A0A077Z216_TRITR Loading...

MA3 and MIF4G domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z216, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 519 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
1M40.9Very low78.4Confident238 Ų238113.4 Ų113.4100%1.17254%0.538SS*.  0-8.90-119.2176.2-167.300114.6
2F47.8Very low79.6Confident191 Ų191105.4 Ų105.484%0.83851%0.506SS*.  trans-94.3-0.8-179-78.5-79.4000115.4Y4F2-Y4 VanDerWaalsContact C-N 3.32Å; F2-Y4 PolarHBondContact O-N 3.47Å
3C56.3Low80.8Confident90 Ų9098.5 Ų98.561%0.60847%0.471SS*.THydrogen-bonded Turntrans-75.5-13.2-163.1-60.90000115.2
4Y73.8Confident81.9Confident83 Ų8395.4 Ų95.433%0.32546%0.459SS..THydrogen-bonded Turntrans-135.646.1-179.1-55.8-72000112.7F2 Y8 Q9 F245 E246F2-Y4 VanDerWaalsContact C-N 3.32Å; F2-Y4 PolarHBondContact O-N 3.47Å; Y4-Y8 AromaticContact CD1-CD1 3.99Å; Y4-Y8 HydrophobicContact CD1-CD1 3.99Å; Y4-Y8 AromaticContact CD1-CE1 3.77Å; Y4-Y8 HydrophobicContact CD1-CE1 3.77Å; Y4-Y8 HydrophobicContact CE1-CE1 4.11Å; Y4-Q9 PolarHBondContact O-NE2 3.49Å; Y4-F245 AromaticContact CD1-CD1 3.4Å; Y4-F245 HydrophobicContact CD1-CD1 3.4Å; Y4-F245 VanDerWaalsContact CD1-CD1 3.4Å; Y4-F245 AromaticContact CD1-CE1 3.62Å; Y4-F245 HydrophobicContact CD1-CE1 3.62Å; Y4-F245 AromaticContact CE1-CD1 3.99Å; Y4-F245 HydrophobicContact CE1-CD1 3.99Å; Y4-F245 AromaticContact CE1-CE1 3.95Å; Y4-F245 HydrophobicContact CE1-CE1 3.95Å; Y4-F245 HydrophobicContact CG-CD1 4.05Å; Y4-E246 HydrophobicContact CD2-CB 4.01Å; Y4-E246 HydrophobicContact CD2-CG 4.41Å; Y4-E246 HydrophobicContact CE2-CB 3.76Å; Y4-E246 HydrophobicContact CE2-CG 3.68Å; Y4-E246 WeakPolarHBondContact CE2-OE2 3.48Å
5S86.5Confident82.8Confident46 Ų4697.4 Ų97.432%0.32247%0.467SS..  trans-58.3159.4175.474.10000111.9E7 Y8 Q9S5-E7 PolarHBondContact O-N 3.2Å; S5-Y8 WeakPolarHBondContact O-CB 3.34Å; S5-Y8 PolarHBondContact O-N 3.43Å; S5-Y8 PolarHBondContact OG-N 3.33Å; S5-Y8 VanDerWaalsContact OG-N 3.15Å; S5-Q9 PolarHBondContact O-N 3.12Å
6Q92.3Very high83.6Confident121 Ų12192.4 Ų92.457%0.56544%0.444SS*.Hα-helixtrans-56-34.6174.9-175.5177.15.900112.4R10 F239 Y241Q6-R10 WeakPolarHBondContact O-CB 3.46Å; Q6-R10 PolarHBondContact O-N 3.32Å; Q6-F239 HydrophobicContact CG-CE1 4.08Å; Q6-F239 HydrophobicContact CG-CZ 4.21Å; Q6-Y241 HydrophobicContact CB-CD2 3.63Å; Q6-Y241 HydrophobicContact CB-CE2 3.95Å; Q6-Y241 HydrophobicContact CB-CG 4.5Å; Q6-Y241 HydrophobicContact CG-CD2 3.84Å; Q6-Y241 HydrophobicContact CG-CG 4.38Å
7E91.7Very high84.3Confident153 Ų15392.6 Ų92.672%0.71544%0.442SS*.Hα-helixtrans-66.1-45.2175.4-62.5178.3167.300111.7S5 R10 I11S5-E7 PolarHBondContact O-N 3.2Å; E7-R10 WeakPolarHBondContact O-CB 3.47Å; E7-R10 PolarHBondContact O-N 3.26Å; E7-I11 WeakPolarHBondContact O-CG1 3.27Å; E7-I11 PolarHBondContact O-N 2.9Å
8Y92.3Very high84.9Confident115 Ų11596.6 Ų96.645%0.45146%0.457SS..Hα-helixtrans-59.9-50.2176176.4-93.6000111.4Y4 S5 R10 I11 A12 F245Y4-Y8 AromaticContact CD1-CD1 3.99Å; Y4-Y8 HydrophobicContact CD1-CD1 3.99Å; Y4-Y8 AromaticContact CD1-CE1 3.77Å; Y4-Y8 HydrophobicContact CD1-CE1 3.77Å; Y4-Y8 HydrophobicContact CE1-CE1 4.11Å; S5-Y8 WeakPolarHBondContact O-CB 3.34Å; S5-Y8 PolarHBondContact O-N 3.43Å; S5-Y8 PolarHBondContact OG-N 3.33Å; S5-Y8 VanDerWaalsContact OG-N 3.15Å; Y8-R10 PolarHBondContact O-N 3.23Å; Y8-I11 PolarHBondContact O-N 3.2Å; Y8-I11 VanDerWaalsContact O-N 3.14Å; Y8-A12 PolarHBondContact O-N 3.39Å; Y8-F245 HydrophobicContact CD1-CE1 4.44Å; Y8-F245 AromaticContact CE1-CE1 3.94Å; Y8-F245 HydrophobicContact CE1-CE1 3.94Å; Y8-F245 HydrophobicContact CE1-CZ 4.4Å
9Q93.1Very high85.5Confident2 Ų296.3 Ų96.31%0.00946%0.455CS..Hα-helixtrans-61.7-31.7179.4-64.6-173.819.300112.5Y4 S5 W13 R46 F239 Y241 D242 F245Y4-Q9 PolarHBondContact O-NE2 3.49Å; S5-Q9 PolarHBondContact O-N 3.12Å; Q9-W13 WeakPolarHBondContact O-CB 3.34Å; Q9-W13 PolarHBondContact O-N 3.44Å; Q9-R46 PolarHBondContact O-NH2 3.38Å; Q9-F239 VanDerWaalsContact C-CE2 3.42Å; Q9-F239 HydrophobicContact CB-CE2 3.78Å; Q9-F239 HydrophobicContact CB-CZ 3.99Å; Q9-F239 WeakPolarHBondContact O-CE2 3.49Å; Q9-Y241 VanDerWaalsContact NE2-CE2 3.31Å; Q9-D242 PolarHBondContact NE2-O 3.06Å; Q9-F245 HydrophobicContact CB-CD2 4.45Å; Q9-F245 HydrophobicContact CG-CB 4.28Å; Q9-F245 HydrophobicContact CG-CD1 4.17Å; Q9-F245 HydrophobicContact CG-CD2 3.79Å; Q9-F245 HydrophobicContact CG-CE2 4.16Å; Q9-F245 HydrophobicContact CG-CG 3.8Å; Q9-F245 VanDerWaalsContact NE2-CB 3.3Å
10R93.7Very high86.1Confident111 Ų11191.5 Ų91.542%0.41943%0.433SS..Hα-helixtrans-68.4-45175.8-179.864.1-168.4-146-0.6111.4Q6 E7 Y8 W13 D14 F239Q6-R10 WeakPolarHBondContact O-CB 3.46Å; Q6-R10 PolarHBondContact O-N 3.32Å; E7-R10 WeakPolarHBondContact O-CB 3.47Å; E7-R10 PolarHBondContact O-N 3.26Å; Y8-R10 PolarHBondContact O-N 3.23Å; R10-W13 WeakPolarHBondContact O-CB 3.41Å; R10-W13 PolarHBondContact O-N 3.02Å; R10-D14 IonicContact NE-OD1 3.26Å; R10-D14 IonicContact NE-OD2 3.03Å; R10-D14 PolarHBondContact NE-OD2 3.44Å; R10-D14 IonicContact NH2-OD1 2.69Å; R10-D14 PolarHBondContact O-N 3.48Å; R10-F239 HydrophobicContact CB-CD1 4.44Å; R10-F239 HydrophobicContact CB-CD2 4.48Å; R10-F239 HydrophobicContact CB-CE1 4.04Å; R10-F239 HydrophobicContact CB-CE2 4.11Å; R10-F239 HydrophobicContact CB-CZ 3.85Å; R10-F239 VanDerWaalsContact CD-CG 3.49Å
11I93.6Very high86.4Confident97 Ų9791 Ų9150%0.49743%0.43SS..Hα-helixtrans-61.1-46.5174.7-66.2166.6000110.1E7 Y8 W13 D14 Q15E7-I11 WeakPolarHBondContact O-CG1 3.27Å; E7-I11 PolarHBondContact O-N 2.9Å; Y8-I11 PolarHBondContact O-N 3.2Å; Y8-I11 VanDerWaalsContact O-N 3.14Å; I11-W13 VanDerWaalsContact C-N 3.32Å; I11-W13 PolarHBondContact O-N 2.99Å; I11-D14 PolarHBondContact O-N 2.9Å; I11-Q15 HydrophobicContact CG2-CG 4.47Å; I11-Q15 WeakPolarHBondContact O-CG 3.41Å; I11-Q15 PolarHBondContact O-N 3.26Å
12A93.6Very high88.9Confident18 Ų1881.3 Ų81.315%0.14939%0.391CS..Hα-helixtrans-60.3-4017700000112.2Y8 Q15 L16 F245Y8-A12 PolarHBondContact O-N 3.39Å; A12-Q15 PolarHBondContact O-N 3.22Å; A12-L16 VanDerWaalsContact O-CB 3.31Å; A12-L16 WeakPolarHBondContact O-CB 3.4Å; A12-L16 PolarHBondContact O-N 3.44Å; A12-F245 HydrophobicContact CB-CZ 4.36Å
13W95.5Very high91.2Very high15 Ų1572.3 Ų72.36%0.05735%0.352CS..Hα-helixtrans-62.6-45.4173.2178.2-95.8000113Q9 R10 I11 Q15 L16 K17 R46 I50 L236 F239Q9-W13 WeakPolarHBondContact O-CB 3.34Å; Q9-W13 PolarHBondContact O-N 3.44Å; R10-W13 WeakPolarHBondContact O-CB 3.41Å; R10-W13 PolarHBondContact O-N 3.02Å; I11-W13 VanDerWaalsContact C-N 3.32Å; I11-W13 PolarHBondContact O-N 2.99Å; W13-Q15 VanDerWaalsContact C-N 3.3Å; W13-Q15 PolarHBondContact O-N 3.13Å; W13-L16 HydrophobicContact CE3-CD2 4.4Å; W13-L16 PolarHBondContact O-N 3.38Å; W13-K17 WeakPolarHBondContact O-CB 3.31Å; W13-K17 PolarHBondContact O-N 3.48Å; W13-R46 HydrophobicContact CE3-CG 4.32Å; W13-R46 HydrophobicContact CZ3-CG 4.02Å; W13-R46 WeakPolarHBondContact CZ3-O 3.37Å; W13-I50 HydrophobicContact CD2-CD1 4.19Å; W13-I50 HydrophobicContact CE3-CD1 4.21Å; W13-I50 HydrophobicContact CH2-CD1 3.63Å; W13-I50 HydrophobicContact CH2-CG1 3.92Å; W13-I50 HydrophobicContact CZ2-CD1 3.58Å; W13-I50 HydrophobicContact CZ2-CG1 3.81Å; W13-I50 HydrophobicContact CZ3-CD1 3.95Å; W13-L236 WeakPolarHBondContact CH2-O 3.5Å; W13-F239 HydrophobicContact CB-CD2 3.67Å; W13-F239 HydrophobicContact CB-CE2 4.35Å; W13-F239 HydrophobicContact CD2-CB 4.4Å; W13-F239 HydrophobicContact CD2-CD2 4.41Å; W13-F239 HydrophobicContact CG-CB 4.01Å; W13-F239 AromaticContact CG-CD2 3.84Å; W13-F239 HydrophobicContact CG-CD2 3.84Å; W13-F239 HydrophobicContact CG-CG 4.4Å
14D95.2Very high93.1Very high55 Ų5568 Ų6829%0.29432%0.323SS..Hα-helixtrans-68.1-32179.4-71.7-33.3000111.6R10 I11 K18R10-D14 IonicContact NE-OD1 3.26Å; R10-D14 IonicContact NE-OD2 3.03Å; R10-D14 PolarHBondContact NE-OD2 3.44Å; R10-D14 IonicContact NH2-OD1 2.69Å; R10-D14 PolarHBondContact O-N 3.48Å; I11-D14 PolarHBondContact O-N 2.9Å; D14-K18 WeakPolarHBondContact O-CG 3.48Å; D14-K18 PolarHBondContact O-N 2.99Å; D14-K18 VanDerWaalsContact O-N 3.13Å
15Q95.5Very high94Very high126 Ų12668.2 Ų68.259%0.58933%0.329SS*.Hα-helixtrans-67.9-49.9171-73.8175.4-9.600112.1I11 A12 W13 K17 K18 H19I11-Q15 HydrophobicContact CG2-CG 4.47Å; I11-Q15 WeakPolarHBondContact O-CG 3.41Å; I11-Q15 PolarHBondContact O-N 3.26Å; A12-Q15 PolarHBondContact O-N 3.22Å; W13-Q15 VanDerWaalsContact C-N 3.3Å; W13-Q15 PolarHBondContact O-N 3.13Å; Q15-K17 PolarHBondContact O-N 3.4Å; Q15-K18 PolarHBondContact O-N 3.39Å; Q15-K18 VanDerWaalsContact O-N 3.11Å; Q15-H19 WeakPolarHBondContact O-CB 3.47Å; Q15-H19 PolarHBondContact O-N 3.1Å
16L96.3Very high94.3Very high17 Ų1771.8 Ų71.89%0.08934%0.336CS..Hα-helixtrans-52.4-45.6174.517963.5000110.7A12 W13 K18 H19 I20 V42 R46 I50A12-L16 VanDerWaalsContact O-CB 3.31Å; A12-L16 WeakPolarHBondContact O-CB 3.4Å; A12-L16 PolarHBondContact O-N 3.44Å; W13-L16 HydrophobicContact CE3-CD2 4.4Å; W13-L16 PolarHBondContact O-N 3.38Å; L16-K18 PolarHBondContact O-N 3.09Å; L16-H19 PolarHBondContact O-N 2.84Å; L16-I20 HydrophobicContact CD1-CD1 3.73Å; L16-I20 HydrophobicContact CD1-CG1 4.17Å; L16-I20 HydrophobicContact CG-CD1 3.91Å; L16-I20 WeakPolarHBondContact O-CG1 3.45Å; L16-I20 PolarHBondContact O-N 3.23Å; L16-V42 HydrophobicContact CD1-CB 3.74Å; L16-V42 HydrophobicContact CD1-CG2 4.16Å; L16-R46 HydrophobicContact CD2-CB 4.47Å; L16-R46 HydrophobicContact CD2-CG 4.29Å; L16-I50 HydrophobicContact CD2-CD1 4.43Å; L16-I50 HydrophobicContact CG-CD1 4.42Å
17K95.5Very high94.5Very high97 Ų9766.7 Ų66.742%0.42231%0.313SS..Hα-helixtrans-59.6-47.8177-173.9178.3178.3-176.90113.2W13 Q15 H19 H21 I50W13-K17 WeakPolarHBondContact O-CB 3.31Å; W13-K17 PolarHBondContact O-N 3.48Å; Q15-K17 PolarHBondContact O-N 3.4Å; K17-H19 VanDerWaalsContact C-N 3.35Å; K17-H21 VanDerWaalsContact O-CB 3.25Å; K17-H21 WeakPolarHBondContact O-CB 3.38Å; K17-H21 PolarHBondContact O-N 3.19Å; K17-H21 VanDerWaalsContact O-N 3.14Å; K17-I50 HydrophobicContact CB-CD1 3.95Å; K17-I50 HydrophobicContact CB-CG2 4.31Å; K17-I50 HydrophobicContact CG-CD1 4.4Å; K17-I50 HydrophobicContact CG-CG2 3.95Å
18K93.9Very high94.5Very high164 Ų16462.3 Ų62.371%0.71330%0.295SS*.Hα-helixtrans-64.6-41.2178.5-73.7175.6-175.5178.90111.5D14 Q15 L16 G22D14-K18 WeakPolarHBondContact O-CG 3.48Å; D14-K18 PolarHBondContact O-N 2.99Å; D14-K18 VanDerWaalsContact O-N 3.13Å; Q15-K18 PolarHBondContact O-N 3.39Å; Q15-K18 VanDerWaalsContact O-N 3.11Å; L16-K18 PolarHBondContact O-N 3.09Å; K18-G22 PolarHBondContact O-N 3.35Å
19H96.5Very high94.4Very high90 Ų9059.6 Ų59.642%0.41730%0.296SS..Hα-helixtrans-63.5-57-179-160.4131.7000110.6Q15 L16 K17 H21 G22 L23 V42Q15-H19 WeakPolarHBondContact O-CB 3.47Å; Q15-H19 PolarHBondContact O-N 3.1Å; L16-H19 PolarHBondContact O-N 2.84Å; K17-H19 VanDerWaalsContact C-N 3.35Å; H19-H21 VanDerWaalsContact C-N 3.3Å; H19-H21 PolarHBondContact O-N 2.96Å; H19-G22 PolarHBondContact O-N 3.02Å; H19-L23 VanDerWaalsContact CD2-CD1 3.48Å; H19-L23 WeakPolarHBondContact CD2-CD1 3.36Å; H19-L23 WeakPolarHBondContact O-CG 3.44Å; H19-L23 PolarHBondContact O-N 2.85Å; H19-V42 HydrophobicContact CB-CG1 4.46Å
20I98.1Very high94.4Very high0 Ų065 Ų650%033%0.334CS..Hα-helixtrans-55.2-46178.7-69.1173.9000111L16 G22 L23 V24 L39 V42 L44 I50 F51 A54L16-I20 HydrophobicContact CD1-CD1 3.73Å; L16-I20 HydrophobicContact CD1-CG1 4.17Å; L16-I20 HydrophobicContact CG-CD1 3.91Å; L16-I20 WeakPolarHBondContact O-CG1 3.45Å; L16-I20 PolarHBondContact O-N 3.23Å; I20-G22 VanDerWaalsContact C-N 3.32Å; I20-G22 PolarHBondContact O-N 3.01Å; I20-L23 PolarHBondContact O-N 2.77Å; I20-V24 HydrophobicContact CG2-CG2 4.35Å; I20-V24 WeakPolarHBondContact O-CG2 3.44Å; I20-V24 PolarHBondContact O-N 3.36Å; I20-L39 HydrophobicContact CG1-CD1 4.32Å; I20-L39 HydrophobicContact CG2-CD1 4.5Å; I20-V42 HydrophobicContact CD1-CG2 4.45Å; I20-V42 HydrophobicContact CG1-CG2 3.89Å; I20-L44 HydrophobicContact CD1-CD2 4.34Å; I20-I50 HydrophobicContact CB-CG2 4.18Å; I20-I50 HydrophobicContact CD1-CB 4.37Å; I20-I50 HydrophobicContact CD1-CG2 4.28Å; I20-I50 HydrophobicContact CG2-CG2 4.08Å; I20-F51 HydrophobicContact CG2-CB 3.92Å; I20-F51 HydrophobicContact CG2-CD2 4.11Å; I20-A54 HydrophobicContact CG2-CB 4.43Å
21H93.2Very high94.5Very high82 Ų8261.8 Ų61.838%0.3833%0.325SS..Hα-helixtrans-63.9-37.2179.3-173.5-126.6000112.6K17 H19 N25K17-H21 VanDerWaalsContact O-CB 3.25Å; K17-H21 WeakPolarHBondContact O-CB 3.38Å; K17-H21 PolarHBondContact O-N 3.19Å; K17-H21 VanDerWaalsContact O-N 3.14Å; H19-H21 VanDerWaalsContact C-N 3.3Å; H19-H21 PolarHBondContact O-N 2.96Å; H21-N25 PolarHBondContact CD2-ND2 3.3Å; H21-N25 VanDerWaalsContact CD2-ND2 3.28Å; H21-N25 PolarHBondContact CE1-ND2 3.28Å; H21-N25 PolarHBondContact NE2-ND2 3.39Å; H21-N25 WeakPolarHBondContact O-CB 3.48Å; H21-N25 VanDerWaalsContact O-CG 3.26Å; H21-N25 PolarHBondContact O-N 3.49Å; H21-N25 VanDerWaalsContact O-N 3.11Å; H21-N25 PolarHBondContact O-ND2 3.4Å; H21-N25 VanDerWaalsContact O-ND2 3.11Å
22G91.8Very high94.7Very high35 Ų3557.3 Ų57.336%0.36130%0.302SS..Hα-helixtrans-64.8-43174.800000112.9K18 H19 I20 R26K18-G22 PolarHBondContact O-N 3.35Å; H19-G22 PolarHBondContact O-N 3.02Å; I20-G22 VanDerWaalsContact C-N 3.32Å; I20-G22 PolarHBondContact O-N 3.01Å; G22-R26 VanDerWaalsContact O-CG 3.31Å; G22-R26 WeakPolarHBondContact O-CG 3.17Å; G22-R26 PolarHBondContact O-N 3.34Å
23L97.2Very high94.8Very high2 Ų261.2 Ų61.21%0.0132%0.319CS..Hα-helixtrans-63-50.8176.8-67.9-179.7000112H19 I20 N25 R26 V27 V35 D38 L39H19-L23 VanDerWaalsContact CD2-CD1 3.48Å; H19-L23 WeakPolarHBondContact CD2-CD1 3.36Å; H19-L23 WeakPolarHBondContact O-CG 3.44Å; H19-L23 PolarHBondContact O-N 2.85Å; I20-L23 PolarHBondContact O-N 2.77Å; L23-N25 VanDerWaalsContact C-N 3.34Å; L23-N25 PolarHBondContact O-N 2.82Å; L23-R26 VanDerWaalsContact CD2-CZ 3.48Å; L23-R26 WeakPolarHBondContact O-CG 3.49Å; L23-R26 PolarHBondContact O-N 2.72Å; L23-V27 PolarHBondContact O-N 3.03Å; L23-V35 HydrophobicContact CB-CG1 4.21Å; L23-D38 HydrophobicContact CD1-CB 4.06Å; L23-D38 HydrophobicContact CD2-CB 3.68Å; L23-L39 HydrophobicContact CB-CD1 4.46Å; L23-L39 HydrophobicContact CD1-CB 3.95Å; L23-L39 HydrophobicContact CD1-CD1 3.72Å; L23-L39 HydrophobicContact CD1-CG 4.47Å
24V96.9Very high94.8Very high0 Ų064.8 Ų64.80%034%0.337CS..Hα-helixtrans-62.8-39.9-178.8171.30000111.5I20 R26 V27 F51 A54 I55 A58 M69I20-V24 HydrophobicContact CG2-CG2 4.35Å; I20-V24 WeakPolarHBondContact O-CG2 3.44Å; I20-V24 PolarHBondContact O-N 3.36Å; V24-R26 VanDerWaalsContact C-N 3.31Å; V24-R26 PolarHBondContact O-N 3.3Å; V24-V27 VanDerWaalsContact O-CG1 3.29Å; V24-V27 WeakPolarHBondContact O-CG1 3.46Å; V24-F51 HydrophobicContact CG2-CD2 3.94Å; V24-F51 HydrophobicContact CG2-CE2 3.92Å; V24-A54 HydrophobicContact CB-CB 4.26Å; V24-A54 HydrophobicContact CG1-CB 4.25Å; V24-A54 HydrophobicContact CG2-CB 4.22Å; V24-I55 HydrophobicContact CG1-CB 4.12Å; V24-I55 HydrophobicContact CG1-CG1 4.24Å; V24-A58 HydrophobicContact CG1-CB 3.69Å; V24-M69 HydrophobicContact CG1-SD 4.35Å; V24-M69 WeakPolarHBondContact O-CE 3.42Å
25N92.2Very high94.8Very high86 Ų8662.2 Ų62.246%0.4632%0.323SS..Hα-helixtrans-75-17.1-178.2-73.6-27.1000114.5H21 L23H21-N25 PolarHBondContact CD2-ND2 3.3Å; H21-N25 VanDerWaalsContact CD2-ND2 3.28Å; H21-N25 PolarHBondContact CE1-ND2 3.28Å; H21-N25 PolarHBondContact NE2-ND2 3.39Å; H21-N25 WeakPolarHBondContact O-CB 3.48Å; H21-N25 VanDerWaalsContact O-CG 3.26Å; H21-N25 PolarHBondContact O-N 3.49Å; H21-N25 VanDerWaalsContact O-N 3.11Å; H21-N25 PolarHBondContact O-ND2 3.4Å; H21-N25 VanDerWaalsContact O-ND2 3.11Å; L23-N25 VanDerWaalsContact C-N 3.34Å; L23-N25 PolarHBondContact O-N 2.82Å
26R92.9Very high94.9Very high122 Ų12256.8 Ų56.846%0.4630%0.298SS..Hα-helixtrans-101.5-6.4-178.976-175.7-175.5171.24.1113.7G22 L23 V24 N28 N31 V35 D38G22-R26 VanDerWaalsContact O-CG 3.31Å; G22-R26 WeakPolarHBondContact O-CG 3.17Å; G22-R26 PolarHBondContact O-N 3.34Å; L23-R26 VanDerWaalsContact CD2-CZ 3.48Å; L23-R26 WeakPolarHBondContact O-CG 3.49Å; L23-R26 PolarHBondContact O-N 2.72Å; V24-R26 VanDerWaalsContact C-N 3.31Å; V24-R26 PolarHBondContact O-N 3.3Å; R26-N28 PolarHBondContact O-ND2 3.05Å; R26-N31 PolarHBondContact O-ND2 2.91Å; R26-V35 HydrophobicContact CG-CG2 4.32Å; R26-D38 IonicContact CZ-OD2 3.76Å; R26-D38 IonicContact NH2-OD2 2.87Å; R26-D38 PolarHBondContact NH2-OD2 3Å
27V95.4Very high94.8Very high14 Ų1458.1 Ų58.19%0.08530%0.304CS..  trans-65.5135.6-176.975.80000111.2L23 V24 N31 I32 V35 I68 M69 L72L23-V27 PolarHBondContact O-N 3.03Å; V24-V27 VanDerWaalsContact O-CG1 3.29Å; V24-V27 WeakPolarHBondContact O-CG1 3.46Å; V27-N31 WeakPolarHBondContact CA-OD1 3.47Å; V27-I32 HydrophobicContact CG2-CB 4.13Å; V27-I32 HydrophobicContact CG2-CG1 3.96Å; V27-V35 HydrophobicContact CB-CG1 4.12Å; V27-V35 HydrophobicContact CB-CG2 4.35Å; V27-V35 HydrophobicContact CG2-CB 4.12Å; V27-V35 HydrophobicContact CG2-CG1 3.96Å; V27-V35 HydrophobicContact CG2-CG2 4.27Å; V27-I68 HydrophobicContact CG1-CG2 4.27Å; V27-I68 HydrophobicContact CG2-CG2 4.14Å; V27-M69 HydrophobicContact CG1-CE 3.5Å; V27-M69 VanDerWaalsContact CG1-CE 3.5Å; V27-M69 HydrophobicContact CG1-SD 3.52Å; V27-M69 VanDerWaalsContact CG1-SD 3.52Å; V27-L72 HydrophobicContact CG1-CD2 4.31Å; V27-L72 HydrophobicContact CG2-CD2 4.37Å
28N92.1Very high94.8Very high61 Ų6155 Ų5533%0.32629%0.292SS..  trans-151174.9172.26261.7000108.7R26 S30 N31 I32R26-N28 PolarHBondContact O-ND2 3.05Å; N28-S30 PolarHBondContact O-N 2.97Å; N28-S30 PolarHBondContact OD1-N 3.15Å; N28-S30 PolarHBondContact OD1-OG 3.28Å; N28-N31 PolarHBondContact N-OD1 3.04Å; N28-N31 PolarHBondContact ND2-ND2 3.18Å; N28-N31 PolarHBondContact O-N 3.11Å; N28-N31 PolarHBondContact O-OD1 2.98Å; N28-N31 VanDerWaalsContact O-OD1 3.1Å; N28-N31 PolarHBondContact OD1-N 2.82Å; N28-N31 PolarHBondContact OD1-OD1 2.95Å; N28-I32 WeakPolarHBondContact O-CB 3.38Å; N28-I32 PolarHBondContact O-N 3.42Å; N28-I32 VanDerWaalsContact O-N 3.09Å
29A91.6Very high95Very high57 Ų5747.2 Ų47.247%0.47126%0.258SS..THydrogen-bonded Turntrans-60.2-30.9-174.800000113.8I68A29-I68 HydrophobicContact CB-CD1 4.25Å
30S93.1Very high95Very high117 Ų11743 Ų4382%0.81824%0.238SC*.THydrogen-bonded Turntrans-87.1-11.8-17766.10000114.4N28N28-S30 PolarHBondContact O-N 2.97Å; N28-S30 PolarHBondContact OD1-N 3.15Å; N28-S30 PolarHBondContact OD1-OG 3.28Å
31N95.6Very high94.8Very high43 Ų4346.8 Ų46.823%0.2326%0.255CS..THydrogen-bonded Turntrans-124.18.2179.874.42.2000114.1R26 V27 N28 I33 Q34 V35R26-N31 PolarHBondContact O-ND2 2.91Å; V27-N31 WeakPolarHBondContact CA-OD1 3.47Å; N28-N31 PolarHBondContact N-OD1 3.04Å; N28-N31 PolarHBondContact ND2-ND2 3.18Å; N28-N31 PolarHBondContact O-N 3.11Å; N28-N31 PolarHBondContact O-OD1 2.98Å; N28-N31 VanDerWaalsContact O-OD1 3.1Å; N28-N31 PolarHBondContact OD1-N 2.82Å; N28-N31 PolarHBondContact OD1-OD1 2.95Å; N31-I33 VanDerWaalsContact C-N 3.35Å; N31-I33 PolarHBondContact O-N 3.42Å; N31-Q34 PolarHBondContact O-N 2.97Å; N31-V35 WeakPolarHBondContact O-CG2 3.29Å; N31-V35 PolarHBondContact O-N 3.43Å
32I97.3Very high94.8Very high3 Ų343.7 Ų43.72%0.01524%0.241CC..Hα-helixtrans-60.4-41.6-174-171167.4000112.5V27 N28 V35 I36 I68 A71 L72 L211 L213V27-I32 HydrophobicContact CG2-CB 4.13Å; V27-I32 HydrophobicContact CG2-CG1 3.96Å; N28-I32 WeakPolarHBondContact O-CB 3.38Å; N28-I32 PolarHBondContact O-N 3.42Å; N28-I32 VanDerWaalsContact O-N 3.09Å; I32-V35 PolarHBondContact O-N 3.2Å; I32-I36 HydrophobicContact CG1-CD1 3.89Å; I32-I36 HydrophobicContact CG1-CG1 4.38Å; I32-I36 WeakPolarHBondContact O-CD1 3.49Å; I32-I36 VanDerWaalsContact O-CG1 3.27Å; I32-I36 WeakPolarHBondContact O-CG1 3.49Å; I32-I36 PolarHBondContact O-N 2.82Å; I32-I68 HydrophobicContact CD1-CG2 4.22Å; I32-A71 HydrophobicContact CD1-CB 3.84Å; I32-L72 HydrophobicContact CD1-CB 4.35Å; I32-L211 HydrophobicContact CD1-CD2 3.91Å; I32-L211 HydrophobicContact CG2-CD2 4.04Å; I32-L213 HydrophobicContact CD1-CD1 3.8Å; I32-L213 HydrophobicContact CG1-CD1 4.03Å; I32-L213 HydrophobicContact CG2-CD1 3.88Å
33I95.3Very high95Very high99 Ų9942.5 Ų42.551%0.50823%0.227SC..Hα-helixtrans-59.3-53.1178.1-60.5174.6000110.2N31 V35 I36 E37N31-I33 VanDerWaalsContact C-N 3.35Å; N31-I33 PolarHBondContact O-N 3.42Å; I33-V35 VanDerWaalsContact C-N 3.26Å; I33-V35 PolarHBondContact O-N 3.4Å; I33-I36 WeakPolarHBondContact O-CA 3.19Å; I33-I36 WeakPolarHBondContact O-CB 3.13Å; I33-I36 PolarHBondContact O-N 3.09Å; I33-E37 PolarHBondContact O-N 3.07Å
34Q94.9Very high95Very high90 Ų9042.4 Ų42.442%0.42123%0.227SC..Hα-helixtrans-60-36.8176.8-175.663.689.500112.8N31 E37 D38N31-Q34 PolarHBondContact O-N 2.97Å; Q34-E37 PolarHBondContact NE2-OE2 3.32Å; Q34-D38 WeakPolarHBondContact O-CB 3.45Å; Q34-D38 PolarHBondContact O-N 3.43Å
35V96.7Very high94.9Very high2 Ų245.9 Ų45.91%0.01224%0.244CC..Hα-helixtrans-66.7-38.2176.21680000111.1L23 R26 V27 N31 I32 I33 D38 L39 L72L23-V35 HydrophobicContact CB-CG1 4.21Å; R26-V35 HydrophobicContact CG-CG2 4.32Å; V27-V35 HydrophobicContact CB-CG1 4.12Å; V27-V35 HydrophobicContact CB-CG2 4.35Å; V27-V35 HydrophobicContact CG2-CB 4.12Å; V27-V35 HydrophobicContact CG2-CG1 3.96Å; V27-V35 HydrophobicContact CG2-CG2 4.27Å; N31-V35 WeakPolarHBondContact O-CG2 3.29Å; N31-V35 PolarHBondContact O-N 3.43Å; I32-V35 PolarHBondContact O-N 3.2Å; I33-V35 VanDerWaalsContact C-N 3.26Å; I33-V35 PolarHBondContact O-N 3.4Å; V35-D38 PolarHBondContact O-N 3.26Å; V35-L39 WeakPolarHBondContact O-CB 3.45Å; V35-L39 PolarHBondContact O-N 3.45Å; V35-L72 HydrophobicContact CG1-CD1 4.3Å
