CD2-CD1 4.33Å; L86-L181 HydrophobicContact CD2-CD2 3.84Å
87L90.1Very high79.5Confident4 Ų443.3 Ų43.32%0.02123%0.233CC..Hα-helixtrans-66.6-32.8-176.5-70.7173.8000112.1L83 W84 S85 A91 F178 L181 V210 L230L83-L87 WeakPolarHBondContact O-CB 3.46Å; L83-L87 VanDerWaalsContact O-CG 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.22Å; L83-L87 PolarHBondContact O-N 3.3Å; L83-L87 VanDerWaalsContact O-N 3.09Å; W84-L87 PolarHBondContact O-N 3.14Å; S85-L87 PolarHBondContact O-N 3.16Å; L87-A91 PolarHBondContact O-N 3.25Å; L87-F178 HydrophobicContact CD2-CE2 4.38Å; L87-F178 HydrophobicContact CD2-CZ 3.86Å; L87-L181 HydrophobicContact CD1-CD1 4.04Å; L87-L181 HydrophobicContact CD2-CD1 3.79Å; L87-L181 HydrophobicContact CG-CD1 3.92Å; L87-V210 HydrophobicContact CD1-CG2 3.9Å; L87-L230 HydrophobicContact CB-CD1 4.35Å
88S85.4Confident78Confident14 Ų1445.3 Ų45.310%0.09825%0.248CC..Hα-helixtrans-69.6-47.2179.6760000111.4W84 S85 L86 A91 A92 I226W84-S88 WeakPolarHBondContact O-CB 3.3Å; W84-S88 PolarHBondContact O-N 3.45Å; W84-S88 PolarHBondContact O-OG 2.51Å; S85-S88 PolarHBondContact O-N 2.84Å; S85-S88 PolarHBondContact O-OG 3.47Å; L86-S88 VanDerWaalsContact C-N 3.27Å; L86-S88 PolarHBondContact O-N 2.95Å; S88-A91 PolarHBondContact O-N 3.3Å; S88-A92 PolarHBondContact O-N 2.93Å; S88-I226 VanDerWaalsContact C-CD1 3.41Å; S88-I226 VanDerWaalsContact CA-CD1 3.42Å; S88-I226 WeakPolarHBondContact O-CD1 3.46Å
89V77.4Confident77.4Confident26 Ų2647.4 Ų47.416%0.15827%0.269CS..Hα-helixtrans-64.1-44.8179168.60000111.5N48 S85 L86 A91 A92 R93 T97N48-V89 WeakPolarHBondContact ND2-CG2 3.4Å; S85-V89 WeakPolarHBondContact O-CG2 3.31Å; S85-V89 PolarHBondContact O-N 3.08Å; L86-V89 PolarHBondContact O-N 3.29Å; V89-A91 PolarHBondContact O-N 2.98Å; V89-A91 VanDerWaalsContact O-N 3.11Å; V89-A92 PolarHBondContact O-N 3.29Å; V89-R93 PolarHBondContact O-N 2.98Å; V89-T97 HydrophobicContact CB-CG2 4.41Å; V89-T97 HydrophobicContact CG1-CG2 3.53Å; V89-T97 WeakPolarHBondContact CG1-OG1 3.48Å; V89-T97 HydrophobicContact CG2-CG2 3.96Å
90S65.6Low77Confident62 Ų6248.1 Ų48.143%0.43427%0.274SS..Hα-helixtrans-55.1-31.8176.2-72.40000112.9L86L86-S90 WeakPolarHBondContact O-CB 3.16Å; L86-S90 PolarHBondContact O-N 3.32Å; L86-S90 VanDerWaalsContact O-N 3.1Å; L86-S90 PolarHBondContact O-OG 3.5Å; L86-S90 VanDerWaalsContact O-OG 3.11Å
91A59.4Low76.8Confident25 Ų2548.6 Ų48.621%0.20728%0.276CS..Hα-helixtrans-85.4-20.4178.600000113.6L87 S88 V89 I226 L230L87-A91 PolarHBondContact O-N 3.25Å; S88-A91 PolarHBondContact O-N 3.3Å; V89-A91 PolarHBondContact O-N 2.98Å; V89-A91 VanDerWaalsContact O-N 3.11Å; A91-I226 HydrophobicContact CB-CG2 3.75Å; A91-L230 HydrophobicContact CB-CD2 3.8Å
92A59.7Low76.6Confident59 Ų5951.9 Ų51.949%0.48829%0.292SS..Hα-helixtrans-86.1-15.4-179.100000114.1S88 V89 D94 I226S88-A92 PolarHBondContact O-N 2.93Å; V89-A92 PolarHBondContact O-N 3.29Å; A92-D94 VanDerWaalsContact C-N 3.32Å; A92-D94 PolarHBondContact O-N 3.13Å; A92-I226 HydrophobicContact CB-CD1 4.46Å; A92-I226 HydrophobicContact CB-CG1 4.33Å
93R55.6Low76.6Confident231 Ų23154.9 Ų54.987%0.87232%0.316SS*.THydrogen-bonded Turntrans54.640-179.3-58.6-173.4177.7-161.3-1113.8V89 P95V89-R93 PolarHBondContact O-N 2.98Å; R93-P95 WeakPolarHBondContact O-CD 3.41Å
94D56.1Low76.6Confident87 Ų8755 Ų5547%0.46532%0.317SS..  trans-91.5116.8176.2-163.2-14.9000110.6A92 H96 T97A92-D94 VanDerWaalsContact C-N 3.32Å; A92-D94 PolarHBondContact O-N 3.13Å; D94-H96 PolarHBondContact O-N 3.37Å; D94-H96 IonicContact OD1-CD2 2.82Å; D94-H96 PolarHBondContact OD1-N 3.26Å; D94-T97 PolarHBondContact O-OG1 3.05Å
95P50.4Low76.8Confident116 Ų11653.4 Ų53.475%0.75331%0.311SS*.THydrogen-bonded Turntrans-71.2-10.4-178.7-15.630.1000114.9R93R93-P95 WeakPolarHBondContact O-CD 3.41Å
96H52.8Low77Confident170 Ų17054 Ų5479%0.78731%0.313SS*.THydrogen-bonded Turntrans-97.44.3-170.3-67.5-61.8000115.2D94 S98D94-H96 PolarHBondContact O-N 3.37Å; D94-H96 IonicContact OD1-CD2 2.82Å; D94-H96 PolarHBondContact OD1-N 3.26Å; H96-S98 PolarHBondContact O-N 2.95Å
97T60.6Low77.3Confident52 Ų5254.1 Ų54.132%0.31932%0.318SS..SBendtrans-76.1126.6178.848.10000111.3V89 D94 G99V89-T97 HydrophobicContact CB-CG2 4.41Å; V89-T97 HydrophobicContact CG1-CG2 3.53Å; V89-T97 WeakPolarHBondContact CG1-OG1 3.48Å; V89-T97 HydrophobicContact CG2-CG2 3.96Å; D94-T97 PolarHBondContact O-OG1 3.05Å; T97-G99 PolarHBondContact O-N 3.19Å; T97-G99 VanDerWaalsContact O-N 3.12Å
98S63.6Low77.7Confident51 Ų5154 Ų5436%0.35732%0.317SS..  trans-59.1117.4173.860.70000108.5H96 C100H96-S98 PolarHBondContact O-N 2.95Å; S98-C100 PolarHBondContact O-N 3.37Å; S98-C100 PolarHBondContact O-SG 3.25Å; S98-C100 PolarHBondContact OG-SG 3.28Å
99G85.4Confident78.3Confident43 Ų4353.4 Ų53.444%0.44331%0.313SS..THydrogen-bonded Turntrans-64.921.1177.900000114T97 E102 A103T97-G99 PolarHBondContact O-N 3.19Å; T97-G99 VanDerWaalsContact O-N 3.12Å; G99-E102 WeakPolarHBondContact O-CB 3.49Å; G99-E102 PolarHBondContact O-N 3.41Å; G99-A103 WeakPolarHBondContact O-CB 3.39Å; G99-A103 PolarHBondContact O-N 3.46Å
100C91.1Very high79.2Confident17 Ų1754 Ų5412%0.11532%0.315CS..Hα-helixtrans-67.7-37.9-176.962.60000112.4E54 C57 S98 A103 L104E54-C100 HydrophobicContact CB-CB 4.33Å; E54-C100 HydrophobicContact CG-CB 4.32Å; C57-C100 HydrophobicContact CB-CB 4.02Å; S98-C100 PolarHBondContact O-N 3.37Å; S98-C100 PolarHBondContact O-SG 3.25Å; S98-C100 PolarHBondContact OG-SG 3.28Å; C100-A103 PolarHBondContact O-N 3.47Å; C100-L104 VanDerWaalsContact O-CB 3.31Å; C100-L104 WeakPolarHBondContact O-CB 3.43Å; C100-L104 PolarHBondContact O-N 2.97Å
101I93.4Very high80.7Confident10 Ų1054.2 Ų54.25%0.05131%0.311CS..Hα-helixtrans-67.1-41173.9-64.5177.8000110.2L53 L82 S85 L86 L104 L105L53-I101 HydrophobicContact CD1-CD1 4.25Å; L53-I101 HydrophobicContact CD1-CG1 4.37Å; L53-I101 HydrophobicContact CD2-CD1 4.13Å; L53-I101 HydrophobicContact CD2-CG1 4.36Å; L82-I101 HydrophobicContact CB-CG2 4.31Å; L82-I101 HydrophobicContact CD2-CD1 4.35Å; L82-I101 HydrophobicContact CD2-CG1 4.08Å; L82-I101 HydrophobicContact CD2-CG2 4.07Å; S85-I101 WeakPolarHBondContact OG-CD1 3.36Å; L86-I101 HydrophobicContact CB-CG2 4.29Å; I101-L104 PolarHBondContact O-N 2.93Å; I101-L105 HydrophobicContact CG2-CD1 3.81Å; I101-L105 HydrophobicContact CG2-CG 4.27Å; I101-L105 WeakPolarHBondContact O-CB 3.41Å; I101-L105 VanDerWaalsContact O-CG 3.28Å; I101-L105 WeakPolarHBondContact O-CG 3.49Å; I101-L105 PolarHBondContact O-N 3.47Å
102E93.2Very high82.5Confident75 Ų7554.4 Ų54.435%0.3531%0.308SS..Hα-helixtrans-59-51.3174.2-75.8-178.2-169.700110.9L86 G99 L104 L105 L106 F172L86-E102 HydrophobicContact CD1-CG 3.25Å; G99-E102 WeakPolarHBondContact O-CB 3.49Å; G99-E102 PolarHBondContact O-N 3.41Å; E102-L104 VanDerWaalsContact C-N 3.35Å; E102-L104 PolarHBondContact O-N 3.36Å; E102-L105 PolarHBondContact O-N 2.95Å; E102-L106 WeakPolarHBondContact O-CB 3.4Å; E102-L106 PolarHBondContact O-N 3.34Å; E102-F172 HydrophobicContact CB-CD2 3.87Å; E102-F172 HydrophobicContact CB-CE2 4.14Å; E102-F172 HydrophobicContact CG-CD2 3.83Å; E102-F172 HydrophobicContact CG-CE2 4.28Å; E102-F172 WeakPolarHBondContact O-CE2 3.46Å
103A94.8Very high84.2Confident62 Ų6251.7 Ų51.751%0.51229%0.285SS..Hα-helixtrans-60-42.5178.200000112.4G99 C100 G107G99-A103 WeakPolarHBondContact O-CB 3.39Å; G99-A103 PolarHBondContact O-N 3.46Å; C100-A103 PolarHBondContact O-N 3.47Å; A103-G107 PolarHBondContact O-N 3.49Å
104L97.1Very high86Confident4 Ų442.6 Ų42.62%0.02126%0.255CS..Hα-helixtrans-60.9-53176.5171.562.2000111.6C57 L60 F61 L82 C100 I101 E102 L106 G107 I108C57-L104 HydrophobicContact CB-CB 4.3Å; C57-L104 HydrophobicContact CB-CD2 4.16Å; L60-L104 HydrophobicContact CB-CD1 4.22Å; L60-L104 HydrophobicContact CB-CD2 4.2Å; L60-L104 HydrophobicContact CD1-CD2 4.27Å; F61-L104 HydrophobicContact CB-CD1 3.64Å; F61-L104 HydrophobicContact CD2-CD1 4.41Å; L82-L104 HydrophobicContact CD1-CD2 3.71Å; L82-L104 HydrophobicContact CD2-CD2 4.04Å; C100-L104 VanDerWaalsContact O-CB 3.31Å; C100-L104 WeakPolarHBondContact O-CB 3.43Å; C100-L104 PolarHBondContact O-N 2.97Å; I101-L104 PolarHBondContact O-N 2.93Å; E102-L104 VanDerWaalsContact C-N 3.35Å; E102-L104 PolarHBondContact O-N 3.36Å; L104-L106 VanDerWaalsContact C-N 3.32Å; L104-L106 PolarHBondContact O-N 3.06Å; L104-G107 PolarHBondContact O-N 2.84Å; L104-I108 HydrophobicContact CD1-CD1 3.67Å; L104-I108 HydrophobicContact CD1-CG1 4.1Å; L104-I108 HydrophobicContact CG-CD1 3.99Å; L104-I108 VanDerWaalsContact O-CG1 3.31Å; L104-I108 WeakPolarHBondContact O-CG1 3.28Å; L104-I108 PolarHBondContact O-N 2.87Å
105L97.8Very high87.6Confident0 Ų041.4 Ų41.40%025%0.249CC..Hα-helixtrans-63.2-41.4-177.5-69.6172.7000111.4L79 L82 L83 L86 I101 E102 I108 Y109 F172 L184L79-L105 HydrophobicContact CD1-CD2 3.51Å; L82-L105 HydrophobicContact CB-CD2 4.05Å; L83-L105 HydrophobicContact CD2-CD1 4.02Å; L83-L105 HydrophobicContact CD2-CD2 3.99Å; L86-L105 HydrophobicContact CB-CD1 4.09Å; L86-L105 HydrophobicContact CD2-CD1 3.65Å; L86-L105 HydrophobicContact CG-CD1 4.44Å; I101-L105 HydrophobicContact CG2-CD1 3.81Å; I101-L105 HydrophobicContact CG2-CG 4.27Å; I101-L105 WeakPolarHBondContact O-CB 3.41Å; I101-L105 VanDerWaalsContact O-CG 3.28Å; I101-L105 WeakPolarHBondContact O-CG 3.49Å; I101-L105 PolarHBondContact O-N 3.47Å; E102-L105 PolarHBondContact O-N 2.95Å; L105-I108 PolarHBondContact O-N 3.25Å; L105-Y109 WeakPolarHBondContact O-CB 3.34Å; L105-Y109 PolarHBondContact O-N 3.31Å; L105-F172 HydrophobicContact CB-CE2 4.25Å; L105-F172 HydrophobicContact CB-CZ 4.08Å; L105-L184 HydrophobicContact CB-CD1 3.93Å; L105-L184 HydrophobicContact CD2-CD1 3.9Å; L105-L184 HydrophobicContact CG-CD1 4.47Å
106L96.8Very high89.2Confident15 Ų1546 Ų468%0.07926%0.257CS..Hα-helixtrans-67.7-39.6177.5-165.969.8000112E102 L104 Y109 N110 R169 E170 F172E102-L106 WeakPolarHBondContact O-CB 3.4Å; E102-L106 PolarHBondContact O-N 3.34Å; L104-L106 VanDerWaalsContact C-N 3.32Å; L104-L106 PolarHBondContact O-N 3.06Å; L106-Y109 WeakPolarHBondContact O-CB 3.43Å; L106-Y109 PolarHBondContact O-N 3.34Å; L106-N110 WeakPolarHBondContact O-CB 3.45Å; L106-N110 PolarHBondContact O-N 3.46Å; L106-N110 PolarHBondContact O-ND2 3.48Å; L106-R169 HydrophobicContact CD1-CB 3.65Å; L106-R169 WeakPolarHBondContact CD2-O 3.3Å; L106-R169 WeakPolarHBondContact CG-O 3.3Å; L106-E170 WeakPolarHBondContact CD2-O 3.16Å; L106-F172 HydrophobicContact CB-CE2 4.22Å
107G97.4Very high90.9Very high14 Ų1444.4 Ų44.414%0.14425%0.254CS..Hα-helixtrans-61.5-47.4174.200000112.1A103 L104 Y109 N110 L111A103-G107 PolarHBondContact O-N 3.49Å; L104-G107 PolarHBondContact O-N 2.84Å; G107-Y109 VanDerWaalsContact C-N 3.33Å; G107-Y109 PolarHBondContact O-N 2.85Å; G107-N110 PolarHBondContact O-N 3.44Å; G107-L111 WeakPolarHBondContact O-CG 3.44Å; G107-L111 PolarHBondContact O-N 3.17Å
108I98.1Very high92.2Very high2 Ų244.4 Ų44.41%0.0126%0.264CS..Hα-helixtrans-60.4-45.2175.2-67.8170.2000110.3Y64 T75 L104 L105 N110 L111 E112 L184Y64-I108 HydrophobicContact CD1-CB 4.48Å; Y64-I108 HydrophobicContact CD1-CG1 4.13Å; Y64-I108 HydrophobicContact CD1-CG2 4.18Å; Y64-I108 HydrophobicContact CD2-CD1 4.34Å; Y64-I108 HydrophobicContact CD2-CG1 4.21Å; Y64-I108 HydrophobicContact CD2-CG2 4.33Å; Y64-I108 HydrophobicContact CE1-CG2 3.82Å; Y64-I108 HydrophobicContact CE2-CG2 3.96Å; Y64-I108 HydrophobicContact CG-CD1 4.48Å; Y64-I108 HydrophobicContact CG-CG1 3.92Å; Y64-I108 HydrophobicContact CG-CG2 4.42Å; T75-I108 HydrophobicContact CG2-CD1 3.84Å; L104-I108 HydrophobicContact CD1-CD1 3.67Å; L104-I108 HydrophobicContact CD1-CG1 4.1Å; L104-I108 HydrophobicContact CG-CD1 3.99Å; L104-I108 VanDerWaalsContact O-CG1 3.31Å; L104-I108 WeakPolarHBondContact O-CG1 3.28Å; L104-I108 PolarHBondContact O-N 2.87Å; L105-I108 PolarHBondContact O-N 3.25Å; I108-N110 PolarHBondContact O-N 2.96Å; I108-L111 PolarHBondContact O-N 3.09Å; I108-E112 PolarHBondContact O-N 3.47Å; I108-L184 HydrophobicContact CB-CD2 4.12Å; I108-L184 HydrophobicContact CG2-CD2 3.58Å
109Y98.2Very high93.5Very high0 Ų048 Ų480%028%0.275CS..Hα-helixtrans-57.7-51.9178.3168.6-95.6000111.3L105 L106 G107 L111 E112 I113 L167 R169 V180 F183L105-Y109 WeakPolarHBondContact O-CB 3.34Å; L105-Y109 PolarHBondContact O-N 3.31Å; L106-Y109 WeakPolarHBondContact O-CB 3.43Å; L106-Y109 PolarHBondContact O-N 3.34Å; G107-Y109 VanDerWaalsContact C-N 3.33Å; G107-Y109 PolarHBondContact O-N 2.85Å; Y109-L111 VanDerWaalsContact C-N 3.26Å; Y109-L111 PolarHBondContact O-N 3.27Å; Y109-E112 PolarHBondContact O-N 3.14Å; Y109-I113 HydrophobicContact CD1-CD1 4.28Å; Y109-I113 HydrophobicContact CD2-CG2 4.02Å; Y109-I113 HydrophobicContact CE1-CD1 3.72Å; Y109-I113 HydrophobicContact CE1-CG2 4.22Å; Y109-I113 HydrophobicContact CE2-CG2 3.65Å; Y109-I113 HydrophobicContact CG-CG2 4.45Å; Y109-I113 WeakPolarHBondContact O-CG1 3.43Å; Y109-I113 WeakPolarHBondContact O-CG2 3.43Å; Y109-I113 PolarHBondContact O-N 3.18Å; Y109-I113 VanDerWaalsContact O-N 3.07Å; Y109-L167 WeakPolarHBondContact CE1-O 3.38Å; Y109-L167 PolarHBondContact OH-O 3.3Å; Y109-R169 HydrophobicContact CE1-CB 4.35Å; Y109-R169 HydrophobicContact CE1-CG 3.85Å; Y109-V180 HydrophobicContact CD1-CG1 4.39Å; Y109-V180 HydrophobicContact CD1-CG2 4.15Å; Y109-V180 HydrophobicContact CD2-CB 4.09Å; Y109-V180 HydrophobicContact CD2-CG1 3.77Å; Y109-V180 HydrophobicContact CD2-CG2 4.08Å; Y109-V180 HydrophobicContact CE1-CG2 4.04Å; Y109-V180 HydrophobicContact CE2-CB 4.28Å; Y109-V180 HydrophobicContact CE2-CG1 4.45Å; Y109-V180 HydrophobicContact CE2-CG2 3.97Å; Y109-V180 HydrophobicContact CG-CB 4.39Å; Y109-V180 HydrophobicContact CG-CG1 3.74Å; Y109-V180 HydrophobicContact CG-CG2 4.18Å; Y109-F183 HydrophobicContact CD2-CB 4.24Å; Y109-F183 AromaticContact CD2-CD1 3.62Å; Y109-F183 HydrophobicContact CD2-CD1 3.62Å; Y109-F183 HydrophobicContact CD2-CE1 4.44Å; Y109-F183 HydrophobicContact CD2-CG 4.32Å; Y109-F183 HydrophobicContact CE2-CB 4.07Å; Y109-F183 AromaticContact CE2-CD1 3.83Å; Y109-F183 HydrophobicContact CE2-CD1 3.83Å; Y109-F183 HydrophobicContact CE2-CG 4.2Å
110N97.2Very high93.9Very high39 Ų3948.9 Ų48.921%0.20928%0.275CS..Hα-helixtrans-62.8-33.2-179-72.9-28.7000112.4L106 G107 I108 I113 Q168 R169L106-N110 WeakPolarHBondContact O-CB 3.45Å; L106-N110 PolarHBondContact O-N 3.46Å; L106-N110 PolarHBondContact O-ND2 3.48Å; G107-N110 PolarHBondContact O-N 3.44Å; I108-N110 PolarHBondContact O-N 2.96Å; N110-I113 WeakPolarHBondContact O-CG1 3.47Å; N110-Q168 WeakPolarHBondContact OD1-CA 3.46Å; N110-R169 PolarHBondContact ND2-O 3.2Å; N110-R169 PolarHBondContact OD1-N 3.03Å
111L96.4Very high94Very high66 Ų6651.2 Ų51.235%0.34628%0.283SS..Hα-helixtrans-69.5-36.1173.2-74.4173.6000112.7F61 Y64 R65 G107 I108 Y109 V114F61-L111 HydrophobicContact CE2-CD1 3.67Å; F61-L111 HydrophobicContact CE2-CG 4.48Å; F61-L111 HydrophobicContact CZ-CD1 4.07Å; Y64-L111 HydrophobicContact CD1-CD1 4.03Å; R65-L111 HydrophobicContact CB-CD1 4.14Å; R65-L111 HydrophobicContact CG-CD1 4.46Å; G107-L111 WeakPolarHBondContact O-CG 3.44Å; G107-L111 PolarHBondContact O-N 3.17Å; I108-L111 PolarHBondContact O-N 3.09Å; Y109-L111 VanDerWaalsContact C-N 3.26Å; Y109-L111 PolarHBondContact O-N 3.27Å; L111-V114 WeakPolarHBondContact O-CG2 3.26Å
112E96.2Very high94Very high30 Ų3054.5 Ų54.514%0.1430%0.3CS..Hα-helixtrans-82.9-24.8-175.3-83.7-60.5149.200114.7Y64 I108 Y109 V114 K121 F183Y64-E112 HydrophobicContact CE1-CG 3.91Å; Y64-E112 WeakPolarHBondContact CE1-OE1 3.5Å; Y64-E112 WeakPolarHBondContact OH-CG 3.26Å; Y64-E112 PolarHBondContact OH-OE1 3.48Å; I108-E112 PolarHBondContact O-N 3.47Å; Y109-E112 PolarHBondContact O-N 3.14Å; E112-V114 VanDerWaalsContact C-N 3.28Å; E112-K121 WeakPolarHBondContact O-CD 3.44Å; E112-K121 PolarHBondContact O-NZ 2.91Å; E112-K121 IonicContact OE2-NZ 3.56Å; E112-K121 PolarHBondContact OE2-NZ 2.63Å; E112-F183 HydrophobicContact CB-CE1 3.55Å; E112-F183 HydrophobicContact CB-CZ 4.14Å
113I95.9Very high94.1Very high2 Ų252.5 Ų52.51%0.0129%0.292CS..SBendtrans-79.9-10.3179.862.8173000113.3Y109 N110 K121 H166 Q168 F183Y109-I113 HydrophobicContact CD1-CD1 4.28Å; Y109-I113 HydrophobicContact CD2-CG2 4.02Å; Y109-I113 HydrophobicContact CE1-CD1 3.72Å; Y109-I113 HydrophobicContact CE1-CG2 4.22Å; Y109-I113 HydrophobicContact CE2-CG2 3.65Å; Y109-I113 HydrophobicContact CG-CG2 4.45Å; Y109-I113 WeakPolarHBondContact O-CG1 3.43Å; Y109-I113 WeakPolarHBondContact O-CG2 3.43Å; Y109-I113 PolarHBondContact O-N 3.18Å; Y109-I113 VanDerWaalsContact O-N 3.07Å; N110-I113 WeakPolarHBondContact O-CG1 3.47Å; I113-K121 VanDerWaalsContact O-CB 3.31Å; I113-K121 WeakPolarHBondContact O-CB 3.22Å; I113-K121 PolarHBondContact O-N 3.27Å; I113-H166 HydrophobicContact CB-CB 3.93Å; I113-H166 HydrophobicContact CD1-CB 4.47Å; I113-H166 HydrophobicContact CG2-CB 3.49Å; I113-H166 VanDerWaalsContact CG2-CB 3.49Å; I113-Q168 HydrophobicContact CD1-CB 4.3Å; I113-Q168 HydrophobicContact CD1-CG 3.71Å; I113-F183 HydrophobicContact CB-CE1 4.39Å; I113-F183 HydrophobicContact CG2-CD1 3.74Å; I113-F183 HydrophobicContact CG2-CE1 3.31Å; I113-F183 HydrophobicContact CG2-CG 4.49Å; I113-F183 HydrophobicContact CG2-CZ 3.79Å
114V94Very high94.1Very high40 Ų4051 Ų5124%0.24228%0.278CS..BIsolated β-bridgetrans-101.6146.5174.5-62.40000110.5L111 E112 Q119L111-V114 WeakPolarHBondContact O-CG2 3.26Å; E112-V114 VanDerWaalsContact C-N 3.28Å; V114-Q119 CarbonylContact C-O 3.55Å; V114-Q119 VanDerWaalsContact CA-O 3.31Å; V114-Q119 WeakPolarHBondContact CA-O 3.38Å
