G4VSA0_SCHMA Loading...

SAM domain-containing protein

AlphaFold DB , UniProt , Accession G4VSA0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 232 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
1M33.8Very low64.3Low242 Ų242125.2 Ų125.2100%1.19261%0.608SS**  093.10-77.9179-18000106.3K3M1-K3 PolarHBondContact O-N 3.06Å
2D42.1Very low66.7Low161 Ų161120.6 Ų120.686%0.86160%0.598SS**  trans-64.6109.9166.7-116.3-16000105.6F4D2-F4 PolarHBondContact O-N 2.64Å
3K46.2Very low68.8Low185 Ų185114.5 Ų114.580%0.80456%0.564SS**  trans-55.8116.7163.4-83.1174.3171.3176.90103.6M1 E5M1-K3 PolarHBondContact O-N 3.06Å; K3-E5 PolarHBondContact O-N 3.01Å
4F53.8Low70.7Confident173 Ų173111.7 Ų111.776%0.75956%0.557SS**  trans-6081.4167.3-98.1-94.4000106.7D2 K6D2-F4 PolarHBondContact O-N 2.64Å; F4-K6 PolarHBondContact O-N 3.03Å
5E55.4Low72.4Confident172 Ų172106.1 Ų106.180%0.80453%0.531SS*.PPolyproline II helixtrans-61.8127.8171.3-123.3174.9-176.900105.1K3K3-E5 PolarHBondContact O-N 3.01Å
6K62.3Low73.9Confident105 Ų105106.5 Ų106.546%0.45754%0.541SS..PPolyproline II helixtrans-47.3121.6175.9177.3-179176.71770107.1F4 Q8 F82 D83F4-K6 PolarHBondContact O-N 3.03Å; K6-Q8 PolarHBondContact O-N 3.09Å; K6-F82 HydrophobicContact CG-CD1 4.43Å; K6-D83 VanDerWaalsContact CE-OD1 3.29Å; K6-D83 WeakPolarHBondContact CE-OD1 3.45Å; K6-D83 IonicContact NZ-OD1 3.25Å; K6-D83 PolarHBondContact NZ-OD1 3.15Å; K6-D83 IonicContact NZ-OD2 2.59Å; K6-D83 PolarHBondContact NZ-OD2 2.97Å
7P69.2Low75.2Confident50 Ų50105.1 Ų105.133%0.32553%0.532SS..PPolyproline II helixtrans-55.7138.5-177.219.6-29.5000108.7S9 F79 F82P7-S9 PolarHBondContact O-N 3.24Å; P7-F79 HydrophobicContact CB-CE1 4.31Å; P7-F79 HydrophobicContact CG-CE1 4.28Å; P7-F82 VanDerWaalsContact CD-CE1 3.48Å; P7-F82 VanDerWaalsContact CD-CZ 3.41Å; P7-F82 HydrophobicContact CG-CD2 3.98Å; P7-F82 HydrophobicContact CG-CE1 4.2Å; P7-F82 HydrophobicContact CG-CE2 3.53Å; P7-F82 HydrophobicContact CG-CG 4.49Å; P7-F82 HydrophobicContact CG-CZ 3.65Å
8Q77Confident76.3Confident143 Ų14399.2 Ų99.267%0.66850%0.502SS*.PPolyproline II helixtrans-51.9128.4179.1-71.8-175.6-12.200109.4K6 Y10 F79K6-Q8 PolarHBondContact O-N 3.09Å; Q8-Y10 PolarHBondContact O-N 2.96Å; Q8-F79 WeakPolarHBondContact O-CE1 3.38Å; Q8-F79 WeakPolarHBondContact O-CZ 3.43Å
9S85.8Confident77.4Confident48 Ų4895.5 Ų95.534%0.33648%0.484SS..PPolyproline II helixtrans-49136.1-177.5179.40000110.5P7 L11 S12P7-S9 PolarHBondContact O-N 3.24Å; S9-L11 PolarHBondContact O-N 3.31Å; S9-L11 WeakPolarHBondContact OG-CB 3.49Å; S9-L11 PolarHBondContact OG-N 2.93Å; S9-S12 PolarHBondContact O-N 3.13Å; S9-S12 PolarHBondContact O-OG 2.98Å
10Y89.6Confident78.2Confident24 Ų2494.9 Ų94.99%0.09449%0.488CS..G310 helixtrans-55.8-21.6174.776.2-86.8000112.5Q8 S12 W13 G43 L46 L75 Q76 F79Q8-Y10 PolarHBondContact O-N 2.96Å; Y10-S12 PolarHBondContact O-N 3.13Å; Y10-W13 VanDerWaalsContact O-CB 3.22Å; Y10-W13 WeakPolarHBondContact O-CB 3.5Å; Y10-W13 VanDerWaalsContact O-CG 3.29Å; Y10-W13 PolarHBondContact O-N 3.46Å; Y10-G43 WeakPolarHBondContact O-CA 3.16Å; Y10-L46 HydrophobicContact CD2-CB 4.25Å; Y10-L46 HydrophobicContact CD2-CD1 4.4Å; Y10-L46 HydrophobicContact CE2-CB 4.2Å; Y10-L75 HydrophobicContact CD1-CG 4.45Å; Y10-L75 HydrophobicContact CD2-CD2 4.12Å; Y10-L75 HydrophobicContact CG-CD2 3.95Å; Y10-L75 HydrophobicContact CG-CG 4.29Å; Y10-Q76 HydrophobicContact CE1-CG 4.15Å; Y10-Q76 WeakPolarHBondContact OH-CG 3.48Å; Y10-F79 HydrophobicContact CD1-CB 4.01Å; Y10-F79 HydrophobicContact CD1-CD1 4.45Å; Y10-F79 AromaticContact CD1-CD2 3.57Å; Y10-F79 HydrophobicContact CD1-CD2 3.57Å; Y10-F79 HydrophobicContact CD1-CE2 4.14Å; Y10-F79 AromaticContact CD1-CG 3.74Å; Y10-F79 HydrophobicContact CD1-CG 3.74Å; Y10-F79 HydrophobicContact CE1-CB 4.3Å; Y10-F79 HydrophobicContact CG-CD2 4.26Å; Y10-F79 HydrophobicContact CG-CE2 4.41Å
11L92.5Very high79Confident74 Ų7493 Ų9339%0.38748%0.475SS..G310 helixtrans-61.3-24.3175.1-64.9175.9000113.7S9S9-L11 PolarHBondContact O-N 3.31Å; S9-L11 WeakPolarHBondContact OG-CB 3.49Å; S9-L11 PolarHBondContact OG-N 2.93Å
12S92.5Very high82Confident70 Ų7081.5 Ų81.549%0.4942%0.418SS..G310 helixtrans-91.73.8175.165.80000113.4S9 Y10 T14S9-S12 PolarHBondContact O-N 3.13Å; S9-S12 PolarHBondContact O-OG 2.98Å; Y10-S12 PolarHBondContact O-N 3.13Å; S12-T14 PolarHBondContact O-N 2.9Å
13W94.9Very high84.4Confident41 Ų4176.5 Ų76.516%0.15540%0.396CS..  trans-65.8131178.9-70.70.1000111.8Y10 Q17 V18 W21 G43 L46 L75 F79Y10-W13 VanDerWaalsContact O-CB 3.22Å; Y10-W13 WeakPolarHBondContact O-CB 3.5Å; Y10-W13 VanDerWaalsContact O-CG 3.29Å; Y10-W13 PolarHBondContact O-N 3.46Å; W13-Q17 HydrophobicContact CB-CB 4Å; W13-Q17 HydrophobicContact CG-CB 4.16Å; W13-V18 HydrophobicContact CB-CG2 3.9Å; W13-V18 HydrophobicContact CE3-CG2 4.28Å; W13-W21 HydrophobicContact CE3-CB 4.49Å; W13-W21 HydrophobicContact CH2-CB 4.36Å; W13-W21 AromaticContact CH2-CD1 3.77Å; W13-W21 AromaticContact CH2-CG 3.96Å; W13-W21 HydrophobicContact CH2-CG 3.96Å; W13-W21 HydrophobicContact CZ3-CB 3.76Å; W13-W21 AromaticContact CZ3-CD1 3.84Å; W13-W21 AromaticContact CZ3-CD2 3.96Å; W13-W21 HydrophobicContact CZ3-CD2 3.96Å; W13-W21 AromaticContact CZ3-CG 3.54Å; W13-W21 HydrophobicContact CZ3-CG 3.54Å; W13-G43 PolarHBondContact O-N 3.23Å; W13-L46 HydrophobicContact CE3-CD1 4.1Å; W13-L46 HydrophobicContact CZ3-CD1 4.29Å; W13-L75 HydrophobicContact CH2-CD1 3.67Å; W13-L75 HydrophobicContact CH2-CD2 4.07Å; W13-L75 HydrophobicContact CZ2-CD1 4.37Å; W13-L75 HydrophobicContact CZ3-CD1 4.31Å; W13-L75 HydrophobicContact CZ3-CD2 3.86Å; W13-F79 HydrophobicContact CZ2-CE2 4.17Å; W13-F79 HydrophobicContact CZ2-CZ 4.16Å
14T95.3Very high86.6Confident76 Ų7670.8 Ų70.847%0.46639%0.39SS..  trans-70.7165.7170.660.90000111.1S12 T16 Q17 V18S12-T14 PolarHBondContact O-N 2.9Å; T14-T16 VanDerWaalsContact C-N 3.27Å; T14-T16 PolarHBondContact O-N 3.42Å; T14-Q17 PolarHBondContact O-N 2.91Å; T14-Q17 VanDerWaalsContact O-N 3.14Å; T14-Q17 WeakPolarHBondContact OG1-CG 3.46Å; T14-Q17 PolarHBondContact OG1-N 3.37Å; T14-Q17 PolarHBondContact OG1-OE1 3.33Å; T14-V18 WeakPolarHBondContact O-CG2 3.35Å; T14-V18 PolarHBondContact O-N 3.15Å
15T96.4Very high88.4Confident28 Ų2864 Ų6417%0.17236%0.361CS..Hα-helixtrans-52.2-46.7174.9-47.20000112Q17 V18 I19 I41T15-Q17 VanDerWaalsContact C-N 3.33Å; T15-Q17 PolarHBondContact O-N 2.96Å; T15-V18 PolarHBondContact O-N 3.02Å; T15-I19 HydrophobicContact CG2-CG1 4.21Å; T15-I19 VanDerWaalsContact O-CG1 3.3Å; T15-I19 WeakPolarHBondContact O-CG1 3.4Å; T15-I19 PolarHBondContact O-N 3.05Å; T15-I41 WeakPolarHBondContact CA-O 3.47Å; T15-I41 WeakPolarHBondContact CB-O 3.43Å; T15-I41 WeakPolarHBondContact CG2-O 3.27Å; T15-I41 PolarHBondContact OG1-O 3.11Å
16T95.8Very high90.1Very high112 Ų11259.5 Ų59.569%0.68734%0.343SS*.Hα-helixtrans-58.6-42.9179.5-520000112.5T14 I19 S20T14-T16 VanDerWaalsContact C-N 3.27Å; T14-T16 PolarHBondContact O-N 3.42Å; T16-I19 PolarHBondContact O-N 3.27Å; T16-S20 WeakPolarHBondContact O-CB 3.41Å; T16-S20 PolarHBondContact O-N 3.15Å
17Q95.1Very high91.5Very high82 Ų8261.6 Ų61.638%0.38336%0.359SS..Hα-helixtrans-66.6-40.7178-71.4168.5-57.300111.8W13 T14 T15 W21W13-Q17 HydrophobicContact CB-CB 4Å; W13-Q17 HydrophobicContact CG-CB 4.16Å; T14-Q17 PolarHBondContact O-N 2.91Å; T14-Q17 VanDerWaalsContact O-N 3.14Å; T14-Q17 WeakPolarHBondContact OG1-CG 3.46Å; T14-Q17 PolarHBondContact OG1-N 3.37Å; T14-Q17 PolarHBondContact OG1-OE1 3.33Å; T15-Q17 VanDerWaalsContact C-N 3.33Å; T15-Q17 PolarHBondContact O-N 2.96Å; Q17-W21 WeakPolarHBondContact O-CB 3.5Å; Q17-W21 PolarHBondContact O-N 3.35Å
18V95.8Very high92.7Very high0 Ų060.5 Ų60.50%035%0.354CS..Hα-helixtrans-65.2-43.9176.7175.70000111.4W13 T14 T15 W21 L22 I41 L46W13-V18 HydrophobicContact CB-CG2 3.9Å; W13-V18 HydrophobicContact CE3-CG2 4.28Å; T14-V18 WeakPolarHBondContact O-CG2 3.35Å; T14-V18 PolarHBondContact O-N 3.15Å; T15-V18 PolarHBondContact O-N 3.02Å; V18-W21 PolarHBondContact O-N 2.95Å; V18-L22 HydrophobicContact CG1-CD1 3.89Å; V18-L22 HydrophobicContact CG1-CG 4.32Å; V18-L22 WeakPolarHBondContact O-CB 3.45Å; V18-L22 WeakPolarHBondContact O-CG 3.42Å; V18-L22 PolarHBondContact O-N 3.11Å; V18-I41 HydrophobicContact CG1-CD1 3.49Å; V18-I41 VanDerWaalsContact CG1-CD1 3.49Å; V18-I41 HydrophobicContact CG1-CG1 3.96Å; V18-L46 HydrophobicContact CG1-CD1 4.06Å; V18-L46 HydrophobicContact CG1-CD2 4.03Å; V18-L46 HydrophobicContact CG1-CG 4.08Å; V18-L46 HydrophobicContact CG2-CD1 4.01Å; V18-L46 HydrophobicContact CG2-CG 4.44Å
19I96.5Very high93.5Very high29 Ų2953.7 Ų53.715%0.14932%0.322CS..Hα-helixtrans-64.2-45.2178-63.5-57.2000111T15 T16 W21 L22 S23 L33 F36 I41T15-I19 HydrophobicContact CG2-CG1 4.21Å; T15-I19 VanDerWaalsContact O-CG1 3.3Å; T15-I19 WeakPolarHBondContact O-CG1 3.4Å; T15-I19 PolarHBondContact O-N 3.05Å; T16-I19 PolarHBondContact O-N 3.27Å; I19-W21 PolarHBondContact O-N 3.18Å; I19-L22 PolarHBondContact O-N 3.38Å; I19-S23 PolarHBondContact O-N 3.09Å; I19-L33 HydrophobicContact CG2-CB 4.36Å; I19-F36 HydrophobicContact CD1-CB 3.6Å; I19-I41 HydrophobicContact CD1-CD1 4.11Å; I19-I41 HydrophobicContact CD1-CG1 4.25Å
20S94.8Very high93.9Very high83 Ų8356.5 Ų56.558%0.5833%0.33SS*.Hα-helixtrans-62.4-31.9175.9-178.30000112.9T16 S23T16-S20 WeakPolarHBondContact O-CB 3.41Å; T16-S20 PolarHBondContact O-N 3.15Å; S20-S23 PolarHBondContact O-OG 3.44Å
21W94.9Very high94.2Very high55 Ų5560.1 Ų60.121%0.20836%0.356CS..Hα-helixtrans-74-43.4174.6176.480.1000111.4W13 Q17 V18 I19 S23 G24 L25 L46 K71 V72 L75W13-W21 HydrophobicContact CE3-CB 4.49Å; W13-W21 HydrophobicContact CH2-CB 4.36Å; W13-W21 AromaticContact CH2-CD1 3.77Å; W13-W21 AromaticContact CH2-CG 3.96Å; W13-W21 HydrophobicContact CH2-CG 3.96Å; W13-W21 HydrophobicContact CZ3-CB 3.76Å; W13-W21 AromaticContact CZ3-CD1 3.84Å; W13-W21 AromaticContact CZ3-CD2 3.96Å; W13-W21 HydrophobicContact CZ3-CD2 3.96Å; W13-W21 AromaticContact CZ3-CG 3.54Å; W13-W21 HydrophobicContact CZ3-CG 3.54Å; Q17-W21 WeakPolarHBondContact O-CB 3.5Å; Q17-W21 PolarHBondContact O-N 3.35Å; V18-W21 PolarHBondContact O-N 2.95Å; I19-W21 PolarHBondContact O-N 3.18Å; W21-S23 VanDerWaalsContact C-N 3.32Å; W21-S23 PolarHBondContact O-N 3.34Å; W21-G24 PolarHBondContact O-N 3.39Å; W21-G24 VanDerWaalsContact O-N 3.15Å; W21-L25 HydrophobicContact CD2-CD2 4.45Å; W21-L25 HydrophobicContact CH2-CD1 3.98Å; W21-L25 HydrophobicContact CH2-CD2 4.14Å; W21-L25 HydrophobicContact CZ2-CD2 3.87Å; W21-L25 HydrophobicContact CZ3-CD1 3.97Å; W21-L46 HydrophobicContact CE3-CD1 4.24Å; W21-L46 HydrophobicContact CE3-CD2 4.43Å; W21-L46 HydrophobicContact CZ3-CD1 4.31Å; W21-L46 HydrophobicContact CZ3-CD2 3.97Å; W21-K71 HydrophobicContact CH2-CB 4.03Å; W21-K71 HydrophobicContact CZ2-CB 4.16Å; W21-V72 HydrophobicContact CH2-CG2 3.8Å; W21-V72 HydrophobicContact CZ3-CG2 4.07Å; W21-L75 HydrophobicContact CH2-CD2 4.27Å; W21-L75 HydrophobicContact CZ2-CB 4.01Å; W21-L75 HydrophobicContact CZ2-CD1 4.48Å; W21-L75 HydrophobicContact CZ2-CD2 3.96Å; W21-L75 HydrophobicContact CZ2-CG 4.39Å
22L95.9Very high94.3Very high0 Ų058.1 Ų58.10%034%0.344CS..Hα-helixtrans-62.9-36.2178.2-75.2171.3000112.6V18 I19 G24 L25 L33 F36 I41 W45 I68V18-L22 HydrophobicContact CG1-CD1 3.89Å; V18-L22 HydrophobicContact CG1-CG 4.32Å; V18-L22 WeakPolarHBondContact O-CB 3.45Å; V18-L22 WeakPolarHBondContact O-CG 3.42Å; V18-L22 PolarHBondContact O-N 3.11Å; I19-L22 PolarHBondContact O-N 3.38Å; L22-G24 PolarHBondContact O-N 3.13Å; L22-L25 HydrophobicContact CD2-CD1 3.76Å; L22-L25 WeakPolarHBondContact O-CB 3.41Å; L22-L25 WeakPolarHBondContact O-CG 3.32Å; L22-L25 PolarHBondContact O-N 3.02Å; L22-L33 HydrophobicContact CB-CD2 3.54Å; L22-F36 HydrophobicContact CD1-CD2 3.61Å; L22-F36 HydrophobicContact CD1-CE2 3.98Å; L22-I41 HydrophobicContact CD1-CD1 3.68Å; L22-W45 HydrophobicContact CD1-CZ3 4.42Å; L22-I68 HydrophobicContact CD2-CG2 4.46Å
23S93.5Very high94.5Very high56 Ų5655.3 Ų55.339%0.39232%0.323SS..THydrogen-bonded Turntrans-66.6-18.917769.90000113.3I19 S20 W21I19-S23 PolarHBondContact O-N 3.09Å; S20-S23 PolarHBondContact O-OG 3.44Å; W21-S23 VanDerWaalsContact C-N 3.32Å; W21-S23 PolarHBondContact O-N 3.34Å
24G91.1Very high94.4Very high66 Ų6658.1 Ų58.168%0.6835%0.349SS*.THydrogen-bonded Turntrans-88.40.7176.500000114.4W21 L22W21-G24 PolarHBondContact O-N 3.39Å; W21-G24 VanDerWaalsContact O-N 3.15Å; L22-G24 PolarHBondContact O-N 3.13Å
25L91.1Very high94.4Very high30 Ų3056.5 Ų56.516%0.15734%0.344CS..THydrogen-bonded Turntrans-82-57.7-174.2-61.5-170.9000113.2W21 L22 I29 K71W21-L25 HydrophobicContact CD2-CD2 4.45Å; W21-L25 HydrophobicContact CH2-CD1 3.98Å; W21-L25 HydrophobicContact CH2-CD2 4.14Å; W21-L25 HydrophobicContact CZ2-CD2 3.87Å; W21-L25 HydrophobicContact CZ3-CD1 3.97Å; L22-L25 HydrophobicContact CD2-CD1 3.76Å; L22-L25 WeakPolarHBondContact O-CB 3.41Å; L22-L25 WeakPolarHBondContact O-CG 3.32Å; L22-L25 PolarHBondContact O-N 3.02Å; L25-I29 HydrophobicContact CB-CG1 4.44Å; L25-K71 HydrophobicContact CD1-CB 3.85Å; L25-K71 HydrophobicContact CD1-CG 4.13Å; L25-K71 HydrophobicContact CD2-CB 3.76Å; L25-K71 HydrophobicContact CD2-CD 4.14Å; L25-K71 HydrophobicContact CD2-CG 3.81Å; L25-K71 HydrophobicContact CG-CB 4.4Å; L25-K71 HydrophobicContact CG-CG 4.38Å
26D91.9Very high94.4Very high78 Ų7855.1 Ų55.142%0.41734%0.336SS..  trans-168.2144.8-176.9-165.7-75.2000108.9A28 I29 I67D26-A28 PolarHBondContact O-N 3.39Å; D26-A28 VanDerWaalsContact O-N 3.11Å; D26-A28 WeakPolarHBondContact OD1-CB 3.49Å; D26-A28 PolarHBondContact OD1-N 3.33Å; D26-I29 HydrophobicContact CB-CG1 4.31Å; D26-I29 WeakPolarHBondContact O-CB 3.16Å; D26-I29 PolarHBondContact O-N 2.92Å; D26-I67 HydrophobicContact CB-CG2 4.12Å
27D92Very high94.3Very high148 Ų14852.5 Ų52.579%0.79132%0.321SS*.G310 helixtrans-58.3-25.7177.9-65.4-19.5000112.2I29 E30D27-I29 PolarHBondContact O-N 3.07Å; D27-I29 VanDerWaalsContact O-N 3.15Å; D27-E30 WeakPolarHBondContact O-CB 3.31Å; D27-E30 PolarHBondContact O-N 3.42Å
28A93.3Very high94.3Very high27 Ų2752.3 Ų52.322%0.22333%0.334CS..G310 helixtrans-62.6-17.5175.400000113.8D26 P31D26-A28 PolarHBondContact O-N 3.39Å; D26-A28 VanDerWaalsContact O-N 3.11Å; D26-A28 WeakPolarHBondContact OD1-CB 3.49Å; D26-A28 PolarHBondContact OD1-N 3.33Å; A28-P31 WeakPolarHBondContact O-CD 3.42Å
29I93.9Very high94.2Very high0 Ų057 Ų570%036%0.355CS..G310 helixtrans-89.5-20.9-178.7-51.8-50.9000112.3L25 D26 D27 P31 Y32 L33 H64 I67 I68L25-I29 HydrophobicContact CB-CG1 4.44Å; D26-I29 HydrophobicContact CB-CG1 4.31Å; D26-I29 WeakPolarHBondContact O-CB 3.16Å; D26-I29 PolarHBondContact O-N 2.92Å; D27-I29 PolarHBondContact O-N 3.07Å; D27-I29 VanDerWaalsContact O-N 3.15Å; I29-P31 VanDerWaalsContact C-N 3.31Å; I29-P31 VanDerWaalsContact O-N 3.14Å; I29-Y32 HydrophobicContact CG2-CD2 4.43Å; I29-Y32 WeakPolarHBondContact O-CD2 3.49Å; I29-Y32 PolarHBondContact O-N 2.93Å; I29-L33 HydrophobicContact CG2-CD2 4.16Å; I29-H64 HydrophobicContact CD1-CB 4.37Å; I29-I67 HydrophobicContact CD1-CB 4.41Å; I29-I67 HydrophobicContact CD1-CG2 4.16Å; I29-I67 HydrophobicContact CG1-CG2 4.28Å; I29-I68 HydrophobicContact CD1-CD1 4.02Å; I29-I68 HydrophobicContact CD1-CG1 3.72Å; I29-I68 HydrophobicContact CG1-CG1 4.36Å; I29-I68 HydrophobicContact CG2-CD1 4.39Å; I29-I68 HydrophobicContact CG2-CG1 4.49Å
30E94.5Very high94.1Very high108 Ų10861.3 Ų61.351%0.50538%0.378SS..Hα-helixtrans-46.9-43.8-178.6-166.764.6-156.700113.8D27 Y32 L33D27-E30 WeakPolarHBondContact O-CB 3.31Å; D27-E30 PolarHBondContact O-N 3.42Å; E30-Y32 PolarHBondContact O-N 2.95Å; E30-L33 PolarHBondContact O-N 3.19Å; E30-L33 WeakPolarHBondContact OE2-CD1 3.35Å
31P95.5Very high94Very high99 Ų9957.5 Ų57.564%0.64335%0.351SS*.Hα-helixtrans-61.6-19.5-179-23.736000114.9A28 I29A28-P31 WeakPolarHBondContact O-CD 3.42Å; I29-P31 VanDerWaalsContact C-N 3.31Å; I29-P31 VanDerWaalsContact O-N 3.14Å
32Y96.1Very high94Very high32 Ų3256.9 Ų56.913%0.12536%0.355CS..Hα-helixtrans-94.7-18.4-177.2-50.9-64.1000113.5I29 E30 S34 A35 F36 V59 H64I29-Y32 HydrophobicContact CG2-CD2 4.43Å; I29-Y32 WeakPolarHBondContact O-CD2 3.49Å; I29-Y32 PolarHBondContact O-N 2.93Å; E30-Y32 PolarHBondContact O-N 2.95Å; Y32-S34 PolarHBondContact O-N 3.04Å; Y32-A35 PolarHBondContact O-N 2.89Å; Y32-A35 VanDerWaalsContact O-N 3.11Å; Y32-F36 HydrophobicContact CG-CZ 4.38Å; Y32-F36 WeakPolarHBondContact O-CB 3.49Å; Y32-F36 VanDerWaalsContact O-CG 3.27Å; Y32-F36 WeakPolarHBondContact O-CG 3.36Å; Y32-F36 PolarHBondContact O-N 3.37Å; Y32-V59 HydrophobicContact CD1-CG2 3.76Å; Y32-V59 HydrophobicContact CD2-CG2 4.05Å; Y32-V59 HydrophobicContact CE1-CB 4.39Å; Y32-V59 HydrophobicContact CE1-CG2 4Å; Y32-V59 HydrophobicContact CE2-CG1 4.13Å; Y32-V59 HydrophobicContact CE2-CG2 4.3Å; Y32-V59 HydrophobicContact CG-CG2 3.78Å; Y32-H64 HydrophobicContact CE2-CB 4.15Å; Y32-H64 AromaticContact CE2-ND1 3.28Å; Y32-H64 VanDerWaalsContact CE2-ND1 3.28Å; Y32-H64 WeakPolarHBondContact CE2-ND1 3.48Å; Y32-H64 AromaticContact CZ-ND1 3.45Å; Y32-H64 PolarHBondContact OH-ND1 2.91Å
33L95.3Very high93.9Very high11 Ų1156.9 Ų56.96%0.05836%0.355CS..Hα-helixtrans-59.9-43-170.9-61.9-175.8000112.5I19 L22 I29 E30 A35 F36 S37I19-L33 HydrophobicContact CG2-CB 4.36Å; L22-L33 HydrophobicContact CB-CD2 3.54Å; I29-L33 HydrophobicContact CG2-CD2 4.16Å; E30-L33 PolarHBondContact O-N 3.19Å; E30-L33 WeakPolarHBondContact OE2-CD1 3.35Å; L33-A35 PolarHBondContact O-N 2.73Å; L33-F36 PolarHBondContact O-N 2.73Å; L33-S37 WeakPolarHBondContact O-CB 3.43Å; L33-S37 PolarHBondContact O-N 3.49Å
34S94.1Very high93.9Very high100 Ų10061.1 Ų61.170%0.69937%0.366SS*.Hα-helixtrans-61.1-43.2177-61.50000112.2Y32 S37 A38Y32-S34 PolarHBondContact O-N 3.04Å; S34-S37 PolarHBondContact O-N 3.13Å; S34-A38 WeakPolarHBondContact O-CB 3.49Å; S34-A38 PolarHBondContact O-N 3.46Å
35A94.3Very high94.1Very high42 Ų4258.8 Ų58.835%0.34734%0.337SS..Hα-helixtrans-68.2-39.8178.900000111.8Y32 L33 A38 K39Y32-A35 PolarHBondContact O-N 2.89Å; Y32-A35 VanDerWaalsContact O-N 3.11Å; L33-A35 PolarHBondContact O-N 2.73Å; A35-A38 PolarHBondContact O-N 3.19Å; A35-K39 WeakPolarHBondContact O-CG 3.43Å; A35-K39 PolarHBondContact O-N 3.02Å; A35-K39 VanDerWaalsContact O-N 3.13Å