36I96.8Very high95Very high11 Ų1143.7 Ų43.76%0.05623%0.23CC..Hα-helixtrans-61.6-52.2175.4-72.9158.5000110I32 I33 D38 L39 F40 L72 V75 L213I32-I36 HydrophobicContact CG1-CD1 3.89Å; I32-I36 HydrophobicContact CG1-CG1 4.38Å; I32-I36 WeakPolarHBondContact O-CD1 3.49Å; I32-I36 VanDerWaalsContact O-CG1 3.27Å; I32-I36 WeakPolarHBondContact O-CG1 3.49Å; I32-I36 PolarHBondContact O-N 2.82Å; I33-I36 WeakPolarHBondContact O-CA 3.19Å; I33-I36 WeakPolarHBondContact O-CB 3.13Å; I33-I36 PolarHBondContact O-N 3.09Å; I36-D38 VanDerWaalsContact C-N 3.33Å; I36-D38 PolarHBondContact O-N 3.43Å; I36-L39 CarbonylContact O-C 3.54Å; I36-L39 WeakPolarHBondContact O-CA 3.34Å; I36-L39 WeakPolarHBondContact O-CB 3.49Å; I36-L39 PolarHBondContact O-N 3.04Å; I36-F40 HydrophobicContact CG2-CD2 3.86Å; I36-F40 HydrophobicContact CG2-CE2 3.52Å; I36-F40 HydrophobicContact CG2-CZ 4.12Å; I36-F40 PolarHBondContact O-N 3.48Å; I36-L72 HydrophobicContact CG1-CD1 3.68Å; I36-V75 HydrophobicContact CD1-CB 4.02Å; I36-V75 HydrophobicContact CD1-CG1 3.98Å; I36-V75 HydrophobicContact CD1-CG2 3.8Å; I36-V75 HydrophobicContact CG1-CB 4.36Å; I36-V75 HydrophobicContact CG1-CG1 4.19Å; I36-V75 HydrophobicContact CG2-CG1 3.64Å; I36-L213 HydrophobicContact CD1-CD1 3.77Å
37E94.4Very high95.2Very high46 Ų4637.9 Ų37.922%0.21521%0.208CC..Hα-helixtrans-55.7-47.9176.8-71.3168-137.300111.8I33 Q34 L39 F40 K41I33-E37 PolarHBondContact O-N 3.07Å; Q34-E37 PolarHBondContact NE2-OE2 3.32Å; E37-L39 PolarHBondContact O-N 3.07Å; E37-F40 PolarHBondContact O-N 3.24Å; E37-K41 WeakPolarHBondContact O-CG 3.35Å; E37-K41 PolarHBondContact O-N 3.36Å; E37-K41 VanDerWaalsContact O-N 3.11Å
38D96.2Very high95.4Very high31 Ų3140 Ų4017%0.16621%0.214CC..Hα-helixtrans-64.2-31.3178.5-78.9-12.4000112.2L23 R26 Q34 V35 I36 K41L23-D38 HydrophobicContact CD1-CB 4.06Å; L23-D38 HydrophobicContact CD2-CB 3.68Å; R26-D38 IonicContact CZ-OD2 3.76Å; R26-D38 IonicContact NH2-OD2 2.87Å; R26-D38 PolarHBondContact NH2-OD2 3Å; Q34-D38 WeakPolarHBondContact O-CB 3.45Å; Q34-D38 PolarHBondContact O-N 3.43Å; V35-D38 PolarHBondContact O-N 3.26Å; I36-D38 VanDerWaalsContact C-N 3.33Å; I36-D38 PolarHBondContact O-N 3.43Å; D38-K41 PolarHBondContact O-N 2.92Å; D38-K41 IonicContact OD1-NZ 2.82Å; D38-K41 PolarHBondContact OD1-NZ 2.63Å
39L97.1Very high95.7Very high1 Ų137 Ų371%0.00520%0.198CC..Hα-helixtrans-74.3-35178-168.470.2000111.6I20 L23 V35 I36 E37 K41 V42 L44 F51 L72 V76I20-L39 HydrophobicContact CG1-CD1 4.32Å; I20-L39 HydrophobicContact CG2-CD1 4.5Å; L23-L39 HydrophobicContact CB-CD1 4.46Å; L23-L39 HydrophobicContact CD1-CB 3.95Å; L23-L39 HydrophobicContact CD1-CD1 3.72Å; L23-L39 HydrophobicContact CD1-CG 4.47Å; V35-L39 WeakPolarHBondContact O-CB 3.45Å; V35-L39 PolarHBondContact O-N 3.45Å; I36-L39 CarbonylContact O-C 3.54Å; I36-L39 WeakPolarHBondContact O-CA 3.34Å; I36-L39 WeakPolarHBondContact O-CB 3.49Å; I36-L39 PolarHBondContact O-N 3.04Å; E37-L39 PolarHBondContact O-N 3.07Å; L39-K41 VanDerWaalsContact C-N 3.27Å; L39-K41 PolarHBondContact O-N 3.05Å; L39-V42 HydrophobicContact CD1-CG2 4.31Å; L39-V42 WeakPolarHBondContact O-CG2 3.48Å; L39-V42 PolarHBondContact O-N 3.03Å; L39-L44 HydrophobicContact CD1-CD2 3.92Å; L39-L44 HydrophobicContact CD2-CD1 4.2Å; L39-L44 HydrophobicContact CD2-CD2 4.38Å; L39-L44 HydrophobicContact CG-CD1 3.96Å; L39-L44 HydrophobicContact CG-CD2 3.91Å; L39-L44 HydrophobicContact CG-CG 4.29Å; L39-F51 HydrophobicContact CD1-CD2 4.11Å; L39-F51 HydrophobicContact CD1-CE2 4.38Å; L39-F51 HydrophobicContact CD2-CD2 3.9Å; L39-F51 HydrophobicContact CD2-CE2 3.44Å; L39-F51 VanDerWaalsContact CD2-CE2 3.44Å; L39-F51 HydrophobicContact CD2-CZ 4.16Å; L39-L72 HydrophobicContact CD2-CD1 4.12Å; L39-V76 HydrophobicContact CD2-CG2 3.46Å; L39-V76 VanDerWaalsContact CD2-CG2 3.46Å
40F95.6Very high96Very high1 Ų134.8 Ų34.80%0.00418%0.178CC..Hα-helixtrans-74.4-16.3172.8-66.7-27.3000113.4I36 E37 V42 L44 V75 V76 K79 F80 Y252 R256 I259I36-F40 HydrophobicContact CG2-CD2 3.86Å; I36-F40 HydrophobicContact CG2-CE2 3.52Å; I36-F40 HydrophobicContact CG2-CZ 4.12Å; I36-F40 PolarHBondContact O-N 3.48Å; E37-F40 PolarHBondContact O-N 3.24Å; F40-V42 PolarHBondContact O-N 3.16Å; F40-L44 HydrophobicContact CD1-CD1 3.76Å; F40-L44 HydrophobicContact CE1-CD1 3.97Å; F40-V75 HydrophobicContact CE2-CG1 4.16Å; F40-V75 HydrophobicContact CZ-CG1 3.98Å; F40-V76 HydrophobicContact CE1-CG2 4.26Å; F40-K79 HydrophobicContact CE1-CB 4.44Å; F40-K79 HydrophobicContact CE2-CG 4.18Å; F40-K79 HydrophobicContact CZ-CB 4.18Å; F40-K79 HydrophobicContact CZ-CG 3.79Å; F40-F80 HydrophobicContact CD1-CD2 4.49Å; F40-F80 AromaticContact CD1-CE2 3.82Å; F40-F80 HydrophobicContact CD1-CE2 3.82Å; F40-F80 HydrophobicContact CE1-CD2 4.07Å; F40-F80 AromaticContact CE1-CE2 3.78Å; F40-F80 HydrophobicContact CE1-CE2 3.78Å; F40-Y252 PolarHBondContact O-OH 3.06Å; F40-R256 WeakPolarHBondContact O-CG 3.44Å; F40-I259 HydrophobicContact CD2-CG2 3.77Å; F40-I259 HydrophobicContact CE2-CG2 4.1Å; F40-I259 HydrophobicContact CG-CG2 4.4Å
41K94.5Very high96.2Very high79 Ų7929.3 Ų29.334%0.34314%0.14SC..THydrogen-bonded Turntrans-71-12.5168.7-66.9167.7-157.4159.80113.9E37 D38 L39 L260E37-K41 WeakPolarHBondContact O-CG 3.35Å; E37-K41 PolarHBondContact O-N 3.36Å; E37-K41 VanDerWaalsContact O-N 3.11Å; D38-K41 PolarHBondContact O-N 2.92Å; D38-K41 IonicContact OD1-NZ 2.82Å; D38-K41 PolarHBondContact OD1-NZ 2.63Å; L39-K41 VanDerWaalsContact C-N 3.27Å; L39-K41 PolarHBondContact O-N 3.05Å; K41-L260 HydrophobicContact CG-CD1 4.25Å
42V94.2Very high96.4Very high17 Ų1727.3 Ų27.310%0.10313%0.129CC..SBendtrans-113.8143.3179.4-610000111.4L16 H19 I20 L39 F40 L44 Y252L16-V42 HydrophobicContact CD1-CB 3.74Å; L16-V42 HydrophobicContact CD1-CG2 4.16Å; H19-V42 HydrophobicContact CB-CG1 4.46Å; I20-V42 HydrophobicContact CD1-CG2 4.45Å; I20-V42 HydrophobicContact CG1-CG2 3.89Å; L39-V42 HydrophobicContact CD1-CG2 4.31Å; L39-V42 WeakPolarHBondContact O-CG2 3.48Å; L39-V42 PolarHBondContact O-N 3.03Å; F40-V42 PolarHBondContact O-N 3.16Å; V42-L44 PolarHBondContact O-N 3.13Å; V42-Y252 VanDerWaalsContact O-CE1 3.31Å; V42-Y252 WeakPolarHBondContact O-CE1 3.45Å; V42-Y252 PolarHBondContact O-OH 3.45Å
43N95.7Very high96.4Very high11 Ų1132.6 Ų32.66%0.05915%0.149CC..  trans-61.188.1-177.3-169-23.3000113.5I45 R46 G47 E249 Y252N43-I45 VanDerWaalsContact C-N 3.32Å; N43-I45 PolarHBondContact O-N 2.78Å; N43-I45 PolarHBondContact OD1-N 2.94Å; N43-R46 HydrophobicContact CB-CB 4.21Å; N43-R46 PolarHBondContact O-N 3.29Å; N43-R46 WeakPolarHBondContact OD1-CB 3.4Å; N43-R46 PolarHBondContact OD1-N 3.41Å; N43-G47 WeakPolarHBondContact O-CA 3.1Å; N43-G47 PolarHBondContact O-N 2.82Å; N43-E249 PolarHBondContact ND2-OE1 3.39Å; N43-Y252 VanDerWaalsContact CA-CE1 3.42Å; N43-Y252 HydrophobicContact CB-CD1 3.89Å; N43-Y252 HydrophobicContact CB-CD2 4.27Å; N43-Y252 HydrophobicContact CB-CE1 4.29Å; N43-Y252 HydrophobicContact CB-CG 3.88Å; N43-Y252 VanDerWaalsContact CG-CG 3.49Å; N43-Y252 VanDerWaalsContact OD1-CD2 3.25Å; N43-Y252 WeakPolarHBondContact OD1-CD2 3.37Å
44L96.1Very high96.6Very high0 Ų028.1 Ų28.10%013%0.126CC..Hα-helixtrans-70.6-24.8178.8-77-179.7000112.9I20 L39 F40 V42 G47 R48 F51 V76 F80 Y252I20-L44 HydrophobicContact CD1-CD2 4.34Å; L39-L44 HydrophobicContact CD1-CD2 3.92Å; L39-L44 HydrophobicContact CD2-CD1 4.2Å; L39-L44 HydrophobicContact CD2-CD2 4.38Å; L39-L44 HydrophobicContact CG-CD1 3.96Å; L39-L44 HydrophobicContact CG-CD2 3.91Å; L39-L44 HydrophobicContact CG-CG 4.29Å; F40-L44 HydrophobicContact CD1-CD1 3.76Å; F40-L44 HydrophobicContact CE1-CD1 3.97Å; V42-L44 PolarHBondContact O-N 3.13Å; L44-G47 CarbonylContact O-C 3.6Å; L44-G47 PolarHBondContact O-N 3.11Å; L44-R48 VanDerWaalsContact O-CA 3.29Å; L44-R48 WeakPolarHBondContact O-CA 3.15Å; L44-R48 VanDerWaalsContact O-CB 3.29Å; L44-R48 WeakPolarHBondContact O-CB 3.47Å; L44-R48 PolarHBondContact O-N 3.24Å; L44-F51 HydrophobicContact CD2-CB 4.21Å; L44-F51 HydrophobicContact CD2-CD2 4.43Å; L44-F51 HydrophobicContact CD2-CG 4.34Å; L44-V76 HydrophobicContact CD1-CG1 3.99Å; L44-V76 HydrophobicContact CD1-CG2 4.26Å; L44-F80 HydrophobicContact CB-CD2 4.28Å; L44-F80 HydrophobicContact CB-CE2 4.33Å; L44-F80 HydrophobicContact CD1-CD2 3.96Å; L44-F80 HydrophobicContact CD1-CE2 4.01Å; L44-Y252 HydrophobicContact CB-CE2 4.33Å; L44-Y252 PolarHBondContact N-OH 3.24Å
45I95.3Very high96.7Very high73 Ų7323.8 Ų23.837%0.37411%0.106SC..Hα-helixtrans-63.7-50.2174.2-62.8178.1000108.8N43 R48 F80 Y252 I255N43-I45 VanDerWaalsContact C-N 3.32Å; N43-I45 PolarHBondContact O-N 2.78Å; N43-I45 PolarHBondContact OD1-N 2.94Å; I45-R48 WeakPolarHBondContact O-CG 3.35Å; I45-R48 PolarHBondContact O-NH1 2.96Å; I45-F80 HydrophobicContact CD1-CD1 4.34Å; I45-F80 HydrophobicContact CD1-CE1 4.08Å; I45-F80 HydrophobicContact CG1-CD1 3.85Å; I45-F80 HydrophobicContact CG1-CE1 3.86Å; I45-Y252 HydrophobicContact CB-CD2 4.24Å; I45-Y252 HydrophobicContact CD1-CD2 3.92Å; I45-Y252 HydrophobicContact CD1-CE2 4.4Å; I45-Y252 HydrophobicContact CG1-CD2 3.87Å; I45-Y252 HydrophobicContact CG1-CE2 4.02Å; I45-I255 HydrophobicContact CD1-CD1 3.89Å
46R95.3Very high96.8Very high40 Ų4024.6 Ų24.615%0.15111%0.11CC..Hα-helixtrans-67.3-38.9174.5-174.7171.1-176.5-105.63.5111.7Q9 W13 L16 N43Q9-R46 PolarHBondContact O-NH2 3.38Å; W13-R46 HydrophobicContact CE3-CG 4.32Å; W13-R46 HydrophobicContact CZ3-CG 4.02Å; W13-R46 WeakPolarHBondContact CZ3-O 3.37Å; L16-R46 HydrophobicContact CD2-CB 4.47Å; L16-R46 HydrophobicContact CD2-CG 4.29Å; N43-R46 HydrophobicContact CB-CB 4.21Å; N43-R46 PolarHBondContact O-N 3.29Å; N43-R46 WeakPolarHBondContact OD1-CB 3.4Å; N43-R46 PolarHBondContact OD1-N 3.41Å
47G97.2Very high96.8Very high0 Ų027.6 Ų27.60%012%0.124CC..Hα-helixtrans-85.1-1.5-175.100000116.1N43 L44 G49 I50 F51N43-G47 WeakPolarHBondContact O-CA 3.1Å; N43-G47 PolarHBondContact O-N 2.82Å; L44-G47 CarbonylContact O-C 3.6Å; L44-G47 PolarHBondContact O-N 3.11Å; G47-G49 VanDerWaalsContact C-N 3.31Å; G47-G49 PolarHBondContact O-N 3.42Å; G47-G49 VanDerWaalsContact O-N 3.17Å; G47-I50 WeakPolarHBondContact O-CA 3.44Å; G47-I50 VanDerWaalsContact O-CB 3.26Å; G47-I50 WeakPolarHBondContact O-CB 3.25Å; G47-I50 PolarHBondContact O-N 3.36Å; G47-F51 PolarHBondContact O-N 2.91Å
48R98Very high96.8Very high57 Ų5725.7 Ų25.722%0.21512%0.116CC..Hα-helixtrans-54.6-41.8-17065.5-170.4-175.8-914.8114.3L44 I45 I50 F51 V52 V83 L86 L236L44-R48 VanDerWaalsContact O-CA 3.29Å; L44-R48 WeakPolarHBondContact O-CA 3.15Å; L44-R48 VanDerWaalsContact O-CB 3.29Å; L44-R48 WeakPolarHBondContact O-CB 3.47Å; L44-R48 PolarHBondContact O-N 3.24Å; I45-R48 WeakPolarHBondContact O-CG 3.35Å; I45-R48 PolarHBondContact O-NH1 2.96Å; R48-I50 VanDerWaalsContact C-N 3.31Å; R48-I50 PolarHBondContact O-N 3.27Å; R48-F51 PolarHBondContact O-N 3.29Å; R48-V52 WeakPolarHBondContact O-CB 3.38Å; R48-V52 VanDerWaalsContact O-CG2 3.3Å; R48-V52 WeakPolarHBondContact O-CG2 3.37Å; R48-V52 PolarHBondContact O-N 3.49Å; R48-V83 HydrophobicContact CB-CG2 3.79Å; R48-L86 HydrophobicContact CB-CD2 4.47Å; R48-L86 HydrophobicContact CG-CD2 4.1Å; R48-L236 HydrophobicContact CG-CD1 3.82Å
49G98.2Very high96.8Very high0 Ų024.2 Ų24.20%011%0.108CC..Hα-helixtrans-63.6-37.6176.700000112.8G47 R53 R90 N237G47-G49 VanDerWaalsContact C-N 3.31Å; G47-G49 PolarHBondContact O-N 3.42Å; G47-G49 VanDerWaalsContact O-N 3.17Å; G49-R53 WeakPolarHBondContact O-CB 3.44Å; G49-R53 PolarHBondContact O-N 3.11Å; G49-R53 VanDerWaalsContact O-N 3.12Å; G49-R90 PolarHBondContact O-NH1 3.3Å; G49-N237 PolarHBondContact O-OD1 3.38Å
50I98.1Very high96.8Very high10 Ų1026.1 Ų26.15%0.05112%0.122CC..Hα-helixtrans-67.1-50.3175.6-59.9169.1000110.2W13 L16 K17 I20 G47 R48 R53 A54W13-I50 HydrophobicContact CD2-CD1 4.19Å; W13-I50 HydrophobicContact CE3-CD1 4.21Å; W13-I50 HydrophobicContact CH2-CD1 3.63Å; W13-I50 HydrophobicContact CH2-CG1 3.92Å; W13-I50 HydrophobicContact CZ2-CD1 3.58Å; W13-I50 HydrophobicContact CZ2-CG1 3.81Å; W13-I50 HydrophobicContact CZ3-CD1 3.95Å; L16-I50 HydrophobicContact CD2-CD1 4.43Å; L16-I50 HydrophobicContact CG-CD1 4.42Å; K17-I50 HydrophobicContact CB-CD1 3.95Å; K17-I50 HydrophobicContact CB-CG2 4.31Å; K17-I50 HydrophobicContact CG-CD1 4.4Å; K17-I50 HydrophobicContact CG-CG2 3.95Å; I20-I50 HydrophobicContact CB-CG2 4.18Å; I20-I50 HydrophobicContact CD1-CB 4.37Å; I20-I50 HydrophobicContact CD1-CG2 4.28Å; I20-I50 HydrophobicContact CG2-CG2 4.08Å; G47-I50 WeakPolarHBondContact O-CA 3.44Å; G47-I50 VanDerWaalsContact O-CB 3.26Å; G47-I50 WeakPolarHBondContact O-CB 3.25Å; G47-I50 PolarHBondContact O-N 3.36Å; R48-I50 VanDerWaalsContact C-N 3.31Å; R48-I50 PolarHBondContact O-N 3.27Å; I50-R53 PolarHBondContact O-N 3.34Å; I50-A54 WeakPolarHBondContact O-CB 3.49Å; I50-A54 PolarHBondContact O-N 2.98Å
51F98.7Very high96.6Very high2 Ų234.7 Ų34.71%0.00916%0.159CC..Hα-helixtrans-58-51.4-179.4172.2-99.4000111.2I20 V24 L39 L44 G47 R48 R53 A54 I55 L72 V76 V83I20-F51 HydrophobicContact CG2-CB 3.92Å; I20-F51 HydrophobicContact CG2-CD2 4.11Å; V24-F51 HydrophobicContact CG2-CD2 3.94Å; V24-F51 HydrophobicContact CG2-CE2 3.92Å; L39-F51 HydrophobicContact CD1-CD2 4.11Å; L39-F51 HydrophobicContact CD1-CE2 4.38Å; L39-F51 HydrophobicContact CD2-CD2 3.9Å; L39-F51 HydrophobicContact CD2-CE2 3.44Å; L39-F51 VanDerWaalsContact CD2-CE2 3.44Å; L39-F51 HydrophobicContact CD2-CZ 4.16Å; L44-F51 HydrophobicContact CD2-CB 4.21Å; L44-F51 HydrophobicContact CD2-CD2 4.43Å; L44-F51 HydrophobicContact CD2-CG 4.34Å; G47-F51 PolarHBondContact O-N 2.91Å; R48-F51 PolarHBondContact O-N 3.29Å; F51-R53 VanDerWaalsContact C-N 3.29Å; F51-R53 PolarHBondContact O-N 3.02Å; F51-A54 PolarHBondContact O-N 2.89Å; F51-A54 VanDerWaalsContact O-N 3.1Å; F51-I55 HydrophobicContact CE1-CD1 4.4Å; F51-I55 HydrophobicContact CE1-CG2 4.47Å; F51-I55 HydrophobicContact CE2-CD1 4.34Å; F51-I55 HydrophobicContact CZ-CD1 3.79Å; F51-I55 PolarHBondContact O-N 2.9Å; F51-L72 HydrophobicContact CE2-CD2 4.21Å; F51-L72 HydrophobicContact CE2-CG 4.42Å; F51-L72 HydrophobicContact CZ-CD2 4.5Å; F51-L72 HydrophobicContact CZ-CG 4.35Å; F51-V76 HydrophobicContact CD1-CG1 4.44Å; F51-V76 HydrophobicContact CE1-CB 4.26Å; F51-V76 HydrophobicContact CE1-CG1 3.96Å; F51-V76 HydrophobicContact CE1-CG2 4.31Å; F51-V76 HydrophobicContact CE2-CG2 4.32Å; F51-V76 HydrophobicContact CZ-CB 4.23Å; F51-V76 HydrophobicContact CZ-CG1 4.32Å; F51-V76 HydrophobicContact CZ-CG2 3.82Å; F51-V83 HydrophobicContact CD1-CG1 3.42Å; F51-V83 VanDerWaalsContact CD1-CG1 3.42Å; F51-V83 HydrophobicContact CE1-CG1 3.75Å
52V98.8Very high96.4Very high0 Ų032.4 Ų32.40%016%0.155CC..Hα-helixtrans-58.7-42.3178.4172.40000111.3R48 I55 M56 V83 L86 L87 R90R48-V52 WeakPolarHBondContact O-CB 3.38Å; R48-V52 VanDerWaalsContact O-CG2 3.3Å; R48-V52 WeakPolarHBondContact O-CG2 3.37Å; R48-V52 PolarHBondContact O-N 3.49Å; V52-I55 WeakPolarHBondContact O-CG2 3.36Å; V52-M56 HydrophobicContact CG1-CG 4.43Å; V52-M56 HydrophobicContact CG1-SD 3.79Å; V52-M56 WeakPolarHBondContact O-CB 3.34Å; V52-M56 WeakPolarHBondContact O-CG 3.39Å; V52-M56 PolarHBondContact O-N 3.39Å; V52-M56 VanDerWaalsContact O-N 3.12Å; V52-V83 HydrophobicContact CG2-CG1 3.93Å; V52-L86 HydrophobicContact CG1-CG 4.49Å; V52-L86 HydrophobicContact CG2-CB 4.31Å; V52-L86 HydrophobicContact CG2-CD2 4.09Å; V52-L86 HydrophobicContact CG2-CG 4.12Å; V52-L87 HydrophobicContact CG1-CB 4.13Å; V52-L87 HydrophobicContact CG1-CD1 3.89Å; V52-L87 HydrophobicContact CG2-CB 4.09Å; V52-R90 HydrophobicContact CG1-CB 4.36Å; V52-R90 HydrophobicContact CG1-CG 4.49Å
53R98.1Very high96.3Very high115 Ų11534.9 Ų34.943%0.43417%0.165SC..Hα-helixtrans-64.2-44.5175.8-179.7176.5177.3163.94.2112.1G49 I50 F51 Q57G49-R53 WeakPolarHBondContact O-CB 3.44Å; G49-R53 PolarHBondContact O-N 3.11Å; G49-R53 VanDerWaalsContact O-N 3.12Å; I50-R53 PolarHBondContact O-N 3.34Å; F51-R53 VanDerWaalsContact C-N 3.29Å; F51-R53 PolarHBondContact O-N 3.02Å; R53-Q57 WeakPolarHBondContact O-CB 3.35Å; R53-Q57 VanDerWaalsContact O-CG 3.26Å; R53-Q57 WeakPolarHBondContact O-CG 3.39Å; R53-Q57 PolarHBondContact O-N 3.48Å
54A98.2Very high96.1Very high4 Ų439.2 Ų39.23%0.03319%0.194CC..Hα-helixtrans-62.9-45.7-178.900000111.1I20 V24 I50 F51 Q57 A58I20-A54 HydrophobicContact CG2-CB 4.43Å; V24-A54 HydrophobicContact CB-CB 4.26Å; V24-A54 HydrophobicContact CG1-CB 4.25Å; V24-A54 HydrophobicContact CG2-CB 4.22Å; I50-A54 WeakPolarHBondContact O-CB 3.49Å; I50-A54 PolarHBondContact O-N 2.98Å; F51-A54 PolarHBondContact O-N 2.89Å; F51-A54 VanDerWaalsContact O-N 3.1Å; A54-Q57 PolarHBondContact O-N 2.86Å; A54-A58 WeakPolarHBondContact O-CB 3.31Å; A54-A58 PolarHBondContact O-N 2.97Å
55I98.6Very high96Very high0 Ų045.7 Ų45.70%022%0.219CC..Hα-helixtrans-70.8-38.3-177.1-156.2170.2000112.4V24 F51 V52 Q57 A58 Q59 M69 L72 A73 L87 F113V24-I55 HydrophobicContact CG1-CB 4.12Å; V24-I55 HydrophobicContact CG1-CG1 4.24Å; F51-I55 HydrophobicContact CE1-CD1 4.4Å; F51-I55 HydrophobicContact CE1-CG2 4.47Å; F51-I55 HydrophobicContact CE2-CD1 4.34Å; F51-I55 HydrophobicContact CZ-CD1 3.79Å; F51-I55 PolarHBondContact O-N 2.9Å; V52-I55 WeakPolarHBondContact O-CG2 3.36Å; I55-Q57 VanDerWaalsContact C-N 3.34Å; I55-Q57 PolarHBondContact O-N 3.1Å; I55-A58 PolarHBondContact O-N 3.02Å; I55-Q59 VanDerWaalsContact O-CB 3.25Å; I55-Q59 WeakPolarHBondContact O-CB 3.28Å; I55-Q59 PolarHBondContact O-N 2.97Å; I55-M69 HydrophobicContact CD1-CB 4.21Å; I55-M69 VanDerWaalsContact CD1-O 3.25Å; I55-M69 WeakPolarHBondContact CD1-O 3.33Å; I55-M69 HydrophobicContact CG1-CB 4Å; I55-M69 HydrophobicContact CG1-CG 4.43Å; I55-M69 HydrophobicContact CG1-SD 3.97Å; I55-L72 HydrophobicContact CD1-CB 4.47Å; I55-L72 HydrophobicContact CD1-CD2 4.14Å; I55-L72 HydrophobicContact CD1-CG 4.42Å; I55-A73 HydrophobicContact CD1-CB 4.15Å; I55-L87 HydrophobicContact CG2-CD1 3.92Å; I55-L87 HydrophobicContact CG2-CD2 4.45Å; I55-F113 HydrophobicContact CD1-CZ 4.31Å; I55-F113 HydrophobicContact CG1-CZ 4.08Å; I55-F113 HydrophobicContact CG2-CE1 4.36Å; I55-F113 HydrophobicContact CG2-CZ 4.37Å
56M98.5Very high96.1Very high18 Ų1842.3 Ų42.39%0.08920%0.202CC..Hα-helixtrans-61.8-41.9172.1-70.5174.271.100111.7V52 S60 L87 R90 L91 Q94V52-M56 HydrophobicContact CG1-CG 4.43Å; V52-M56 HydrophobicContact CG1-SD 3.79Å; V52-M56 WeakPolarHBondContact O-CB 3.34Å; V52-M56 WeakPolarHBondContact O-CG 3.39Å; V52-M56 PolarHBondContact O-N 3.39Å; V52-M56 VanDerWaalsContact O-N 3.12Å; M56-S60 WeakPolarHBondContact O-CB 3.46Å; M56-S60 PolarHBondContact O-N 3.44Å; M56-S60 PolarHBondContact O-OG 3.3Å; M56-L87 HydrophobicContact CG-CD1 3.61Å; M56-L87 HydrophobicContact SD-CD1 4.2Å; M56-R90 HydrophobicContact CE-CB 3.98Å; M56-R90 HydrophobicContact SD-CB 3.64Å; M56-L91 HydrophobicContact CE-CD2 3.92Å; M56-L91 HydrophobicContact CE-CG 4.11Å; M56-L91 HydrophobicContact CG-CD2 4.1Å; M56-L91 HydrophobicContact CG-CG 4.22Å; M56-L91 HydrophobicContact SD-CG 4.41Å; M56-Q94 HydrophobicContact CE-CB 4.26Å
57Q95.8Very high96.2Very high74 Ų7443.5 Ų43.535%0.34621%0.209SC..Hα-helixtrans-66-51.3177.2-74.5-178.9-36.300111.1R53 A54 I55 Q59 S60 F61R53-Q57 WeakPolarHBondContact O-CB 3.35Å; R53-Q57 VanDerWaalsContact O-CG 3.26Å; R53-Q57 WeakPolarHBondContact O-CG 3.39Å; R53-Q57 PolarHBondContact O-N 3.48Å; A54-Q57 PolarHBondContact O-N 2.86Å; I55-Q57 VanDerWaalsContact C-N 3.34Å; I55-Q57 PolarHBondContact O-N 3.1Å; Q57-Q59 VanDerWaalsContact C-N 3.33Å; Q57-Q59 PolarHBondContact O-N 2.88Å; Q57-S60 PolarHBondContact O-N 3.5Å; Q57-S60 VanDerWaalsContact O-N 3.13Å; Q57-S60 PolarHBondContact O-OG 3.11Å; Q57-F61 WeakPolarHBondContact O-CD2 3.33Å; Q57-F61 PolarHBondContact O-N 3.13Å; Q57-F61 VanDerWaalsContact O-N 3.1Å
58A94.6Very high96.2Very high6 Ų643.9 Ų43.95%0.0521%0.21CC..Hα-helixtrans-57.5-45.8179.500000111.8V24 A54 I55 S60 F61 A62 M69V24-A58 HydrophobicContact CG1-CB 3.69Å; A54-A58 WeakPolarHBondContact O-CB 3.31Å; A54-A58 PolarHBondContact O-N 2.97Å; I55-A58 PolarHBondContact O-N 3.02Å; A58-S60 PolarHBondContact O-N 3.29Å; A58-F61 PolarHBondContact O-N 3.14Å; A58-A62 WeakPolarHBondContact O-CB 3.47Å; A58-A62 PolarHBondContact O-N 3.29Å; A58-M69 HydrophobicContact CB-CE 3.84Å; A58-M69 HydrophobicContact CB-SD 4.37Å
59Q97.4Very high96.2Very high1 Ų141.6 Ų41.61%0.00520%0.202CC..Hα-helixtrans-61.5-41.8176.2-176.3-84.1-26.800112.1I55 Q57 F61 A62 Q63 S66 M69 P109 F113I55-Q59 VanDerWaalsContact O-CB 3.25Å; I55-Q59 WeakPolarHBondContact O-CB 3.28Å; I55-Q59 PolarHBondContact O-N 2.97Å; Q57-Q59 VanDerWaalsContact C-N 3.33Å; Q57-Q59 PolarHBondContact O-N 2.88Å; Q59-F61 VanDerWaalsContact C-N 3.31Å; Q59-F61 PolarHBondContact O-N 3.39Å; Q59-A62 CarbonylContact O-C 3.6Å; Q59-A62 PolarHBondContact O-N 2.92Å; Q59-Q63 WeakPolarHBondContact O-CA 3.18Å; Q59-Q63 PolarHBondContact O-N 2.9Å; Q59-Q63 VanDerWaalsContact O-N 3.13Å; Q59-S66 WeakPolarHBondContact CG-OG 3.33Å; Q59-S66 PolarHBondContact NE2-OG 3.24Å; Q59-M69 HydrophobicContact CB-CB 4.41Å; Q59-M69 HydrophobicContact CB-CG 4.29Å; Q59-P109 PolarHBondContact NE2-O 3.33Å; Q59-P109 PolarHBondContact OE1-O 2.87Å; Q59-F113 HydrophobicContact CB-CD1 3.77Å; Q59-F113 HydrophobicContact CB-CE1 3.78Å; Q59-F113 HydrophobicContact CB-CG 4.36Å; Q59-F113 HydrophobicContact CB-CZ 4.35Å; Q59-F113 HydrophobicContact CG-CB 4.06Å; Q59-F113 HydrophobicContact CG-CD1 3.58Å; Q59-F113 HydrophobicContact CG-CD2 4.13Å; Q59-F113 HydrophobicContact CG-CE1 4.02Å; Q59-F113 HydrophobicContact CG-CG 3.67Å; Q59-F113 HydrophobicContact CG-CZ 4.47Å
60S95.2Very high96.3Very high41 Ų4141.6 Ų41.629%0.28720%0.202SC..Hα-helixtrans-63.4-35.617972.70000113.3M56 Q57 A58M56-S60 WeakPolarHBondContact O-CB 3.46Å; M56-S60 PolarHBondContact O-N 3.44Å; M56-S60 PolarHBondContact O-OG 3.3Å; Q57-S60 PolarHBondContact O-N 3.5Å; Q57-S60 VanDerWaalsContact O-N 3.13Å; Q57-S60 PolarHBondContact O-OG 3.11Å; A58-S60 PolarHBondContact O-N 3.29Å
61F91.8Very high96.3Very high181 Ų18141.2 Ų41.279%0.79420%0.2SC*.Hα-helixtrans-78.5-28.6176.6-74.6-66.3000113Q57 A58 Q59Q57-F61 WeakPolarHBondContact O-CD2 3.33Å; Q57-F61 PolarHBondContact O-N 3.13Å; Q57-F61 VanDerWaalsContact O-N 3.1Å; A58-F61 PolarHBondContact O-N 3.14Å; Q59-F61 VanDerWaalsContact C-N 3.31Å; Q59-F61 PolarHBondContact O-N 3.39Å
62A91.3Very high96.3Very high31 Ų3141.1 Ų41.126%0.25620%0.2SC..  trans-126.349.1-169.900000112A58 Q59 P64 Y65A58-A62 WeakPolarHBondContact O-CB 3.47Å; A58-A62 PolarHBondContact O-N 3.29Å; Q59-A62 CarbonylContact O-C 3.6Å; Q59-A62 PolarHBondContact O-N 2.92Å; A62-P64 VanDerWaalsContact C-N 3.33Å; A62-P64 VanDerWaalsContact O-N 3.14Å; A62-Y65 HydrophobicContact CB-CD2 4.1Å; A62-Y65 PolarHBondContact O-N 3.2Å