115D88.6Confident94Very high62 Ų6255.8 Ų55.833%0.33230%0.298SS..  trans-87.7-177.1170.469.518.8000111.8D117 G118 Q119D115-D117 PolarHBondContact O-N 3.48Å; D115-D117 WeakPolarHBondContact OD1-CA 3.27Å; D115-D117 PolarHBondContact OD1-N 2.89Å; D115-G118 PolarHBondContact O-N 2.88Å; D115-G118 VanDerWaalsContact O-N 3.11Å; D115-G118 PolarHBondContact OD1-N 3.48Å; D115-Q119 PolarHBondContact N-O 3.29Å; D115-Q119 PolarHBondContact OD1-N 3.05Å
116K85.6Confident93.8Very high212 Ų21258.9 Ų58.992%0.92232%0.317SS*.THydrogen-bonded Turntrans-65-22.5-178.6-64-177.7179.8-179.10113.1G118K116-G118 VanDerWaalsContact C-N 3.33Å
117D88.3Confident93.4Very high136 Ų13661.3 Ų61.373%0.72733%0.332SS*.THydrogen-bonded Turntrans-95.15.3-179.6-56.2-48.6000111.4D115 Q119D115-D117 PolarHBondContact O-N 3.48Å; D115-D117 WeakPolarHBondContact OD1-CA 3.27Å; D115-D117 PolarHBondContact OD1-N 2.89Å; D117-Q119 VanDerWaalsContact C-N 3.28Å; D117-Q119 HydrophobicContact CB-CG 4.48Å; D117-Q119 PolarHBondContact O-N 2.93Å
118G88.3Confident93Very high52 Ų5266.2 Ų66.254%0.53636%0.362SS..SBendtrans76.510.1-179.400000114.2D115 K116D115-G118 PolarHBondContact O-N 2.88Å; D115-G118 VanDerWaalsContact O-N 3.11Å; D115-G118 PolarHBondContact OD1-N 3.48Å; K116-G118 VanDerWaalsContact C-N 3.33Å
119Q90.8Very high92.2Very high126 Ų12668.1 Ų68.159%0.58938%0.375SS*.SBendtrans-87.8158.9177.5-56.3-58-49.900111.2V114 D115 D117 K121V114-Q119 CarbonylContact C-O 3.55Å; V114-Q119 VanDerWaalsContact CA-O 3.31Å; V114-Q119 WeakPolarHBondContact CA-O 3.38Å; D115-Q119 PolarHBondContact N-O 3.29Å; D115-Q119 PolarHBondContact OD1-N 3.05Å; D117-Q119 VanDerWaalsContact C-N 3.28Å; D117-Q119 HydrophobicContact CB-CG 4.48Å; D117-Q119 PolarHBondContact O-N 2.93Å; Q119-K121 PolarHBondContact O-N 2.79Å
120S92.6Very high91.4Very high63 Ų6373 Ų7344%0.44140%0.401SS..BIsolated β-bridgetrans-63.4121.7175.5-62.80000111.1I122S120-I122 PolarHBondContact O-N 2.85Å
121K93.6Very high90.6Very high65 Ų6571.9 Ų71.928%0.28340%0.396SS..PPolyproline II helixtrans-68.3125.3177.7-169-179.7-173.7177.40110.1E112 I113 Q119 L123E112-K121 WeakPolarHBondContact O-CD 3.44Å; E112-K121 PolarHBondContact O-NZ 2.91Å; E112-K121 IonicContact OE2-NZ 3.56Å; E112-K121 PolarHBondContact OE2-NZ 2.63Å; I113-K121 VanDerWaalsContact O-CB 3.31Å; I113-K121 WeakPolarHBondContact O-CB 3.22Å; I113-K121 PolarHBondContact O-N 3.27Å; Q119-K121 PolarHBondContact O-N 2.79Å; K121-L123 HydrophobicContact CD-CD2 4.31Å; K121-L123 HydrophobicContact CG-CD2 4.15Å
122I94.4Very high89.8Confident80 Ų8071.3 Ų71.341%0.4139%0.391SS..  trans-113.6113.7174.7-61174.9000108.8S120 V161 P165S120-I122 PolarHBondContact O-N 2.85Å; I122-V161 HydrophobicContact CG2-CB 4.39Å; I122-V161 HydrophobicContact CG2-CG1 3.69Å; I122-V161 HydrophobicContact CG2-CG2 3.79Å; I122-P165 HydrophobicContact CD1-CB 4.47Å; I122-P165 HydrophobicContact CG1-CB 4.1Å
123L94.9Very high89.3Confident33 Ų3374 Ų7417%0.17341%0.411CS..EExtended strand (participates in β ladder)trans-87.3117.9177.7-59.2-178.3000109.7K121 Y162 S163 F183 L186K121-L123 HydrophobicContact CD-CD2 4.31Å; K121-L123 HydrophobicContact CG-CD2 4.15Å; L123-Y162 VanDerWaalsContact C-CE1 3.5Å; L123-Y162 HydrophobicContact CB-CD1 4.2Å; L123-Y162 HydrophobicContact CB-CE1 3.61Å; L123-Y162 HydrophobicContact CB-CE2 3.95Å; L123-Y162 VanDerWaalsContact CB-CZ 3.47Å; L123-Y162 HydrophobicContact CD1-CE2 4.13Å; L123-Y162 VanDerWaalsContact O-CD1 3.3Å; L123-Y162 WeakPolarHBondContact O-CD1 3.38Å; L123-Y162 PolarHBondContact O-N 2.86Å; L123-S163 WeakPolarHBondContact CA-O 3.39Å; L123-S163 WeakPolarHBondContact CB-O 3.42Å; L123-S163 PolarHBondContact N-O 3.33Å; L123-S163 PolarHBondContact O-N 3.14Å; L123-F183 HydrophobicContact CD1-CE2 4.17Å; L123-L186 HydrophobicContact CD1-CD2 3.64Å; L123-L186 HydrophobicContact CD1-CG 4.49Å
124S95.1Very high89Confident31 Ų3176.4 Ų76.422%0.21743%0.428CS..EExtended strand (participates in β ladder)trans-146.7150.9-175.254.80000110.7R159 V160S124-R159 VanDerWaalsContact OG-CZ 3.3Å; S124-R159 PolarHBondContact OG-NE 2.97Å; S124-R159 PolarHBondContact OG-NH2 3.21Å; S124-V160 CarbonylContact C-O 3.56Å; S124-V160 WeakPolarHBondContact CA-O 3.26Å; S124-V160 VanDerWaalsContact CB-O 3.25Å; S124-V160 WeakPolarHBondContact CB-O 3.35Å
125F94.4Very high89Confident104 Ų10480.7 Ų80.746%0.45645%0.454SS..EExtended strand (participates in β ladder)trans-133.8162.8172.470.6-85000109.7V127 R159 V160 Y162F125-V127 HydrophobicContact CE2-CG2 3.93Å; F125-R159 WeakPolarHBondContact O-CA 3.35Å; F125-V160 PolarHBondContact N-O 3.26Å; F125-V160 PolarHBondContact O-N 3.1Å; F125-Y162 AromaticContact CD1-CD1 3.73Å; F125-Y162 HydrophobicContact CD1-CD1 3.73Å; F125-Y162 HydrophobicContact CD1-CE1 4.28Å; F125-Y162 HydrophobicContact CD1-CG 4.49Å; F125-Y162 HydrophobicContact CE1-CD1 4.27Å
126T92.9Very high89.2Confident64 Ų6488 Ų8839%0.39348%0.478SS..EExtended strand (participates in β ladder)trans-97.9125.6176.6-64.60000109.1P128 L157T126-P128 VanDerWaalsContact O-CD 3.29Å; T126-P128 WeakPolarHBondContact O-CD 3.39Å; T126-L157 HydrophobicContact CG2-CB 3.46Å; T126-L157 VanDerWaalsContact CG2-CB 3.46Å; T126-L157 HydrophobicContact CG2-CD1 4.2Å; T126-L157 HydrophobicContact CG2-CD2 3.55Å; T126-L157 HydrophobicContact CG2-CG 3.86Å
127V89.6Confident89.3Confident66 Ų6680 Ų8040%0.444%0.444SS..PPolyproline II helixtrans-68.2120.2175.1-178.30000108.9F125 S158 V160F125-V127 HydrophobicContact CE2-CG2 3.93Å; V127-S158 PolarHBondContact N-O 2.88Å; V127-V160 HydrophobicContact CG2-CG2 3.71Å
128P87.5Confident89.3Confident117 Ų11778.5 Ų78.576%0.7643%0.433SS*.PPolyproline II helixtrans-62.7151.3177.3-21.633.8000111.8T126T126-P128 VanDerWaalsContact O-CD 3.29Å; T126-P128 WeakPolarHBondContact O-CD 3.39Å
129S82Confident89Confident43 Ų4376.4 Ų76.430%0.30141%0.41SS..  trans-128.8134.1176.21750000110.6S131 K132S129-S131 PolarHBondContact O-N 2.79Å; S129-S131 PolarHBondContact OG-N 3.26Å; S129-K132 PolarHBondContact O-N 3.43Å
130L82.1Confident88.5Confident102 Ų10275.1 Ų75.153%0.53442%0.415SS..THydrogen-bonded Turntrans-67.6-21.9174-66.7178.7000112.4K132 H137 P139 I142 A146L130-K132 PolarHBondContact O-N 2.98Å; L130-H137 WeakPolarHBondContact CA-NE2 3.29Å; L130-H137 PolarHBondContact O-NE2 2.94Å; L130-P139 WeakPolarHBondContact O-CB 3.39Å; L130-I142 HydrophobicContact CB-CD1 4.15Å; L130-I142 HydrophobicContact CD2-CD1 4.03Å; L130-A146 HydrophobicContact CB-CB 4.39Å
131S78.5Confident88Confident15 Ų1576.3 Ų76.311%0.10543%0.429CS..THydrogen-bonded Turntrans-78.8-8.7179.1-41.70000112.7S129 A146 H155S129-S131 PolarHBondContact O-N 2.79Å; S129-S131 PolarHBondContact OG-N 3.26Å; S131-A146 WeakPolarHBondContact CB-O 3.36Å; S131-A146 PolarHBondContact OG-O 2.84Å; S131-H155 WeakPolarHBondContact CB-CE1 3.49Å; S131-H155 WeakPolarHBondContact CB-NE2 3.36Å; S131-H155 PolarHBondContact O-CE1 3.43Å
132K80.4Confident87Confident54 Ų5476.5 Ų76.524%0.23543%0.432CS..SBendtrans-109.4140.8173.2-68.2-168.8176.5-176.40110.5S129 L130 S134 H137 H155 L157S129-K132 PolarHBondContact O-N 3.43Å; L130-K132 PolarHBondContact O-N 2.98Å; K132-S134 PolarHBondContact O-N 3.1Å; K132-H137 PolarHBondContact O-CE1 2.94Å; K132-H137 VanDerWaalsContact O-CE1 3.3Å; K132-H137 PolarHBondContact O-NE2 3.23Å; K132-H137 VanDerWaalsContact O-NE2 3.1Å; K132-H155 WeakPolarHBondContact CE-O 3.41Å; K132-H155 PolarHBondContact NZ-O 3.06Å; K132-L157 HydrophobicContact CD-CD2 3.88Å; K132-L157 HydrophobicContact CD-CG 4.03Å
133P86.4Confident85.8Confident86 Ų8674.5 Ų74.556%0.55843%0.431SS*.  trans-56.6139.7171.5-2030.8000110.5P139P133-P139 HydrophobicContact CG-CG 4.02Å; P133-P139 VanDerWaalsContact N-CG 3.34Å
134S89.1Confident84.5Confident54 Ų5477.7 Ų77.738%0.37846%0.456SS..  trans-131.5172.8176.2850000109.9K132 Y136 H137K132-S134 PolarHBondContact O-N 3.1Å; S134-Y136 PolarHBondContact O-N 3.48Å; S134-Y136 VanDerWaalsContact O-N 3.1Å; S134-Y136 PolarHBondContact OG-N 3.25Å; S134-H137 PolarHBondContact N-O 3.41Å; S134-H137 PolarHBondContact O-N 2.92Å; S134-H137 PolarHBondContact OG-CE1 2.78Å; S134-H137 PolarHBondContact OG-N 3.11Å; S134-H137 PolarHBondContact OG-ND1 3.38Å
135V94Very high83.1Confident130 Ų13082.8 Ų82.879%0.78848%0.479SS*.SBendtrans-60.2-17.4172.468.30000113
136Y91.8Very high81.4Confident214 Ų21478.4 Ų78.484%0.83946%0.463SS*.SBendtrans-106.3-19.6-176.4-56.9-60.9000114.4S134S134-Y136 PolarHBondContact O-N 3.48Å; S134-Y136 VanDerWaalsContact O-N 3.1Å; S134-Y136 PolarHBondContact OG-N 3.25Å
137H87.9Confident80Confident44 Ų4478.7 Ų78.720%0.20446%0.461CS..  trans-156.3154.5-173.180.4-81.8000113.5L130 K132 S134 I142L130-H137 WeakPolarHBondContact CA-NE2 3.29Å; L130-H137 PolarHBondContact O-NE2 2.94Å; K132-H137 PolarHBondContact O-CE1 2.94Å; K132-H137 VanDerWaalsContact O-CE1 3.3Å; K132-H137 PolarHBondContact O-NE2 3.23Å; K132-H137 VanDerWaalsContact O-NE2 3.1Å; S134-H137 PolarHBondContact N-O 3.41Å; S134-H137 PolarHBondContact O-N 2.92Å; S134-H137 PolarHBondContact OG-CE1 2.78Å; S134-H137 PolarHBondContact OG-N 3.11Å; S134-H137 PolarHBondContact OG-ND1 3.38Å; H137-I142 HydrophobicContact CB-CD1 4.5Å; H137-I142 WeakPolarHBondContact CD2-CD1 3.46Å
138E88.3Confident79Confident106 Ų10679 Ų7950%0.49546%0.464SS..  trans-106.5128.9169.2-169.460.3-136.500109S140 A141E138-S140 PolarHBondContact O-N 3.07Å; E138-A141 WeakPolarHBondContact O-CB 3.31Å; E138-A141 PolarHBondContact O-N 2.98Å
139P82.7Confident77.8Confident7 Ų781.7 Ų81.75%0.04547%0.466CS..G310 helixtrans-61.8-31.2-173.6-24.436.9000112.9L130 P133 A141 I142 L147L130-P139 WeakPolarHBondContact O-CB 3.39Å; P133-P139 HydrophobicContact CG-CG 4.02Å; P133-P139 VanDerWaalsContact N-CG 3.34Å; P139-A141 PolarHBondContact O-N 3.31Å; P139-A141 VanDerWaalsContact O-N 3.14Å; P139-I142 PolarHBondContact O-N 3.29Å; P139-L147 HydrophobicContact CB-CD2 3.98Å
140S80.9Confident77Confident100 Ų10081.7 Ų81.770%0.69947%0.473SS*.G310 helixtrans-58.4-24.9176.2-53.60000113.1E138E138-S140 PolarHBondContact O-N 3.07Å
141A80.6Confident76Confident88 Ų8878.2 Ų78.273%0.72746%0.458SS*.G310 helixtrans-78.4-17.5178.400000113.7E138 P139E138-A141 WeakPolarHBondContact O-CB 3.31Å; E138-A141 PolarHBondContact O-N 2.98Å; P139-A141 PolarHBondContact O-N 3.31Å; P139-A141 VanDerWaalsContact O-N 3.14Å
142I74.2Confident75.1Confident68 Ų6881.4 Ų81.435%0.34947%0.474SS..G310 helixtrans-90.3-1.7-171.8-58.8179.4000112.1L130 H137 P139 A146L130-I142 HydrophobicContact CB-CD1 4.15Å; L130-I142 HydrophobicContact CD2-CD1 4.03Å; H137-I142 HydrophobicContact CB-CD1 4.5Å; H137-I142 WeakPolarHBondContact CD2-CD1 3.46Å; P139-I142 PolarHBondContact O-N 3.29Å; I142-A146 HydrophobicContact CB-CB 4.11Å; I142-A146 HydrophobicContact CG2-CB 3.44Å; I142-A146 VanDerWaalsContact CG2-CB 3.44Å
143G69.1Low74Confident38 Ų3883 Ų8339%0.39250%0.497SS..  trans72.6172-177.700000112.8I145 A146G143-I145 PolarHBondContact O-N 3.04Å; G143-I145 VanDerWaalsContact O-N 3.08Å; G143-A146 PolarHBondContact O-N 3.32Å
144S67.6Low72.6Confident100 Ų10085.3 Ų85.370%0.69951%0.505SS*.G310 helixtrans-65.4-14-171.353.80000115A146 L147S144-A146 PolarHBondContact O-N 3Å; S144-L147 CarbonylContact O-C 3.56Å; S144-L147 PolarHBondContact O-N 2.86Å; S144-L147 VanDerWaalsContact O-N 3.17Å
145I64.1Low71Confident138 Ų13885.2 Ų85.271%0.70850%0.498SS*.G310 helixtrans-65.7-34.3179.2-81170.1000112.5G143 L147G143-I145 PolarHBondContact O-N 3.04Å; G143-I145 VanDerWaalsContact O-N 3.08Å; I145-L147 VanDerWaalsContact C-N 3.29Å
146A60.4Low69.3Low13 Ų1381.7 Ų81.711%0.10749%0.488CS..G310 helixtrans-85.5-2.5176.200000113.4L130 S131 I142 G143 S144L130-A146 HydrophobicContact CB-CB 4.39Å; S131-A146 WeakPolarHBondContact CB-O 3.36Å; S131-A146 PolarHBondContact OG-O 2.84Å; I142-A146 HydrophobicContact CB-CB 4.11Å; I142-A146 HydrophobicContact CG2-CB 3.44Å; I142-A146 VanDerWaalsContact CG2-CB 3.44Å; G143-A146 PolarHBondContact O-N 3.32Å; S144-A146 PolarHBondContact O-N 3Å
147L62.7Low68.1Low70 Ų7076.2 Ų76.237%0.36647%0.473SS..G310 helixtrans-118.434.3-175-61174.3000111.5P139 S144 I145 L152P139-L147 HydrophobicContact CB-CD2 3.98Å; S144-L147 CarbonylContact O-C 3.56Å; S144-L147 PolarHBondContact O-N 2.86Å; S144-L147 VanDerWaalsContact O-N 3.17Å; I145-L147 VanDerWaalsContact C-N 3.29Å; L147-L152 HydrophobicContact CB-CD1 4.22Å; L147-L152 HydrophobicContact CD2-CD1 4.07Å
148T69.2Low67.8Low73 Ų7377.5 Ų77.545%0.44849%0.487SS..  trans-66.4152174.561.40000110.5G150 A151 L152T148-G150 PolarHBondContact O-N 3.41Å; T148-A151 WeakPolarHBondContact O-CA 3.48Å; T148-A151 WeakPolarHBondContact O-CB 3.4Å; T148-A151 PolarHBondContact O-N 3.22Å; T148-A151 VanDerWaalsContact OG1-CB 3.31Å; T148-A151 WeakPolarHBondContact OG1-CB 3.46Å; T148-A151 PolarHBondContact OG1-N 2.96Å; T148-A151 VanDerWaalsContact OG1-N 3.16Å; T148-L152 WeakPolarHBondContact O-CA 3.28Å; T148-L152 PolarHBondContact O-N 2.96Å
149E62.5Low67.9Low173 Ų17380.4 Ų80.481%0.80849%0.493SS*.Hα-helixtrans-59-26.9176.6-170.9-178.4174.500112.6L152 A153E149-L152 CarbonylContact O-C 3.54Å; E149-L152 WeakPolarHBondContact O-CA 3.45Å; E149-A153 VanDerWaalsContact O-CB 3.28Å; E149-A153 WeakPolarHBondContact O-CB 3.39Å; E149-A153 PolarHBondContact O-N 2.86Å
150G64.2Low68.4Low43 Ų4382.9 Ų82.944%0.44351%0.508SS..Hα-helixtrans-77.7-33.3170.700000113.7T148 N154T148-G150 PolarHBondContact O-N 3.41Å; G150-N154 PolarHBondContact O-N 3.48Å; G150-N154 PolarHBondContact O-ND2 3.36Å
151A60.5Low69.1Low28 Ų2881.8 Ų81.823%0.23150%0.497CS..Hα-helixtrans-64.1-63.9171.200000109T148 N154 H155T148-A151 WeakPolarHBondContact O-CA 3.48Å; T148-A151 WeakPolarHBondContact O-CB 3.4Å; T148-A151 PolarHBondContact O-N 3.22Å; T148-A151 VanDerWaalsContact OG1-CB 3.31Å; T148-A151 WeakPolarHBondContact OG1-CB 3.46Å; T148-A151 PolarHBondContact OG1-N 2.96Å; T148-A151 VanDerWaalsContact OG1-N 3.16Å; A151-N154 PolarHBondContact O-N 3.16Å; A151-H155 PolarHBondContact O-CD2 2.92Å
152L60.4Low69.7Low83 Ų8383.7 Ų83.744%0.43549%0.486SS..Hα-helix19.3-94.7128.4-39.673.7000121.3L147 T148 E149 N154 H155L147-L152 HydrophobicContact CB-CD1 4.22Å; L147-L152 HydrophobicContact CD2-CD1 4.07Å; T148-L152 WeakPolarHBondContact O-CA 3.28Å; T148-L152 PolarHBondContact O-N 2.96Å; E149-L152 CarbonylContact O-C 3.54Å; E149-L152 WeakPolarHBondContact O-CA 3.45Å; L152-N154 PolarHBondContact O-N 3.34Å; L152-H155 WeakPolarHBondContact CA-CD2 3.31Å; L152-H155 VanDerWaalsContact CG-NE2 3.31Å; L152-H155 WeakPolarHBondContact CG-NE2 3.44Å; L152-H155 PolarHBondContact N-CD2 3.47Å; L152-H155 PolarHBondContact N-NE2 2.94Å; L152-H155 WeakPolarHBondContact O-CB 3.35Å; L152-H155 PolarHBondContact O-CD2 3.41Å; L152-H155 PolarHBondContact O-N 3.5Å; L152-H155 VanDerWaalsContact O-N 3.11Å
153A58Low70.7Confident87 Ų8781.1 Ų81.172%0.71948%0.475SS*.Hα-helixtrans-69-22.7-17200000112.4E149 H155E149-A153 VanDerWaalsContact O-CB 3.28Å; E149-A153 WeakPolarHBondContact O-CB 3.39Å; E149-A153 PolarHBondContact O-N 2.86Å; A153-H155 PolarHBondContact O-N 3.49Å
154N57.1Low71.8Confident134 Ų13480.3 Ų80.372%0.71747%0.466SS*.THydrogen-bonded Turntrans-83.711.1173-66.6-32.9000112.9G150 A151 L152 G156G150-N154 PolarHBondContact O-N 3.48Å; G150-N154 PolarHBondContact O-ND2 3.36Å; A151-N154 PolarHBondContact O-N 3.16Å; L152-N154 PolarHBondContact O-N 3.34Å; N154-G156 PolarHBondContact O-N 3.28Å
155H54Low73.1Confident53 Ų5379.8 Ų79.825%0.24546%0.46CS..  trans-65.625-177.5-87.9-122.9000116.7S131 K132 A151 L152 A153 L157S131-H155 WeakPolarHBondContact CB-CE1 3.49Å; S131-H155 WeakPolarHBondContact CB-NE2 3.36Å; S131-H155 PolarHBondContact O-CE1 3.43Å; K132-H155 WeakPolarHBondContact CE-O 3.41Å; K132-H155 PolarHBondContact NZ-O 3.06Å; A151-H155 PolarHBondContact O-CD2 2.92Å; L152-H155 WeakPolarHBondContact CA-CD2 3.31Å; L152-H155 VanDerWaalsContact CG-NE2 3.31Å; L152-H155 WeakPolarHBondContact CG-NE2 3.44Å; L152-H155 PolarHBondContact N-CD2 3.47Å; L152-H155 PolarHBondContact N-NE2 2.94Å; L152-H155 WeakPolarHBondContact O-CB 3.35Å; L152-H155 PolarHBondContact O-CD2 3.41Å; L152-H155 PolarHBondContact O-N 3.5Å; L152-H155 VanDerWaalsContact O-N 3.11Å; A153-H155 PolarHBondContact O-N 3.49Å; H155-L157 PolarHBondContact O-N 3.35Å
156G59.1Low74.6Confident56 Ų5674.5 Ų74.558%0.57743%0.433SS*.SBendtrans-70.2126.8151.200000108N154 S158N154-G156 PolarHBondContact O-N 3.28Å; G156-S158 PolarHBondContact O-N 2.84Å
157L67.3Low76.1Confident98 Ų9879.7 Ų79.751%0.51346%0.458SS..  trans-58.197.6156.7-85.6176.9000105.6T126 K132 H155 R159T126-L157 HydrophobicContact CG2-CB 3.46Å; T126-L157 VanDerWaalsContact CG2-CB 3.46Å; T126-L157 HydrophobicContact CG2-CD1 4.2Å; T126-L157 HydrophobicContact CG2-CD2 3.55Å; T126-L157 HydrophobicContact CG2-CG 3.86Å; K132-L157 HydrophobicContact CD-CD2 3.88Å; K132-L157 HydrophobicContact CD-CG 4.03Å; H155-L157 PolarHBondContact O-N 3.35Å; L157-R159 PolarHBondContact O-N 2.78Å
158S81.8Confident77.7Confident71 Ų7182.8 Ų82.850%0.49747%0.471SS..  trans-71.2109.9-172.4-172.50000107.8V127 G156 V160V127-S158 PolarHBondContact N-O 2.88Å; G156-S158 PolarHBondContact O-N 2.84Å; S158-V160 PolarHBondContact O-N 3.41Å
159R89.1Confident78.9Confident168 Ų16882.1 Ų82.163%0.63446%0.46SS*.EExtended strand (participates in β ladder)trans-82.4113.7174.4-174.3176.2172.1-165.8-5107.4S124 F125 L157S124-R159 VanDerWaalsContact OG-CZ 3.3Å; S124-R159 PolarHBondContact OG-NE 2.97Å; S124-R159 PolarHBondContact OG-NH2 3.21Å; F125-R159 WeakPolarHBondContact O-CA 3.35Å; L157-R159 PolarHBondContact O-N 2.78Å