36F96.1Very high94.2Very high0 Ų057.4 Ų57.40%033%0.33CS..Hα-helixtrans-63.2-44.3174.3-70.9-13.2000112.3I19 L22 Y32 L33 A38 K39 N40 I41 W45 Y57 V59 I68I19-F36 HydrophobicContact CD1-CB 3.6Å; L22-F36 HydrophobicContact CD1-CD2 3.61Å; L22-F36 HydrophobicContact CD1-CE2 3.98Å; Y32-F36 HydrophobicContact CG-CZ 4.38Å; Y32-F36 WeakPolarHBondContact O-CB 3.49Å; Y32-F36 VanDerWaalsContact O-CG 3.27Å; Y32-F36 WeakPolarHBondContact O-CG 3.36Å; Y32-F36 PolarHBondContact O-N 3.37Å; L33-F36 PolarHBondContact O-N 2.73Å; F36-A38 PolarHBondContact O-N 3.42Å; F36-K39 PolarHBondContact O-N 3.33Å; F36-N40 PolarHBondContact O-N 3.35Å; F36-I41 HydrophobicContact CB-CD1 3.57Å; F36-I41 HydrophobicContact CB-CG1 4.04Å; F36-I41 HydrophobicContact CD2-CD1 4.16Å; F36-I41 HydrophobicContact CG-CD1 3.92Å; F36-I41 PolarHBondContact O-N 2.81Å; F36-W45 HydrophobicContact CD1-CH2 4.43Å; F36-W45 HydrophobicContact CE1-CH2 4.14Å; F36-W45 HydrophobicContact CE1-CZ2 4.34Å; F36-W45 HydrophobicContact CE2-CH2 4.33Å; F36-W45 HydrophobicContact CZ-CH2 4.06Å; F36-Y57 HydrophobicContact CD1-CD1 4.2Å; F36-Y57 HydrophobicContact CE1-CD1 4.39Å; F36-V59 HydrophobicContact CE1-CG2 4.01Å; F36-V59 HydrophobicContact CZ-CG2 3.59Å; F36-I68 HydrophobicContact CE2-CD1 4.4Å; F36-I68 HydrophobicContact CZ-CD1 4.33Å
37S94.9Very high94.2Very high56 Ų5656.3 Ų56.339%0.39233%0.328SS..Hα-helixtrans-61.8-45.2177.2-170.50000111L33 S34 K39 N40L33-S37 WeakPolarHBondContact O-CB 3.43Å; L33-S37 PolarHBondContact O-N 3.49Å; S34-S37 PolarHBondContact O-N 3.13Å; S37-K39 PolarHBondContact O-N 3.23Å; S37-N40 PolarHBondContact O-N 3.39Å
38A94.4Very high94.3Very high79 Ų7952.5 Ų52.565%0.65331%0.313SS*.Hα-helixtrans-62-30.3177.400000113.1S34 A35 F36 N40S34-A38 WeakPolarHBondContact O-CB 3.49Å; S34-A38 PolarHBondContact O-N 3.46Å; A35-A38 PolarHBondContact O-N 3.19Å; F36-A38 PolarHBondContact O-N 3.42Å; A38-N40 VanDerWaalsContact C-N 3.29Å; A38-N40 PolarHBondContact O-N 3.48Å
39K94.2Very high94.3Very high99 Ų9952.1 Ų52.143%0.4331%0.307SS..THydrogen-bonded Turntrans-84.54.3176.3-69.9-178.8-179.7-178.40114A35 F36 S37 I41 K56 Y57A35-K39 WeakPolarHBondContact O-CG 3.43Å; A35-K39 PolarHBondContact O-N 3.02Å; A35-K39 VanDerWaalsContact O-N 3.13Å; F36-K39 PolarHBondContact O-N 3.33Å; S37-K39 PolarHBondContact O-N 3.23Å; K39-I41 VanDerWaalsContact C-N 3.29Å; K39-I41 HydrophobicContact CB-CG2 4.42Å; K39-I41 PolarHBondContact O-N 3.35Å; K39-K56 PolarHBondContact NZ-O 2.94Å; K39-Y57 HydrophobicContact CB-CD1 4.48Å; K39-Y57 HydrophobicContact CB-CE1 3.92Å; K39-Y57 HydrophobicContact CD-CD1 3.47Å; K39-Y57 VanDerWaalsContact CD-CD1 3.47Å; K39-Y57 HydrophobicContact CD-CE1 3.5Å; K39-Y57 VanDerWaalsContact CD-CE1 3.5Å; K39-Y57 HydrophobicContact CD-CG 4.25Å; K39-Y57 HydrophobicContact CG-CE1 4.34Å
40N93.2Very high94.3Very high119 Ų11955.1 Ų55.164%0.63633%0.325SS*.THydrogen-bonded Turntrans51.444.4179-65.3-66.7000113.5F36 S37 A38F36-N40 PolarHBondContact O-N 3.35Å; S37-N40 PolarHBondContact O-N 3.39Å; A38-N40 VanDerWaalsContact C-N 3.29Å; A38-N40 PolarHBondContact O-N 3.48Å
41I94.6Very high94.3Very high3 Ų351.7 Ų51.72%0.01532%0.316CS..  trans-62141.8176.163.6164.4000110.3T15 V18 I19 L22 F36 K39 W45 Y57T15-I41 WeakPolarHBondContact CA-O 3.47Å; T15-I41 WeakPolarHBondContact CB-O 3.43Å; T15-I41 WeakPolarHBondContact CG2-O 3.27Å; T15-I41 PolarHBondContact OG1-O 3.11Å; V18-I41 HydrophobicContact CG1-CD1 3.49Å; V18-I41 VanDerWaalsContact CG1-CD1 3.49Å; V18-I41 HydrophobicContact CG1-CG1 3.96Å; I19-I41 HydrophobicContact CD1-CD1 4.11Å; I19-I41 HydrophobicContact CD1-CG1 4.25Å; L22-I41 HydrophobicContact CD1-CD1 3.68Å; F36-I41 HydrophobicContact CB-CD1 3.57Å; F36-I41 HydrophobicContact CB-CG1 4.04Å; F36-I41 HydrophobicContact CD2-CD1 4.16Å; F36-I41 HydrophobicContact CG-CD1 3.92Å; F36-I41 PolarHBondContact O-N 2.81Å; K39-I41 VanDerWaalsContact C-N 3.29Å; K39-I41 HydrophobicContact CB-CG2 4.42Å; K39-I41 PolarHBondContact O-N 3.35Å; I41-W45 HydrophobicContact CB-CB 4.14Å; I41-W45 HydrophobicContact CB-CD2 3.81Å; I41-W45 HydrophobicContact CB-CE3 3.85Å; I41-W45 HydrophobicContact CB-CG 3.96Å; I41-W45 HydrophobicContact CB-CZ3 4.47Å; I41-W45 HydrophobicContact CD1-CD2 4.32Å; I41-W45 HydrophobicContact CD1-CE3 3.6Å; I41-W45 HydrophobicContact CD1-CH2 4.03Å; I41-W45 HydrophobicContact CD1-CZ3 3.43Å; I41-W45 VanDerWaalsContact CD1-CZ3 3.43Å; I41-W45 HydrophobicContact CG1-CE3 4.31Å; I41-W45 HydrophobicContact CG2-CD2 3.68Å; I41-W45 HydrophobicContact CG2-CE3 4.09Å; I41-W45 HydrophobicContact CG2-CG 3.89Å; I41-W45 HydrophobicContact CG2-CZ2 4.26Å; I41-Y57 HydrophobicContact CG2-CD1 4.21Å; I41-Y57 HydrophobicContact CG2-CE1 3.62Å
42S93.7Very high94.3Very high41 Ų4152.5 Ų52.529%0.28732%0.315SS..  trans-129.4177.6-179.661.70000110.9K44 W45 L46S42-K44 PolarHBondContact O-N 3.2Å; S42-K44 VanDerWaalsContact O-N 3.1Å; S42-W45 WeakPolarHBondContact O-CA 3.2Å; S42-W45 VanDerWaalsContact O-CB 3.25Å; S42-W45 WeakPolarHBondContact O-CB 3.43Å; S42-W45 PolarHBondContact O-N 3.1Å; S42-L46 PolarHBondContact O-N 3.11Å
43G93.4Very high94.3Very high0 Ų052.5 Ų52.50%032%0.318CS..Hα-helixtrans-48.1-36.7173.500000114.7Y10 W13 W45 L46 S47Y10-G43 WeakPolarHBondContact O-CA 3.16Å; W13-G43 PolarHBondContact O-N 3.23Å; G43-W45 VanDerWaalsContact C-N 3.33Å; G43-W45 PolarHBondContact O-N 3.11Å; G43-L46 WeakPolarHBondContact O-CB 3.29Å; G43-L46 PolarHBondContact O-N 3.01Å; G43-S47 PolarHBondContact O-N 3.08Å
44K93.8Very high94.4Very high146 Ų14652 Ų5264%0.63532%0.315SS*.Hα-helixtrans-65.2-35.8175.6-64.5-177.8-178.2177.30112.4S42 L46 S47 S48S42-K44 PolarHBondContact O-N 3.2Å; S42-K44 VanDerWaalsContact O-N 3.1Å; K44-L46 VanDerWaalsContact C-N 3.34Å; K44-L46 PolarHBondContact O-N 2.97Å; K44-S47 WeakPolarHBondContact O-CB 2.95Å; K44-S47 PolarHBondContact O-N 3.14Å; K44-S47 VanDerWaalsContact O-N 3.14Å; K44-S47 PolarHBondContact O-OG 3.46Å; K44-S48 PolarHBondContact O-N 2.8Å; K44-S48 PolarHBondContact O-OG 3.23Å
45W94.9Very high94.4Very high17 Ų1750.7 Ų50.76%0.06430%0.301CS..Hα-helixtrans-62.2-43.7176.1176.982.8000111L22 F36 I41 S42 G43 S47 S48 L49 L54 Y57L22-W45 HydrophobicContact CD1-CZ3 4.42Å; F36-W45 HydrophobicContact CD1-CH2 4.43Å; F36-W45 HydrophobicContact CE1-CH2 4.14Å; F36-W45 HydrophobicContact CE1-CZ2 4.34Å; F36-W45 HydrophobicContact CE2-CH2 4.33Å; F36-W45 HydrophobicContact CZ-CH2 4.06Å; I41-W45 HydrophobicContact CB-CB 4.14Å; I41-W45 HydrophobicContact CB-CD2 3.81Å; I41-W45 HydrophobicContact CB-CE3 3.85Å; I41-W45 HydrophobicContact CB-CG 3.96Å; I41-W45 HydrophobicContact CB-CZ3 4.47Å; I41-W45 HydrophobicContact CD1-CD2 4.32Å; I41-W45 HydrophobicContact CD1-CE3 3.6Å; I41-W45 HydrophobicContact CD1-CH2 4.03Å; I41-W45 HydrophobicContact CD1-CZ3 3.43Å; I41-W45 VanDerWaalsContact CD1-CZ3 3.43Å; I41-W45 HydrophobicContact CG1-CE3 4.31Å; I41-W45 HydrophobicContact CG2-CD2 3.68Å; I41-W45 HydrophobicContact CG2-CE3 4.09Å; I41-W45 HydrophobicContact CG2-CG 3.89Å; I41-W45 HydrophobicContact CG2-CZ2 4.26Å; S42-W45 WeakPolarHBondContact O-CA 3.2Å; S42-W45 VanDerWaalsContact O-CB 3.25Å; S42-W45 WeakPolarHBondContact O-CB 3.43Å; S42-W45 PolarHBondContact O-N 3.1Å; G43-W45 VanDerWaalsContact C-N 3.33Å; G43-W45 PolarHBondContact O-N 3.11Å; W45-S47 PolarHBondContact O-N 3.44Å; W45-S48 PolarHBondContact O-N 2.62Å; W45-S48 PolarHBondContact O-OG 2.65Å; W45-L49 HydrophobicContact CD2-CD2 4.1Å; W45-L49 HydrophobicContact CD2-CG 4.23Å; W45-L49 HydrophobicContact CE3-CD1 4.01Å; W45-L49 HydrophobicContact CE3-CD2 4.29Å; W45-L49 HydrophobicContact CE3-CG 4.15Å; W45-L49 HydrophobicContact CH2-CD1 3.95Å; W45-L49 HydrophobicContact CH2-CD2 3.66Å; W45-L49 HydrophobicContact CH2-CG 4.22Å; W45-L49 HydrophobicContact CZ2-CD1 4.49Å; W45-L49 HydrophobicContact CZ2-CD2 3.4Å; W45-L49 HydrophobicContact CZ2-CG 4.28Å; W45-L49 HydrophobicContact CZ3-CD1 3.66Å; W45-L49 HydrophobicContact CZ3-CD2 4.09Å; W45-L49 HydrophobicContact CZ3-CG 4.15Å; W45-L49 PolarHBondContact O-N 3.41Å; W45-L54 HydrophobicContact CH2-CD2 4.06Å; W45-L54 HydrophobicContact CZ2-CD2 4.2Å; W45-Y57 AromaticContact CD1-CZ 3.81Å; W45-Y57 AromaticContact CE2-CE1 3.99Å; W45-Y57 AromaticContact CZ2-CD1 3.89Å; W45-Y57 HydrophobicContact CZ2-CD1 3.89Å; W45-Y57 HydrophobicContact CZ2-CE1 4.26Å; W45-Y57 HydrophobicContact CZ2-CG 4.11Å; W45-Y57 AromaticContact NE1-CD1 3.91Å; W45-Y57 AromaticContact NE1-CE1 3.46Å; W45-Y57 AromaticContact NE1-CE2 3.58Å; W45-Y57 AromaticContact NE1-CZ 3.27Å; W45-Y57 VanDerWaalsContact NE1-CZ 3.27Å
46L94.9Very high94.3Very high0 Ų056.4 Ų56.40%032%0.318CS..Hα-helixtrans-57.2-33.5175.1-62.9176.8000112.3Y10 W13 V18 W21 S42 G43 K44 S48 L49 V72 L75 Q76Y10-L46 HydrophobicContact CD2-CB 4.25Å; Y10-L46 HydrophobicContact CD2-CD1 4.4Å; Y10-L46 HydrophobicContact CE2-CB 4.2Å; W13-L46 HydrophobicContact CE3-CD1 4.1Å; W13-L46 HydrophobicContact CZ3-CD1 4.29Å; V18-L46 HydrophobicContact CG1-CD1 4.06Å; V18-L46 HydrophobicContact CG1-CD2 4.03Å; V18-L46 HydrophobicContact CG1-CG 4.08Å; V18-L46 HydrophobicContact CG2-CD1 4.01Å; V18-L46 HydrophobicContact CG2-CG 4.44Å; W21-L46 HydrophobicContact CE3-CD1 4.24Å; W21-L46 HydrophobicContact CE3-CD2 4.43Å; W21-L46 HydrophobicContact CZ3-CD1 4.31Å; W21-L46 HydrophobicContact CZ3-CD2 3.97Å; S42-L46 PolarHBondContact O-N 3.11Å; G43-L46 WeakPolarHBondContact O-CB 3.29Å; G43-L46 PolarHBondContact O-N 3.01Å; K44-L46 VanDerWaalsContact C-N 3.34Å; K44-L46 PolarHBondContact O-N 2.97Å; L46-S48 VanDerWaalsContact C-N 3.32Å; L46-L49 HydrophobicContact CD2-CD1 3.89Å; L46-V72 HydrophobicContact CD2-CG2 4.09Å; L46-V72 VanDerWaalsContact O-CG1 3.26Å; L46-V72 WeakPolarHBondContact O-CG1 3.45Å; L46-L75 HydrophobicContact CD1-CD2 4.01Å; L46-Q76 PolarHBondContact O-NE2 3.06Å
47S91.7Very high94.2Very high56 Ų5659.4 Ų59.439%0.39233%0.33SS..Hα-helixtrans-71.6-25177.776.60000114.2G43 K44 W45G43-S47 PolarHBondContact O-N 3.08Å; K44-S47 WeakPolarHBondContact O-CB 2.95Å; K44-S47 PolarHBondContact O-N 3.14Å; K44-S47 VanDerWaalsContact O-N 3.14Å; K44-S47 PolarHBondContact O-OG 3.46Å; W45-S47 PolarHBondContact O-N 3.44Å
48S92.6Very high94.1Very high67 Ų6758.9 Ų58.947%0.46933%0.332SS..THydrogen-bonded Turntrans-100.37.9-178.358.80000113.9K44 W45 L46 T50K44-S48 PolarHBondContact O-N 2.8Å; K44-S48 PolarHBondContact O-OG 3.23Å; W45-S48 PolarHBondContact O-N 2.62Å; W45-S48 PolarHBondContact O-OG 2.65Å; L46-S48 VanDerWaalsContact C-N 3.32Å; S48-T50 PolarHBondContact O-N 3.4Å
49L94.4Very high94.2Very high20 Ų2055.1 Ų55.111%0.10530%0.301CS..  trans-68.9129-173.2-89.9179.6000112.4W45 L46 V53 L54 I68 L69 V72W45-L49 HydrophobicContact CD2-CD2 4.1Å; W45-L49 HydrophobicContact CD2-CG 4.23Å; W45-L49 HydrophobicContact CE3-CD1 4.01Å; W45-L49 HydrophobicContact CE3-CD2 4.29Å; W45-L49 HydrophobicContact CE3-CG 4.15Å; W45-L49 HydrophobicContact CH2-CD1 3.95Å; W45-L49 HydrophobicContact CH2-CD2 3.66Å; W45-L49 HydrophobicContact CH2-CG 4.22Å; W45-L49 HydrophobicContact CZ2-CD1 4.49Å; W45-L49 HydrophobicContact CZ2-CD2 3.4Å; W45-L49 HydrophobicContact CZ2-CG 4.28Å; W45-L49 HydrophobicContact CZ3-CD1 3.66Å; W45-L49 HydrophobicContact CZ3-CD2 4.09Å; W45-L49 HydrophobicContact CZ3-CG 4.15Å; W45-L49 PolarHBondContact O-N 3.41Å; L46-L49 HydrophobicContact CD2-CD1 3.89Å; L49-V53 HydrophobicContact CD2-CB 4.4Å; L49-V53 HydrophobicContact CD2-CG1 3.95Å; L49-L54 HydrophobicContact CD2-CD2 3.59Å; L49-L54 HydrophobicContact CD2-CG 3.83Å; L49-I68 HydrophobicContact CD1-CG2 3.99Å; L49-L69 HydrophobicContact CB-CD2 4.13Å; L49-V72 HydrophobicContact CD1-CG2 3.73Å
50T94.6Very high94.2Very high62 Ų6256.9 Ų56.938%0.3831%0.311SS..  trans-134.1168.3167.869.90000108.9S48 D52 V53 L54S48-T50 PolarHBondContact O-N 3.4Å; T50-D52 PolarHBondContact O-N 2.79Å; T50-D52 PolarHBondContact OG1-N 3.23Å; T50-V53 PolarHBondContact O-N 3.26Å; T50-V53 VanDerWaalsContact O-N 3.16Å; T50-V53 WeakPolarHBondContact OG1-CG2 3.12Å; T50-V53 PolarHBondContact OG1-N 3.44Å; T50-L54 PolarHBondContact O-N 3.29Å
51A94.4Very high94.3Very high37 Ų3757.5 Ų57.531%0.30631%0.308SS..Hα-helixtrans-55.1-42.1172.700000111.5V53 L54 D55 Q65 L69A51-V53 VanDerWaalsContact C-N 3.35Å; A51-V53 PolarHBondContact O-N 3.49Å; A51-L54 PolarHBondContact O-N 2.94Å; A51-D55 PolarHBondContact O-N 3.47Å; A51-Q65 PolarHBondContact O-NE2 3.44Å; A51-L69 HydrophobicContact CB-CD1 4.3Å
52D95.2Very high94.3Very high115 Ų11563.2 Ų63.262%0.61534%0.338SS*.Hα-helixtrans-64.6-36.9178-54.6-45.9000112.9T50 K56T50-D52 PolarHBondContact O-N 2.79Å; T50-D52 PolarHBondContact OG1-N 3.23Å; D52-K56 VanDerWaalsContact O-CG 3.28Å; D52-K56 WeakPolarHBondContact O-CG 3.36Å; D52-K56 PolarHBondContact O-N 3.49Å; D52-K56 VanDerWaalsContact O-N 3.15Å
53V95.1Very high94.3Very high33 Ų3363.2 Ų63.220%0.234%0.344CS..Hα-helixtrans-67.5-43.1175.1175.20000109.7L49 T50 A51 D55 K56 Y57L49-V53 HydrophobicContact CD2-CB 4.4Å; L49-V53 HydrophobicContact CD2-CG1 3.95Å; T50-V53 PolarHBondContact O-N 3.26Å; T50-V53 VanDerWaalsContact O-N 3.16Å; T50-V53 WeakPolarHBondContact OG1-CG2 3.12Å; T50-V53 PolarHBondContact OG1-N 3.44Å; A51-V53 VanDerWaalsContact C-N 3.35Å; A51-V53 PolarHBondContact O-N 3.49Å; V53-D55 VanDerWaalsContact C-N 3.34Å; V53-D55 PolarHBondContact O-N 3.23Å; V53-K56 PolarHBondContact O-N 2.96Å; V53-Y57 HydrophobicContact CG1-CD2 4.03Å; V53-Y57 HydrophobicContact CG1-CE2 4.03Å; V53-Y57 WeakPolarHBondContact O-CD2 3.05Å; V53-Y57 PolarHBondContact O-N 2.79Å
54L96.7Very high94.5Very high0 Ų064.9 Ų64.90%035%0.351CS..Hα-helixtrans-62.5-41.1177.4-74.8177000112.3W45 L49 T50 A51 Y57 G58 V59 Q65 I68 L69W45-L54 HydrophobicContact CH2-CD2 4.06Å; W45-L54 HydrophobicContact CZ2-CD2 4.2Å; L49-L54 HydrophobicContact CD2-CD2 3.59Å; L49-L54 HydrophobicContact CD2-CG 3.83Å; T50-L54 PolarHBondContact O-N 3.29Å; A51-L54 PolarHBondContact O-N 2.94Å; L54-Y57 CarbonylContact O-C 3.42Å; L54-Y57 WeakPolarHBondContact O-CA 3.11Å; L54-Y57 PolarHBondContact O-N 2.94Å; L54-G58 PolarHBondContact O-N 3.14Å; L54-G58 VanDerWaalsContact O-N 3.13Å; L54-V59 HydrophobicContact CB-CB 4.13Å; L54-V59 HydrophobicContact CD2-CG2 4.36Å; L54-V59 PolarHBondContact O-N 3.03Å; L54-Q65 HydrophobicContact CB-CG 4.02Å; L54-Q65 HydrophobicContact CD1-CB 3.95Å; L54-Q65 HydrophobicContact CD1-CG 4.08Å; L54-I68 HydrophobicContact CD1-CB 4.18Å; L54-I68 HydrophobicContact CD1-CG2 4.22Å; L54-I68 HydrophobicContact CD2-CD1 4.05Å; L54-I68 HydrophobicContact CD2-CG2 4.18Å; L54-L69 HydrophobicContact CD1-CD1 4.23Å; L54-L69 HydrophobicContact CD1-CD2 4.01Å; L54-L69 HydrophobicContact CD1-CG 3.76Å
55D94.5Very high94.6Very high73 Ų7358.9 Ų58.939%0.3933%0.326SS..Hα-helixtrans-58.2-49.7175-169.495.8000111.4A51 V53 Y57 G58A51-D55 PolarHBondContact O-N 3.47Å; V53-D55 VanDerWaalsContact C-N 3.34Å; V53-D55 PolarHBondContact O-N 3.23Å; D55-Y57 PolarHBondContact O-N 3.34Å; D55-Y57 VanDerWaalsContact O-N 3.1Å; D55-G58 PolarHBondContact O-N 3.3Å
56K92.8Very high94.6Very high161 Ų16163.7 Ų63.770%0.735%0.351SS*.Hα-helixtrans-60.8-22.1174-68.8172.8-170.7179.10113.3K39 D52 V53K39-K56 PolarHBondContact NZ-O 2.94Å; D52-K56 VanDerWaalsContact O-CG 3.28Å; D52-K56 WeakPolarHBondContact O-CG 3.36Å; D52-K56 PolarHBondContact O-N 3.49Å; D52-K56 VanDerWaalsContact O-N 3.15Å; V53-K56 PolarHBondContact O-N 2.96Å
57Y94Very high94.5Very high64 Ų6465.8 Ų65.825%0.25136%0.361SS..THydrogen-bonded Turntrans-91.4-0.3176-83.8-113.4000113.7F36 K39 I41 W45 V53 L54 D55F36-Y57 HydrophobicContact CD1-CD1 4.2Å; F36-Y57 HydrophobicContact CE1-CD1 4.39Å; K39-Y57 HydrophobicContact CB-CD1 4.48Å; K39-Y57 HydrophobicContact CB-CE1 3.92Å; K39-Y57 HydrophobicContact CD-CD1 3.47Å; K39-Y57 VanDerWaalsContact CD-CD1 3.47Å; K39-Y57 HydrophobicContact CD-CE1 3.5Å; K39-Y57 VanDerWaalsContact CD-CE1 3.5Å; K39-Y57 HydrophobicContact CD-CG 4.25Å; K39-Y57 HydrophobicContact CG-CE1 4.34Å; I41-Y57 HydrophobicContact CG2-CD1 4.21Å; I41-Y57 HydrophobicContact CG2-CE1 3.62Å; W45-Y57 AromaticContact CD1-CZ 3.81Å; W45-Y57 AromaticContact CE2-CE1 3.99Å; W45-Y57 AromaticContact CZ2-CD1 3.89Å; W45-Y57 HydrophobicContact CZ2-CD1 3.89Å; W45-Y57 HydrophobicContact CZ2-CE1 4.26Å; W45-Y57 HydrophobicContact CZ2-CG 4.11Å; W45-Y57 AromaticContact NE1-CD1 3.91Å; W45-Y57 AromaticContact NE1-CE1 3.46Å; W45-Y57 AromaticContact NE1-CE2 3.58Å; W45-Y57 AromaticContact NE1-CZ 3.27Å; W45-Y57 VanDerWaalsContact NE1-CZ 3.27Å; V53-Y57 HydrophobicContact CG1-CD2 4.03Å; V53-Y57 HydrophobicContact CG1-CE2 4.03Å; V53-Y57 WeakPolarHBondContact O-CD2 3.05Å; V53-Y57 PolarHBondContact O-N 2.79Å; L54-Y57 CarbonylContact O-C 3.42Å; L54-Y57 WeakPolarHBondContact O-CA 3.11Å; L54-Y57 PolarHBondContact O-N 2.94Å; D55-Y57 PolarHBondContact O-N 3.34Å; D55-Y57 VanDerWaalsContact O-N 3.1Å
58G93.8Very high94.7Very high44 Ų4463.1 Ų63.145%0.45434%0.342SS..THydrogen-bonded Turntrans99.11.5175.600000114.3L54 D55 Q60L54-G58 PolarHBondContact O-N 3.14Å; L54-G58 VanDerWaalsContact O-N 3.13Å; D55-G58 PolarHBondContact O-N 3.3Å; G58-Q60 PolarHBondContact O-N 2.97Å
59V96.1Very high94.9Very high0 Ų062.4 Ų62.40%033%0.333CS..  trans-91.484.2175.8-170.70000108.5Y32 F36 L54 H64 Q65 I68Y32-V59 HydrophobicContact CD1-CG2 3.76Å; Y32-V59 HydrophobicContact CD2-CG2 4.05Å; Y32-V59 HydrophobicContact CE1-CB 4.39Å; Y32-V59 HydrophobicContact CE1-CG2 4Å; Y32-V59 HydrophobicContact CE2-CG1 4.13Å; Y32-V59 HydrophobicContact CE2-CG2 4.3Å; Y32-V59 HydrophobicContact CG-CG2 3.78Å; F36-V59 HydrophobicContact CE1-CG2 4.01Å; F36-V59 HydrophobicContact CZ-CG2 3.59Å; L54-V59 HydrophobicContact CB-CB 4.13Å; L54-V59 HydrophobicContact CD2-CG2 4.36Å; L54-V59 PolarHBondContact O-N 3.03Å; V59-H64 HydrophobicContact CG1-CB 3.77Å; V59-Q65 HydrophobicContact CB-CG 4.43Å; V59-Q65 HydrophobicContact CG1-CG 3.86Å; V59-Q65 VanDerWaalsContact O-CG 3.31Å; V59-Q65 WeakPolarHBondContact O-CG 3.19Å; V59-Q65 PolarHBondContact O-NE2 2.9Å; V59-I68 HydrophobicContact CG1-CD1 4.34Å; V59-I68 HydrophobicContact CG2-CD1 4.32Å
60Q94.1Very high94.9Very high137 Ų13766.8 Ų66.864%0.6435%0.353SS*.  trans-89.6-19.7-178.7-63.1-178.3-24.900113.2G58 I62G58-Q60 PolarHBondContact O-N 2.97Å; Q60-I62 PolarHBondContact O-N 3.01Å
61K95.8Very high94.8Very high131 Ų13167.2 Ų67.257%0.5735%0.35SS*.  trans-71.5115.5179.4-72.6-176175.7-176.50109.7G63 H64 Q65K61-G63 VanDerWaalsContact C-N 3.26Å; K61-G63 PolarHBondContact O-N 3.24Å; K61-H64 HydrophobicContact CB-CB 4.14Å; K61-H64 PolarHBondContact O-N 3.17Å; K61-Q65 PolarHBondContact O-N 3.41Å