63Q91.8Very high96.3Very high69 Ų6941.2 Ų41.232%0.32220%0.201SC..G310 helixtrans-49.3-38.9-174.4-67.6172.259.800115.8Q59 Y65 S66 P109Q59-Q63 WeakPolarHBondContact O-CA 3.18Å; Q59-Q63 PolarHBondContact O-N 2.9Å; Q59-Q63 VanDerWaalsContact O-N 3.13Å; Q63-Y65 PolarHBondContact O-N 2.9Å; Q63-S66 WeakPolarHBondContact O-CB 3.36Å; Q63-S66 PolarHBondContact O-N 3.44Å; Q63-S66 PolarHBondContact O-OG 3.4Å; Q63-P109 HydrophobicContact CG-CB 3.97Å; Q63-P109 HydrophobicContact CG-CG 4.14Å
64P91Very high96.3Very high101 Ų10135.7 Ų35.766%0.65618%0.18SC*.G310 helixtrans-58.7-19.2177.1-26.136.7000114.2A62 F67A62-P64 VanDerWaalsContact C-N 3.33Å; A62-P64 VanDerWaalsContact O-N 3.14Å; P64-F67 WeakPolarHBondContact O-CE1 3.46Å
65Y94Very high96.3Very high137 Ų13736 Ų3654%0.53718%0.181SC..G310 helixtrans-105.216.7-180-53.3-66.4000113A62 Q63 F67 I68 M69A62-Y65 HydrophobicContact CB-CD2 4.1Å; A62-Y65 PolarHBondContact O-N 3.2Å; Q63-Y65 PolarHBondContact O-N 2.9Å; Y65-F67 PolarHBondContact O-N 2.93Å; Y65-F67 VanDerWaalsContact O-N 3.16Å; Y65-I68 HydrophobicContact CD1-CD1 4.02Å; Y65-I68 WeakPolarHBondContact O-CB 3.23Å; Y65-I68 PolarHBondContact O-N 3.17Å; Y65-M69 PolarHBondContact O-N 3.46Å
66S97.4Very high96.3Very high1 Ų136 Ų361%0.00718%0.181CC..Hα-helixtrans-55.4-34.5-178.3-610000112.9Q59 Q63 I68 M69 A70 H116Q59-S66 WeakPolarHBondContact CG-OG 3.33Å; Q59-S66 PolarHBondContact NE2-OG 3.24Å; Q63-S66 WeakPolarHBondContact O-CB 3.36Å; Q63-S66 PolarHBondContact O-N 3.44Å; Q63-S66 PolarHBondContact O-OG 3.4Å; S66-I68 VanDerWaalsContact C-N 3.33Å; S66-I68 PolarHBondContact O-N 3.41Å; S66-M69 PolarHBondContact O-N 2.7Å; S66-A70 PolarHBondContact O-N 3.12Å; S66-H116 WeakPolarHBondContact CB-CD2 3.43Å
67F97.6Very high96.3Very high66 Ų6635.1 Ų35.129%0.28918%0.177SC..Hα-helixtrans-65.5-32.5178.865.3-89.5000113.2P64 Y65 A70 A71 A208 L211P64-F67 WeakPolarHBondContact O-CE1 3.46Å; Y65-F67 PolarHBondContact O-N 2.93Å; Y65-F67 VanDerWaalsContact O-N 3.16Å; F67-A70 PolarHBondContact O-N 3.31Å; F67-A71 PolarHBondContact O-N 3.13Å; F67-A208 HydrophobicContact CD2-CB 4.1Å; F67-A208 HydrophobicContact CE2-CB 4.09Å; F67-L211 HydrophobicContact CD2-CD1 3.34Å; F67-L211 HydrophobicContact CE2-CD1 3.49Å; F67-L211 VanDerWaalsContact CE2-CD1 3.49Å
68I97.8Very high96.2Very high7 Ų732.3 Ų32.34%0.03617%0.166CC..Hα-helixtrans-69.7-43.8174.6-61.4171.4000110V27 A29 I32 Y65 S66 A70 A71 L72 L211V27-I68 HydrophobicContact CG1-CG2 4.27Å; V27-I68 HydrophobicContact CG2-CG2 4.14Å; A29-I68 HydrophobicContact CB-CD1 4.25Å; I32-I68 HydrophobicContact CD1-CG2 4.22Å; Y65-I68 HydrophobicContact CD1-CD1 4.02Å; Y65-I68 WeakPolarHBondContact O-CB 3.23Å; Y65-I68 PolarHBondContact O-N 3.17Å; S66-I68 VanDerWaalsContact C-N 3.33Å; S66-I68 PolarHBondContact O-N 3.41Å; I68-A70 VanDerWaalsContact C-N 3.29Å; I68-A70 PolarHBondContact O-N 3.39Å; I68-A71 PolarHBondContact O-N 2.96Å; I68-L72 PolarHBondContact O-N 2.97Å; I68-L211 HydrophobicContact CG1-CD1 3.9Å
69M98.4Very high96.2Very high10 Ų1035.3 Ų35.35%0.04918%0.177CC..Hα-helixtrans-65-35.1177.1-61.8-66.217600111.6V24 V27 I55 A58 Q59 Y65 S66 A73 F113V24-M69 HydrophobicContact CG1-SD 4.35Å; V24-M69 WeakPolarHBondContact O-CE 3.42Å; V27-M69 HydrophobicContact CG1-CE 3.5Å; V27-M69 VanDerWaalsContact CG1-CE 3.5Å; V27-M69 HydrophobicContact CG1-SD 3.52Å; V27-M69 VanDerWaalsContact CG1-SD 3.52Å; I55-M69 HydrophobicContact CD1-CB 4.21Å; I55-M69 VanDerWaalsContact CD1-O 3.25Å; I55-M69 WeakPolarHBondContact CD1-O 3.33Å; I55-M69 HydrophobicContact CG1-CB 4Å; I55-M69 HydrophobicContact CG1-CG 4.43Å; I55-M69 HydrophobicContact CG1-SD 3.97Å; A58-M69 HydrophobicContact CB-CE 3.84Å; A58-M69 HydrophobicContact CB-SD 4.37Å; Q59-M69 HydrophobicContact CB-CB 4.41Å; Q59-M69 HydrophobicContact CB-CG 4.29Å; Y65-M69 PolarHBondContact O-N 3.46Å; S66-M69 PolarHBondContact O-N 2.7Å; M69-A73 WeakPolarHBondContact O-CB 3.44Å; M69-A73 PolarHBondContact O-N 3.48Å; M69-F113 HydrophobicContact CB-CE2 4.16Å; M69-F113 HydrophobicContact CB-CZ 4.09Å
70A98.7Very high96.2Very high0 Ų036 Ų360%018%0.181CC..Hα-helixtrans-68.4-39.5174.200000112.4S66 F67 I68 A73 A74 F113 H116 L117 Q120S66-A70 PolarHBondContact O-N 3.12Å; F67-A70 PolarHBondContact O-N 3.31Å; I68-A70 VanDerWaalsContact C-N 3.29Å; I68-A70 PolarHBondContact O-N 3.39Å; A70-A73 PolarHBondContact O-N 3.34Å; A70-A74 WeakPolarHBondContact O-CB 3.36Å; A70-A74 PolarHBondContact O-N 3.22Å; A70-F113 HydrophobicContact CB-CD2 4.46Å; A70-F113 HydrophobicContact CB-CE2 4.11Å; A70-H116 HydrophobicContact CB-CB 3.45Å; A70-H116 VanDerWaalsContact CB-CB 3.45Å; A70-L117 HydrophobicContact CB-CD2 4.25Å; A70-Q120 HydrophobicContact CB-CG 3.97Å
71A98.5Very high96.2Very high1 Ų136.4 Ų36.41%0.00818%0.182CC..Hα-helixtrans-61.1-46.3173.400000111.4I32 F67 I68 A73 A74 V75 L211I32-A71 HydrophobicContact CD1-CB 3.84Å; F67-A71 PolarHBondContact O-N 3.13Å; I68-A71 PolarHBondContact O-N 2.96Å; A71-A73 VanDerWaalsContact C-N 3.31Å; A71-A73 PolarHBondContact O-N 2.69Å; A71-A74 WeakPolarHBondContact O-CB 3.35Å; A71-A74 PolarHBondContact O-N 3.42Å; A71-A74 VanDerWaalsContact O-N 3.12Å; A71-V75 PolarHBondContact O-N 2.97Å; A71-V75 VanDerWaalsContact O-N 3.09Å; A71-L211 HydrophobicContact CB-CB 4.04Å; A71-L211 HydrophobicContact CB-CD2 4.3Å
72L98.6Very high96.4Very high0 Ų030.4 Ų30.40%017%0.166CC..Hα-helixtrans-58.7-43.7174.2179.564.6000111.6V27 I32 V35 I36 L39 F51 I55 I68 A74 V76V27-L72 HydrophobicContact CG1-CD2 4.31Å; V27-L72 HydrophobicContact CG2-CD2 4.37Å; I32-L72 HydrophobicContact CD1-CB 4.35Å; V35-L72 HydrophobicContact CG1-CD1 4.3Å; I36-L72 HydrophobicContact CG1-CD1 3.68Å; L39-L72 HydrophobicContact CD2-CD1 4.12Å; F51-L72 HydrophobicContact CE2-CD2 4.21Å; F51-L72 HydrophobicContact CE2-CG 4.42Å; F51-L72 HydrophobicContact CZ-CD2 4.5Å; F51-L72 HydrophobicContact CZ-CG 4.35Å; I55-L72 HydrophobicContact CD1-CB 4.47Å; I55-L72 HydrophobicContact CD1-CD2 4.14Å; I55-L72 HydrophobicContact CD1-CG 4.42Å; I68-L72 PolarHBondContact O-N 2.97Å; L72-A74 VanDerWaalsContact C-N 3.31Å; L72-A74 PolarHBondContact O-N 3.32Å; L72-V76 WeakPolarHBondContact O-CG2 3.31Å; L72-V76 PolarHBondContact O-N 3.22Å; L72-V76 VanDerWaalsContact O-N 3.13Å
73A98.7Very high96.7Very high2 Ų229.1 Ų29.12%0.01716%0.155CC..Hα-helixtrans-63.9-35.8176.600000112.6I55 M69 A70 A71 N77 L87 L117I55-A73 HydrophobicContact CD1-CB 4.15Å; M69-A73 WeakPolarHBondContact O-CB 3.44Å; M69-A73 PolarHBondContact O-N 3.48Å; A70-A73 PolarHBondContact O-N 3.34Å; A71-A73 VanDerWaalsContact C-N 3.31Å; A71-A73 PolarHBondContact O-N 2.69Å; A73-N77 WeakPolarHBondContact O-CB 3.35Å; A73-N77 PolarHBondContact O-N 2.89Å; A73-L87 HydrophobicContact CB-CD2 3.68Å; A73-L117 HydrophobicContact CB-CD2 3.87Å
74A98.7Very high97Very high0 Ų025.9 Ų25.90%014%0.14CC..Hα-helixtrans-65.6-46.6178.800000111.7A70 A71 L72 N77 S78 Q120 V122 V214A70-A74 WeakPolarHBondContact O-CB 3.36Å; A70-A74 PolarHBondContact O-N 3.22Å; A71-A74 WeakPolarHBondContact O-CB 3.35Å; A71-A74 PolarHBondContact O-N 3.42Å; A71-A74 VanDerWaalsContact O-N 3.12Å; L72-A74 VanDerWaalsContact C-N 3.31Å; L72-A74 PolarHBondContact O-N 3.32Å; A74-N77 WeakPolarHBondContact O-CB 3.48Å; A74-N77 PolarHBondContact O-N 3.47Å; A74-N77 VanDerWaalsContact O-N 3.16Å; A74-S78 PolarHBondContact O-N 3.48Å; A74-Q120 HydrophobicContact CB-CB 3.95Å; A74-Q120 HydrophobicContact CB-CG 4.38Å; A74-V122 HydrophobicContact CB-CG2 3.83Å; A74-V214 HydrophobicContact CB-CG2 4.08Å
75V97.9Very high97.4Very high9 Ų925.3 Ų25.36%0.05513%0.129CC..Hα-helixtrans-62.8-46.7177.1-179.50000110.8I36 F40 A71 N77 S78 L213 V214I36-V75 HydrophobicContact CD1-CB 4.02Å; I36-V75 HydrophobicContact CD1-CG1 3.98Å; I36-V75 HydrophobicContact CD1-CG2 3.8Å; I36-V75 HydrophobicContact CG1-CB 4.36Å; I36-V75 HydrophobicContact CG1-CG1 4.19Å; I36-V75 HydrophobicContact CG2-CG1 3.64Å; F40-V75 HydrophobicContact CE2-CG1 4.16Å; F40-V75 HydrophobicContact CZ-CG1 3.98Å; A71-V75 PolarHBondContact O-N 2.97Å; A71-V75 VanDerWaalsContact O-N 3.09Å; V75-N77 VanDerWaalsContact C-N 3.26Å; V75-N77 PolarHBondContact O-N 2.78Å; V75-S78 PolarHBondContact O-N 2.81Å; V75-S78 PolarHBondContact O-OG 2.93Å; V75-L213 HydrophobicContact CG2-CB 3.53Å; V75-L213 HydrophobicContact CG2-CD1 4.2Å; V75-V214 HydrophobicContact CB-CG2 4.25Å; V75-V214 HydrophobicContact CG2-CG2 3.68Å
76V98.3Very high97.6Very high1 Ų118.9 Ų18.91%0.00610%0.104CC..Hα-helixtrans-60.5-37.7175.1173.10000111.9L39 F40 L44 F51 L72 K79 F80 V83L39-V76 HydrophobicContact CD2-CG2 3.46Å; L39-V76 VanDerWaalsContact CD2-CG2 3.46Å; F40-V76 HydrophobicContact CE1-CG2 4.26Å; L44-V76 HydrophobicContact CD1-CG1 3.99Å; L44-V76 HydrophobicContact CD1-CG2 4.26Å; F51-V76 HydrophobicContact CD1-CG1 4.44Å; F51-V76 HydrophobicContact CE1-CB 4.26Å; F51-V76 HydrophobicContact CE1-CG1 3.96Å; F51-V76 HydrophobicContact CE1-CG2 4.31Å; F51-V76 HydrophobicContact CE2-CG2 4.32Å; F51-V76 HydrophobicContact CZ-CB 4.23Å; F51-V76 HydrophobicContact CZ-CG1 4.32Å; F51-V76 HydrophobicContact CZ-CG2 3.82Å; L72-V76 WeakPolarHBondContact O-CG2 3.31Å; L72-V76 PolarHBondContact O-N 3.22Å; L72-V76 VanDerWaalsContact O-N 3.13Å; V76-K79 PolarHBondContact O-N 3.2Å; V76-F80 WeakPolarHBondContact O-CA 3.25Å; V76-F80 WeakPolarHBondContact O-CB 3.45Å; V76-F80 PolarHBondContact O-N 3.43Å; V76-V83 HydrophobicContact CG1-CB 3.96Å; V76-V83 HydrophobicContact CG1-CG1 3.73Å; V76-V83 HydrophobicContact CG1-CG2 4.17Å
77N98.4Very high97.6Very high0 Ų018.9 Ų18.90%010%0.104CC..Hα-helixtrans-67.7-34.3178.4172.671.1000113.2A73 A74 V75 K79 F80 P81 G84 V122 I220 H222A73-N77 WeakPolarHBondContact O-CB 3.35Å; A73-N77 PolarHBondContact O-N 2.89Å; A74-N77 WeakPolarHBondContact O-CB 3.48Å; A74-N77 PolarHBondContact O-N 3.47Å; A74-N77 VanDerWaalsContact O-N 3.16Å; V75-N77 VanDerWaalsContact C-N 3.26Å; V75-N77 PolarHBondContact O-N 2.78Å; N77-K79 VanDerWaalsContact C-N 3.29Å; N77-K79 PolarHBondContact O-N 3.06Å; N77-F80 CarbonylContact O-C 3.28Å; N77-P81 VanDerWaalsContact O-CA 3.3Å; N77-P81 WeakPolarHBondContact O-CA 3.4Å; N77-P81 WeakPolarHBondContact O-CD 3.25Å; N77-P81 VanDerWaalsContact O-N 3.16Å; N77-G84 WeakPolarHBondContact OD1-CA 3.18Å; N77-V122 HydrophobicContact CB-CG1 4.38Å; N77-V122 HydrophobicContact CB-CG2 4.43Å; N77-I220 PolarHBondContact ND2-O 3.29Å; N77-H222 PolarHBondContact OD1-NE2 3.38Å
78S95.2Very high97.7Very high15 Ų1515.8 Ų15.811%0.1059%0.09CC..Hα-helixtrans-61.8-36.817774.20000112.5A74 V75 D218 I220A74-S78 PolarHBondContact O-N 3.48Å; V75-S78 PolarHBondContact O-N 2.81Å; V75-S78 PolarHBondContact O-OG 2.93Å; S78-D218 VanDerWaalsContact CB-O 3.27Å; S78-D218 WeakPolarHBondContact CB-O 3.5Å; S78-I220 WeakPolarHBondContact O-CD1 3.38Å
79K93.8Very high97.7Very high68 Ų6816.2 Ų16.230%0.2969%0.092SC..Hα-helixtrans-94.7-30.9179.4-51.8-51.8-178.2-174.50112.9F40 V76 N77 D218 I259F40-K79 HydrophobicContact CE1-CB 4.44Å; F40-K79 HydrophobicContact CE2-CG 4.18Å; F40-K79 HydrophobicContact CZ-CB 4.18Å; F40-K79 HydrophobicContact CZ-CG 3.79Å; V76-K79 PolarHBondContact O-N 3.2Å; N77-K79 VanDerWaalsContact C-N 3.29Å; N77-K79 PolarHBondContact O-N 3.06Å; K79-D218 IonicContact NZ-OD2 3.52Å; K79-D218 PolarHBondContact NZ-OD2 3.45Å; K79-I259 HydrophobicContact CB-CD1 4.05Å; K79-I259 HydrophobicContact CG-CD1 4.33Å
80F96.1Very high97.7Very high17 Ų1716.5 Ų16.58%0.0759%0.092CC..  trans-131.573.5-178.7-54.7-75000111.9F40 L44 I45 V76 N77 A82 V83 Y252 I255 I259F40-F80 HydrophobicContact CD1-CD2 4.49Å; F40-F80 AromaticContact CD1-CE2 3.82Å; F40-F80 HydrophobicContact CD1-CE2 3.82Å; F40-F80 HydrophobicContact CE1-CD2 4.07Å; F40-F80 AromaticContact CE1-CE2 3.78Å; F40-F80 HydrophobicContact CE1-CE2 3.78Å; L44-F80 HydrophobicContact CB-CD2 4.28Å; L44-F80 HydrophobicContact CB-CE2 4.33Å; L44-F80 HydrophobicContact CD1-CD2 3.96Å; L44-F80 HydrophobicContact CD1-CE2 4.01Å; I45-F80 HydrophobicContact CD1-CD1 4.34Å; I45-F80 HydrophobicContact CD1-CE1 4.08Å; I45-F80 HydrophobicContact CG1-CD1 3.85Å; I45-F80 HydrophobicContact CG1-CE1 3.86Å; V76-F80 WeakPolarHBondContact O-CA 3.25Å; V76-F80 WeakPolarHBondContact O-CB 3.45Å; V76-F80 PolarHBondContact O-N 3.43Å; N77-F80 CarbonylContact O-C 3.28Å; F80-A82 PolarHBondContact O-N 2.95Å; F80-V83 HydrophobicContact CB-CB 4.43Å; F80-V83 HydrophobicContact CB-CG2 3.64Å; F80-V83 VanDerWaalsContact O-CB 3.27Å; F80-V83 WeakPolarHBondContact O-CB 3.46Å; F80-V83 WeakPolarHBondContact O-CG2 3.25Å; F80-V83 PolarHBondContact O-N 2.98Å; F80-Y252 AromaticContact CE1-CE2 3.79Å; F80-Y252 HydrophobicContact CE1-CE2 3.79Å; F80-Y252 HydrophobicContact CE2-CE2 4.43Å; F80-Y252 AromaticContact CZ-CE2 3.57Å; F80-Y252 HydrophobicContact CZ-CE2 3.57Å; F80-Y252 AromaticContact CZ-CZ 3.93Å; F80-I255 HydrophobicContact CE1-CG2 4.03Å; F80-I255 HydrophobicContact CZ-CG2 4.11Å; F80-I259 HydrophobicContact CE2-CD1 4.1Å; F80-I259 HydrophobicContact CZ-CD1 3.8Å
81P96.7Very high97.7Very high48 Ų4816.5 Ų16.531%0.3129%0.092SC..Hα-helixtrans-55.2-31-175.47.1-21.4000115.5N77 V83 G84 E85 I220 H222N77-P81 VanDerWaalsContact O-CA 3.3Å; N77-P81 WeakPolarHBondContact O-CA 3.4Å; N77-P81 WeakPolarHBondContact O-CD 3.25Å; N77-P81 VanDerWaalsContact O-N 3.16Å; P81-V83 PolarHBondContact O-N 2.78Å; P81-V83 VanDerWaalsContact O-N 3.14Å; P81-G84 PolarHBondContact O-N 2.83Å; P81-G84 VanDerWaalsContact O-N 3.11Å; P81-E85 PolarHBondContact O-N 2.83Å; P81-I220 HydrophobicContact CB-CD1 3.99Å; P81-I220 HydrophobicContact CB-CG2 3.97Å; P81-I220 HydrophobicContact CG-CD1 3.73Å; P81-H222 PolarHBondContact O-CE1 3.01Å; P81-H222 VanDerWaalsContact O-CE1 3.3Å; P81-H222 PolarHBondContact O-NE2 3.1Å
82A95.8Very high97.7Very high56 Ų5616.5 Ų16.546%0.4639%0.092SC..Hα-helixtrans-59.5-24.317500000113.2F80 L86F80-A82 PolarHBondContact O-N 2.95Å; A82-L86 VanDerWaalsContact O-CB 3.25Å; A82-L86 WeakPolarHBondContact O-CB 3.46Å; A82-L86 PolarHBondContact O-N 2.81Å
83V98.2Very high97.6Very high4 Ų417.2 Ų17.22%0.02410%0.097CC..Hα-helixtrans-74.8-45.3175.1-175.50000110.7R48 F51 V52 V76 F80 P81 L86 L87R48-V83 HydrophobicContact CB-CG2 3.79Å; F51-V83 HydrophobicContact CD1-CG1 3.42Å; F51-V83 VanDerWaalsContact CD1-CG1 3.42Å; F51-V83 HydrophobicContact CE1-CG1 3.75Å; V52-V83 HydrophobicContact CG2-CG1 3.93Å; V76-V83 HydrophobicContact CG1-CB 3.96Å; V76-V83 HydrophobicContact CG1-CG1 3.73Å; V76-V83 HydrophobicContact CG1-CG2 4.17Å; F80-V83 HydrophobicContact CB-CB 4.43Å; F80-V83 HydrophobicContact CB-CG2 3.64Å; F80-V83 VanDerWaalsContact O-CB 3.27Å; F80-V83 WeakPolarHBondContact O-CB 3.46Å; F80-V83 WeakPolarHBondContact O-CG2 3.25Å; F80-V83 PolarHBondContact O-N 2.98Å; P81-V83 PolarHBondContact O-N 2.78Å; P81-V83 VanDerWaalsContact O-N 3.14Å; V83-L86 PolarHBondContact O-N 3.49Å; V83-L87 WeakPolarHBondContact O-CB 3.31Å; V83-L87 PolarHBondContact O-N 2.72Å
84G98Very high97.6Very high1 Ų120 Ų201%0.0111%0.11CC..Hα-helixtrans-65.3-42.517800000112.4N77 P81 L86 L87 L88N77-G84 WeakPolarHBondContact OD1-CA 3.18Å; P81-G84 PolarHBondContact O-N 2.83Å; P81-G84 VanDerWaalsContact O-N 3.11Å; G84-L86 PolarHBondContact O-N 3.45Å; G84-L87 WeakPolarHBondContact O-CB 3.24Å; G84-L87 PolarHBondContact O-N 3.44Å; G84-L88 WeakPolarHBondContact O-CG 3.36Å; G84-L88 PolarHBondContact O-N 3.09Å
85E98Very high97.5Very high88 Ų8820 Ų2041%0.41111%0.11SC..Hα-helixtrans-60.6-45.9174.5-168.7-177-171.500111.4P81 L87 L88 H89 H222P81-E85 PolarHBondContact O-N 2.83Å; E85-L87 VanDerWaalsContact C-N 3.32Å; E85-L87 PolarHBondContact O-N 3.14Å; E85-L88 PolarHBondContact O-N 3.12Å; E85-H89 PolarHBondContact O-N 3.38Å; E85-H89 IonicContact OE1-CE1 3.69Å; E85-H222 PolarHBondContact N-NE2 3.47Å
86L98.5Very high97.5Very high3 Ų322.7 Ų22.72%0.01612%0.121CC..Hα-helixtrans-61.6-39.5177-179.962.2000112.2R48 V52 A82 V83 G84 R90 L232 Q233 L236R48-L86 HydrophobicContact CB-CD2 4.47Å; R48-L86 HydrophobicContact CG-CD2 4.1Å; V52-L86 HydrophobicContact CG1-CG 4.49Å; V52-L86 HydrophobicContact CG2-CB 4.31Å; V52-L86 HydrophobicContact CG2-CD2 4.09Å; V52-L86 HydrophobicContact CG2-CG 4.12Å; A82-L86 VanDerWaalsContact O-CB 3.25Å; A82-L86 WeakPolarHBondContact O-CB 3.46Å; A82-L86 PolarHBondContact O-N 2.81Å; V83-L86 PolarHBondContact O-N 3.49Å; G84-L86 PolarHBondContact O-N 3.45Å; L86-R90 HydrophobicContact CD1-CG 4.27Å; L86-R90 WeakPolarHBondContact O-CB 3.4Å; L86-R90 WeakPolarHBondContact O-CG 3.12Å; L86-R90 PolarHBondContact O-N 2.78Å; L86-L232 WeakPolarHBondContact CD1-O 3.37Å; L86-Q233 HydrophobicContact CD1-CB 3.94Å; L86-Q233 HydrophobicContact CD1-CG 4.22Å; L86-L236 HydrophobicContact CD2-CD1 3.93Å
87L98.7Very high97.4Very high1 Ų129.1 Ų29.11%0.00515%0.145CC..Hα-helixtrans-59.8-48.4174.8176.760000111.1V52 I55 M56 A73 V83 G84 E85 R90 L91 F113 L117V52-L87 HydrophobicContact CG1-CB 4.13Å; V52-L87 HydrophobicContact CG1-CD1 3.89Å; V52-L87 HydrophobicContact CG2-CB 4.09Å; I55-L87 HydrophobicContact CG2-CD1 3.92Å; I55-L87 HydrophobicContact CG2-CD2 4.45Å; M56-L87 HydrophobicContact CG-CD1 3.61Å; M56-L87 HydrophobicContact SD-CD1 4.2Å; A73-L87 HydrophobicContact CB-CD2 3.68Å; V83-L87 WeakPolarHBondContact O-CB 3.31Å; V83-L87 PolarHBondContact O-N 2.72Å; G84-L87 WeakPolarHBondContact O-CB 3.24Å; G84-L87 PolarHBondContact O-N 3.44Å; E85-L87 VanDerWaalsContact C-N 3.32Å; E85-L87 PolarHBondContact O-N 3.14Å; L87-R90 PolarHBondContact O-N 2.69Å; L87-L91 HydrophobicContact CD1-CD1 3.69Å; L87-L91 HydrophobicContact CD1-CG 4.02Å; L87-L91 HydrophobicContact CG-CD1 3.84Å; L87-L91 WeakPolarHBondContact O-CB 3.26Å; L87-L91 WeakPolarHBondContact O-CG 3.43Å; L87-L91 PolarHBondContact O-N 2.78Å; L87-F113 HydrophobicContact CD1-CE1 4.17Å; L87-F113 HydrophobicContact CD2-CZ 4.24Å; L87-L117 HydrophobicContact CD2-CD1 3.9Å; L87-L117 HydrophobicContact CD2-CD2 4.04Å; L87-L117 HydrophobicContact CG-CD1 4.09Å
88L98.4Very high97.3Very high0 Ų029.3 Ų29.30%015%0.147CC..Hα-helixtrans-63.1-45178.5-70.2174.4000112.3G84 E85 R90 L91 L92 L117 V122 A123 H222 V224G84-L88 WeakPolarHBondContact O-CG 3.36Å; G84-L88 PolarHBondContact O-N 3.09Å; E85-L88 PolarHBondContact O-N 3.12Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.47Å; L88-L91 PolarHBondContact O-N 2.87Å; L88-L92 WeakPolarHBondContact O-CB 3.48Å; L88-L92 VanDerWaalsContact O-CG 3.32Å; L88-L92 WeakPolarHBondContact O-CG 3.4Å; L88-L92 PolarHBondContact O-N 2.99Å; L88-L117 HydrophobicContact CD2-CB 4.31Å; L88-L117 HydrophobicContact CD2-CD1 3.62Å; L88-V122 HydrophobicContact CD1-CG1 4.31Å; L88-A123 HydrophobicContact CD1-CB 3.93Å; L88-A123 HydrophobicContact CD2-CB 3.74Å; L88-H222 HydrophobicContact CD1-CB 3.64Å; L88-V224 HydrophobicContact CB-CG2 4.31Å; L88-V224 HydrophobicContact CD1-CG2 4.29Å
89H98.4Very high97.4Very high17 Ų1730.8 Ų30.88%0.07915%0.151CC..Hα-helixtrans-58.5-44.2176.6-74.3166.7000112.4E85 S93 L230 N231 L232E85-H89 PolarHBondContact O-N 3.38Å; E85-H89 IonicContact OE1-CE1 3.69Å; H89-S93 VanDerWaalsContact O-CB 3.27Å; H89-S93 WeakPolarHBondContact O-CB 3.35Å; H89-S93 PolarHBondContact O-N 3.41Å; H89-L230 HydrophobicContact CB-CB 4.46Å; H89-N231 PolarHBondContact ND1-O 3.27Å; H89-L232 HydrophobicContact CB-CD2 4.46Å
90R98.4Very high97.4Very high16 Ų1636.3 Ų36.36%0.0618%0.175CC..Hα-helixtrans-71.4-41-180-70.8-179.1178.9-173.2-0.2112.3G49 V52 M56 L86 L87 L88 S93 Q94 L232 Q233 N237G49-R90 PolarHBondContact O-NH1 3.3Å; V52-R90 HydrophobicContact CG1-CB 4.36Å; V52-R90 HydrophobicContact CG1-CG 4.49Å; M56-R90 HydrophobicContact CE-CB 3.98Å; M56-R90 HydrophobicContact SD-CB 3.64Å; L86-R90 HydrophobicContact CD1-CG 4.27Å; L86-R90 WeakPolarHBondContact O-CB 3.4Å; L86-R90 WeakPolarHBondContact O-CG 3.12Å; L86-R90 PolarHBondContact O-N 2.78Å; L87-R90 PolarHBondContact O-N 2.69Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.47Å; R90-S93 PolarHBondContact O-N 2.92Å; R90-Q94 VanDerWaalsContact O-CB 3.31Å; R90-Q94 WeakPolarHBondContact O-CB 3.39Å; R90-Q94 PolarHBondContact O-N 3.2Å; R90-L232 HydrophobicContact CG-CD2 4.46Å; R90-L232 PolarHBondContact NE-O 3.3Å; R90-L232 PolarHBondContact NH2-O 2.99Å; R90-Q233 PolarHBondContact NH2-O 2.66Å; R90-N237 PolarHBondContact NH1-OD1 2.86Å; R90-N237 PolarHBondContact NH2-OD1 2.96Å
91L98.3Very high97.4Very high0 Ų044.5 Ų44.50%021%0.206CC..Hα-helixtrans-62.9-44.4175-81170.4000112.1M56 L87 L88 Q94 F95 F113 I114 L117M56-L91 HydrophobicContact CE-CD2 3.92Å; M56-L91 HydrophobicContact CE-CG 4.11Å; M56-L91 HydrophobicContact CG-CD2 4.1Å; M56-L91 HydrophobicContact CG-CG 4.22Å; M56-L91 HydrophobicContact SD-CG 4.41Å; L87-L91 HydrophobicContact CD1-CD1 3.69Å; L87-L91 HydrophobicContact CD1-CG 4.02Å; L87-L91 HydrophobicContact CG-CD1 3.84Å; L87-L91 WeakPolarHBondContact O-CB 3.26Å; L87-L91 WeakPolarHBondContact O-CG 3.43Å; L87-L91 PolarHBondContact O-N 2.78Å; L88-L91 PolarHBondContact O-N 2.87Å; L91-Q94 PolarHBondContact O-N 2.71Å; L91-F95 WeakPolarHBondContact O-CB 3.46Å; L91-F95 PolarHBondContact O-N 3.36Å; L91-F113 HydrophobicContact CD1-CB 4.24Å; L91-F113 HydrophobicContact CD1-CD1 3.72Å; L91-F113 HydrophobicContact CD1-CE1 4.19Å; L91-F113 HydrophobicContact CD1-CG 3.95Å; L91-F113 HydrophobicContact CD2-CB 4.16Å; L91-F113 HydrophobicContact CD2-CD1 3.73Å; L91-F113 HydrophobicContact CD2-CG 4.31Å; L91-F113 HydrophobicContact CG-CD1 4.32Å; L91-I114 HydrophobicContact CB-CD1 4.36Å; L91-I114 HydrophobicContact CB-CG1 4.09Å; L91-I114 HydrophobicContact CD1-CG1 4.43Å; L91-L117 HydrophobicContact CD1-CD1 3.48Å; L91-L117 VanDerWaalsContact CD1-CD1 3.48Å
92L97.8Very high97.3Very high0 Ų047.7 Ų47.70%022%0.22CC..Hα-helixtrans-65.8-40.5177.6-74172.7000112.3L88 F95 K96 I114 L127 V224 L226 L230L88-L92 WeakPolarHBondContact O-CB 3.48Å; L88-L92 VanDerWaalsContact O-CG 3.32Å; L88-L92 WeakPolarHBondContact O-CG 3.4Å; L88-L92 PolarHBondContact O-N 2.99Å; L92-F95 PolarHBondContact O-N 2.96Å; L92-K96 WeakPolarHBondContact O-CB 3.33Å; L92-K96 VanDerWaalsContact O-CG 3.27Å; L92-K96 WeakPolarHBondContact O-CG 3.48Å; L92-K96 PolarHBondContact O-N 3.18Å; L92-I114 HydrophobicContact CD2-CD1 3.74Å; L92-I114 HydrophobicContact CG-CD1 4.37Å; L92-L127 HydrophobicContact CD1-CD1 3.99Å; L92-L127 HydrophobicContact CD1-CD2 3.95Å; L92-L127 HydrophobicContact CD2-CD1 3.81Å; L92-L127 HydrophobicContact CD2-CD2 4.1Å; L92-L127 HydrophobicContact CD2-CG 4.39Å; L92-L127 HydrophobicContact CG-CD2 4.39Å; L92-V224 HydrophobicContact CD1-CB 4.2Å; L92-V224 HydrophobicContact CD1-CG1 3.5Å; L92-L226 HydrophobicContact CD2-CD2 3.79Å; L92-L230 HydrophobicContact CB-CD1 3.98Å; L92-L230 HydrophobicContact CB-CD2 4.42Å; L92-L230 HydrophobicContact CD1-CD2 4.42Å