160V93.1Very high80.4Confident59 Ų5982.7 Ų82.736%0.35846%0.462SS..EExtended strand (participates in β ladder)trans-104.7128.7179.9-177.50000108.3S124 F125 V127 S158S124-V160 CarbonylContact C-O 3.56Å; S124-V160 WeakPolarHBondContact CA-O 3.26Å; S124-V160 VanDerWaalsContact CB-O 3.25Å; S124-V160 WeakPolarHBondContact CB-O 3.35Å; F125-V160 PolarHBondContact N-O 3.26Å; F125-V160 PolarHBondContact O-N 3.1Å; V127-V160 HydrophobicContact CG2-CG2 3.71Å; S158-V160 PolarHBondContact O-N 3.41Å
161V95.6Very high81.8Confident77 Ų7785 Ų8547%0.46747%0.468SS..EExtended strand (participates in β ladder)trans-84.8125.9171.3-179.80000107.6I122 G164I122-V161 HydrophobicContact CG2-CB 4.39Å; I122-V161 HydrophobicContact CG2-CG1 3.69Å; I122-V161 HydrophobicContact CG2-CG2 3.79Å; V161-G164 VanDerWaalsContact CG1-O 3.3Å; V161-G164 WeakPolarHBondContact CG1-O 3.24Å
162Y94.1Very high83.3Confident127 Ų12785.4 Ų85.450%0.49847%0.465SS..EExtended strand (participates in β ladder)trans-111.9-11.9178.271.7-88.8000112.7L123 F125 L186L123-Y162 VanDerWaalsContact C-CE1 3.5Å; L123-Y162 HydrophobicContact CB-CD1 4.2Å; L123-Y162 HydrophobicContact CB-CE1 3.61Å; L123-Y162 HydrophobicContact CB-CE2 3.95Å; L123-Y162 VanDerWaalsContact CB-CZ 3.47Å; L123-Y162 HydrophobicContact CD1-CE2 4.13Å; L123-Y162 VanDerWaalsContact O-CD1 3.3Å; L123-Y162 WeakPolarHBondContact O-CD1 3.38Å; L123-Y162 PolarHBondContact O-N 2.86Å; F125-Y162 AromaticContact CD1-CD1 3.73Å; F125-Y162 HydrophobicContact CD1-CD1 3.73Å; F125-Y162 HydrophobicContact CD1-CE1 4.28Å; F125-Y162 HydrophobicContact CD1-CG 4.49Å; F125-Y162 HydrophobicContact CE1-CD1 4.27Å; Y162-L186 HydrophobicContact CE2-CD1 4.2Å; Y162-L186 HydrophobicContact CE2-CD2 4.11Å
163S95.9Very high84.8Confident15 Ų1584.3 Ų84.311%0.10546%0.461CS..EExtended strand (participates in β ladder)trans-160.6133174.3158.80000110.9L123 H166L123-S163 WeakPolarHBondContact CA-O 3.39Å; L123-S163 WeakPolarHBondContact CB-O 3.42Å; L123-S163 PolarHBondContact N-O 3.33Å; L123-S163 PolarHBondContact O-N 3.14Å; S163-H166 PolarHBondContact OG-NE2 2.85Å
164G91.9Very high86.2Confident21 Ų2184 Ų8422%0.21646%0.458CS..  trans92.4171.917700000114.1V161 H166V161-G164 VanDerWaalsContact CG1-O 3.3Å; V161-G164 WeakPolarHBondContact CG1-O 3.24Å; G164-H166 PolarHBondContact N-NE2 3.16Å
165P94.1Very high87.8Confident88 Ų8886.2 Ų86.257%0.57147%0.465SS*.  cis-69.81431.630-35.1000112.5I122I122-P165 HydrophobicContact CD1-CB 4.47Å; I122-P165 HydrophobicContact CG1-CB 4.1Å
166H94.9Very high89.7Confident28 Ų2884 Ų8413%0.1345%0.454CS..  trans-104.3148.3179.8-68.8-70.9000110.8I113 S163 G164 F183I113-H166 HydrophobicContact CB-CB 3.93Å; I113-H166 HydrophobicContact CD1-CB 4.47Å; I113-H166 HydrophobicContact CG2-CB 3.49Å; I113-H166 VanDerWaalsContact CG2-CB 3.49Å; S163-H166 PolarHBondContact OG-NE2 2.85Å; G164-H166 PolarHBondContact N-NE2 3.16Å; H166-F183 AromaticContact CD2-CD2 3.57Å; H166-F183 AromaticContact CD2-CE2 3.61Å; H166-F183 AromaticContact NE2-CD2 3.28Å; H166-F183 VanDerWaalsContact NE2-CD2 3.28Å; H166-F183 WeakPolarHBondContact NE2-CD2 3.42Å; H166-F183 AromaticContact NE2-CE2 3.68Å
167L93.8Very high91.3Very high122 Ų12284.2 Ų84.264%0.63944%0.438SS*.  trans-97135.4-179.3-67.5172.7000111.2Y109 R169Y109-L167 WeakPolarHBondContact CE1-O 3.38Å; Y109-L167 PolarHBondContact OH-O 3.3Å; L167-R169 WeakPolarHBondContact O-CG 3.32Å; L167-R169 PolarHBondContact O-NE 3.03Å
168Q94.9Very high92.6Very high135 Ų13580.1 Ų80.163%0.63142%0.416SS*.  trans-56.9143.3172-73.8178.81.100111.3N110 I113N110-Q168 WeakPolarHBondContact OD1-CA 3.46Å; I113-Q168 HydrophobicContact CD1-CB 4.3Å; I113-Q168 HydrophobicContact CD1-CG 3.71Å
169R95.3Very high93.3Very high59 Ų5980 Ų8022%0.22341%0.407CS..  trans-128.4137.3-178.1-57.6-57.8179.7132.911.1110.1L106 Y109 N110 L167 N176 E179 V180L106-R169 HydrophobicContact CD1-CB 3.65Å; L106-R169 WeakPolarHBondContact CD2-O 3.3Å; L106-R169 WeakPolarHBondContact CG-O 3.3Å; Y109-R169 HydrophobicContact CE1-CB 4.35Å; Y109-R169 HydrophobicContact CE1-CG 3.85Å; N110-R169 PolarHBondContact ND2-O 3.2Å; N110-R169 PolarHBondContact OD1-N 3.03Å; L167-R169 WeakPolarHBondContact O-CG 3.32Å; L167-R169 PolarHBondContact O-NE 3.03Å; R169-N176 VanDerWaalsContact NH1-CB 3.34Å; R169-E179 IonicContact CZ-OE1 3.84Å; R169-E179 IonicContact CZ-OE2 3.9Å; R169-E179 IonicContact NH2-OE1 2.82Å; R169-E179 PolarHBondContact NH2-OE1 3.5Å; R169-E179 IonicContact NH2-OE2 2.76Å; R169-E179 PolarHBondContact NH2-OE2 3.47Å; R169-V180 HydrophobicContact CG-CG2 4.19Å
170E93.7Very high93.7Very high184 Ų18472 Ų7286%0.8638%0.377SS*.SBendtrans-95.2-25177.6-63-179.8175.300112.9L106L106-E170 WeakPolarHBondContact CD2-O 3.16Å
171T92.9Very high93.9Very high91 Ų9169.1 Ų69.156%0.55836%0.36SS*.SBendtrans-146.6155.3179.958.60000111.8N176T171-N176 PolarHBondContact O-ND2 3.37Å
172F92Very high94.1Very high38 Ų3866.2 Ų66.217%0.16734%0.343CS..  trans-74.5132.8168.1-81.4-71.1000110.9L86 E102 L105 L106 R177 V180 L181L86-F172 HydrophobicContact CD2-CE1 4.28Å; L86-F172 HydrophobicContact CD2-CE2 4.11Å; L86-F172 HydrophobicContact CD2-CZ 3.96Å; E102-F172 HydrophobicContact CB-CD2 3.87Å; E102-F172 HydrophobicContact CB-CE2 4.14Å; E102-F172 HydrophobicContact CG-CD2 3.83Å; E102-F172 HydrophobicContact CG-CE2 4.28Å; E102-F172 WeakPolarHBondContact O-CE2 3.46Å; L105-F172 HydrophobicContact CB-CE2 4.25Å; L105-F172 HydrophobicContact CB-CZ 4.08Å; L106-F172 HydrophobicContact CB-CE2 4.22Å; F172-R177 HydrophobicContact CD1-CB 3.9Å; F172-R177 HydrophobicContact CE1-CB 4.48Å; F172-V180 HydrophobicContact CE1-CB 3.86Å; F172-V180 HydrophobicContact CE1-CG1 3.6Å; F172-V180 HydrophobicContact CE1-CG2 4.37Å; F172-V180 HydrophobicContact CZ-CG1 3.79Å; F172-L181 HydrophobicContact CE1-CD2 3.95Å; F172-L181 HydrophobicContact CZ-CD2 4.1Å
173T91.4Very high94.3Very high59 Ų5960.4 Ų60.436%0.36232%0.32SS..  trans-127.5161.417366.70000109.2Q175 N176 R177T173-Q175 PolarHBondContact O-N 3.33Å; T173-Q175 VanDerWaalsContact O-N 3.12Å; T173-N176 PolarHBondContact N-OD1 3.44Å; T173-N176 PolarHBondContact O-N 3.35Å; T173-N176 PolarHBondContact O-OD1 3.41Å; T173-N176 PolarHBondContact OG1-N 2.98Å; T173-N176 PolarHBondContact OG1-ND2 2.96Å; T173-N176 PolarHBondContact OG1-OD1 2.87Å; T173-R177 VanDerWaalsContact O-CB 3.29Å; T173-R177 WeakPolarHBondContact O-CB 3.12Å; T173-R177 WeakPolarHBondContact O-CG 3.42Å; T173-R177 PolarHBondContact O-N 3.42Å
174A88.1Confident94.4Very high80 Ų8059.7 Ų59.766%0.66132%0.315SS*.THydrogen-bonded Turntrans-58.6-27.8177.700000113.2R177A174-R177 PolarHBondContact O-NE 3.44Å
175Q90.2Very high94.7Very high181 Ų18158.7 Ų58.785%0.84631%0.305SS*.THydrogen-bonded Turntrans-81-47.9-179.4-66.4178.8-8.200112.3T173T173-Q175 PolarHBondContact O-N 3.33Å; T173-Q175 VanDerWaalsContact O-N 3.12Å
176N93.8Very high94.9Very high6 Ų655.7 Ų55.73%0.03228%0.284CS..THydrogen-bonded Turntrans-85.5-18.4-173.572.712.3000113.9R169 T171 T173 F178 E179 V180R169-N176 VanDerWaalsContact NH1-CB 3.34Å; T171-N176 PolarHBondContact O-ND2 3.37Å; T173-N176 PolarHBondContact N-OD1 3.44Å; T173-N176 PolarHBondContact O-N 3.35Å; T173-N176 PolarHBondContact O-OD1 3.41Å; T173-N176 PolarHBondContact OG1-N 2.98Å; T173-N176 PolarHBondContact OG1-ND2 2.96Å; T173-N176 PolarHBondContact OG1-OD1 2.87Å; N176-F178 PolarHBondContact O-N 2.89Å; N176-E179 WeakPolarHBondContact O-CB 3.4Å; N176-E179 PolarHBondContact O-N 2.97Å; N176-E179 VanDerWaalsContact O-N 3.1Å; N176-V180 PolarHBondContact O-N 2.97Å
177R93.4Very high95Very high61 Ų6155.1 Ų55.123%0.2328%0.283CS..Hα-helixtrans-56.4-48.4-168.761.6-175.9172.5157.8-0.3112.5F172 T173 A174 E179 V180 L181 T231F172-R177 HydrophobicContact CD1-CB 3.9Å; F172-R177 HydrophobicContact CE1-CB 4.48Å; T173-R177 VanDerWaalsContact O-CB 3.29Å; T173-R177 WeakPolarHBondContact O-CB 3.12Å; T173-R177 WeakPolarHBondContact O-CG 3.42Å; T173-R177 PolarHBondContact O-N 3.42Å; A174-R177 PolarHBondContact O-NE 3.44Å; R177-E179 VanDerWaalsContact C-N 3.34Å; R177-E179 PolarHBondContact O-N 3.36Å; R177-V180 PolarHBondContact O-N 3.21Å; R177-L181 WeakPolarHBondContact O-CG 3.5Å; R177-L181 PolarHBondContact O-N 3.3Å; R177-T231 PolarHBondContact NH2-OG1 2.96Å
178F95.5Very high95.2Very high12 Ų1249.3 Ų49.35%0.05325%0.252CS..Hα-helixtrans-75.2-24.4-177.5-83.5-79.2000112.8L87 N176 T182 T231 V232 T233 F236L87-F178 HydrophobicContact CD2-CE2 4.38Å; L87-F178 HydrophobicContact CD2-CZ 3.86Å; N176-F178 PolarHBondContact O-N 2.89Å; F178-T182 WeakPolarHBondContact O-CB 3.45Å; F178-T182 PolarHBondContact O-N 2.73Å; F178-T182 PolarHBondContact O-OG1 3.41Å; F178-T231 WeakPolarHBondContact CE2-O 3.41Å; F178-T231 WeakPolarHBondContact CZ-O 3.32Å; F178-V232 HydrophobicContact CD1-CG1 4.48Å; F178-V232 HydrophobicContact CE1-CB 4.27Å; F178-V232 HydrophobicContact CE1-CG1 3.96Å; F178-V232 HydrophobicContact CE1-CG2 4.2Å; F178-V232 HydrophobicContact CZ-CB 4.39Å; F178-V232 HydrophobicContact CZ-CG2 4.05Å; F178-T233 HydrophobicContact CB-CG2 3.71Å; F178-T233 HydrophobicContact CG-CG2 4.17Å; F178-F236 HydrophobicContact CD1-CB 4.01Å; F178-F236 HydrophobicContact CD1-CD1 4.29Å; F178-F236 HydrophobicContact CD1-CD2 4.04Å; F178-F236 AromaticContact CD1-CG 3.85Å; F178-F236 HydrophobicContact CD1-CG 3.85Å; F178-F236 HydrophobicContact CE1-CD1 4.05Å; F178-F236 HydrophobicContact CE1-CD2 4.39Å; F178-F236 HydrophobicContact CE1-CE1 4.31Å; F178-F236 HydrophobicContact CE1-CG 4.07Å
179E95.8Very high95.4Very high68 Ų6843.8 Ų43.832%0.31823%0.227SC..Hα-helixtrans-62.4-50.6169-177.2-169.2139.600110R169 N176 R177 T182 F183R169-E179 IonicContact CZ-OE1 3.84Å; R169-E179 IonicContact CZ-OE2 3.9Å; R169-E179 IonicContact NH2-OE1 2.82Å; R169-E179 PolarHBondContact NH2-OE1 3.5Å; R169-E179 IonicContact NH2-OE2 2.76Å; R169-E179 PolarHBondContact NH2-OE2 3.47Å; N176-E179 WeakPolarHBondContact O-CB 3.4Å; N176-E179 PolarHBondContact O-N 2.97Å; N176-E179 VanDerWaalsContact O-N 3.1Å; R177-E179 VanDerWaalsContact C-N 3.34Å; R177-E179 PolarHBondContact O-N 3.36Å; E179-T182 PolarHBondContact O-N 3.15Å; E179-F183 PolarHBondContact O-N 3.09Å
180V97.6Very high95.5Very high0 Ų045 Ų450%025%0.25CS..Hα-helixtrans-60.1-51.6176.21730000111.1Y109 R169 F172 N176 R177 T182 F183 L184Y109-V180 HydrophobicContact CD1-CG1 4.39Å; Y109-V180 HydrophobicContact CD1-CG2 4.15Å; Y109-V180 HydrophobicContact CD2-CB 4.09Å; Y109-V180 HydrophobicContact CD2-CG1 3.77Å; Y109-V180 HydrophobicContact CD2-CG2 4.08Å; Y109-V180 HydrophobicContact CE1-CG2 4.04Å; Y109-V180 HydrophobicContact CE2-CB 4.28Å; Y109-V180 HydrophobicContact CE2-CG1 4.45Å; Y109-V180 HydrophobicContact CE2-CG2 3.97Å; Y109-V180 HydrophobicContact CG-CB 4.39Å; Y109-V180 HydrophobicContact CG-CG1 3.74Å; Y109-V180 HydrophobicContact CG-CG2 4.18Å; R169-V180 HydrophobicContact CG-CG2 4.19Å; F172-V180 HydrophobicContact CE1-CB 3.86Å; F172-V180 HydrophobicContact CE1-CG1 3.6Å; F172-V180 HydrophobicContact CE1-CG2 4.37Å; F172-V180 HydrophobicContact CZ-CG1 3.79Å; N176-V180 PolarHBondContact O-N 2.97Å; R177-V180 PolarHBondContact O-N 3.21Å; V180-T182 VanDerWaalsContact C-N 3.32Å; V180-T182 PolarHBondContact O-N 2.91Å; V180-F183 PolarHBondContact O-N 2.88Å; V180-L184 HydrophobicContact CG1-CD1 4Å; V180-L184 HydrophobicContact CG1-CG 4.42Å; V180-L184 WeakPolarHBondContact O-CG 3.18Å; V180-L184 PolarHBondContact O-N 3.1Å
181L97.7Very high95.6Very high0 Ų036.9 Ų36.90%021%0.214CC..Hα-helixtrans-64.7-36.2-177.2-60-159.4000112.3L83 L86 L87 F172 R177 L184 L185 F236L83-L181 HydrophobicContact CD2-CB 4.38Å; L83-L181 HydrophobicContact CD2-CD1 4.22Å; L83-L181 HydrophobicContact CD2-CD2 3.62Å; L83-L181 HydrophobicContact CD2-CG 4.23Å; L86-L181 HydrophobicContact CD2-CD1 4.33Å; L86-L181 HydrophobicContact CD2-CD2 3.84Å; L87-L181 HydrophobicContact CD1-CD1 4.04Å; L87-L181 HydrophobicContact CD2-CD1 3.79Å; L87-L181 HydrophobicContact CG-CD1 3.92Å; F172-L181 HydrophobicContact CE1-CD2 3.95Å; F172-L181 HydrophobicContact CZ-CD2 4.1Å; R177-L181 WeakPolarHBondContact O-CG 3.5Å; R177-L181 PolarHBondContact O-N 3.3Å; L181-L184 HydrophobicContact CD2-CD1 4.43Å; L181-L185 WeakPolarHBondContact O-CB 3.42Å; L181-L185 PolarHBondContact O-N 3.37Å; L181-F236 HydrophobicContact CB-CD2 4.17Å; L181-F236 HydrophobicContact CB-CE2 3.82Å
182T98.2Very high95.8Very high16 Ų1633.1 Ų33.110%0.09819%0.19CC..Hα-helixtrans-66-42.6176.5-60.20000110.8F178 E179 V180 L185 L186 E235 F236 Q239F178-T182 WeakPolarHBondContact O-CB 3.45Å; F178-T182 PolarHBondContact O-N 2.73Å; F178-T182 PolarHBondContact O-OG1 3.41Å; E179-T182 PolarHBondContact O-N 3.15Å; V180-T182 VanDerWaalsContact C-N 3.32Å; V180-T182 PolarHBondContact O-N 2.91Å; T182-L185 PolarHBondContact O-N 3.45Å; T182-L186 PolarHBondContact O-N 3.34Å; T182-E235 HydrophobicContact CG2-CB 4.04Å; T182-F236 WeakPolarHBondContact OG1-CA 3.32Å; T182-F236 WeakPolarHBondContact OG1-CB 3.39Å; T182-Q239 HydrophobicContact CG2-CG 3.7Å
183F98.3Very high96.1Very high5 Ų535.1 Ų35.12%0.02221%0.209CC..Hα-helixtrans-67.7-40.1177.2-177.6-104.6000112.7Y109 E112 I113 L123 H166 E179 V180 L185 L186 C187Y109-F183 HydrophobicContact CD2-CB 4.24Å; Y109-F183 AromaticContact CD2-CD1 3.62Å; Y109-F183 HydrophobicContact CD2-CD1 3.62Å; Y109-F183 HydrophobicContact CD2-CE1 4.44Å; Y109-F183 HydrophobicContact CD2-CG 4.32Å; Y109-F183 HydrophobicContact CE2-CB 4.07Å; Y109-F183 AromaticContact CE2-CD1 3.83Å; Y109-F183 HydrophobicContact CE2-CD1 3.83Å; Y109-F183 HydrophobicContact CE2-CG 4.2Å; E112-F183 HydrophobicContact CB-CE1 3.55Å; E112-F183 HydrophobicContact CB-CZ 4.14Å; I113-F183 HydrophobicContact CB-CE1 4.39Å; I113-F183 HydrophobicContact CG2-CD1 3.74Å; I113-F183 HydrophobicContact CG2-CE1 3.31Å; I113-F183 HydrophobicContact CG2-CG 4.49Å; I113-F183 HydrophobicContact CG2-CZ 3.79Å; L123-F183 HydrophobicContact CD1-CE2 4.17Å; H166-F183 AromaticContact CD2-CD2 3.57Å; H166-F183 AromaticContact CD2-CE2 3.61Å; H166-F183 AromaticContact NE2-CD2 3.28Å; H166-F183 VanDerWaalsContact NE2-CD2 3.28Å; H166-F183 WeakPolarHBondContact NE2-CD2 3.42Å; H166-F183 AromaticContact NE2-CE2 3.68Å; E179-F183 PolarHBondContact O-N 3.09Å; V180-F183 PolarHBondContact O-N 2.88Å; F183-L185 VanDerWaalsContact C-N 3.3Å; F183-L185 PolarHBondContact O-N 3.47Å; F183-L186 HydrophobicContact CD2-CD2 4.21Å; F183-L186 HydrophobicContact CE2-CD2 4.47Å; F183-L186 WeakPolarHBondContact O-CB 3.42Å; F183-L186 PolarHBondContact O-N 2.74Å; F183-L186 VanDerWaalsContact O-N 3.16Å; F183-C187 PolarHBondContact O-N 3.12Å; F183-C187 PolarHBondContact O-SG 3.47Å
184L98.5Very high96.2Very high0 Ų038.5 Ų38.50%022%0.216CC..Hα-helixtrans-61.1-41.4173.3-70176.2000111.5L79 L105 I108 V180 L181 L186 C187 Y188L79-L184 HydrophobicContact CD1-CB 4.21Å; L79-L184 HydrophobicContact CD1-CD1 4.45Å; L79-L184 HydrophobicContact CD2-CB 4.17Å; L79-L184 VanDerWaalsContact CD2-O 3.29Å; L79-L184 WeakPolarHBondContact CD2-O 3.23Å; L105-L184 HydrophobicContact CB-CD1 3.93Å; L105-L184 HydrophobicContact CD2-CD1 3.9Å; L105-L184 HydrophobicContact CG-CD1 4.47Å; I108-L184 HydrophobicContact CB-CD2 4.12Å; I108-L184 HydrophobicContact CG2-CD2 3.58Å; V180-L184 HydrophobicContact CG1-CD1 4Å; V180-L184 HydrophobicContact CG1-CG 4.42Å; V180-L184 WeakPolarHBondContact O-CG 3.18Å; V180-L184 PolarHBondContact O-N 3.1Å; L181-L184 HydrophobicContact CD2-CD1 4.43Å; L184-L186 VanDerWaalsContact C-N 3.31Å; L184-L186 PolarHBondContact O-N 2.99Å; L184-C187 WeakPolarHBondContact O-CB 3.34Å; L184-C187 PolarHBondContact O-N 3.02Å; L184-C187 VanDerWaalsContact O-N 3.16Å; L184-Y188 PolarHBondContact O-N 3.49Å
185L98.4Very high96.6Very high0 Ų035.6 Ų35.60%019%0.189CC..Hα-helixtrans-67.1-32.8176-167.960.7000112.2L181 T182 F183 Y188 N189 L203 F236 Q239 L240L181-L185 WeakPolarHBondContact O-CB 3.42Å; L181-L185 PolarHBondContact O-N 3.37Å; T182-L185 PolarHBondContact O-N 3.45Å; F183-L185 VanDerWaalsContact C-N 3.3Å; F183-L185 PolarHBondContact O-N 3.47Å; L185-Y188 HydrophobicContact CD1-CD1 4.35Å; L185-Y188 WeakPolarHBondContact O-CB 3.35Å; L185-Y188 PolarHBondContact O-N 3.37Å; L185-N189 WeakPolarHBondContact O-CB 3.35Å; L185-N189 VanDerWaalsContact O-CG 3.23Å; L185-N189 PolarHBondContact O-N 2.88Å; L185-N189 PolarHBondContact O-ND2 3.3Å; L185-L203 HydrophobicContact CD1-CD1 3.88Å; L185-F236 HydrophobicContact CD2-CD2 4.31Å; L185-F236 HydrophobicContact CD2-CE2 3.99Å; L185-F236 HydrophobicContact CD2-CZ 4.33Å; L185-Q239 HydrophobicContact CB-CB 4.18Å; L185-Q239 HydrophobicContact CD2-CB 3.54Å; L185-Q239 HydrophobicContact CG-CB 3.82Å; L185-L240 HydrophobicContact CD1-CD2 4.4Å; L185-L240 HydrophobicContact CD2-CB 4.44Å; L185-L240 HydrophobicContact CD2-CD2 3.45Å; L185-L240 VanDerWaalsContact CD2-CD2 3.45Å; L185-L240 HydrophobicContact CD2-CG 3.71Å
186L98.3Very high96.8Very high25 Ų2529.1 Ų29.113%0.13116%0.162CC..Hα-helixtrans-62.6-41.5169.7176.263.8000111.7L123 Y162 T182 F183 L184 Y188 N189 A190L123-L186 HydrophobicContact CD1-CD2 3.64Å; L123-L186 HydrophobicContact CD1-CG 4.49Å; Y162-L186 HydrophobicContact CE2-CD1 4.2Å; Y162-L186 HydrophobicContact CE2-CD2 4.11Å; T182-L186 PolarHBondContact O-N 3.34Å; F183-L186 HydrophobicContact CD2-CD2 4.21Å; F183-L186 HydrophobicContact CE2-CD2 4.47Å; F183-L186 WeakPolarHBondContact O-CB 3.42Å; F183-L186 PolarHBondContact O-N 2.74Å; F183-L186 VanDerWaalsContact O-N 3.16Å; L184-L186 VanDerWaalsContact C-N 3.31Å; L184-L186 PolarHBondContact O-N 2.99Å; L186-Y188 VanDerWaalsContact C-N 3.35Å; L186-N189 PolarHBondContact O-N 3.21Å; L186-A190 PolarHBondContact O-N 3.39Å