62I94.2Very high94.9Very high124 Ų12465.7 Ų65.764%0.63634%0.337SS*.Hα-helixtrans-52.1-45179.9-61.9172.6000111.3Q60 H64 Q65 M66Q60-I62 PolarHBondContact O-N 3.01Å; I62-H64 VanDerWaalsContact C-N 3.3Å; I62-H64 PolarHBondContact O-N 3.36Å; I62-Q65 WeakPolarHBondContact O-CB 3.42Å; I62-Q65 PolarHBondContact O-N 3.12Å; I62-M66 HydrophobicContact CG2-CG 4.34Å; I62-M66 HydrophobicContact CG2-SD 4.11Å; I62-M66 WeakPolarHBondContact O-CG 3.36Å; I62-M66 PolarHBondContact O-N 3.34Å
63G93.7Very high94.7Very high40 Ų4067.5 Ų67.541%0.41234%0.339SS..Hα-helixtrans-58.7-38.9178.300000113.5K61 M66 I67K61-G63 VanDerWaalsContact C-N 3.26Å; K61-G63 PolarHBondContact O-N 3.24Å; G63-M66 PolarHBondContact O-N 3.31Å; G63-I67 WeakPolarHBondContact O-CG1 3.48Å; G63-I67 PolarHBondContact O-N 2.88Å; G63-I67 VanDerWaalsContact O-N 3.17Å
64H96.3Very high94.3Very high35 Ų3570.2 Ų70.216%0.16235%0.349CS..Hα-helixtrans-73.5-37.8178.6-61.5-167.3000111.1I29 Y32 V59 K61 I62 M66 I67 I68I29-H64 HydrophobicContact CD1-CB 4.37Å; Y32-H64 HydrophobicContact CE2-CB 4.15Å; Y32-H64 AromaticContact CE2-ND1 3.28Å; Y32-H64 VanDerWaalsContact CE2-ND1 3.28Å; Y32-H64 WeakPolarHBondContact CE2-ND1 3.48Å; Y32-H64 AromaticContact CZ-ND1 3.45Å; Y32-H64 PolarHBondContact OH-ND1 2.91Å; V59-H64 HydrophobicContact CG1-CB 3.77Å; K61-H64 HydrophobicContact CB-CB 4.14Å; K61-H64 PolarHBondContact O-N 3.17Å; I62-H64 VanDerWaalsContact C-N 3.3Å; I62-H64 PolarHBondContact O-N 3.36Å; H64-M66 VanDerWaalsContact C-N 3.31Å; H64-M66 PolarHBondContact O-N 2.87Å; H64-I67 PolarHBondContact O-N 3.05Å; H64-I68 WeakPolarHBondContact O-CG1 3.33Å; H64-I68 PolarHBondContact O-N 3.38Å; H64-I68 VanDerWaalsContact O-N 3.14Å
65Q96.7Very high94.1Very high20 Ų2070.6 Ų70.69%0.09335%0.351CS..Hα-helixtrans-60.5-43172.9-65-178.8-11.900111.3A51 L54 V59 K61 I62 I67 I68 L69A51-Q65 PolarHBondContact O-NE2 3.44Å; L54-Q65 HydrophobicContact CB-CG 4.02Å; L54-Q65 HydrophobicContact CD1-CB 3.95Å; L54-Q65 HydrophobicContact CD1-CG 4.08Å; V59-Q65 HydrophobicContact CB-CG 4.43Å; V59-Q65 HydrophobicContact CG1-CG 3.86Å; V59-Q65 VanDerWaalsContact O-CG 3.31Å; V59-Q65 WeakPolarHBondContact O-CG 3.19Å; V59-Q65 PolarHBondContact O-NE2 2.9Å; K61-Q65 PolarHBondContact O-N 3.41Å; I62-Q65 WeakPolarHBondContact O-CB 3.42Å; I62-Q65 PolarHBondContact O-N 3.12Å; Q65-I67 PolarHBondContact O-N 3.01Å; Q65-I68 PolarHBondContact O-N 3.41Å; Q65-L69 VanDerWaalsContact O-CB 3.32Å; Q65-L69 WeakPolarHBondContact O-CB 3.22Å; Q65-L69 VanDerWaalsContact O-CG 3.24Å; Q65-L69 WeakPolarHBondContact O-CG 2.99Å; Q65-L69 PolarHBondContact O-N 3.32Å
66M94.5Very high93.9Very high119 Ų11970.2 Ų70.259%0.58635%0.347SS*.Hα-helixtrans-59.7-46.8177.7-72.9177.766.900111.7I62 G63 H64 I68 L69 E70I62-M66 HydrophobicContact CG2-CG 4.34Å; I62-M66 HydrophobicContact CG2-SD 4.11Å; I62-M66 WeakPolarHBondContact O-CG 3.36Å; I62-M66 PolarHBondContact O-N 3.34Å; G63-M66 PolarHBondContact O-N 3.31Å; H64-M66 VanDerWaalsContact C-N 3.31Å; H64-M66 PolarHBondContact O-N 2.87Å; M66-I68 PolarHBondContact O-N 3.39Å; M66-L69 PolarHBondContact O-N 3.43Å; M66-E70 WeakPolarHBondContact O-CB 3.32Å; M66-E70 PolarHBondContact O-N 2.85Å
67I93.6Very high93.4Very high43 Ų4367.3 Ų67.322%0.22133%0.333CS..Hα-helixtrans-55.9-52.3177-67.5163.6000110.3D26 I29 G63 H64 Q65 K71D26-I67 HydrophobicContact CB-CG2 4.12Å; I29-I67 HydrophobicContact CD1-CB 4.41Å; I29-I67 HydrophobicContact CD1-CG2 4.16Å; I29-I67 HydrophobicContact CG1-CG2 4.28Å; G63-I67 WeakPolarHBondContact O-CG1 3.48Å; G63-I67 PolarHBondContact O-N 2.88Å; G63-I67 VanDerWaalsContact O-N 3.17Å; H64-I67 PolarHBondContact O-N 3.05Å; Q65-I67 PolarHBondContact O-N 3.01Å; I67-K71 WeakPolarHBondContact O-CB 3.3Å; I67-K71 WeakPolarHBondContact O-CG 3.4Å; I67-K71 PolarHBondContact O-N 3.47Å; I67-K71 VanDerWaalsContact O-N 3.07Å
68I96.1Very high92.8Very high0 Ų069.5 Ų69.50%035%0.345CS..Hα-helixtrans-62.8-50.7-178.5-62.9170.1000110.7L22 I29 F36 L49 L54 V59 H64 Q65 M66 E70 K71 V72L22-I68 HydrophobicContact CD2-CG2 4.46Å; I29-I68 HydrophobicContact CD1-CD1 4.02Å; I29-I68 HydrophobicContact CD1-CG1 3.72Å; I29-I68 HydrophobicContact CG1-CG1 4.36Å; I29-I68 HydrophobicContact CG2-CD1 4.39Å; I29-I68 HydrophobicContact CG2-CG1 4.49Å; F36-I68 HydrophobicContact CE2-CD1 4.4Å; F36-I68 HydrophobicContact CZ-CD1 4.33Å; L49-I68 HydrophobicContact CD1-CG2 3.99Å; L54-I68 HydrophobicContact CD1-CB 4.18Å; L54-I68 HydrophobicContact CD1-CG2 4.22Å; L54-I68 HydrophobicContact CD2-CD1 4.05Å; L54-I68 HydrophobicContact CD2-CG2 4.18Å; V59-I68 HydrophobicContact CG1-CD1 4.34Å; V59-I68 HydrophobicContact CG2-CD1 4.32Å; H64-I68 WeakPolarHBondContact O-CG1 3.33Å; H64-I68 PolarHBondContact O-N 3.38Å; H64-I68 VanDerWaalsContact O-N 3.14Å; Q65-I68 PolarHBondContact O-N 3.41Å; M66-I68 PolarHBondContact O-N 3.39Å; I68-E70 VanDerWaalsContact C-N 3.35Å; I68-E70 PolarHBondContact O-N 2.88Å; I68-K71 PolarHBondContact O-N 3Å; I68-V72 HydrophobicContact CG2-CG2 4.12Å; I68-V72 WeakPolarHBondContact O-CB 3.28Å; I68-V72 WeakPolarHBondContact O-CG2 3.49Å; I68-V72 PolarHBondContact O-N 2.99Å
69L96.7Very high92.2Very high52 Ų5268.7 Ų68.727%0.27233%0.329SS..Hα-helixtrans-64.7-38.5-176-69.8171.9000112.2L49 A51 L54 Q65 M66 K73L49-L69 HydrophobicContact CB-CD2 4.13Å; A51-L69 HydrophobicContact CB-CD1 4.3Å; L54-L69 HydrophobicContact CD1-CD1 4.23Å; L54-L69 HydrophobicContact CD1-CD2 4.01Å; L54-L69 HydrophobicContact CD1-CG 3.76Å; Q65-L69 VanDerWaalsContact O-CB 3.32Å; Q65-L69 WeakPolarHBondContact O-CB 3.22Å; Q65-L69 VanDerWaalsContact O-CG 3.24Å; Q65-L69 WeakPolarHBondContact O-CG 2.99Å; Q65-L69 PolarHBondContact O-N 3.32Å; M66-L69 PolarHBondContact O-N 3.43Å; L69-K73 WeakPolarHBondContact O-CB 3.45Å; L69-K73 PolarHBondContact O-N 3.48Å
70E93.5Very high91.3Very high112 Ų11271.4 Ų71.452%0.52335%0.348SS..Hα-helixtrans-63.2-47.4175.2-175.2-179.7179.700111M66 I68 V72 K73 Q74M66-E70 WeakPolarHBondContact O-CB 3.32Å; M66-E70 PolarHBondContact O-N 2.85Å; I68-E70 VanDerWaalsContact C-N 3.35Å; I68-E70 PolarHBondContact O-N 2.88Å; E70-V72 PolarHBondContact O-N 2.9Å; E70-K73 WeakPolarHBondContact O-CB 3.43Å; E70-K73 PolarHBondContact O-N 2.99Å; E70-Q74 WeakPolarHBondContact O-CG 3.46Å; E70-Q74 PolarHBondContact O-N 2.59Å; E70-Q74 PolarHBondContact OE1-NE2 3.4Å
71K93.7Very high90.3Very high72 Ų7265.5 Ų65.531%0.31332%0.322SS..Hα-helixtrans-66.9-36.5179.7-65.4-68.2-178.5-177.40112.4W21 L25 I67 I68 Q74 L75W21-K71 HydrophobicContact CH2-CB 4.03Å; W21-K71 HydrophobicContact CZ2-CB 4.16Å; L25-K71 HydrophobicContact CD1-CB 3.85Å; L25-K71 HydrophobicContact CD1-CG 4.13Å; L25-K71 HydrophobicContact CD2-CB 3.76Å; L25-K71 HydrophobicContact CD2-CD 4.14Å; L25-K71 HydrophobicContact CD2-CG 3.81Å; L25-K71 HydrophobicContact CG-CB 4.4Å; L25-K71 HydrophobicContact CG-CG 4.38Å; I67-K71 WeakPolarHBondContact O-CB 3.3Å; I67-K71 WeakPolarHBondContact O-CG 3.4Å; I67-K71 PolarHBondContact O-N 3.47Å; I67-K71 VanDerWaalsContact O-N 3.07Å; I68-K71 PolarHBondContact O-N 3Å; K71-Q74 PolarHBondContact O-N 3.13Å; K71-L75 WeakPolarHBondContact O-CB 3.08Å; K71-L75 PolarHBondContact O-N 2.86Å
72V94.8Very high89.2Confident5 Ų562.8 Ų62.83%0.0331%0.311CS..Hα-helixtrans-64.6-43.2172.8169.80000110.8W21 L46 L49 I68 E70 Q74 L75 Q76W21-V72 HydrophobicContact CH2-CG2 3.8Å; W21-V72 HydrophobicContact CZ3-CG2 4.07Å; L46-V72 HydrophobicContact CD2-CG2 4.09Å; L46-V72 VanDerWaalsContact O-CG1 3.26Å; L46-V72 WeakPolarHBondContact O-CG1 3.45Å; L49-V72 HydrophobicContact CD1-CG2 3.73Å; I68-V72 HydrophobicContact CG2-CG2 4.12Å; I68-V72 WeakPolarHBondContact O-CB 3.28Å; I68-V72 WeakPolarHBondContact O-CG2 3.49Å; I68-V72 PolarHBondContact O-N 2.99Å; E70-V72 PolarHBondContact O-N 2.9Å; V72-Q74 VanDerWaalsContact C-N 3.3Å; V72-Q74 PolarHBondContact O-N 2.81Å; V72-L75 WeakPolarHBondContact O-CB 3.27Å; V72-L75 PolarHBondContact O-N 3.29Å; V72-Q76 HydrophobicContact CG1-CG 4.33Å; V72-Q76 WeakPolarHBondContact O-CB 3.38Å; V72-Q76 VanDerWaalsContact O-CG 3.25Å; V72-Q76 WeakPolarHBondContact O-CG 3.36Å; V72-Q76 PolarHBondContact O-N 2.8Å
73K91.6Very high88Confident153 Ų15361.6 Ų61.667%0.66531%0.305SS*.Hα-helixtrans-60.3-41.6174.8-176.2-179.8179.8-1790111.4L69 E70 Y77L69-K73 WeakPolarHBondContact O-CB 3.45Å; L69-K73 PolarHBondContact O-N 3.48Å; E70-K73 WeakPolarHBondContact O-CB 3.43Å; E70-K73 PolarHBondContact O-N 2.99Å; K73-Y77 VanDerWaalsContact O-CB 3.25Å; K73-Y77 WeakPolarHBondContact O-CB 3.37Å; K73-Y77 PolarHBondContact O-N 2.96Å
74Q88Confident87.1Confident89 Ų8965.7 Ų65.742%0.41632%0.318SS..Hα-helixtrans-62.9-44.3174.7-70173.614.200111.7E70 K71 V72 Y77 Q78E70-Q74 WeakPolarHBondContact O-CG 3.46Å; E70-Q74 PolarHBondContact O-N 2.59Å; E70-Q74 PolarHBondContact OE1-NE2 3.4Å; K71-Q74 PolarHBondContact O-N 3.13Å; V72-Q74 VanDerWaalsContact C-N 3.3Å; V72-Q74 PolarHBondContact O-N 2.81Å; Q74-Y77 WeakPolarHBondContact O-CB 3.5Å; Q74-Y77 PolarHBondContact O-N 3.33Å; Q74-Q78 WeakPolarHBondContact O-CB 3.42Å; Q74-Q78 PolarHBondContact O-N 3.48Å
75L91Very high86.5Confident8 Ų864.9 Ų64.94%0.04231%0.314CS..Hα-helixtrans-58.9-51.6176.1-176.370.5000111.5Y10 W13 W21 L46 K71 V72 Y77 Q78 F79Y10-L75 HydrophobicContact CD1-CG 4.45Å; Y10-L75 HydrophobicContact CD2-CD2 4.12Å; Y10-L75 HydrophobicContact CG-CD2 3.95Å; Y10-L75 HydrophobicContact CG-CG 4.29Å; W13-L75 HydrophobicContact CH2-CD1 3.67Å; W13-L75 HydrophobicContact CH2-CD2 4.07Å; W13-L75 HydrophobicContact CZ2-CD1 4.37Å; W13-L75 HydrophobicContact CZ3-CD1 4.31Å; W13-L75 HydrophobicContact CZ3-CD2 3.86Å; W21-L75 HydrophobicContact CH2-CD2 4.27Å; W21-L75 HydrophobicContact CZ2-CB 4.01Å; W21-L75 HydrophobicContact CZ2-CD1 4.48Å; W21-L75 HydrophobicContact CZ2-CD2 3.96Å; W21-L75 HydrophobicContact CZ2-CG 4.39Å; L46-L75 HydrophobicContact CD1-CD2 4.01Å; K71-L75 WeakPolarHBondContact O-CB 3.08Å; K71-L75 PolarHBondContact O-N 2.86Å; V72-L75 WeakPolarHBondContact O-CB 3.27Å; V72-L75 PolarHBondContact O-N 3.29Å; L75-Y77 VanDerWaalsContact C-N 3.3Å; L75-Y77 PolarHBondContact O-N 2.92Å; L75-Q78 WeakPolarHBondContact O-CB 3.34Å; L75-Q78 PolarHBondContact O-N 2.88Å; L75-Q78 VanDerWaalsContact O-N 3.15Å; L75-F79 HydrophobicContact CD1-CD2 3.95Å; L75-F79 HydrophobicContact CD1-CE2 3.62Å; L75-F79 HydrophobicContact CG-CD2 4.14Å; L75-F79 HydrophobicContact CG-CE2 4.21Å; L75-F79 WeakPolarHBondContact O-CD2 2.91Å; L75-F79 PolarHBondContact O-N 3.39Å
76Q90.1Very high85.9Confident65 Ų6567.1 Ų67.130%0.30433%0.329SS..Hα-helixtrans-59.9-42.9178.6-69.4176.9-0.500111.7Y10 L46 V72 Q78 F79 S80Y10-Q76 HydrophobicContact CE1-CG 4.15Å; Y10-Q76 WeakPolarHBondContact OH-CG 3.48Å; L46-Q76 PolarHBondContact O-NE2 3.06Å; V72-Q76 HydrophobicContact CG1-CG 4.33Å; V72-Q76 WeakPolarHBondContact O-CB 3.38Å; V72-Q76 VanDerWaalsContact O-CG 3.25Å; V72-Q76 WeakPolarHBondContact O-CG 3.36Å; V72-Q76 PolarHBondContact O-N 2.8Å; Q76-Q78 PolarHBondContact O-N 3.33Å; Q76-F79 PolarHBondContact O-N 3.29Å; Q76-S80 WeakPolarHBondContact O-CB 2.91Å; Q76-S80 PolarHBondContact O-N 3.25Å; Q76-S80 PolarHBondContact O-OG 3.42Å
77Y83.7Confident85.5Confident100 Ų10061.9 Ų61.939%0.39230%0.303SS..Hα-helixtrans-59.1-46.8174.5179.8-95.8000111.3K73 Q74 L75 F79 S80 S81 E85 R93K73-Y77 VanDerWaalsContact O-CB 3.25Å; K73-Y77 WeakPolarHBondContact O-CB 3.37Å; K73-Y77 PolarHBondContact O-N 2.96Å; Q74-Y77 WeakPolarHBondContact O-CB 3.5Å; Q74-Y77 PolarHBondContact O-N 3.33Å; L75-Y77 VanDerWaalsContact C-N 3.3Å; L75-Y77 PolarHBondContact O-N 2.92Å; Y77-F79 PolarHBondContact O-N 3.42Å; Y77-S80 WeakPolarHBondContact CA-OG 3.33Å; Y77-S80 PolarHBondContact O-N 3Å; Y77-S80 PolarHBondContact O-OG 3.47Å; Y77-S81 WeakPolarHBondContact O-CB 3.12Å; Y77-S81 PolarHBondContact O-N 3.23Å; Y77-S81 PolarHBondContact O-OG 3.04Å; Y77-E85 PolarHBondContact OH-OE1 3.43Å; Y77-R93 WeakPolarHBondContact OH-CD 3.18Å; Y77-R93 PolarHBondContact OH-NE 2.96Å; Y77-R93 PolarHBondContact OH-NH1 2.62Å
78Q80.5Confident85Confident111 Ų11163.2 Ų63.252%0.51931%0.309SS..Hα-helixtrans-62.4-38.9179.1-171.8178.9100113.1Q74 L75 Q76 S81 F82Q74-Q78 WeakPolarHBondContact O-CB 3.42Å; Q74-Q78 PolarHBondContact O-N 3.48Å; L75-Q78 WeakPolarHBondContact O-CB 3.34Å; L75-Q78 PolarHBondContact O-N 2.88Å; L75-Q78 VanDerWaalsContact O-N 3.15Å; Q76-Q78 PolarHBondContact O-N 3.33Å; Q78-S81 WeakPolarHBondContact CA-OG 3.46Å; Q78-S81 PolarHBondContact O-OG 3.06Å; Q78-F82 WeakPolarHBondContact O-CD2 3.48Å; Q78-F82 PolarHBondContact O-N 3.02Å
79F81.4Confident84.5Confident26 Ų2665.1 Ų65.111%0.11432%0.322CS..Hα-helixtrans-74.1-35.8177.7-86.3-83.9000113.1P7 Q8 Y10 W13 L75 Q76 Y77P7-F79 HydrophobicContact CB-CE1 4.31Å; P7-F79 HydrophobicContact CG-CE1 4.28Å; Q8-F79 WeakPolarHBondContact O-CE1 3.38Å; Q8-F79 WeakPolarHBondContact O-CZ 3.43Å; Y10-F79 HydrophobicContact CD1-CB 4.01Å; Y10-F79 HydrophobicContact CD1-CD1 4.45Å; Y10-F79 AromaticContact CD1-CD2 3.57Å; Y10-F79 HydrophobicContact CD1-CD2 3.57Å; Y10-F79 HydrophobicContact CD1-CE2 4.14Å; Y10-F79 AromaticContact CD1-CG 3.74Å; Y10-F79 HydrophobicContact CD1-CG 3.74Å; Y10-F79 HydrophobicContact CE1-CB 4.3Å; Y10-F79 HydrophobicContact CG-CD2 4.26Å; Y10-F79 HydrophobicContact CG-CE2 4.41Å; W13-F79 HydrophobicContact CZ2-CE2 4.17Å; W13-F79 HydrophobicContact CZ2-CZ 4.16Å; L75-F79 HydrophobicContact CD1-CD2 3.95Å; L75-F79 HydrophobicContact CD1-CE2 3.62Å; L75-F79 HydrophobicContact CG-CD2 4.14Å; L75-F79 HydrophobicContact CG-CE2 4.21Å; L75-F79 WeakPolarHBondContact O-CD2 2.91Å; L75-F79 PolarHBondContact O-N 3.39Å; Q76-F79 PolarHBondContact O-N 3.29Å; Y77-F79 PolarHBondContact O-N 3.42Å
80S77.3Confident84.1Confident57 Ų5762.6 Ų62.640%0.39931%0.309SS..Hα-helixtrans-74.3-29.917559.90000112.8Q76 Y77 F82 D83 N84Q76-S80 WeakPolarHBondContact O-CB 2.91Å; Q76-S80 PolarHBondContact O-N 3.25Å; Q76-S80 PolarHBondContact O-OG 3.42Å; Y77-S80 WeakPolarHBondContact CA-OG 3.33Å; Y77-S80 PolarHBondContact O-N 3Å; Y77-S80 PolarHBondContact O-OG 3.47Å; S80-F82 VanDerWaalsContact C-N 3.31Å; S80-D83 PolarHBondContact O-N 3.29Å; S80-N84 PolarHBondContact O-N 2.89Å; S80-N84 PolarHBondContact O-ND2 3.35Å
81S74.3Confident84Confident14 Ų1457.4 Ų57.410%0.09829%0.285CS..Hα-helixtrans-68.7-31.1176.175.70000111.2Y77 Q78 D83 N84 E85Y77-S81 WeakPolarHBondContact O-CB 3.12Å; Y77-S81 PolarHBondContact O-N 3.23Å; Y77-S81 PolarHBondContact O-OG 3.04Å; Q78-S81 WeakPolarHBondContact CA-OG 3.46Å; Q78-S81 PolarHBondContact O-OG 3.06Å; S81-D83 PolarHBondContact O-N 3.27Å; S81-D83 VanDerWaalsContact O-N 3.11Å; S81-N84 PolarHBondContact O-N 2.92Å; S81-E85 WeakPolarHBondContact O-CA 3.3Å; S81-E85 WeakPolarHBondContact O-CB 3.38Å; S81-E85 PolarHBondContact O-N 2.71Å
82F71.4Confident83.7Confident74 Ų7457.3 Ų57.333%0.32529%0.287SS..Hα-helixtrans-54.3-33.1176.1-110.8-81.3000114.1K6 P7 Q78 S80K6-F82 HydrophobicContact CG-CD1 4.43Å; P7-F82 VanDerWaalsContact CD-CE1 3.48Å; P7-F82 VanDerWaalsContact CD-CZ 3.41Å; P7-F82 HydrophobicContact CG-CD2 3.98Å; P7-F82 HydrophobicContact CG-CE1 4.2Å; P7-F82 HydrophobicContact CG-CE2 3.53Å; P7-F82 HydrophobicContact CG-CG 4.49Å; P7-F82 HydrophobicContact CG-CZ 3.65Å; Q78-F82 WeakPolarHBondContact O-CD2 3.48Å; Q78-F82 PolarHBondContact O-N 3.02Å; S80-F82 VanDerWaalsContact C-N 3.31Å
83D69.6Low83.5Confident98 Ų9859.8 Ų59.852%0.52430%0.296SS..Hα-helixtrans-92.2-29.3-179.4-67.3-38.7000113.8K6 S80 S81K6-D83 VanDerWaalsContact CE-OD1 3.29Å; K6-D83 WeakPolarHBondContact CE-OD1 3.45Å; K6-D83 IonicContact NZ-OD1 3.25Å; K6-D83 PolarHBondContact NZ-OD1 3.15Å; K6-D83 IonicContact NZ-OD2 2.59Å; K6-D83 PolarHBondContact NZ-OD2 2.97Å; S80-D83 PolarHBondContact O-N 3.29Å; S81-D83 PolarHBondContact O-N 3.27Å; S81-D83 VanDerWaalsContact O-N 3.11Å
84N75Confident83.5Confident126 Ų12652.5 Ų52.567%0.67426%0.264SS*.Hα-helixtrans-122.9-15.6-163.8-58.3-66.4000114S80 S81S80-N84 PolarHBondContact O-N 2.89Å; S80-N84 PolarHBondContact O-ND2 3.35Å; S81-N84 PolarHBondContact O-N 2.92Å
85E83.8Confident83.7Confident18 Ų1848.8 Ų48.88%0.08425%0.248CC..  trans-74.5138.1-178.7-169.8172.1-100.100110.2Y77 S81 S89 V90 R93 N148 W152Y77-E85 PolarHBondContact OH-OE1 3.43Å; S81-E85 WeakPolarHBondContact O-CA 3.3Å; S81-E85 WeakPolarHBondContact O-CB 3.38Å; S81-E85 PolarHBondContact O-N 2.71Å; E85-S89 WeakPolarHBondContact CG-OG 3.33Å; E85-V90 HydrophobicContact CG-CG2 3.44Å; E85-V90 VanDerWaalsContact CG-CG2 3.44Å; E85-V90 WeakPolarHBondContact OE2-CG2 3.48Å; E85-R93 VanDerWaalsContact CD-NH2 3.31Å; E85-R93 IonicContact OE1-CZ 3.7Å; E85-R93 VanDerWaalsContact OE1-CZ 3.25Å; E85-R93 IonicContact OE1-NH1 3.85Å; E85-R93 IonicContact OE1-NH2 2.65Å; E85-R93 PolarHBondContact OE1-NH2 3.37Å; E85-R93 IonicContact OE2-NH2 2.62Å; E85-N148 PolarHBondContact OE1-ND2 2.9Å; E85-N148 PolarHBondContact OE2-ND2 2.95Å; E85-W152 HydrophobicContact CB-CZ2 4.17Å; E85-W152 HydrophobicContact CG-CZ2 4.26Å; E85-W152 WeakPolarHBondContact O-CH2 3.3Å; E85-W152 WeakPolarHBondContact O-CZ2 3.48Å; E85-W152 PolarHBondContact OE2-NE1 3.47Å; E85-W152 VanDerWaalsContact OE2-NE1 3.11Å
86T83.6Confident83.8Confident67 Ų6757.9 Ų57.941%0.41128%0.282SS..  trans-119.1156.9173.761.50000107.6Q88 S89 V90T86-Q88 PolarHBondContact O-N 3.34Å; T86-Q88 VanDerWaalsContact O-N 3.08Å; T86-Q88 WeakPolarHBondContact OG1-CB 3.11Å; T86-S89 PolarHBondContact N-OG 2.94Å; T86-S89 VanDerWaalsContact N-OG 3.14Å; T86-S89 PolarHBondContact O-N 3.26Å; T86-S89 PolarHBondContact O-OG 3.22Å; T86-S89 PolarHBondContact OG1-N 2.88Å; T86-V90 WeakPolarHBondContact O-CG2 3.11Å; T86-V90 PolarHBondContact O-N 2.89Å
87L85.1Confident84Confident9 Ų955 Ų555%0.04727%0.269CS..Hα-helixtrans-51.4-35.7171.3177.759.9000111.1V90 L91 W152 L153 F158 A215L87-V90 PolarHBondContact O-N 3.3Å; L87-L91 HydrophobicContact CD1-CD1 4.12Å; L87-L91 HydrophobicContact CD1-CD2 4.36Å; L87-L91 HydrophobicContact CD1-CG 3.97Å; L87-L91 HydrophobicContact CG-CD1 3.98Å; L87-L91 HydrophobicContact CG-CG 4.26Å; L87-L91 VanDerWaalsContact O-CG 3.3Å; L87-L91 WeakPolarHBondContact O-CG 3.13Å; L87-L91 PolarHBondContact O-N 3.1Å; L87-W152 HydrophobicContact CB-CE3 4.41Å; L87-W152 HydrophobicContact CD1-CB 3.88Å; L87-L153 HydrophobicContact CD1-CD2 4.31Å; L87-L153 HydrophobicContact CD1-CG 4.36Å; L87-L153 HydrophobicContact CD2-CD2 3.86Å; L87-F158 HydrophobicContact CD2-CD1 4.36Å; L87-F158 HydrophobicContact CD2-CE1 4.05Å; L87-F158 HydrophobicContact CD2-CE2 4.43Å; L87-F158 HydrophobicContact CD2-CZ 4.08Å; L87-A215 HydrophobicContact CD2-CB 4.49Å