93S97.6Very high97.3Very high15 Ų1548 Ų4811%0.10521%0.214CC..Hα-helixtrans-62.4-43.5173.9-177.50000111.7H89 R90 R97 L232H89-S93 VanDerWaalsContact O-CB 3.27Å; H89-S93 WeakPolarHBondContact O-CB 3.35Å; H89-S93 PolarHBondContact O-N 3.41Å; R90-S93 PolarHBondContact O-N 2.92Å; S93-R97 WeakPolarHBondContact O-CB 3.47Å; S93-R97 VanDerWaalsContact O-CG 3.25Å; S93-R97 WeakPolarHBondContact O-CG 3.31Å; S93-R97 PolarHBondContact O-N 3.13Å; S93-R97 VanDerWaalsContact O-N 3.1Å; S93-L232 VanDerWaalsContact CB-CD2 3.5Å
94Q97.8Very high97.1Very high62 Ų6251.9 Ų51.929%0.2923%0.228SC..Hα-helixtrans-61.8-50176-177.6176.543.900111.3M56 R90 L91 R97 A98 V106 S110M56-Q94 HydrophobicContact CE-CB 4.26Å; R90-Q94 VanDerWaalsContact O-CB 3.31Å; R90-Q94 WeakPolarHBondContact O-CB 3.39Å; R90-Q94 PolarHBondContact O-N 3.2Å; L91-Q94 PolarHBondContact O-N 2.71Å; Q94-R97 PolarHBondContact O-N 3.19Å; Q94-A98 VanDerWaalsContact O-CB 3.28Å; Q94-A98 WeakPolarHBondContact O-CB 3.4Å; Q94-A98 PolarHBondContact O-N 3.31Å; Q94-V106 HydrophobicContact CG-CG1 3.44Å; Q94-V106 VanDerWaalsContact CG-CG1 3.44Å; Q94-S110 WeakPolarHBondContact CG-OG 3.45Å; Q94-S110 PolarHBondContact OE1-OG 3.13Å
95F98Very high97Very high0 Ų058.7 Ų58.70%026%0.264CS..Hα-helixtrans-59-52177.6172.6-102.1000111.9L91 L92 R97 A98 F99 A107 I111 I114 L131 L135L91-F95 WeakPolarHBondContact O-CB 3.46Å; L91-F95 PolarHBondContact O-N 3.36Å; L92-F95 PolarHBondContact O-N 2.96Å; F95-R97 VanDerWaalsContact C-N 3.3Å; F95-R97 PolarHBondContact O-N 3.44Å; F95-A98 PolarHBondContact O-N 2.99Å; F95-A98 VanDerWaalsContact O-N 3.15Å; F95-F99 HydrophobicContact CE1-CB 4.46Å; F95-F99 HydrophobicContact CE2-CB 4.34Å; F95-F99 HydrophobicContact CZ-CB 4.19Å; F95-F99 HydrophobicContact CZ-CG 4.3Å; F95-F99 VanDerWaalsContact O-CB 3.32Å; F95-F99 WeakPolarHBondContact O-CB 3.22Å; F95-F99 PolarHBondContact O-N 3.33Å; F95-A107 HydrophobicContact CD2-CB 4.49Å; F95-I111 HydrophobicContact CD2-CB 3.9Å; F95-I111 HydrophobicContact CD2-CG1 4.2Å; F95-I111 HydrophobicContact CE2-CB 3.83Å; F95-I111 HydrophobicContact CE2-CD1 3.71Å; F95-I111 HydrophobicContact CE2-CG1 3.86Å; F95-I111 HydrophobicContact CZ-CD1 3.88Å; F95-I111 HydrophobicContact CZ-CG1 4.31Å; F95-I114 HydrophobicContact CB-CD1 4.37Å; F95-L131 HydrophobicContact CD1-CD2 3.7Å; F95-L131 HydrophobicContact CE1-CD2 3.28Å; F95-L131 HydrophobicContact CZ-CD2 4.01Å; F95-L135 HydrophobicContact CZ-CD2 4.2Å
96K96.2Very high96.9Very high64 Ų6456.5 Ų56.528%0.27826%0.257SS..Hα-helixtrans-55.9-44.7179.3-77.3173.4178.8175.30112.1L92 K100 L226 L230L92-K96 WeakPolarHBondContact O-CB 3.33Å; L92-K96 VanDerWaalsContact O-CG 3.27Å; L92-K96 WeakPolarHBondContact O-CG 3.48Å; L92-K96 PolarHBondContact O-N 3.18Å; K96-K100 VanDerWaalsContact O-CB 3.26Å; K96-K100 WeakPolarHBondContact O-CB 3.41Å; K96-K100 PolarHBondContact O-N 3.32Å; K96-L226 WeakPolarHBondContact CE-O 3.4Å; K96-L226 PolarHBondContact NZ-O 2.85Å; K96-L230 HydrophobicContact CD-CD1 4.29Å
97R96.9Very high96.9Very high137 Ų13756.4 Ų56.452%0.51726%0.257SS..Hα-helixtrans-66.4-42.3178.8-73.5174.2178.4-1742.3111.7S93 Q94 F95 R101S93-R97 WeakPolarHBondContact O-CB 3.47Å; S93-R97 VanDerWaalsContact O-CG 3.25Å; S93-R97 WeakPolarHBondContact O-CG 3.31Å; S93-R97 PolarHBondContact O-N 3.13Å; S93-R97 VanDerWaalsContact O-N 3.1Å; Q94-R97 PolarHBondContact O-N 3.19Å; F95-R97 VanDerWaalsContact C-N 3.3Å; F95-R97 PolarHBondContact O-N 3.44Å; R97-R101 WeakPolarHBondContact O-CB 3.34Å; R97-R101 WeakPolarHBondContact O-CD 3.09Å; R97-R101 VanDerWaalsContact O-CG 3.23Å; R97-R101 WeakPolarHBondContact O-CG 3.42Å; R97-R101 PolarHBondContact O-N 3.39Å
98A97.2Very high96.8Very high4 Ų457.7 Ų57.73%0.03326%0.264CS..Hα-helixtrans-67.6-48.7179.600000111.6Q94 F95 K100 R101 N102 D103 V106 A107Q94-A98 VanDerWaalsContact O-CB 3.28Å; Q94-A98 WeakPolarHBondContact O-CB 3.4Å; Q94-A98 PolarHBondContact O-N 3.31Å; F95-A98 PolarHBondContact O-N 2.99Å; F95-A98 VanDerWaalsContact O-N 3.15Å; A98-K100 PolarHBondContact O-N 3.45Å; A98-R101 CarbonylContact O-C 3.55Å; A98-R101 PolarHBondContact O-N 2.95Å; A98-N102 PolarHBondContact O-N 2.89Å; A98-D103 HydrophobicContact CB-CB 4.28Å; A98-D103 PolarHBondContact O-N 3.32Å; A98-V106 HydrophobicContact CB-CB 3.74Å; A98-V106 HydrophobicContact CB-CG1 3.71Å; A98-A107 HydrophobicContact CB-CB 3.92Å
99F95.8Very high96.8Very high46 Ų4657.9 Ų57.920%0.20227%0.265CS..Hα-helixtrans-58.6-47.7177.4-177.6-116.4000111.7F95 R101 N102 L134 L135 L146F95-F99 HydrophobicContact CE1-CB 4.46Å; F95-F99 HydrophobicContact CE2-CB 4.34Å; F95-F99 HydrophobicContact CZ-CB 4.19Å; F95-F99 HydrophobicContact CZ-CG 4.3Å; F95-F99 VanDerWaalsContact O-CB 3.32Å; F95-F99 WeakPolarHBondContact O-CB 3.22Å; F95-F99 PolarHBondContact O-N 3.33Å; F99-R101 PolarHBondContact O-N 2.81Å; F99-R101 VanDerWaalsContact O-N 3.14Å; F99-N102 PolarHBondContact O-N 3.43Å; F99-N102 PolarHBondContact O-OD1 2.89Å; F99-L134 HydrophobicContact CE1-CG 4.43Å; F99-L135 HydrophobicContact CD2-CD2 3.99Å; F99-L135 HydrophobicContact CE1-CD2 4.38Å; F99-L135 HydrophobicContact CE2-CD2 3.46Å; F99-L135 VanDerWaalsContact CE2-CD2 3.46Å; F99-L135 HydrophobicContact CZ-CD2 3.69Å; F99-L146 HydrophobicContact CD2-CD1 3.62Å; F99-L146 HydrophobicContact CE2-CD1 3.91Å
100K94.5Very high96.8Very high184 Ų18457.1 Ų57.180%0.826%0.262SS*.Hα-helixtrans-59.9-27.1176.3-176.3173.6-179174.70113.5K96 A98K96-K100 VanDerWaalsContact O-CB 3.26Å; K96-K100 WeakPolarHBondContact O-CB 3.41Å; K96-K100 PolarHBondContact O-N 3.32Å; A98-K100 PolarHBondContact O-N 3.45Å
101R96.2Very high96.8Very high189 Ų18956.3 Ų56.371%0.71326%0.259SS*.THydrogen-bonded Turntrans-961-179.9-69.1174-179176-0.1113R97 A98 F99 D103R97-R101 WeakPolarHBondContact O-CB 3.34Å; R97-R101 WeakPolarHBondContact O-CD 3.09Å; R97-R101 VanDerWaalsContact O-CG 3.23Å; R97-R101 WeakPolarHBondContact O-CG 3.42Å; R97-R101 PolarHBondContact O-N 3.39Å; A98-R101 CarbonylContact O-C 3.55Å; A98-R101 PolarHBondContact O-N 2.95Å; F99-R101 PolarHBondContact O-N 2.81Å; F99-R101 VanDerWaalsContact O-N 3.14Å; R101-D103 HydrophobicContact CB-CB 4.34Å; R101-D103 PolarHBondContact O-N 3.1Å
102N93.7Very high96.8Very high115 Ų11558.6 Ų58.662%0.61527%0.269SS*.THydrogen-bonded Turntrans5134.2-168.6-62.6-26.8000112.6A98 F99 R104A98-N102 PolarHBondContact O-N 2.89Å; F99-N102 PolarHBondContact O-N 3.43Å; F99-N102 PolarHBondContact O-OD1 2.89Å; N102-R104 PolarHBondContact O-N 3.47Å
103D96.6Very high96.8Very high62 Ų6258.6 Ų58.633%0.33227%0.269SS..  trans-86.488.6176.6-175.2-11.3000109.3A98 R101 D105 V106 A107A98-D103 HydrophobicContact CB-CB 4.28Å; A98-D103 PolarHBondContact O-N 3.32Å; R101-D103 HydrophobicContact CB-CB 4.34Å; R101-D103 PolarHBondContact O-N 3.1Å; D103-D105 VanDerWaalsContact C-N 3.34Å; D103-D105 PolarHBondContact OD1-N 3.42Å; D103-V106 PolarHBondContact O-N 3.05Å; D103-V106 PolarHBondContact OD1-N 3.12Å; D103-V106 WeakPolarHBondContact OD2-CG2 3.43Å; D103-A107 VanDerWaalsContact O-CB 3.27Å; D103-A107 WeakPolarHBondContact O-CB 3.44Å; D103-A107 PolarHBondContact O-N 2.7Å
104R93.9Very high96.9Very high85 Ų8557.9 Ų57.932%0.32126%0.264SS..Hα-helixtrans-67.2-34.3-175.8-71.7-174.551.1151.2-2113.6N102 V106 A107 V108 D142 E145N102-R104 PolarHBondContact O-N 3.47Å; R104-V106 PolarHBondContact O-N 3.3Å; R104-A107 PolarHBondContact O-N 3.13Å; R104-V108 WeakPolarHBondContact O-CG2 3.32Å; R104-V108 PolarHBondContact O-N 3.24Å; R104-D142 WeakPolarHBondContact CD-OD1 3.5Å; R104-D142 IonicContact CZ-OD1 2.94Å; R104-D142 IonicContact NE-OD1 3.61Å; R104-D142 IonicContact NH1-OD1 3.59Å; R104-D142 PolarHBondContact NH1-OD1 2.87Å; R104-E145 IonicContact CZ-OE1 3.75Å; R104-E145 IonicContact CZ-OE2 3.72Å; R104-E145 VanDerWaalsContact CZ-OE2 3.3Å; R104-E145 IonicContact NH1-OE1 3.7Å; R104-E145 IonicContact NH1-OE2 2.69Å; R104-E145 PolarHBondContact NH1-OE2 3.35Å; R104-E145 IonicContact NH2-OE1 2.93Å; R104-E145 PolarHBondContact NH2-OE1 2.99Å; R104-E145 IonicContact NH2-OE2 3.6Å; R104-E145 PolarHBondContact NH2-OE2 3.06Å; R104-E145 VanDerWaalsContact NH2-OE2 3.14Å
105D95Very high96.9Very high144 Ų14454.9 Ų54.977%0.7725%0.25SS*.Hα-helixtrans-62.7-25.4-179-66.7-26.8000111.2D103 P109D103-D105 VanDerWaalsContact C-N 3.34Å; D103-D105 PolarHBondContact OD1-N 3.42Å; D105-P109 VanDerWaalsContact O-CD 3.25Å; D105-P109 WeakPolarHBondContact O-CD 3.5Å; D105-P109 WeakPolarHBondContact O-CG 3.37Å
106V97.6Very high97Very high42 Ų4255.6 Ų55.626%0.25525%0.253SS..Hα-helixtrans-99.4-38.1173.9-177.70000112.4Q94 A98 D103 R104 P109 S110Q94-V106 HydrophobicContact CG-CG1 3.44Å; Q94-V106 VanDerWaalsContact CG-CG1 3.44Å; A98-V106 HydrophobicContact CB-CB 3.74Å; A98-V106 HydrophobicContact CB-CG1 3.71Å; D103-V106 PolarHBondContact O-N 3.05Å; D103-V106 PolarHBondContact OD1-N 3.12Å; D103-V106 WeakPolarHBondContact OD2-CG2 3.43Å; R104-V106 PolarHBondContact O-N 3.3Å; V106-P109 WeakPolarHBondContact O-CD 3.31Å; V106-S110 WeakPolarHBondContact O-CB 3.5Å; V106-S110 PolarHBondContact O-N 3.42Å; V106-S110 PolarHBondContact O-OG 2.92Å
107A97.6Very high97.1Very high2 Ų252.5 Ų52.52%0.01724%0.24CC..Hα-helixtrans-66.7-43.5-175.700000113F95 A98 D103 R104 S110 I111 L146F95-A107 HydrophobicContact CD2-CB 4.49Å; A98-A107 HydrophobicContact CB-CB 3.92Å; D103-A107 VanDerWaalsContact O-CB 3.27Å; D103-A107 WeakPolarHBondContact O-CB 3.44Å; D103-A107 PolarHBondContact O-N 2.7Å; R104-A107 PolarHBondContact O-N 3.13Å; A107-S110 PolarHBondContact O-N 2.94Å; A107-I111 PolarHBondContact O-N 2.74Å; A107-L146 HydrophobicContact CB-CD1 4.38Å; A107-L146 HydrophobicContact CB-CD2 4.11Å
108V97.4Very high97.2Very high27 Ų2746 Ų4616%0.16422%0.216CC..Hα-helixtrans-65-49.8-177.8174.10000112R104 S110 I111 K112 L146R104-V108 WeakPolarHBondContact O-CG2 3.32Å; R104-V108 PolarHBondContact O-N 3.24Å; V108-S110 VanDerWaalsContact C-N 3.33Å; V108-S110 PolarHBondContact O-N 2.96Å; V108-I111 WeakPolarHBondContact O-CG2 3.38Å; V108-K112 HydrophobicContact CG1-CD 4.29Å; V108-K112 WeakPolarHBondContact O-CB 3.39Å; V108-K112 WeakPolarHBondContact O-CG 3.46Å; V108-K112 PolarHBondContact O-N 3.42Å; V108-K112 VanDerWaalsContact O-N 3.13Å; V108-L146 HydrophobicContact CB-CD2 4.41Å; V108-L146 HydrophobicContact CG2-CD2 3.66Å
109P97.9Very high97.2Very high4 Ų445.9 Ų45.93%0.02621%0.214CC..Hα-helixtrans-60.9-42.1175.6-19.227.1000112.7Q59 Q63 D105 V106 I111 K112 F113Q59-P109 PolarHBondContact NE2-O 3.33Å; Q59-P109 PolarHBondContact OE1-O 2.87Å; Q63-P109 HydrophobicContact CG-CB 3.97Å; Q63-P109 HydrophobicContact CG-CG 4.14Å; D105-P109 VanDerWaalsContact O-CD 3.25Å; D105-P109 WeakPolarHBondContact O-CD 3.5Å; D105-P109 WeakPolarHBondContact O-CG 3.37Å; V106-P109 WeakPolarHBondContact O-CD 3.31Å; P109-I111 PolarHBondContact O-N 2.8Å; P109-K112 PolarHBondContact O-N 3.49Å; P109-F113 PolarHBondContact O-N 3.37Å
110S98.3Very high97.3Very high1 Ų144.1 Ų44.11%0.00721%0.207CC..Hα-helixtrans-61.5-47.3-177.3-56.90000111.3Q94 V106 A107 V108 F113 I114Q94-S110 WeakPolarHBondContact CG-OG 3.45Å; Q94-S110 PolarHBondContact OE1-OG 3.13Å; V106-S110 WeakPolarHBondContact O-CB 3.5Å; V106-S110 PolarHBondContact O-N 3.42Å; V106-S110 PolarHBondContact O-OG 2.92Å; A107-S110 PolarHBondContact O-N 2.94Å; V108-S110 VanDerWaalsContact C-N 3.33Å; V108-S110 PolarHBondContact O-N 2.96Å; S110-F113 PolarHBondContact O-N 2.91Å; S110-I114 WeakPolarHBondContact O-CG1 3.4Å; S110-I114 PolarHBondContact O-N 3.26Å; S110-I114 VanDerWaalsContact O-N 3.08Å
111I97.9Very high97.5Very high0 Ų038.2 Ų38.20%018%0.182CC..Hα-helixtrans-70-36.7-177.7-150.9-176.9000111.6F95 A107 V108 P109 F113 I114 A115 L135 L146 F150F95-I111 HydrophobicContact CD2-CB 3.9Å; F95-I111 HydrophobicContact CD2-CG1 4.2Å; F95-I111 HydrophobicContact CE2-CB 3.83Å; F95-I111 HydrophobicContact CE2-CD1 3.71Å; F95-I111 HydrophobicContact CE2-CG1 3.86Å; F95-I111 HydrophobicContact CZ-CD1 3.88Å; F95-I111 HydrophobicContact CZ-CG1 4.31Å; A107-I111 PolarHBondContact O-N 2.74Å; V108-I111 WeakPolarHBondContact O-CG2 3.38Å; P109-I111 PolarHBondContact O-N 2.8Å; I111-F113 VanDerWaalsContact C-N 3.33Å; I111-F113 PolarHBondContact O-N 2.83Å; I111-I114 PolarHBondContact O-N 3.49Å; I111-A115 PolarHBondContact O-N 2.81Å; I111-L135 HydrophobicContact CD1-CD1 3.52Å; I111-L146 HydrophobicContact CD1-CB 4.47Å; I111-L146 HydrophobicContact CG2-CD2 4Å; I111-F150 HydrophobicContact CD1-CB 3.96Å; I111-F150 HydrophobicContact CD1-CD2 3.99Å; I111-F150 HydrophobicContact CD1-CG 4.07Å; I111-F150 HydrophobicContact CG1-CB 4.33Å; I111-F150 HydrophobicContact CG1-CD2 3.55Å; I111-F150 HydrophobicContact CG1-CE2 4.05Å; I111-F150 HydrophobicContact CG1-CG 4.16Å; I111-F150 WeakPolarHBondContact O-CD2 3.38Å
112K98.3Very high97.6Very high47 Ų4729.2 Ų29.220%0.20415%0.148CC..Hα-helixtrans-62.6-39.1172.9-75.3-172.1166.5-1410112.3V108 P109 A115 H116 E153V108-K112 HydrophobicContact CG1-CD 4.29Å; V108-K112 WeakPolarHBondContact O-CB 3.39Å; V108-K112 WeakPolarHBondContact O-CG 3.46Å; V108-K112 PolarHBondContact O-N 3.42Å; V108-K112 VanDerWaalsContact O-N 3.13Å; P109-K112 PolarHBondContact O-N 3.49Å; K112-A115 VanDerWaalsContact O-CB 3.32Å; K112-A115 WeakPolarHBondContact O-CB 3.27Å; K112-A115 PolarHBondContact O-N 2.9Å; K112-H116 PolarHBondContact O-CD2 3.19Å; K112-H116 PolarHBondContact O-N 2.97Å; K112-H116 VanDerWaalsContact O-N 3.12Å; K112-E153 HydrophobicContact CB-CG 4.44Å; K112-E153 HydrophobicContact CD-CG 4.49Å; K112-E153 WeakPolarHBondContact CE-OE1 3.44Å; K112-E153 HydrophobicContact CG-CG 4.06Å; K112-E153 IonicContact NZ-OE1 3.88Å; K112-E153 PolarHBondContact NZ-OE1 2.87Å
113F98.7Very high97.8Very high0 Ų023.8 Ų23.80%012%0.119CC..Hα-helixtrans-66-43.8176.9-158.6178.4000111.2I55 Q59 M69 A70 L87 L91 P109 S110 I111 A115 H116 L117I55-F113 HydrophobicContact CD1-CZ 4.31Å; I55-F113 HydrophobicContact CG1-CZ 4.08Å; I55-F113 HydrophobicContact CG2-CE1 4.36Å; I55-F113 HydrophobicContact CG2-CZ 4.37Å; Q59-F113 HydrophobicContact CB-CD1 3.77Å; Q59-F113 HydrophobicContact CB-CE1 3.78Å; Q59-F113 HydrophobicContact CB-CG 4.36Å; Q59-F113 HydrophobicContact CB-CZ 4.35Å; Q59-F113 HydrophobicContact CG-CB 4.06Å; Q59-F113 HydrophobicContact CG-CD1 3.58Å; Q59-F113 HydrophobicContact CG-CD2 4.13Å; Q59-F113 HydrophobicContact CG-CE1 4.02Å; Q59-F113 HydrophobicContact CG-CG 3.67Å; Q59-F113 HydrophobicContact CG-CZ 4.47Å; M69-F113 HydrophobicContact CB-CE2 4.16Å; M69-F113 HydrophobicContact CB-CZ 4.09Å; A70-F113 HydrophobicContact CB-CD2 4.46Å; A70-F113 HydrophobicContact CB-CE2 4.11Å; L87-F113 HydrophobicContact CD1-CE1 4.17Å; L87-F113 HydrophobicContact CD2-CZ 4.24Å; L91-F113 HydrophobicContact CD1-CB 4.24Å; L91-F113 HydrophobicContact CD1-CD1 3.72Å; L91-F113 HydrophobicContact CD1-CE1 4.19Å; L91-F113 HydrophobicContact CD1-CG 3.95Å; L91-F113 HydrophobicContact CD2-CB 4.16Å; L91-F113 HydrophobicContact CD2-CD1 3.73Å; L91-F113 HydrophobicContact CD2-CG 4.31Å; L91-F113 HydrophobicContact CG-CD1 4.32Å; P109-F113 PolarHBondContact O-N 3.37Å; S110-F113 PolarHBondContact O-N 2.91Å; I111-F113 VanDerWaalsContact C-N 3.33Å; I111-F113 PolarHBondContact O-N 2.83Å; F113-A115 VanDerWaalsContact C-N 3.25Å; F113-A115 PolarHBondContact O-N 3.3Å; F113-H116 PolarHBondContact O-N 3.25Å; F113-L117 HydrophobicContact CD2-CD1 4.39Å; F113-L117 HydrophobicContact CD2-CG 4.13Å; F113-L117 HydrophobicContact CE2-CD1 4.49Å; F113-L117 HydrophobicContact CE2-CD2 4.2Å; F113-L117 HydrophobicContact CE2-CG 4.2Å; F113-L117 WeakPolarHBondContact O-CG 3.21Å; F113-L117 PolarHBondContact O-N 3.14Å
114I98.7Very high97.9Very high0 Ų023.8 Ų23.80%012%0.117CC..Hα-helixtrans-57.1-41.8173.2-64.1164.5000110.5L91 L92 F95 S110 I111 H116 L117 I118 L127 L131 F150L91-I114 HydrophobicContact CB-CD1 4.36Å; L91-I114 HydrophobicContact CB-CG1 4.09Å; L91-I114 HydrophobicContact CD1-CG1 4.43Å; L92-I114 HydrophobicContact CD2-CD1 3.74Å; L92-I114 HydrophobicContact CG-CD1 4.37Å; F95-I114 HydrophobicContact CB-CD1 4.37Å; S110-I114 WeakPolarHBondContact O-CG1 3.4Å; S110-I114 PolarHBondContact O-N 3.26Å; S110-I114 VanDerWaalsContact O-N 3.08Å; I111-I114 PolarHBondContact O-N 3.49Å; I114-H116 PolarHBondContact O-N 3.06Å; I114-L117 PolarHBondContact O-N 3.02Å; I114-I118 HydrophobicContact CG2-CD1 4.11Å; I114-I118 WeakPolarHBondContact O-CG1 3.15Å; I114-I118 PolarHBondContact O-N 3.25Å; I114-L127 HydrophobicContact CG2-CD2 4.12Å; I114-L131 HydrophobicContact CD1-CD1 4.41Å; I114-L131 HydrophobicContact CG2-CD1 3.85Å; I114-F150 HydrophobicContact CB-CE2 4.42Å; I114-F150 HydrophobicContact CG2-CE2 4.18Å
115A98.7Very high98Very high0 Ų021.8 Ų21.80%011%0.111CC..Hα-helixtrans-57.5-46.2177.700000112.2I111 K112 F113 I118 N119 F150 E153 C154I111-A115 PolarHBondContact O-N 2.81Å; K112-A115 VanDerWaalsContact O-CB 3.32Å; K112-A115 WeakPolarHBondContact O-CB 3.27Å; K112-A115 PolarHBondContact O-N 2.9Å; F113-A115 VanDerWaalsContact C-N 3.25Å; F113-A115 PolarHBondContact O-N 3.3Å; A115-I118 WeakPolarHBondContact O-CB 3.28Å; A115-I118 PolarHBondContact O-N 3.05Å; A115-N119 PolarHBondContact O-N 3.15Å; A115-F150 HydrophobicContact CB-CD2 3.56Å; A115-F150 HydrophobicContact CB-CE2 3.65Å; A115-F150 HydrophobicContact CB-CG 4.46Å; A115-E153 HydrophobicContact CB-CB 3.66Å; A115-E153 HydrophobicContact CB-CG 4.4Å; A115-C154 HydrophobicContact CB-CB 3.86Å; A115-C154 WeakPolarHBondContact O-CB 3.48Å
116H98.7Very high98Very high14 Ų1418.1 Ų18.17%0.0659%0.094CC..Hα-helixtrans-70.9-30.9177-68.2-65.4000113.3S66 A70 K112 F113 I114 I118 N119 Q120 E153S66-H116 WeakPolarHBondContact CB-CD2 3.43Å; A70-H116 HydrophobicContact CB-CB 3.45Å; A70-H116 VanDerWaalsContact CB-CB 3.45Å; K112-H116 PolarHBondContact O-CD2 3.19Å; K112-H116 PolarHBondContact O-N 2.97Å; K112-H116 VanDerWaalsContact O-N 3.12Å; F113-H116 PolarHBondContact O-N 3.25Å; I114-H116 PolarHBondContact O-N 3.06Å; H116-I118 PolarHBondContact O-N 3.24Å; H116-N119 WeakPolarHBondContact O-CB 3.47Å; H116-N119 PolarHBondContact O-N 2.72Å; H116-Q120 WeakPolarHBondContact O-CB 3.38Å; H116-Q120 WeakPolarHBondContact O-CG 3.49Å; H116-Q120 PolarHBondContact O-N 2.96Å; H116-E153 IonicContact CE1-OE2 2.72Å; H116-E153 PolarHBondContact CE1-OE2 3Å; H116-E153 IonicContact NE2-OE2 3.94Å
117L98.8Very high98Very high0 Ų016.2 Ų16.20%08%0.082CC..Hα-helixtrans-66.5-27.4171.6-69175.2000112.3A70 A73 L87 L88 L91 F113 I114 Q121 V122 A123A70-L117 HydrophobicContact CB-CD2 4.25Å; A73-L117 HydrophobicContact CB-CD2 3.87Å; L87-L117 HydrophobicContact CD2-CD1 3.9Å; L87-L117 HydrophobicContact CD2-CD2 4.04Å; L87-L117 HydrophobicContact CG-CD1 4.09Å; L88-L117 HydrophobicContact CD2-CB 4.31Å; L88-L117 HydrophobicContact CD2-CD1 3.62Å; L91-L117 HydrophobicContact CD1-CD1 3.48Å; L91-L117 VanDerWaalsContact CD1-CD1 3.48Å; F113-L117 HydrophobicContact CD2-CD1 4.39Å; F113-L117 HydrophobicContact CD2-CG 4.13Å; F113-L117 HydrophobicContact CE2-CD1 4.49Å; F113-L117 HydrophobicContact CE2-CD2 4.2Å; F113-L117 HydrophobicContact CE2-CG 4.2Å; F113-L117 WeakPolarHBondContact O-CG 3.21Å; F113-L117 PolarHBondContact O-N 3.14Å; I114-L117 PolarHBondContact O-N 3.02Å; L117-Q121 PolarHBondContact O-N 2.93Å; L117-V122 HydrophobicContact CB-CB 4.27Å; L117-V122 HydrophobicContact CD2-CB 4.11Å; L117-V122 HydrophobicContact CD2-CG1 4.3Å; L117-V122 HydrophobicContact CD2-CG2 4.18Å; L117-V122 PolarHBondContact O-N 2.99Å; L117-A123 PolarHBondContact O-N 3.23Å; L117-A123 VanDerWaalsContact O-N 3.15Å
118I98.6Very high98Very high1 Ų116.1 Ų16.11%0.0058%0.081CC..Hα-helixtrans-74.6-41.2171-66.5172.1000110.7I114 A115 H116 Q120 Q121 A123 A128 F150 M158I114-I118 HydrophobicContact CG2-CD1 4.11Å; I114-I118 WeakPolarHBondContact O-CG1 3.15Å; I114-I118 PolarHBondContact O-N 3.25Å; A115-I118 WeakPolarHBondContact O-CB 3.28Å; A115-I118 PolarHBondContact O-N 3.05Å; H116-I118 PolarHBondContact O-N 3.24Å; I118-Q120 VanDerWaalsContact C-N 3.27Å; I118-Q120 PolarHBondContact O-N 3.43Å; I118-Q121 PolarHBondContact O-N 3.32Å; I118-A123 HydrophobicContact CG1-CB 3.68Å; I118-A128 HydrophobicContact CD1-CB 3.45Å; I118-A128 VanDerWaalsContact CD1-CB 3.45Å; I118-F150 HydrophobicContact CD1-CE2 4.44Å; I118-F150 HydrophobicContact CD1-CZ 3.78Å; I118-M158 HydrophobicContact CG2-SD 3.86Å
119N98.6Very high98.1Very high1 Ų116.6 Ų16.61%0.0058%0.083CC..Hα-helixtrans-57.3-44.2174.4-72.9-11.4000112A115 H116 Q121 E153 C154 K157 P206A115-N119 PolarHBondContact O-N 3.15Å; H116-N119 WeakPolarHBondContact O-CB 3.47Å; H116-N119 PolarHBondContact O-N 2.72Å; N119-Q121 PolarHBondContact O-N 3.18Å; N119-E153 PolarHBondContact ND2-O 2.87Å; N119-C154 WeakPolarHBondContact OD1-CA 3.27Å; N119-C154 WeakPolarHBondContact OD1-CB 3.3Å; N119-K157 VanDerWaalsContact OD1-CB 3.27Å; N119-K157 WeakPolarHBondContact OD1-CB 3.35Å; N119-P206 HydrophobicContact CB-CB 4.3Å; N119-P206 WeakPolarHBondContact CB-O 3.38Å; N119-P206 VanDerWaalsContact CG-O 3.27Å; N119-P206 PolarHBondContact ND2-O 2.86Å
120Q98.2Very high98.1Very high9 Ų918.9 Ų18.94%0.0429%0.093CC..THydrogen-bonded Turntrans-78.97.1175.8-68.1-70.6-1.100113.5A70 A74 H116 I118 V122 L211 Q219A70-Q120 HydrophobicContact CB-CG 3.97Å; A74-Q120 HydrophobicContact CB-CB 3.95Å; A74-Q120 HydrophobicContact CB-CG 4.38Å; H116-Q120 WeakPolarHBondContact O-CB 3.38Å; H116-Q120 WeakPolarHBondContact O-CG 3.49Å; H116-Q120 PolarHBondContact O-N 2.96Å; I118-Q120 VanDerWaalsContact C-N 3.27Å; I118-Q120 PolarHBondContact O-N 3.43Å; Q120-V122 HydrophobicContact CB-CG2 4.33Å; Q120-V122 PolarHBondContact O-N 3.03Å; Q120-L211 PolarHBondContact NE2-O 2.93Å; Q120-L211 VanDerWaalsContact NE2-O 3.09Å; Q120-Q219 PolarHBondContact O-NE2 3.06Å