187C97.6Very high96.8Very high16 Ų1632.8 Ų32.811%0.10819%0.186CC..Hα-helixtrans-63.5-41.1175.2-61.80000111.6F183 L184 A190F183-C187 PolarHBondContact O-N 3.12Å; F183-C187 PolarHBondContact O-SG 3.47Å; L184-C187 WeakPolarHBondContact O-CB 3.34Å; L184-C187 PolarHBondContact O-N 3.02Å; L184-C187 VanDerWaalsContact O-N 3.16Å; C187-A190 WeakPolarHBondContact O-CB 3.49Å; C187-A190 PolarHBondContact O-N 3.42Å
188Y98.6Very high96.9Very high0 Ų031.8 Ų31.80%019%0.191CC..Hα-helixtrans-60.6-45171.6179.6-87.4000112L76 L79 P80 L184 L185 L186 A190 A191 L192 M195 S199 L203L76-Y188 VanDerWaalsContact O-CD2 3.3Å; L76-Y188 WeakPolarHBondContact O-CD2 3.22Å; L76-Y188 WeakPolarHBondContact O-CE2 3.49Å; L79-Y188 HydrophobicContact CB-CD2 4.19Å; L79-Y188 HydrophobicContact CD2-CD2 4.28Å; L79-Y188 HydrophobicContact CD2-CG 4.25Å; P80-Y188 HydrophobicContact CG-CD2 4.44Å; P80-Y188 HydrophobicContact CG-CE2 3.87Å; L184-Y188 PolarHBondContact O-N 3.49Å; L185-Y188 HydrophobicContact CD1-CD1 4.35Å; L185-Y188 WeakPolarHBondContact O-CB 3.35Å; L185-Y188 PolarHBondContact O-N 3.37Å; L186-Y188 VanDerWaalsContact C-N 3.35Å; Y188-A190 PolarHBondContact O-N 3.5Å; Y188-A191 CarbonylContact O-C 3.56Å; Y188-A191 PolarHBondContact O-N 3.44Å; Y188-L192 HydrophobicContact CD1-CD2 4.09Å; Y188-L192 HydrophobicContact CE1-CD2 3.57Å; Y188-L192 PolarHBondContact O-N 2.85Å; Y188-M195 HydrophobicContact CD2-CE 4.46Å; Y188-M195 HydrophobicContact CD2-SD 4.09Å; Y188-M195 HydrophobicContact CE1-CG 4.38Å; Y188-M195 HydrophobicContact CE2-CE 4.43Å; Y188-M195 HydrophobicContact CE2-CG 3.84Å; Y188-M195 HydrophobicContact CE2-SD 3.5Å; Y188-M195 WeakPolarHBondContact CE2-SD 3.3Å; Y188-S199 WeakPolarHBondContact CE2-OG 3.44Å; Y188-S199 PolarHBondContact OH-O 2.87Å; Y188-S199 PolarHBondContact OH-OG 3.13Å; Y188-L203 HydrophobicContact CD1-CD2 4.49Å; Y188-L203 HydrophobicContact CE1-CD1 4.19Å; Y188-L203 HydrophobicContact CE1-CD2 3.64Å; Y188-L203 HydrophobicContact CE1-CG 4.33Å
189N98.2Very high97Very high18 Ų1831.2 Ų31.210%0.09619%0.188CC..Hα-helixtrans-60.9-33.6178.5-75.7-20.5000112.6L185 L186 A191 L192 Q239 T242L185-N189 WeakPolarHBondContact O-CB 3.35Å; L185-N189 VanDerWaalsContact O-CG 3.23Å; L185-N189 PolarHBondContact O-N 2.88Å; L185-N189 PolarHBondContact O-ND2 3.3Å; L186-N189 PolarHBondContact O-N 3.21Å; N189-A191 PolarHBondContact O-N 3.45Å; N189-L192 HydrophobicContact CB-CD1 4.18Å; N189-L192 WeakPolarHBondContact O-CD1 3.39Å; N189-L192 WeakPolarHBondContact O-CG 3.31Å; N189-L192 PolarHBondContact O-N 3.27Å; N189-Q239 PolarHBondContact ND2-O 3.48Å; N189-Q239 PolarHBondContact ND2-OE1 3.02Å; N189-T242 HydrophobicContact CB-CG2 4.38Å
190A97.2Very high97.2Very high86 Ų8628.2 Ų28.271%0.71117%0.174SC*.Hα-helixtrans-66-18.3174.400000113.6L186 C187 Y188L186-A190 PolarHBondContact O-N 3.39Å; C187-A190 WeakPolarHBondContact O-CB 3.49Å; C187-A190 PolarHBondContact O-N 3.42Å; Y188-A190 PolarHBondContact O-N 3.5Å
191A96.8Very high97.2Very high12 Ų1231.6 Ų31.610%0.09919%0.19CC..THydrogen-bonded Turntrans-114.511.4-176.900000114.1L76 Y188 N189 S193 Y194 M195L76-A191 HydrophobicContact CD1-CB 4.34Å; Y188-A191 CarbonylContact O-C 3.56Å; Y188-A191 PolarHBondContact O-N 3.44Å; N189-A191 PolarHBondContact O-N 3.45Å; A191-S193 PolarHBondContact O-N 2.9Å; A191-S193 VanDerWaalsContact O-N 3.1Å; A191-Y194 PolarHBondContact O-N 2.86Å; A191-M195 HydrophobicContact CB-CE 3.53Å; A191-M195 WeakPolarHBondContact O-CE 3.48Å
192L97Very high97.2Very high12 Ų1231.8 Ų31.86%0.06319%0.191CC..G310 helixtrans-51.3-37.8-175.5-79.6163.9000114.5Y188 N189 Y194 M195 L200 L203 Y246Y188-L192 HydrophobicContact CD1-CD2 4.09Å; Y188-L192 HydrophobicContact CE1-CD2 3.57Å; Y188-L192 PolarHBondContact O-N 2.85Å; N189-L192 HydrophobicContact CB-CD1 4.18Å; N189-L192 WeakPolarHBondContact O-CD1 3.39Å; N189-L192 WeakPolarHBondContact O-CG 3.31Å; N189-L192 PolarHBondContact O-N 3.27Å; L192-Y194 PolarHBondContact O-N 3.32Å; L192-Y194 VanDerWaalsContact O-N 3.12Å; L192-M195 WeakPolarHBondContact O-CB 3.37Å; L192-M195 PolarHBondContact O-N 3.23Å; L192-M195 VanDerWaalsContact O-N 3.07Å; L192-L200 HydrophobicContact CD2-CD2 3.91Å; L192-L203 HydrophobicContact CD2-CD2 4.45Å; L192-Y246 HydrophobicContact CB-CD1 3.92Å; L192-Y246 HydrophobicContact CB-CD2 4.06Å; L192-Y246 HydrophobicContact CB-CE1 4.13Å; L192-Y246 HydrophobicContact CB-CE2 4.27Å; L192-Y246 HydrophobicContact CB-CG 3.89Å; L192-Y246 HydrophobicContact CD1-CG 4.09Å; L192-Y246 HydrophobicContact CD2-CD1 4.05Å; L192-Y246 HydrophobicContact CD2-CG 4.29Å; L192-Y246 HydrophobicContact CG-CD1 4.41Å; L192-Y246 HydrophobicContact CG-CG 4.31Å; L192-Y246 WeakPolarHBondContact O-CE1 3.29Å
193S96.7Very high97.2Very high80 Ų8031 Ų3156%0.55919%0.187SC*.G310 helixtrans-61-19.4178.556.10000114.5A191 Y246A191-S193 PolarHBondContact O-N 2.9Å; A191-S193 VanDerWaalsContact O-N 3.1Å; S193-Y246 WeakPolarHBondContact CA-OH 3.14Å
194Y95.1Very high97.2Very high131 Ų13130.9 Ų30.951%0.51419%0.186SC..G310 helixtrans-103.6-2.8179.2-55.1-74.7000113.2R73 A191 L192R73-Y194 VanDerWaalsContact NH1-CD1 3.32Å; A191-Y194 PolarHBondContact O-N 2.86Å; L192-Y194 PolarHBondContact O-N 3.32Å; L192-Y194 VanDerWaalsContact O-N 3.12Å
195M95.6Very high97.2Very high18 Ų1833.1 Ų33.19%0.08920%0.197CC..  trans-77.7139.6-176.5-64.8-59.8139.100111.2L76 Q77 Y188 A191 L192 L200L76-M195 HydrophobicContact CB-CE 3.88Å; Q77-M195 HydrophobicContact CB-SD 4.19Å; Y188-M195 HydrophobicContact CD2-CE 4.46Å; Y188-M195 HydrophobicContact CD2-SD 4.09Å; Y188-M195 HydrophobicContact CE1-CG 4.38Å; Y188-M195 HydrophobicContact CE2-CE 4.43Å; Y188-M195 HydrophobicContact CE2-CG 3.84Å; Y188-M195 HydrophobicContact CE2-SD 3.5Å; Y188-M195 WeakPolarHBondContact CE2-SD 3.3Å; A191-M195 HydrophobicContact CB-CE 3.53Å; A191-M195 WeakPolarHBondContact O-CE 3.48Å; L192-M195 WeakPolarHBondContact O-CB 3.37Å; L192-M195 PolarHBondContact O-N 3.23Å; L192-M195 VanDerWaalsContact O-N 3.07Å; M195-L200 HydrophobicContact CB-CD2 4.11Å; M195-L200 HydrophobicContact CB-CG 4.41Å
196T94.1Very high97.1Very high45 Ų4533.2 Ų33.228%0.27620%0.197SC..  trans-73.3158.2176.5630000111.2A198 S199 L200T196-A198 PolarHBondContact O-N 3.48Å; T196-S199 WeakPolarHBondContact O-CA 3.4Å; T196-S199 WeakPolarHBondContact O-CB 3.49Å; T196-S199 PolarHBondContact O-N 2.85Å; T196-S199 PolarHBondContact OG1-N 3.43Å; T196-L200 PolarHBondContact O-N 3.26Å; T196-L200 VanDerWaalsContact O-N 3.1Å
197P95.3Very high97.1Very high83 Ų8332 Ų3254%0.53919%0.191SC..Hα-helixtrans-53.7-41.2173.8-27.535.4000112.6S199 L200 Q201P197-S199 VanDerWaalsContact C-N 3.26Å; P197-S199 PolarHBondContact O-N 3.06Å; P197-L200 PolarHBondContact O-N 2.61Å; P197-L200 VanDerWaalsContact O-N 3.15Å; P197-Q201 WeakPolarHBondContact O-CB 3.1Å; P197-Q201 VanDerWaalsContact O-CG 3.22Å; P197-Q201 WeakPolarHBondContact O-CG 3.31Å; P197-Q201 PolarHBondContact O-N 3.12Å
198A95.6Very high97.2Very high40 Ų4031.3 Ų31.333%0.33119%0.186SC..Hα-helixtrans-57.9-37.6176.100000112.9Y42 T196 S202Y42-A198 HydrophobicContact CE2-CB 4.2Å; T196-A198 PolarHBondContact O-N 3.48Å; A198-S202 WeakPolarHBondContact O-CB 3.34Å; A198-S202 PolarHBondContact O-N 2.75Å
199S97.6Very high97Very high0 Ų033.8 Ų33.80%020%0.196CC..Hα-helixtrans-69-43.8175.7-172.20000112.4Y42 Q77 Y188 T196 P197 Q201 S202 L203Y42-S199 VanDerWaalsContact OH-CA 3.32Å; Y42-S199 WeakPolarHBondContact OH-CA 3.2Å; Q77-S199 WeakPolarHBondContact CA-OG 3.4Å; Q77-S199 WeakPolarHBondContact O-CB 3.28Å; Q77-S199 PolarHBondContact O-OG 3.48Å; Y188-S199 WeakPolarHBondContact CE2-OG 3.44Å; Y188-S199 PolarHBondContact OH-O 2.87Å; Y188-S199 PolarHBondContact OH-OG 3.13Å; T196-S199 WeakPolarHBondContact O-CA 3.4Å; T196-S199 WeakPolarHBondContact O-CB 3.49Å; T196-S199 PolarHBondContact O-N 2.85Å; T196-S199 PolarHBondContact OG1-N 3.43Å; P197-S199 VanDerWaalsContact C-N 3.26Å; P197-S199 PolarHBondContact O-N 3.06Å; S199-Q201 VanDerWaalsContact C-N 3.33Å; S199-Q201 PolarHBondContact O-N 3.02Å; S199-S202 WeakPolarHBondContact O-CB 3.41Å; S199-S202 PolarHBondContact O-N 3.27Å; S199-L203 PolarHBondContact O-N 3.4Å
200L98.3Very high96.9Very high5 Ų533 Ų333%0.02619%0.191CC..Hα-helixtrans-64.5-37.7176.3-61.9179.1000112.1L192 M195 T196 P197 L203 C204 Y246 A247 N250 E252L192-L200 HydrophobicContact CD2-CD2 3.91Å; M195-L200 HydrophobicContact CB-CD2 4.11Å; M195-L200 HydrophobicContact CB-CG 4.41Å; T196-L200 PolarHBondContact O-N 3.26Å; T196-L200 VanDerWaalsContact O-N 3.1Å; P197-L200 PolarHBondContact O-N 2.61Å; P197-L200 VanDerWaalsContact O-N 3.15Å; L200-L203 WeakPolarHBondContact O-CB 3.33Å; L200-L203 PolarHBondContact O-N 2.87Å; L200-C204 PolarHBondContact O-N 3.14Å; L200-C204 PolarHBondContact O-SG 2.9Å; L200-Y246 HydrophobicContact CD1-CD1 4.14Å; L200-Y246 HydrophobicContact CD1-CE1 3.99Å; L200-Y246 HydrophobicContact CD2-CD1 3.94Å; L200-Y246 HydrophobicContact CD2-CE1 4.3Å; L200-A247 HydrophobicContact CB-CB 4.33Å; L200-N250 HydrophobicContact CD1-CB 4.48Å; L200-E252 HydrophobicContact CB-CG 4.11Å
201Q98.1Very high96.9Very high71 Ų7128.9 Ų28.933%0.33216%0.157SC..Hα-helixtrans-62.4-45.8172.1-69.9176.61.100111.1P197 S199 L203 C204 Q205 E252 L255P197-Q201 WeakPolarHBondContact O-CB 3.1Å; P197-Q201 VanDerWaalsContact O-CG 3.22Å; P197-Q201 WeakPolarHBondContact O-CG 3.31Å; P197-Q201 PolarHBondContact O-N 3.12Å; S199-Q201 VanDerWaalsContact C-N 3.33Å; S199-Q201 PolarHBondContact O-N 3.02Å; Q201-L203 VanDerWaalsContact C-N 3.32Å; Q201-L203 PolarHBondContact O-N 3.28Å; Q201-C204 PolarHBondContact O-N 3Å; Q201-Q205 WeakPolarHBondContact O-CB 3.47Å; Q201-Q205 WeakPolarHBondContact O-CG 3.5Å; Q201-Q205 PolarHBondContact O-N 3.1Å; Q201-E252 HydrophobicContact CG-CG 4.16Å; Q201-E252 WeakPolarHBondContact CG-OE1 3.4Å; Q201-E252 WeakPolarHBondContact CG-OE2 3.36Å; Q201-E252 PolarHBondContact NE2-OE1 3.08Å; Q201-E252 PolarHBondContact NE2-OE2 3.04Å; Q201-L255 HydrophobicContact CB-CD1 4.03Å; Q201-L255 HydrophobicContact CG-CD1 3.73Å
202S98.1Very high96.9Very high4 Ų428.3 Ų28.33%0.02815%0.153CC..Hα-helixtrans-60.2-41.4175.2-174.40000111.4E81 A198 S199 Q205 L206E81-S202 PolarHBondContact OE2-OG 2.97Å; A198-S202 WeakPolarHBondContact O-CB 3.34Å; A198-S202 PolarHBondContact O-N 2.75Å; S199-S202 WeakPolarHBondContact O-CB 3.41Å; S199-S202 PolarHBondContact O-N 3.27Å; S202-Q205 PolarHBondContact O-N 3.3Å; S202-L206 WeakPolarHBondContact O-CB 3.46Å; S202-L206 PolarHBondContact O-N 3.26Å
203L98.6Very high96.8Very high0 Ų027.8 Ų27.80%015%0.15CC..Hα-helixtrans-60.6-47.1174.1178.969.3000113P80 L185 Y188 L192 S199 L200 Q201 Q205 L206 S207 L240P80-L203 HydrophobicContact CB-CB 4.25Å; P80-L203 HydrophobicContact CB-CD1 4.5Å; P80-L203 HydrophobicContact CG-CB 3.98Å; P80-L203 HydrophobicContact CG-CD1 4.26Å; L185-L203 HydrophobicContact CD1-CD1 3.88Å; Y188-L203 HydrophobicContact CD1-CD2 4.49Å; Y188-L203 HydrophobicContact CE1-CD1 4.19Å; Y188-L203 HydrophobicContact CE1-CD2 3.64Å; Y188-L203 HydrophobicContact CE1-CG 4.33Å; L192-L203 HydrophobicContact CD2-CD2 4.45Å; S199-L203 PolarHBondContact O-N 3.4Å; L200-L203 WeakPolarHBondContact O-CB 3.33Å; L200-L203 PolarHBondContact O-N 2.87Å; Q201-L203 VanDerWaalsContact C-N 3.32Å; Q201-L203 PolarHBondContact O-N 3.28Å; L203-Q205 VanDerWaalsContact C-N 3.3Å; L203-Q205 PolarHBondContact O-N 3.42Å; L203-L206 PolarHBondContact O-N 3.19Å; L203-S207 WeakPolarHBondContact O-CB 3.35Å; L203-S207 PolarHBondContact O-N 3.04Å; L203-S207 PolarHBondContact O-OG 3.45Å; L203-L240 HydrophobicContact CD1-CD2 4.19Å
204C98.6Very high96.7Very high2 Ų224.9 Ų24.91%0.01413%0.133CC..Hα-helixtrans-63.7-39.4177.2-66.20000111.2L200 Q201 S207 S208 L255 A259L200-C204 PolarHBondContact O-N 3.14Å; L200-C204 PolarHBondContact O-SG 2.9Å; Q201-C204 PolarHBondContact O-N 3Å; C204-S207 PolarHBondContact O-N 2.81Å; C204-S208 WeakPolarHBondContact O-CB 3.5Å; C204-S208 PolarHBondContact O-N 2.82Å; C204-L255 HydrophobicContact CB-CB 3.87Å; C204-A259 HydrophobicContact CB-CB 4.1Å; C204-A259 WeakPolarHBondContact O-CB 3.37Å
205Q97.4Very high96.7Very high47 Ų4719.4 Ų19.422%0.2211%0.111CC..Hα-helixtrans-66.4-46.1176.1-70.4174.123.500112.2Q201 S202 L203 S207 S208 R209Q201-Q205 WeakPolarHBondContact O-CB 3.47Å; Q201-Q205 WeakPolarHBondContact O-CG 3.5Å; Q201-Q205 PolarHBondContact O-N 3.1Å; S202-Q205 PolarHBondContact O-N 3.3Å; L203-Q205 VanDerWaalsContact C-N 3.3Å; L203-Q205 PolarHBondContact O-N 3.42Å; Q205-S207 VanDerWaalsContact C-N 3.31Å; Q205-S207 PolarHBondContact O-N 3.23Å; Q205-S208 PolarHBondContact O-N 3.05Å; Q205-R209 WeakPolarHBondContact O-CB 3.41Å; Q205-R209 VanDerWaalsContact O-CG 3.23Å; Q205-R209 WeakPolarHBondContact O-CG 3.34Å; Q205-R209 PolarHBondContact O-N 3.43Å
206L97.6Very high96.7Very high2 Ų222.5 Ų22.51%0.0113%0.133CC..Hα-helixtrans-52.7-52.4171.9167.170.6000109.9P80 L83 W84 S202 L203 S208 R209 V210 L240P80-L206 HydrophobicContact CB-CB 4.26Å; P80-L206 HydrophobicContact CB-CD2 3.93Å; L83-L206 HydrophobicContact CB-CD1 4.23Å; L83-L206 HydrophobicContact CB-CD2 4.1Å; L83-L206 HydrophobicContact CD1-CD2 4.15Å; W84-L206 HydrophobicContact CB-CD1 3.69Å; W84-L206 HydrophobicContact CE3-CD1 4.38Å; S202-L206 WeakPolarHBondContact O-CB 3.46Å; S202-L206 PolarHBondContact O-N 3.26Å; L203-L206 PolarHBondContact O-N 3.19Å; L206-S208 PolarHBondContact O-N 3Å; L206-R209 PolarHBondContact O-N 3.28Å; L206-V210 HydrophobicContact CD1-CG2 3.57Å; L206-V210 HydrophobicContact CG-CG2 4.32Å; L206-V210 WeakPolarHBondContact O-CB 3.48Å; L206-V210 WeakPolarHBondContact O-CG2 3.33Å; L206-V210 PolarHBondContact O-N 3.36Å; L206-L240 HydrophobicContact CD2-CD2 4.02Å; L206-L240 HydrophobicContact CG-CD2 4.41Å
207S98.2Very high96.8Very high0 Ų023.2 Ų23.20%013%0.13CC..Hα-helixtrans-58.1-47.5-176.1-57.90000111.9L203 C204 Q205 S211 L240L203-S207 WeakPolarHBondContact O-CB 3.35Å; L203-S207 PolarHBondContact O-N 3.04Å; L203-S207 PolarHBondContact O-OG 3.45Å; C204-S207 PolarHBondContact O-N 2.81Å; Q205-S207 VanDerWaalsContact C-N 3.31Å; Q205-S207 PolarHBondContact O-N 3.23Å; S207-S211 VanDerWaalsContact O-CB 3.22Å; S207-S211 WeakPolarHBondContact O-CB 3.43Å; S207-S211 PolarHBondContact O-N 3.12Å; S207-S211 VanDerWaalsContact O-N 3.13Å; S207-S211 PolarHBondContact O-OG 3.01Å; S207-L240 WeakPolarHBondContact OG-CD2 3.46Å
208S97.8Very high96.8Very high1 Ų119.9 Ų19.91%0.00711%0.107CC..Hα-helixtrans-65.4-47.9178179.40000111.3C204 Q205 L206 S211 I212 Y223 D262C204-S208 WeakPolarHBondContact O-CB 3.5Å; C204-S208 PolarHBondContact O-N 2.82Å; Q205-S208 PolarHBondContact O-N 3.05Å; L206-S208 PolarHBondContact O-N 3Å; S208-S211 PolarHBondContact O-N 3.07Å; S208-I212 WeakPolarHBondContact O-CG1 3.2Å; S208-I212 PolarHBondContact O-N 3.16Å; S208-Y223 WeakPolarHBondContact OG-CE2 3.35Å; S208-Y223 PolarHBondContact OG-OH 2.78Å; S208-D262 PolarHBondContact OG-OD2 2.85Å
209R96Very high96.6Very high53 Ų5325.7 Ų25.720%0.213%0.128CC..Hα-helixtrans-60.5-50.3179.7-72.7178.4-172.5170.47.2112.2E81 W84 Q205 L206 S211 I212 C213 Y223E81-R209 IonicContact OE1-NH1 2.76Å; W84-R209 HydrophobicContact CD2-CB 4.31Å; W84-R209 HydrophobicContact CE3-CB 3.85Å; W84-R209 HydrophobicContact CH2-CB 3.76Å; W84-R209 HydrophobicContact CH2-CG 4.43Å; W84-R209 HydrophobicContact CZ2-CB 4.21Å; W84-R209 HydrophobicContact CZ2-CG 4.44Å; W84-R209 HydrophobicContact CZ3-CB 3.56Å; W84-R209 VanDerWaalsContact NE1-NH1 3.16Å; Q205-R209 WeakPolarHBondContact O-CB 3.41Å; Q205-R209 VanDerWaalsContact O-CG 3.23Å; Q205-R209 WeakPolarHBondContact O-CG 3.34Å; Q205-R209 PolarHBondContact O-N 3.43Å; L206-R209 PolarHBondContact O-N 3.28Å; R209-S211 VanDerWaalsContact C-N 3.29Å; R209-S211 PolarHBondContact O-N 3.04Å; R209-I212 PolarHBondContact O-N 2.9Å; R209-C213 VanDerWaalsContact O-CB 3.23Å; R209-C213 WeakPolarHBondContact O-CB 3.34Å; R209-C213 PolarHBondContact O-N 3.23Å; R209-Y223 HydrophobicContact CG-CD1 4.25Å; R209-Y223 HydrophobicContact CG-CD2 4.15Å; R209-Y223 HydrophobicContact CG-CE1 4.28Å; R209-Y223 HydrophobicContact CG-CE2 4.22Å; R209-Y223 HydrophobicContact CG-CG 4.2Å
210V95.9Very high96.5Very high0 Ų032.9 Ų32.90%016%0.163CC..Hα-helixtrans-61.9-39.6-180169.20000111.4W84 L87 L206 I212 L230 V232 F236 R266W84-V210 HydrophobicContact CE3-CG2 3.91Å; W84-V210 HydrophobicContact CZ3-CG2 4.09Å; L87-V210 HydrophobicContact CD1-CG2 3.9Å; L206-V210 HydrophobicContact CD1-CG2 3.57Å; L206-V210 HydrophobicContact CG-CG2 4.32Å; L206-V210 WeakPolarHBondContact O-CB 3.48Å; L206-V210 WeakPolarHBondContact O-CG2 3.33Å; L206-V210 PolarHBondContact O-N 3.36Å; V210-I212 PolarHBondContact O-N 2.8Å; V210-L230 HydrophobicContact CG2-CD1 4.39Å; V210-V232 HydrophobicContact CG1-CG1 4.39Å; V210-V232 HydrophobicContact CG1-CG2 3.56Å; V210-F236 HydrophobicContact CG1-CE1 4.1Å; V210-R266 PolarHBondContact O-NH1 2.78Å
211S97.1Very high96.2Very high0 Ų036.3 Ų36.30%018%0.176CC..Hα-helixtrans-68.1-37-176.8-61.40000112.7S207 S208 R209 D262 V263 R266S207-S211 VanDerWaalsContact O-CB 3.22Å; S207-S211 WeakPolarHBondContact O-CB 3.43Å; S207-S211 PolarHBondContact O-N 3.12Å; S207-S211 VanDerWaalsContact O-N 3.13Å; S207-S211 PolarHBondContact O-OG 3.01Å; S208-S211 PolarHBondContact O-N 3.07Å; R209-S211 VanDerWaalsContact C-N 3.29Å; R209-S211 PolarHBondContact O-N 3.04Å; S211-D262 WeakPolarHBondContact CB-O 3.2Å; S211-V263 WeakPolarHBondContact OG-CA 2.79Å; S211-V263 VanDerWaalsContact OG-CG2 3.26Å; S211-V263 WeakPolarHBondContact OG-CG2 3.29Å; S211-R266 WeakPolarHBondContact O-CB 3.28Å; S211-R266 VanDerWaalsContact O-CD 3.28Å; S211-R266 WeakPolarHBondContact O-CD 3.38Å; S211-R266 WeakPolarHBondContact O-CG 3.44Å