88Q84.4Confident84.5Confident71 Ų7150.2 Ų50.233%0.33225%0.25SS..Hα-helixtrans-56.1-51.8173.4-166.9176.6-10.800113.2T86 V90 L91 L92 V217 I218 V219T86-Q88 PolarHBondContact O-N 3.34Å; T86-Q88 VanDerWaalsContact O-N 3.08Å; T86-Q88 WeakPolarHBondContact OG1-CB 3.11Å; Q88-V90 VanDerWaalsContact C-N 3.26Å; Q88-V90 PolarHBondContact O-N 3.47Å; Q88-L91 PolarHBondContact O-N 3.36Å; Q88-L92 HydrophobicContact CG-CD1 4.28Å; Q88-L92 WeakPolarHBondContact O-CB 3.32Å; Q88-L92 VanDerWaalsContact O-CG 3.32Å; Q88-L92 WeakPolarHBondContact O-CG 3.47Å; Q88-L92 PolarHBondContact O-N 3.49Å; Q88-V217 HydrophobicContact CB-CG1 3.35Å; Q88-V217 HydrophobicContact CG-CG1 3.37Å; Q88-I218 PolarHBondContact NE2-O 3.28Å; Q88-V219 HydrophobicContact CG-CG2 4.44Å
89S86.1Confident85.2Confident40 Ų4047.6 Ų47.628%0.2824%0.242SC..Hα-helixtrans-69.5-28.1-178.267.60000111.8E85 T86 R93E85-S89 WeakPolarHBondContact CG-OG 3.33Å; T86-S89 PolarHBondContact N-OG 2.94Å; T86-S89 VanDerWaalsContact N-OG 3.14Å; T86-S89 PolarHBondContact O-N 3.26Å; T86-S89 PolarHBondContact O-OG 3.22Å; T86-S89 PolarHBondContact OG1-N 2.88Å; S89-R93 WeakPolarHBondContact O-CG 3.46Å; S89-R93 PolarHBondContact O-N 3.18Å
90V88.4Confident85.9Confident0 Ų048 Ų480%025%0.248CC..Hα-helixtrans-66.9-50.4170.4-172.30000111.5E85 T86 L87 Q88 L92 R93 V94 N148 A149E85-V90 HydrophobicContact CG-CG2 3.44Å; E85-V90 VanDerWaalsContact CG-CG2 3.44Å; E85-V90 WeakPolarHBondContact OE2-CG2 3.48Å; T86-V90 WeakPolarHBondContact O-CG2 3.11Å; T86-V90 PolarHBondContact O-N 2.89Å; L87-V90 PolarHBondContact O-N 3.3Å; Q88-V90 VanDerWaalsContact C-N 3.26Å; Q88-V90 PolarHBondContact O-N 3.47Å; V90-L92 VanDerWaalsContact C-N 3.31Å; V90-L92 PolarHBondContact O-N 3.19Å; V90-R93 WeakPolarHBondContact O-CA 3.3Å; V90-R93 WeakPolarHBondContact O-CB 3.47Å; V90-R93 PolarHBondContact O-N 3.38Å; V90-V94 PolarHBondContact O-N 2.85Å; V90-N148 HydrophobicContact CG1-CB 4.21Å; V90-A149 HydrophobicContact CG1-CB 3.76Å
91L89.5Confident86.9Confident3 Ų345.3 Ų45.32%0.01623%0.229CC..Hα-helixtrans-63.4-37.3179.6-66.6177.3000112L87 Q88 R93 V94 S95 A149 F167 L171 F208L87-L91 HydrophobicContact CD1-CD1 4.12Å; L87-L91 HydrophobicContact CD1-CD2 4.36Å; L87-L91 HydrophobicContact CD1-CG 3.97Å; L87-L91 HydrophobicContact CG-CD1 3.98Å; L87-L91 HydrophobicContact CG-CG 4.26Å; L87-L91 VanDerWaalsContact O-CG 3.3Å; L87-L91 WeakPolarHBondContact O-CG 3.13Å; L87-L91 PolarHBondContact O-N 3.1Å; Q88-L91 PolarHBondContact O-N 3.36Å; L91-R93 VanDerWaalsContact C-N 3.26Å; L91-R93 PolarHBondContact O-N 3.2Å; L91-V94 WeakPolarHBondContact O-CB 3.4Å; L91-V94 PolarHBondContact O-N 3.14Å; L91-V94 VanDerWaalsContact O-N 3.09Å; L91-S95 PolarHBondContact O-N 3.38Å; L91-S95 PolarHBondContact O-OG 3.33Å; L91-A149 HydrophobicContact CD2-CB 4.24Å; L91-F167 HydrophobicContact CD1-CE1 4.01Å; L91-F167 HydrophobicContact CD1-CZ 4.46Å; L91-F167 HydrophobicContact CD2-CE1 3.73Å; L91-F167 HydrophobicContact CD2-CZ 3.91Å; L91-L171 HydrophobicContact CD2-CD1 4.07Å; L91-F208 HydrophobicContact CB-CD2 4.49Å; L91-F208 HydrophobicContact CB-CE2 4.39Å; L91-F208 HydrophobicContact CD2-CZ 4.46Å; L91-F208 WeakPolarHBondContact O-CE2 3.31Å
92L87.6Confident87.9Confident70 Ų7045 Ų4537%0.36623%0.226SC..Hα-helixtrans-60-35.4172.1-75.9170.8000112.6Q88 V90 S95 R96 V219Q88-L92 HydrophobicContact CG-CD1 4.28Å; Q88-L92 WeakPolarHBondContact O-CB 3.32Å; Q88-L92 VanDerWaalsContact O-CG 3.32Å; Q88-L92 WeakPolarHBondContact O-CG 3.47Å; Q88-L92 PolarHBondContact O-N 3.49Å; V90-L92 VanDerWaalsContact C-N 3.31Å; V90-L92 PolarHBondContact O-N 3.19Å; L92-S95 PolarHBondContact O-N 2.94Å; L92-R96 WeakPolarHBondContact O-CB 3.25Å; L92-R96 PolarHBondContact O-N 3.37Å; L92-V219 HydrophobicContact CD2-CG1 3.93Å
93R90.5Very high89.1Confident56 Ų5645.1 Ų45.121%0.21123%0.233CC..Hα-helixtrans-69.3-38.2173.2-74.3-178.1-62.9152.42.3112.1Y77 E85 S89 V90 L91 S95 R96 S97 T145 N148Y77-R93 WeakPolarHBondContact OH-CD 3.18Å; Y77-R93 PolarHBondContact OH-NE 2.96Å; Y77-R93 PolarHBondContact OH-NH1 2.62Å; E85-R93 VanDerWaalsContact CD-NH2 3.31Å; E85-R93 IonicContact OE1-CZ 3.7Å; E85-R93 VanDerWaalsContact OE1-CZ 3.25Å; E85-R93 IonicContact OE1-NH1 3.85Å; E85-R93 IonicContact OE1-NH2 2.65Å; E85-R93 PolarHBondContact OE1-NH2 3.37Å; E85-R93 IonicContact OE2-NH2 2.62Å; S89-R93 WeakPolarHBondContact O-CG 3.46Å; S89-R93 PolarHBondContact O-N 3.18Å; V90-R93 WeakPolarHBondContact O-CA 3.3Å; V90-R93 WeakPolarHBondContact O-CB 3.47Å; V90-R93 PolarHBondContact O-N 3.38Å; L91-R93 VanDerWaalsContact C-N 3.26Å; L91-R93 PolarHBondContact O-N 3.2Å; R93-S95 VanDerWaalsContact C-N 3.32Å; R93-S95 PolarHBondContact O-N 3.04Å; R93-R96 PolarHBondContact O-N 3.48Å; R93-S97 WeakPolarHBondContact O-CB 3.46Å; R93-S97 PolarHBondContact O-N 3.47Å; R93-S97 PolarHBondContact O-OG 3.15Å; R93-S97 VanDerWaalsContact O-OG 3.08Å; R93-T145 HydrophobicContact CB-CG2 4.08Å; R93-N148 PolarHBondContact NH2-ND2 3.14Å
94V93.1Very high90.4Very high0 Ų040.8 Ų40.80%021%0.211CC..Hα-helixtrans-59.1-46.3172.2-177.30000109.9V90 L91 R96 S97 C98 L142 I146 A149 L171 F208V90-V94 PolarHBondContact O-N 2.85Å; L91-V94 WeakPolarHBondContact O-CB 3.4Å; L91-V94 PolarHBondContact O-N 3.14Å; L91-V94 VanDerWaalsContact O-N 3.09Å; V94-R96 PolarHBondContact O-N 2.92Å; V94-S97 WeakPolarHBondContact O-CB 3.46Å; V94-S97 PolarHBondContact O-N 3.39Å; V94-C98 PolarHBondContact O-N 2.85Å; V94-C98 PolarHBondContact O-SG 2.94Å; V94-L142 HydrophobicContact CG1-CD1 3.86Å; V94-I146 HydrophobicContact CG1-CD1 4.02Å; V94-I146 HydrophobicContact CG1-CG1 3.75Å; V94-I146 HydrophobicContact CG2-CG1 3.95Å; V94-A149 HydrophobicContact CG2-CB 4.37Å; V94-L171 HydrophobicContact CG1-CD2 4.36Å; V94-F208 HydrophobicContact CB-CE2 4.03Å; V94-F208 HydrophobicContact CB-CZ 3.89Å; V94-F208 HydrophobicContact CG1-CE2 4.16Å; V94-F208 HydrophobicContact CG1-CZ 3.61Å
95S91.8Very high91.5Very high11 Ų1134.8 Ų34.88%0.07718%0.179CC..Hα-helixtrans-58.9-45.3175.6-590000112.6L91 L92 R93 S97 C98 T99 F208L91-S95 PolarHBondContact O-N 3.38Å; L91-S95 PolarHBondContact O-OG 3.33Å; L92-S95 PolarHBondContact O-N 2.94Å; R93-S95 VanDerWaalsContact C-N 3.32Å; R93-S95 PolarHBondContact O-N 3.04Å; S95-S97 VanDerWaalsContact C-N 3.31Å; S95-S97 PolarHBondContact O-N 3.39Å; S95-C98 WeakPolarHBondContact O-CB 3.47Å; S95-C98 PolarHBondContact O-N 2.89Å; S95-T99 PolarHBondContact O-N 3.22Å; S95-T99 PolarHBondContact O-OG1 3.34Å; S95-T99 VanDerWaalsContact O-OG1 3.14Å; S95-F208 WeakPolarHBondContact OG-CD2 3.14Å; S95-F208 WeakPolarHBondContact OG-CE2 3.49Å
96R91.8Very high92.1Very high200 Ų20038 Ų3876%0.75520%0.196SC*.Hα-helixtrans-61.4-40.5177.4-176.5-179.8177.3124.91.3111.7L92 R93 V94 T99 C100L92-R96 WeakPolarHBondContact O-CB 3.25Å; L92-R96 PolarHBondContact O-N 3.37Å; R93-R96 PolarHBondContact O-N 3.48Å; V94-R96 PolarHBondContact O-N 2.92Å; R96-T99 PolarHBondContact O-N 2.89Å; R96-C100 PolarHBondContact O-N 3.38Å
97S94.6Very high92.7Very high4 Ų437.8 Ų37.83%0.02820%0.197CC..Hα-helixtrans-62.6-43.8174.9-64.50000111.3R93 V94 S95 T99 C100 I101 N141R93-S97 WeakPolarHBondContact O-CB 3.46Å; R93-S97 PolarHBondContact O-N 3.47Å; R93-S97 PolarHBondContact O-OG 3.15Å; R93-S97 VanDerWaalsContact O-OG 3.08Å; V94-S97 WeakPolarHBondContact O-CB 3.46Å; V94-S97 PolarHBondContact O-N 3.39Å; S95-S97 VanDerWaalsContact C-N 3.31Å; S95-S97 PolarHBondContact O-N 3.39Å; S97-T99 PolarHBondContact O-N 3.42Å; S97-C100 VanDerWaalsContact O-CB 3.25Å; S97-C100 WeakPolarHBondContact O-CB 3.43Å; S97-C100 PolarHBondContact O-N 2.88Å; S97-I101 WeakPolarHBondContact O-CG1 3.32Å; S97-I101 PolarHBondContact O-N 3.47Å; S97-N141 PolarHBondContact OG-ND2 2.88Å
98C95.5Very high93.2Very high0 Ų037.3 Ų37.30%020%0.195CC..Hα-helixtrans-59.5-45.2173.4-66.40000111.9V94 S95 C100 I101 I102 A201 T205V94-C98 PolarHBondContact O-N 2.85Å; V94-C98 PolarHBondContact O-SG 2.94Å; S95-C98 WeakPolarHBondContact O-CB 3.47Å; S95-C98 PolarHBondContact O-N 2.89Å; C98-C100 VanDerWaalsContact C-N 3.34Å; C98-C100 PolarHBondContact O-N 3.5Å; C98-I101 PolarHBondContact O-N 3.4Å; C98-I102 VanDerWaalsContact O-CG1 3.3Å; C98-I102 WeakPolarHBondContact O-CG1 3.47Å; C98-I102 PolarHBondContact O-N 3.35Å; C98-A201 HydrophobicContact CB-CB 4.13Å; C98-A201 WeakPolarHBondContact CB-O 3.29Å; C98-T205 HydrophobicContact CB-CG2 3.52Å
99T94.5Very high93.6Very high55 Ų5535.3 Ų35.334%0.33719%0.186SC..Hα-helixtrans-62.8-37.6176.2-53.80000112.6S95 R96 S97 I102 T103S95-T99 PolarHBondContact O-N 3.22Å; S95-T99 PolarHBondContact O-OG1 3.34Å; S95-T99 VanDerWaalsContact O-OG1 3.14Å; R96-T99 PolarHBondContact O-N 2.89Å; S97-T99 PolarHBondContact O-N 3.42Å; T99-I102 PolarHBondContact O-N 2.94Å; T99-T103 WeakPolarHBondContact O-CB 3.49Å; T99-T103 PolarHBondContact O-N 2.96Å; T99-T103 PolarHBondContact O-OG1 2.79Å
100C96.5Very high94Very high35 Ų3536.2 Ų36.224%0.23620%0.196CC..Hα-helixtrans-55.4-52172.3-172.80000110.2R96 S97 C98 T103 A104 C138R96-C100 PolarHBondContact O-N 3.38Å; S97-C100 VanDerWaalsContact O-CB 3.25Å; S97-C100 WeakPolarHBondContact O-CB 3.43Å; S97-C100 PolarHBondContact O-N 2.88Å; C98-C100 VanDerWaalsContact C-N 3.34Å; C98-C100 PolarHBondContact O-N 3.5Å; C100-T103 PolarHBondContact O-N 3.37Å; C100-A104 WeakPolarHBondContact O-CB 3.25Å; C100-A104 PolarHBondContact O-N 2.8Å; C100-C138 HydrophobicContact CB-CB 4.03Å; C100-C138 WeakPolarHBondContact CB-SG 3.38Å; C100-C138 WeakPolarHBondContact SG-CB 3.4Å; C100-C138 CovalentContact SG-SG 2.09Å; C100-C138 PolarHBondContact SG-SG 3.22Å
101I97Very high94.3Very high0 Ų037.9 Ų37.90%021%0.205CC..Hα-helixtrans-60.2-51.7-178.8-67.5166.1000110.3S97 C98 T103 A104 I105 C138 I139 L142 I197S97-I101 WeakPolarHBondContact O-CG1 3.32Å; S97-I101 PolarHBondContact O-N 3.47Å; C98-I101 PolarHBondContact O-N 3.4Å; I101-T103 VanDerWaalsContact C-N 3.32Å; I101-T103 PolarHBondContact O-N 3.4Å; I101-A104 PolarHBondContact O-N 3.13Å; I101-I105 HydrophobicContact CG2-CD1 3.46Å; I101-I105 VanDerWaalsContact CG2-CD1 3.46Å; I101-I105 HydrophobicContact CG2-CG1 4.28Å; I101-I105 WeakPolarHBondContact O-CB 3.4Å; I101-I105 VanDerWaalsContact O-CG1 3.23Å; I101-I105 WeakPolarHBondContact O-CG1 3.25Å; I101-I105 PolarHBondContact O-N 3.11Å; I101-C138 HydrophobicContact CG1-CB 3.57Å; I101-I139 HydrophobicContact CD1-CG1 3.85Å; I101-I139 HydrophobicContact CG1-CG1 4.09Å; I101-L142 HydrophobicContact CD1-CB 3.91Å; I101-L142 HydrophobicContact CD1-CD2 3.58Å; I101-L142 HydrophobicContact CD1-CG 4.25Å; I101-I197 HydrophobicContact CG2-CG2 3.73Å
102I96.5Very high94.4Very high8 Ų838.3 Ų38.34%0.04121%0.207CC..Hα-helixtrans-58.6-45.6-179.7-65.4164.3000110.9C98 T99 N106 I198 A201 V202 I225C98-I102 VanDerWaalsContact O-CG1 3.3Å; C98-I102 WeakPolarHBondContact O-CG1 3.47Å; C98-I102 PolarHBondContact O-N 3.35Å; T99-I102 PolarHBondContact O-N 2.94Å; I102-N106 WeakPolarHBondContact O-CB 3.5Å; I102-N106 VanDerWaalsContact O-CG 3.26Å; I102-N106 PolarHBondContact O-N 2.97Å; I102-N106 PolarHBondContact O-ND2 3.22Å; I102-N106 VanDerWaalsContact O-ND2 3.17Å; I102-I198 HydrophobicContact CG1-CG2 4.35Å; I102-A201 HydrophobicContact CD1-CB 3.95Å; I102-A201 HydrophobicContact CG1-CB 3.78Å; I102-V202 HydrophobicContact CD1-CG2 3.76Å; I102-I225 HydrophobicContact CG2-CD1 4.26Å
103T97.1Very high94.6Very high77 Ų7742.8 Ų42.847%0.47222%0.224SC..Hα-helixtrans-64.4-45.4179.3-54.80000111.1T99 C100 I101 N106 S107T99-T103 WeakPolarHBondContact O-CB 3.49Å; T99-T103 PolarHBondContact O-N 2.96Å; T99-T103 PolarHBondContact O-OG1 2.79Å; C100-T103 PolarHBondContact O-N 3.37Å; I101-T103 VanDerWaalsContact C-N 3.32Å; I101-T103 PolarHBondContact O-N 3.4Å; T103-N106 PolarHBondContact O-N 2.93Å; T103-S107 PolarHBondContact O-N 3.43Å; T103-S107 PolarHBondContact O-OG 2.83Å
104A97Very high94.6Very high7 Ų748 Ų486%0.05824%0.244CC..Hα-helixtrans-63.7-41.4179.800000112.1C100 I101 S107 L108 Y134 I135C100-A104 WeakPolarHBondContact O-CB 3.25Å; C100-A104 PolarHBondContact O-N 2.8Å; I101-A104 PolarHBondContact O-N 3.13Å; A104-S107 PolarHBondContact O-N 3.48Å; A104-L108 PolarHBondContact O-N 3.49Å; A104-Y134 HydrophobicContact CB-CD1 3.79Å; A104-Y134 HydrophobicContact CB-CE1 3.95Å; A104-I135 HydrophobicContact CB-CG1 3.63Å
105I96.7Very high94.4Very high0 Ų051.4 Ų51.40%026%0.259CS..Hα-helixtrans-64.7-47.2175.2-64.9164.5000110.1I101 S107 L108 M109 I135 F194 I197 I198I101-I105 HydrophobicContact CG2-CD1 3.46Å; I101-I105 VanDerWaalsContact CG2-CD1 3.46Å; I101-I105 HydrophobicContact CG2-CG1 4.28Å; I101-I105 WeakPolarHBondContact O-CB 3.4Å; I101-I105 VanDerWaalsContact O-CG1 3.23Å; I101-I105 WeakPolarHBondContact O-CG1 3.25Å; I101-I105 PolarHBondContact O-N 3.11Å; I105-S107 VanDerWaalsContact C-N 3.26Å; I105-S107 PolarHBondContact O-N 2.94Å; I105-L108 WeakPolarHBondContact O-CA 3.49Å; I105-L108 WeakPolarHBondContact O-CB 3.43Å; I105-L108 PolarHBondContact O-N 3.34Å; I105-M109 HydrophobicContact CG2-CG 4.17Å; I105-M109 VanDerWaalsContact O-CG 3.3Å; I105-M109 WeakPolarHBondContact O-CG 3.4Å; I105-M109 PolarHBondContact O-N 3.42Å; I105-I135 HydrophobicContact CG1-CD1 3.9Å; I105-I135 HydrophobicContact CG1-CG1 4.21Å; I105-I135 HydrophobicContact CG1-CG2 4.32Å; I105-F194 WeakPolarHBondContact CD1-O 3.22Å; I105-F194 HydrophobicContact CG1-CB 4.21Å; I105-F194 HydrophobicContact CG2-CB 4.16Å; I105-I197 HydrophobicContact CD1-CB 3.91Å; I105-I197 HydrophobicContact CD1-CG2 4.06Å; I105-I198 HydrophobicContact CB-CD1 4.28Å; I105-I198 HydrophobicContact CB-CG1 4.28Å; I105-I198 HydrophobicContact CD1-CG1 3.93Å; I105-I198 HydrophobicContact CG2-CD1 3.75Å; I105-I198 HydrophobicContact CG2-CG1 4Å
106N96.3Very high94.1Very high84 Ų8456.8 Ų56.845%0.44929%0.287SS..Hα-helixtrans-59.3-38.4177.2-74.3-29.9000112.3I102 T103 M109 A110I102-N106 WeakPolarHBondContact O-CB 3.5Å; I102-N106 VanDerWaalsContact O-CG 3.26Å; I102-N106 PolarHBondContact O-N 2.97Å; I102-N106 PolarHBondContact O-ND2 3.22Å; I102-N106 VanDerWaalsContact O-ND2 3.17Å; T103-N106 PolarHBondContact O-N 2.93Å; N106-M109 PolarHBondContact O-N 3.33Å; N106-A110 WeakPolarHBondContact O-CB 3.42Å; N106-A110 PolarHBondContact O-N 3.24Å
107S95.9Very high94Very high63 Ų6349.2 Ų49.244%0.44127%0.268SS..Hα-helixtrans-63.4-44.6172.2-65.30000112T103 A104 I105 A110 I111T103-S107 PolarHBondContact O-N 3.43Å; T103-S107 PolarHBondContact O-OG 2.83Å; A104-S107 PolarHBondContact O-N 3.48Å; I105-S107 VanDerWaalsContact C-N 3.26Å; I105-S107 PolarHBondContact O-N 2.94Å; S107-A110 PolarHBondContact O-N 3.4Å; S107-I111 WeakPolarHBondContact O-CG1 3.48Å; S107-I111 PolarHBondContact O-N 3.17Å; S107-I111 VanDerWaalsContact O-N 3.14Å
108L95.5Very high93.7Very high0 Ų057.5 Ų57.50%031%0.311CS..Hα-helixtrans-59.1-48.3175175.564000111.4A104 I105 A110 I111 T112 I128 A131 I135 N191 F194A104-L108 PolarHBondContact O-N 3.49Å; I105-L108 WeakPolarHBondContact O-CA 3.49Å; I105-L108 WeakPolarHBondContact O-CB 3.43Å; I105-L108 PolarHBondContact O-N 3.34Å; L108-A110 VanDerWaalsContact C-N 3.26Å; L108-A110 PolarHBondContact O-N 3.4Å; L108-I111 PolarHBondContact O-N 3.37Å; L108-T112 PolarHBondContact O-N 3.09Å; L108-T112 PolarHBondContact O-OG1 3.25Å; L108-I128 HydrophobicContact CD1-CB 4.43Å; L108-I128 HydrophobicContact CD1-CG1 4.41Å; L108-I128 HydrophobicContact CD1-CG2 4.06Å; L108-A131 HydrophobicContact CB-CB 4.23Å; L108-A131 HydrophobicContact CD1-CB 3.95Å; L108-I135 HydrophobicContact CB-CD1 3.95Å; L108-I135 HydrophobicContact CD2-CD1 3.55Å; L108-I135 HydrophobicContact CG-CD1 4.38Å; L108-N191 HydrophobicContact CD2-CB 4.03Å; L108-N191 HydrophobicContact CG-CB 4.35Å; L108-F194 HydrophobicContact CD2-CB 4.49Å; L108-F194 HydrophobicContact CD2-CD2 3.42Å; L108-F194 VanDerWaalsContact CD2-CD2 3.42Å; L108-F194 HydrophobicContact CD2-CE2 3.93Å; L108-F194 HydrophobicContact CD2-CG 4.21Å
109M94.8Very high93.3Very high29 Ų2962.5 Ų62.514%0.14335%0.347CS..Hα-helixtrans-59.7-38.2179.5-63.4-61.293.200111.8I105 N106 I111 K113 N191I105-M109 HydrophobicContact CG2-CG 4.17Å; I105-M109 VanDerWaalsContact O-CG 3.3Å; I105-M109 WeakPolarHBondContact O-CG 3.4Å; I105-M109 PolarHBondContact O-N 3.42Å; N106-M109 PolarHBondContact O-N 3.33Å; M109-I111 VanDerWaalsContact C-N 3.33Å; M109-I111 PolarHBondContact O-N 2.86Å; M109-K113 WeakPolarHBondContact O-CB 3.24Å; M109-K113 PolarHBondContact O-N 3.26Å; M109-N191 HydrophobicContact CE-CB 4.22Å; M109-N191 WeakPolarHBondContact CE-O 3.37Å
110A94Very high93.1Very high59 Ų5962.9 Ų62.949%0.48835%0.35SS..Hα-helixtrans-64.4-37175.400000112.4N106 S107 L108 R114N106-A110 WeakPolarHBondContact O-CB 3.42Å; N106-A110 PolarHBondContact O-N 3.24Å; S107-A110 PolarHBondContact O-N 3.4Å; L108-A110 VanDerWaalsContact C-N 3.26Å; L108-A110 PolarHBondContact O-N 3.4Å; A110-R114 WeakPolarHBondContact O-CG 3.44Å
111I93.5Very high93Very high35 Ų3565.4 Ų65.418%0.17936%0.355CS..Hα-helixtrans-73.2-46.4176.9-59.7162.3000110.4S107 L108 M109 K113 R114 Q115 I124 D127 I128 A131S107-I111 WeakPolarHBondContact O-CG1 3.48Å; S107-I111 PolarHBondContact O-N 3.17Å; S107-I111 VanDerWaalsContact O-N 3.14Å; L108-I111 PolarHBondContact O-N 3.37Å; M109-I111 VanDerWaalsContact C-N 3.33Å; M109-I111 PolarHBondContact O-N 2.86Å; I111-K113 VanDerWaalsContact C-N 3.31Å; I111-K113 PolarHBondContact O-N 2.89Å; I111-R114 WeakPolarHBondContact O-CA 3.36Å; I111-R114 WeakPolarHBondContact O-CB 3.42Å; I111-R114 PolarHBondContact O-N 2.71Å; I111-Q115 PolarHBondContact O-N 3.43Å; I111-Q115 VanDerWaalsContact O-N 3.15Å; I111-I124 HydrophobicContact CG2-CD1 4.37Å; I111-I124 HydrophobicContact CG2-CG1 3.79Å; I111-D127 HydrophobicContact CD1-CB 4.45Å; I111-D127 HydrophobicContact CG2-CB 4.36Å; I111-I128 HydrophobicContact CB-CG1 4.32Å; I111-I128 HydrophobicContact CG2-CD1 4.17Å; I111-I128 HydrophobicContact CG2-CG1 3.52Å; I111-A131 HydrophobicContact CD1-CB 4.32Å