121Q97.7Very high98.1Very high59 Ų5918.8 Ų18.828%0.2769%0.093SC..THydrogen-bonded Turntrans51.528.6179.1-64.5-177.1-112.200115.4L117 I118 N119 Q219 T221L117-Q121 PolarHBondContact O-N 2.93Å; I118-Q121 PolarHBondContact O-N 3.32Å; N119-Q121 PolarHBondContact O-N 3.18Å; Q121-Q219 HydrophobicContact CB-CG 3.89Å; Q121-Q219 PolarHBondContact O-NE2 2.8Å; Q121-T221 VanDerWaalsContact O-CA 3.31Å; Q121-T221 WeakPolarHBondContact O-CA 3.37Å; Q121-T221 VanDerWaalsContact O-CB 3.3Å; Q121-T221 WeakPolarHBondContact O-CB 3.32Å; Q121-T221 PolarHBondContact O-OG1 3.17Å
122V98.6Very high98.1Very high0 Ų018.8 Ų18.80%09%0.093CC..SBendtrans-77.4-35.9167.7179.80000109.6A74 N77 L88 L117 Q120 H222A74-V122 HydrophobicContact CB-CG2 3.83Å; N77-V122 HydrophobicContact CB-CG1 4.38Å; N77-V122 HydrophobicContact CB-CG2 4.43Å; L88-V122 HydrophobicContact CD1-CG1 4.31Å; L117-V122 HydrophobicContact CB-CB 4.27Å; L117-V122 HydrophobicContact CD2-CB 4.11Å; L117-V122 HydrophobicContact CD2-CG1 4.3Å; L117-V122 HydrophobicContact CD2-CG2 4.18Å; L117-V122 PolarHBondContact O-N 2.99Å; Q120-V122 HydrophobicContact CB-CG2 4.33Å; Q120-V122 PolarHBondContact O-N 3.03Å; V122-H222 PolarHBondContact O-CD2 2.68Å; V122-H222 PolarHBondContact O-N 3.48Å
123A98.5Very high98Very high2 Ų220.5 Ų20.52%0.01711%0.107CC..BIsolated β-bridgetrans-108.7137.7173.400000111.7L88 L117 I118 L127L88-A123 HydrophobicContact CD1-CB 3.93Å; L88-A123 HydrophobicContact CD2-CB 3.74Å; L117-A123 PolarHBondContact O-N 3.23Å; L117-A123 VanDerWaalsContact O-N 3.15Å; I118-A123 HydrophobicContact CG1-CB 3.68Å; A123-L127 HydrophobicContact CB-CD2 4.16Å
124H97.5Very high97.9Very high62 Ų6223.8 Ų23.829%0.28712%0.124SC..  trans-67.5144.1176.3-160.8-84.8000111.7V126 L127 T221 H222 A223H124-V126 WeakPolarHBondContact ND1-CG2 3.33Å; H124-V126 PolarHBondContact ND1-N 2.95Å; H124-V126 PolarHBondContact O-N 3.29Å; H124-V126 VanDerWaalsContact O-N 3.1Å; H124-L127 WeakPolarHBondContact O-CB 3.36Å; H124-L127 PolarHBondContact O-N 3.49Å; H124-T221 VanDerWaalsContact CA-CG2 3.5Å; H124-T221 HydrophobicContact CB-CG2 3.83Å; H124-T221 VanDerWaalsContact N-CG2 3.34Å; H124-H222 PolarHBondContact N-O 3.45Å; H124-A223 HydrophobicContact CB-CB 4.29Å
125E96.3Very high97.9Very high42 Ų4223.8 Ų23.820%0.19612%0.124CC..Hα-helixtrans-62.6-20.6-176.666.5-81-176.100114.2L127 A128 L129 M158 L161E125-L127 PolarHBondContact O-N 3.2Å; E125-A128 WeakPolarHBondContact O-CB 3.48Å; E125-A128 PolarHBondContact O-N 2.92Å; E125-A128 VanDerWaalsContact O-N 3.09Å; E125-L129 PolarHBondContact O-N 3.08Å; E125-L129 VanDerWaalsContact O-N 3.17Å; E125-M158 HydrophobicContact CB-CE 3.88Å; E125-M158 HydrophobicContact CB-SD 3.58Å; E125-M158 VanDerWaalsContact CB-SD 3.58Å; E125-M158 WeakPolarHBondContact O-CE 3.29Å; E125-L161 HydrophobicContact CB-CB 4.18Å; E125-L161 HydrophobicContact CB-CD1 4.03Å; E125-L161 HydrophobicContact CG-CB 4.03Å; E125-L161 HydrophobicContact CG-CD1 4.47Å
126V95.6Very high97.8Very high68 Ų6824 Ų2441%0.41213%0.125SC..Hα-helixtrans-58.3-38.7173.6169.90000110.5H124 A128 L129 E130H124-V126 WeakPolarHBondContact ND1-CG2 3.33Å; H124-V126 PolarHBondContact ND1-N 2.95Å; H124-V126 PolarHBondContact O-N 3.29Å; H124-V126 VanDerWaalsContact O-N 3.1Å; V126-A128 VanDerWaalsContact C-N 3.3Å; V126-A128 PolarHBondContact O-N 3.4Å; V126-L129 PolarHBondContact O-N 3.06Å; V126-L129 VanDerWaalsContact O-N 3.13Å; V126-E130 HydrophobicContact CG1-CG 4.31Å; V126-E130 WeakPolarHBondContact O-CG 3.44Å; V126-E130 PolarHBondContact O-N 2.94Å
127L97.4Very high97.5Very high1 Ų129.8 Ų29.81%0.00515%0.153CC..Hα-helixtrans-62-37.9176.6178.960.3000112L92 I114 A123 H124 E125 E130 L131 L226L92-L127 HydrophobicContact CD1-CD1 3.99Å; L92-L127 HydrophobicContact CD1-CD2 3.95Å; L92-L127 HydrophobicContact CD2-CD1 3.81Å; L92-L127 HydrophobicContact CD2-CD2 4.1Å; L92-L127 HydrophobicContact CD2-CG 4.39Å; L92-L127 HydrophobicContact CG-CD2 4.39Å; I114-L127 HydrophobicContact CG2-CD2 4.12Å; A123-L127 HydrophobicContact CB-CD2 4.16Å; H124-L127 WeakPolarHBondContact O-CB 3.36Å; H124-L127 PolarHBondContact O-N 3.49Å; E125-L127 PolarHBondContact O-N 3.2Å; L127-E130 PolarHBondContact O-N 3.36Å; L127-L131 HydrophobicContact CD1-CD1 4.43Å; L127-L131 HydrophobicContact CD1-CG 4.41Å; L127-L131 HydrophobicContact CG-CD1 4.19Å; L127-L131 WeakPolarHBondContact O-CB 3.35Å; L127-L131 WeakPolarHBondContact O-CG 3.4Å; L127-L131 PolarHBondContact O-N 3.19Å; L127-L226 HydrophobicContact CD1-CD2 3.78Å; L127-L226 HydrophobicContact CD1-CG 3.97Å
128A98.3Very high97.2Very high0 Ų036.2 Ų36.20%019%0.186CC..Hα-helixtrans-62.8-43.117400000111.8I118 E125 V126 L131 L132 F150 M158I118-A128 HydrophobicContact CD1-CB 3.45Å; I118-A128 VanDerWaalsContact CD1-CB 3.45Å; E125-A128 WeakPolarHBondContact O-CB 3.48Å; E125-A128 PolarHBondContact O-N 2.92Å; E125-A128 VanDerWaalsContact O-N 3.09Å; V126-A128 VanDerWaalsContact C-N 3.3Å; V126-A128 PolarHBondContact O-N 3.4Å; A128-L131 PolarHBondContact O-N 3.2Å; A128-L132 WeakPolarHBondContact O-CB 3.33Å; A128-L132 WeakPolarHBondContact O-CD1 3.27Å; A128-L132 VanDerWaalsContact O-CG 3.31Å; A128-L132 WeakPolarHBondContact O-CG 3.41Å; A128-L132 PolarHBondContact O-N 3.35Å; A128-F150 HydrophobicContact CB-CE1 3.59Å; A128-F150 HydrophobicContact CB-CZ 3.73Å; A128-M158 HydrophobicContact CB-CE 3.51Å; A128-M158 HydrophobicContact CB-CG 4.25Å; A128-M158 HydrophobicContact CB-SD 3.44Å; A128-M158 WeakPolarHBondContact CB-SD 3.48Å
129L98.2Very high96.9Very high38 Ų3837.8 Ų37.820%0.19920%0.196CC..Hα-helixtrans-65.3-41.6178.2-63.6177.1000111.6E125 V126 L132 T133 M158 I169E125-L129 PolarHBondContact O-N 3.08Å; E125-L129 VanDerWaalsContact O-N 3.17Å; V126-L129 PolarHBondContact O-N 3.06Å; V126-L129 VanDerWaalsContact O-N 3.13Å; L129-L132 PolarHBondContact O-N 3.5Å; L129-T133 VanDerWaalsContact O-CB 3.3Å; L129-T133 WeakPolarHBondContact O-CB 3.36Å; L129-T133 PolarHBondContact O-N 2.99Å; L129-T133 PolarHBondContact O-OG1 3.31Å; L129-M158 HydrophobicContact CD2-CE 3.87Å; L129-M158 HydrophobicContact CG-CE 3.97Å; L129-I169 HydrophobicContact CD2-CG1 4.44Å
130E97.9Very high96.7Very high51 Ų5141 Ų4124%0.23822%0.215CC..Hα-helixtrans-61.7-45.6174.9-70.3179.7169.100111.3V126 L127 T133 L134 S225 L226V126-E130 HydrophobicContact CG1-CG 4.31Å; V126-E130 WeakPolarHBondContact O-CG 3.44Å; V126-E130 PolarHBondContact O-N 2.94Å; L127-E130 PolarHBondContact O-N 3.36Å; E130-T133 PolarHBondContact O-N 3.18Å; E130-L134 WeakPolarHBondContact O-CB 3.42Å; E130-L134 PolarHBondContact O-N 2.95Å; E130-S225 PolarHBondContact OE1-OG 3.18Å; E130-S225 WeakPolarHBondContact OE2-CA 3.33Å; E130-S225 PolarHBondContact OE2-OG 3.31Å; E130-L226 VanDerWaalsContact C-CD1 3.46Å; E130-L226 HydrophobicContact CB-CB 4.4Å; E130-L226 HydrophobicContact CB-CD1 3.7Å; E130-L226 HydrophobicContact CB-CG 3.84Å; E130-L226 PolarHBondContact OE2-N 2.94Å
131L98.3Very high96.5Very high0 Ų043.1 Ų43.10%023%0.227CC..Hα-helixtrans-60.5-47176.8-79.3169.7000112.1F95 I114 L127 A128 T133 L134 L135 F150 L226F95-L131 HydrophobicContact CD1-CD2 3.7Å; F95-L131 HydrophobicContact CE1-CD2 3.28Å; F95-L131 HydrophobicContact CZ-CD2 4.01Å; I114-L131 HydrophobicContact CD1-CD1 4.41Å; I114-L131 HydrophobicContact CG2-CD1 3.85Å; L127-L131 HydrophobicContact CD1-CD1 4.43Å; L127-L131 HydrophobicContact CD1-CG 4.41Å; L127-L131 HydrophobicContact CG-CD1 4.19Å; L127-L131 WeakPolarHBondContact O-CB 3.35Å; L127-L131 WeakPolarHBondContact O-CG 3.4Å; L127-L131 PolarHBondContact O-N 3.19Å; A128-L131 PolarHBondContact O-N 3.2Å; L131-T133 VanDerWaalsContact C-N 3.34Å; L131-L134 PolarHBondContact O-N 2.96Å; L131-L135 WeakPolarHBondContact O-CB 3.31Å; L131-L135 VanDerWaalsContact O-CG 3.23Å; L131-L135 WeakPolarHBondContact O-CG 3.46Å; L131-L135 PolarHBondContact O-N 2.87Å; L131-F150 HydrophobicContact CD1-CE2 4.17Å; L131-F150 HydrophobicContact CD1-CZ 3.96Å; L131-L226 HydrophobicContact CD2-CD1 4.01Å; L131-L226 HydrophobicContact CD2-CD2 3.71Å; L131-L226 HydrophobicContact CD2-CG 4.42Å; L131-L226 HydrophobicContact CG-CD1 4.15Å; L131-L226 HydrophobicContact CG-CD2 4.07Å; L131-L226 HydrophobicContact CG-CG 4.45Å
132L98.5Very high96.3Very high0 Ų042.8 Ų42.80%023%0.227CC..Hα-helixtrans-67.4-36.4179.4-73.7163.3000112A128 L129 L135 L136 F150 L151 I169A128-L132 WeakPolarHBondContact O-CB 3.33Å; A128-L132 WeakPolarHBondContact O-CD1 3.27Å; A128-L132 VanDerWaalsContact O-CG 3.31Å; A128-L132 WeakPolarHBondContact O-CG 3.41Å; A128-L132 PolarHBondContact O-N 3.35Å; L129-L132 PolarHBondContact O-N 3.5Å; L132-L135 PolarHBondContact O-N 2.99Å; L132-L136 VanDerWaalsContact O-CB 3.28Å; L132-L136 WeakPolarHBondContact O-CB 3.32Å; L132-L136 VanDerWaalsContact O-CG 3.24Å; L132-L136 WeakPolarHBondContact O-CG 3.4Å; L132-L136 PolarHBondContact O-N 3.19Å; L132-F150 HydrophobicContact CD1-CD1 4.03Å; L132-F150 HydrophobicContact CD1-CE1 4.06Å; L132-F150 HydrophobicContact CD2-CD1 3.92Å; L132-F150 HydrophobicContact CG-CD1 3.83Å; L132-F150 HydrophobicContact CG-CE1 4.05Å; L132-L151 HydrophobicContact CD1-CD2 3.68Å; L132-L151 HydrophobicContact CD1-CG 4.22Å; L132-L151 HydrophobicContact CD2-CD1 3.97Å; L132-L151 HydrophobicContact CD2-CD2 4.24Å; L132-L151 HydrophobicContact CD2-CG 3.82Å; L132-I169 HydrophobicContact CB-CD1 3.63Å; L132-I169 HydrophobicContact CB-CG1 4.09Å; L132-I169 HydrophobicContact CB-CG2 4.43Å; L132-I169 HydrophobicContact CD1-CG1 4.18Å; L132-I169 HydrophobicContact CD1-CG2 4.23Å; L132-I169 HydrophobicContact CD2-CG2 4.37Å
133T97.2Very high96.2Very high83 Ų8342.9 Ų42.951%0.50923%0.228SC..Hα-helixtrans-64.1-48.1174.8-57.70000110.4L129 E130 L131 L135 L136 E137L129-T133 VanDerWaalsContact O-CB 3.3Å; L129-T133 WeakPolarHBondContact O-CB 3.36Å; L129-T133 PolarHBondContact O-N 2.99Å; L129-T133 PolarHBondContact O-OG1 3.31Å; E130-T133 PolarHBondContact O-N 3.18Å; L131-T133 VanDerWaalsContact C-N 3.34Å; T133-L135 VanDerWaalsContact C-N 3.33Å; T133-L135 PolarHBondContact O-N 2.96Å; T133-L136 PolarHBondContact O-N 2.94Å; T133-E137 WeakPolarHBondContact O-CB 3.47Å; T133-E137 PolarHBondContact O-N 3.39Å
134L96.3Very high96.1Very high68 Ų6842.8 Ų42.836%0.35623%0.227SC..Hα-helixtrans-57.4-44.5176.3175.466.8000112.1F99 E130 L131 L226F99-L134 HydrophobicContact CE1-CG 4.43Å; E130-L134 WeakPolarHBondContact O-CB 3.42Å; E130-L134 PolarHBondContact O-N 2.95Å; L131-L134 PolarHBondContact O-N 2.96Å; L134-L226 HydrophobicContact CB-CD1 4.26Å; L134-L226 HydrophobicContact CD2-CD1 4.03Å
135L97.1Very high96Very high0 Ų041.5 Ų41.50%022%0.222CC..Hα-helixtrans-71.6-30.4-177.9-70.9169.8000113.2F95 F99 I111 L131 L132 T133 S143 L146 S147F95-L135 HydrophobicContact CZ-CD2 4.2Å; F99-L135 HydrophobicContact CD2-CD2 3.99Å; F99-L135 HydrophobicContact CE1-CD2 4.38Å; F99-L135 HydrophobicContact CE2-CD2 3.46Å; F99-L135 VanDerWaalsContact CE2-CD2 3.46Å; F99-L135 HydrophobicContact CZ-CD2 3.69Å; I111-L135 HydrophobicContact CD1-CD1 3.52Å; L131-L135 WeakPolarHBondContact O-CB 3.31Å; L131-L135 VanDerWaalsContact O-CG 3.23Å; L131-L135 WeakPolarHBondContact O-CG 3.46Å; L131-L135 PolarHBondContact O-N 2.87Å; L132-L135 PolarHBondContact O-N 2.99Å; T133-L135 VanDerWaalsContact C-N 3.33Å; T133-L135 PolarHBondContact O-N 2.96Å; L135-S143 WeakPolarHBondContact O-CB 3.27Å; L135-S143 PolarHBondContact O-OG 3.14Å; L135-L146 HydrophobicContact CD1-CB 4.07Å; L135-L146 HydrophobicContact CD2-CB 4.01Å; L135-L146 HydrophobicContact CD2-CD1 3.98Å; L135-S147 WeakPolarHBondContact CB-OG 3.3Å
136L96.5Very high96.1Very high4 Ų439.9 Ų39.92%0.02121%0.214CC..Hα-helixtrans-103.6-1.2-174.4-59.5176.2000114L132 T133 V144 S147 I169 R172 L173 I176L132-L136 VanDerWaalsContact O-CB 3.28Å; L132-L136 WeakPolarHBondContact O-CB 3.32Å; L132-L136 VanDerWaalsContact O-CG 3.24Å; L132-L136 WeakPolarHBondContact O-CG 3.4Å; L132-L136 PolarHBondContact O-N 3.19Å; T133-L136 PolarHBondContact O-N 2.94Å; L136-V144 HydrophobicContact CD2-CG2 4.36Å; L136-S147 WeakPolarHBondContact CD2-OG 3.48Å; L136-I169 HydrophobicContact CD1-CG2 3.92Å; L136-R172 HydrophobicContact CB-CG 3.94Å; L136-R172 HydrophobicContact CD1-CG 4.37Å; L136-R172 PolarHBondContact O-NE 3.03Å; L136-R172 PolarHBondContact O-NH2 2.89Å; L136-R172 VanDerWaalsContact O-NH2 3.11Å; L136-L173 HydrophobicContact CD1-CD2 4.07Å; L136-L173 HydrophobicContact CD1-CG 4.08Å; L136-L173 HydrophobicContact CD2-CD2 3.78Å; L136-I176 HydrophobicContact CB-CD1 4.26Å; L136-I176 HydrophobicContact CD2-CD1 3.77Å
137E93.8Very high96.2Very high136 Ų13636.6 Ų36.664%0.63619%0.194SC*.Hα-helixtrans-60.5-59.8176.3-173.2179.1-17700110.3T133 R172T133-E137 WeakPolarHBondContact O-CB 3.47Å; T133-E137 PolarHBondContact O-N 3.39Å; E137-R172 PolarHBondContact O-NH2 3.3Å
138I91.7Very high96.3Very high135 Ų13536.7 Ų36.769%0.69220%0.195SC*.SBendtrans-113.495.7171.2-55.8174.6000107.7T140I138-T140 PolarHBondContact O-N 3.42Å
139P93.2Very high96.2Very high34 Ų3437.5 Ų37.522%0.22120%0.201CC..  trans-69.4126-174.729.2-35.8000110.9V144 I176 A180P139-V144 HydrophobicContact CB-CG2 3.93Å; P139-I176 HydrophobicContact CB-CD1 3.8Å; P139-I176 HydrophobicContact CB-CG1 3.99Å; P139-I176 HydrophobicContact CB-CG2 4.07Å; P139-I176 HydrophobicContact CG-CD1 4.28Å; P139-I176 HydrophobicContact CG-CG1 4.04Å; P139-A180 HydrophobicContact CG-CB 4.35Å
140T93.5Very high96.2Very high68 Ų6835.7 Ų35.742%0.41719%0.192SC..  trans-120.1163.9165.2680000108.9I138 D142 S143 V144I138-T140 PolarHBondContact O-N 3.42Å; T140-D142 PolarHBondContact O-N 3.08Å; T140-S143 PolarHBondContact N-OG 3.43Å; T140-S143 PolarHBondContact O-N 3.07Å; T140-S143 VanDerWaalsContact O-N 3.15Å; T140-S143 PolarHBondContact O-OG 3.14Å; T140-S143 WeakPolarHBondContact OG1-CB 3.42Å; T140-S143 PolarHBondContact OG1-N 3.15Å; T140-S143 VanDerWaalsContact OG1-N 3.1Å; T140-V144 WeakPolarHBondContact O-CG2 3.4Å; T140-V144 PolarHBondContact O-N 2.96Å
141D94.6Very high96.3Very high55 Ų5533.2 Ų33.229%0.29418%0.18SC..Hα-helixtrans-55.2-37.9177.9-65.2-30.5000112E145 D183 V186D141-E145 VanDerWaalsContact O-CB 3.29Å; D141-E145 WeakPolarHBondContact O-CB 3.47Å; D141-E145 PolarHBondContact O-N 3.15Å; D141-E145 VanDerWaalsContact O-N 3.1Å; D141-D183 PolarHBondContact OD1-N 2.78Å; D141-V186 HydrophobicContact CB-CG2 3.7Å
142D93.6Very high96.3Very high51 Ų5137.1 Ų37.127%0.27320%0.195SC..Hα-helixtrans-73.9-40.8177.9-72.8-30.7000113R104 T140 E145 L146R104-D142 WeakPolarHBondContact CD-OD1 3.5Å; R104-D142 IonicContact CZ-OD1 2.94Å; R104-D142 IonicContact NE-OD1 3.61Å; R104-D142 IonicContact NH1-OD1 3.59Å; R104-D142 PolarHBondContact NH1-OD1 2.87Å; T140-D142 PolarHBondContact O-N 3.08Å; D142-E145 PolarHBondContact O-N 2.76Å; D142-L146 WeakPolarHBondContact O-CG 3.42Å; D142-L146 PolarHBondContact O-N 2.97Å
143S95.9Very high96.2Very high2 Ų239.1 Ų39.11%0.01420%0.204CC..Hα-helixtrans-70.2-36.3-178.781.60000111.8L135 T140 S147L135-S143 WeakPolarHBondContact O-CB 3.27Å; L135-S143 PolarHBondContact O-OG 3.14Å; T140-S143 PolarHBondContact N-OG 3.43Å; T140-S143 PolarHBondContact O-N 3.07Å; T140-S143 VanDerWaalsContact O-N 3.15Å; T140-S143 PolarHBondContact O-OG 3.14Å; T140-S143 WeakPolarHBondContact OG1-CB 3.42Å; T140-S143 PolarHBondContact OG1-N 3.15Å; T140-S143 VanDerWaalsContact OG1-N 3.1Å; S143-S147 PolarHBondContact O-N 3.23Å; S143-S147 PolarHBondContact O-OG 2.96Å
144V96.7Very high96.3Very high0 Ų035.2 Ų35.20%018%0.18CC..Hα-helixtrans-69.2-41.1174179.40000110.5L136 P139 T140 L146 S147 V148 L173 I176 V186 I190L136-V144 HydrophobicContact CD2-CG2 4.36Å; P139-V144 HydrophobicContact CB-CG2 3.93Å; T140-V144 WeakPolarHBondContact O-CG2 3.4Å; T140-V144 PolarHBondContact O-N 2.96Å; V144-L146 PolarHBondContact O-N 3.01Å; V144-S147 WeakPolarHBondContact O-CB 3.36Å; V144-S147 PolarHBondContact O-N 3.37Å; V144-S147 VanDerWaalsContact O-N 3.17Å; V144-V148 HydrophobicContact CG1-CG2 4.36Å; V144-V148 WeakPolarHBondContact O-CG2 3.06Å; V144-V148 PolarHBondContact O-N 3.25Å; V144-L173 HydrophobicContact CG1-CD2 4.48Å; V144-I176 HydrophobicContact CG2-CG2 4.13Å; V144-V186 HydrophobicContact CB-CG1 3.65Å; V144-V186 HydrophobicContact CG1-CG1 3.38Å; V144-V186 HydrophobicContact CG2-CG1 4.24Å; V144-I190 HydrophobicContact CG1-CD1 3.9Å; V144-I190 HydrophobicContact CG1-CG1 3.81Å
145E96.1Very high96.4Very high36 Ų3632 Ų3217%0.16816%0.163CC..Hα-helixtrans-60.3-44.5174.9-177168.3176.400112.5R104 D141 D142 S147 V148 A149 R185 M189R104-E145 IonicContact CZ-OE1 3.75Å; R104-E145 IonicContact CZ-OE2 3.72Å; R104-E145 VanDerWaalsContact CZ-OE2 3.3Å; R104-E145 IonicContact NH1-OE1 3.7Å; R104-E145 IonicContact NH1-OE2 2.69Å; R104-E145 PolarHBondContact NH1-OE2 3.35Å; R104-E145 IonicContact NH2-OE1 2.93Å; R104-E145 PolarHBondContact NH2-OE1 2.99Å; R104-E145 IonicContact NH2-OE2 3.6Å; R104-E145 PolarHBondContact NH2-OE2 3.06Å; R104-E145 VanDerWaalsContact NH2-OE2 3.14Å; D141-E145 VanDerWaalsContact O-CB 3.29Å; D141-E145 WeakPolarHBondContact O-CB 3.47Å; D141-E145 PolarHBondContact O-N 3.15Å; D141-E145 VanDerWaalsContact O-N 3.1Å; D142-E145 PolarHBondContact O-N 2.76Å; E145-S147 VanDerWaalsContact C-N 3.3Å; E145-S147 PolarHBondContact O-N 3.05Å; E145-V148 PolarHBondContact O-N 3.03Å; E145-A149 WeakPolarHBondContact O-CB 3.46Å; E145-A149 PolarHBondContact O-N 3.43Å; E145-R185 IonicContact OE1-NH1 3.49Å; E145-R185 IonicContact OE2-CZ 3.53Å; E145-R185 VanDerWaalsContact OE2-CZ 3.3Å; E145-R185 IonicContact OE2-NH1 2.83Å; E145-R185 PolarHBondContact OE2-NH1 2.98Å; E145-R185 IonicContact OE2-NH2 3.77Å; E145-R185 PolarHBondContact OE2-NH2 2.95Å; E145-M189 HydrophobicContact CB-CE 3.82Å; E145-M189 HydrophobicContact CB-SD 4.37Å; E145-M189 HydrophobicContact CG-CE 3.94Å; E145-M189 HydrophobicContact CG-SD 3.9Å
146L97.9Very high96.4Very high7 Ų732.5 Ų32.54%0.03717%0.168CC..Hα-helixtrans-59.9-41.5173.7-74.8168.4000111.6F99 A107 V108 I111 L135 D142 V144 A149 F150F99-L146 HydrophobicContact CD2-CD1 3.62Å; F99-L146 HydrophobicContact CE2-CD1 3.91Å; A107-L146 HydrophobicContact CB-CD1 4.38Å; A107-L146 HydrophobicContact CB-CD2 4.11Å; V108-L146 HydrophobicContact CB-CD2 4.41Å; V108-L146 HydrophobicContact CG2-CD2 3.66Å; I111-L146 HydrophobicContact CD1-CB 4.47Å; I111-L146 HydrophobicContact CG2-CD2 4Å; L135-L146 HydrophobicContact CD1-CB 4.07Å; L135-L146 HydrophobicContact CD2-CB 4.01Å; L135-L146 HydrophobicContact CD2-CD1 3.98Å; D142-L146 WeakPolarHBondContact O-CG 3.42Å; D142-L146 PolarHBondContact O-N 2.97Å; V144-L146 PolarHBondContact O-N 3.01Å; L146-A149 PolarHBondContact O-N 2.99Å; L146-F150 WeakPolarHBondContact O-CB 3.49Å; L146-F150 PolarHBondContact O-N 3.23Å
147S98.3Very high96.5Very high0 Ų033.8 Ų33.80%017%0.173CC..Hα-helixtrans-63.2-43.3177.1-57.60000111.9L135 L136 S143 V144 E145 F150 L151L135-S147 WeakPolarHBondContact CB-OG 3.3Å; L136-S147 WeakPolarHBondContact CD2-OG 3.48Å; S143-S147 PolarHBondContact O-N 3.23Å; S143-S147 PolarHBondContact O-OG 2.96Å; V144-S147 WeakPolarHBondContact O-CB 3.36Å; V144-S147 PolarHBondContact O-N 3.37Å; V144-S147 VanDerWaalsContact O-N 3.17Å; E145-S147 VanDerWaalsContact C-N 3.3Å; E145-S147 PolarHBondContact O-N 3.05Å; S147-F150 PolarHBondContact O-N 3.38Å; S147-L151 WeakPolarHBondContact O-CB 3.34Å; S147-L151 WeakPolarHBondContact O-CG 3.27Å; S147-L151 PolarHBondContact O-N 3.45Å
148V98.2Very high96.7Very high3 Ų327.3 Ų27.32%0.01814%0.143CC..Hα-helixtrans-65.6-44.6176.6172.20000110.7V144 E145 F150 L151 R152 M189 L193V144-V148 HydrophobicContact CG1-CG2 4.36Å; V144-V148 WeakPolarHBondContact O-CG2 3.06Å; V144-V148 PolarHBondContact O-N 3.25Å; E145-V148 PolarHBondContact O-N 3.03Å; V148-F150 VanDerWaalsContact C-N 3.33Å; V148-F150 PolarHBondContact O-N 3.06Å; V148-L151 PolarHBondContact O-N 2.94Å; V148-R152 HydrophobicContact CG1-CG 4.45Å; V148-R152 VanDerWaalsContact O-CG 3.28Å; V148-R152 WeakPolarHBondContact O-CG 3.48Å; V148-R152 PolarHBondContact O-N 3.46Å; V148-M189 HydrophobicContact CG1-CB 4.28Å; V148-M189 HydrophobicContact CG2-CB 4.27Å; V148-L193 HydrophobicContact CB-CD2 4.45Å; V148-L193 HydrophobicContact CG1-CB 4.31Å; V148-L193 HydrophobicContact CG1-CD2 4.49Å; V148-L193 HydrophobicContact CG2-CD2 4.01Å
149A97.3Very high97Very high16 Ų1622.5 Ų22.513%0.13212%0.121CC..Hα-helixtrans-59.3-44.9176.500000111.3E145 L146 R152 E153E145-A149 WeakPolarHBondContact O-CB 3.46Å; E145-A149 PolarHBondContact O-N 3.43Å; L146-A149 PolarHBondContact O-N 2.99Å; A149-R152 PolarHBondContact O-N 3.43Å; A149-E153 WeakPolarHBondContact O-CG 3.32Å
150F98.6Very high97.1Very high0 Ų026.8 Ų26.80%014%0.142CC..Hα-helixtrans-62.8-49.9177.8-172.1-113.5000112.7I111 I114 A115 I118 A128 L131 L132 L146 S147 V148 R152 E153 C154I111-F150 HydrophobicContact CD1-CB 3.96Å; I111-F150 HydrophobicContact CD1-CD2 3.99Å; I111-F150 HydrophobicContact CD1-CG 4.07Å; I111-F150 HydrophobicContact CG1-CB 4.33Å; I111-F150 HydrophobicContact CG1-CD2 3.55Å; I111-F150 HydrophobicContact CG1-CE2 4.05Å; I111-F150 HydrophobicContact CG1-CG 4.16Å; I111-F150 WeakPolarHBondContact O-CD2 3.38Å; I114-F150 HydrophobicContact CB-CE2 4.42Å; I114-F150 HydrophobicContact CG2-CE2 4.18Å; A115-F150 HydrophobicContact CB-CD2 3.56Å; A115-F150 HydrophobicContact CB-CE2 3.65Å; A115-F150 HydrophobicContact CB-CG 4.46Å; I118-F150 HydrophobicContact CD1-CE2 4.44Å; I118-F150 HydrophobicContact CD1-CZ 3.78Å; A128-F150 HydrophobicContact CB-CE1 3.59Å; A128-F150 HydrophobicContact CB-CZ 3.73Å; L131-F150 HydrophobicContact CD1-CE2 4.17Å; L131-F150 HydrophobicContact CD1-CZ 3.96Å; L132-F150 HydrophobicContact CD1-CD1 4.03Å; L132-F150 HydrophobicContact CD1-CE1 4.06Å; L132-F150 HydrophobicContact CD2-CD1 3.92Å; L132-F150 HydrophobicContact CG-CD1 3.83Å; L132-F150 HydrophobicContact CG-CE1 4.05Å; L146-F150 WeakPolarHBondContact O-CB 3.49Å; L146-F150 PolarHBondContact O-N 3.23Å; S147-F150 PolarHBondContact O-N 3.38Å; V148-F150 VanDerWaalsContact C-N 3.33Å; V148-F150 PolarHBondContact O-N 3.06Å; F150-R152 VanDerWaalsContact C-N 3.29Å; F150-R152 PolarHBondContact O-N 2.9Å; F150-E153 PolarHBondContact O-N 3.38Å; F150-E153 VanDerWaalsContact O-N 3.14Å; F150-C154 PolarHBondContact O-N 3.3Å; F150-C154 PolarHBondContact O-SG 2.7Å; F150-C154 VanDerWaalsContact O-SG 3.38Å