212I96.5Very high95.9Very high0 Ų043.3 Ų43.30%020%0.199CC..Hα-helixtrans-110-3.3-172.675.6-169.9000114.7S208 R209 V210 G214 Y215 R217 Q218 R221 Y223 D262 Y265S208-I212 WeakPolarHBondContact O-CG1 3.2Å; S208-I212 PolarHBondContact O-N 3.16Å; R209-I212 PolarHBondContact O-N 2.9Å; V210-I212 PolarHBondContact O-N 2.8Å; I212-G214 PolarHBondContact O-N 3.43Å; I212-Y215 WeakPolarHBondContact O-CB 3.12Å; I212-Y215 PolarHBondContact O-N 3.05Å; I212-R217 HydrophobicContact CB-CB 4.29Å; I212-R217 HydrophobicContact CD1-CG 4.43Å; I212-R217 HydrophobicContact CG2-CB 4.18Å; I212-R217 HydrophobicContact CG2-CG 4.09Å; I212-Q218 HydrophobicContact CG1-CB 4.16Å; I212-Q218 WeakPolarHBondContact O-CB 3.35Å; I212-R221 HydrophobicContact CD1-CB 3.72Å; I212-R221 HydrophobicContact CD1-CG 3.33Å; I212-Y223 HydrophobicContact CD1-CD2 3.75Å; I212-Y223 HydrophobicContact CD1-CE2 3.86Å; I212-Y223 HydrophobicContact CG1-CD2 4.28Å; I212-D262 HydrophobicContact CG2-CB 3.75Å; I212-Y265 HydrophobicContact CG2-CD1 4.18Å
213C95Very high95.6Very high2 Ų245.2 Ų45.21%0.01421%0.206CC..THydrogen-bonded Turntrans-54.4123.7177.2-171.70000111R209 Y215 I226 T228 R229 L230R209-C213 VanDerWaalsContact O-CB 3.23Å; R209-C213 WeakPolarHBondContact O-CB 3.34Å; R209-C213 PolarHBondContact O-N 3.23Å; C213-Y215 VanDerWaalsContact C-N 3.34Å; C213-Y215 VanDerWaalsContact O-CD2 3.22Å; C213-Y215 WeakPolarHBondContact O-CD2 3.23Å; C213-I226 PolarHBondContact SG-O 3.34Å; C213-T228 PolarHBondContact SG-O 2.94Å; C213-R229 WeakPolarHBondContact O-CA 3.22Å; C213-L230 HydrophobicContact CB-CD1 4.11Å; C213-L230 HydrophobicContact CB-CG 4.23Å
214G93.4Very high95Very high18 Ų1854.8 Ų54.819%0.18625%0.248CC..THydrogen-bonded Turntrans76.711.5-17700000115.8I212 S227 R229I212-G214 PolarHBondContact O-N 3.43Å; G214-S227 WeakPolarHBondContact CA-O 3.46Å; G214-R229 VanDerWaalsContact O-CG 3.29Å; G214-R229 WeakPolarHBondContact O-CG 3.31Å; G214-R229 PolarHBondContact O-NE 2.91Å
215Y95.5Very high94.3Very high17 Ų1757.6 Ų57.67%0.06728%0.277CS..SBendtrans-114.1155.9174.2-63.3-91.1000111.6I212 C213 R217 Q218 R229 Y265 R266 L269 E270I212-Y215 WeakPolarHBondContact O-CB 3.12Å; I212-Y215 PolarHBondContact O-N 3.05Å; C213-Y215 VanDerWaalsContact C-N 3.34Å; C213-Y215 VanDerWaalsContact O-CD2 3.22Å; C213-Y215 WeakPolarHBondContact O-CD2 3.23Å; Y215-R217 PolarHBondContact O-N 3.31Å; Y215-R217 VanDerWaalsContact O-N 3.07Å; Y215-Q218 WeakPolarHBondContact O-CB 3.41Å; Y215-Q218 PolarHBondContact O-N 3.04Å; Y215-R229 HydrophobicContact CD2-CG 4.32Å; Y215-R229 HydrophobicContact CE1-CG 4.49Å; Y215-R229 HydrophobicContact CE2-CB 4.33Å; Y215-R229 HydrophobicContact CE2-CG 3.89Å; Y215-Y265 HydrophobicContact CG-CE1 4.32Å; Y215-R266 VanDerWaalsContact OH-CZ 3.24Å; Y215-R266 PolarHBondContact OH-NE 3.49Å; Y215-R266 VanDerWaalsContact OH-NE 3.14Å; Y215-R266 PolarHBondContact OH-NH2 2.59Å; Y215-L269 HydrophobicContact CD1-CD1 3.36Å; Y215-L269 HydrophobicContact CE1-CD1 3.54Å; Y215-L269 HydrophobicContact CG-CD1 4.24Å; Y215-E270 PolarHBondContact OH-OE1 3.05Å
216P95.8Very high93.5Very high83 Ų8357.1 Ų57.154%0.53928%0.275SS..THydrogen-bonded Turntrans-53.5-34-179.7-28.635.7000114.2Q218 Q219P216-Q218 PolarHBondContact O-N 3.48Å; P216-Q218 VanDerWaalsContact O-N 3.15Å; P216-Q219 WeakPolarHBondContact O-CB 3.26Å; P216-Q219 PolarHBondContact O-N 3.33Å
217R96.2Very high93Very high59 Ų5961.3 Ų61.322%0.22331%0.305CS..Hα-helixtrans-59.6-24.5177.5-169.1176.3-91.1-143.76.9113.3I212 Y215 Q219 M220 R221 D261 D262 Y265I212-R217 HydrophobicContact CB-CB 4.29Å; I212-R217 HydrophobicContact CD1-CG 4.43Å; I212-R217 HydrophobicContact CG2-CB 4.18Å; I212-R217 HydrophobicContact CG2-CG 4.09Å; Y215-R217 PolarHBondContact O-N 3.31Å; Y215-R217 VanDerWaalsContact O-N 3.07Å; R217-Q219 VanDerWaalsContact C-N 3.31Å; R217-Q219 PolarHBondContact O-N 2.85Å; R217-M220 WeakPolarHBondContact O-CB 3.49Å; R217-M220 PolarHBondContact O-N 3.43Å; R217-R221 HydrophobicContact CG-CG 4.49Å; R217-R221 WeakPolarHBondContact O-CG 3.45Å; R217-R221 PolarHBondContact O-N 3.01Å; R217-D261 PolarHBondContact NH1-O 2.75Å; R217-D262 WeakPolarHBondContact CD-OD1 3.03Å; R217-D262 IonicContact NH1-OD1 3.06Å; R217-D262 PolarHBondContact NH1-OD1 3.33Å; R217-D262 VanDerWaalsContact NH1-OD1 3.08Å; R217-Y265 HydrophobicContact CB-CD1 4.19Å; R217-Y265 HydrophobicContact CB-CE1 3.74Å; R217-Y265 VanDerWaalsContact CZ-CB 3.47Å
218Q95.2Very high92.6Very high13 Ų1365.1 Ų65.16%0.06133%0.328CS..Hα-helixtrans-56.8-43.9172.6-175175.3-6.900112.3I212 Y215 P216 M220 R221 R222 Y223 I226I212-Q218 HydrophobicContact CG1-CB 4.16Å; I212-Q218 WeakPolarHBondContact O-CB 3.35Å; Y215-Q218 WeakPolarHBondContact O-CB 3.41Å; Y215-Q218 PolarHBondContact O-N 3.04Å; P216-Q218 PolarHBondContact O-N 3.48Å; P216-Q218 VanDerWaalsContact O-N 3.15Å; Q218-M220 VanDerWaalsContact C-N 3.35Å; Q218-R221 CarbonylContact O-C 3.51Å; Q218-R221 PolarHBondContact O-N 3.2Å; Q218-R222 PolarHBondContact O-N 3.37Å; Q218-Y223 PolarHBondContact NE2-O 2.95Å; Q218-Y223 PolarHBondContact O-N 3.49Å; Q218-I226 PolarHBondContact NE2-O 3.3Å
219Q93Very high92.3Very high162 Ų16272.7 Ų72.776%0.75736%0.357SS*.Hα-helixtrans-66.7-39.9179.2-61.9177.5-2.500110.6P216 R217 R221 R222P216-Q219 WeakPolarHBondContact O-CB 3.26Å; P216-Q219 PolarHBondContact O-N 3.33Å; R217-Q219 VanDerWaalsContact C-N 3.31Å; R217-Q219 PolarHBondContact O-N 2.85Å; Q219-R221 VanDerWaalsContact C-N 3.3Å; Q219-R221 PolarHBondContact O-N 3.29Å; Q219-R222 PolarHBondContact O-N 2.91Å
220M93.8Very high92Very high152 Ų15270.8 Ų70.875%0.74935%0.35SS*.Hα-helixtrans-61.2-38.4174.7-58.1-177.974.700112.1R217 Q218 R222R217-M220 WeakPolarHBondContact O-CB 3.49Å; R217-M220 PolarHBondContact O-N 3.43Å; Q218-M220 VanDerWaalsContact C-N 3.35Å; M220-R222 VanDerWaalsContact C-N 3.28Å
221R92.3Very high91.8Very high77 Ų7774.9 Ų74.929%0.29138%0.376SS..THydrogen-bonded Turntrans-80.6-5.6175.6-62.9-44-160.6-170.7-7114.1I212 R217 Q218 Q219 Y223 D262I212-R221 HydrophobicContact CD1-CB 3.72Å; I212-R221 HydrophobicContact CD1-CG 3.33Å; R217-R221 HydrophobicContact CG-CG 4.49Å; R217-R221 WeakPolarHBondContact O-CG 3.45Å; R217-R221 PolarHBondContact O-N 3.01Å; Q218-R221 CarbonylContact O-C 3.51Å; Q218-R221 PolarHBondContact O-N 3.2Å; Q219-R221 VanDerWaalsContact C-N 3.3Å; Q219-R221 PolarHBondContact O-N 3.29Å; R221-Y223 HydrophobicContact CB-CD2 3.75Å; R221-Y223 HydrophobicContact CB-CE2 3.74Å; R221-Y223 HydrophobicContact CB-CG 4.44Å; R221-Y223 HydrophobicContact CG-CE2 4.26Å; R221-Y223 PolarHBondContact O-N 3.03Å; R221-D262 IonicContact CZ-OD1 3.47Å; R221-D262 IonicContact CZ-OD2 3.08Å; R221-D262 IonicContact NE-OD1 2.94Å; R221-D262 PolarHBondContact NE-OD1 3.47Å; R221-D262 VanDerWaalsContact NE-OD1 3.12Å; R221-D262 IonicContact NE-OD2 3.38Å; R221-D262 PolarHBondContact NE-OD2 3.44Å; R221-D262 VanDerWaalsContact NE-OD2 3.13Å; R221-D262 IonicContact NH2-OD1 3.68Å; R221-D262 PolarHBondContact NH2-OD1 3.49Å; R221-D262 IonicContact NH2-OD2 3.78Å
222R92.8Very high91.6Very high217 Ų21775.5 Ų75.582%0.81938%0.379SS*.THydrogen-bonded Turntrans55.331-177.8-55.8-179.9-179.9173.2-0.3113.7Q218 Q219 M220 K224Q218-R222 PolarHBondContact O-N 3.37Å; Q219-R222 PolarHBondContact O-N 2.91Å; M220-R222 VanDerWaalsContact C-N 3.28Å; R222-K224 PolarHBondContact O-N 2.85Å
223Y90.8Very high91.6Very high45 Ų4577.8 Ų77.818%0.17639%0.393CS..  trans-75.2124.8172.4-70.2-49.3000110.5S208 R209 I212 Q218 R221 K258S208-Y223 WeakPolarHBondContact OG-CE2 3.35Å; S208-Y223 PolarHBondContact OG-OH 2.78Å; R209-Y223 HydrophobicContact CG-CD1 4.25Å; R209-Y223 HydrophobicContact CG-CD2 4.15Å; R209-Y223 HydrophobicContact CG-CE1 4.28Å; R209-Y223 HydrophobicContact CG-CE2 4.22Å; R209-Y223 HydrophobicContact CG-CG 4.2Å; I212-Y223 HydrophobicContact CD1-CD2 3.75Å; I212-Y223 HydrophobicContact CD1-CE2 3.86Å; I212-Y223 HydrophobicContact CG1-CD2 4.28Å; Q218-Y223 PolarHBondContact NE2-O 2.95Å; Q218-Y223 PolarHBondContact O-N 3.49Å; R221-Y223 HydrophobicContact CB-CD2 3.75Å; R221-Y223 HydrophobicContact CB-CE2 3.74Å; R221-Y223 HydrophobicContact CB-CG 4.44Å; R221-Y223 HydrophobicContact CG-CE2 4.26Å; R221-Y223 PolarHBondContact O-N 3.03Å; Y223-K258 WeakPolarHBondContact OH-CE 3.22Å; Y223-K258 PolarHBondContact OH-NZ 2.99Å; Y223-K258 VanDerWaalsContact OH-NZ 3.14Å
224K86.7Confident91.7Very high201 Ų20178.5 Ų78.587%0.87440%0.398SS*.  trans-88.9162.2174.1-60.5-177.1179.7-178.70110.3R222R222-K224 PolarHBondContact O-N 2.85Å
225G82.6Confident91.9Very high60 Ų6084 Ų8462%0.61942%0.419SS*.SBendtrans109.8-148.7179.200000111.9S227G225-S227 PolarHBondContact O-N 3.39Å; G225-S227 PolarHBondContact O-OG 2.89Å
226I81.9Confident92Very high38 Ų3883.2 Ų83.220%0.19542%0.416CS..  trans-59.3135.8-175.8-64.1126.8000111.1S88 A91 A92 C213 Q218S88-I226 VanDerWaalsContact C-CD1 3.41Å; S88-I226 VanDerWaalsContact CA-CD1 3.42Å; S88-I226 WeakPolarHBondContact O-CD1 3.46Å; A91-I226 HydrophobicContact CB-CG2 3.75Å; A92-I226 HydrophobicContact CB-CD1 4.46Å; A92-I226 HydrophobicContact CB-CG1 4.33Å; C213-I226 PolarHBondContact SG-O 3.34Å; Q218-I226 PolarHBondContact NE2-O 3.3Å
227S86.6Confident92.2Very high89 Ų8979.2 Ų79.262%0.62239%0.39SS*.  trans-121.432.1-179.3-600000111.3G214 G225G214-S227 WeakPolarHBondContact CA-O 3.46Å; G225-S227 PolarHBondContact O-N 3.39Å; G225-S227 PolarHBondContact O-OG 2.89Å
228T89.3Confident92.3Very high81 Ų8178 Ų7850%0.49739%0.389SS..SBendtrans-106135.6177.6-55.10000109.2C213 L230C213-T228 PolarHBondContact SG-O 2.94Å; T228-L230 PolarHBondContact O-N 2.97Å
229R92.8Very high92.4Very high160 Ų16079 Ų7960%0.60439%0.394SS*.PPolyproline II helixtrans-62.9121.6179.3-65.1-178.5-172.6176.44.1110.6C213 G214 Y215C213-R229 WeakPolarHBondContact O-CA 3.22Å; G214-R229 VanDerWaalsContact O-CG 3.29Å; G214-R229 WeakPolarHBondContact O-CG 3.31Å; G214-R229 PolarHBondContact O-NE 2.91Å; Y215-R229 HydrophobicContact CD2-CG 4.32Å; Y215-R229 HydrophobicContact CE1-CG 4.49Å; Y215-R229 HydrophobicContact CE2-CB 4.33Å; Y215-R229 HydrophobicContact CE2-CG 3.89Å
230L89.8Confident92.7Very high12 Ų1271.2 Ų71.26%0.06336%0.358CS..PPolyproline II helixtrans-81.4125.2170.8-62.2175.1000108.5W84 L87 A91 V210 C213 T228 V232 R266W84-L230 HydrophobicContact CZ3-CD1 4.19Å; L87-L230 HydrophobicContact CB-CD1 4.35Å; A91-L230 HydrophobicContact CB-CD2 3.8Å; V210-L230 HydrophobicContact CG2-CD1 4.39Å; C213-L230 HydrophobicContact CB-CD1 4.11Å; C213-L230 HydrophobicContact CB-CG 4.23Å; T228-L230 PolarHBondContact O-N 2.97Å; L230-V232 HydrophobicContact CB-CG2 4.22Å; L230-V232 PolarHBondContact O-N 2.98Å; L230-R266 PolarHBondContact O-NH1 3.07Å; L230-R266 VanDerWaalsContact O-NH1 3.13Å; L230-R266 PolarHBondContact O-NH2 3.31Å
231T90.1Very high92.9Very high87 Ų8764 Ų6453%0.53432%0.322SS..PPolyproline II helixtrans-70.6122.5168.652.10000108.5R177 F178R177-T231 PolarHBondContact NH2-OG1 2.96Å; F178-T231 WeakPolarHBondContact CE2-O 3.41Å; F178-T231 WeakPolarHBondContact CZ-O 3.32Å
232V93.8Very high93.2Very high12 Ų1263.1 Ų63.17%0.07333%0.325CS..  trans-128.8151.5-176.1-177.30000108.7F178 V210 L230 F236 L237 F272F178-V232 HydrophobicContact CD1-CG1 4.48Å; F178-V232 HydrophobicContact CE1-CB 4.27Å; F178-V232 HydrophobicContact CE1-CG1 3.96Å; F178-V232 HydrophobicContact CE1-CG2 4.2Å; F178-V232 HydrophobicContact CZ-CB 4.39Å; F178-V232 HydrophobicContact CZ-CG2 4.05Å; V210-V232 HydrophobicContact CG1-CG1 4.39Å; V210-V232 HydrophobicContact CG1-CG2 3.56Å; L230-V232 HydrophobicContact CB-CG2 4.22Å; L230-V232 PolarHBondContact O-N 2.98Å; V232-F236 HydrophobicContact CG1-CB 4.14Å; V232-F236 HydrophobicContact CG1-CD1 3.53Å; V232-F236 HydrophobicContact CG1-CE1 4.37Å; V232-F236 HydrophobicContact CG1-CG 4.21Å; V232-L237 HydrophobicContact CG1-CD2 3.72Å; V232-L237 HydrophobicContact CG1-CG 4.01Å; V232-F272 WeakPolarHBondContact O-CZ 3.29Å
233T96.6Very high93.5Very high49 Ų4952.8 Ų52.830%0.30129%0.286SS..  trans-94.9154.1177.461.50000112F178 E235 F236 L237F178-T233 HydrophobicContact CB-CG2 3.71Å; F178-T233 HydrophobicContact CG-CG2 4.17Å; T233-E235 VanDerWaalsContact C-N 3.31Å; T233-E235 PolarHBondContact O-N 2.76Å; T233-F236 PolarHBondContact O-N 3.35Å; T233-F236 WeakPolarHBondContact OG1-CB 3.36Å; T233-F236 PolarHBondContact OG1-N 3.05Å; T233-L237 PolarHBondContact O-N 3.13Å
234S97.3Very high93.9Very high17 Ų1750.7 Ų50.712%0.11928%0.278CS..Hα-helixtrans-58-44175.5-173.20000111.5F236 L237 V238 E274S234-F236 VanDerWaalsContact C-N 3.32Å; S234-F236 PolarHBondContact O-N 3.47Å; S234-L237 WeakPolarHBondContact O-CB 3.33Å; S234-L237 PolarHBondContact O-N 2.86Å; S234-L237 VanDerWaalsContact O-N 3.07Å; S234-V238 WeakPolarHBondContact O-CG2 2.96Å; S234-V238 PolarHBondContact O-N 2.66Å; S234-E274 WeakPolarHBondContact CB-OE2 3.31Å; S234-E274 PolarHBondContact OG-OE2 2.84Å
235E97.4Very high94.4Very high133 Ų13345.3 Ų45.362%0.62126%0.256SS*.Hα-helixtrans-58.6-41.8179.5-61169.8159.900112.4T182 T233 L237 V238 Q239T182-E235 HydrophobicContact CG2-CB 4.04Å; T233-E235 VanDerWaalsContact C-N 3.31Å; T233-E235 PolarHBondContact O-N 2.76Å; E235-L237 PolarHBondContact O-N 2.88Å; E235-V238 PolarHBondContact O-N 3.13Å; E235-Q239 WeakPolarHBondContact O-CG 3.45Å; E235-Q239 PolarHBondContact O-N 3.4Å
236F98.3Very high95.1Very high0 Ų045.5 Ų45.50%024%0.238CC..Hα-helixtrans-62.3-43.4175.7-175.2-99.5000111.4L83 F178 L181 T182 L185 V210 V232 T233 S234 V238 Q239 L240L83-F236 HydrophobicContact CD1-CE2 4.33Å; L83-F236 HydrophobicContact CD1-CZ 4.47Å; F178-F236 HydrophobicContact CD1-CB 4.01Å; F178-F236 HydrophobicContact CD1-CD1 4.29Å; F178-F236 HydrophobicContact CD1-CD2 4.04Å; F178-F236 AromaticContact CD1-CG 3.85Å; F178-F236 HydrophobicContact CD1-CG 3.85Å; F178-F236 HydrophobicContact CE1-CD1 4.05Å; F178-F236 HydrophobicContact CE1-CD2 4.39Å; F178-F236 HydrophobicContact CE1-CE1 4.31Å; F178-F236 HydrophobicContact CE1-CG 4.07Å; L181-F236 HydrophobicContact CB-CD2 4.17Å; L181-F236 HydrophobicContact CB-CE2 3.82Å; T182-F236 WeakPolarHBondContact OG1-CA 3.32Å; T182-F236 WeakPolarHBondContact OG1-CB 3.39Å; L185-F236 HydrophobicContact CD2-CD2 4.31Å; L185-F236 HydrophobicContact CD2-CE2 3.99Å; L185-F236 HydrophobicContact CD2-CZ 4.33Å; V210-F236 HydrophobicContact CG1-CE1 4.1Å; V232-F236 HydrophobicContact CG1-CB 4.14Å; V232-F236 HydrophobicContact CG1-CD1 3.53Å; V232-F236 HydrophobicContact CG1-CE1 4.37Å; V232-F236 HydrophobicContact CG1-CG 4.21Å; T233-F236 PolarHBondContact O-N 3.35Å; T233-F236 WeakPolarHBondContact OG1-CB 3.36Å; T233-F236 PolarHBondContact OG1-N 3.05Å; S234-F236 VanDerWaalsContact C-N 3.32Å; S234-F236 PolarHBondContact O-N 3.47Å; F236-V238 PolarHBondContact O-N 3.35Å; F236-Q239 PolarHBondContact O-N 3.44Å; F236-L240 HydrophobicContact CD1-CD1 3.88Å; F236-L240 HydrophobicContact CD1-CG 4.28Å; F236-L240 HydrophobicContact CE1-CD1 3.57Å; F236-L240 HydrophobicContact CE1-CD2 4.27Å; F236-L240 HydrophobicContact CE1-CG 4Å; F236-L240 HydrophobicContact CZ-CD1 4.4Å; F236-L240 HydrophobicContact CZ-CD2 4.32Å; F236-L240 HydrophobicContact CZ-CG 4.44Å; F236-L240 WeakPolarHBondContact O-CG 3.23Å; F236-L240 PolarHBondContact O-N 3.11Å
237L98.4Very high95.9Very high0 Ų043.7 Ų43.70%023%0.229CC..Hα-helixtrans-64.5-38.4176.2-62.8-172.8000112V232 T233 S234 E235 Q239 L240 I241 V263 R266 A267 F272 A275V232-L237 HydrophobicContact CG1-CD2 3.72Å; V232-L237 HydrophobicContact CG1-CG 4.01Å; T233-L237 PolarHBondContact O-N 3.13Å; S234-L237 WeakPolarHBondContact O-CB 3.33Å; S234-L237 PolarHBondContact O-N 2.86Å; S234-L237 VanDerWaalsContact O-N 3.07Å; E235-L237 PolarHBondContact O-N 2.88Å; L237-Q239 VanDerWaalsContact C-N 3.32Å; L237-Q239 PolarHBondContact O-N 3.49Å; L237-L240 HydrophobicContact CD2-CD1 4.02Å; L237-L240 WeakPolarHBondContact O-CB 3.19Å; L237-L240 PolarHBondContact O-N 3.1Å; L237-I241 VanDerWaalsContact O-CG1 3.23Å; L237-I241 WeakPolarHBondContact O-CG1 3.43Å; L237-I241 PolarHBondContact O-N 3.39Å; L237-V263 HydrophobicContact CB-CG1 4.12Å; L237-V263 HydrophobicContact CD1-CG1 4.37Å; L237-V263 HydrophobicContact CD2-CG1 4.31Å; L237-R266 HydrophobicContact CD1-CG 4.28Å; L237-A267 HydrophobicContact CD1-CB 4.4Å; L237-F272 HydrophobicContact CD1-CD2 3.75Å; L237-F272 HydrophobicContact CD1-CE2 4.2Å; L237-A275 HydrophobicContact CB-CB 3.95Å; L237-A275 HydrophobicContact CD1-CB 4.36Å
238V98.5Very high96.3Very high32 Ų3240.5 Ų40.519%0.19421%0.205CC..Hα-helixtrans-62.2-40.4175.5172.30000111.2S234 E235 F236 I241 T242 E274 A275S234-V238 WeakPolarHBondContact O-CG2 2.96Å; S234-V238 PolarHBondContact O-N 2.66Å; E235-V238 PolarHBondContact O-N 3.13Å; F236-V238 PolarHBondContact O-N 3.35Å; V238-I241 PolarHBondContact O-N 3.36Å; V238-T242 PolarHBondContact O-N 3.39Å; V238-T242 PolarHBondContact O-OG1 3.08Å; V238-E274 HydrophobicContact CG2-CB 3.99Å; V238-A275 HydrophobicContact CG2-CB 4.34Å
239Q98.5Very high96.5Very high34 Ų3440.4 Ų40.416%0.15921%0.207CC..Hα-helixtrans-65.4-39173.9-68.1-56.2-32.200112.1T182 L185 N189 E235 F236 L237 T242 G243T182-Q239 HydrophobicContact CG2-CG 3.7Å; L185-Q239 HydrophobicContact CB-CB 4.18Å; L185-Q239 HydrophobicContact CD2-CB 3.54Å; L185-Q239 HydrophobicContact CG-CB 3.82Å; N189-Q239 PolarHBondContact ND2-O 3.48Å; N189-Q239 PolarHBondContact ND2-OE1 3.02Å; E235-Q239 WeakPolarHBondContact O-CG 3.45Å; E235-Q239 PolarHBondContact O-N 3.4Å; F236-Q239 PolarHBondContact O-N 3.44Å; L237-Q239 VanDerWaalsContact C-N 3.32Å; L237-Q239 PolarHBondContact O-N 3.49Å; Q239-T242 WeakPolarHBondContact O-CB 3.48Å; Q239-T242 PolarHBondContact O-N 3.48Å; Q239-G243 PolarHBondContact O-N 2.92Å