112T91.7Very high92.8Very high12 Ų1271.6 Ų71.67%0.07440%0.395CS..Hα-helixtrans-58.9-41.6178.2-58.30000111.5L108 R114 Q115 D116L108-T112 PolarHBondContact O-N 3.09Å; L108-T112 PolarHBondContact O-OG1 3.25Å; T112-R114 PolarHBondContact O-N 3.01Å; T112-R114 VanDerWaalsContact O-N 3.15Å; T112-Q115 WeakPolarHBondContact O-CA 3.33Å; T112-Q115 VanDerWaalsContact O-CB 3.24Å; T112-Q115 WeakPolarHBondContact O-CB 3.5Å; T112-Q115 PolarHBondContact O-N 3Å; T112-D116 PolarHBondContact O-N 3.36Å
113K91.3Very high92.7Very high163 Ų16373.4 Ų73.471%0.70942%0.416SS*.Hα-helixtrans-60.1-27.1173.4-174.3172.8-179.9175.20113.9M109 I111M109-K113 WeakPolarHBondContact O-CB 3.24Å; M109-K113 PolarHBondContact O-N 3.26Å; I111-K113 VanDerWaalsContact C-N 3.31Å; I111-K113 PolarHBondContact O-N 2.89Å
114R90.6Very high92.6Very high167 Ų16770.3 Ų70.363%0.6340%0.396SS*.Hα-helixtrans-79.6-24.8174.3-65.8-68.2-174.3-1791.8112.5A110 I111 T112 D116 A117 Y121 I124A110-R114 WeakPolarHBondContact O-CG 3.44Å; I111-R114 WeakPolarHBondContact O-CA 3.36Å; I111-R114 WeakPolarHBondContact O-CB 3.42Å; I111-R114 PolarHBondContact O-N 2.71Å; T112-R114 PolarHBondContact O-N 3.01Å; T112-R114 VanDerWaalsContact O-N 3.15Å; R114-D116 VanDerWaalsContact C-N 3.33Å; R114-A117 PolarHBondContact O-N 3.2Å; R114-Y121 HydrophobicContact CB-CE1 4.48Å; R114-I124 HydrophobicContact CB-CD1 3.9Å
115Q89.2Confident92.4Very high71 Ų7175.4 Ų75.433%0.33242%0.422SS..Hα-helixtrans-67.6-37.7173.8-177.1-170.2-27.100111I111 T112 A117 P120 I124 I128I111-Q115 PolarHBondContact O-N 3.43Å; I111-Q115 VanDerWaalsContact O-N 3.15Å; T112-Q115 WeakPolarHBondContact O-CA 3.33Å; T112-Q115 VanDerWaalsContact O-CB 3.24Å; T112-Q115 WeakPolarHBondContact O-CB 3.5Å; T112-Q115 PolarHBondContact O-N 3Å; Q115-A117 PolarHBondContact O-N 3.32Å; Q115-P120 WeakPolarHBondContact O-CG 3.45Å; Q115-I124 HydrophobicContact CB-CD1 3.78Å; Q115-I124 HydrophobicContact CB-CG1 4.37Å; Q115-I124 VanDerWaalsContact N-CD1 3.31Å; Q115-I128 HydrophobicContact CB-CD1 4.27Å
116D87Confident92.3Very high123 Ų12379.3 Ų79.366%0.65845%0.449SS*.SBendtrans-80.5-3.4179.5-58.4-32.5000113.5T112 R114T112-D116 PolarHBondContact O-N 3.36Å; R114-D116 VanDerWaalsContact C-N 3.33Å
117A88.7Confident92.2Very high42 Ų4278.8 Ų78.835%0.34745%0.446SS..SBendtrans-83.2157.4176.900000111.6R114 Q115 S119 P120R114-A117 PolarHBondContact O-N 3.2Å; Q115-A117 PolarHBondContact O-N 3.32Å; A117-S119 PolarHBondContact O-N 3.45Å; A117-P120 VanDerWaalsContact O-CD 3.31Å; A117-P120 WeakPolarHBondContact O-CD 3.18Å; A117-P120 WeakPolarHBondContact O-CG 3.44Å
118D87.6Confident92.1Very high177 Ų17776.4 Ų76.495%0.94743%0.429SS*.SBendtrans-60.4-14.7-177.3-61.8-37.6000114.8
119S88.7Confident92Very high106 Ų10683 Ų8374%0.74146%0.459SS*.SBendtrans-135.377.5-179.8-170.20000111.6A117A117-S119 PolarHBondContact O-N 3.45Å
120P90.4Very high91.9Very high62 Ų6283.5 Ų83.540%0.40347%0.473SS..PPolyproline II helixtrans-67.7137.5170.8-15.731.7000109.7Q115 A117 I124Q115-P120 WeakPolarHBondContact O-CG 3.45Å; A117-P120 VanDerWaalsContact O-CD 3.31Å; A117-P120 WeakPolarHBondContact O-CD 3.18Å; A117-P120 WeakPolarHBondContact O-CG 3.44Å; P120-I124 HydrophobicContact CB-CD1 4.32Å; P120-I124 HydrophobicContact CB-CG2 4.15Å
121Y93Very high91.9Very high88 Ų8881.5 Ų81.535%0.34546%0.456SS..PPolyproline II helixtrans-78.8152.7178.464-91.9000111.4R114 G123 I124 D127R114-Y121 HydrophobicContact CB-CE1 4.48Å; Y121-G123 PolarHBondContact O-N 3.33Å; Y121-I124 HydrophobicContact CD1-CB 4.39Å; Y121-I124 HydrophobicContact CD1-CD1 4.01Å; Y121-I124 HydrophobicContact CD1-CG1 4.42Å; Y121-I124 HydrophobicContact CD2-CB 4.28Å; Y121-I124 HydrophobicContact CE1-CB 4.09Å; Y121-I124 HydrophobicContact CE1-CD1 3.65Å; Y121-I124 HydrophobicContact CE1-CG1 3.8Å; Y121-I124 HydrophobicContact CE2-CB 3.96Å; Y121-I124 HydrophobicContact CE2-CG1 4.41Å; Y121-I124 HydrophobicContact CG-CB 4.48Å; Y121-I124 WeakPolarHBondContact O-CB 3.39Å; Y121-I124 WeakPolarHBondContact O-CG2 3.45Å; Y121-I124 PolarHBondContact O-N 3.49Å; Y121-D127 WeakPolarHBondContact CE2-OD2 3.48Å; Y121-D127 VanDerWaalsContact CZ-OD2 3.32Å; Y121-D127 PolarHBondContact OH-OD2 2.85Å
122P93.5Very high92Very high130 Ų13080.2 Ų80.284%0.84445%0.451SS*.THydrogen-bonded Turntrans-59.8130.4176.5-23.433.9000111.9
123G94.6Very high92.1Very high46 Ų4682.6 Ų82.647%0.47447%0.467SS..THydrogen-bonded Turntrans94.1-2.4-179.900000115.2Y121 L125 S126 D127Y121-G123 PolarHBondContact O-N 3.33Å; G123-L125 VanDerWaalsContact C-N 3.26Å; G123-L125 PolarHBondContact O-N 3.48Å; G123-L125 VanDerWaalsContact O-N 3.14Å; G123-S126 WeakPolarHBondContact O-CA 3.46Å; G123-S126 VanDerWaalsContact O-CB 3.29Å; G123-S126 WeakPolarHBondContact O-CB 3.27Å; G123-S126 PolarHBondContact O-N 3.2Å; G123-D127 PolarHBondContact O-N 3.33Å; G123-D127 VanDerWaalsContact O-N 3.09Å
124I94.3Very high92.2Very high12 Ų1281.2 Ų81.26%0.06246%0.459CS..Hα-helixtrans-52.8-38.4-178-167.8162.3000114.5I111 R114 Q115 P120 Y121 S126 D127 I128I111-I124 HydrophobicContact CG2-CD1 4.37Å; I111-I124 HydrophobicContact CG2-CG1 3.79Å; R114-I124 HydrophobicContact CB-CD1 3.9Å; Q115-I124 HydrophobicContact CB-CD1 3.78Å; Q115-I124 HydrophobicContact CB-CG1 4.37Å; Q115-I124 VanDerWaalsContact N-CD1 3.31Å; P120-I124 HydrophobicContact CB-CD1 4.32Å; P120-I124 HydrophobicContact CB-CG2 4.15Å; Y121-I124 HydrophobicContact CD1-CB 4.39Å; Y121-I124 HydrophobicContact CD1-CD1 4.01Å; Y121-I124 HydrophobicContact CD1-CG1 4.42Å; Y121-I124 HydrophobicContact CD2-CB 4.28Å; Y121-I124 HydrophobicContact CE1-CB 4.09Å; Y121-I124 HydrophobicContact CE1-CD1 3.65Å; Y121-I124 HydrophobicContact CE1-CG1 3.8Å; Y121-I124 HydrophobicContact CE2-CB 3.96Å; Y121-I124 HydrophobicContact CE2-CG1 4.41Å; Y121-I124 HydrophobicContact CG-CB 4.48Å; Y121-I124 WeakPolarHBondContact O-CB 3.39Å; Y121-I124 WeakPolarHBondContact O-CG2 3.45Å; Y121-I124 PolarHBondContact O-N 3.49Å; I124-S126 VanDerWaalsContact C-N 3.34Å; I124-S126 PolarHBondContact O-N 2.91Å; I124-D127 PolarHBondContact O-N 3.5Å; I124-I128 HydrophobicContact CG1-CD1 4.27Å; I124-I128 WeakPolarHBondContact O-CG1 3.44Å; I124-I128 PolarHBondContact O-N 3.19Å
125L92.7Very high92.5Very high115 Ų11573.3 Ų73.360%0.60243%0.429SS*.Hα-helixtrans-65.8-37.1177.3-63.8177.9000112.2G123 I128 Q129G123-L125 VanDerWaalsContact C-N 3.26Å; G123-L125 PolarHBondContact O-N 3.48Å; G123-L125 VanDerWaalsContact O-N 3.14Å; L125-I128 PolarHBondContact O-N 3.13Å; L125-Q129 PolarHBondContact O-N 3.4Å
126S94.7Very high92.7Very high81 Ų8171.9 Ų71.957%0.56642%0.424SS*.Hα-helixtrans-66.7-40.2175.4-1750000110.9G123 I124 Q129 G130G123-S126 WeakPolarHBondContact O-CA 3.46Å; G123-S126 VanDerWaalsContact O-CB 3.29Å; G123-S126 WeakPolarHBondContact O-CB 3.27Å; G123-S126 PolarHBondContact O-N 3.2Å; I124-S126 VanDerWaalsContact C-N 3.34Å; I124-S126 PolarHBondContact O-N 2.91Å; S126-Q129 PolarHBondContact O-N 3.09Å; S126-G130 PolarHBondContact O-N 3.39Å
127D95.5Very high93.1Very high73 Ų7369.4 Ų69.439%0.3942%0.416SS..Hα-helixtrans-65.8-40.2177.5-71.2-8.4000111.8I111 Y121 G123 I124 G130 A131I111-D127 HydrophobicContact CD1-CB 4.45Å; I111-D127 HydrophobicContact CG2-CB 4.36Å; Y121-D127 WeakPolarHBondContact CE2-OD2 3.48Å; Y121-D127 VanDerWaalsContact CZ-OD2 3.32Å; Y121-D127 PolarHBondContact OH-OD2 2.85Å; G123-D127 PolarHBondContact O-N 3.33Å; G123-D127 VanDerWaalsContact O-N 3.09Å; I124-D127 PolarHBondContact O-N 3.5Å; D127-G130 PolarHBondContact O-N 2.84Å; D127-A131 VanDerWaalsContact O-CB 3.31Å; D127-A131 WeakPolarHBondContact O-CB 3.39Å; D127-A131 PolarHBondContact O-N 3.48Å
128I93.4Very high93.5Very high13 Ų1367.6 Ų67.67%0.06740%0.4CS..Hα-helixtrans-60.5-47.4174-74.1172.7000110.7L108 I111 Q115 I124 L125 G130 A131 A132 N191L108-I128 HydrophobicContact CD1-CB 4.43Å; L108-I128 HydrophobicContact CD1-CG1 4.41Å; L108-I128 HydrophobicContact CD1-CG2 4.06Å; I111-I128 HydrophobicContact CB-CG1 4.32Å; I111-I128 HydrophobicContact CG2-CD1 4.17Å; I111-I128 HydrophobicContact CG2-CG1 3.52Å; Q115-I128 HydrophobicContact CB-CD1 4.27Å; I124-I128 HydrophobicContact CG1-CD1 4.27Å; I124-I128 WeakPolarHBondContact O-CG1 3.44Å; I124-I128 PolarHBondContact O-N 3.19Å; L125-I128 PolarHBondContact O-N 3.13Å; I128-G130 VanDerWaalsContact C-N 3.33Å; I128-G130 PolarHBondContact O-N 2.94Å; I128-A131 PolarHBondContact O-N 3.24Å; I128-A132 WeakPolarHBondContact O-CB 3.37Å; I128-A132 PolarHBondContact O-N 2.86Å; I128-N191 WeakPolarHBondContact CG2-ND2 3.16Å
129Q92.8Very high93.9Very high138 Ų13859.2 Ų59.265%0.64536%0.356SS*.Hα-helixtrans-63.3-40.4178-173.8176.2-4.500111.8L125 S126 S133L125-Q129 PolarHBondContact O-N 3.4Å; S126-Q129 PolarHBondContact O-N 3.09Å; Q129-S133 WeakPolarHBondContact O-CB 3.35Å; Q129-S133 PolarHBondContact O-N 3.07Å; Q129-S133 PolarHBondContact O-OG 3.31Å
130G93.8Very high94.2Very high41 Ų4159.4 Ų59.442%0.42335%0.348SS..Hα-helixtrans-62.5-45.3174.500000112.4S126 D127 I128 S133 Y134S126-G130 PolarHBondContact O-N 3.39Å; D127-G130 PolarHBondContact O-N 2.84Å; I128-G130 VanDerWaalsContact C-N 3.33Å; I128-G130 PolarHBondContact O-N 2.94Å; G130-S133 PolarHBondContact O-N 3.27Å; G130-Y134 WeakPolarHBondContact O-CB 3.37Å; G130-Y134 PolarHBondContact O-N 3.38Å
131A94.3Very high94.3Very high17 Ų1760.5 Ų60.514%0.1435%0.35CS..Hα-helixtrans-64.3-43.6177.400000112L108 I111 D127 I128 S133 Y134 I135L108-A131 HydrophobicContact CB-CB 4.23Å; L108-A131 HydrophobicContact CD1-CB 3.95Å; I111-A131 HydrophobicContact CD1-CB 4.32Å; D127-A131 VanDerWaalsContact O-CB 3.31Å; D127-A131 WeakPolarHBondContact O-CB 3.39Å; D127-A131 PolarHBondContact O-N 3.48Å; I128-A131 PolarHBondContact O-N 3.24Å; A131-S133 PolarHBondContact O-N 3.43Å; A131-Y134 WeakPolarHBondContact O-CB 3.36Å; A131-Y134 PolarHBondContact O-N 3Å; A131-I135 WeakPolarHBondContact O-CG1 3.17Å; A131-I135 PolarHBondContact O-N 2.9Å
132A93.9Very high94.5Very high8 Ų856.3 Ų56.37%0.06633%0.334CS..Hα-helixtrans-60.9-44.2174.700000111.9I128 Y134 I135 L136 I186 F194I128-A132 WeakPolarHBondContact O-CB 3.37Å; I128-A132 PolarHBondContact O-N 2.86Å; A132-Y134 VanDerWaalsContact C-N 3.28Å; A132-Y134 PolarHBondContact O-N 3.32Å; A132-I135 PolarHBondContact O-N 2.89Å; A132-L136 WeakPolarHBondContact O-CG 3.43Å; A132-L136 PolarHBondContact O-N 3.09Å; A132-I186 HydrophobicContact CB-CD1 4.33Å; A132-F194 HydrophobicContact CB-CE2 4.23Å; A132-F194 HydrophobicContact CB-CZ 4.43Å
133S93.4Very high94.6Very high61 Ų6152.9 Ų52.943%0.42731%0.307SS..Hα-helixtrans-62.3-36.6176.1-570000112.1Q129 G130 A131 L136 S137Q129-S133 WeakPolarHBondContact O-CB 3.35Å; Q129-S133 PolarHBondContact O-N 3.07Å; Q129-S133 PolarHBondContact O-OG 3.31Å; G130-S133 PolarHBondContact O-N 3.27Å; A131-S133 PolarHBondContact O-N 3.43Å; S133-L136 PolarHBondContact O-N 3.1Å; S133-S137 PolarHBondContact O-N 3.43Å; S133-S137 PolarHBondContact O-OG 3.38Å
134Y95.5Very high94.6Very high135 Ų13554.4 Ų54.453%0.52931%0.311SS..Hα-helixtrans-69.3-39.9175.8-176.1-114.5000112.4A104 G130 A131 A132 L136 S137 C138A104-Y134 HydrophobicContact CB-CD1 3.79Å; A104-Y134 HydrophobicContact CB-CE1 3.95Å; G130-Y134 WeakPolarHBondContact O-CB 3.37Å; G130-Y134 PolarHBondContact O-N 3.38Å; A131-Y134 WeakPolarHBondContact O-CB 3.36Å; A131-Y134 PolarHBondContact O-N 3Å; A132-Y134 VanDerWaalsContact C-N 3.28Å; A132-Y134 PolarHBondContact O-N 3.32Å; Y134-L136 VanDerWaalsContact C-N 3.35Å; Y134-L136 PolarHBondContact O-N 3.35Å; Y134-S137 WeakPolarHBondContact O-CB 3.18Å; Y134-S137 PolarHBondContact O-N 2.91Å; Y134-C138 PolarHBondContact O-N 3.39Å
135I95.8Very high94.5Very high0 Ų054.1 Ų54.10%031%0.309CS..Hα-helixtrans-59.1-47172.9-69.3163.1000110.5A104 I105 L108 A131 A132 S137 C138 I139 F194A104-I135 HydrophobicContact CB-CG1 3.63Å; I105-I135 HydrophobicContact CG1-CD1 3.9Å; I105-I135 HydrophobicContact CG1-CG1 4.21Å; I105-I135 HydrophobicContact CG1-CG2 4.32Å; L108-I135 HydrophobicContact CB-CD1 3.95Å; L108-I135 HydrophobicContact CD2-CD1 3.55Å; L108-I135 HydrophobicContact CG-CD1 4.38Å; A131-I135 WeakPolarHBondContact O-CG1 3.17Å; A131-I135 PolarHBondContact O-N 2.9Å; A132-I135 PolarHBondContact O-N 2.89Å; I135-S137 VanDerWaalsContact C-N 3.26Å; I135-S137 PolarHBondContact O-N 3.12Å; I135-C138 PolarHBondContact O-N 2.87Å; I135-C138 VanDerWaalsContact O-N 3.12Å; I135-I139 HydrophobicContact CG2-CD1 3.86Å; I135-I139 HydrophobicContact CG2-CG1 4.43Å; I135-I139 WeakPolarHBondContact O-CG1 3.33Å; I135-I139 PolarHBondContact O-N 2.92Å; I135-F194 HydrophobicContact CD1-CD2 4.45Å; I135-F194 HydrophobicContact CD1-CG 4.35Å; I135-F194 HydrophobicContact CG2-CD1 3.84Å; I135-F194 HydrophobicContact CG2-CE1 3.8Å
136L94.5Very high94.6Very high42 Ų4248.8 Ų48.822%0.2228%0.282CS..Hα-helixtrans-57.9-41.2176.4-68.2174.6000111.5A132 S133 Y134 I139 L140 I186A132-L136 WeakPolarHBondContact O-CG 3.43Å; A132-L136 PolarHBondContact O-N 3.09Å; S133-L136 PolarHBondContact O-N 3.1Å; Y134-L136 VanDerWaalsContact C-N 3.35Å; Y134-L136 PolarHBondContact O-N 3.35Å; L136-I139 PolarHBondContact O-N 3.06Å; L136-L140 WeakPolarHBondContact O-CG 3.36Å; L136-L140 PolarHBondContact O-N 3.23Å; L136-I186 HydrophobicContact CD1-CD1 4.08Å; L136-I186 HydrophobicContact CD1-CG1 4.13Å; L136-I186 HydrophobicContact CD2-CG1 4.3Å
137S94.6Very high94.6Very high70 Ų7047.9 Ų47.949%0.4928%0.279SS..Hα-helixtrans-62.7-44.7174.5-59.30000112.5S133 Y134 I135 I139 L140 N141S133-S137 PolarHBondContact O-N 3.43Å; S133-S137 PolarHBondContact O-OG 3.38Å; Y134-S137 WeakPolarHBondContact O-CB 3.18Å; Y134-S137 PolarHBondContact O-N 2.91Å; I135-S137 VanDerWaalsContact C-N 3.26Å; I135-S137 PolarHBondContact O-N 3.12Å; S137-I139 VanDerWaalsContact C-N 3.28Å; S137-I139 PolarHBondContact O-N 3.42Å; S137-L140 PolarHBondContact O-N 2.91Å; S137-N141 WeakPolarHBondContact O-CB 3.26Å; S137-N141 PolarHBondContact O-N 3.33Å
138C96.2Very high94.4Very high4 Ų446.2 Ų46.23%0.02727%0.27CS..Hα-helixtrans-60.5-38.1174.2-67.30000111C100 I101 Y134 I135 N141 L142C100-C138 HydrophobicContact CB-CB 4.03Å; C100-C138 WeakPolarHBondContact CB-SG 3.38Å; C100-C138 WeakPolarHBondContact SG-CB 3.4Å; C100-C138 CovalentContact SG-SG 2.09Å; C100-C138 PolarHBondContact SG-SG 3.22Å; I101-C138 HydrophobicContact CG1-CB 3.57Å; Y134-C138 PolarHBondContact O-N 3.39Å; I135-C138 PolarHBondContact O-N 2.87Å; I135-C138 VanDerWaalsContact O-N 3.12Å; C138-N141 PolarHBondContact O-N 3.46Å; C138-L142 PolarHBondContact O-N 2.94Å
139I96.7Very high94.3Very high1 Ų145.6 Ų45.61%0.00527%0.267CS..Hα-helixtrans-69.5-43.2179.7-69.6174000111.9I101 I135 L136 S137 N141 L142 M143 T178 N179 I197I101-I139 HydrophobicContact CD1-CG1 3.85Å; I101-I139 HydrophobicContact CG1-CG1 4.09Å; I135-I139 HydrophobicContact CG2-CD1 3.86Å; I135-I139 HydrophobicContact CG2-CG1 4.43Å; I135-I139 WeakPolarHBondContact O-CG1 3.33Å; I135-I139 PolarHBondContact O-N 2.92Å; L136-I139 PolarHBondContact O-N 3.06Å; S137-I139 VanDerWaalsContact C-N 3.28Å; S137-I139 PolarHBondContact O-N 3.42Å; I139-N141 VanDerWaalsContact C-N 3.26Å; I139-N141 PolarHBondContact O-N 3.34Å; I139-L142 WeakPolarHBondContact O-CB 3.39Å; I139-L142 PolarHBondContact O-N 2.93Å; I139-L142 VanDerWaalsContact O-N 3.12Å; I139-M143 WeakPolarHBondContact O-CG 3.33Å; I139-M143 PolarHBondContact O-N 2.85Å; I139-T178 HydrophobicContact CD1-CG2 4.03Å; I139-T178 HydrophobicContact CG1-CG2 3.95Å; I139-T178 HydrophobicContact CG2-CG2 4.2Å; I139-N179 HydrophobicContact CG2-CB 4.08Å; I139-I197 HydrophobicContact CD1-CD1 3.89Å
140L94.4Very high94.3Very high111 Ų11139.5 Ų39.558%0.58124%0.24SC*.Hα-helixtrans-61.4-38.8174.4-68.8173.7000111.3L136 S137 M143 S144L136-L140 WeakPolarHBondContact O-CG 3.36Å; L136-L140 PolarHBondContact O-N 3.23Å; S137-L140 PolarHBondContact O-N 2.91Å; L140-M143 PolarHBondContact O-N 3.5Å; L140-S144 PolarHBondContact O-N 2.98Å
141N94.1Very high94.2Very high84 Ų8439.3 Ų39.345%0.44923%0.232SC..Hα-helixtrans-65.1-40.9172.9-176.367.8000112.1S97 S137 C138 I139 S144 T145S97-N141 PolarHBondContact OG-ND2 2.88Å; S137-N141 WeakPolarHBondContact O-CB 3.26Å; S137-N141 PolarHBondContact O-N 3.33Å; C138-N141 PolarHBondContact O-N 3.46Å; I139-N141 VanDerWaalsContact C-N 3.26Å; I139-N141 PolarHBondContact O-N 3.34Å; N141-S144 PolarHBondContact O-N 3.48Å; N141-T145 WeakPolarHBondContact O-CG2 3.27Å; N141-T145 PolarHBondContact O-N 2.95Å; N141-T145 PolarHBondContact O-OG1 3.22Å; N141-T145 VanDerWaalsContact O-OG1 3.11Å
142L96.3Very high93.9Very high0 Ų040.8 Ų40.80%023%0.234CC..Hα-helixtrans-56.8-51.2172.5177.970.8000110.8V94 I101 C138 I139 S144 T145 I146 T178 M204V94-L142 HydrophobicContact CG1-CD1 3.86Å; I101-L142 HydrophobicContact CD1-CB 3.91Å; I101-L142 HydrophobicContact CD1-CD2 3.58Å; I101-L142 HydrophobicContact CD1-CG 4.25Å; C138-L142 PolarHBondContact O-N 2.94Å; I139-L142 WeakPolarHBondContact O-CB 3.39Å; I139-L142 PolarHBondContact O-N 2.93Å; I139-L142 VanDerWaalsContact O-N 3.12Å; L142-S144 VanDerWaalsContact C-N 3.32Å; L142-S144 PolarHBondContact O-N 3.36Å; L142-T145 WeakPolarHBondContact CA-OG1 3.44Å; L142-T145 PolarHBondContact O-N 3.08Å; L142-T145 VanDerWaalsContact O-N 3.13Å; L142-T145 PolarHBondContact O-OG1 3.31Å; L142-I146 HydrophobicContact CD1-CD1 3.71Å; L142-I146 HydrophobicContact CD1-CG1 4.19Å; L142-I146 HydrophobicContact CD2-CD1 4.37Å; L142-I146 HydrophobicContact CG-CD1 3.81Å; L142-I146 HydrophobicContact CG-CG1 4.47Å; L142-I146 PolarHBondContact O-N 3.42Å; L142-T178 HydrophobicContact CD2-CG2 4.02Å; L142-M204 HydrophobicContact CD2-CE 3.84Å
143M96.6Very high93.8Very high58 Ų5840.4 Ų40.429%0.28623%0.231SC..Hα-helixtrans-54.8-47.1178.8-68.5-68.9-64.200111.7I139 L140 I146 A147 A175 N179I139-M143 WeakPolarHBondContact O-CG 3.33Å; I139-M143 PolarHBondContact O-N 2.85Å; L140-M143 PolarHBondContact O-N 3.5Å; M143-I146 PolarHBondContact O-N 3.24Å; M143-A147 WeakPolarHBondContact O-CB 3.33Å; M143-A147 PolarHBondContact O-N 3.34Å; M143-A175 HydrophobicContact SD-CB 3.53Å; M143-A175 VanDerWaalsContact SD-CB 3.53Å; M143-N179 HydrophobicContact CG-CB 4.4Å; M143-N179 HydrophobicContact SD-CB 3.96Å
144S93.6Very high93.6Very high79 Ų7943 Ų4355%0.55224%0.236SC*.Hα-helixtrans-62-44.6177.1-177.70000112.4L140 N141 L142 I146 A147 N148L140-S144 PolarHBondContact O-N 2.98Å; N141-S144 PolarHBondContact O-N 3.48Å; L142-S144 VanDerWaalsContact C-N 3.32Å; L142-S144 PolarHBondContact O-N 3.36Å; S144-I146 PolarHBondContact O-N 3.33Å; S144-A147 PolarHBondContact O-N 2.94Å; S144-N148 PolarHBondContact O-N 3.03Å; S144-N148 VanDerWaalsContact O-N 3.12Å