151L98.6Very high97.2Very high0 Ų026.5 Ų26.50%014%0.138CC..Hα-helixtrans-66.2-28.4-179.1-76172000113.4L132 S147 V148 E153 G155 M166 I169 L173 L193 F201L132-L151 HydrophobicContact CD1-CD2 3.68Å; L132-L151 HydrophobicContact CD1-CG 4.22Å; L132-L151 HydrophobicContact CD2-CD1 3.97Å; L132-L151 HydrophobicContact CD2-CD2 4.24Å; L132-L151 HydrophobicContact CD2-CG 3.82Å; S147-L151 WeakPolarHBondContact O-CB 3.34Å; S147-L151 WeakPolarHBondContact O-CG 3.27Å; S147-L151 PolarHBondContact O-N 3.45Å; V148-L151 PolarHBondContact O-N 2.94Å; L151-E153 VanDerWaalsContact C-N 3.32Å; L151-G155 WeakPolarHBondContact O-CA 3.45Å; L151-G155 PolarHBondContact O-N 3.38Å; L151-M166 HydrophobicContact CD2-CE 3.55Å; L151-M166 HydrophobicContact CD2-SD 4.07Å; L151-I169 HydrophobicContact CD1-CG2 3.93Å; L151-L173 HydrophobicContact CD1-CD1 3.79Å; L151-L193 HydrophobicContact CB-CD1 3.93Å; L151-L193 HydrophobicContact CB-CD2 3.99Å; L151-L193 HydrophobicContact CD1-CD2 3.68Å; L151-L193 HydrophobicContact CG-CD2 4.5Å; L151-F201 WeakPolarHBondContact O-CE1 3.33Å
152R97.9Very high97.2Very high82 Ų8225 Ų2531%0.30913%0.132SC..Hα-helixtrans-62-42172.7-78.2178.3-176.2-158.14111.6V148 A149 F150 L193 I196 N204V148-R152 HydrophobicContact CG1-CG 4.45Å; V148-R152 VanDerWaalsContact O-CG 3.28Å; V148-R152 WeakPolarHBondContact O-CG 3.48Å; V148-R152 PolarHBondContact O-N 3.46Å; A149-R152 PolarHBondContact O-N 3.43Å; F150-R152 VanDerWaalsContact C-N 3.29Å; F150-R152 PolarHBondContact O-N 2.9Å; R152-L193 HydrophobicContact CG-CD1 4.19Å; R152-I196 HydrophobicContact CG-CD1 3.91Å; R152-N204 VanDerWaalsContact O-CB 3.31Å; R152-N204 WeakPolarHBondContact O-CB 3.46Å
153E97.8Very high97.4Very high42 Ų4225.8 Ų25.820%0.19614%0.14CC..Hα-helixtrans-79.3-44.1-176.5-50.3-59.6170.200112K112 A115 H116 N119 A149 F150 L151K112-E153 HydrophobicContact CB-CG 4.44Å; K112-E153 HydrophobicContact CD-CG 4.49Å; K112-E153 WeakPolarHBondContact CE-OE1 3.44Å; K112-E153 HydrophobicContact CG-CG 4.06Å; K112-E153 IonicContact NZ-OE1 3.88Å; K112-E153 PolarHBondContact NZ-OE1 2.87Å; A115-E153 HydrophobicContact CB-CB 3.66Å; A115-E153 HydrophobicContact CB-CG 4.4Å; H116-E153 IonicContact CE1-OE2 2.72Å; H116-E153 PolarHBondContact CE1-OE2 3Å; H116-E153 IonicContact NE2-OE2 3.94Å; N119-E153 PolarHBondContact ND2-O 2.87Å; A149-E153 WeakPolarHBondContact O-CG 3.32Å; F150-E153 PolarHBondContact O-N 3.38Å; F150-E153 VanDerWaalsContact O-N 3.14Å; L151-E153 VanDerWaalsContact C-N 3.32Å
154C98.4Very high97.4Very high0 Ų031.4 Ų31.40%017%0.173CC..Hα-helixtrans-111-0.8-174.271.90000116.4A115 N119 F150 A156 K157 M158A115-C154 HydrophobicContact CB-CB 3.86Å; A115-C154 WeakPolarHBondContact O-CB 3.48Å; N119-C154 WeakPolarHBondContact OD1-CA 3.27Å; N119-C154 WeakPolarHBondContact OD1-CB 3.3Å; F150-C154 PolarHBondContact O-N 3.3Å; F150-C154 PolarHBondContact O-SG 2.7Å; F150-C154 VanDerWaalsContact O-SG 3.38Å; C154-A156 PolarHBondContact O-N 2.66Å; C154-K157 PolarHBondContact O-N 2.75Å; C154-M158 HydrophobicContact CB-CG 4.37Å; C154-M158 WeakPolarHBondContact O-CB 3.17Å; C154-M158 VanDerWaalsContact O-CG 3.28Å; C154-M158 WeakPolarHBondContact O-CG 3.41Å; C154-M158 PolarHBondContact O-N 3.44Å
155G98.4Very high97.4Very high0 Ų032.1 Ų32.10%018%0.181CC..Hα-helixtrans-61.6-30.7-173.300000114L151 S159L151-G155 WeakPolarHBondContact O-CA 3.45Å; L151-G155 PolarHBondContact O-N 3.38Å; G155-S159 VanDerWaalsContact O-CB 3.32Å; G155-S159 WeakPolarHBondContact O-CB 3.46Å; G155-S159 PolarHBondContact O-N 3.35Å; G155-S159 PolarHBondContact O-OG 2.96Å
156A98.3Very high97.4Very high11 Ų1130.4 Ų30.49%0.09117%0.173CC..Hα-helixtrans-63.2-53.2173.900000111.8C154 M158 S159 N160 F201 P206C154-A156 PolarHBondContact O-N 2.66Å; A156-M158 PolarHBondContact O-N 2.93Å; A156-S159 PolarHBondContact O-N 3.16Å; A156-N160 PolarHBondContact O-N 2.81Å; A156-F201 HydrophobicContact CB-CB 3.64Å; A156-F201 HydrophobicContact CB-CD2 4.21Å; A156-F201 HydrophobicContact CB-CG 3.91Å; A156-P206 HydrophobicContact CB-CG 3.67Å
157K98.1Very high97.4Very high32 Ų3233.7 Ų33.714%0.13919%0.191CC..Hα-helixtrans-62.5-45.9178.7-169.272.2173.3-170.40110.8N119 C154 S159 N160 L161 P206N119-K157 VanDerWaalsContact OD1-CB 3.27Å; N119-K157 WeakPolarHBondContact OD1-CB 3.35Å; C154-K157 PolarHBondContact O-N 2.75Å; K157-S159 VanDerWaalsContact C-N 3.27Å; K157-S159 PolarHBondContact O-N 3.17Å; K157-N160 WeakPolarHBondContact O-CB 3.29Å; K157-N160 PolarHBondContact O-N 3.41Å; K157-L161 HydrophobicContact CD-CD1 4.35Å; K157-L161 HydrophobicContact CG-CD1 3.74Å; K157-L161 HydrophobicContact CG-CG 4.17Å; K157-L161 PolarHBondContact O-N 3.12Å; K157-P206 HydrophobicContact CB-CB 4.05Å; K157-P206 HydrophobicContact CB-CG 4.22Å; K157-P206 HydrophobicContact CD-CB 4.23Å
158M98.2Very high97.4Very high0 Ų036.6 Ų36.60%021%0.214CC..Hα-helixtrans-61.7-34.3179.3-70.3-61.8-59.900112.9I118 E125 A128 L129 C154 A156 N160 L161 S162 M166I118-M158 HydrophobicContact CG2-SD 3.86Å; E125-M158 HydrophobicContact CB-CE 3.88Å; E125-M158 HydrophobicContact CB-SD 3.58Å; E125-M158 VanDerWaalsContact CB-SD 3.58Å; E125-M158 WeakPolarHBondContact O-CE 3.29Å; A128-M158 HydrophobicContact CB-CE 3.51Å; A128-M158 HydrophobicContact CB-CG 4.25Å; A128-M158 HydrophobicContact CB-SD 3.44Å; A128-M158 WeakPolarHBondContact CB-SD 3.48Å; L129-M158 HydrophobicContact CD2-CE 3.87Å; L129-M158 HydrophobicContact CG-CE 3.97Å; C154-M158 HydrophobicContact CB-CG 4.37Å; C154-M158 WeakPolarHBondContact O-CB 3.17Å; C154-M158 VanDerWaalsContact O-CG 3.28Å; C154-M158 WeakPolarHBondContact O-CG 3.41Å; C154-M158 PolarHBondContact O-N 3.44Å; A156-M158 PolarHBondContact O-N 2.93Å; M158-N160 PolarHBondContact O-N 3.2Å; M158-L161 PolarHBondContact O-N 3.33Å; M158-S162 CarbonylContact O-C 3.54Å; M158-S162 PolarHBondContact O-N 3.15Å; M158-M166 HydrophobicContact CB-CE 4.08Å; M158-M166 HydrophobicContact CB-CG 3.8Å; M158-M166 HydrophobicContact CB-SD 3.49Å; M158-M166 WeakPolarHBondContact CB-SD 3.25Å; M158-M166 HydrophobicContact CE-SD 4.44Å; M158-M166 HydrophobicContact CG-SD 4.38Å; M158-M166 WeakPolarHBondContact O-CG 3.49Å
159S97.6Very high97.5Very high34 Ų3437 Ų3724%0.23822%0.216CC..Hα-helixtrans-66.2-25.8176-62.40000112.6G155 A156 K157 P163G155-S159 VanDerWaalsContact O-CB 3.32Å; G155-S159 WeakPolarHBondContact O-CB 3.46Å; G155-S159 PolarHBondContact O-N 3.35Å; G155-S159 PolarHBondContact O-OG 2.96Å; A156-S159 PolarHBondContact O-N 3.16Å; K157-S159 VanDerWaalsContact C-N 3.27Å; K157-S159 PolarHBondContact O-N 3.17Å; S159-P163 WeakPolarHBondContact O-CG 3.26Å
160N95.7Very high97.5Very high124 Ų12436.2 Ų36.266%0.66321%0.21SC*.Hα-helixtrans-85.2-45.7175.3-63.5-17.2000111.5A156 K157 M158A156-N160 PolarHBondContact O-N 2.81Å; K157-N160 WeakPolarHBondContact O-CB 3.29Å; K157-N160 PolarHBondContact O-N 3.41Å; M158-N160 PolarHBondContact O-N 3.2Å
161L95.1Very high97.5Very high61 Ų6140 Ų4032%0.31923%0.23SC..Hα-helixtrans-74.8-41.2-176.1-64.2-180000113.1E125 K157 M158E125-L161 HydrophobicContact CB-CB 4.18Å; E125-L161 HydrophobicContact CB-CD1 4.03Å; E125-L161 HydrophobicContact CG-CB 4.03Å; E125-L161 HydrophobicContact CG-CD1 4.47Å; K157-L161 HydrophobicContact CD-CD1 4.35Å; K157-L161 HydrophobicContact CG-CD1 3.74Å; K157-L161 HydrophobicContact CG-CG 4.17Å; K157-L161 PolarHBondContact O-N 3.12Å; M158-L161 PolarHBondContact O-N 3.33Å
162S95.7Very high97.4Very high24 Ų2444.3 Ų44.317%0.16825%0.246CC..  trans-136.272.8-177.7-165.90000112.6M158 V164 G165 M166M158-S162 CarbonylContact O-C 3.54Å; M158-S162 PolarHBondContact O-N 3.15Å; S162-V164 VanDerWaalsContact C-N 3.28Å; S162-V164 PolarHBondContact O-N 3.08Å; S162-G165 PolarHBondContact O-N 3.33Å; S162-G165 PolarHBondContact OG-N 3.47Å; S162-M166 WeakPolarHBondContact O-CB 3.39Å; S162-M166 VanDerWaalsContact O-CG 3.3Å; S162-M166 WeakPolarHBondContact O-CG 3.46Å; S162-M166 PolarHBondContact O-N 3.25Å
163P96.4Very high97.4Very high68 Ų6840.4 Ų40.444%0.44223%0.232SC..Hα-helixtrans-58-39.4-179.6-22.330.7000113.2S159 N167S159-P163 WeakPolarHBondContact O-CG 3.26Å; P163-N167 PolarHBondContact O-N 2.94Å; P163-N167 PolarHBondContact O-ND2 3.14Å
164V97.1Very high97.4Very high119 Ų11943.1 Ų43.172%0.72124%0.24SC*.Hα-helixtrans-69.5-47-180179.40000111.2S162 M166 N167 A168S162-V164 VanDerWaalsContact C-N 3.28Å; S162-V164 PolarHBondContact O-N 3.08Å; V164-M166 VanDerWaalsContact C-N 3.3Å; V164-M166 PolarHBondContact O-N 2.96Å; V164-N167 PolarHBondContact O-N 3.42Å; V164-A168 PolarHBondContact O-N 3.01Å; V164-A168 VanDerWaalsContact O-N 3.13Å
165G95.2Very high97.3Very high15 Ų1545.1 Ų45.116%0.15525%0.254CS..Hα-helixtrans-59.6-43.9176.100000111.2S162 N167 A168 I169S162-G165 PolarHBondContact O-N 3.33Å; S162-G165 PolarHBondContact OG-N 3.47Å; G165-N167 PolarHBondContact O-N 2.96Å; G165-A168 PolarHBondContact O-N 2.72Å; G165-I169 WeakPolarHBondContact O-CG1 3.34Å; G165-I169 PolarHBondContact O-N 3.3Å
166M97.8Very high97.2Very high1 Ų145.1 Ų45.11%0.00525%0.254CS..Hα-helixtrans-63.2-40176-73.9-57.6-73.500113.5L151 M158 S162 V164 A168 I169 F170L151-M166 HydrophobicContact CD2-CE 3.55Å; L151-M166 HydrophobicContact CD2-SD 4.07Å; M158-M166 HydrophobicContact CB-CE 4.08Å; M158-M166 HydrophobicContact CB-CG 3.8Å; M158-M166 HydrophobicContact CB-SD 3.49Å; M158-M166 WeakPolarHBondContact CB-SD 3.25Å; M158-M166 HydrophobicContact CE-SD 4.44Å; M158-M166 HydrophobicContact CG-SD 4.38Å; M158-M166 WeakPolarHBondContact O-CG 3.49Å; S162-M166 WeakPolarHBondContact O-CB 3.39Å; S162-M166 VanDerWaalsContact O-CG 3.3Å; S162-M166 WeakPolarHBondContact O-CG 3.46Å; S162-M166 PolarHBondContact O-N 3.25Å; V164-M166 VanDerWaalsContact C-N 3.3Å; V164-M166 PolarHBondContact O-N 2.96Å; M166-A168 VanDerWaalsContact C-N 3.33Å; M166-A168 PolarHBondContact O-N 2.87Å; M166-I169 PolarHBondContact O-N 3.4Å; M166-F170 HydrophobicContact CE-CD2 4.19Å; M166-F170 HydrophobicContact CE-CE2 3.63Å; M166-F170 WeakPolarHBondContact O-CD2 3.36Å; M166-F170 PolarHBondContact O-N 3.13Å
167N98Very high97.1Very high76 Ų7646 Ų4641%0.40626%0.257SS..Hα-helixtrans-57.9-47173.8-75.1-28.7000111.4P163 V164 G165 I169 F170 D171 R197P163-N167 PolarHBondContact O-N 2.94Å; P163-N167 PolarHBondContact O-ND2 3.14Å; V164-N167 PolarHBondContact O-N 3.42Å; G165-N167 PolarHBondContact O-N 2.96Å; N167-I169 PolarHBondContact O-N 3.42Å; N167-F170 PolarHBondContact O-N 3.49Å; N167-D171 VanDerWaalsContact O-CG 3.26Å; N167-D171 PolarHBondContact O-N 3.28Å; N167-R197 PolarHBondContact OD1-NH2 3.34Å
168A98.1Very high96.9Very high60 Ų6051.2 Ų51.250%0.49628%0.282SS..Hα-helixtrans-61.1-42.5178.600000112.9V164 G165 M166 F170 D171 R172V164-A168 PolarHBondContact O-N 3.01Å; V164-A168 VanDerWaalsContact O-N 3.13Å; G165-A168 PolarHBondContact O-N 2.72Å; M166-A168 VanDerWaalsContact C-N 3.33Å; M166-A168 PolarHBondContact O-N 2.87Å; A168-F170 PolarHBondContact O-N 3Å; A168-D171 PolarHBondContact O-N 2.64Å; A168-R172 PolarHBondContact O-N 2.81Å
169I98.4Very high96.5Very high11 Ų1158.5 Ų58.56%0.05632%0.316CS..Hα-helixtrans-61.5-45.1176.6-66.9-53.1000111.6L129 L132 L136 L151 G165 M166 N167 R172 L173L129-I169 HydrophobicContact CD2-CG1 4.44Å; L132-I169 HydrophobicContact CB-CD1 3.63Å; L132-I169 HydrophobicContact CB-CG1 4.09Å; L132-I169 HydrophobicContact CB-CG2 4.43Å; L132-I169 HydrophobicContact CD1-CG1 4.18Å; L132-I169 HydrophobicContact CD1-CG2 4.23Å; L132-I169 HydrophobicContact CD2-CG2 4.37Å; L136-I169 HydrophobicContact CD1-CG2 3.92Å; L151-I169 HydrophobicContact CD1-CG2 3.93Å; G165-I169 WeakPolarHBondContact O-CG1 3.34Å; G165-I169 PolarHBondContact O-N 3.3Å; M166-I169 PolarHBondContact O-N 3.4Å; N167-I169 PolarHBondContact O-N 3.42Å; I169-R172 WeakPolarHBondContact O-CB 3.32Å; I169-R172 PolarHBondContact O-N 3.49Å; I169-L173 HydrophobicContact CG2-CD1 4.29Å; I169-L173 WeakPolarHBondContact O-CG 3.36Å; I169-L173 PolarHBondContact O-N 2.87Å
170F98.4Very high95.7Very high0 Ų058.3 Ų58.30%032%0.316CS..Hα-helixtrans-71.7-30.6179.1-88.5-83.8000113.3M166 N167 A168 R172 L173 R174 L193 F194 R197 F201M166-F170 HydrophobicContact CE-CD2 4.19Å; M166-F170 HydrophobicContact CE-CE2 3.63Å; M166-F170 WeakPolarHBondContact O-CD2 3.36Å; M166-F170 PolarHBondContact O-N 3.13Å; N167-F170 PolarHBondContact O-N 3.49Å; A168-F170 PolarHBondContact O-N 3Å; F170-R172 VanDerWaalsContact C-N 3.33Å; F170-L173 HydrophobicContact CD1-CD1 4.29Å; F170-L173 PolarHBondContact O-N 3.19Å; F170-R174 PolarHBondContact O-N 3.06Å; F170-L193 HydrophobicContact CE1-CD2 4.2Å; F170-L193 HydrophobicContact CE1-CG 3.98Å; F170-L193 HydrophobicContact CZ-CD2 4.33Å; F170-L193 HydrophobicContact CZ-CG 4.11Å; F170-F194 HydrophobicContact CB-CE1 4.44Å; F170-F194 HydrophobicContact CD1-CD1 4.03Å; F170-F194 AromaticContact CD1-CE1 3.71Å; F170-F194 HydrophobicContact CD1-CE1 3.71Å; F170-F194 HydrophobicContact CD1-CZ 4.02Å; F170-F194 HydrophobicContact CE1-CD1 4.45Å; F170-F194 WeakPolarHBondContact O-CZ 3.36Å; F170-R197 HydrophobicContact CE1-CB 3.88Å; F170-R197 HydrophobicContact CE1-CG 4.23Å; F170-R197 HydrophobicContact CE2-CB 4.48Å; F170-R197 HydrophobicContact CE2-CG 4.18Å; F170-R197 HydrophobicContact CZ-CB 3.74Å; F170-R197 HydrophobicContact CZ-CG 3.93Å; F170-F201 HydrophobicContact CZ-CZ 4.4Å
171D98.1Very high95.3Very high80 Ų8062.3 Ų62.343%0.42833%0.331SS..Hα-helixtrans-64.6-41.2170.7-70.2-19.7000110.6N167 A168 R174 S175N167-D171 VanDerWaalsContact O-CG 3.26Å; N167-D171 PolarHBondContact O-N 3.28Å; A168-D171 PolarHBondContact O-N 2.64Å; D171-R174 WeakPolarHBondContact O-CB 3.33Å; D171-R174 PolarHBondContact O-N 2.86Å; D171-R174 IonicContact OD1-CZ 3.9Å; D171-R174 IonicContact OD1-NH1 2.9Å; D171-R174 PolarHBondContact OD1-NH1 3.43Å; D171-R174 IonicContact OD1-NH2 3.77Å; D171-S175 PolarHBondContact O-N 3.38Å
172R97.4Very high95.1Very high91 Ų9160 Ų6034%0.34332%0.319SS..Hα-helixtrans-61.2-45.1173179.956.5177.7160.4-3.8112.4L136 E137 A168 I169 F170 R174 S175 I176L136-R172 HydrophobicContact CB-CG 3.94Å; L136-R172 HydrophobicContact CD1-CG 4.37Å; L136-R172 PolarHBondContact O-NE 3.03Å; L136-R172 PolarHBondContact O-NH2 2.89Å; L136-R172 VanDerWaalsContact O-NH2 3.11Å; E137-R172 PolarHBondContact O-NH2 3.3Å; A168-R172 PolarHBondContact O-N 2.81Å; I169-R172 WeakPolarHBondContact O-CB 3.32Å; I169-R172 PolarHBondContact O-N 3.49Å; F170-R172 VanDerWaalsContact C-N 3.33Å; R172-R174 VanDerWaalsContact C-N 3.27Å; R172-R174 PolarHBondContact O-N 3.41Å; R172-S175 PolarHBondContact O-N 3.43Å; R172-I176 HydrophobicContact CG-CD1 4.04Å; R172-I176 WeakPolarHBondContact O-CG1 3.48Å; R172-I176 PolarHBondContact O-N 3.24Å
173L98Very high95.1Very high0 Ų061 Ų610%032%0.323CS..Hα-helixtrans-60.5-35.8175.3-73.7168.8000112.3L136 V144 L151 I169 F170 I176 L177 I190 L193 F194L136-L173 HydrophobicContact CD1-CD2 4.07Å; L136-L173 HydrophobicContact CD1-CG 4.08Å; L136-L173 HydrophobicContact CD2-CD2 3.78Å; V144-L173 HydrophobicContact CG1-CD2 4.48Å; L151-L173 HydrophobicContact CD1-CD1 3.79Å; I169-L173 HydrophobicContact CG2-CD1 4.29Å; I169-L173 WeakPolarHBondContact O-CG 3.36Å; I169-L173 PolarHBondContact O-N 2.87Å; F170-L173 HydrophobicContact CD1-CD1 4.29Å; F170-L173 PolarHBondContact O-N 3.19Å; L173-I176 PolarHBondContact O-N 3.28Å; L173-L177 WeakPolarHBondContact O-CB 3.43Å; L173-L177 PolarHBondContact O-N 3.29Å; L173-I190 HydrophobicContact CB-CG2 4.34Å; L173-I190 HydrophobicContact CD2-CG1 4.41Å; L173-L193 HydrophobicContact CD1-CD2 3.82Å; L173-F194 HydrophobicContact CB-CE2 4.36Å; L173-F194 HydrophobicContact CB-CZ 4.47Å
174R97.7Very high95Very high99 Ų9962.7 Ų62.737%0.37433%0.333SS..Hα-helixtrans-65-44.2174.6-167.8179.5-60.6106.31.4111.9F170 D171 R172 I176 L177 H178 F194F170-R174 PolarHBondContact O-N 3.06Å; D171-R174 WeakPolarHBondContact O-CB 3.33Å; D171-R174 PolarHBondContact O-N 2.86Å; D171-R174 IonicContact OD1-CZ 3.9Å; D171-R174 IonicContact OD1-NH1 2.9Å; D171-R174 PolarHBondContact OD1-NH1 3.43Å; D171-R174 IonicContact OD1-NH2 3.77Å; R172-R174 VanDerWaalsContact C-N 3.27Å; R172-R174 PolarHBondContact O-N 3.41Å; R174-I176 VanDerWaalsContact C-N 3.33Å; R174-L177 PolarHBondContact O-N 3.19Å; R174-H178 PolarHBondContact O-N 2.92Å; R174-F194 HydrophobicContact CB-CZ 3.97Å
175S96.7Very high95Very high41 Ų4161.8 Ų61.829%0.28732%0.317SS..Hα-helixtrans-60.9-43.2174.4-67.10000111.4D171 R172 L177 H178 E179D171-S175 PolarHBondContact O-N 3.38Å; R172-S175 PolarHBondContact O-N 3.43Å; S175-L177 VanDerWaalsContact C-N 3.34Å; S175-L177 PolarHBondContact O-N 3.18Å; S175-H178 PolarHBondContact O-N 3.22Å; S175-E179 VanDerWaalsContact O-CB 3.25Å; S175-E179 WeakPolarHBondContact O-CB 3.45Å; S175-E179 PolarHBondContact O-N 3.22Å
176I96.3Very high95Very high1 Ų161.1 Ų61.11%0.00531%0.31CS..Hα-helixtrans-59.9-44.5176.7-66.9165.1000111L136 P139 V144 R172 L173 R174 H178 A180 V182 I190L136-I176 HydrophobicContact CB-CD1 4.26Å; L136-I176 HydrophobicContact CD2-CD1 3.77Å; P139-I176 HydrophobicContact CB-CD1 3.8Å; P139-I176 HydrophobicContact CB-CG1 3.99Å; P139-I176 HydrophobicContact CB-CG2 4.07Å; P139-I176 HydrophobicContact CG-CD1 4.28Å; P139-I176 HydrophobicContact CG-CG1 4.04Å; V144-I176 HydrophobicContact CG2-CG2 4.13Å; R172-I176 HydrophobicContact CG-CD1 4.04Å; R172-I176 WeakPolarHBondContact O-CG1 3.48Å; R172-I176 PolarHBondContact O-N 3.24Å; L173-I176 PolarHBondContact O-N 3.28Å; R174-I176 VanDerWaalsContact C-N 3.33Å; I176-H178 VanDerWaalsContact C-N 3.27Å; I176-H178 PolarHBondContact O-N 3.38Å; I176-A180 HydrophobicContact CB-CB 4.42Å; I176-A180 HydrophobicContact CG2-CB 3.95Å; I176-A180 VanDerWaalsContact O-CB 3.26Å; I176-A180 WeakPolarHBondContact O-CB 3.35Å; I176-A180 PolarHBondContact O-N 3.29Å; I176-A180 VanDerWaalsContact O-N 3.11Å; I176-V182 HydrophobicContact CG2-CG1 3.98Å; I176-V182 HydrophobicContact CG2-CG2 4.43Å; I176-I190 HydrophobicContact CG2-CD1 4.11Å
177L95.4Very high94.9Very high30 Ų3064.3 Ų64.316%0.15733%0.325CS..Hα-helixtrans-60.3-34179.7-177.862.6000113.3L173 R174 S175 Q187 I190 E191L173-L177 WeakPolarHBondContact O-CB 3.43Å; L173-L177 PolarHBondContact O-N 3.29Å; R174-L177 PolarHBondContact O-N 3.19Å; S175-L177 VanDerWaalsContact C-N 3.34Å; S175-L177 PolarHBondContact O-N 3.18Å; L177-Q187 HydrophobicContact CD1-CB 3.73Å; L177-Q187 HydrophobicContact CD1-CG 3.98Å; L177-I190 HydrophobicContact CB-CD1 4.27Å; L177-I190 HydrophobicContact CB-CG2 4.22Å; L177-I190 HydrophobicContact CD1-CB 4.38Å; L177-I190 HydrophobicContact CD1-CD1 4.41Å; L177-I190 HydrophobicContact CD1-CG2 4.49Å; L177-I190 HydrophobicContact CD2-CG2 4.19Å; L177-E191 HydrophobicContact CD1-CG 4.42Å; L177-E191 HydrophobicContact CD2-CG 4.18Å
178H93.2Very high94.9Very high141 Ų14166.9 Ų66.965%0.65333%0.333SS*.Hα-helixtrans-97.8-32-175.5-64.6167.5000114.3R174 S175 I176R174-H178 PolarHBondContact O-N 2.92Å; S175-H178 PolarHBondContact O-N 3.22Å; I176-H178 VanDerWaalsContact C-N 3.27Å; I176-H178 PolarHBondContact O-N 3.38Å
179E90.6Very high94.9Very high153 Ų15365.2 Ų65.272%0.71532%0.315SS*.Hα-helixtrans-113.9-22.4-166.4-58.5171.4-169.500113.2S175S175-E179 VanDerWaalsContact O-CB 3.25Å; S175-E179 WeakPolarHBondContact O-CB 3.45Å; S175-E179 PolarHBondContact O-N 3.22Å
180A81.5Confident94.9Very high30 Ų3064.7 Ų64.725%0.24831%0.312CS..SBendtrans-90.6147.5-177.500000112.2P139 I176 V182P139-A180 HydrophobicContact CG-CB 4.35Å; I176-A180 HydrophobicContact CB-CB 4.42Å; I176-A180 HydrophobicContact CG2-CB 3.95Å; I176-A180 VanDerWaalsContact O-CB 3.26Å; I176-A180 WeakPolarHBondContact O-CB 3.35Å; I176-A180 PolarHBondContact O-N 3.29Å; I176-A180 VanDerWaalsContact O-N 3.11Å; A180-V182 HydrophobicContact CB-CG1 4.18Å; A180-V182 PolarHBondContact O-N 2.73Å
181E86.9Confident94.9Very high207 Ų20769.7 Ų69.797%0.96734%0.336SS*.  trans-79.160.6171.9-65-174.5169.200111.2
182V90.6Very high94.9Very high13 Ų1367.9 Ų67.98%0.07933%0.328CS..  trans-90.6151.7173.9-69.30000111.6I176 A180 V186 Q187I176-V182 HydrophobicContact CG2-CG1 3.98Å; I176-V182 HydrophobicContact CG2-CG2 4.43Å; A180-V182 HydrophobicContact CB-CG1 4.18Å; A180-V182 PolarHBondContact O-N 2.73Å; V182-V186 HydrophobicContact CB-CB 4.18Å; V182-V186 HydrophobicContact CB-CG1 3.9Å; V182-V186 HydrophobicContact CG1-CG1 4.17Å; V182-V186 HydrophobicContact CG2-CG1 4.23Å; V182-Q187 HydrophobicContact CG2-CG 3.81Å; V182-Q187 PolarHBondContact O-NE2 2.91Å
183D94.8Very high94.9Very high46 Ų4663.6 Ų63.625%0.24631%0.311CS..  trans-64.5157.8-179.583.721.2000112.4D141 R185 V186 Q187D141-D183 PolarHBondContact OD1-N 2.78Å; D183-R185 PolarHBondContact O-N 2.9Å; D183-R185 VanDerWaalsContact O-N 3.14Å; D183-R185 VanDerWaalsContact OD1-CA 3.31Å; D183-R185 WeakPolarHBondContact OD1-CA 3.37Å; D183-R185 VanDerWaalsContact OD1-CB 3.23Å; D183-R185 WeakPolarHBondContact OD1-CB 3.46Å; D183-R185 PolarHBondContact OD1-N 3.17Å; D183-R185 IonicContact OD1-NE 2.66Å; D183-R185 IonicContact OD2-NE 2.78Å; D183-R185 PolarHBondContact OD2-NE 2.96Å; D183-R185 IonicContact OD2-NH2 2.69Å; D183-V186 PolarHBondContact O-N 3.42Å; D183-V186 VanDerWaalsContact O-N 3.15Å; D183-V186 WeakPolarHBondContact OD1-CB 3.3Å; D183-V186 VanDerWaalsContact OD1-CG2 3.27Å; D183-V186 WeakPolarHBondContact OD1-CG2 3.37Å; D183-V186 PolarHBondContact OD1-N 3.12Å; D183-Q187 WeakPolarHBondContact O-CG 3.44Å; D183-Q187 PolarHBondContact O-N 3Å; D183-Q187 VanDerWaalsContact O-N 3.07Å
184P95.2Very high94.9Very high102 Ų10265.9 Ų65.966%0.66232%0.321SS*.Hα-helixtrans-59.8-25.3179.2-26.735.5000114.7F188P184-F188 WeakPolarHBondContact O-CB 3.48Å; P184-F188 PolarHBondContact O-N 3.49Å; P184-F188 VanDerWaalsContact O-N 3.08Å
185R96.1Very high94.9Very high101 Ų10165.3 Ų65.338%0.38132%0.323SS..Hα-helixtrans-73.1-38.8179.3172.5-162.972.492.5-0.4110.1E145 D183 F188 M189E145-R185 IonicContact OE1-NH1 3.49Å; E145-R185 IonicContact OE2-CZ 3.53Å; E145-R185 VanDerWaalsContact OE2-CZ 3.3Å; E145-R185 IonicContact OE2-NH1 2.83Å; E145-R185 PolarHBondContact OE2-NH1 2.98Å; E145-R185 IonicContact OE2-NH2 3.77Å; E145-R185 PolarHBondContact OE2-NH2 2.95Å; D183-R185 PolarHBondContact O-N 2.9Å; D183-R185 VanDerWaalsContact O-N 3.14Å; D183-R185 VanDerWaalsContact OD1-CA 3.31Å; D183-R185 WeakPolarHBondContact OD1-CA 3.37Å; D183-R185 VanDerWaalsContact OD1-CB 3.23Å; D183-R185 WeakPolarHBondContact OD1-CB 3.46Å; D183-R185 PolarHBondContact OD1-N 3.17Å; D183-R185 IonicContact OD1-NE 2.66Å; D183-R185 IonicContact OD2-NE 2.78Å; D183-R185 PolarHBondContact OD2-NE 2.96Å; D183-R185 IonicContact OD2-NH2 2.69Å; R185-F188 PolarHBondContact O-N 2.92Å; R185-M189 HydrophobicContact CG-CE 4.43Å; R185-M189 VanDerWaalsContact NH1-CE 3.27Å; R185-M189 WeakPolarHBondContact O-CG 3.33Å; R185-M189 PolarHBondContact O-N 2.96Å