240L98.6Very high96.6Very high0 Ų036.2 Ų36.20%020%0.197CC..Hα-helixtrans-62.6-44.3172.9-67.7173.3000111.4L185 L203 L206 S207 F236 L237 T242 G243 I244L185-L240 HydrophobicContact CD1-CD2 4.4Å; L185-L240 HydrophobicContact CD2-CB 4.44Å; L185-L240 HydrophobicContact CD2-CD2 3.45Å; L185-L240 VanDerWaalsContact CD2-CD2 3.45Å; L185-L240 HydrophobicContact CD2-CG 3.71Å; L203-L240 HydrophobicContact CD1-CD2 4.19Å; L206-L240 HydrophobicContact CD2-CD2 4.02Å; L206-L240 HydrophobicContact CG-CD2 4.41Å; S207-L240 WeakPolarHBondContact OG-CD2 3.46Å; F236-L240 HydrophobicContact CD1-CD1 3.88Å; F236-L240 HydrophobicContact CD1-CG 4.28Å; F236-L240 HydrophobicContact CE1-CD1 3.57Å; F236-L240 HydrophobicContact CE1-CD2 4.27Å; F236-L240 HydrophobicContact CE1-CG 4Å; F236-L240 HydrophobicContact CZ-CD1 4.4Å; F236-L240 HydrophobicContact CZ-CD2 4.32Å; F236-L240 HydrophobicContact CZ-CG 4.44Å; F236-L240 WeakPolarHBondContact O-CG 3.23Å; F236-L240 PolarHBondContact O-N 3.11Å; L237-L240 HydrophobicContact CD2-CD1 4.02Å; L237-L240 WeakPolarHBondContact O-CB 3.19Å; L237-L240 PolarHBondContact O-N 3.1Å; L240-T242 VanDerWaalsContact C-N 3.26Å; L240-T242 PolarHBondContact O-N 3.48Å; L240-G243 PolarHBondContact O-N 3.18Å; L240-G243 VanDerWaalsContact O-N 3.16Å; L240-I244 VanDerWaalsContact O-CG1 3.24Å; L240-I244 WeakPolarHBondContact O-CG1 3.02Å; L240-I244 PolarHBondContact O-N 3.14Å
241I98.6Very high96.6Very high0 Ų039.1 Ų39.10%023%0.23CC..Hα-helixtrans-59.1-38.8178.4-70164.6000111.2L237 V238 I244 H245 L260 V263 A275 V278 I282L237-I241 VanDerWaalsContact O-CG1 3.23Å; L237-I241 WeakPolarHBondContact O-CG1 3.43Å; L237-I241 PolarHBondContact O-N 3.39Å; V238-I241 PolarHBondContact O-N 3.36Å; I241-I244 PolarHBondContact O-N 3.25Å; I241-H245 WeakPolarHBondContact O-CB 3.39Å; I241-H245 PolarHBondContact O-N 2.94Å; I241-L260 HydrophobicContact CG1-CD1 4.37Å; I241-L260 HydrophobicContact CG2-CD1 4.43Å; I241-V263 HydrophobicContact CD1-CG1 3.83Å; I241-V263 HydrophobicContact CG1-CG1 3.77Å; I241-A275 HydrophobicContact CD1-CB 3.99Å; I241-A275 VanDerWaalsContact CD1-O 3.31Å; I241-A275 WeakPolarHBondContact CD1-O 3.45Å; I241-V278 HydrophobicContact CG2-CB 4.43Å; I241-V278 HydrophobicContact CG2-CG1 3.7Å; I241-I282 HydrophobicContact CG2-CD1 3.23Å
242T98.3Very high96.9Very high59 Ų5936.1 Ų36.136%0.36221%0.21SC..Hα-helixtrans-59.5-47.9175.9-58.60000111.4N189 V238 Q239 L240 H245 Y246N189-T242 HydrophobicContact CB-CG2 4.38Å; V238-T242 PolarHBondContact O-N 3.39Å; V238-T242 PolarHBondContact O-OG1 3.08Å; Q239-T242 WeakPolarHBondContact O-CB 3.48Å; Q239-T242 PolarHBondContact O-N 3.48Å; L240-T242 VanDerWaalsContact C-N 3.26Å; L240-T242 PolarHBondContact O-N 3.48Å; T242-H245 PolarHBondContact O-N 3.17Å; T242-Y246 PolarHBondContact O-N 2.94Å
243G98.4Very high96.9Very high0 Ų038.2 Ų38.20%023%0.228CC..Hα-helixtrans-65.9-40.4175.800000113.5Q239 L240 H245 Y246 A247Q239-G243 PolarHBondContact O-N 2.92Å; L240-G243 PolarHBondContact O-N 3.18Å; L240-G243 VanDerWaalsContact O-N 3.16Å; G243-H245 VanDerWaalsContact C-N 3.33Å; G243-H245 PolarHBondContact O-N 3.42Å; G243-Y246 WeakPolarHBondContact O-CB 3.44Å; G243-Y246 PolarHBondContact O-N 3.18Å; G243-A247 PolarHBondContact O-N 3.11Å
244I98.5Very high96.8Very high0 Ų044.2 Ų44.20%025%0.253CS..Hα-helixtrans-61.3-41.9175.6-68.4163.4000110.9L240 I241 Y246 A247 L248 G256 A259 L260 V263L240-I244 VanDerWaalsContact O-CG1 3.24Å; L240-I244 WeakPolarHBondContact O-CG1 3.02Å; L240-I244 PolarHBondContact O-N 3.14Å; I241-I244 PolarHBondContact O-N 3.25Å; I244-Y246 VanDerWaalsContact C-N 3.29Å; I244-Y246 PolarHBondContact O-N 3.4Å; I244-A247 PolarHBondContact O-N 3.3Å; I244-L248 HydrophobicContact CG2-CD1 3.78Å; I244-L248 HydrophobicContact CG2-CG 4.22Å; I244-L248 WeakPolarHBondContact O-CB 3.3Å; I244-L248 WeakPolarHBondContact O-CD1 3.49Å; I244-L248 VanDerWaalsContact O-CG 3.28Å; I244-L248 WeakPolarHBondContact O-CG 3.48Å; I244-L248 PolarHBondContact O-N 3.31Å; I244-G256 VanDerWaalsContact CG2-O 3.26Å; I244-G256 WeakPolarHBondContact CG2-O 3.24Å; I244-A259 HydrophobicContact CD1-CB 3.83Å; I244-A259 HydrophobicContact CG1-CB 4.04Å; I244-L260 HydrophobicContact CG2-CB 3.99Å; I244-V263 HydrophobicContact CD1-CG2 3.93Å
245H97.9Very high96.8Very high88 Ų8845.8 Ų45.841%0.40726%0.26SS..Hα-helixtrans-59.3-42.2177-179.5-139.7000112I241 T242 G243 S249 I282I241-H245 WeakPolarHBondContact O-CB 3.39Å; I241-H245 PolarHBondContact O-N 2.94Å; T242-H245 PolarHBondContact O-N 3.17Å; G243-H245 VanDerWaalsContact C-N 3.33Å; G243-H245 PolarHBondContact O-N 3.42Å; H245-S249 PolarHBondContact O-N 2.93Å; H245-S249 PolarHBondContact O-OG 3.4Å; H245-S249 VanDerWaalsContact O-OG 3.13Å; H245-I282 HydrophobicContact CB-CD1 3.8Å; H245-I282 HydrophobicContact CB-CG1 4.36Å
246Y97.8Very high96.8Very high65 Ų6539.5 Ų39.526%0.25523%0.23SC..Hα-helixtrans-63.9-47.9173.5-174.9-90.7000111.4L192 S193 L200 T242 G243 I244 L248 S249 N250L192-Y246 HydrophobicContact CB-CD1 3.92Å; L192-Y246 HydrophobicContact CB-CD2 4.06Å; L192-Y246 HydrophobicContact CB-CE1 4.13Å; L192-Y246 HydrophobicContact CB-CE2 4.27Å; L192-Y246 HydrophobicContact CB-CG 3.89Å; L192-Y246 HydrophobicContact CD1-CG 4.09Å; L192-Y246 HydrophobicContact CD2-CD1 4.05Å; L192-Y246 HydrophobicContact CD2-CG 4.29Å; L192-Y246 HydrophobicContact CG-CD1 4.41Å; L192-Y246 HydrophobicContact CG-CG 4.31Å; L192-Y246 WeakPolarHBondContact O-CE1 3.29Å; S193-Y246 WeakPolarHBondContact CA-OH 3.14Å; L200-Y246 HydrophobicContact CD1-CD1 4.14Å; L200-Y246 HydrophobicContact CD1-CE1 3.99Å; L200-Y246 HydrophobicContact CD2-CD1 3.94Å; L200-Y246 HydrophobicContact CD2-CE1 4.3Å; T242-Y246 PolarHBondContact O-N 2.94Å; G243-Y246 WeakPolarHBondContact O-CB 3.44Å; G243-Y246 PolarHBondContact O-N 3.18Å; I244-Y246 VanDerWaalsContact C-N 3.29Å; I244-Y246 PolarHBondContact O-N 3.4Å; Y246-L248 VanDerWaalsContact C-N 3.33Å; Y246-L248 PolarHBondContact O-N 3.31Å; Y246-S249 PolarHBondContact O-N 3.15Å; Y246-N250 HydrophobicContact CD1-CB 4.35Å; Y246-N250 HydrophobicContact CE1-CB 3.97Å; Y246-N250 VanDerWaalsContact CE2-ND2 3.34Å; Y246-N250 WeakPolarHBondContact CE2-ND2 3.25Å; Y246-N250 VanDerWaalsContact CZ-ND2 3.32Å; Y246-N250 WeakPolarHBondContact O-CB 3.42Å; Y246-N250 PolarHBondContact O-N 3.07Å; Y246-N250 VanDerWaalsContact O-N 3.13Å; Y246-N250 PolarHBondContact O-ND2 2.9Å
247A97.6Very high96.8Very high0 Ų042.2 Ų42.20%025%0.249CC..Hα-helixtrans-58.3-42.4179.400000112.7L200 G243 I244 S249 N250 E252L200-A247 HydrophobicContact CB-CB 4.33Å; G243-A247 PolarHBondContact O-N 3.11Å; I244-A247 PolarHBondContact O-N 3.3Å; A247-S249 PolarHBondContact O-N 3.21Å; A247-N250 CarbonylContact O-C 3.54Å; A247-N250 PolarHBondContact O-N 2.95Å; A247-N250 VanDerWaalsContact O-N 3.1Å; A247-E252 HydrophobicContact CB-CB 4.08Å; A247-E252 PolarHBondContact O-N 3.44Å
248L95.6Very high96.7Very high22 Ų2244.8 Ų44.812%0.11526%0.26CS..Hα-helixtrans-56.3-35.8174.8-78.9161.8000112.9I244 Y246 L260 I282 L286I244-L248 HydrophobicContact CG2-CD1 3.78Å; I244-L248 HydrophobicContact CG2-CG 4.22Å; I244-L248 WeakPolarHBondContact O-CB 3.3Å; I244-L248 WeakPolarHBondContact O-CD1 3.49Å; I244-L248 VanDerWaalsContact O-CG 3.28Å; I244-L248 WeakPolarHBondContact O-CG 3.48Å; I244-L248 PolarHBondContact O-N 3.31Å; Y246-L248 VanDerWaalsContact C-N 3.33Å; Y246-L248 PolarHBondContact O-N 3.31Å; L248-L260 HydrophobicContact CD1-CD2 4.29Å; L248-I282 HydrophobicContact CD1-CG2 4.13Å; L248-L286 HydrophobicContact CD1-CD1 3.87Å; L248-L286 HydrophobicContact CD2-CD1 4.32Å
249S94.1Very high96.7Very high78 Ų7843.2 Ų43.255%0.54525%0.251SS..Hα-helixtrans-89.6-7.4-178.5-52.50000113.4H245 Y246 A247H245-S249 PolarHBondContact O-N 2.93Å; H245-S249 PolarHBondContact O-OG 3.4Å; H245-S249 VanDerWaalsContact O-OG 3.13Å; Y246-S249 PolarHBondContact O-N 3.15Å; A247-S249 PolarHBondContact O-N 3.21Å
250N94.6Very high96.7Very high73 Ų7341.8 Ų41.839%0.3925%0.245SC..THydrogen-bonded Turntrans-129.846.3-170.8-69.7-85.1000112.5L200 Y246 A247 E252L200-N250 HydrophobicContact CD1-CB 4.48Å; Y246-N250 HydrophobicContact CD1-CB 4.35Å; Y246-N250 HydrophobicContact CE1-CB 3.97Å; Y246-N250 VanDerWaalsContact CE2-ND2 3.34Å; Y246-N250 WeakPolarHBondContact CE2-ND2 3.25Å; Y246-N250 VanDerWaalsContact CZ-ND2 3.32Å; Y246-N250 WeakPolarHBondContact O-CB 3.42Å; Y246-N250 PolarHBondContact O-N 3.07Å; Y246-N250 VanDerWaalsContact O-N 3.13Å; Y246-N250 PolarHBondContact O-ND2 2.9Å; A247-N250 CarbonylContact O-C 3.54Å; A247-N250 PolarHBondContact O-N 2.95Å; A247-N250 VanDerWaalsContact O-N 3.1Å; N250-E252 PolarHBondContact O-N 3.23Å
251G89.9Confident96.7Very high73 Ų7344 Ų4475%0.75326%0.257SS*.THydrogen-bonded Turntrans91.4-10.7168.700000116.1
252E95.6Very high96.7Very high24 Ų2444 Ų4411%0.11226%0.257CS..  trans-105.444.4-177.4-61.1-59.4158.800112.3L200 Q201 A247 N250 E254 G256L200-E252 HydrophobicContact CB-CG 4.11Å; Q201-E252 HydrophobicContact CG-CG 4.16Å; Q201-E252 WeakPolarHBondContact CG-OE1 3.4Å; Q201-E252 WeakPolarHBondContact CG-OE2 3.36Å; Q201-E252 PolarHBondContact NE2-OE1 3.08Å; Q201-E252 PolarHBondContact NE2-OE2 3.04Å; A247-E252 HydrophobicContact CB-CB 4.08Å; A247-E252 PolarHBondContact O-N 3.44Å; N250-E252 PolarHBondContact O-N 3.23Å; E252-E254 PolarHBondContact O-N 3.4Å; E252-G256 WeakPolarHBondContact O-CA 3.34Å; E252-G256 PolarHBondContact O-N 3.06Å
253A94.3Very high96.7Very high56 Ų5641.2 Ų41.246%0.46324%0.239SC..Hα-helixtrans-62.4-42.9-172.400000113.5S257A253-S257 VanDerWaalsContact O-CB 3.26Å; A253-S257 WeakPolarHBondContact O-CB 3.47Å; A253-S257 PolarHBondContact O-N 3.2Å
254E95.7Very high96.7Very high175 Ų17541.6 Ų41.682%0.81824%0.241SC*.Hα-helixtrans-67.7-50.1-177.8-63.5-168.3161.300112.1E252 S257 K258E252-E254 PolarHBondContact O-N 3.4Å; E254-S257 PolarHBondContact O-N 3.49Å; E254-K258 WeakPolarHBondContact O-CB 3.25Å; E254-K258 PolarHBondContact O-N 3.4Å
255L97.1Very high96.7Very high50 Ų5043.6 Ų43.626%0.26225%0.249SC..Hα-helixtrans-66.7-40.1178.5-70.9175.8000111.2Q201 C204 K258 A259Q201-L255 HydrophobicContact CB-CD1 4.03Å; Q201-L255 HydrophobicContact CG-CD1 3.73Å; C204-L255 HydrophobicContact CB-CB 3.87Å; L255-K258 PolarHBondContact O-N 2.65Å; L255-A259 VanDerWaalsContact O-CB 3.27Å; L255-A259 WeakPolarHBondContact O-CB 3.45Å; L255-A259 PolarHBondContact O-N 3.36Å
256G97.6Very high96.7Very high0 Ų039.5 Ų39.50%023%0.23CC..Hα-helixtrans-62.4-45.9175.700000112.5I244 E252 K258 A259 L260I244-G256 VanDerWaalsContact CG2-O 3.26Å; I244-G256 WeakPolarHBondContact CG2-O 3.24Å; E252-G256 WeakPolarHBondContact O-CA 3.34Å; E252-G256 PolarHBondContact O-N 3.06Å; G256-K258 PolarHBondContact O-N 2.83Å; G256-A259 PolarHBondContact O-N 3.47Å; G256-L260 WeakPolarHBondContact O-CB 3.1Å; G256-L260 PolarHBondContact O-N 2.91Å
257S97Very high96.8Very high57 Ų5736.4 Ų36.440%0.39922%0.218SC..Hα-helixtrans-64.7-43.3178.8-173.40000111.2A253 E254 A259 L260 D261A253-S257 VanDerWaalsContact O-CB 3.26Å; A253-S257 WeakPolarHBondContact O-CB 3.47Å; A253-S257 PolarHBondContact O-N 3.2Å; E254-S257 PolarHBondContact O-N 3.49Å; S257-A259 PolarHBondContact O-N 2.76Å; S257-L260 PolarHBondContact O-N 3.04Å; S257-D261 PolarHBondContact O-N 3.42Å
258K97.5Very high96.8Very high54 Ų5441.7 Ų41.724%0.23524%0.242CC..Hα-helixtrans-59.8-46.7175.3178-178.3171.8179.40111.4Y223 E254 L255 G256 D261 D262Y223-K258 WeakPolarHBondContact OH-CE 3.22Å; Y223-K258 PolarHBondContact OH-NZ 2.99Å; Y223-K258 VanDerWaalsContact OH-NZ 3.14Å; E254-K258 WeakPolarHBondContact O-CB 3.25Å; E254-K258 PolarHBondContact O-N 3.4Å; L255-K258 PolarHBondContact O-N 2.65Å; G256-K258 PolarHBondContact O-N 2.83Å; K258-D261 PolarHBondContact O-N 2.87Å; K258-D262 WeakPolarHBondContact O-CB 3.49Å; K258-D262 PolarHBondContact O-N 2.98Å; K258-D262 VanDerWaalsContact O-N 3.13Å
259A98.4Very high96.9Very high0 Ų044.7 Ų44.70%026%0.258CS..Hα-helixtrans-62-44.5178.400000111.6C204 I244 L255 G256 S257 D261 D262 V263C204-A259 HydrophobicContact CB-CB 4.1Å; C204-A259 WeakPolarHBondContact O-CB 3.37Å; I244-A259 HydrophobicContact CD1-CB 3.83Å; I244-A259 HydrophobicContact CG1-CB 4.04Å; L255-A259 VanDerWaalsContact O-CB 3.27Å; L255-A259 WeakPolarHBondContact O-CB 3.45Å; L255-A259 PolarHBondContact O-N 3.36Å; G256-A259 PolarHBondContact O-N 3.47Å; S257-A259 PolarHBondContact O-N 2.76Å; A259-D261 PolarHBondContact O-N 2.76Å; A259-D262 PolarHBondContact O-N 2.86Å; A259-V263 VanDerWaalsContact O-CG2 3.32Å; A259-V263 WeakPolarHBondContact O-CG2 3.43Å; A259-V263 PolarHBondContact O-N 2.84Å
260L98.5Very high97Very high4 Ų444.5 Ų44.52%0.02125%0.249CC..Hα-helixtrans-60.9-45.8178.3-175.559000111.9I241 I244 L248 G256 S257 D262 V263 L264 I282 K283I241-L260 HydrophobicContact CG1-CD1 4.37Å; I241-L260 HydrophobicContact CG2-CD1 4.43Å; I244-L260 HydrophobicContact CG2-CB 3.99Å; L248-L260 HydrophobicContact CD1-CD2 4.29Å; G256-L260 WeakPolarHBondContact O-CB 3.1Å; G256-L260 PolarHBondContact O-N 2.91Å; S257-L260 PolarHBondContact O-N 3.04Å; L260-D262 VanDerWaalsContact C-N 3.25Å; L260-D262 PolarHBondContact O-N 3.37Å; L260-V263 PolarHBondContact O-N 3Å; L260-L264 HydrophobicContact CD1-CD1 4.43Å; L260-L264 HydrophobicContact CD1-CG 4.4Å; L260-L264 HydrophobicContact CG-CD1 4.2Å; L260-L264 WeakPolarHBondContact O-CB 3.28Å; L260-L264 WeakPolarHBondContact O-CG 3.47Å; L260-L264 PolarHBondContact O-N 3.44Å; L260-I282 HydrophobicContact CD2-CB 4.46Å; L260-I282 HydrophobicContact CD2-CG2 3.93Å; L260-K283 HydrophobicContact CD2-CB 4.39Å
261D98.3Very high97.2Very high47 Ų4747.7 Ų47.725%0.25127%0.265SS..Hα-helixtrans-62.7-33.9177.6-79.1-26.8000112.6R217 S257 K258 A259 Y265 K283R217-D261 PolarHBondContact NH1-O 2.75Å; S257-D261 PolarHBondContact O-N 3.42Å; K258-D261 PolarHBondContact O-N 2.87Å; A259-D261 PolarHBondContact O-N 2.76Å; D261-Y265 WeakPolarHBondContact O-CB 3.19Å; D261-Y265 PolarHBondContact O-N 2.98Å; D261-K283 IonicContact OD1-NZ 3.92Å; D261-K283 PolarHBondContact OD1-NZ 2.82Å
262D98.5Very high97.6Very high0 Ų046.1 Ų46.10%024%0.237CC..Hα-helixtrans-76.7-38.1179.7-70.5-8.8000111.5S208 S211 I212 R217 R221 K258 A259 L260 Y265 R266S208-D262 PolarHBondContact OG-OD2 2.85Å; S211-D262 WeakPolarHBondContact CB-O 3.2Å; I212-D262 HydrophobicContact CG2-CB 3.75Å; R217-D262 WeakPolarHBondContact CD-OD1 3.03Å; R217-D262 IonicContact NH1-OD1 3.06Å; R217-D262 PolarHBondContact NH1-OD1 3.33Å; R217-D262 VanDerWaalsContact NH1-OD1 3.08Å; R221-D262 IonicContact CZ-OD1 3.47Å; R221-D262 IonicContact CZ-OD2 3.08Å; R221-D262 IonicContact NE-OD1 2.94Å; R221-D262 PolarHBondContact NE-OD1 3.47Å; R221-D262 VanDerWaalsContact NE-OD1 3.12Å; R221-D262 IonicContact NE-OD2 3.38Å; R221-D262 PolarHBondContact NE-OD2 3.44Å; R221-D262 VanDerWaalsContact NE-OD2 3.13Å; R221-D262 IonicContact NH2-OD1 3.68Å; R221-D262 PolarHBondContact NH2-OD1 3.49Å; R221-D262 IonicContact NH2-OD2 3.78Å; K258-D262 WeakPolarHBondContact O-CB 3.49Å; K258-D262 PolarHBondContact O-N 2.98Å; K258-D262 VanDerWaalsContact O-N 3.13Å; A259-D262 PolarHBondContact O-N 2.86Å; L260-D262 VanDerWaalsContact C-N 3.25Å; L260-D262 PolarHBondContact O-N 3.37Å; D262-Y265 PolarHBondContact O-N 2.83Å; D262-R266 PolarHBondContact O-N 2.94Å
263V98.5Very high97.7Very high0 Ų048.7 Ų48.70%026%0.257CS..Hα-helixtrans-64.3-45.5171.1173.50000110.9S211 L237 I241 I244 A259 L260 Y265 R266 A267S211-V263 WeakPolarHBondContact OG-CA 2.79Å; S211-V263 VanDerWaalsContact OG-CG2 3.26Å; S211-V263 WeakPolarHBondContact OG-CG2 3.29Å; L237-V263 HydrophobicContact CB-CG1 4.12Å; L237-V263 HydrophobicContact CD1-CG1 4.37Å; L237-V263 HydrophobicContact CD2-CG1 4.31Å; I241-V263 HydrophobicContact CD1-CG1 3.83Å; I241-V263 HydrophobicContact CG1-CG1 3.77Å; I244-V263 HydrophobicContact CD1-CG2 3.93Å; A259-V263 VanDerWaalsContact O-CG2 3.32Å; A259-V263 WeakPolarHBondContact O-CG2 3.43Å; A259-V263 PolarHBondContact O-N 2.84Å; L260-V263 PolarHBondContact O-N 3Å; V263-Y265 VanDerWaalsContact C-N 3.34Å; V263-Y265 PolarHBondContact O-N 3.3Å; V263-R266 WeakPolarHBondContact O-CB 3.42Å; V263-R266 PolarHBondContact O-N 3.27Å; V263-R266 VanDerWaalsContact O-N 3.13Å; V263-A267 WeakPolarHBondContact O-CB 3.41Å; V263-A267 PolarHBondContact O-N 3.47Å
264L98.4Very high97.9Very high7 Ų750.9 Ų50.94%0.03726%0.257CS..Hα-helixtrans-62.3-41.9176.8-76.1174.6000111.7L260 R266 A267 Q268 L276 K283L260-L264 HydrophobicContact CD1-CD1 4.43Å; L260-L264 HydrophobicContact CD1-CG 4.4Å; L260-L264 HydrophobicContact CG-CD1 4.2Å; L260-L264 WeakPolarHBondContact O-CB 3.28Å; L260-L264 WeakPolarHBondContact O-CG 3.47Å; L260-L264 PolarHBondContact O-N 3.44Å; L264-R266 VanDerWaalsContact C-N 3.28Å; L264-R266 PolarHBondContact O-N 2.93Å; L264-A267 PolarHBondContact O-N 3.1Å; L264-Q268 VanDerWaalsContact O-CG 3.28Å; L264-Q268 WeakPolarHBondContact O-CG 3.22Å; L264-Q268 PolarHBondContact O-N 2.99Å; L264-L276 HydrophobicContact CD2-CD2 4.09Å; L264-K283 HydrophobicContact CD1-CD 4.23Å