145T92.6Very high93.2Very high5 Ų540.5 Ų40.53%0.03123%0.226CC..Hα-helixtrans-66.8-35.2178.355.50000113R93 N141 L142 N148 A149R93-T145 HydrophobicContact CB-CG2 4.08Å; N141-T145 WeakPolarHBondContact O-CG2 3.27Å; N141-T145 PolarHBondContact O-N 2.95Å; N141-T145 PolarHBondContact O-OG1 3.22Å; N141-T145 VanDerWaalsContact O-OG1 3.11Å; L142-T145 WeakPolarHBondContact CA-OG1 3.44Å; L142-T145 PolarHBondContact O-N 3.08Å; L142-T145 VanDerWaalsContact O-N 3.13Å; L142-T145 PolarHBondContact O-OG1 3.31Å; T145-N148 PolarHBondContact O-N 3.22Å; T145-A149 PolarHBondContact O-N 3.05Å
146I95.2Very high92.5Very high4 Ų445.1 Ų45.12%0.02126%0.256CS..Hα-helixtrans-72.2-39.7176-73.6176.5000111.5V94 L142 M143 S144 N148 A149 A150 L171 V172 A175 M204V94-I146 HydrophobicContact CG1-CD1 4.02Å; V94-I146 HydrophobicContact CG1-CG1 3.75Å; V94-I146 HydrophobicContact CG2-CG1 3.95Å; L142-I146 HydrophobicContact CD1-CD1 3.71Å; L142-I146 HydrophobicContact CD1-CG1 4.19Å; L142-I146 HydrophobicContact CD2-CD1 4.37Å; L142-I146 HydrophobicContact CG-CD1 3.81Å; L142-I146 HydrophobicContact CG-CG1 4.47Å; L142-I146 PolarHBondContact O-N 3.42Å; M143-I146 PolarHBondContact O-N 3.24Å; S144-I146 PolarHBondContact O-N 3.33Å; I146-N148 PolarHBondContact O-N 3.43Å; I146-A149 WeakPolarHBondContact O-CB 3.44Å; I146-A149 PolarHBondContact O-N 3.46Å; I146-A149 VanDerWaalsContact O-N 3.13Å; I146-A150 WeakPolarHBondContact O-CB 3.3Å; I146-A150 PolarHBondContact O-N 3.08Å; I146-L171 HydrophobicContact CD1-CD2 4.49Å; I146-L171 HydrophobicContact CG2-CB 4.04Å; I146-V172 HydrophobicContact CG2-CG2 4.38Å; I146-A175 HydrophobicContact CB-CB 4.24Å; I146-A175 HydrophobicContact CD1-CB 3.56Å; I146-A175 HydrophobicContact CG1-CB 4.48Å; I146-A175 HydrophobicContact CG2-CB 3.96Å; I146-M204 HydrophobicContact CD1-SD 3.67Å
147A94.1Very high91.9Very high61 Ų6146.9 Ų46.950%0.50427%0.27SS..Hα-helixtrans-57.4-41.6172.800000111.1M143 S144 A150 S151M143-A147 WeakPolarHBondContact O-CB 3.33Å; M143-A147 PolarHBondContact O-N 3.34Å; S144-A147 PolarHBondContact O-N 2.94Å; A147-A150 PolarHBondContact O-N 3.22Å; A147-S151 PolarHBondContact O-N 3.15Å
148N91.4Very high91.6Very high39 Ų3945.4 Ų45.421%0.20926%0.255CS..Hα-helixtrans-63.8-47.2173.7-169.722.9000111.8E85 V90 R93 S144 T145 I146 A150 S151 W152E85-N148 PolarHBondContact OE1-ND2 2.9Å; E85-N148 PolarHBondContact OE2-ND2 2.95Å; V90-N148 HydrophobicContact CG1-CB 4.21Å; R93-N148 PolarHBondContact NH2-ND2 3.14Å; S144-N148 PolarHBondContact O-N 3.03Å; S144-N148 VanDerWaalsContact O-N 3.12Å; T145-N148 PolarHBondContact O-N 3.22Å; I146-N148 PolarHBondContact O-N 3.43Å; N148-A150 VanDerWaalsContact C-N 3.29Å; N148-A150 PolarHBondContact O-N 3.44Å; N148-S151 WeakPolarHBondContact O-CB 3.46Å; N148-S151 PolarHBondContact O-N 3.03Å; N148-S151 VanDerWaalsContact O-N 3.13Å; N148-S151 PolarHBondContact O-OG 2.87Å; N148-S151 PolarHBondContact OD1-OG 3.11Å; N148-W152 PolarHBondContact O-N 2.97Å; N148-W152 VanDerWaalsContact O-N 3.1Å
149A91.2Very high91.3Very high0 Ų047 Ų470%027%0.266CS..Hα-helixtrans-57.2-43.1176.900000112.1V90 L91 V94 T145 I146 S151 W152 L153 L171V90-A149 HydrophobicContact CG1-CB 3.76Å; L91-A149 HydrophobicContact CD2-CB 4.24Å; V94-A149 HydrophobicContact CG2-CB 4.37Å; T145-A149 PolarHBondContact O-N 3.05Å; I146-A149 WeakPolarHBondContact O-CB 3.44Å; I146-A149 PolarHBondContact O-N 3.46Å; I146-A149 VanDerWaalsContact O-N 3.13Å; A149-S151 VanDerWaalsContact C-N 3.34Å; A149-S151 PolarHBondContact O-N 2.96Å; A149-W152 WeakPolarHBondContact O-CB 3.5Å; A149-W152 PolarHBondContact O-N 3.25Å; A149-L153 WeakPolarHBondContact O-CG 3.25Å; A149-L153 PolarHBondContact O-N 3.47Å; A149-L171 HydrophobicContact CB-CD1 4.17Å
150A93.3Very high90.9Very high9 Ų953.3 Ų53.37%0.07430%0.299CS..Hα-helixtrans-62.2-41.5177.200000112I146 A147 N148 W152 L153 E154 R168 V172I146-A150 WeakPolarHBondContact O-CB 3.3Å; I146-A150 PolarHBondContact O-N 3.08Å; A147-A150 PolarHBondContact O-N 3.22Å; N148-A150 VanDerWaalsContact C-N 3.29Å; N148-A150 PolarHBondContact O-N 3.44Å; A150-W152 VanDerWaalsContact C-N 3.26Å; A150-W152 PolarHBondContact O-N 3.25Å; A150-L153 CarbonylContact O-C 3.59Å; A150-L153 PolarHBondContact O-N 3.14Å; A150-L153 VanDerWaalsContact O-N 3.11Å; A150-E154 WeakPolarHBondContact O-CG 3.47Å; A150-E154 PolarHBondContact O-N 3.38Å; A150-R168 HydrophobicContact CB-CG 3.87Å; A150-V172 HydrophobicContact CB-CG2 3.96Å
151S90.9Very high90.6Very high37 Ų3751.2 Ų51.226%0.25929%0.288SS..Hα-helixtrans-64.3-29.5176.584.40000113.4A147 N148 A149 R155A147-S151 PolarHBondContact O-N 3.15Å; N148-S151 WeakPolarHBondContact O-CB 3.46Å; N148-S151 PolarHBondContact O-N 3.03Å; N148-S151 VanDerWaalsContact O-N 3.13Å; N148-S151 PolarHBondContact O-OG 2.87Å; N148-S151 PolarHBondContact OD1-OG 3.11Å; A149-S151 VanDerWaalsContact C-N 3.34Å; A149-S151 PolarHBondContact O-N 2.96Å; S151-R155 WeakPolarHBondContact O-CG 3.45Å; S151-R155 PolarHBondContact O-NE 3.11Å
152W88.9Confident90.5Very high48 Ų4852.1 Ų52.118%0.18230%0.298CS..Hα-helixtrans-71-43.6171.4-86.492.1000111.2E85 L87 N148 A149 A150 E154 R155E85-W152 HydrophobicContact CB-CZ2 4.17Å; E85-W152 HydrophobicContact CG-CZ2 4.26Å; E85-W152 WeakPolarHBondContact O-CH2 3.3Å; E85-W152 WeakPolarHBondContact O-CZ2 3.48Å; E85-W152 PolarHBondContact OE2-NE1 3.47Å; E85-W152 VanDerWaalsContact OE2-NE1 3.11Å; L87-W152 HydrophobicContact CB-CE3 4.41Å; L87-W152 HydrophobicContact CD1-CB 3.88Å; N148-W152 PolarHBondContact O-N 2.97Å; N148-W152 VanDerWaalsContact O-N 3.1Å; A149-W152 WeakPolarHBondContact O-CB 3.5Å; A149-W152 PolarHBondContact O-N 3.25Å; A150-W152 VanDerWaalsContact C-N 3.26Å; A150-W152 PolarHBondContact O-N 3.25Å; W152-E154 PolarHBondContact O-N 3.05Å; W152-R155 WeakPolarHBondContact O-CB 3.34Å; W152-R155 PolarHBondContact O-N 3.47Å; W152-R155 VanDerWaalsContact O-N 3.15Å
153L90.3Very high90.1Very high0 Ų058.3 Ų58.30%033%0.325CS..Hα-helixtrans-71.1-17.2-179.5-65.8169.8000113.4L87 A149 A150 R155 F158 S159 M164 F167 R168 L171L87-L153 HydrophobicContact CD1-CD2 4.31Å; L87-L153 HydrophobicContact CD1-CG 4.36Å; L87-L153 HydrophobicContact CD2-CD2 3.86Å; A149-L153 WeakPolarHBondContact O-CG 3.25Å; A149-L153 PolarHBondContact O-N 3.47Å; A150-L153 CarbonylContact O-C 3.59Å; A150-L153 PolarHBondContact O-N 3.14Å; A150-L153 VanDerWaalsContact O-N 3.11Å; L153-R155 VanDerWaalsContact C-N 3.26Å; L153-F158 HydrophobicContact CD2-CB 4.3Å; L153-S159 WeakPolarHBondContact O-CA 3.42Å; L153-S159 PolarHBondContact O-N 3.39Å; L153-M164 HydrophobicContact CD2-CB 4.22Å; L153-M164 HydrophobicContact CD2-SD 3.91Å; L153-F167 HydrophobicContact CD1-CD1 3.78Å; L153-F167 HydrophobicContact CD1-CE1 4.28Å; L153-F167 HydrophobicContact CD2-CD1 4.43Å; L153-R168 HydrophobicContact CB-CB 3.97Å; L153-R168 HydrophobicContact CB-CG 4.19Å; L153-R168 HydrophobicContact CD1-CB 3.73Å; L153-R168 HydrophobicContact CD1-CG 4.31Å; L153-L171 HydrophobicContact CD1-CD1 4.33Å
154E90.4Very high89.7Confident117 Ų11755.6 Ų55.655%0.54731%0.312SS..THydrogen-bonded Turntrans-73.1-15.9170.8-82.6173.1-174.900113.9A150 W152 S159A150-E154 WeakPolarHBondContact O-CG 3.47Å; A150-E154 PolarHBondContact O-N 3.38Å; W152-E154 PolarHBondContact O-N 3.05Å; E154-S159 WeakPolarHBondContact O-CB 3.48Å; E154-S159 PolarHBondContact O-OG 3.33Å
155R85.8Confident89.6Confident81 Ų8154.3 Ų54.331%0.30630%0.301SS..SBendtrans-87.8141.1-176.5-59.4169.7-169-165.9-0.4110.8S151 W152 L153 F158 S159S151-R155 WeakPolarHBondContact O-CG 3.45Å; S151-R155 PolarHBondContact O-NE 3.11Å; W152-R155 WeakPolarHBondContact O-CB 3.34Å; W152-R155 PolarHBondContact O-N 3.47Å; W152-R155 VanDerWaalsContact O-N 3.15Å; L153-R155 VanDerWaalsContact C-N 3.26Å; R155-F158 WeakPolarHBondContact O-CA 3.19Å; R155-F158 WeakPolarHBondContact O-CB 3.43Å; R155-F158 PolarHBondContact O-N 2.82Å; R155-S159 PolarHBondContact O-N 2.88Å; R155-S159 VanDerWaalsContact O-N 3.13Å
156P81.6Confident89.5Confident97 Ų9758.4 Ų58.463%0.6333%0.326SS*.THydrogen-bonded Turntrans-58.5145.8166.5-24.134.7000111.3
157P82.9Confident89.4Confident80 Ų8058.4 Ų58.452%0.51933%0.325SS..THydrogen-bonded Turncis-81.1-9.81.733.7-35.6000113.9S159 L160 L161P157-S159 VanDerWaalsContact C-N 3.35Å; P157-S159 PolarHBondContact O-N 3.15Å; P157-L160 WeakPolarHBondContact O-CB 3.38Å; P157-L160 PolarHBondContact O-N 3.33Å; P157-L161 PolarHBondContact O-N 2.88Å
158F87.5Confident89.3Confident38 Ų3858.1 Ų58.117%0.16731%0.311CS..G310 helixtrans-58.7-42.5-172.1-52.5-64.1000113L87 L153 R155 L160 L161 M164 A215L87-F158 HydrophobicContact CD2-CD1 4.36Å; L87-F158 HydrophobicContact CD2-CE1 4.05Å; L87-F158 HydrophobicContact CD2-CE2 4.43Å; L87-F158 HydrophobicContact CD2-CZ 4.08Å; L153-F158 HydrophobicContact CD2-CB 4.3Å; R155-F158 WeakPolarHBondContact O-CA 3.19Å; R155-F158 WeakPolarHBondContact O-CB 3.43Å; R155-F158 PolarHBondContact O-N 2.82Å; F158-L160 PolarHBondContact O-N 3.43Å; F158-L160 VanDerWaalsContact O-N 3.09Å; F158-L161 PolarHBondContact O-N 3.48Å; F158-M164 HydrophobicContact CB-CB 4.21Å; F158-M164 HydrophobicContact CB-CG 4.26Å; F158-M164 HydrophobicContact CD1-CG 4.23Å; F158-M164 HydrophobicContact CD1-SD 4.45Å; F158-M164 VanDerWaalsContact O-CB 3.27Å; F158-M164 WeakPolarHBondContact O-CB 3.42Å; F158-A215 HydrophobicContact CE1-CB 4.33Å
159S88.8Confident89.5Confident37 Ų3760.5 Ų60.526%0.25932%0.321SS..G310 helixtrans-64.6-15.2177.751.50000114.6L153 E154 R155 P157 V165L153-S159 WeakPolarHBondContact O-CA 3.42Å; L153-S159 PolarHBondContact O-N 3.39Å; E154-S159 WeakPolarHBondContact O-CB 3.48Å; E154-S159 PolarHBondContact O-OG 3.33Å; R155-S159 PolarHBondContact O-N 2.88Å; R155-S159 VanDerWaalsContact O-N 3.13Å; P157-S159 VanDerWaalsContact C-N 3.35Å; P157-S159 PolarHBondContact O-N 3.15Å; S159-V165 WeakPolarHBondContact O-CG2 3.18Å
160L89.1Confident89.6Confident134 Ų13462 Ų6270%0.70233%0.328SS*.G310 helixtrans-93.2-9.6175.4-55.9176.9000112.8P157 F158 P162P157-L160 WeakPolarHBondContact O-CB 3.38Å; P157-L160 PolarHBondContact O-N 3.33Å; F158-L160 PolarHBondContact O-N 3.43Å; F158-L160 VanDerWaalsContact O-N 3.09Å; L160-P162 WeakPolarHBondContact O-CD 3.46Å
161L89.1Confident89.7Confident67 Ų6761.6 Ų61.635%0.35132%0.324SS..  trans-95112.8180-62.1176.9000109.4P157 F158 K163 M164 V165P157-L161 PolarHBondContact O-N 2.88Å; F158-L161 PolarHBondContact O-N 3.48Å; L161-K163 PolarHBondContact O-N 2.93Å; L161-K163 VanDerWaalsContact O-N 3.13Å; L161-M164 HydrophobicContact CB-CB 4.06Å; L161-M164 HydrophobicContact CB-CG 3.78Å; L161-M164 HydrophobicContact CD1-CG 4.01Å; L161-M164 WeakPolarHBondContact O-CB 3.13Å; L161-M164 PolarHBondContact O-N 3.28Å; L161-V165 PolarHBondContact O-N 3.35Å; L161-V165 VanDerWaalsContact O-N 3.15Å
162P90.2Very high89.9Confident103 Ų10362 Ų6267%0.66933%0.325SS*.Hα-helixtrans-53.9-39.2-176.3-29.135.8000113.9L160 M164 V165 V166L160-P162 WeakPolarHBondContact O-CD 3.46Å; P162-M164 VanDerWaalsContact C-N 3.31Å; P162-M164 PolarHBondContact O-N 3.18Å; P162-V165 PolarHBondContact O-N 3.5Å; P162-V166 WeakPolarHBondContact O-CG2 3.24Å; P162-V166 PolarHBondContact O-N 2.97Å
163K87.9Confident90.2Very high131 Ų13164.1 Ų64.157%0.5734%0.337SS*.Hα-helixtrans-60.4-37.6175.9-71.2-174.5173.3-172.30112.9L161 F167 F211 T214L161-K163 PolarHBondContact O-N 2.93Å; L161-K163 VanDerWaalsContact O-N 3.13Å; K163-F167 WeakPolarHBondContact O-CB 3.39Å; K163-F167 PolarHBondContact O-N 3.45Å; K163-F211 WeakPolarHBondContact O-CE1 3.41Å; K163-T214 HydrophobicContact CB-CG2 4.18Å; K163-T214 HydrophobicContact CD-CG2 3.79Å
164M88.7Confident90.4Very high1 Ų164.5 Ų64.51%0.00534%0.339CS..Hα-helixtrans-73.8-35.1179-66.4-60.7128.200111.9L153 F158 L161 P162 F167 R168 F211 T214 A215L153-M164 HydrophobicContact CD2-CB 4.22Å; L153-M164 HydrophobicContact CD2-SD 3.91Å; F158-M164 HydrophobicContact CB-CB 4.21Å; F158-M164 HydrophobicContact CB-CG 4.26Å; F158-M164 HydrophobicContact CD1-CG 4.23Å; F158-M164 HydrophobicContact CD1-SD 4.45Å; F158-M164 VanDerWaalsContact O-CB 3.27Å; F158-M164 WeakPolarHBondContact O-CB 3.42Å; L161-M164 HydrophobicContact CB-CB 4.06Å; L161-M164 HydrophobicContact CB-CG 3.78Å; L161-M164 HydrophobicContact CD1-CG 4.01Å; L161-M164 WeakPolarHBondContact O-CB 3.13Å; L161-M164 PolarHBondContact O-N 3.28Å; P162-M164 VanDerWaalsContact C-N 3.31Å; P162-M164 PolarHBondContact O-N 3.18Å; M164-F167 PolarHBondContact O-N 2.85Å; M164-R168 WeakPolarHBondContact O-CB 3.36Å; M164-R168 PolarHBondContact O-N 3.45Å; M164-F211 WeakPolarHBondContact CE-O 3.33Å; M164-T214 HydrophobicContact CE-CG2 3.5Å; M164-T214 VanDerWaalsContact CE-CG2 3.5Å; M164-A215 HydrophobicContact CE-CB 3.99Å; M164-A215 HydrophobicContact SD-CB 4.15Å
165V91.3Very high90.7Very high51 Ų5159 Ų5931%0.30931%0.314SS..Hα-helixtrans-63.1-45.2173.41780000110.6S159 L161 P162 R168 Q169S159-V165 WeakPolarHBondContact O-CG2 3.18Å; L161-V165 PolarHBondContact O-N 3.35Å; L161-V165 VanDerWaalsContact O-N 3.15Å; P162-V165 PolarHBondContact O-N 3.5Å; V165-R168 PolarHBondContact O-N 3.41Å; V165-Q169 PolarHBondContact O-N 2.87Å; V165-Q169 VanDerWaalsContact O-N 3.11Å
166V92.2Very high91.1Very high92 Ų9258.9 Ų58.956%0.55832%0.318SS*.Hα-helixtrans-62.2-45.1174.9173.30000110.9P162 R168 Q169 F170P162-V166 WeakPolarHBondContact O-CG2 3.24Å; P162-V166 PolarHBondContact O-N 2.97Å; V166-R168 VanDerWaalsContact C-N 3.35Å; V166-R168 PolarHBondContact O-N 3.2Å; V166-Q169 PolarHBondContact O-N 3.34Å; V166-F170 WeakPolarHBondContact O-CB 3.46Å; V166-F170 PolarHBondContact O-N 3.48Å
167F91.8Very high91.8Very high3 Ų356.8 Ų56.81%0.01330%0.302CS..Hα-helixtrans-60.9-42.3178.4-176.9-131.3000113.1L91 L153 K163 M164 Q169 F170 L171 F208 F211L91-F167 HydrophobicContact CD1-CE1 4.01Å; L91-F167 HydrophobicContact CD1-CZ 4.46Å; L91-F167 HydrophobicContact CD2-CE1 3.73Å; L91-F167 HydrophobicContact CD2-CZ 3.91Å; L153-F167 HydrophobicContact CD1-CD1 3.78Å; L153-F167 HydrophobicContact CD1-CE1 4.28Å; L153-F167 HydrophobicContact CD2-CD1 4.43Å; K163-F167 WeakPolarHBondContact O-CB 3.39Å; K163-F167 PolarHBondContact O-N 3.45Å; M164-F167 PolarHBondContact O-N 2.85Å; F167-Q169 VanDerWaalsContact C-N 3.33Å; F167-Q169 PolarHBondContact O-N 3.06Å; F167-F170 HydrophobicContact CD2-CD1 4.17Å; F167-F170 HydrophobicContact CE2-CD1 4.31Å; F167-F170 PolarHBondContact O-N 3.04Å; F167-L171 HydrophobicContact CD1-CD1 4.26Å; F167-L171 HydrophobicContact CD2-CG 4.3Å; F167-L171 HydrophobicContact CE1-CD1 3.76Å; F167-L171 HydrophobicContact CE1-CG 4.43Å; F167-L171 HydrophobicContact CE2-CD1 4.13Å; F167-L171 HydrophobicContact CE2-CD2 4.22Å; F167-L171 HydrophobicContact CE2-CG 3.91Å; F167-L171 HydrophobicContact CZ-CD1 3.7Å; F167-L171 HydrophobicContact CZ-CD2 4.28Å; F167-L171 HydrophobicContact CZ-CG 3.99Å; F167-L171 WeakPolarHBondContact O-CG 3.32Å; F167-L171 PolarHBondContact O-N 3.16Å; F167-F208 AromaticContact CE2-CD1 3.68Å; F167-F208 HydrophobicContact CE2-CD1 3.68Å; F167-F208 AromaticContact CE2-CE1 3.73Å; F167-F208 HydrophobicContact CE2-CE1 3.73Å; F167-F208 AromaticContact CZ-CD1 3.49Å; F167-F208 HydrophobicContact CZ-CD1 3.49Å; F167-F208 VanDerWaalsContact CZ-CD1 3.49Å; F167-F208 AromaticContact CZ-CE1 3.51Å; F167-F208 HydrophobicContact CZ-CE1 3.51Å; F167-F208 HydrophobicContact CZ-CG 4.48Å; F167-F208 HydrophobicContact CZ-CZ 4.49Å; F167-F211 HydrophobicContact CB-CD1 3.55Å; F167-F211 HydrophobicContact CB-CD2 4.16Å; F167-F211 HydrophobicContact CB-CE1 3.65Å; F167-F211 HydrophobicContact CB-CE2 4.26Å; F167-F211 HydrophobicContact CB-CG 3.82Å; F167-F211 HydrophobicContact CB-CZ 4.02Å; F167-F211 HydrophobicContact CD1-CB 4Å; F167-F211 HydrophobicContact CD1-CG 4.13Å; F167-F211 HydrophobicContact CD2-CB 4.03Å; F167-F211 HydrophobicContact CD2-CD1 4.08Å; F167-F211 AromaticContact CD2-CD2 3.08Å; F167-F211 HydrophobicContact CD2-CD2 3.08Å; F167-F211 HydrophobicContact CD2-CE1 4.34Å; F167-F211 AromaticContact CD2-CE2 3.43Å; F167-F211 HydrophobicContact CD2-CE2 3.43Å; F167-F211 VanDerWaalsContact CD2-CE2 3.43Å; F167-F211 AromaticContact CD2-CG 3.46Å; F167-F211 HydrophobicContact CD2-CG 3.46Å; F167-F211 VanDerWaalsContact CD2-CG 3.46Å; F167-F211 HydrophobicContact CD2-CZ 4.05Å; F167-F211 HydrophobicContact CE1-CB 4.16Å; F167-F211 HydrophobicContact CE2-CB 4.2Å; F167-F211 AromaticContact CE2-CD2 3.48Å; F167-F211 HydrophobicContact CE2-CD2 3.48Å; F167-F211 VanDerWaalsContact CE2-CD2 3.48Å; F167-F211 HydrophobicContact CE2-CE2 4.11Å; F167-F211 AromaticContact CE2-CG 4Å; F167-F211 HydrophobicContact CE2-CG 4Å; F167-F211 HydrophobicContact CG-CB 3.92Å; F167-F211 AromaticContact CG-CD1 3.83Å; F167-F211 HydrophobicContact CG-CD1 3.83Å; F167-F211 AromaticContact CG-CD2 3.69Å; F167-F211 HydrophobicContact CG-CD2 3.69Å; F167-F211 HydrophobicContact CG-CE1 4.25Å; F167-F211 HydrophobicContact CG-CE2 4.14Å; F167-F211 AromaticContact CG-CG 3.53Å; F167-F211 HydrophobicContact CG-CG 3.53Å; F167-F211 HydrophobicContact CG-CZ 4.39Å; F167-F211 HydrophobicContact CZ-CB 4.25Å; F167-F211 HydrophobicContact CZ-CD2 4.34Å
168R93Very high92.4Very high55 Ų5553 Ų5321%0.20828%0.277CS..Hα-helixtrans-57.8-48.5174.3-178.3-173.167.1-165.3-0.7110.8A150 L153 M164 V165 V166 F170 L171 V172A150-R168 HydrophobicContact CB-CG 3.87Å; L153-R168 HydrophobicContact CB-CB 3.97Å; L153-R168 HydrophobicContact CB-CG 4.19Å; L153-R168 HydrophobicContact CD1-CB 3.73Å; L153-R168 HydrophobicContact CD1-CG 4.31Å; M164-R168 WeakPolarHBondContact O-CB 3.36Å; M164-R168 PolarHBondContact O-N 3.45Å; V165-R168 PolarHBondContact O-N 3.41Å; V166-R168 VanDerWaalsContact C-N 3.35Å; V166-R168 PolarHBondContact O-N 3.2Å; R168-F170 VanDerWaalsContact C-N 3.35Å; R168-L171 PolarHBondContact O-N 3.43Å; R168-V172 WeakPolarHBondContact O-CG2 3.5Å; R168-V172 PolarHBondContact O-N 3.33Å
169Q94.6Very high92.8Very high89 Ų8953.3 Ų53.342%0.41628%0.28SS..Hα-helixtrans-60.8-47.4180-172.862.324.300110.8V165 V166 F167 L171 V172 E173V165-Q169 PolarHBondContact O-N 2.87Å; V165-Q169 VanDerWaalsContact O-N 3.11Å; V166-Q169 PolarHBondContact O-N 3.34Å; F167-Q169 VanDerWaalsContact C-N 3.33Å; F167-Q169 PolarHBondContact O-N 3.06Å; Q169-L171 PolarHBondContact O-N 3.18Å; Q169-V172 PolarHBondContact O-N 3.48Å; Q169-E173 HydrophobicContact CG-CG 4.32Å; Q169-E173 VanDerWaalsContact CG-OE1 3.31Å; Q169-E173 WeakPolarHBondContact CG-OE1 3.23Å; Q169-E173 PolarHBondContact NE2-OE1 2.95Å; Q169-E173 WeakPolarHBondContact O-CB 3.39Å; Q169-E173 WeakPolarHBondContact O-CG 3.38Å; Q169-E173 PolarHBondContact O-N 3.29Å