186V95.6Very high95Very high0 Ų064.6 Ų64.60%032%0.316CS..Hα-helixtrans-69.5-42175.6173.30000110.7D141 V144 V182 D183 F188 M189 I190D141-V186 HydrophobicContact CB-CG2 3.7Å; V144-V186 HydrophobicContact CB-CG1 3.65Å; V144-V186 HydrophobicContact CG1-CG1 3.38Å; V144-V186 HydrophobicContact CG2-CG1 4.24Å; V182-V186 HydrophobicContact CB-CB 4.18Å; V182-V186 HydrophobicContact CB-CG1 3.9Å; V182-V186 HydrophobicContact CG1-CG1 4.17Å; V182-V186 HydrophobicContact CG2-CG1 4.23Å; D183-V186 PolarHBondContact O-N 3.42Å; D183-V186 VanDerWaalsContact O-N 3.15Å; D183-V186 WeakPolarHBondContact OD1-CB 3.3Å; D183-V186 VanDerWaalsContact OD1-CG2 3.27Å; D183-V186 WeakPolarHBondContact OD1-CG2 3.37Å; D183-V186 PolarHBondContact OD1-N 3.12Å; V186-F188 VanDerWaalsContact C-N 3.32Å; V186-F188 PolarHBondContact O-N 3.46Å; V186-M189 HydrophobicContact CB-CE 4.12Å; V186-M189 HydrophobicContact CG2-CE 3.58Å; V186-M189 WeakPolarHBondContact O-CB 3.47Å; V186-M189 PolarHBondContact O-N 3.27Å; V186-M189 VanDerWaalsContact O-N 3.14Å; V186-I190 HydrophobicContact CG1-CD1 4.29Å; V186-I190 WeakPolarHBondContact O-CG1 3.37Å; V186-I190 PolarHBondContact O-N 3.07Å
187Q96.5Very high95.1Very high68 Ų6867.6 Ų67.632%0.31833%0.327SS..Hα-helixtrans-54.2-50.5171-65.5177.4-7.200110.9L177 V182 D183 M189 I190 E191L177-Q187 HydrophobicContact CD1-CB 3.73Å; L177-Q187 HydrophobicContact CD1-CG 3.98Å; V182-Q187 HydrophobicContact CG2-CG 3.81Å; V182-Q187 PolarHBondContact O-NE2 2.91Å; D183-Q187 WeakPolarHBondContact O-CG 3.44Å; D183-Q187 PolarHBondContact O-N 3Å; D183-Q187 VanDerWaalsContact O-N 3.07Å; Q187-M189 VanDerWaalsContact C-N 3.34Å; Q187-M189 PolarHBondContact O-N 3.49Å; Q187-I190 PolarHBondContact O-N 3.12Å; Q187-E191 WeakPolarHBondContact O-CG 3.44Å; Q187-E191 PolarHBondContact O-N 3.2Å
188F97.4Very high95.2Very high131 Ų13173.7 Ų73.758%0.57535%0.352SS*.Hα-helixtrans-60.2-40.5176.3178.9-104.1000112.8P184 R185 V186 I190 E191 V192P184-F188 WeakPolarHBondContact O-CB 3.48Å; P184-F188 PolarHBondContact O-N 3.49Å; P184-F188 VanDerWaalsContact O-N 3.08Å; R185-F188 PolarHBondContact O-N 2.92Å; V186-F188 VanDerWaalsContact C-N 3.32Å; V186-F188 PolarHBondContact O-N 3.46Å; F188-I190 VanDerWaalsContact C-N 3.33Å; F188-I190 PolarHBondContact O-N 2.88Å; F188-E191 PolarHBondContact O-N 3.45Å; F188-V192 HydrophobicContact CD1-CG2 4.19Å; F188-V192 HydrophobicContact CD2-CG2 4.38Å; F188-V192 HydrophobicContact CE1-CG2 3.74Å; F188-V192 HydrophobicContact CE2-CG2 3.94Å; F188-V192 HydrophobicContact CZ-CG2 3.6Å; F188-V192 WeakPolarHBondContact O-CG2 3.49Å; F188-V192 PolarHBondContact O-N 3.04Å
189M98Very high95.4Very high24 Ų2470.4 Ų70.412%0.11834%0.339CS..Hα-helixtrans-62-39.6176.4-75.8-171.9-64.700112.6E145 V148 R185 V186 Q187 L193E145-M189 HydrophobicContact CB-CE 3.82Å; E145-M189 HydrophobicContact CB-SD 4.37Å; E145-M189 HydrophobicContact CG-CE 3.94Å; E145-M189 HydrophobicContact CG-SD 3.9Å; V148-M189 HydrophobicContact CG1-CB 4.28Å; V148-M189 HydrophobicContact CG2-CB 4.27Å; R185-M189 HydrophobicContact CG-CE 4.43Å; R185-M189 VanDerWaalsContact NH1-CE 3.27Å; R185-M189 WeakPolarHBondContact O-CG 3.33Å; R185-M189 PolarHBondContact O-N 2.96Å; V186-M189 HydrophobicContact CB-CE 4.12Å; V186-M189 HydrophobicContact CG2-CE 3.58Å; V186-M189 WeakPolarHBondContact O-CB 3.47Å; V186-M189 PolarHBondContact O-N 3.27Å; V186-M189 VanDerWaalsContact O-N 3.14Å; Q187-M189 VanDerWaalsContact C-N 3.34Å; Q187-M189 PolarHBondContact O-N 3.49Å; M189-L193 WeakPolarHBondContact O-CB 3.36Å; M189-L193 PolarHBondContact O-N 3.48Å
190I98Very high95.7Very high0 Ų071.7 Ų71.70%034%0.343CS..Hα-helixtrans-65-47.3174.9-64166.8000110.1V144 L173 I176 L177 V186 Q187 F188 V192 L193 F194V144-I190 HydrophobicContact CG1-CD1 3.9Å; V144-I190 HydrophobicContact CG1-CG1 3.81Å; L173-I190 HydrophobicContact CB-CG2 4.34Å; L173-I190 HydrophobicContact CD2-CG1 4.41Å; I176-I190 HydrophobicContact CG2-CD1 4.11Å; L177-I190 HydrophobicContact CB-CD1 4.27Å; L177-I190 HydrophobicContact CB-CG2 4.22Å; L177-I190 HydrophobicContact CD1-CB 4.38Å; L177-I190 HydrophobicContact CD1-CD1 4.41Å; L177-I190 HydrophobicContact CD1-CG2 4.49Å; L177-I190 HydrophobicContact CD2-CG2 4.19Å; V186-I190 HydrophobicContact CG1-CD1 4.29Å; V186-I190 WeakPolarHBondContact O-CG1 3.37Å; V186-I190 PolarHBondContact O-N 3.07Å; Q187-I190 PolarHBondContact O-N 3.12Å; F188-I190 VanDerWaalsContact C-N 3.33Å; F188-I190 PolarHBondContact O-N 2.88Å; I190-V192 PolarHBondContact O-N 3.19Å; I190-L193 WeakPolarHBondContact O-CA 3.45Å; I190-L193 WeakPolarHBondContact O-CB 3.49Å; I190-L193 PolarHBondContact O-N 3.28Å; I190-L193 VanDerWaalsContact O-N 3.08Å; I190-F194 HydrophobicContact CG2-CD2 3.65Å; I190-F194 HydrophobicContact CG2-CE2 3.47Å; I190-F194 VanDerWaalsContact CG2-CE2 3.47Å; I190-F194 VanDerWaalsContact O-CD2 3.31Å; I190-F194 WeakPolarHBondContact O-CD2 3.31Å; I190-F194 PolarHBondContact O-N 3.42Å
191E97.9Very high96.4Very high106 Ų10670.7 Ų70.750%0.49533%0.333SS..Hα-helixtrans-58.5-45.6178.6-71.6176.8175.100112.2L177 Q187 F188 L193 F194 Q195L177-E191 HydrophobicContact CD1-CG 4.42Å; L177-E191 HydrophobicContact CD2-CG 4.18Å; Q187-E191 WeakPolarHBondContact O-CG 3.44Å; Q187-E191 PolarHBondContact O-N 3.2Å; F188-E191 PolarHBondContact O-N 3.45Å; E191-L193 VanDerWaalsContact C-N 3.29Å; E191-L193 PolarHBondContact O-N 3.24Å; E191-F194 WeakPolarHBondContact O-CB 3.3Å; E191-F194 PolarHBondContact O-N 3.05Å; E191-Q195 PolarHBondContact O-N 2.83Å
192V98.2Very high96.8Very high42 Ų4265.8 Ų65.826%0.25532%0.316SS..Hα-helixtrans-60-41174.6171.80000110.8F188 I190 Q195 I196F188-V192 HydrophobicContact CD1-CG2 4.19Å; F188-V192 HydrophobicContact CD2-CG2 4.38Å; F188-V192 HydrophobicContact CE1-CG2 3.74Å; F188-V192 HydrophobicContact CE2-CG2 3.94Å; F188-V192 HydrophobicContact CZ-CG2 3.6Å; F188-V192 WeakPolarHBondContact O-CG2 3.49Å; F188-V192 PolarHBondContact O-N 3.04Å; I190-V192 PolarHBondContact O-N 3.19Å; V192-Q195 WeakPolarHBondContact O-CB 3.38Å; V192-Q195 PolarHBondContact O-N 2.89Å; V192-I196 HydrophobicContact CG1-CD1 4.08Å; V192-I196 HydrophobicContact CG1-CG1 4.47Å; V192-I196 WeakPolarHBondContact O-CG1 3.31Å; V192-I196 PolarHBondContact O-N 3.04Å
193L98.3Very high96.9Very high1 Ų171.8 Ų71.81%0.00535%0.348CS..Hα-helixtrans-65-38.4177.2-177.566.2000112.4V148 L151 R152 F170 L173 M189 I190 E191 Q195 I196 R197V148-L193 HydrophobicContact CB-CD2 4.45Å; V148-L193 HydrophobicContact CG1-CB 4.31Å; V148-L193 HydrophobicContact CG1-CD2 4.49Å; V148-L193 HydrophobicContact CG2-CD2 4.01Å; L151-L193 HydrophobicContact CB-CD1 3.93Å; L151-L193 HydrophobicContact CB-CD2 3.99Å; L151-L193 HydrophobicContact CD1-CD2 3.68Å; L151-L193 HydrophobicContact CG-CD2 4.5Å; R152-L193 HydrophobicContact CG-CD1 4.19Å; F170-L193 HydrophobicContact CE1-CD2 4.2Å; F170-L193 HydrophobicContact CE1-CG 3.98Å; F170-L193 HydrophobicContact CZ-CD2 4.33Å; F170-L193 HydrophobicContact CZ-CG 4.11Å; L173-L193 HydrophobicContact CD1-CD2 3.82Å; M189-L193 WeakPolarHBondContact O-CB 3.36Å; M189-L193 PolarHBondContact O-N 3.48Å; I190-L193 WeakPolarHBondContact O-CA 3.45Å; I190-L193 WeakPolarHBondContact O-CB 3.49Å; I190-L193 PolarHBondContact O-N 3.28Å; I190-L193 VanDerWaalsContact O-N 3.08Å; E191-L193 VanDerWaalsContact C-N 3.29Å; E191-L193 PolarHBondContact O-N 3.24Å; L193-Q195 VanDerWaalsContact C-N 3.29Å; L193-Q195 PolarHBondContact O-N 3.08Å; L193-I196 PolarHBondContact O-N 2.67Å; L193-R197 PolarHBondContact O-N 2.91Å
194F98.4Very high96.9Very high47 Ų4771.7 Ų71.721%0.20635%0.348CS..Hα-helixtrans-61.5-38.3172.6-87.3-76.7000112F170 L173 R174 I190 E191 R197 K198F170-F194 HydrophobicContact CB-CE1 4.44Å; F170-F194 HydrophobicContact CD1-CD1 4.03Å; F170-F194 AromaticContact CD1-CE1 3.71Å; F170-F194 HydrophobicContact CD1-CE1 3.71Å; F170-F194 HydrophobicContact CD1-CZ 4.02Å; F170-F194 HydrophobicContact CE1-CD1 4.45Å; F170-F194 WeakPolarHBondContact O-CZ 3.36Å; L173-F194 HydrophobicContact CB-CE2 4.36Å; L173-F194 HydrophobicContact CB-CZ 4.47Å; R174-F194 HydrophobicContact CB-CZ 3.97Å; I190-F194 HydrophobicContact CG2-CD2 3.65Å; I190-F194 HydrophobicContact CG2-CE2 3.47Å; I190-F194 VanDerWaalsContact CG2-CE2 3.47Å; I190-F194 VanDerWaalsContact O-CD2 3.31Å; I190-F194 WeakPolarHBondContact O-CD2 3.31Å; I190-F194 PolarHBondContact O-N 3.42Å; E191-F194 WeakPolarHBondContact O-CB 3.3Å; E191-F194 PolarHBondContact O-N 3.05Å; F194-R197 PolarHBondContact O-N 3.36Å; F194-K198 WeakPolarHBondContact O-CB 3.17Å; F194-K198 PolarHBondContact O-N 2.92Å
195Q98.3Very high96.9Very high87 Ų8770.4 Ų70.441%0.40734%0.34SS..Hα-helixtrans-66.3-44.5174.6-17355.446.500111.4E191 V192 L193 R197 K198 D199E191-Q195 PolarHBondContact O-N 2.83Å; V192-Q195 WeakPolarHBondContact O-CB 3.38Å; V192-Q195 PolarHBondContact O-N 2.89Å; L193-Q195 VanDerWaalsContact C-N 3.29Å; L193-Q195 PolarHBondContact O-N 3.08Å; Q195-R197 VanDerWaalsContact C-N 3.3Å; Q195-R197 PolarHBondContact O-N 2.74Å; Q195-K198 WeakPolarHBondContact O-CB 3.33Å; Q195-K198 PolarHBondContact O-N 3.25Å; Q195-K198 VanDerWaalsContact O-N 3.12Å; Q195-D199 PolarHBondContact NE2-OD1 2.87Å; Q195-D199 PolarHBondContact NE2-OD2 3.46Å; Q195-D199 PolarHBondContact O-N 3.23Å
196I98.3Very high96.8Very high27 Ų2767.4 Ų67.414%0.13833%0.333CS..Hα-helixtrans-56.1-44.5174.2-67.6169.6000111.1R152 V192 L193 D199 K200 F201R152-I196 HydrophobicContact CG-CD1 3.91Å; V192-I196 HydrophobicContact CG1-CD1 4.08Å; V192-I196 HydrophobicContact CG1-CG1 4.47Å; V192-I196 WeakPolarHBondContact O-CG1 3.31Å; V192-I196 PolarHBondContact O-N 3.04Å; L193-I196 PolarHBondContact O-N 2.67Å; I196-D199 CarbonylContact O-C 3.55Å; I196-D199 PolarHBondContact O-N 3.45Å; I196-K200 PolarHBondContact O-N 2.97Å; I196-F201 HydrophobicContact CG2-CB 4.49Å; I196-F201 HydrophobicContact CG2-CD1 3.4Å; I196-F201 VanDerWaalsContact CG2-CD1 3.4Å; I196-F201 HydrophobicContact CG2-CE1 3.75Å; I196-F201 HydrophobicContact CG2-CG 4.07Å; I196-F201 PolarHBondContact O-N 3.35Å
197R97.8Very high96.8Very high63 Ų6369 Ų6924%0.23834%0.341CS..Hα-helixtrans-63-44.1176.4-176-171.4-176.5-178.3-0.6112N167 F170 L193 F194 Q195 D199 K200 F201N167-R197 PolarHBondContact OD1-NH2 3.34Å; F170-R197 HydrophobicContact CE1-CB 3.88Å; F170-R197 HydrophobicContact CE1-CG 4.23Å; F170-R197 HydrophobicContact CE2-CB 4.48Å; F170-R197 HydrophobicContact CE2-CG 4.18Å; F170-R197 HydrophobicContact CZ-CB 3.74Å; F170-R197 HydrophobicContact CZ-CG 3.93Å; L193-R197 PolarHBondContact O-N 2.91Å; F194-R197 PolarHBondContact O-N 3.36Å; Q195-R197 VanDerWaalsContact C-N 3.3Å; Q195-R197 PolarHBondContact O-N 2.74Å; R197-D199 VanDerWaalsContact C-N 3.25Å; R197-D199 PolarHBondContact O-N 3.21Å; R197-K200 WeakPolarHBondContact O-CA 3.34Å; R197-K200 PolarHBondContact O-N 3Å; R197-F201 HydrophobicContact CB-CE2 4.34Å; R197-F201 HydrophobicContact CB-CZ 4.33Å; R197-F201 HydrophobicContact CG-CE2 4.27Å
198K97.6Very high96.6Very high158 Ų15867.4 Ų67.469%0.68734%0.34SS*.Hα-helixtrans-60.7-38.5179.2-177.9-179.1174.6-173.60111.4F194 Q195 K200F194-K198 WeakPolarHBondContact O-CB 3.17Å; F194-K198 PolarHBondContact O-N 2.92Å; Q195-K198 WeakPolarHBondContact O-CB 3.33Å; Q195-K198 PolarHBondContact O-N 3.25Å; Q195-K198 VanDerWaalsContact O-N 3.12Å; K198-K200 PolarHBondContact O-N 2.94Å
199D97.7Very high96.2Very high72 Ų7270.7 Ų70.739%0.38536%0.357SS..THydrogen-bonded Turntrans-80.712.5174.6-58.4-26.5000112.5Q195 I196 R197 F201 V202Q195-D199 PolarHBondContact NE2-OD1 2.87Å; Q195-D199 PolarHBondContact NE2-OD2 3.46Å; Q195-D199 PolarHBondContact O-N 3.23Å; I196-D199 CarbonylContact O-C 3.55Å; I196-D199 PolarHBondContact O-N 3.45Å; R197-D199 VanDerWaalsContact C-N 3.25Å; R197-D199 PolarHBondContact O-N 3.21Å; D199-F201 PolarHBondContact O-N 3.4Å; D199-F201 VanDerWaalsContact O-N 3.17Å; D199-V202 HydrophobicContact CB-CG1 4.18Å; D199-V202 WeakPolarHBondContact O-CB 3.29Å; D199-V202 PolarHBondContact O-N 3.21Å; D199-V202 VanDerWaalsContact O-N 3.13Å
200K96.3Very high95.8Very high181 Ų18172.3 Ų72.379%0.78738%0.38SS*.THydrogen-bonded Turntrans51.936.7179-58.7-177178.1-178.10113.5I196 R197 K198 V202I196-K200 PolarHBondContact O-N 2.97Å; R197-K200 WeakPolarHBondContact O-CA 3.34Å; R197-K200 PolarHBondContact O-N 3Å; K198-K200 PolarHBondContact O-N 2.94Å; K200-V202 PolarHBondContact O-N 3.49Å
201F96.9Very high95.7Very high9 Ų972.4 Ų72.44%0.03938%0.38CS..THydrogen-bonded Turntrans56.731.5179.7-56.5-94.8000113.7L151 A156 F170 I196 R197 D199 N203 N204L151-F201 WeakPolarHBondContact O-CE1 3.33Å; A156-F201 HydrophobicContact CB-CB 3.64Å; A156-F201 HydrophobicContact CB-CD2 4.21Å; A156-F201 HydrophobicContact CB-CG 3.91Å; F170-F201 HydrophobicContact CZ-CZ 4.4Å; I196-F201 HydrophobicContact CG2-CB 4.49Å; I196-F201 HydrophobicContact CG2-CD1 3.4Å; I196-F201 VanDerWaalsContact CG2-CD1 3.4Å; I196-F201 HydrophobicContact CG2-CE1 3.75Å; I196-F201 HydrophobicContact CG2-CG 4.07Å; I196-F201 PolarHBondContact O-N 3.35Å; R197-F201 HydrophobicContact CB-CE2 4.34Å; R197-F201 HydrophobicContact CB-CZ 4.33Å; R197-F201 HydrophobicContact CG-CE2 4.27Å; D199-F201 PolarHBondContact O-N 3.4Å; D199-F201 VanDerWaalsContact O-N 3.17Å; F201-N203 PolarHBondContact O-N 3.32Å; F201-N204 HydrophobicContact CB-CB 4.44Å; F201-N204 CarbonylContact O-C 3.38Å; F201-N204 WeakPolarHBondContact O-CA 3.4Å; F201-N204 PolarHBondContact O-N 3.02Å
202V94.7Very high95.6Very high103 Ų10372.6 Ų72.662%0.62439%0.385SS*.THydrogen-bonded Turntrans-52-34.2-177.266.60000114.1D199 K200D199-V202 HydrophobicContact CB-CG1 4.18Å; D199-V202 WeakPolarHBondContact O-CB 3.29Å; D199-V202 PolarHBondContact O-N 3.21Å; D199-V202 VanDerWaalsContact O-N 3.13Å; K200-V202 PolarHBondContact O-N 3.49Å
203N94Very high95.4Very high140 Ų14073.2 Ų73.275%0.74939%0.386SS*.THydrogen-bonded Turntrans-92.91.9178.2-61.3-38.2000113.9F201F201-N203 PolarHBondContact O-N 3.32Å
204N94.6Very high95.1Very high43 Ų4373.5 Ų73.523%0.2339%0.388CS..SBendtrans-135.464.1179.8-50.3-94.2000109.1R152 F201R152-N204 VanDerWaalsContact O-CB 3.31Å; R152-N204 WeakPolarHBondContact O-CB 3.46Å; F201-N204 HydrophobicContact CB-CB 4.44Å; F201-N204 CarbonylContact O-C 3.38Å; F201-N204 WeakPolarHBondContact O-CA 3.4Å; F201-N204 PolarHBondContact O-N 3.02Å
205P94.5Very high94.5Very high76 Ų7675.9 Ų75.949%0.49440%0.399SS..  trans-61.9148.7176.728.1-35000110.6I207P205-I207 PolarHBondContact O-N 3.39Å
206P94.6Very high93.7Very high37 Ų3777.8 Ų77.824%0.2441%0.409CS..SBendtrans-54.4-52.6179.8-27.234.4000113.7N119 A156 K157N119-P206 HydrophobicContact CB-CB 4.3Å; N119-P206 WeakPolarHBondContact CB-O 3.38Å; N119-P206 VanDerWaalsContact CG-O 3.27Å; N119-P206 PolarHBondContact ND2-O 2.86Å; A156-P206 HydrophobicContact CB-CG 3.67Å; K157-P206 HydrophobicContact CB-CB 4.05Å; K157-P206 HydrophobicContact CB-CG 4.22Å; K157-P206 HydrophobicContact CD-CB 4.23Å
207I95Very high92.8Very high35 Ų3581 Ų8118%0.17942%0.423CS..SBendtrans-124.5132.3-177.9-58.2176000106P205 L211 D212P205-I207 PolarHBondContact O-N 3.39Å; I207-L211 HydrophobicContact CG2-CB 4.23Å; I207-L211 WeakPolarHBondContact CG2-O 3.43Å; I207-D212 HydrophobicContact CG2-CB 3.96Å
208A92Very high92.2Very high34 Ų3481 Ų8128%0.28143%0.428SS..  trans-76.2154.3177.100000110.3F67 G210 L211F67-A208 HydrophobicContact CD2-CB 4.1Å; F67-A208 HydrophobicContact CE2-CB 4.09Å; A208-G210 PolarHBondContact O-N 3.43Å; A208-L211 HydrophobicContact CB-CD1 4.17Å; A208-L211 WeakPolarHBondContact O-CB 3.47Å; A208-L211 PolarHBondContact O-N 3.32Å; A208-L211 VanDerWaalsContact O-N 3.07Å
209E89.9Confident91.9Very high200 Ų20075 Ų7594%0.93540%0.402SS*.THydrogen-bonded Turntrans-53.9135.1177.9-169.3176.4-177.700111.5L211E209-L211 VanDerWaalsContact C-N 3.27Å; E209-L211 PolarHBondContact O-N 2.97Å
210G90Very high91.6Very high58 Ų5873.8 Ų73.860%0.59840%0.395SS*.THydrogen-bonded Turntrans74.96.3-177.100000115.6A208A208-G210 PolarHBondContact O-N 3.43Å
211L95.9Very high91.6Very high2 Ų267.7 Ų67.71%0.0137%0.373CS..  trans-118.411.6177.8-62.3-179000113.9I32 F67 I68 A71 Q120 I207 A208 E209 L213I32-L211 HydrophobicContact CD1-CD2 3.91Å; I32-L211 HydrophobicContact CG2-CD2 4.04Å; F67-L211 HydrophobicContact CD2-CD1 3.34Å; F67-L211 HydrophobicContact CE2-CD1 3.49Å; F67-L211 VanDerWaalsContact CE2-CD1 3.49Å; I68-L211 HydrophobicContact CG1-CD1 3.9Å; A71-L211 HydrophobicContact CB-CB 4.04Å; A71-L211 HydrophobicContact CB-CD2 4.3Å; Q120-L211 PolarHBondContact NE2-O 2.93Å; Q120-L211 VanDerWaalsContact NE2-O 3.09Å; I207-L211 HydrophobicContact CG2-CB 4.23Å; I207-L211 WeakPolarHBondContact CG2-O 3.43Å; A208-L211 HydrophobicContact CB-CD1 4.17Å; A208-L211 WeakPolarHBondContact O-CB 3.47Å; A208-L211 PolarHBondContact O-N 3.32Å; A208-L211 VanDerWaalsContact O-N 3.07Å; E209-L211 VanDerWaalsContact C-N 3.27Å; E209-L211 PolarHBondContact O-N 2.97Å; L211-L213 PolarHBondContact O-N 2.69Å
212D95.1Very high91.6Very high110 Ų11068.4 Ų68.459%0.58838%0.377SS*.  trans-90.982.6166.1-159.95.8000107.3I207I207-D212 HydrophobicContact CG2-CB 3.96Å
213L93.6Very high91.6Very high54 Ų5466.9 Ų66.928%0.28338%0.375SS..  trans-106.63.1-167.9-60.6177.3000113I32 I36 V75 L211I32-L213 HydrophobicContact CD1-CD1 3.8Å; I32-L213 HydrophobicContact CG1-CD1 4.03Å; I32-L213 HydrophobicContact CG2-CD1 3.88Å; I36-L213 HydrophobicContact CD1-CD1 3.77Å; V75-L213 HydrophobicContact CG2-CB 3.53Å; V75-L213 HydrophobicContact CG2-CD1 4.2Å; L211-L213 PolarHBondContact O-N 2.69Å
214V91.2Very high91.5Very high8 Ų860.8 Ų60.85%0.04834%0.343CS..SBendtrans-123.5117.4-177.5-1770000107.8A74 V75 D218 Q219A74-V214 HydrophobicContact CB-CG2 4.08Å; V75-V214 HydrophobicContact CB-CG2 4.25Å; V75-V214 HydrophobicContact CG2-CG2 3.68Å; V214-D218 HydrophobicContact CG1-CB 4.08Å; V214-Q219 HydrophobicContact CG1-CB 4.41Å
215E86Confident91.4Very high96 Ų9660.5 Ų60.545%0.44934%0.344SS..  trans-60.5145.2173.3-65.1-64.8121.400110.5E217 D218 Q219 R304E215-E217 HydrophobicContact CB-CG 4.25Å; E215-E217 PolarHBondContact O-N 3.03Å; E215-D218 PolarHBondContact O-N 3.43Å; E215-Q219 PolarHBondContact O-N 2.66Å; E215-Q219 VanDerWaalsContact O-N 3.15Å; E215-R304 IonicContact OE2-CZ 2.97Å; E215-R304 IonicContact OE2-NH1 2.78Å; E215-R304 PolarHBondContact OE2-NH1 3.25Å; E215-R304 IonicContact OE2-NH2 3.2Å; E215-R304 PolarHBondContact OE2-NH2 3.3Å
216E83.1Confident91.2Very high128 Ų12857.6 Ų57.660%0.59832%0.324SS*.THydrogen-bonded Turntrans-56.5-27.6-175.8-64.6-173.5159.100113.6Q219E216-Q219 WeakPolarHBondContact O-CB 3.44Å
217E79.3Confident90.9Very high95 Ų9563.3 Ų63.344%0.44435%0.353SS..THydrogen-bonded Turntrans-77.4-27.5178.664.3-162.9164.200113.9E215 Q219 R304E215-E217 HydrophobicContact CB-CG 4.25Å; E215-E217 PolarHBondContact O-N 3.03Å; E217-Q219 VanDerWaalsContact C-N 3.34Å; E217-R304 IonicContact OE1-CZ 3.02Å; E217-R304 IonicContact OE1-NE 2.69Å; E217-R304 PolarHBondContact OE1-NE 2.97Å; E217-R304 IonicContact OE1-NH2 3.35Å; E217-R304 PolarHBondContact OE1-NH2 2.83Å; E217-R304 WeakPolarHBondContact OE2-CG 3.38Å; E217-R304 IonicContact OE2-NE 2.78Å; E217-R304 PolarHBondContact OE2-NE 3.26Å
218D85.1Confident90.5Very high63 Ų6363.7 Ų63.734%0.33736%0.359SS..THydrogen-bonded Turntrans-88.6-7.9175.4-84.33.6000111.8S78 K79 V214 E215 I220S78-D218 VanDerWaalsContact CB-O 3.27Å; S78-D218 WeakPolarHBondContact CB-O 3.5Å; K79-D218 IonicContact NZ-OD2 3.52Å; K79-D218 PolarHBondContact NZ-OD2 3.45Å; V214-D218 HydrophobicContact CG1-CB 4.08Å; E215-D218 PolarHBondContact O-N 3.43Å; D218-I220 PolarHBondContact O-N 2.96Å
219Q90.7Very high90.3Very high31 Ų3171.2 Ų71.215%0.14539%0.388CS..  trans-68.5122.4-178.5-170.46752.900111.5Q120 Q121 V214 E215 E216 E217Q120-Q219 PolarHBondContact O-NE2 3.06Å; Q121-Q219 HydrophobicContact CB-CG 3.89Å; Q121-Q219 PolarHBondContact O-NE2 2.8Å; V214-Q219 HydrophobicContact CG1-CB 4.41Å; E215-Q219 PolarHBondContact O-N 2.66Å; E215-Q219 VanDerWaalsContact O-N 3.15Å; E216-Q219 WeakPolarHBondContact O-CB 3.44Å; E217-Q219 VanDerWaalsContact C-N 3.34Å
220I91.3Very high90.5Very high47 Ų4763.3 Ų63.324%0.24135%0.352CS..  trans-114.9111.4175.9-63.8160.1000110.5N77 S78 P81 D218N77-I220 PolarHBondContact ND2-O 3.29Å; S78-I220 WeakPolarHBondContact O-CD1 3.38Å; P81-I220 HydrophobicContact CB-CD1 3.99Å; P81-I220 HydrophobicContact CB-CG2 3.97Å; P81-I220 HydrophobicContact CG-CD1 3.73Å; D218-I220 PolarHBondContact O-N 2.96Å
221T97.1Very high90.6Very high53 Ų5364.9 Ų64.933%0.32535%0.346SS..  trans-99.6127179-52.80000111.8Q121 H124Q121-T221 VanDerWaalsContact O-CA 3.31Å; Q121-T221 WeakPolarHBondContact O-CA 3.37Å; Q121-T221 VanDerWaalsContact O-CB 3.3Å; Q121-T221 WeakPolarHBondContact O-CB 3.32Å; Q121-T221 PolarHBondContact O-OG1 3.17Å; H124-T221 VanDerWaalsContact CA-CG2 3.5Å; H124-T221 HydrophobicContact CB-CG2 3.83Å; H124-T221 VanDerWaalsContact N-CG2 3.34Å
222H97.1Very high90.6Very high24 Ų2466 Ų6611%0.11135%0.353CS..BIsolated β-bridgetrans-94.4124.1178.1-59.6-76.7000111.6N77 P81 E85 L88 V122 H124 V224N77-H222 PolarHBondContact OD1-NE2 3.38Å; P81-H222 PolarHBondContact O-CE1 3.01Å; P81-H222 VanDerWaalsContact O-CE1 3.3Å; P81-H222 PolarHBondContact O-NE2 3.1Å; E85-H222 PolarHBondContact N-NE2 3.47Å; L88-H222 HydrophobicContact CD1-CB 3.64Å; V122-H222 PolarHBondContact O-CD2 2.68Å; V122-H222 PolarHBondContact O-N 3.48Å; H124-H222 PolarHBondContact N-O 3.45Å; H222-V224 HydrophobicContact CB-CG2 4.12Å; H222-V224 PolarHBondContact O-N 2.97Å
223A93.2Very high90.7Very high71 Ų7163.1 Ų63.159%0.58734%0.336SS*.  trans-89.571.1173.500000111.2H124H124-A223 HydrophobicContact CB-CB 4.29Å