265Y98.4Very high98Very high43 Ų4342.5 Ų42.517%0.16922%0.218CC..Hα-helixtrans-56.9-43.9172.6169.5-96.4000111.6I212 Y215 R217 D261 D262 V263 Q268 L269I212-Y265 HydrophobicContact CG2-CD1 4.18Å; Y215-Y265 HydrophobicContact CG-CE1 4.32Å; R217-Y265 HydrophobicContact CB-CD1 4.19Å; R217-Y265 HydrophobicContact CB-CE1 3.74Å; R217-Y265 VanDerWaalsContact CZ-CB 3.47Å; D261-Y265 WeakPolarHBondContact O-CB 3.19Å; D261-Y265 PolarHBondContact O-N 2.98Å; D262-Y265 PolarHBondContact O-N 2.83Å; V263-Y265 VanDerWaalsContact C-N 3.34Å; V263-Y265 PolarHBondContact O-N 3.3Å; Y265-Q268 PolarHBondContact O-N 3.27Å; Y265-L269 HydrophobicContact CD1-CD1 4.15Å; Y265-L269 HydrophobicContact CE1-CD1 3.49Å; Y265-L269 VanDerWaalsContact CE1-CD1 3.49Å; Y265-L269 HydrophobicContact CE1-CG 4.48Å; Y265-L269 HydrophobicContact CE2-CD1 4.13Å; Y265-L269 VanDerWaalsContact CZ-CD1 3.49Å; Y265-L269 WeakPolarHBondContact O-CG 3.47Å; Y265-L269 PolarHBondContact O-N 3.46Å
266R98Very high98.1Very high1 Ų141.9 Ų41.90%0.00422%0.215CC..Hα-helixtrans-64.8-46.1176.8-178.155-176.9-833.7112.2V210 S211 Y215 L230 L237 D262 V263 L264 Q268 L269 E270V210-R266 PolarHBondContact O-NH1 2.78Å; S211-R266 WeakPolarHBondContact O-CB 3.28Å; S211-R266 VanDerWaalsContact O-CD 3.28Å; S211-R266 WeakPolarHBondContact O-CD 3.38Å; S211-R266 WeakPolarHBondContact O-CG 3.44Å; Y215-R266 VanDerWaalsContact OH-CZ 3.24Å; Y215-R266 PolarHBondContact OH-NE 3.49Å; Y215-R266 VanDerWaalsContact OH-NE 3.14Å; Y215-R266 PolarHBondContact OH-NH2 2.59Å; L230-R266 PolarHBondContact O-NH1 3.07Å; L230-R266 VanDerWaalsContact O-NH1 3.13Å; L230-R266 PolarHBondContact O-NH2 3.31Å; L237-R266 HydrophobicContact CD1-CG 4.28Å; D262-R266 PolarHBondContact O-N 2.94Å; V263-R266 WeakPolarHBondContact O-CB 3.42Å; V263-R266 PolarHBondContact O-N 3.27Å; V263-R266 VanDerWaalsContact O-N 3.13Å; L264-R266 VanDerWaalsContact C-N 3.28Å; L264-R266 PolarHBondContact O-N 2.93Å; R266-Q268 VanDerWaalsContact C-N 3.25Å; R266-Q268 PolarHBondContact O-N 3.34Å; R266-L269 PolarHBondContact O-N 3.32Å; R266-L269 VanDerWaalsContact O-N 3.14Å; R266-E270 HydrophobicContact CG-CG 4.47Å; R266-E270 IonicContact CZ-OE1 3.82Å; R266-E270 IonicContact NE-OE1 3.13Å; R266-E270 PolarHBondContact NE-OE1 3.43Å; R266-E270 IonicContact NH2-OE1 3.44Å; R266-E270 PolarHBondContact NH2-OE1 3Å; R266-E270 PolarHBondContact O-N 3.38Å
267A98.3Very high98.1Very high0 Ų047.9 Ų47.90%025%0.246CC..Hα-helixtrans-63.4-31.2179.700000112.4L237 V263 L264 L271 F272 A275 L276L237-A267 HydrophobicContact CD1-CB 4.4Å; V263-A267 WeakPolarHBondContact O-CB 3.41Å; V263-A267 PolarHBondContact O-N 3.47Å; L264-A267 PolarHBondContact O-N 3.1Å; A267-L271 CarbonylContact O-C 3.57Å; A267-L271 VanDerWaalsContact O-CA 3.32Å; A267-L271 WeakPolarHBondContact O-CA 3.43Å; A267-L271 PolarHBondContact O-N 3.18Å; A267-F272 HydrophobicContact CB-CB 4.21Å; A267-F272 PolarHBondContact O-N 3.14Å; A267-A275 HydrophobicContact CB-CB 3.86Å; A267-L276 HydrophobicContact CB-CD2 3.76Å; A267-L276 HydrophobicContact CB-CG 3.8Å
268Q98.3Very high98.1Very high111 Ų11147.7 Ų47.752%0.51924%0.243SC..Hα-helixtrans-67.4-42.9172.5-73.9174.3-6.800112L264 Y265 R266 L276L264-Q268 VanDerWaalsContact O-CG 3.28Å; L264-Q268 WeakPolarHBondContact O-CG 3.22Å; L264-Q268 PolarHBondContact O-N 2.99Å; Y265-Q268 PolarHBondContact O-N 3.27Å; R266-Q268 VanDerWaalsContact C-N 3.25Å; R266-Q268 PolarHBondContact O-N 3.34Å; Q268-L276 HydrophobicContact CB-CD2 4.47Å; Q268-L276 HydrophobicContact CG-CD2 3.57Å
269L97.8Very high98.1Very high85 Ų8545.1 Ų45.145%0.44523%0.231SC..Hα-helixtrans-68.6-36.7-179.8-68.5-179.8000112.9Y215 Y265 R266Y215-L269 HydrophobicContact CD1-CD1 3.36Å; Y215-L269 HydrophobicContact CE1-CD1 3.54Å; Y215-L269 HydrophobicContact CG-CD1 4.24Å; Y265-L269 HydrophobicContact CD1-CD1 4.15Å; Y265-L269 HydrophobicContact CE1-CD1 3.49Å; Y265-L269 VanDerWaalsContact CE1-CD1 3.49Å; Y265-L269 HydrophobicContact CE1-CG 4.48Å; Y265-L269 HydrophobicContact CE2-CD1 4.13Å; Y265-L269 VanDerWaalsContact CZ-CD1 3.49Å; Y265-L269 WeakPolarHBondContact O-CG 3.47Å; Y265-L269 PolarHBondContact O-N 3.46Å; R266-L269 PolarHBondContact O-N 3.32Å; R266-L269 VanDerWaalsContact O-N 3.14Å
270E97.2Very high98.1Very high74 Ų7448.3 Ų48.335%0.34625%0.248SC..Hα-helixtrans-93.3-1.8-179.9-59.2-73-177.500113.2Y215 R266 F272Y215-E270 PolarHBondContact OH-OE1 3.05Å; R266-E270 HydrophobicContact CG-CG 4.47Å; R266-E270 IonicContact CZ-OE1 3.82Å; R266-E270 IonicContact NE-OE1 3.13Å; R266-E270 PolarHBondContact NE-OE1 3.43Å; R266-E270 IonicContact NH2-OE1 3.44Å; R266-E270 PolarHBondContact NH2-OE1 3Å; R266-E270 PolarHBondContact O-N 3.38Å; E270-F272 HydrophobicContact CB-CD1 4.2Å; E270-F272 HydrophobicContact CB-CD2 3.72Å; E270-F272 HydrophobicContact CB-CE1 3.96Å; E270-F272 HydrophobicContact CB-CE2 3.48Å; E270-F272 VanDerWaalsContact CB-CE2 3.48Å; E270-F272 HydrophobicContact CB-CG 4.08Å; E270-F272 HydrophobicContact CB-CZ 3.61Å; E270-F272 HydrophobicContact CG-CD2 4.44Å; E270-F272 HydrophobicContact CG-CE2 3.88Å; E270-F272 HydrophobicContact CG-CZ 4.14Å; E270-F272 PolarHBondContact O-N 2.77Å
271L98.1Very high98Very high140 Ų14050.6 Ų50.673%0.73327%0.268SS*.THydrogen-bonded Turntrans55.945.9-177.8-54.8173.7000113.6A267 P273A267-L271 CarbonylContact O-C 3.57Å; A267-L271 VanDerWaalsContact O-CA 3.32Å; A267-L271 WeakPolarHBondContact O-CA 3.43Å; A267-L271 PolarHBondContact O-N 3.18Å; L271-P273 WeakPolarHBondContact O-CD 3.39Å
272F98.4Very high97.9Very high40 Ų4049.1 Ų49.118%0.17526%0.26CS..  trans-87.6101177.8-66.7-31.8000111.8V232 L237 A267 E270 E274 A275 L276V232-F272 WeakPolarHBondContact O-CZ 3.29Å; L237-F272 HydrophobicContact CD1-CD2 3.75Å; L237-F272 HydrophobicContact CD1-CE2 4.2Å; A267-F272 HydrophobicContact CB-CB 4.21Å; A267-F272 PolarHBondContact O-N 3.14Å; E270-F272 HydrophobicContact CB-CD1 4.2Å; E270-F272 HydrophobicContact CB-CD2 3.72Å; E270-F272 HydrophobicContact CB-CE1 3.96Å; E270-F272 HydrophobicContact CB-CE2 3.48Å; E270-F272 VanDerWaalsContact CB-CE2 3.48Å; E270-F272 HydrophobicContact CB-CG 4.08Å; E270-F272 HydrophobicContact CB-CZ 3.61Å; E270-F272 HydrophobicContact CG-CD2 4.44Å; E270-F272 HydrophobicContact CG-CE2 3.88Å; E270-F272 HydrophobicContact CG-CZ 4.14Å; E270-F272 PolarHBondContact O-N 2.77Å; F272-E274 PolarHBondContact O-N 3.19Å; F272-A275 HydrophobicContact CB-CB 4.26Å; F272-L276 VanDerWaalsContact O-CG 3.25Å; F272-L276 WeakPolarHBondContact O-CG 3.35Å; F272-L276 PolarHBondContact O-N 3.4Å; F272-L276 VanDerWaalsContact O-N 3.13Å
273P98.2Very high97.7Very high79 Ų7952.6 Ų52.651%0.51328%0.275SS..Hα-helixtrans-68.4-35.8-170.528.1-34.2000112.7L271 L276 L277L271-P273 WeakPolarHBondContact O-CD 3.39Å; P273-L276 PolarHBondContact O-N 3.13Å; P273-L277 VanDerWaalsContact O-CB 3.25Å; P273-L277 WeakPolarHBondContact O-CB 3.34Å; P273-L277 PolarHBondContact O-N 3.27Å
274E97.6Very high97.4Very high101 Ų10156.2 Ų56.247%0.47230%0.3SS..Hα-helixtrans-67.4-47.5-177.3-52.679.1-170.600110.9S234 V238 F272 L276 L277 V278S234-E274 WeakPolarHBondContact CB-OE2 3.31Å; S234-E274 PolarHBondContact OG-OE2 2.84Å; V238-E274 HydrophobicContact CG2-CB 3.99Å; F272-E274 PolarHBondContact O-N 3.19Å; E274-L276 VanDerWaalsContact C-N 3.33Å; E274-L276 PolarHBondContact O-N 2.91Å; E274-L277 PolarHBondContact O-N 2.94Å; E274-V278 WeakPolarHBondContact O-CG2 3.36Å; E274-V278 PolarHBondContact O-N 3.28Å
275A97.9Very high97Very high0 Ų059.4 Ų59.40%032%0.323CS..Hα-helixtrans-62.7-40.1176.400000111.8L237 V238 I241 A267 F272 G279L237-A275 HydrophobicContact CB-CB 3.95Å; L237-A275 HydrophobicContact CD1-CB 4.36Å; V238-A275 HydrophobicContact CG2-CB 4.34Å; I241-A275 HydrophobicContact CD1-CB 3.99Å; I241-A275 VanDerWaalsContact CD1-O 3.31Å; I241-A275 WeakPolarHBondContact CD1-O 3.45Å; A267-A275 HydrophobicContact CB-CB 3.86Å; F272-A275 HydrophobicContact CB-CB 4.26Å; A275-G279 PolarHBondContact O-N 3.35Å
276L98.5Very high96.4Very high36 Ų3660.5 Ų60.519%0.18833%0.331CS..Hα-helixtrans-63.8-45174.5-71.9173000112.2L264 A267 Q268 F272 P273 E274 N280L264-L276 HydrophobicContact CD2-CD2 4.09Å; A267-L276 HydrophobicContact CB-CD2 3.76Å; A267-L276 HydrophobicContact CB-CG 3.8Å; Q268-L276 HydrophobicContact CB-CD2 4.47Å; Q268-L276 HydrophobicContact CG-CD2 3.57Å; F272-L276 VanDerWaalsContact O-CG 3.25Å; F272-L276 WeakPolarHBondContact O-CG 3.35Å; F272-L276 PolarHBondContact O-N 3.4Å; F272-L276 VanDerWaalsContact O-N 3.13Å; P273-L276 PolarHBondContact O-N 3.13Å; E274-L276 VanDerWaalsContact C-N 3.33Å; E274-L276 PolarHBondContact O-N 2.91Å; L276-N280 WeakPolarHBondContact O-CB 3.39Å; L276-N280 VanDerWaalsContact O-CG 3.27Å; L276-N280 PolarHBondContact O-N 3.14Å; L276-N280 PolarHBondContact O-ND2 3.4Å
277L98.3Very high95.3Very high127 Ų12766 Ų6667%0.66536%0.357SS*.Hα-helixtrans-61.4-54.7-179.3176.962.9000110.8P273 E274 A281P273-L277 VanDerWaalsContact O-CB 3.25Å; P273-L277 WeakPolarHBondContact O-CB 3.34Å; P273-L277 PolarHBondContact O-N 3.27Å; E274-L277 PolarHBondContact O-N 2.94Å; L277-A281 WeakPolarHBondContact O-CB 3.31Å; L277-A281 PolarHBondContact O-N 3.27Å
278V98Very high93.9Very high53 Ų5368.5 Ų68.532%0.32138%0.375SS..Hα-helixtrans-65.5-45.1-177.2-1790000110.6I241 E274 N280 A281 I282I241-V278 HydrophobicContact CG2-CB 4.43Å; I241-V278 HydrophobicContact CG2-CG1 3.7Å; E274-V278 WeakPolarHBondContact O-CG2 3.36Å; E274-V278 PolarHBondContact O-N 3.28Å; V278-N280 PolarHBondContact O-N 2.86Å; V278-A281 PolarHBondContact O-N 3.03Å; V278-I282 HydrophobicContact CG1-CD1 4.03Å; V278-I282 WeakPolarHBondContact O-CG1 3.43Å; V278-I282 PolarHBondContact O-N 3.47Å
279G97.6Very high92.2Very high0 Ų066 Ų660%037%0.373CS..Hα-helixtrans-64.9-40.7-179.400000113.2A275 I282 K283A275-G279 PolarHBondContact O-N 3.35Å; G279-I282 PolarHBondContact O-N 3.02Å; G279-K283 WeakPolarHBondContact O-CB 3.09Å; G279-K283 PolarHBondContact O-N 3.06Å
280N97.6Very high90.5Very high67 Ų6764.9 Ų64.936%0.35838%0.376SS..Hα-helixtrans-70.4-33.8175.6-74.7-42.2000112.5L276 V278 K283 S284L276-N280 WeakPolarHBondContact O-CB 3.39Å; L276-N280 VanDerWaalsContact O-CG 3.27Å; L276-N280 PolarHBondContact O-N 3.14Å; L276-N280 PolarHBondContact O-ND2 3.4Å; V278-N280 PolarHBondContact O-N 2.86Å; N280-K283 PolarHBondContact O-N 3.14Å; N280-S284 WeakPolarHBondContact O-CB 3.41Å; N280-S284 PolarHBondContact O-N 3.26Å; N280-S284 PolarHBondContact O-OG 3.45Å
281A97.2Very high88.7Confident52 Ų5267.6 Ų67.643%0.4339%0.392SS..Hα-helixtrans-62-43.6173.600000111.4L277 V278 S284 S285L277-A281 WeakPolarHBondContact O-CB 3.31Å; L277-A281 PolarHBondContact O-N 3.27Å; V278-A281 PolarHBondContact O-N 3.03Å; A281-S284 PolarHBondContact O-N 3.13Å; A281-S285 WeakPolarHBondContact O-CB 3.49Å; A281-S285 PolarHBondContact O-N 3.21Å; A281-S285 PolarHBondContact O-OG 3.17Å
282I95.8Very high86.6Confident15 Ų1564.7 Ų64.78%0.07737%0.373CS..Hα-helixtrans-62.9-49.8174.3-70.2157.9000110.5I241 H245 L248 L260 V278 G279 S284 S285 L286I241-I282 HydrophobicContact CG2-CD1 3.23Å; H245-I282 HydrophobicContact CB-CD1 3.8Å; H245-I282 HydrophobicContact CB-CG1 4.36Å; L248-I282 HydrophobicContact CD1-CG2 4.13Å; L260-I282 HydrophobicContact CD2-CB 4.46Å; L260-I282 HydrophobicContact CD2-CG2 3.93Å; V278-I282 HydrophobicContact CG1-CD1 4.03Å; V278-I282 WeakPolarHBondContact O-CG1 3.43Å; V278-I282 PolarHBondContact O-N 3.47Å; G279-I282 PolarHBondContact O-N 3.02Å; I282-S284 VanDerWaalsContact C-N 3.28Å; I282-S284 PolarHBondContact O-N 2.9Å; I282-S285 PolarHBondContact O-N 3.2Å; I282-S285 VanDerWaalsContact O-N 3.1Å; I282-L286 HydrophobicContact CG2-CD1 3.92Å; I282-L286 HydrophobicContact CG2-CG 4.38Å; I282-L286 WeakPolarHBondContact O-CG 3.25Å; I282-L286 PolarHBondContact O-N 3.47Å
283K93.3Very high84.4Confident73 Ų7367.9 Ų67.932%0.31740%0.401SS..Hα-helixtrans-56.5-43.4179.5-169.8166.8-175.9161.40112L260 D261 L264 G279 N280 L286 H287L260-K283 HydrophobicContact CD2-CB 4.39Å; D261-K283 IonicContact OD1-NZ 3.92Å; D261-K283 PolarHBondContact OD1-NZ 2.82Å; L264-K283 HydrophobicContact CD1-CD 4.23Å; G279-K283 WeakPolarHBondContact O-CB 3.09Å; G279-K283 PolarHBondContact O-N 3.06Å; N280-K283 PolarHBondContact O-N 3.14Å; K283-L286 PolarHBondContact O-N 2.88Å; K283-H287 PolarHBondContact O-CD2 2.69Å; K283-H287 PolarHBondContact O-N 3.21Å; K283-H287 VanDerWaalsContact O-N 3.15Å
284S93.1Very high82.1Confident77 Ų7773.3 Ų73.354%0.53842%0.416SS..Hα-helixtrans-66.6-39.9177.3-56.20000112.3N280 A281 I282 L286 H287 S288N280-S284 WeakPolarHBondContact O-CB 3.41Å; N280-S284 PolarHBondContact O-N 3.26Å; N280-S284 PolarHBondContact O-OG 3.45Å; A281-S284 PolarHBondContact O-N 3.13Å; I282-S284 VanDerWaalsContact C-N 3.28Å; I282-S284 PolarHBondContact O-N 2.9Å; S284-L286 PolarHBondContact O-N 3.13Å; S284-H287 PolarHBondContact O-N 2.95Å; S284-S288 PolarHBondContact O-N 3.19Å
285S90.6Very high79.6Confident74 Ų7476.3 Ų76.352%0.51743%0.43SS..Hα-helixtrans-64.9-39.1178.1-59.80000112.1A281 I282 S288 A289A281-S285 WeakPolarHBondContact O-CB 3.49Å; A281-S285 PolarHBondContact O-N 3.21Å; A281-S285 PolarHBondContact O-OG 3.17Å; I282-S285 PolarHBondContact O-N 3.2Å; I282-S285 VanDerWaalsContact O-N 3.1Å; S285-S288 PolarHBondContact O-N 3.27Å; S285-A289 PolarHBondContact O-N 3.4Å
286L84.9Confident76.8Confident65 Ų6580.2 Ų80.234%0.3447%0.471SS..Hα-helixtrans-66.1-42.2175.5-66167.1000112L248 I282 K283 S284 S288 A289 A290L248-L286 HydrophobicContact CD1-CD1 3.87Å; L248-L286 HydrophobicContact CD2-CD1 4.32Å; I282-L286 HydrophobicContact CG2-CD1 3.92Å; I282-L286 HydrophobicContact CG2-CG 4.38Å; I282-L286 WeakPolarHBondContact O-CG 3.25Å; I282-L286 PolarHBondContact O-N 3.47Å; K283-L286 PolarHBondContact O-N 2.88Å; S284-L286 PolarHBondContact O-N 3.13Å; L286-S288 VanDerWaalsContact C-N 3.34Å; L286-S288 PolarHBondContact O-N 3.22Å; L286-A289 PolarHBondContact O-N 3.36Å; L286-A290 PolarHBondContact O-N 3.26Å
287H74.4Confident74.4Confident116 Ų11681.3 Ų81.354%0.53749%0.491SS..Hα-helixtrans-61-43173.6-83.9-66.9000111.7K283 S284 A290 L291K283-H287 PolarHBondContact O-CD2 2.69Å; K283-H287 PolarHBondContact O-N 3.21Å; K283-H287 VanDerWaalsContact O-N 3.15Å; S284-H287 PolarHBondContact O-N 2.95Å; H287-A290 PolarHBondContact O-N 2.79Å; H287-L291 WeakPolarHBondContact O-CG 3.18Å; H287-L291 PolarHBondContact O-N 2.8Å
288S68.6Low71.6Confident54 Ų5485.2 Ų85.238%0.37850%0.497SS..Hα-helixtrans-62.4-42.2175.5-169.50000112S284 S285 L286 A290 L291 K292S284-S288 PolarHBondContact O-N 3.19Å; S285-S288 PolarHBondContact O-N 3.27Å; L286-S288 VanDerWaalsContact C-N 3.34Å; L286-S288 PolarHBondContact O-N 3.22Å; S288-A290 PolarHBondContact O-N 2.85Å; S288-L291 PolarHBondContact O-N 3.03Å; S288-K292 WeakPolarHBondContact O-CG 3.36Å; S288-K292 PolarHBondContact O-N 3.11Å
289A64.2Low68.8Low58 Ų5887.8 Ų87.848%0.47952%0.517SS..Hα-helixtrans-63.1-41.1176.200000112.4S285 L286 L291 K292 S293S285-A289 PolarHBondContact O-N 3.4Å; L286-A289 PolarHBondContact O-N 3.36Å; A289-L291 VanDerWaalsContact C-N 3.34Å; A289-L291 PolarHBondContact O-N 3.18Å; A289-K292 PolarHBondContact O-N 2.9Å; A289-S293 PolarHBondContact O-N 2.86Å
290A61.5Low66.3Low61 Ų6194.6 Ų94.650%0.50455%0.551SS.*Hα-helixtrans-64.4-36.9176.600000112.7L286 H287 S288L286-A290 PolarHBondContact O-N 3.26Å; H287-A290 PolarHBondContact O-N 2.79Å; S288-A290 PolarHBondContact O-N 2.85Å
291L58.9Low63.6Low131 Ų13198.8 Ų98.869%0.68657%0.569SS**Hα-helixtrans-69.5-42.2175.4-69.8166.3000111.7H287 S288 A289 S293 K294H287-L291 WeakPolarHBondContact O-CG 3.18Å; H287-L291 PolarHBondContact O-N 2.8Å; S288-L291 PolarHBondContact O-N 3.03Å; A289-L291 VanDerWaalsContact C-N 3.34Å; A289-L291 PolarHBondContact O-N 3.18Å; L291-S293 VanDerWaalsContact C-N 3.27Å; L291-S293 PolarHBondContact O-N 2.76Å; L291-K294 PolarHBondContact O-N 2.82Å
292K54.8Low61.2Low79 Ų79101.1 Ų101.134%0.34358%0.578SS.*Hα-helixtrans-70.6-16.3176.6-68.9-176.7-176.5-167.30114.5S288 A289 K294 E295 R298S288-K292 WeakPolarHBondContact O-CG 3.36Å; S288-K292 PolarHBondContact O-N 3.11Å; A289-K292 PolarHBondContact O-N 2.9Å; K292-K294 PolarHBondContact O-N 2.84Å; K292-E295 CarbonylContact O-C 3.46Å; K292-R298 PolarHBondContact NZ-O 3.44Å; K292-R298 VanDerWaalsContact NZ-O 3.08Å
293S50.5Low58.6Low107 Ų107108.6 Ų108.675%0.74861%0.612SS**THydrogen-bonded Turntrans-69.7-21.5173.3-171.60000112.1A289 L291A289-S293 PolarHBondContact O-N 2.86Å; L291-S293 VanDerWaalsContact C-N 3.27Å; L291-S293 PolarHBondContact O-N 2.76Å
294K50.8Low56.4Low193 Ų193111.2 Ų111.284%0.83963%0.628SS**THydrogen-bonded Turntrans-92-19176.7-70.1-171.1175-1770114.5L291 K292L291-K294 PolarHBondContact O-N 2.82Å; K292-K294 PolarHBondContact O-N 2.84Å
295E44.3Very low54Low165 Ų165113.1 Ų113.177%0.77164%0.637SS**SBendtrans-129.4109.7174.9-78.3-177.7154.900109.1K292 G297K292-E295 CarbonylContact O-C 3.46Å; E295-G297 PolarHBondContact O-N 2.64Å
296G40.9Very low51.5Low82 Ų82114.9 Ų114.985%0.84565%0.647SS**  trans-45.8121.4-171.200000114.5
297G46.4Very low49.9Very low59 Ų59117.2 Ų117.261%0.60866%0.664SS**  trans52.9107.1145.200000118.4E295E295-G297 PolarHBondContact O-N 2.64Å
298R39.7Very low48.5Very low209 Ų209115.1 Ų115.179%0.78967%0.667SS**  -163.3126.8124.7-98154.6-162.4-161.36.4111K292K292-R298 PolarHBondContact NZ-O 3.44Å; K292-R298 VanDerWaalsContact NZ-O 3.08Å
299S40.4Very low47.5Very low106 Ų106118.5 Ų118.574%0.74169%0.69SS**SBendtrans-51.8144.3165.543.60000111.2Q301S299-Q301 PolarHBondContact O-N 3.18Å
300I44.8Very low46.9Very low143 Ų143126 Ų12673%0.73371%0.706SS**  trans25.790170.7-47.8179.2000113.4V302I300-V302 HydrophobicContact CG2-CG2 3.62Å; I300-V302 PolarHBondContact O-N 3.39Å
301Q39.8Very low46.3Very low156 Ų156130.4 Ų130.473%0.72972%0.72SS**  trans-72.289.4160.1-78.3-178.5-21.300106.8S299 E303S299-Q301 PolarHBondContact O-N 3.18Å; Q301-E303 VanDerWaalsContact C-N 3.25Å; Q301-E303 PolarHBondContact O-N 2.93Å; Q301-E303 VanDerWaalsContact O-N 3.12Å