170F93.9Very high93.1Very high32 Ų3258.7 Ų58.714%0.1430%0.295CS..Hα-helixtrans-54.8-48175.9168.1-95.3000112.3V166 F167 R168 N174 E203 M204 N207V166-F170 WeakPolarHBondContact O-CB 3.46Å; V166-F170 PolarHBondContact O-N 3.48Å; F167-F170 HydrophobicContact CD2-CD1 4.17Å; F167-F170 HydrophobicContact CE2-CD1 4.31Å; F167-F170 PolarHBondContact O-N 3.04Å; R168-F170 VanDerWaalsContact C-N 3.35Å; F170-N174 VanDerWaalsContact CD2-ND2 3.27Å; F170-N174 WeakPolarHBondContact CD2-ND2 3.29Å; F170-N174 WeakPolarHBondContact CE2-ND2 3.49Å; F170-N174 WeakPolarHBondContact CZ-ND2 3.3Å; F170-N174 WeakPolarHBondContact O-CB 3.47Å; F170-N174 PolarHBondContact O-N 2.09Å; F170-N174 PolarHBondContact O-ND2 3.36Å; F170-E203 HydrophobicContact CE2-CG 4.17Å; F170-E203 HydrophobicContact CZ-CG 3.99Å; F170-M204 HydrophobicContact CE1-CG 4.16Å; F170-M204 HydrophobicContact CZ-CG 4.36Å; F170-N207 HydrophobicContact CE1-CB 4.13Å; F170-N207 HydrophobicContact CZ-CB 4.34Å; F170-N207 VanDerWaalsContact CZ-ND2 3.34Å; F170-N207 WeakPolarHBondContact CZ-ND2 3.44Å
171L94.4Very high93.3Very high0 Ų053.2 Ų53.20%027%0.266CS..Hα-helixtrans-60.4-48.4177.5-79.9180000112L91 V94 I146 A149 L153 F167 R168 Q169 N174 A175 M204 F208L91-L171 HydrophobicContact CD2-CD1 4.07Å; V94-L171 HydrophobicContact CG1-CD2 4.36Å; I146-L171 HydrophobicContact CD1-CD2 4.49Å; I146-L171 HydrophobicContact CG2-CB 4.04Å; A149-L171 HydrophobicContact CB-CD1 4.17Å; L153-L171 HydrophobicContact CD1-CD1 4.33Å; F167-L171 HydrophobicContact CD1-CD1 4.26Å; F167-L171 HydrophobicContact CD2-CG 4.3Å; F167-L171 HydrophobicContact CE1-CD1 3.76Å; F167-L171 HydrophobicContact CE1-CG 4.43Å; F167-L171 HydrophobicContact CE2-CD1 4.13Å; F167-L171 HydrophobicContact CE2-CD2 4.22Å; F167-L171 HydrophobicContact CE2-CG 3.91Å; F167-L171 HydrophobicContact CZ-CD1 3.7Å; F167-L171 HydrophobicContact CZ-CD2 4.28Å; F167-L171 HydrophobicContact CZ-CG 3.99Å; F167-L171 WeakPolarHBondContact O-CG 3.32Å; F167-L171 PolarHBondContact O-N 3.16Å; R168-L171 PolarHBondContact O-N 3.43Å; Q169-L171 PolarHBondContact O-N 3.18Å; L171-N174 PolarHBondContact O-N 2.91Å; L171-A175 WeakPolarHBondContact O-CB 3.41Å; L171-A175 PolarHBondContact O-N 3.12Å; L171-M204 HydrophobicContact CD2-CG 4.48Å; L171-F208 HydrophobicContact CD2-CE1 3.65Å; L171-F208 HydrophobicContact CD2-CZ 3.95Å
172V95.8Very high93.6Very high46 Ų4650 Ų5028%0.27925%0.25SC..Hα-helixtrans-64.1-44.2-178.2170.90000111I146 A150 R168 Q169 A175 I176I146-V172 HydrophobicContact CG2-CG2 4.38Å; A150-V172 HydrophobicContact CB-CG2 3.96Å; R168-V172 WeakPolarHBondContact O-CG2 3.5Å; R168-V172 PolarHBondContact O-N 3.33Å; Q169-V172 PolarHBondContact O-N 3.48Å; V172-A175 PolarHBondContact O-N 2.99Å; V172-I176 HydrophobicContact CG1-CD1 3.83Å; V172-I176 VanDerWaalsContact O-CG1 3.28Å; V172-I176 WeakPolarHBondContact O-CG1 3.36Å; V172-I176 PolarHBondContact O-N 3.43Å
173E95.8Very high93.7Very high92 Ų9249.9 Ų49.943%0.4324%0.24SC..Hα-helixtrans-61.7-48.6177.4-74.4174.8177.100111.7Q169 A175 I176 I177Q169-E173 HydrophobicContact CG-CG 4.32Å; Q169-E173 VanDerWaalsContact CG-OE1 3.31Å; Q169-E173 WeakPolarHBondContact CG-OE1 3.23Å; Q169-E173 PolarHBondContact NE2-OE1 2.95Å; Q169-E173 WeakPolarHBondContact O-CB 3.39Å; Q169-E173 WeakPolarHBondContact O-CG 3.38Å; Q169-E173 PolarHBondContact O-N 3.29Å; E173-A175 VanDerWaalsContact C-N 3.3Å; E173-A175 PolarHBondContact O-N 3.27Å; E173-I176 PolarHBondContact O-N 3.07Å; E173-I177 VanDerWaalsContact O-CG1 3.3Å; E173-I177 WeakPolarHBondContact O-CG1 3.28Å; E173-I177 PolarHBondContact O-N 3.18Å
174N94.5Very high93.9Very high8 Ų848.3 Ų48.34%0.04323%0.234CC..Hα-helixtrans-62.6-36.5178.7-85.5-90.8000112.6F170 L171 T178 Y200 M204F170-N174 VanDerWaalsContact CD2-ND2 3.27Å; F170-N174 WeakPolarHBondContact CD2-ND2 3.29Å; F170-N174 WeakPolarHBondContact CE2-ND2 3.49Å; F170-N174 WeakPolarHBondContact CZ-ND2 3.3Å; F170-N174 WeakPolarHBondContact O-CB 3.47Å; F170-N174 PolarHBondContact O-N 2.09Å; F170-N174 PolarHBondContact O-ND2 3.36Å; L171-N174 PolarHBondContact O-N 2.91Å; N174-T178 VanDerWaalsContact O-CB 3.24Å; N174-T178 WeakPolarHBondContact O-CB 3.32Å; N174-T178 PolarHBondContact O-N 3.5Å; N174-T178 PolarHBondContact O-OG1 3.04Å; N174-Y200 WeakPolarHBondContact OD1-CD1 3.33Å; N174-M204 HydrophobicContact CB-CE 4.08Å; N174-M204 HydrophobicContact CB-CG 3.56Å; N174-M204 HydrophobicContact CB-SD 3.58Å; N174-M204 VanDerWaalsContact CB-SD 3.58Å
175A95Very high94Very high3 Ų348.3 Ų48.33%0.02524%0.235CC..Hα-helixtrans-62.4-47.4174.300000111.2M143 I146 L171 V172 E173 T178 N179M143-A175 HydrophobicContact SD-CB 3.53Å; M143-A175 VanDerWaalsContact SD-CB 3.53Å; I146-A175 HydrophobicContact CB-CB 4.24Å; I146-A175 HydrophobicContact CD1-CB 3.56Å; I146-A175 HydrophobicContact CG1-CB 4.48Å; I146-A175 HydrophobicContact CG2-CB 3.96Å; L171-A175 WeakPolarHBondContact O-CB 3.41Å; L171-A175 PolarHBondContact O-N 3.12Å; V172-A175 PolarHBondContact O-N 2.99Å; E173-A175 VanDerWaalsContact C-N 3.3Å; E173-A175 PolarHBondContact O-N 3.27Å; A175-T178 PolarHBondContact O-N 2.85Å; A175-N179 WeakPolarHBondContact O-CB 3.49Å; A175-N179 PolarHBondContact O-N 3.36Å
176I96Very high93.9Very high77 Ų7749.2 Ų49.240%0.39524%0.237SC..Hα-helixtrans-62.8-45179.1-69.2166.2000110.9V172 E173 N179 R180V172-I176 HydrophobicContact CG1-CD1 3.83Å; V172-I176 VanDerWaalsContact O-CG1 3.28Å; V172-I176 WeakPolarHBondContact O-CG1 3.36Å; V172-I176 PolarHBondContact O-N 3.43Å; E173-I176 PolarHBondContact O-N 3.07Å; I176-N179 PolarHBondContact O-N 2.96Å; I176-R180 WeakPolarHBondContact O-CB 3.31Å; I176-R180 PolarHBondContact O-N 2.97Å
177I95.6Very high93.8Very high54 Ų5449.4 Ų49.428%0.27724%0.243SC..Hα-helixtrans-62.6-47.8178.3-66.7164.4000110.1E173 N179 R180 L181 Y200E173-I177 VanDerWaalsContact O-CG1 3.3Å; E173-I177 WeakPolarHBondContact O-CG1 3.28Å; E173-I177 PolarHBondContact O-N 3.18Å; I177-N179 VanDerWaalsContact C-N 3.32Å; I177-N179 PolarHBondContact O-N 3.17Å; I177-R180 PolarHBondContact O-N 3.02Å; I177-R180 VanDerWaalsContact O-N 3.09Å; I177-L181 HydrophobicContact CG2-CD1 3.84Å; I177-L181 HydrophobicContact CG2-CG 4.24Å; I177-L181 WeakPolarHBondContact O-CG 3.34Å; I177-L181 PolarHBondContact O-N 3.13Å; I177-Y200 HydrophobicContact CB-CE1 4.42Å; I177-Y200 HydrophobicContact CD1-CE1 4.19Å; I177-Y200 HydrophobicContact CG2-CD1 3.97Å; I177-Y200 HydrophobicContact CG2-CD2 4.26Å; I177-Y200 HydrophobicContact CG2-CE1 3.59Å; I177-Y200 HydrophobicContact CG2-CE2 3.95Å; I177-Y200 HydrophobicContact CG2-CG 4.28Å
178T95.4Very high93.7Very high0 Ų051.9 Ų51.90%026%0.264CS..Hα-helixtrans-55.5-46.1176.5-64.80000111.8I139 L142 N174 A175 S182 I197I139-T178 HydrophobicContact CD1-CG2 4.03Å; I139-T178 HydrophobicContact CG1-CG2 3.95Å; I139-T178 HydrophobicContact CG2-CG2 4.2Å; L142-T178 HydrophobicContact CD2-CG2 4.02Å; N174-T178 VanDerWaalsContact O-CB 3.24Å; N174-T178 WeakPolarHBondContact O-CB 3.32Å; N174-T178 PolarHBondContact O-N 3.5Å; N174-T178 PolarHBondContact O-OG1 3.04Å; A175-T178 PolarHBondContact O-N 2.85Å; T178-S182 PolarHBondContact O-N 3.23Å; T178-S182 VanDerWaalsContact O-N 3.1Å; T178-I197 HydrophobicContact CG2-CG2 3.51Å
179N95.3Very high93.4Very high44 Ų4457.9 Ų57.924%0.23529%0.294CS..Hα-helixtrans-67.9-38.2177-17453.5000112.3I139 M143 A175 I176 I177 S182 Q183I139-N179 HydrophobicContact CG2-CB 4.08Å; M143-N179 HydrophobicContact CG-CB 4.4Å; M143-N179 HydrophobicContact SD-CB 3.96Å; A175-N179 WeakPolarHBondContact O-CB 3.49Å; A175-N179 PolarHBondContact O-N 3.36Å; I176-N179 PolarHBondContact O-N 2.96Å; I177-N179 VanDerWaalsContact C-N 3.32Å; I177-N179 PolarHBondContact O-N 3.17Å; N179-S182 PolarHBondContact O-N 2.86Å; N179-S182 PolarHBondContact O-OG 2.8Å; N179-Q183 WeakPolarHBondContact O-CG 3.28Å; N179-Q183 PolarHBondContact O-N 3.41Å; N179-Q183 VanDerWaalsContact O-N 3.09Å
180R94.7Very high93.1Very high151 Ų15155.6 Ų55.657%0.5729%0.287SS*.Hα-helixtrans-63.3-47.1176.9-176.6-177.4-65.5169.70.2111.4I176 I177 S182 Q183 Q184I176-R180 WeakPolarHBondContact O-CB 3.31Å; I176-R180 PolarHBondContact O-N 2.97Å; I177-R180 PolarHBondContact O-N 3.02Å; I177-R180 VanDerWaalsContact O-N 3.09Å; R180-S182 VanDerWaalsContact C-N 3.28Å; R180-S182 PolarHBondContact O-N 3.25Å; R180-Q183 PolarHBondContact O-N 2.79Å; R180-Q184 WeakPolarHBondContact O-CG 3.28Å; R180-Q184 PolarHBondContact O-N 3.28Å
181L94.8Very high92.7Very high19 Ų1955.6 Ų55.610%0.09929%0.289CS..Hα-helixtrans-60.8-38.5178.2-70.8172.7000111.3I177 Q184 A185 E196 I197 Y200I177-L181 HydrophobicContact CG2-CD1 3.84Å; I177-L181 HydrophobicContact CG2-CG 4.24Å; I177-L181 WeakPolarHBondContact O-CG 3.34Å; I177-L181 PolarHBondContact O-N 3.13Å; L181-Q184 PolarHBondContact O-N 3.42Å; L181-A185 WeakPolarHBondContact O-CB 3.43Å; L181-A185 PolarHBondContact O-N 2.73Å; L181-E196 HydrophobicContact CD1-CB 4.31Å; L181-I197 HydrophobicContact CB-CD1 4.12Å; L181-I197 HydrophobicContact CB-CG1 3.72Å; L181-I197 HydrophobicContact CD1-CG1 4.2Å; L181-Y200 HydrophobicContact CD1-CD2 3.72Å; L181-Y200 HydrophobicContact CD1-CE2 3.42Å; L181-Y200 VanDerWaalsContact CD1-CE2 3.42Å
182S94.3Very high92.3Very high0 Ų060 Ų600%031%0.31CS..Hα-helixtrans-66.5-40.8176.575.10000112.8T178 N179 R180 Q184 A185 I186T178-S182 PolarHBondContact O-N 3.23Å; T178-S182 VanDerWaalsContact O-N 3.1Å; N179-S182 PolarHBondContact O-N 2.86Å; N179-S182 PolarHBondContact O-OG 2.8Å; R180-S182 VanDerWaalsContact C-N 3.28Å; R180-S182 PolarHBondContact O-N 3.25Å; S182-Q184 VanDerWaalsContact C-N 3.31Å; S182-Q184 PolarHBondContact O-N 3.17Å; S182-A185 PolarHBondContact O-N 2.91Å; S182-I186 WeakPolarHBondContact O-CG1 3.47Å; S182-I186 PolarHBondContact O-N 2.88Å
183Q92.4Very high91.9Very high100 Ų10061.2 Ų61.247%0.46731%0.312SS..Hα-helixtrans-64.1-38.5173.6-63.4-50.4-55.200111.7N179 R180 I186 S187N179-Q183 WeakPolarHBondContact O-CG 3.28Å; N179-Q183 PolarHBondContact O-N 3.41Å; N179-Q183 VanDerWaalsContact O-N 3.09Å; R180-Q183 PolarHBondContact O-N 2.79Å; Q183-I186 PolarHBondContact O-N 3.31Å; Q183-S187 WeakPolarHBondContact O-CB 3.42Å; Q183-S187 PolarHBondContact O-N 2.98Å; Q183-S187 PolarHBondContact O-OG 3Å
184Q92.3Very high91.8Very high97 Ų9756.9 Ų56.945%0.45329%0.292SS..Hα-helixtrans-64.5-46.2176.4-75.1175-31.500111.9R180 L181 S182 I186 S187 A188R180-Q184 WeakPolarHBondContact O-CG 3.28Å; R180-Q184 PolarHBondContact O-N 3.28Å; L181-Q184 PolarHBondContact O-N 3.42Å; S182-Q184 VanDerWaalsContact C-N 3.31Å; S182-Q184 PolarHBondContact O-N 3.17Å; Q184-I186 VanDerWaalsContact C-N 3.28Å; Q184-I186 PolarHBondContact O-N 3.23Å; Q184-S187 WeakPolarHBondContact CA-OG 3.12Å; Q184-S187 PolarHBondContact O-N 3.01Å; Q184-S187 VanDerWaalsContact O-N 3.15Å; Q184-S187 PolarHBondContact O-OG 3.1Å; Q184-A188 WeakPolarHBondContact O-CB 3.41Å; Q184-A188 PolarHBondContact O-N 3.18Å
185A90.9Very high91.7Very high1 Ų162.4 Ų62.41%0.00832%0.315CS..Hα-helixtrans-55.4-43.5176.500000112L181 S182 Q189 C190 H193 F194L181-A185 WeakPolarHBondContact O-CB 3.43Å; L181-A185 PolarHBondContact O-N 2.73Å; S182-A185 PolarHBondContact O-N 2.91Å; A185-Q189 PolarHBondContact O-N 3.16Å; A185-Q189 VanDerWaalsContact O-N 3.16Å; A185-C190 PolarHBondContact O-N 2.87Å; A185-C190 VanDerWaalsContact O-N 3.16Å; A185-H193 HydrophobicContact CB-CB 3.75Å; A185-F194 HydrophobicContact CB-CD1 4Å; A185-F194 HydrophobicContact CB-CD2 4.03Å; A185-F194 HydrophobicContact CB-CE1 3.93Å; A185-F194 HydrophobicContact CB-CE2 3.95Å; A185-F194 HydrophobicContact CB-CG 4.06Å; A185-F194 HydrophobicContact CB-CZ 3.9Å
186I89.4Confident91.6Very high71 Ų7166.7 Ų66.736%0.36434%0.335SS..Hα-helixtrans-65.9-48175.5-64.5-67.2000111.5A132 L136 S182 Q183 Q184 A188 Q189 F194A132-I186 HydrophobicContact CB-CD1 4.33Å; L136-I186 HydrophobicContact CD1-CD1 4.08Å; L136-I186 HydrophobicContact CD1-CG1 4.13Å; L136-I186 HydrophobicContact CD2-CG1 4.3Å; S182-I186 WeakPolarHBondContact O-CG1 3.47Å; S182-I186 PolarHBondContact O-N 2.88Å; Q183-I186 PolarHBondContact O-N 3.31Å; Q184-I186 VanDerWaalsContact C-N 3.28Å; Q184-I186 PolarHBondContact O-N 3.23Å; I186-A188 VanDerWaalsContact C-N 3.29Å; I186-A188 PolarHBondContact O-N 3.15Å; I186-Q189 PolarHBondContact O-N 3.14Å; I186-F194 HydrophobicContact CD1-CE2 4.44Å; I186-F194 HydrophobicContact CD1-CZ 3.89Å; I186-F194 HydrophobicContact CG1-CZ 4.13Å
187S90.1Very high91.6Very high96 Ų9663 Ų6367%0.67132%0.316SS*.Hα-helixtrans-63.5-34.8-178.371.20000113.1Q183 Q184 Q189Q183-S187 WeakPolarHBondContact O-CB 3.42Å; Q183-S187 PolarHBondContact O-N 2.98Å; Q183-S187 PolarHBondContact O-OG 3Å; Q184-S187 WeakPolarHBondContact CA-OG 3.12Å; Q184-S187 PolarHBondContact O-N 3.01Å; Q184-S187 VanDerWaalsContact O-N 3.15Å; Q184-S187 PolarHBondContact O-OG 3.1Å; S187-Q189 VanDerWaalsContact C-N 3.29Å
188A90.6Very high91.6Very high55 Ų5561.8 Ų61.846%0.45531%0.31SS..THydrogen-bonded Turntrans-82.6-7.4177.200000112.9Q184 I186 C190Q184-A188 WeakPolarHBondContact O-CB 3.41Å; Q184-A188 PolarHBondContact O-N 3.18Å; I186-A188 VanDerWaalsContact C-N 3.29Å; I186-A188 PolarHBondContact O-N 3.15Å; A188-C190 HydrophobicContact CB-CB 4.24Å; A188-C190 PolarHBondContact O-N 3.06Å; A188-C190 VanDerWaalsContact O-N 3.14Å
189Q86Confident91.5Very high180 Ų18066.8 Ų66.884%0.84134%0.336SS*.THydrogen-bonded Turntrans50.934-173.3-56.81806.700112.7A185 I186 S187A185-Q189 PolarHBondContact O-N 3.16Å; A185-Q189 VanDerWaalsContact O-N 3.16Å; I186-Q189 PolarHBondContact O-N 3.14Å; S187-Q189 VanDerWaalsContact C-N 3.29Å
190C87.4Confident91.5Very high42 Ų4268.1 Ų68.128%0.28434%0.339SS..  trans-121.8105-175.7-175.80000109.4A185 A188 E192 H193A185-C190 PolarHBondContact O-N 2.87Å; A185-C190 VanDerWaalsContact O-N 3.16Å; A188-C190 HydrophobicContact CB-CB 4.24Å; A188-C190 PolarHBondContact O-N 3.06Å; A188-C190 VanDerWaalsContact O-N 3.14Å; C190-E192 VanDerWaalsContact C-N 3.25Å; C190-E192 PolarHBondContact O-N 3.36Å; C190-H193 PolarHBondContact O-N 3.16Å
191N85.8Confident91.4Very high32 Ų3261 Ų6117%0.17131%0.312CS..G310 helixtrans-65.8-28-176.6-68.2-39.6000112.8L108 M109 I128 H193 F194L108-N191 HydrophobicContact CD2-CB 4.03Å; L108-N191 HydrophobicContact CG-CB 4.35Å; M109-N191 HydrophobicContact CE-CB 4.22Å; M109-N191 WeakPolarHBondContact CE-O 3.37Å; I128-N191 WeakPolarHBondContact CG2-ND2 3.16Å; N191-H193 PolarHBondContact O-N 2.89Å; N191-F194 WeakPolarHBondContact O-CB 3.48Å; N191-F194 WeakPolarHBondContact O-CD2 3.3Å; N191-F194 PolarHBondContact O-N 3.42Å
192E85.4Confident91.3Very high93 Ų9361 Ų6144%0.43531%0.312SS..G310 helixtrans-61.2-28.5178.5-70.1-62.4135.600112.4C190 F194 K195C190-E192 VanDerWaalsContact C-N 3.25Å; C190-E192 PolarHBondContact O-N 3.36Å; E192-F194 PolarHBondContact O-N 2.79Å; E192-K195 WeakPolarHBondContact O-CB 3.38Å; E192-K195 PolarHBondContact O-N 3.42Å
193H88.8Confident91.1Very high71 Ų7165.3 Ų65.333%0.32933%0.333SS..G310 helixtrans-63.8-20.8175.9-64.8153.1000113.2A185 C190 N191 K195 E196A185-H193 HydrophobicContact CB-CB 3.75Å; C190-H193 PolarHBondContact O-N 3.16Å; N191-H193 PolarHBondContact O-N 2.89Å; H193-K195 PolarHBondContact O-N 3.35Å; H193-E196 IonicContact CD2-OE1 3.71Å; H193-E196 PolarHBondContact O-N 3.21Å
194F92.5Very high91Very high0 Ų060.5 Ų60.50%031%0.31CS..G310 helixtrans-63.4-25.2172-75.7-65.9000112.2I105 L108 A132 I135 A185 I186 N191 E192 E196 I197I105-F194 WeakPolarHBondContact CD1-O 3.22Å; I105-F194 HydrophobicContact CG1-CB 4.21Å; I105-F194 HydrophobicContact CG2-CB 4.16Å; L108-F194 HydrophobicContact CD2-CB 4.49Å; L108-F194 HydrophobicContact CD2-CD2 3.42Å; L108-F194 VanDerWaalsContact CD2-CD2 3.42Å; L108-F194 HydrophobicContact CD2-CE2 3.93Å; L108-F194 HydrophobicContact CD2-CG 4.21Å; A132-F194 HydrophobicContact CB-CE2 4.23Å; A132-F194 HydrophobicContact CB-CZ 4.43Å; I135-F194 HydrophobicContact CD1-CD2 4.45Å; I135-F194 HydrophobicContact CD1-CG 4.35Å; I135-F194 HydrophobicContact CG2-CD1 3.84Å; I135-F194 HydrophobicContact CG2-CE1 3.8Å; A185-F194 HydrophobicContact CB-CD1 4Å; A185-F194 HydrophobicContact CB-CD2 4.03Å; A185-F194 HydrophobicContact CB-CE1 3.93Å; A185-F194 HydrophobicContact CB-CE2 3.95Å; A185-F194 HydrophobicContact CB-CG 4.06Å; A185-F194 HydrophobicContact CB-CZ 3.9Å; I186-F194 HydrophobicContact CD1-CE2 4.44Å; I186-F194 HydrophobicContact CD1-CZ 3.89Å; I186-F194 HydrophobicContact CG1-CZ 4.13Å; N191-F194 WeakPolarHBondContact O-CB 3.48Å; N191-F194 WeakPolarHBondContact O-CD2 3.3Å; N191-F194 PolarHBondContact O-N 3.42Å; E192-F194 PolarHBondContact O-N 2.79Å; F194-E196 PolarHBondContact O-N 3.29Å; F194-I197 HydrophobicContact CD1-CD1 3.82Å; F194-I197 VanDerWaalsContact O-CB 3.28Å; F194-I197 WeakPolarHBondContact O-CB 3.44Å; F194-I197 PolarHBondContact O-N 3.38Å; F194-I197 VanDerWaalsContact O-N 3.07Å
195K93.4Very high90.7Very high125 Ų12558.1 Ų58.154%0.54330%0.302SS..G310 helixtrans-60.7-34.9-178.5-169.3178.2176.1-175.10112.5E192 H193 I197 I198E192-K195 WeakPolarHBondContact O-CB 3.38Å; E192-K195 PolarHBondContact O-N 3.42Å; H193-K195 PolarHBondContact O-N 3.35Å; K195-I197 PolarHBondContact O-N 2.89Å; K195-I198 HydrophobicContact CG-CD1 4.43Å; K195-I198 VanDerWaalsContact O-CB 3.3Å; K195-I198 WeakPolarHBondContact O-CB 3.41Å; K195-I198 WeakPolarHBondContact O-CG1 3.5Å; K195-I198 PolarHBondContact O-N 2.94Å
196E93.6Very high90.3Very high93 Ų9365.9 Ų65.944%0.43533%0.333SS..Hα-helixtrans-59.3-28.3177.2-64.1175.6-141.800112.4L181 H193 F194 I198 D199 Y200L181-E196 HydrophobicContact CD1-CB 4.31Å; H193-E196 IonicContact CD2-OE1 3.71Å; H193-E196 PolarHBondContact O-N 3.21Å; F194-E196 PolarHBondContact O-N 3.29Å; E196-I198 PolarHBondContact O-N 3.34Å; E196-D199 PolarHBondContact O-N 3.24Å; E196-Y200 VanDerWaalsContact O-CD2 3.27Å; E196-Y200 WeakPolarHBondContact O-CD2 3.18Å
197I95.6Very high89.6Confident0 Ų064.2 Ų64.20%032%0.324CS..Hα-helixtrans-67-26.6178.8-60.3178.9000111.8I101 I105 I139 T178 L181 F194 K195 D199 Y200 A201I101-I197 HydrophobicContact CG2-CG2 3.73Å; I105-I197 HydrophobicContact CD1-CB 3.91Å; I105-I197 HydrophobicContact CD1-CG2 4.06Å; I139-I197 HydrophobicContact CD1-CD1 3.89Å; T178-I197 HydrophobicContact CG2-CG2 3.51Å; L181-I197 HydrophobicContact CB-CD1 4.12Å; L181-I197 HydrophobicContact CB-CG1 3.72Å; L181-I197 HydrophobicContact CD1-CG1 4.2Å; F194-I197 HydrophobicContact CD1-CD1 3.82Å; F194-I197 VanDerWaalsContact O-CB 3.28Å; F194-I197 WeakPolarHBondContact O-CB 3.44Å; F194-I197 PolarHBondContact O-N 3.38Å; F194-I197 VanDerWaalsContact O-N 3.07Å; K195-I197 PolarHBondContact O-N 2.89Å; I197-D199 VanDerWaalsContact C-N 3.26Å; I197-D199 PolarHBondContact O-N 3.21Å; I197-Y200 PolarHBondContact O-N 3.36Å; I197-A201 WeakPolarHBondContact O-CB 3.31Å; I197-A201 PolarHBondContact O-N 3.24Å
198I95.3Very high88.9Confident28 Ų2859.7 Ų59.714%0.14429%0.293CS..Hα-helixtrans-58.7-41.7-178.6-66.1179.5000110.3I102 I105 K195 E196 Y200 A201 V202I102-I198 HydrophobicContact CG1-CG2 4.35Å; I105-I198 HydrophobicContact CB-CD1 4.28Å; I105-I198 HydrophobicContact CB-CG1 4.28Å; I105-I198 HydrophobicContact CD1-CG1 3.93Å; I105-I198 HydrophobicContact CG2-CD1 3.75Å; I105-I198 HydrophobicContact CG2-CG1 4Å; K195-I198 HydrophobicContact CG-CD1 4.43Å; K195-I198 VanDerWaalsContact O-CB 3.3Å; K195-I198 WeakPolarHBondContact O-CB 3.41Å; K195-I198 WeakPolarHBondContact O-CG1 3.5Å; K195-I198 PolarHBondContact O-N 2.94Å; E196-I198 PolarHBondContact O-N 3.34Å; I198-Y200 PolarHBondContact O-N 2.99Å; I198-A201 PolarHBondContact O-N 3.18Å; I198-V202 HydrophobicContact CG2-CG2 4.12Å; I198-V202 WeakPolarHBondContact O-CB 3.49Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.36Å; I198-V202 PolarHBondContact O-N 3.3Å
199D93.8Very high87.7Confident104 Ų10459.3 Ų59.356%0.55629%0.285SS*.Hα-helixtrans-63.5-45.5-176.5-65.8-28.8000111.3E196 I197 A201 V202 E203E196-D199 PolarHBondContact O-N 3.24Å; I197-D199 VanDerWaalsContact C-N 3.26Å; I197-D199 PolarHBondContact O-N 3.21Å; D199-A201 PolarHBondContact O-N 3.05Å; D199-V202 PolarHBondContact O-N 3.37Å; D199-E203 WeakPolarHBondContact O-CB 3.24Å; D199-E203 PolarHBondContact O-N 2.85Å
200Y93.9Very high86.9Confident73 Ų7355.6 Ų55.629%0.28627%0.271SS..Hα-helixtrans-65.2-39.9175.2-60.5-82.6000112.4N174 I177 L181 E196 I197 I198 V202 E203 M204N174-Y200 WeakPolarHBondContact OD1-CD1 3.33Å; I177-Y200 HydrophobicContact CB-CE1 4.42Å; I177-Y200 HydrophobicContact CD1-CE1 4.19Å; I177-Y200 HydrophobicContact CG2-CD1 3.97Å; I177-Y200 HydrophobicContact CG2-CD2 4.26Å; I177-Y200 HydrophobicContact CG2-CE1 3.59Å; I177-Y200 HydrophobicContact CG2-CE2 3.95Å; I177-Y200 HydrophobicContact CG2-CG 4.28Å; L181-Y200 HydrophobicContact CD1-CD2 3.72Å; L181-Y200 HydrophobicContact CD1-CE2 3.42Å; L181-Y200 VanDerWaalsContact CD1-CE2 3.42Å; E196-Y200 VanDerWaalsContact O-CD2 3.27Å; E196-Y200 WeakPolarHBondContact O-CD2 3.18Å; I197-Y200 PolarHBondContact O-N 3.36Å; I198-Y200 PolarHBondContact O-N 2.99Å; Y200-V202 VanDerWaalsContact C-N 3.34Å; Y200-V202 PolarHBondContact O-N 3.48Å; Y200-E203 PolarHBondContact O-N 2.93Å; Y200-M204 WeakPolarHBondContact O-CE 3.34Å; Y200-M204 WeakPolarHBondContact O-CG 3.33Å; Y200-M204 PolarHBondContact O-N 3.03Å
201A93.6Very high85.9Confident0 Ų055.2 Ų55.20%027%0.265CS..Hα-helixtrans-62.1-42.4175.800000111.7C98 I102 I197 I198 D199 T205C98-A201 HydrophobicContact CB-CB 4.13Å; C98-A201 WeakPolarHBondContact CB-O 3.29Å; I102-A201 HydrophobicContact CD1-CB 3.95Å; I102-A201 HydrophobicContact CG1-CB 3.78Å; I197-A201 WeakPolarHBondContact O-CB 3.31Å; I197-A201 PolarHBondContact O-N 3.24Å; I198-A201 PolarHBondContact O-N 3.18Å; D199-A201 PolarHBondContact O-N 3.05Å; A201-T205 WeakPolarHBondContact O-CG2 3.46Å; A201-T205 PolarHBondContact O-N 2.92Å
202V92.2Very high84.9Confident19 Ų1953.8 Ų53.812%0.11526%0.257CS..Hα-helixtrans-66.6-47.7175.61700000110.4I102 I198 D199 Y200 M204 T205 Y206 P227I102-V202 HydrophobicContact CD1-CG2 3.76Å; I198-V202 HydrophobicContact CG2-CG2 4.12Å; I198-V202 WeakPolarHBondContact O-CB 3.49Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.36Å; I198-V202 PolarHBondContact O-N 3.3Å; D199-V202 PolarHBondContact O-N 3.37Å; Y200-V202 VanDerWaalsContact C-N 3.34Å; Y200-V202 PolarHBondContact O-N 3.48Å; V202-M204 VanDerWaalsContact C-N 3.32Å; V202-M204 PolarHBondContact O-N 3.35Å; V202-T205 PolarHBondContact O-N 2.93Å; V202-T205 PolarHBondContact O-OG1 3.33Å; V202-Y206 PolarHBondContact O-N 3.05Å; V202-P227 HydrophobicContact CG1-CG 4.27Å
203E90.5Very high83.9Confident91 Ų9157 Ų5743%0.42527%0.273SS..Hα-helixtrans-59.4-42.7-178.7-166.5-177.4168.500111.9F170 D199 Y200 T205 Y206 N207F170-E203 HydrophobicContact CE2-CG 4.17Å; F170-E203 HydrophobicContact CZ-CG 3.99Å; D199-E203 WeakPolarHBondContact O-CB 3.24Å; D199-E203 PolarHBondContact O-N 2.85Å; Y200-E203 PolarHBondContact O-N 2.93Å; E203-T205 VanDerWaalsContact C-N 3.32Å; E203-T205 PolarHBondContact O-N 3.15Å; E203-Y206 PolarHBondContact O-N 3.22Å; E203-N207 PolarHBondContact O-N 3.46Å; E203-N207 PolarHBondContact O-ND2 2.87Å
204M90Very high82.5Confident0 Ų056.3 Ų56.30%027%0.273CS..Hα-helixtrans-57.1-45.4172.7-78.1-174-8100111.6L142 I146 F170 L171 N174 Y200 V202 Y206 F208L142-M204 HydrophobicContact CD2-CE 3.84Å; I146-M204 HydrophobicContact CD1-SD 3.67Å; F170-M204 HydrophobicContact CE1-CG 4.16Å; F170-M204 HydrophobicContact CZ-CG 4.36Å; L171-M204 HydrophobicContact CD2-CG 4.48Å; N174-M204 HydrophobicContact CB-CE 4.08Å; N174-M204 HydrophobicContact CB-CG 3.56Å; N174-M204 HydrophobicContact CB-SD 3.58Å; N174-M204 VanDerWaalsContact CB-SD 3.58Å; Y200-M204 WeakPolarHBondContact O-CE 3.34Å; Y200-M204 WeakPolarHBondContact O-CG 3.33Å; Y200-M204 PolarHBondContact O-N 3.03Å; V202-M204 VanDerWaalsContact C-N 3.32Å; V202-M204 PolarHBondContact O-N 3.35Å; M204-Y206 VanDerWaalsContact C-N 3.35Å; M204-Y206 PolarHBondContact O-N 3.31Å; M204-F208 WeakPolarHBondContact O-CD1 3.48Å; M204-F208 WeakPolarHBondContact O-CE1 3.38Å
205T85.4Confident80.8Confident46 Ų4657.4 Ų57.428%0.28228%0.283SS..Hα-helixtrans-70.7-29.8179.660.90000113.9C98 A201 V202 E203C98-T205 HydrophobicContact CB-CG2 3.52Å; A201-T205 WeakPolarHBondContact O-CG2 3.46Å; A201-T205 PolarHBondContact O-N 2.92Å; V202-T205 PolarHBondContact O-N 2.93Å; V202-T205 PolarHBondContact O-OG1 3.33Å; E203-T205 VanDerWaalsContact C-N 3.32Å; E203-T205 PolarHBondContact O-N 3.15Å
206Y82.5Confident79.2Confident165 Ų16554.8 Ų54.865%0.64729%0.291SS*.Hα-helixtrans-72.3-38.5-176.5-176.7-97.4000112.5V202 E203 M204 F208 P209V202-Y206 PolarHBondContact O-N 3.05Å; E203-Y206 PolarHBondContact O-N 3.22Å; M204-Y206 VanDerWaalsContact C-N 3.35Å; M204-Y206 PolarHBondContact O-N 3.31Å; Y206-F208 VanDerWaalsContact C-N 3.26Å; Y206-F208 PolarHBondContact O-N 3.33Å; Y206-P209 WeakPolarHBondContact O-CD 3.43Å
207N75.1Confident77.4Confident35 Ų3551.3 Ų51.319%0.18728%0.276CS..Hα-helixtrans-73.8-15.3-177.1-78.9-69.9000113.6F170 E203 D210 F211F170-N207 HydrophobicContact CE1-CB 4.13Å; F170-N207 HydrophobicContact CZ-CB 4.34Å; F170-N207 VanDerWaalsContact CZ-ND2 3.34Å; F170-N207 WeakPolarHBondContact CZ-ND2 3.44Å; E203-N207 PolarHBondContact O-N 3.46Å; E203-N207 PolarHBondContact O-ND2 2.87Å; N207-D210 PolarHBondContact O-N 2.82Å; N207-F211 HydrophobicContact CB-CD2 4.1Å; N207-F211 HydrophobicContact CB-CE2 3.93Å; N207-F211 WeakPolarHBondContact O-CD2 3.5Å; N207-F211 PolarHBondContact O-N 3.31Å
208F76.1Confident75.1Confident2 Ų257.4 Ų57.41%0.00931%0.307CS..Hα-helixtrans-60.8-41.2-173-767000115.7L91 V94 S95 F167 L171 M204 Y206 D210 F211 A212L91-F208 HydrophobicContact CB-CD2 4.49Å; L91-F208 HydrophobicContact CB-CE2 4.39Å; L91-F208 HydrophobicContact CD2-CZ 4.46Å; L91-F208 WeakPolarHBondContact O-CE2 3.31Å; V94-F208 HydrophobicContact CB-CE2 4.03Å; V94-F208 HydrophobicContact CB-CZ 3.89Å; V94-F208 HydrophobicContact CG1-CE2 4.16Å; V94-F208 HydrophobicContact CG1-CZ 3.61Å; S95-F208 WeakPolarHBondContact OG-CD2 3.14Å; S95-F208 WeakPolarHBondContact OG-CE2 3.49Å; F167-F208 AromaticContact CE2-CD1 3.68Å; F167-F208 HydrophobicContact CE2-CD1 3.68Å; F167-F208 AromaticContact CE2-CE1 3.73Å; F167-F208 HydrophobicContact CE2-CE1 3.73Å; F167-F208 AromaticContact CZ-CD1 3.49Å; F167-F208 HydrophobicContact CZ-CD1 3.49Å; F167-F208 VanDerWaalsContact CZ-CD1 3.49Å; F167-F208 AromaticContact CZ-CE1 3.51Å; F167-F208 HydrophobicContact CZ-CE1 3.51Å; F167-F208 HydrophobicContact CZ-CG 4.48Å; F167-F208 HydrophobicContact CZ-CZ 4.49Å; L171-F208 HydrophobicContact CD2-CE1 3.65Å; L171-F208 HydrophobicContact CD2-CZ 3.95Å; M204-F208 WeakPolarHBondContact O-CD1 3.48Å; M204-F208 WeakPolarHBondContact O-CE1 3.38Å; Y206-F208 VanDerWaalsContact C-N 3.26Å; Y206-F208 PolarHBondContact O-N 3.33Å; F208-D210 PolarHBondContact O-N 3.21Å; F208-F211 PolarHBondContact O-N 3.02Å; F208-A212 WeakPolarHBondContact O-CB 3.49Å; F208-A212 PolarHBondContact O-N 3.48Å
209P65.1Low72.9Confident47 Ų4756.8 Ų56.831%0.30531%0.305SS..Hα-helixtrans-60-43.3180-23.636.1000112.9Y206 F211 A212 E213Y206-P209 WeakPolarHBondContact O-CD 3.43Å; P209-F211 VanDerWaalsContact C-N 3.32Å; P209-F211 PolarHBondContact O-N 3.31Å; P209-A212 PolarHBondContact O-N 3.5Å; P209-E213 PolarHBondContact O-N 2.85Å
210D68.5Low70.3Confident101 Ų10160.1 Ų60.154%0.5431%0.314SS..Hα-helixtrans-65.3-37.8-177.4-65.7-1.9000111.6N207 F208 T214N207-D210 PolarHBondContact O-N 2.82Å; F208-D210 PolarHBondContact O-N 3.21Å; D210-T214 PolarHBondContact O-OG1 3.47Å
211F66.6Low67.9Low34 Ų3460.6 Ų60.615%0.14933%0.326CS..Hα-helixtrans-78.5-36.1175.3-68.4-65.5000112.5K163 M164 F167 N207 F208 P209 E213 T214 A215K163-F211 WeakPolarHBondContact O-CE1 3.41Å; M164-F211 WeakPolarHBondContact CE-O 3.33Å; F167-F211 HydrophobicContact CB-CD1 3.55Å; F167-F211 HydrophobicContact CB-CD2 4.16Å; F167-F211 HydrophobicContact CB-CE1 3.65Å; F167-F211 HydrophobicContact CB-CE2 4.26Å; F167-F211 HydrophobicContact CB-CG 3.82Å; F167-F211 HydrophobicContact CB-CZ 4.02Å; F167-F211 HydrophobicContact CD1-CB 4Å; F167-F211 HydrophobicContact CD1-CG 4.13Å; F167-F211 HydrophobicContact CD2-CB 4.03Å; F167-F211 HydrophobicContact CD2-CD1 4.08Å; F167-F211 AromaticContact CD2-CD2 3.08Å; F167-F211 HydrophobicContact CD2-CD2 3.08Å; F167-F211 HydrophobicContact CD2-CE1 4.34Å; F167-F211 AromaticContact CD2-CE2 3.43Å; F167-F211 HydrophobicContact CD2-CE2 3.43Å; F167-F211 VanDerWaalsContact CD2-CE2 3.43Å; F167-F211 AromaticContact CD2-CG 3.46Å; F167-F211 HydrophobicContact CD2-CG 3.46Å; F167-F211 VanDerWaalsContact CD2-CG 3.46Å; F167-F211 HydrophobicContact CD2-CZ 4.05Å; F167-F211 HydrophobicContact CE1-CB 4.16Å; F167-F211 HydrophobicContact CE2-CB 4.2Å; F167-F211 AromaticContact CE2-CD2 3.48Å; F167-F211 HydrophobicContact CE2-CD2 3.48Å; F167-F211 VanDerWaalsContact CE2-CD2 3.48Å; F167-F211 HydrophobicContact CE2-CE2 4.11Å; F167-F211 AromaticContact CE2-CG 4Å; F167-F211 HydrophobicContact CE2-CG 4Å; F167-F211 HydrophobicContact CG-CB 3.92Å; F167-F211 AromaticContact CG-CD1 3.83Å; F167-F211 HydrophobicContact CG-CD1 3.83Å; F167-F211 AromaticContact CG-CD2 3.69Å; F167-F211 HydrophobicContact CG-CD2 3.69Å; F167-F211 HydrophobicContact CG-CE1 4.25Å; F167-F211 HydrophobicContact CG-CE2 4.14Å; F167-F211 AromaticContact CG-CG 3.53Å; F167-F211 HydrophobicContact CG-CG 3.53Å; F167-F211 HydrophobicContact CG-CZ 4.39Å; F167-F211 HydrophobicContact CZ-CB 4.25Å; F167-F211 HydrophobicContact CZ-CD2 4.34Å; N207-F211 HydrophobicContact CB-CD2 4.1Å; N207-F211 HydrophobicContact CB-CE2 3.93Å; N207-F211 WeakPolarHBondContact O-CD2 3.5Å; N207-F211 PolarHBondContact O-N 3.31Å; F208-F211 PolarHBondContact O-N 3.02Å; P209-F211 VanDerWaalsContact C-N 3.32Å; P209-F211 PolarHBondContact O-N 3.31Å; F211-E213 PolarHBondContact O-N 3.06Å; F211-T214 PolarHBondContact O-N 3Å; F211-A215 PolarHBondContact O-N 2.91Å
212A65.3Low65.5Low2 Ų265.1 Ų65.12%0.01736%0.357CS..Hα-helixtrans-64-41.2178.800000111.3F208 P209 T214 A215 G216 V217 V219F208-A212 WeakPolarHBondContact O-CB 3.49Å; F208-A212 PolarHBondContact O-N 3.48Å; P209-A212 PolarHBondContact O-N 3.5Å; A212-T214 VanDerWaalsContact C-N 3.31Å; A212-T214 PolarHBondContact O-N 2.98Å; A212-A215 CarbonylContact O-C 3.54Å; A212-A215 PolarHBondContact O-N 3.28Å; A212-A215 VanDerWaalsContact O-N 3.09Å; A212-G216 PolarHBondContact O-N 3.15Å; A212-G216 VanDerWaalsContact O-N 3.07Å; A212-V217 CarbonylContact C-O 3.27Å; A212-V217 VanDerWaalsContact C-O 3.27Å; A212-V217 HydrophobicContact CB-CB 4.13Å; A212-V217 HydrophobicContact CB-CG1 4.38Å; A212-V217 WeakPolarHBondContact CB-O 3.42Å; A212-V217 PolarHBondContact O-N 3.14Å; A212-V217 VanDerWaalsContact O-O 3.13Å; A212-V219 HydrophobicContact CB-CB 4.04Å; A212-V219 HydrophobicContact CB-CG2 3.65Å
213E65Low63Low162 Ų16271.5 Ų71.576%0.75739%0.39SS*.Hα-helixtrans-58.1-44.4173.8-172.3176.6-173.100111.6P209 F211 A215 G216P209-E213 PolarHBondContact O-N 2.85Å; F211-E213 PolarHBondContact O-N 3.06Å; E213-A215 VanDerWaalsContact C-N 3.27Å; E213-A215 PolarHBondContact O-N 3.09Å; E213-G216 PolarHBondContact O-N 3.47Å; E213-G216 VanDerWaalsContact O-N 3.13Å
214T57.9Low60.5Low55 Ų5577.1 Ų77.134%0.33741%0.408SS..Hα-helixtrans-64.2-32.2177.3-56.50000112.3K163 M164 D210 F211 A212 G216K163-T214 HydrophobicContact CB-CG2 4.18Å; K163-T214 HydrophobicContact CD-CG2 3.79Å; M164-T214 HydrophobicContact CE-CG2 3.5Å; M164-T214 VanDerWaalsContact CE-CG2 3.5Å; D210-T214 PolarHBondContact O-OG1 3.47Å; F211-T214 PolarHBondContact O-N 3Å; A212-T214 VanDerWaalsContact C-N 3.31Å; A212-T214 PolarHBondContact O-N 2.98Å; T214-G216 VanDerWaalsContact C-N 3.34Å
215A58.2Low58.1Low24 Ų2482.3 Ų82.320%0.19843%0.434CS..THydrogen-bonded Turntrans-85-3.5177.900000113.6L87 F158 M164 F211 A212 E213 V217L87-A215 HydrophobicContact CD2-CB 4.49Å; F158-A215 HydrophobicContact CE1-CB 4.33Å; M164-A215 HydrophobicContact CE-CB 3.99Å; M164-A215 HydrophobicContact SD-CB 4.15Å; F211-A215 PolarHBondContact O-N 2.91Å; A212-A215 CarbonylContact O-C 3.54Å; A212-A215 PolarHBondContact O-N 3.28Å; A212-A215 VanDerWaalsContact O-N 3.09Å; E213-A215 VanDerWaalsContact C-N 3.27Å; E213-A215 PolarHBondContact O-N 3.09Å; A215-V217 HydrophobicContact CB-CB 4.25Å; A215-V217 HydrophobicContact CB-CG2 3.66Å; A215-V217 PolarHBondContact O-N 2.94Å
216G58.5Low55.6Low69 Ų6988.2 Ų88.271%0.71146%0.456SS*.THydrogen-bonded Turntrans67.623-170.500000113.2A212 E213 T214A212-G216 PolarHBondContact O-N 3.15Å; A212-G216 VanDerWaalsContact O-N 3.07Å; E213-G216 PolarHBondContact O-N 3.47Å; E213-G216 VanDerWaalsContact O-N 3.13Å; T214-G216 VanDerWaalsContact C-N 3.34Å
217V55.6Low53.4Low20 Ų2084.6 Ų84.612%0.12145%0.453CS..  trans-101.3126.7-176177.70000109.3Q88 A212 A215 V219Q88-V217 HydrophobicContact CB-CG1 3.35Å; Q88-V217 HydrophobicContact CG-CG1 3.37Å; A212-V217 CarbonylContact C-O 3.27Å; A212-V217 VanDerWaalsContact C-O 3.27Å; A212-V217 HydrophobicContact CB-CB 4.13Å; A212-V217 HydrophobicContact CB-CG1 4.38Å; A212-V217 WeakPolarHBondContact CB-O 3.42Å; A212-V217 PolarHBondContact O-N 3.14Å; A212-V217 VanDerWaalsContact O-O 3.13Å; A215-V217 HydrophobicContact CB-CB 4.25Å; A215-V217 HydrophobicContact CB-CG2 3.66Å; A215-V217 PolarHBondContact O-N 2.94Å; V217-V219 HydrophobicContact CG1-CG2 3.75Å; V217-V219 PolarHBondContact O-N 3.15Å
218I47.7Very low51.6Low128 Ų12888.4 Ų88.466%0.65648%0.482SS*.  trans-9088.9177.2-56.9175.4000109.3Q88Q88-I218 PolarHBondContact NE2-O 3.28Å
219V48.6Very low49.9Very low16 Ų1692.8 Ų92.810%0.09752%0.519CS..  trans-91.1108170.5-173.90000109Q88 L92 A212 V217Q88-V219 HydrophobicContact CG-CG2 4.44Å; L92-V219 HydrophobicContact CD2-CG1 3.93Å; A212-V219 HydrophobicContact CB-CB 4.04Å; A212-V219 HydrophobicContact CB-CG2 3.65Å; V217-V219 HydrophobicContact CG1-CG2 3.75Å; V217-V219 PolarHBondContact O-N 3.15Å
220K40.5Very low48.5Very low173 Ų17399.7 Ų99.775%0.75255%0.547SS*.  trans-73.2128.8166.4-76.4-172.9177.3179.60108.5C222K220-C222 PolarHBondContact O-N 3.35Å
221P43.1Very low47.1Very low83 Ų83100.4 Ų100.454%0.53956%0.56SS.*  trans-60.6130.7178.4-18.528.5000110.7N223P221-N223 PolarHBondContact O-N 2.92Å
222C42.5Very low45.9Very low95 Ų95107.8 Ų107.864%0.64262%0.616SS**SBendtrans-69.4113.5162.3-103.90000107.5K220 R224K220-C222 PolarHBondContact O-N 3.35Å; C222-R224 PolarHBondContact O-N 2.64Å
223N40.7Very low44.9Very low154 Ų154113.1 Ų113.182%0.82465%0.646SS**  trans9.3102.2174.5-73.4-13.1000115.9P221 I225P221-N223 PolarHBondContact O-N 2.92Å; N223-I225 PolarHBondContact O-N 3.14Å; N223-I225 VanDerWaalsContact O-N 3.08Å
224R38.7Very low43.9Very low209 Ų209110.5 Ų110.579%0.78964%0.64SS**  trans-46.6111.2176.4-79.2179.6-176175.20.5111.5C222C222-R224 PolarHBondContact O-N 2.64Å
225I37.7Very low43.1Very low108 Ų108113.6 Ų113.655%0.55466%0.657SS**  trans-91.2102.1153.1-55.7175.8000104.7I102 N223I102-I225 HydrophobicContact CG2-CD1 4.26Å; N223-I225 PolarHBondContact O-N 3.14Å; N223-I225 VanDerWaalsContact O-N 3.08Å
226K34.3Very low42.2Very low170 Ų170118.9 Ų118.974%0.73968%0.684SS**  trans-67.2137171.9-105.5-176.2173.9-174.20107.9S228K226-S228 PolarHBondContact O-N 3.29Å
227P35.8Very low41.2Very low90 Ų90122 Ų12258%0.58468%0.682SS**  trans-59.3127.2168.11.35.6000108.2V202 A229V202-P227 HydrophobicContact CG1-CG 4.27Å; P227-A229 PolarHBondContact O-N 3.36Å
228S37.9Very low40.2Very low114 Ų114128.8 Ų128.880%0.79772%0.719SS**  trans-59.1107.9171.335.50000108.2K226 E230K226-S228 PolarHBondContact O-N 3.29Å; S228-E230 PolarHBondContact O-N 2.95Å
229A40.1Very low39.7Very low95 Ų95128.9 Ų128.979%0.78572%0.724SS**  trans-59.2122.8166.300000107.6P227 S231P227-A229 PolarHBondContact O-N 3.36Å; A229-S231 PolarHBondContact O-N 3.41Å
230E34.9Very low39Very low191 Ų191137.5 Ų137.589%0.89377%0.772SS**  trans-52.8108.8172.5-67.3174147.300108.8S228 S232S228-E230 PolarHBondContact O-N 2.95Å; E230-S232 PolarHBondContact O-N 3.44Å
231S40.2Very low38.9Very low117 Ų117134.6 Ų134.682%0.81877%0.774SS**  trans-79.5109.7165.456.10000107.4A229A229-S231 PolarHBondContact O-N 3.41Å
232S41.1Very low38.5Very low189 Ų189139.3 Ų139.3100%1.32280%0.795SS**  trans-51.90164.7-52.90000112.9E230E230-S232 PolarHBondContact O-N 3.44Å

Retrieved 232 of 232 residues in 125.7 ms (Link to these results)

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