302V47.3Very low46Very low101 Ų101127.4 Ų127.461%0.61271%0.71SS**  trans-68.9100.1152.9-174.90000103.7I300 I304I300-V302 HydrophobicContact CG2-CG2 3.62Å; I300-V302 PolarHBondContact O-N 3.39Å; V302-I304 HydrophobicContact CB-CG1 4.33Å; V302-I304 HydrophobicContact CG1-CG1 3.67Å; V302-I304 PolarHBondContact O-N 3.48Å
303E41Very low45.9Very low171 Ų171135.6 Ų135.680%0.79974%0.739SS**  trans-63.384.7156-82.4-171156.800105.9Q301 T305Q301-E303 VanDerWaalsContact C-N 3.25Å; Q301-E303 PolarHBondContact O-N 2.93Å; Q301-E303 VanDerWaalsContact O-N 3.12Å; E303-T305 PolarHBondContact O-N 3.12Å
304I47.4Very low46Very low128 Ų128136.9 Ų136.966%0.65674%0.737SS**  trans-62.7101.5154.3-56.2175.4000101.7V302 P306V302-I304 HydrophobicContact CB-CG1 4.33Å; V302-I304 HydrophobicContact CG1-CG1 3.67Å; V302-I304 PolarHBondContact O-N 3.48Å; I304-P306 WeakPolarHBondContact O-CD 3.32Å
305T43Very low46.4Very low117 Ų117130.4 Ų130.472%0.71872%0.72SS**  trans-43.2112.5164.1-57.40000104.7E303 T307E303-T305 PolarHBondContact O-N 3.12Å; T305-T307 VanDerWaalsContact C-N 3.35Å; T305-T307 PolarHBondContact O-N 2.94Å
306P38.3Very low47Very low111 Ų111127.5 Ų127.572%0.72171%0.713SS**  trans-59.5109.2-174.819.5-28.5000105.1I304 A308I304-P306 WeakPolarHBondContact O-CD 3.32Å; P306-A308 PolarHBondContact O-N 3.44Å
307T49.7Very low48.1Very low114 Ų114127.5 Ų127.570%0.69970%0.697SS**  trans-62.595160.629.10000102.7T305 S309T305-T307 VanDerWaalsContact C-N 3.35Å; T305-T307 PolarHBondContact O-N 2.94Å; T307-S309 PolarHBondContact O-N 2.81Å
308A45.6Very low48.6Very low73 Ų73129.5 Ų129.560%0.60370%0.702SS**  trans-48.2114.5-177.300000106.7P306 R310P306-A308 PolarHBondContact O-N 3.44Å; A308-R310 PolarHBondContact O-N 2.67Å
309S47.9Very low49.4Very low125 Ų125126 Ų12687%0.87470%0.698SS**SBendtrans-69.322.6170.152.70000111.6T307T307-S309 PolarHBondContact O-N 2.81Å
310R51Low50.2Low214 Ų214123.4 Ų123.481%0.80868%0.679SS**  trans-126.284169.9-64.7-171.4178.7-159.60.1105.9A308 S312A308-R310 PolarHBondContact O-N 2.67Å; R310-S312 PolarHBondContact O-N 3.16Å
311I50.6Low50.8Low154 Ų154121.8 Ų121.879%0.7967%0.671SS**  trans-47.3106.7144.7-63.9168.6000104.3R313 A315I311-R313 PolarHBondContact O-N 3.06Å; I311-A315 HydrophobicContact CG2-CB 4.35Å
312S51.8Low51.7Low69 Ų69124.4 Ų124.448%0.48367%0.674SS.*  trans-50.1127.1172.9168.10000106.5R310 N314 A315R310-S312 PolarHBondContact O-N 3.16Å; S312-N314 PolarHBondContact O-N 2.77Å; S312-N314 PolarHBondContact OG-N 3.25Å; S312-A315 WeakPolarHBondContact O-CB 3.28Å; S312-A315 PolarHBondContact O-N 3.4Å
313R53.1Low52.1Low250 Ų250122.5 Ų122.594%0.94368%0.675SS**THydrogen-bonded Turntrans-55.7-6.8173.7-95.5179.9171.7151.5-2.7113I311I311-R313 PolarHBondContact O-N 3.06Å
314N52.2Low52.7Low135 Ų135122 Ų12272%0.72267%0.672SS**THydrogen-bonded Turntrans-113.515.9178.9-55.6-6.5000112.7S312 V316S312-N314 PolarHBondContact O-N 2.77Å; S312-N314 PolarHBondContact OG-N 3.25Å; N314-V316 PolarHBondContact O-N 2.99Å
315A58.1Low52.9Low57 Ų57126.1 Ų126.147%0.47168%0.68SS.*  trans-64.5103.7174.300000109.4I311 S312 T317I311-A315 HydrophobicContact CG2-CB 4.35Å; S312-A315 WeakPolarHBondContact O-CB 3.28Å; S312-A315 PolarHBondContact O-N 3.4Å; A315-T317 PolarHBondContact O-N 2.95Å
316V58.8Low53.2Low104 Ų104132.3 Ų132.363%0.6369%0.69SS**  trans-68100.5176.2-178.60000107.8N314 I321N314-V316 PolarHBondContact O-N 2.99Å; V316-I321 HydrophobicContact CG1-CD1 4.23Å; V316-I321 HydrophobicContact CG1-CG1 3.79Å
317T63.9Low53.7Low81 Ų81136.5 Ų136.550%0.49770%0.697SS.*  trans-79.2158.9170.857.10000109.7A315 L319 S320 I321A315-T317 PolarHBondContact O-N 2.95Å; T317-L319 PolarHBondContact O-N 3.33Å; T317-S320 WeakPolarHBondContact O-CA 3.27Å; T317-S320 VanDerWaalsContact O-CB 3.27Å; T317-S320 WeakPolarHBondContact O-CB 3.45Å; T317-S320 PolarHBondContact O-N 3.39Å; T317-I321 PolarHBondContact O-N 3.43Å
318S57Low53.1Low102 Ų102142 Ų14271%0.71371%0.705SS**Hα-helixtrans-54-23.9172.9500000113R322S318-R322 PolarHBondContact O-N 3.42Å
319L55Low52.7Low135 Ų135146.2 Ų146.271%0.70772%0.718SS**Hα-helixtrans-67.3-39170.9-136.181.7000112.8T317 I321 R322 G323T317-L319 PolarHBondContact O-N 3.33Å; L319-I321 VanDerWaalsContact C-N 3.34Å; L319-I321 PolarHBondContact O-N 3.29Å; L319-R322 PolarHBondContact O-N 3.47Å; L319-G323 PolarHBondContact O-N 3.02Å
320S58.6Low52.1Low51 Ų51148.4 Ų148.436%0.35771%0.714SS.*Hα-helixtrans-67.1-32.4178.3-168.90000112.4T317 H324T317-S320 WeakPolarHBondContact O-CA 3.27Å; T317-S320 VanDerWaalsContact O-CB 3.27Å; T317-S320 WeakPolarHBondContact O-CB 3.45Å; T317-S320 PolarHBondContact O-N 3.39Å; S320-H324 PolarHBondContact O-CD2 3.4Å
321I56.8Low51.1Low110 Ų110144.8 Ų144.856%0.56472%0.716SS**Hα-helixtrans-71.9-33.9176.2-63.4173.3000111V316 T317 L319V316-I321 HydrophobicContact CG1-CD1 4.23Å; V316-I321 HydrophobicContact CG1-CG1 3.79Å; T317-I321 PolarHBondContact O-N 3.43Å; L319-I321 VanDerWaalsContact C-N 3.34Å; L319-I321 PolarHBondContact O-N 3.29Å
322R58.7Low50.3Low211 Ų211146.3 Ų146.380%0.79672%0.72SS**Hα-helixtrans-68.4-32.9176.9-108179.4-160.3-173.55.9113.2S318 L319 H324S318-R322 PolarHBondContact O-N 3.42Å; L319-R322 PolarHBondContact O-N 3.47Å; R322-H324 PolarHBondContact O-N 2.81Å
323G55.2Low49.3Very low61 Ų61151.9 Ų151.963%0.62974%0.738SS**Hα-helixtrans-70.9-25.3-18000000114.7L319L319-G323 PolarHBondContact O-N 3.02Å
324H54.2Low48.4Very low160 Ų160146.5 Ų146.574%0.74173%0.733SS**G310 helixtrans-86.3-6.1-175.7-85.4-73.7000115.1S320 R322 W326S320-H324 PolarHBondContact O-CD2 3.4Å; R322-H324 PolarHBondContact O-N 2.81Å; H324-W326 VanDerWaalsContact C-N 3.33Å; H324-W326 PolarHBondContact O-N 3.49Å
325R51.4Low47.3Very low215 Ų215145.1 Ų145.181%0.81173%0.733SS**G310 helixtrans-78-8.6-177.6-85.8-169.3173.9-120.71.4115.3
326W48.5Very low46.1Very low246 Ų246149.3 Ų149.393%0.93275%0.753SS**G310 helixtrans-116.223.2-166.6-86.533.1000115.9H324H324-W326 VanDerWaalsContact C-N 3.33Å; H324-W326 PolarHBondContact O-N 3.49Å
327K49Very low44.8Very low200 Ų200152.3 Ų152.387%0.8777%0.765SS**  trans-136.390.4170.6-113.1-176.6178.4-179.30112.1
328R37.2Very low43.1Very low228 Ų228152.2 Ų152.286%0.8678%0.78SS**  trans170.691.9130.1-177176-90.3149.7-10.2109.2
329N37.8Very low42Very low163 Ų163155 Ų15587%0.87279%0.787SS**  trans-110.9115.6138.9-94.42.2000104.9
330E34.6Very low41.4Very low171 Ų171153.5 Ų153.580%0.79979%0.785SS**  trans175.3130.4137.2-97.2175.7-165.800108.7
331T30.3Very low40.1Very low137 Ų137157.7 Ų157.784%0.8481%0.809SS**  trans76.3101170.567.20000117.3
332Q33.4Very low38.9Very low187 Ų187160.8 Ų160.887%0.87483%0.826SS**  174117.990.7-167.6158.323.900109.9
333E32.3Very low37.6Very low185 Ų185154.1 Ų154.186%0.86482%0.822SS**  trans-71.1129.7167.8-60.8177.815700109.8
334V33.1Very low36.3Very low138 Ų138156.6 Ų156.684%0.83683%0.83SS**  trans-154.9120.6140.6-179.60000108.5
335S29.7Very low35.3Very low105 Ų105155.5 Ų155.573%0.73484%0.835SS**  trans-75.1150.9173.7-23.30000112.2
336V31.9Very low34.4Very low146 Ų146149.7 Ų149.789%0.88583%0.833SS**  -167.9137.6127.2170.30000109.5
337D31.3Very low33.8Very low167 Ų167144.3 Ų144.389%0.89383%0.826SS**  trans-65.3159.8-172.8-66.9-53000118.4
338G29.4Very low33.1Very low78 Ų78140.1 Ų140.180%0.80482%0.82SS**  trans176.9102.4160.700000113.6
339D32.8Very low32.7Very low162 Ų162137.8 Ų137.887%0.86682%0.819SS**  trans-69.6175.6-174.9-139.414.3000114.5
340P44Very low32.6Very low102 Ų102137.5 Ų137.566%0.66282%0.815SS**  trans-120.1154.3-133.528.5-3.8000113.6
341T31.1Very low32.3Very low139 Ų139134 Ų13485%0.85381%0.81SS**  trans-153.6126.5157.438.90000113.4
342L32Very low32.6Very low176 Ų176133.9 Ų133.992%0.92181%0.809SS**  trans59.3119.3140.4-125.276.8000121.7
343G29.7Very low32.6Very low70 Ų70131.7 Ų131.772%0.72281%0.808SS**  104.592.4117.800000119.1
344S28.7Very low32.5Very low114 Ų114126.4 Ų126.480%0.79780%0.804SS**  trans48.3108.2133.61770000120
345V32.6Very low32.5Very low137 Ų137126.9 Ų126.983%0.8381%0.806SS**  -143.3115.1127.6-178.60000109
346A34.1Very low32.5Very low93 Ų93127.7 Ų127.777%0.76981%0.812SS**PPolyproline II helixtrans-79131.1170.800000110.2
347V35.8Very low32.4Very low132 Ų132124.2 Ų124.280%0.881%0.806SS**PPolyproline II helixtrans-101.6125.6167.9178.20000107.3E349V347-E349 PolarHBondContact O-N 3.49Å
348P32.9Very low32.3Very low112 Ų112125.5 Ų125.573%0.72781%0.807SS**PPolyproline II helixtrans-75.6124.9-175.628.5-31.2000111.2I350P348-I350 PolarHBondContact O-N 3.2Å
349E29.6Very low32.3Very low180 Ų180133.6 Ų133.684%0.84181%0.813SS**  trans-84.497172.7-161.4172.5-157.900109.1V347 S351V347-E349 PolarHBondContact O-N 3.49Å; E349-S351 PolarHBondContact O-N 3.35Å
350I34.4Very low32.1Very low156 Ų156135.2 Ų135.280%0.882%0.817SS**  trans-78.192.6169.536.5163.9000109.4P348 V352P348-I350 PolarHBondContact O-N 3.2Å; I350-V352 PolarHBondContact O-N 3.44Å
351S30.3Very low31.4Very low99 Ų99135 Ų13569%0.69282%0.824SS**  trans-83.3106.7170.5-69.20000110.4E349E349-S351 PolarHBondContact O-N 3.35Å
352V35.3Very low31.2Very low134 Ų134136.5 Ų136.581%0.81283%0.827SS**  trans-99.179.8170-175.10000108.6I350I350-V352 PolarHBondContact O-N 3.44Å
353T33.6Very low31Very low141 Ų141132 Ų13287%0.86582%0.823SS**  trans-167.3102.1154.146.50000108.5
354G30.8Very low31Very low74 Ų74136.7 Ų136.776%0.76383%0.831SS**  trans-152.768.2177.600000110.7
355V31.8Very low31Very low147 Ų147136.1 Ų136.189%0.89183%0.827SS**  trans-129.982.2162.8-174.10000107
356S30.6Very low30.8Very low122 Ų122137.5 Ų137.585%0.85383%0.829SS**  trans-81.4122.5159.6-78.80000107.5
357G30Very low30.9Very low74 Ų74143.4 Ų143.476%0.76383%0.832SS**  trans-72.7137.1175.100000111.8
358E28.4Very low30.9Very low194 Ų194143.4 Ų143.491%0.90783%0.834SS**  trans-99.6114.5160.7-74-172.1142.200108.9
359R30.5Very low30.7Very low247 Ų247148.6 Ų148.693%0.93284%0.839SS**  trans-78.1127.8161.5-77.5177175176.7-2.3107.8
360M28.4Very low30.6Very low196 Ų196144.9 Ų144.997%0.96683%0.834SS**  trans-87.5121.2158.9-74.4-172.8130.200109
361A29Very low30.4Very low97 Ų97145.4 Ų145.480%0.80284%0.838SS**  trans-104.2141.7170.500000109.6
362N27.4Very low30.2Very low172 Ų172144 Ų14492%0.9284%0.839SS**  trans-53.6141.1175.8-71.1-23.7000113
363G27.8Very low29.9Very low80 Ų80149 Ų14983%0.82584%0.843SS**  trans-113.4124.6165.400000110.4
364D28.1Very low29.7Very low169 Ų169149 Ų14990%0.90484%0.839SS**  trans-80.2169179.1-115.3-27.8000113.6
365S29.4Very low29.6Very low102 Ų102153.2 Ų153.271%0.71384%0.838SS**  trans96.6115.1162.7-134.90000114.9
366L29.4Very low29.6Very low166 Ų166152.9 Ų152.987%0.86983%0.83SS**  -153.6141.565.9-73.6156.1000112.3
367R35.3Very low29.6Very low217 Ų217153.8 Ų153.882%0.81983%0.826SS**  trans-99.9158.5156.8-79.3-174.8170.9177.2-1.7109.2
368P34.9Very low29.5Very low132 Ų132156.8 Ų156.886%0.85782%0.824SS**  -135.3167.991.726.7-7.4000114.7
369R29.9Very low29.6Very low221 Ų221151.2 Ų151.283%0.83481%0.807SS**  trans-79.6157.9-171.9-60.5164.4123.2154.1-2.9113.3
370S28.1Very low29.7Very low103 Ų103147.9 Ų147.972%0.7281%0.806SS**  -174.3131.9120.853.80000111.8
371D28.5Very low29.5Very low166 Ų166141.9 Ų141.989%0.88880%0.795SS**  trans34133.5142.8-52.3-25.1000119.3
372G27.1Very low29.5Very low70 Ų70141.9 Ų141.972%0.72280%0.795SS**  cis129.4139.333.600000108.3
373R29Very low29.5Very low238 Ų238139.4 Ų139.490%0.89879%0.791SS**  trans84.3116.8162.9-62.8-179.8-177.8175.81.3121.1
374N28.6Very low29.6Very low143 Ų143140.4 Ų140.477%0.76579%0.786SS**  46.6150.3118.9-67.25.6000124
375H29.6Very low29.6Very low161 Ų161141 Ų14175%0.74578%0.783SS**  trans91.5112.5163-75.1-78.9000115.7
376L30.8Very low29.7Very low140 Ų140142.1 Ų142.173%0.73379%0.785SS**  85118.666.5-93.6167.6000113
377D30.5Very low29.5Very low142 Ų142140.2 Ų140.276%0.75979%0.786SS**  trans79.4152.6138.4-119.2-10.4000123.5
378D28.5Very low29.3Very low136 Ų136135.6 Ų135.673%0.72778%0.782SS**  trans77.5140.7164.2-87.9-12.3000118.9
379S31.1Very low29Very low78 Ų78136.7 Ų136.755%0.54578%0.78SS.*  cis167.9144.6-13.9-113.40000105.8
380L31.8Very low28.9Very low176 Ų176132.1 Ų132.192%0.92178%0.782SS**  trans66.3143.9150.9-54.2162.4000117
381G25.3Very low29.2Very low70 Ų70139.2 Ų139.272%0.72279%0.793SS**  cis155.1173.412.900000108.5
382A27.7Very low29.1Very low98 Ų98134.6 Ų134.681%0.8179%0.785SS**  trans94.188.4164.700000119.7
383S28.7Very low29.3Very low119 Ų119139.8 Ų139.883%0.83279%0.79SS**  2.7143.9114.3-34.70000121
384S29.1Very low29.4Very low102 Ų102134.7 Ų134.771%0.71378%0.781SS**  trans145.5150.7133.6-94.40000110.7
385E29.3Very low29.5Very low181 Ų181133 Ų13385%0.84678%0.78SS**  cis-169.6165-17.8-116.2175.5160.300106.8
386V29.9Very low29.4Very low125 Ų125129.1 Ų129.176%0.75878%0.784SS**  trans-63.3151.3174.3162.80000112.7
387S26.3Very low29.3Very low126 Ų126127.9 Ų127.988%0.88179%0.787SS**  trans-159.7142.1148.1-76.90000112.8
388T30.2Very low29.3Very low121 Ų121132 Ų13274%0.74279%0.792SS**  trans-103.3154.1-168.940.50000114.2
389D28.7Very low29.3Very low154 Ų154130.3 Ų130.382%0.82479%0.79SS**  trans56.6133148-80.9-15.1000123
390S28.9Very low29.3Very low125 Ų125135.8 Ų135.887%0.87481%0.807SS**  180132.9118.3-74.40000114.8
391R32.6Very low29.2Very low252 Ų252136.6 Ų136.695%0.95181%0.806SS**  trans-33.9151170.3-66.2165.6168.6170-3.8120.3
392G28.1Very low29.5Very low70 Ų70139.8 Ų139.872%0.72281%0.812SS**  127.5115.2116.500000121
393H31Very low29.6Very low179 Ų179146.5 Ų146.583%0.82982%0.816SS**  trans77108.2146.3-89.9-76000124.2
394D30.3Very low30Very low130 Ų130152.3 Ų152.370%0.69582%0.82SS**  92.1129.9111.9-115.5-21.9000125.7
395S31Very low30.1Very low108 Ų108156.7 Ų156.776%0.75583%0.829SS**  trans75.5120.6145.774.70000122.2
396G27.5Very low30.2Very low79 Ų79158 Ų15881%0.81483%0.832SS**  123.6108.112600000119.4
397S29.3Very low30.3Very low114 Ų114158.1 Ų158.180%0.79784%0.838SS**  trans9294.3143.6-1700000121.3
398R30.2Very low30.6Very low230 Ų230157.8 Ų157.887%0.86883%0.83SS**  68.3124112.5-132.4-175.7-177.6174.9-0.1120.5
399S28.2Very low30.7Very low99 Ų99163.7 Ų163.769%0.69284%0.839SS**  trans100.2102.7141.6-35.70000118
400Q30.8Very low30.9Very low194 Ų194167.8 Ų167.891%0.90784%0.843SS**  -176.8122.7107.4-103.6-178.7-6.300111.4
401E29.5Very low30.9Very low193 Ų193168.7 Ų168.790%0.90284%0.835SS**  trans-96.2119.5-178.7-167.3173.8-168.700108.4
402V33.1Very low30.9Very low137 Ų137163.8 Ų163.883%0.8383%0.833SS**  trans-95102.9175177.50000109.5
403R29.8Very low31.1Very low238 Ų238167.4 Ų167.490%0.89883%0.831SS**  trans-74.3115.3178.8-167.9175.6-176.2156.7-0.4110.7
404R35.3Very low31.1Very low242 Ų242165.5 Ų165.591%0.91383%0.827SS**PPolyproline II helixtrans-88.8131.5170.1-91.7-179.6150.6177.5-5.9111.6
405Q31.4Very low31.1Very low194 Ų194167.7 Ų167.791%0.90783%0.833SS**PPolyproline II helixtrans-68.3138.6-171.7-72.6166-43.300113.7
406K31.9Very low31Very low208 Ų208166.2 Ų166.290%0.90484%0.835SS**PPolyproline II helixtrans-81.1131.2160.7-79.3176.4173.2176.70108.8
407S32.9Very low31.4Very low127 Ų127168.6 Ų168.689%0.88884%0.839SS**PPolyproline II helixtrans-103.3146.9165.8-168.90000110.8
408V32.4Very low31.4Very low119 Ų119166.7 Ų166.772%0.72184%0.837SS**PPolyproline II helixtrans-82.8132.2-155.9169.10000112.2R410V408-R410 HydrophobicContact CG1-CG 4.48Å
409R30.9Very low31.6Very low246 Ų246164.5 Ų164.593%0.92884%0.842SS**PPolyproline II helixtrans-84.4128.7156.4-92.3-178.2173.1172.3-2.8108.3
410R32.9Very low31.8Very low239 Ų239164.8 Ų164.890%0.90285%0.85SS**  trans-108.4125.4159.5-97.4-171.1-176.4-177.81.9109.4V408V408-R410 HydrophobicContact CG1-CG 4.48Å
411M30.3Very low32Very low145 Ų145161.1 Ų161.171%0.71485%0.846SS**  trans-74.4144.6162.2-69.5168.861.100109.4E413M411-E413 HydrophobicContact CE-CG 3.78Å
412V31.6Very low32.4Very low149 Ų149156.5 Ų156.590%0.90384%0.841SS**  trans-130.1114.8142.3178.90000105.6
413E33.5Very low32.3Very low146 Ų146154 Ų15468%0.68284%0.842SS**  trans-69.3149.1168.5-63.3167.6147.200109M411M411-E413 HydrophobicContact CE-CG 3.78Å
414N30Very low32.6Very low139 Ų139154.4 Ų154.474%0.74384%0.844SS**  15915891.4-158.721000111.6
415E30.8Very low32.5Very low176 Ų176148.1 Ų148.182%0.82284%0.837SS**  trans94.9117.2159.8-53.5-160.2161.300119
416G29.3Very low32.9Very low77 Ų77146.6 Ų146.679%0.79483%0.83SS**  trans135.553.5150.600000116.6
417S34.3Very low33.7Very low129 Ų129150.3 Ų150.390%0.90284%0.84SS**  trans-53132.2162.249.20000112.6
418G29.7Very low33.7Very low73 Ų73151.5 Ų151.575%0.75384%0.838SS**  trans-171.993.6168.900000112.6
419L35.3Very low33.8Very low185 Ų185153.2 Ų153.297%0.96984%0.844SS**  trans-60.1133169-76.3114.1000110.9
420A32.8Very low33.9Very low105 Ų105148.1 Ų148.187%0.86884%0.839SS**  trans-113.9108.8163.300000109.4
421S33.6Very low34Very low117 Ų117142.7 Ų142.782%0.81884%0.836SS**  trans-68.2148.5172.8176.30000111.5
422A37.8Very low34.2Very low96 Ų96142.6 Ų142.679%0.79384%0.843SS**  trans-55.1159.5161.500000112.4
423G32.5Very low34.4Very low84 Ų84142.1 Ų142.187%0.86684%0.839SS**  trans143.1112.5154.800000114.9
424R35.4Very low34.5Very low246 Ų246141.9 Ų141.993%0.92885%0.851SS**  trans-93.2150.2-177.9-165.3-177.3-173.2-177.91110.2
425S33.8Very low34.8Very low110 Ų110142.1 Ų142.177%0.76986%0.859SS**  trans84.8113.2151.6-153.70000119.2
426Q39.8Very low35.1Very low162 Ų162139.3 Ų139.376%0.75786%0.862SS**  -164.8137.2114.9-101.7178.615.100110.4
427Y47.5Very low35.7Very low287 Ų287144.9 Ų144.9100%1.12587%0.868SS**  trans75.90179.1-58.4-75.4000118.5

Retrieved 427 of 427 residues in 183 ms (Link to these results)

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