224V92.6Very high90.7Very high12 Ų1265.2 Ų65.27%0.07334%0.344CS..  trans-88.2129.7174-175.10000109.3L88 L92 H222 L230L88-V224 HydrophobicContact CB-CG2 4.31Å; L88-V224 HydrophobicContact CD1-CG2 4.29Å; L92-V224 HydrophobicContact CD1-CB 4.2Å; L92-V224 HydrophobicContact CD1-CG1 3.5Å; H222-V224 HydrophobicContact CB-CG2 4.12Å; H222-V224 PolarHBondContact O-N 2.97Å; V224-L230 HydrophobicContact CG1-CD2 4.08Å
225S91.5Very high90.9Very high37 Ų3768.1 Ų68.126%0.25936%0.357SS..  trans-98.6152.6177.8176.30000111.6E130 D227 S228E130-S225 PolarHBondContact OE1-OG 3.18Å; E130-S225 WeakPolarHBondContact OE2-CA 3.33Å; E130-S225 PolarHBondContact OE2-OG 3.31Å; S225-D227 PolarHBondContact O-N 3.33Å; S225-D227 PolarHBondContact OG-N 3.15Å; S225-S228 PolarHBondContact O-N 3.1Å; S225-S228 PolarHBondContact O-OG 3.49Å
226L90.5Very high91.4Very high14 Ų1464.7 Ų64.77%0.07334%0.341CS..THydrogen-bonded Turntrans-61.4-21.4170.7-72-171.8000113.5L92 K96 L127 E130 L131 L134L92-L226 HydrophobicContact CD2-CD2 3.79Å; K96-L226 WeakPolarHBondContact CE-O 3.4Å; K96-L226 PolarHBondContact NZ-O 2.85Å; L127-L226 HydrophobicContact CD1-CD2 3.78Å; L127-L226 HydrophobicContact CD1-CG 3.97Å; E130-L226 VanDerWaalsContact C-CD1 3.46Å; E130-L226 HydrophobicContact CB-CB 4.4Å; E130-L226 HydrophobicContact CB-CD1 3.7Å; E130-L226 HydrophobicContact CB-CG 3.84Å; E130-L226 PolarHBondContact OE2-N 2.94Å; L131-L226 HydrophobicContact CD2-CD1 4.01Å; L131-L226 HydrophobicContact CD2-CD2 3.71Å; L131-L226 HydrophobicContact CD2-CG 4.42Å; L131-L226 HydrophobicContact CG-CD1 4.15Å; L131-L226 HydrophobicContact CG-CD2 4.07Å; L131-L226 HydrophobicContact CG-CG 4.45Å; L134-L226 HydrophobicContact CB-CD1 4.26Å; L134-L226 HydrophobicContact CD2-CD1 4.03Å
227D88.4Confident91.9Very high157 Ų15759.7 Ų59.784%0.8432%0.319SS*.THydrogen-bonded Turntrans-100.90.1178.9-67.1-35.2000113.2S225S225-D227 PolarHBondContact O-N 3.33Å; S225-D227 PolarHBondContact OG-N 3.15Å
228S86.5Confident92.6Very high44 Ų4460.7 Ų60.731%0.30833%0.327SS..SBendtrans-71.4152.2179.373.30000112.6S225 L230S225-S228 PolarHBondContact O-N 3.1Å; S225-S228 PolarHBondContact O-OG 3.49Å; S228-L230 PolarHBondContact O-N 3.35Å
229E88.4Confident93.1Very high191 Ų19159.2 Ų59.289%0.89332%0.317SS*.  trans-67.6115.7167.9-171.6174.8-173.800109.2
230L93.6Very high93.1Very high34 Ų3465.5 Ų65.518%0.17834%0.34CS..  trans-86.8113.4-176.1-58.3178.8000110.4H89 L92 K96 V224 S228 L232H89-L230 HydrophobicContact CB-CB 4.46Å; L92-L230 HydrophobicContact CB-CD1 3.98Å; L92-L230 HydrophobicContact CB-CD2 4.42Å; L92-L230 HydrophobicContact CD1-CD2 4.42Å; K96-L230 HydrophobicContact CD-CD1 4.29Å; V224-L230 HydrophobicContact CG1-CD2 4.08Å; S228-L230 PolarHBondContact O-N 3.35Å; L230-L232 HydrophobicContact CB-CD2 4.01Å; L230-L232 PolarHBondContact O-N 2.72Å
231N93.5Very high93.2Very high91 Ų9168.6 Ų68.649%0.48735%0.349SS..  trans-84.1102.1174.2-171.2-2.4000110.9H89 Q233H89-N231 PolarHBondContact ND1-O 3.27Å; N231-Q233 VanDerWaalsContact OD1-CG 3.22Å; N231-Q233 WeakPolarHBondContact OD1-CG 3.25Å; N231-Q233 PolarHBondContact OD1-N 3.14Å
232L95.9Very high93Very high27 Ų2767.8 Ų67.814%0.14134%0.343CS..  trans-83.5-17.7-174.3-50.9-176.9000114L86 H89 R90 S93 L230 E234L86-L232 WeakPolarHBondContact CD1-O 3.37Å; H89-L232 HydrophobicContact CB-CD2 4.46Å; R90-L232 HydrophobicContact CG-CD2 4.46Å; R90-L232 PolarHBondContact NE-O 3.3Å; R90-L232 PolarHBondContact NH2-O 2.99Å; S93-L232 VanDerWaalsContact CB-CD2 3.5Å; L230-L232 HydrophobicContact CB-CD2 4.01Å; L230-L232 PolarHBondContact O-N 2.72Å; L232-E234 VanDerWaalsContact C-N 3.26Å; L232-E234 HydrophobicContact CB-CG 4.06Å; L232-E234 PolarHBondContact O-N 3.11Å; L232-E234 VanDerWaalsContact O-N 3.16Å
233Q96Very high92.8Very high49 Ų4971.9 Ų71.923%0.22937%0.371CS..  trans41.651.5-177.6-55.9-175.9-33.200112.6L86 R90 N231 E235 L236L86-Q233 HydrophobicContact CD1-CB 3.94Å; L86-Q233 HydrophobicContact CD1-CG 4.22Å; R90-Q233 PolarHBondContact NH2-O 2.66Å; N231-Q233 VanDerWaalsContact OD1-CG 3.22Å; N231-Q233 WeakPolarHBondContact OD1-CG 3.25Å; N231-Q233 PolarHBondContact OD1-N 3.14Å; Q233-E235 WeakPolarHBondContact CA-OE2 3.32Å; Q233-E235 PolarHBondContact O-N 3.03Å; Q233-E235 VanDerWaalsContact O-N 3.16Å; Q233-L236 HydrophobicContact CB-CD1 3.46Å; Q233-L236 VanDerWaalsContact CB-CD1 3.46Å; Q233-L236 HydrophobicContact CB-CG 3.85Å; Q233-L236 HydrophobicContact CG-CD1 4.24Å; Q233-L236 WeakPolarHBondContact O-CB 3.4Å; Q233-L236 WeakPolarHBondContact O-CG 3.31Å; Q233-L236 PolarHBondContact O-N 3.24Å
234E94.2Very high92.7Very high97 Ų9773.4 Ų73.445%0.45337%0.366SS..G310 helixtrans-59.7-27.8-173.6-71.6-68.9179.500112.6L232 L236 N237L232-E234 VanDerWaalsContact C-N 3.26Å; L232-E234 HydrophobicContact CB-CG 4.06Å; L232-E234 PolarHBondContact O-N 3.11Å; L232-E234 VanDerWaalsContact O-N 3.16Å; E234-L236 PolarHBondContact O-N 3.26Å; E234-N237 WeakPolarHBondContact O-CB 3.28Å; E234-N237 PolarHBondContact O-N 3.48Å; E234-N237 VanDerWaalsContact O-N 3.12Å; E234-N237 PolarHBondContact O-ND2 3.39Å; E234-N237 PolarHBondContact OE2-ND2 3.39Å
235E95.6Very high92.6Very high69 Ų6973.2 Ų73.232%0.32237%0.365SS..G310 helixtrans-58.9-25.4175.466.2-78.3-178.200114.3Q233 N237 L238Q233-E235 WeakPolarHBondContact CA-OE2 3.32Å; Q233-E235 PolarHBondContact O-N 3.03Å; Q233-E235 VanDerWaalsContact O-N 3.16Å; E235-N237 PolarHBondContact O-N 2.88Å; E235-L238 PolarHBondContact O-N 2.82Å
236L96.4Very high92.6Very high24 Ų2477 Ų7713%0.12638%0.378CS..G310 helixtrans-71.1-8.9178.7-59.8177.9000113.1W13 R48 L86 Q233 E234 L238W13-L236 WeakPolarHBondContact CH2-O 3.5Å; R48-L236 HydrophobicContact CG-CD1 3.82Å; L86-L236 HydrophobicContact CD2-CD1 3.93Å; Q233-L236 HydrophobicContact CB-CD1 3.46Å; Q233-L236 VanDerWaalsContact CB-CD1 3.46Å; Q233-L236 HydrophobicContact CB-CG 3.85Å; Q233-L236 HydrophobicContact CG-CD1 4.24Å; Q233-L236 WeakPolarHBondContact O-CB 3.4Å; Q233-L236 WeakPolarHBondContact O-CG 3.31Å; Q233-L236 PolarHBondContact O-N 3.24Å; E234-L236 PolarHBondContact O-N 3.26Å; L236-L238 VanDerWaalsContact C-N 3.27Å
237N93.5Very high92.7Very high24 Ų2482.2 Ų82.213%0.12840%0.4CS..G310 helixtrans-83.3-9.9172.8-60.5-29.4000112G49 R90 E234 E235G49-N237 PolarHBondContact O-OD1 3.38Å; R90-N237 PolarHBondContact NH1-OD1 2.86Å; R90-N237 PolarHBondContact NH2-OD1 2.96Å; E234-N237 WeakPolarHBondContact O-CB 3.28Å; E234-N237 PolarHBondContact O-N 3.48Å; E234-N237 VanDerWaalsContact O-N 3.12Å; E234-N237 PolarHBondContact O-ND2 3.39Å; E234-N237 PolarHBondContact OE2-ND2 3.39Å; E235-N237 PolarHBondContact O-N 2.88Å
238L94.4Very high92.8Very high116 Ų11677.8 Ų77.861%0.60738%0.377SS*.SBendtrans-115.3142-172.5-55.8177.4000110.4E235 L236 R240E235-L238 PolarHBondContact O-N 2.82Å; L236-L238 VanDerWaalsContact C-N 3.27Å; L238-R240 PolarHBondContact O-N 3.3Å
239F94.9Very high93.1Very high32 Ų3278.3 Ų78.314%0.1437%0.374CS..  trans-61.4133.8170.3171.8-106.9000110.6Q6 Q9 R10 W13Q6-F239 HydrophobicContact CG-CE1 4.08Å; Q6-F239 HydrophobicContact CG-CZ 4.21Å; Q9-F239 VanDerWaalsContact C-CE2 3.42Å; Q9-F239 HydrophobicContact CB-CE2 3.78Å; Q9-F239 HydrophobicContact CB-CZ 3.99Å; Q9-F239 WeakPolarHBondContact O-CE2 3.49Å; R10-F239 HydrophobicContact CB-CD1 4.44Å; R10-F239 HydrophobicContact CB-CD2 4.48Å; R10-F239 HydrophobicContact CB-CE1 4.04Å; R10-F239 HydrophobicContact CB-CE2 4.11Å; R10-F239 HydrophobicContact CB-CZ 3.85Å; R10-F239 VanDerWaalsContact CD-CG 3.49Å; W13-F239 HydrophobicContact CB-CD2 3.67Å; W13-F239 HydrophobicContact CB-CE2 4.35Å; W13-F239 HydrophobicContact CD2-CB 4.4Å; W13-F239 HydrophobicContact CD2-CD2 4.41Å; W13-F239 HydrophobicContact CG-CB 4.01Å; W13-F239 AromaticContact CG-CD2 3.84Å; W13-F239 HydrophobicContact CG-CD2 3.84Å; W13-F239 HydrophobicContact CG-CG 4.4Å
240R91.5Very high93.3Very high163 Ų16374.4 Ų74.462%0.61536%0.356SS*.  trans-129.5140.7166.8-68.6-177.1170.8-174-4.4108.7L238L238-R240 PolarHBondContact O-N 3.3Å
241Y92.7Very high93.1Very high112 Ų11275 Ų7544%0.43937%0.366SS..  trans-67.3132.1171.4179.4-103.3000109.2Q6 Q9 P243Q6-Y241 HydrophobicContact CB-CD2 3.63Å; Q6-Y241 HydrophobicContact CB-CE2 3.95Å; Q6-Y241 HydrophobicContact CB-CG 4.5Å; Q6-Y241 HydrophobicContact CG-CD2 3.84Å; Q6-Y241 HydrophobicContact CG-CG 4.38Å; Q9-Y241 VanDerWaalsContact NE2-CE2 3.31Å; Y241-P243 HydrophobicContact CD1-CG 4.27Å; Y241-P243 HydrophobicContact CE1-CB 4.47Å; Y241-P243 HydrophobicContact CE1-CG 4.12Å
242D92.5Very high93.1Very high35 Ų3570.8 Ų70.819%0.18734%0.343CS..  trans-114109.8-179.6-178.43.7000109.7Q9 E244 F245 N248Q9-D242 PolarHBondContact NE2-O 3.06Å; D242-E244 PolarHBondContact O-N 2.79Å; D242-E244 PolarHBondContact OD1-N 3.3Å; D242-F245 HydrophobicContact CB-CB 4.1Å; D242-F245 WeakPolarHBondContact O-CB 3.23Å; D242-F245 PolarHBondContact O-N 3.15Å; D242-F245 PolarHBondContact OD1-N 3.3Å; D242-F245 WeakPolarHBondContact OD2-CA 3.43Å; D242-N248 PolarHBondContact OD1-ND2 3.41Å; D242-N248 PolarHBondContact OD2-ND2 3.06Å
243P92.5Very high92.8Very high110 Ų11072.5 Ų72.571%0.71435%0.351SS*.THydrogen-bonded Turntrans-62.7-25.3175.2-2233.8000113.9Y241Y241-P243 HydrophobicContact CD1-CG 4.27Å; Y241-P243 HydrophobicContact CE1-CB 4.47Å; Y241-P243 HydrophobicContact CE1-CG 4.12Å
244E92.1Very high92.5Very high103 Ų10374.4 Ų74.448%0.48136%0.362SS..THydrogen-bonded Turntrans-102.321.5179-65.6-164.3124.600112.2D242 E246 K247 N248D242-E244 PolarHBondContact O-N 2.79Å; D242-E244 PolarHBondContact OD1-N 3.3Å; E244-E246 VanDerWaalsContact C-N 3.34Å; E244-E246 PolarHBondContact O-N 3.4Å; E244-K247 HydrophobicContact CB-CB 4.49Å; E244-K247 WeakPolarHBondContact O-CB 3.44Å; E244-K247 PolarHBondContact O-N 3.23Å; E244-K247 IonicContact OE1-NZ 3.36Å; E244-K247 PolarHBondContact OE1-NZ 2.95Å; E244-K247 IonicContact OE2-NZ 3.24Å; E244-N248 PolarHBondContact O-N 2.89Å
245F90.7Very high92.1Very high8 Ų872.5 Ų72.54%0.03535%0.354CS..Hα-helixtrans-49.2-48.4-173.7-179.8-93.7000113.9Y4 Y8 Q9 A12 D242 K247 N248 E249Y4-F245 AromaticContact CD1-CD1 3.4Å; Y4-F245 HydrophobicContact CD1-CD1 3.4Å; Y4-F245 VanDerWaalsContact CD1-CD1 3.4Å; Y4-F245 AromaticContact CD1-CE1 3.62Å; Y4-F245 HydrophobicContact CD1-CE1 3.62Å; Y4-F245 AromaticContact CE1-CD1 3.99Å; Y4-F245 HydrophobicContact CE1-CD1 3.99Å; Y4-F245 AromaticContact CE1-CE1 3.95Å; Y4-F245 HydrophobicContact CE1-CE1 3.95Å; Y4-F245 HydrophobicContact CG-CD1 4.05Å; Y8-F245 HydrophobicContact CD1-CE1 4.44Å; Y8-F245 AromaticContact CE1-CE1 3.94Å; Y8-F245 HydrophobicContact CE1-CE1 3.94Å; Y8-F245 HydrophobicContact CE1-CZ 4.4Å; Q9-F245 HydrophobicContact CB-CD2 4.45Å; Q9-F245 HydrophobicContact CG-CB 4.28Å; Q9-F245 HydrophobicContact CG-CD1 4.17Å; Q9-F245 HydrophobicContact CG-CD2 3.79Å; Q9-F245 HydrophobicContact CG-CE2 4.16Å; Q9-F245 HydrophobicContact CG-CG 3.8Å; Q9-F245 VanDerWaalsContact NE2-CB 3.3Å; A12-F245 HydrophobicContact CB-CZ 4.36Å; D242-F245 HydrophobicContact CB-CB 4.1Å; D242-F245 WeakPolarHBondContact O-CB 3.23Å; D242-F245 PolarHBondContact O-N 3.15Å; D242-F245 PolarHBondContact OD1-N 3.3Å; D242-F245 WeakPolarHBondContact OD2-CA 3.43Å; F245-K247 PolarHBondContact O-N 2.95Å; F245-N248 PolarHBondContact O-N 3.35Å; F245-E249 HydrophobicContact CD1-CG 4.09Å; F245-E249 HydrophobicContact CD2-CG 4.4Å; F245-E249 HydrophobicContact CE1-CG 3.64Å; F245-E249 HydrophobicContact CE2-CG 3.98Å; F245-E249 HydrophobicContact CG-CG 4.45Å; F245-E249 HydrophobicContact CZ-CG 3.58Å; F245-E249 WeakPolarHBondContact O-CG 3.4Å; F245-E249 PolarHBondContact O-N 3.44Å
246E91.1Very high91.6Very high116 Ų11672 Ų7254%0.54235%0.35SS..Hα-helixtrans-61.2-43.6-179.7-177.6174.6-164.600112.2Y4 E244 E249 Q250Y4-E246 HydrophobicContact CD2-CB 4.01Å; Y4-E246 HydrophobicContact CD2-CG 4.41Å; Y4-E246 HydrophobicContact CE2-CB 3.76Å; Y4-E246 HydrophobicContact CE2-CG 3.68Å; Y4-E246 WeakPolarHBondContact CE2-OE2 3.48Å; E244-E246 VanDerWaalsContact C-N 3.34Å; E244-E246 PolarHBondContact O-N 3.4Å; E246-E249 PolarHBondContact O-N 2.9Å; E246-Q250 WeakPolarHBondContact O-CB 3.4Å; E246-Q250 PolarHBondContact O-N 2.92Å
247K92.3Very high91.2Very high124 Ų12473.9 Ų73.954%0.53936%0.36SS..Hα-helixtrans-65.4-39.9177.6-179.9-169.8174.1-161.90111.4E244 F245 Q250 A251E244-K247 HydrophobicContact CB-CB 4.49Å; E244-K247 WeakPolarHBondContact O-CB 3.44Å; E244-K247 PolarHBondContact O-N 3.23Å; E244-K247 IonicContact OE1-NZ 3.36Å; E244-K247 PolarHBondContact OE1-NZ 2.95Å; E244-K247 IonicContact OE2-NZ 3.24Å; F245-K247 PolarHBondContact O-N 2.95Å; K247-Q250 PolarHBondContact O-N 3.28Å; K247-A251 WeakPolarHBondContact O-CB 3.45Å; K247-A251 PolarHBondContact O-N 3.23Å
248N91Very high90.7Very high65 Ų6579.5 Ų79.535%0.34839%0.386SS..Hα-helixtrans-72.1-35.5179.5-69.4-23000112.4D242 E244 F245 Y252D242-N248 PolarHBondContact OD1-ND2 3.41Å; D242-N248 PolarHBondContact OD2-ND2 3.06Å; E244-N248 PolarHBondContact O-N 2.89Å; F245-N248 PolarHBondContact O-N 3.35Å; N248-Y252 PolarHBondContact O-N 2.88Å
249E92.5Very high90Very high55 Ų5574.7 Ų74.726%0.25736%0.36SS..Hα-helixtrans-68.2-43.5171.6-69.9-66.312000110.8N43 F245 E246 A251 Y252 E253N43-E249 PolarHBondContact ND2-OE1 3.39Å; F245-E249 HydrophobicContact CD1-CG 4.09Å; F245-E249 HydrophobicContact CD2-CG 4.4Å; F245-E249 HydrophobicContact CE1-CG 3.64Å; F245-E249 HydrophobicContact CE2-CG 3.98Å; F245-E249 HydrophobicContact CG-CG 4.45Å; F245-E249 HydrophobicContact CZ-CG 3.58Å; F245-E249 WeakPolarHBondContact O-CG 3.4Å; F245-E249 PolarHBondContact O-N 3.44Å; E246-E249 PolarHBondContact O-N 2.9Å; E249-A251 PolarHBondContact O-N 3.47Å; E249-Y252 PolarHBondContact O-N 3.05Å; E249-E253 PolarHBondContact O-N 2.86Å
250Q92.4Very high89.2Confident108 Ų10875 Ų7551%0.50536%0.363SS..Hα-helixtrans-62.2-44.7176.6-173.260.848.500112E246 K247 Y252 E253 D254E246-Q250 WeakPolarHBondContact O-CB 3.4Å; E246-Q250 PolarHBondContact O-N 2.92Å; K247-Q250 PolarHBondContact O-N 3.28Å; Q250-Y252 PolarHBondContact O-N 3.05Å; Q250-E253 PolarHBondContact O-N 3.16Å; Q250-E253 VanDerWaalsContact O-N 3.13Å; Q250-D254 PolarHBondContact NE2-OD1 3.2Å; Q250-D254 VanDerWaalsContact O-CG 3.23Å; Q250-D254 PolarHBondContact O-N 2.93Å
251A90.4Very high88.1Confident47 Ų4773.1 Ų73.139%0.38836%0.361SS..Hα-helixtrans-61-33.1176.600000112.3K247 E249 I255K247-A251 WeakPolarHBondContact O-CB 3.45Å; K247-A251 PolarHBondContact O-N 3.23Å; E249-A251 PolarHBondContact O-N 3.47Å; A251-I255 WeakPolarHBondContact O-CD1 3.24Å; A251-I255 WeakPolarHBondContact O-CG1 3.31Å; A251-I255 PolarHBondContact O-N 3.05Å
252Y91.6Very high86.1Confident3 Ų370.6 Ų70.61%0.01236%0.36CS..Hα-helixtrans-73-40.3173.9-169.6-90.7000112.1F40 V42 N43 L44 I45 F80 N248 E249 Q250 D254 I255 R256F40-Y252 PolarHBondContact O-OH 3.06Å; V42-Y252 VanDerWaalsContact O-CE1 3.31Å; V42-Y252 WeakPolarHBondContact O-CE1 3.45Å; V42-Y252 PolarHBondContact O-OH 3.45Å; N43-Y252 VanDerWaalsContact CA-CE1 3.42Å; N43-Y252 HydrophobicContact CB-CD1 3.89Å; N43-Y252 HydrophobicContact CB-CD2 4.27Å; N43-Y252 HydrophobicContact CB-CE1 4.29Å; N43-Y252 HydrophobicContact CB-CG 3.88Å; N43-Y252 VanDerWaalsContact CG-CG 3.49Å; N43-Y252 VanDerWaalsContact OD1-CD2 3.25Å; N43-Y252 WeakPolarHBondContact OD1-CD2 3.37Å; L44-Y252 HydrophobicContact CB-CE2 4.33Å; L44-Y252 PolarHBondContact N-OH 3.24Å; I45-Y252 HydrophobicContact CB-CD2 4.24Å; I45-Y252 HydrophobicContact CD1-CD2 3.92Å; I45-Y252 HydrophobicContact CD1-CE2 4.4Å; I45-Y252 HydrophobicContact CG1-CD2 3.87Å; I45-Y252 HydrophobicContact CG1-CE2 4.02Å; F80-Y252 AromaticContact CE1-CE2 3.79Å; F80-Y252 HydrophobicContact CE1-CE2 3.79Å; F80-Y252 HydrophobicContact CE2-CE2 4.43Å; F80-Y252 AromaticContact CZ-CE2 3.57Å; F80-Y252 HydrophobicContact CZ-CE2 3.57Å; F80-Y252 AromaticContact CZ-CZ 3.93Å; N248-Y252 PolarHBondContact O-N 2.88Å; E249-Y252 PolarHBondContact O-N 3.05Å; Q250-Y252 PolarHBondContact O-N 3.05Å; Y252-D254 VanDerWaalsContact C-N 3.27Å; Y252-D254 PolarHBondContact O-N 3.17Å; Y252-I255 PolarHBondContact O-N 3.16Å; Y252-R256 HydrophobicContact CD1-CB 4.4Å; Y252-R256 HydrophobicContact CE1-CB 4.22Å; Y252-R256 VanDerWaalsContact O-CB 3.24Å; Y252-R256 WeakPolarHBondContact O-CB 3.46Å; Y252-R256 PolarHBondContact O-N 2.89Å
253E91.2Very high83.8Confident63 Ų6371.8 Ų71.829%0.29437%0.365SS..Hα-helixtrans-59.7-38.5174.4-74.4-67.1149.600111.6E249 Q250 R256 N257E249-E253 PolarHBondContact O-N 2.86Å; Q250-E253 PolarHBondContact O-N 3.16Å; Q250-E253 VanDerWaalsContact O-N 3.13Å; E253-R256 PolarHBondContact O-N 3.34Å; E253-R256 IonicContact OE1-NH1 3.83Å; E253-R256 PolarHBondContact OE1-NH1 3.26Å; E253-R256 IonicContact OE2-CZ 3.98Å; E253-R256 IonicContact OE2-NH1 2.72Å; E253-R256 PolarHBondContact OE2-NH1 3.3Å; E253-N257 VanDerWaalsContact O-CG 3.23Å; E253-N257 PolarHBondContact O-N 3.22Å; E253-N257 PolarHBondContact O-ND2 3.13Å
254D89.6Confident81.2Confident88 Ų8869.6 Ų69.647%0.47135%0.352SS..Hα-helixtrans-63-47.6175.8-60.1-19.4000111.4Q250 Y252 R256 N257 E258Q250-D254 PolarHBondContact NE2-OD1 3.2Å; Q250-D254 VanDerWaalsContact O-CG 3.23Å; Q250-D254 PolarHBondContact O-N 2.93Å; Y252-D254 VanDerWaalsContact C-N 3.27Å; Y252-D254 PolarHBondContact O-N 3.17Å; D254-R256 VanDerWaalsContact C-N 3.32Å; D254-R256 PolarHBondContact O-N 2.74Å; D254-N257 PolarHBondContact O-N 3.5Å; D254-E258 PolarHBondContact O-N 3.28Å
255I85.2Confident78.3Confident57 Ų5771.7 Ų71.729%0.29236%0.361SS..Hα-helixtrans-62-40.8175.4-65.8165.2000111I45 F80 A251 Y252 E258 I259I45-I255 HydrophobicContact CD1-CD1 3.89Å; F80-I255 HydrophobicContact CE1-CG2 4.03Å; F80-I255 HydrophobicContact CZ-CG2 4.11Å; A251-I255 WeakPolarHBondContact O-CD1 3.24Å; A251-I255 WeakPolarHBondContact O-CG1 3.31Å; A251-I255 PolarHBondContact O-N 3.05Å; Y252-I255 PolarHBondContact O-N 3.16Å; I255-E258 PolarHBondContact O-N 3.43Å; I255-I259 HydrophobicContact CG2-CD1 3.71Å; I255-I259 HydrophobicContact CG2-CG1 4.34Å; I255-I259 VanDerWaalsContact O-CG1 3.31Å; I255-I259 WeakPolarHBondContact O-CG1 3.42Å; I255-I259 PolarHBondContact O-N 3.42Å
256R86Confident75.7Confident59 Ų5974.8 Ų74.822%0.22338%0.381CS..Hα-helixtrans-63.3-43.2-179.6171.6-176166.2-146-12111.5F40 Y252 E253 D254 E258 I259 L260F40-R256 WeakPolarHBondContact O-CG 3.44Å; Y252-R256 HydrophobicContact CD1-CB 4.4Å; Y252-R256 HydrophobicContact CE1-CB 4.22Å; Y252-R256 VanDerWaalsContact O-CB 3.24Å; Y252-R256 WeakPolarHBondContact O-CB 3.46Å; Y252-R256 PolarHBondContact O-N 2.89Å; E253-R256 PolarHBondContact O-N 3.34Å; E253-R256 IonicContact OE1-NH1 3.83Å; E253-R256 PolarHBondContact OE1-NH1 3.26Å; E253-R256 IonicContact OE2-CZ 3.98Å; E253-R256 IonicContact OE2-NH1 2.72Å; E253-R256 PolarHBondContact OE2-NH1 3.3Å; D254-R256 VanDerWaalsContact C-N 3.32Å; D254-R256 PolarHBondContact O-N 2.74Å; R256-E258 VanDerWaalsContact C-N 3.32Å; R256-I259 PolarHBondContact O-N 2.84Å; R256-L260 HydrophobicContact CG-CD1 3.78Å; R256-L260 HydrophobicContact CG-CG 4.41Å; R256-L260 WeakPolarHBondContact O-CB 3.24Å; R256-L260 WeakPolarHBondContact O-CG 3.42Å; R256-L260 PolarHBondContact O-N 2.9Å
257N86.7Confident72.8Confident64 Ų6475 Ų7534%0.34238%0.382SS..Hα-helixtrans-64.5-41.4177.3-66-24.4000110.3E253 D254 I259 L260 E261E253-N257 VanDerWaalsContact O-CG 3.23Å; E253-N257 PolarHBondContact O-N 3.22Å; E253-N257 PolarHBondContact O-ND2 3.13Å; D254-N257 PolarHBondContact O-N 3.5Å; N257-I259 PolarHBondContact O-N 3.32Å; N257-L260 PolarHBondContact O-N 2.68Å; N257-E261 WeakPolarHBondContact O-CB 3.25Å; N257-E261 WeakPolarHBondContact O-CG 3.06Å; N257-E261 PolarHBondContact O-N 2.69Å
258E83Confident69.8Low142 Ų14276.7 Ų76.766%0.66439%0.392SS*.Hα-helixtrans-59.4-43.6174.7-173.3177.1-176.800112.4D254 I255 R256 S262D254-E258 PolarHBondContact O-N 3.28Å; I255-E258 PolarHBondContact O-N 3.43Å; R256-E258 VanDerWaalsContact C-N 3.32Å; E258-S262 WeakPolarHBondContact O-CB 3.48Å; E258-S262 PolarHBondContact O-N 3.21Å; E258-S262 PolarHBondContact O-OG 2.68Å
259I79.7Confident67Low14 Ų1480 Ų807%0.07241%0.409CS..Hα-helixtrans-66.7-48.1178.3-65.8167.1000111.5F40 K79 F80 I255 R256 N257 S262 E263F40-I259 HydrophobicContact CD2-CG2 3.77Å; F40-I259 HydrophobicContact CE2-CG2 4.1Å; F40-I259 HydrophobicContact CG-CG2 4.4Å; K79-I259 HydrophobicContact CB-CD1 4.05Å; K79-I259 HydrophobicContact CG-CD1 4.33Å; F80-I259 HydrophobicContact CE2-CD1 4.1Å; F80-I259 HydrophobicContact CZ-CD1 3.8Å; I255-I259 HydrophobicContact CG2-CD1 3.71Å; I255-I259 HydrophobicContact CG2-CG1 4.34Å; I255-I259 VanDerWaalsContact O-CG1 3.31Å; I255-I259 WeakPolarHBondContact O-CG1 3.42Å; I255-I259 PolarHBondContact O-N 3.42Å; R256-I259 PolarHBondContact O-N 2.84Å; N257-I259 PolarHBondContact O-N 3.32Å; I259-S262 PolarHBondContact O-OG 3.47Å; I259-E263 WeakPolarHBondContact O-CG 3.48Å; I259-E263 PolarHBondContact O-N 3.2Å
260L77.8Confident64Low40 Ų4084 Ų8421%0.20943%0.428CS..Hα-helixtrans-81.6-29.9-173.1-64.2175.6000113.3K41 R256 N257 S264K41-L260 HydrophobicContact CG-CD1 4.25Å; R256-L260 HydrophobicContact CG-CD1 3.78Å; R256-L260 HydrophobicContact CG-CG 4.41Å; R256-L260 WeakPolarHBondContact O-CB 3.24Å; R256-L260 WeakPolarHBondContact O-CG 3.42Å; R256-L260 PolarHBondContact O-N 2.9Å; N257-L260 PolarHBondContact O-N 2.68Å; L260-S264 PolarHBondContact O-N 3.37Å; L260-S264 VanDerWaalsContact O-N 3.07Å
261E69.5Low61Low122 Ų12287.6 Ų87.657%0.5745%0.445SS*.Hα-helixtrans-70.7-40.5175-69.5175.7-178.700110.7N257 E263 S264 E265N257-E261 WeakPolarHBondContact O-CB 3.25Å; N257-E261 WeakPolarHBondContact O-CG 3.06Å; N257-E261 PolarHBondContact O-N 2.69Å; E261-E263 VanDerWaalsContact C-N 3.32Å; E261-E263 PolarHBondContact O-N 2.69Å; E261-S264 WeakPolarHBondContact CA-OG 3.29Å; E261-S264 PolarHBondContact O-N 3.15Å; E261-S264 PolarHBondContact O-OG 3.43Å; E261-E265 PolarHBondContact O-N 3.12Å
262S50.7Low58.1Low59 Ų5994.6 Ų94.641%0.41347%0.466SS..Hα-helixtrans-63.8-34.1174.756.50000113.1E258 I259 T266E258-S262 WeakPolarHBondContact O-CB 3.48Å; E258-S262 PolarHBondContact O-N 3.21Å; E258-S262 PolarHBondContact O-OG 2.68Å; I259-S262 PolarHBondContact O-OG 3.47Å; S262-T266 PolarHBondContact O-N 3.27Å; S262-T266 PolarHBondContact O-OG1 3.49Å
263E43.8Very low55.1Low61 Ų6198.7 Ų98.729%0.28550%0.495SS..Hα-helixtrans-72.8-36.1173.8-74.8176.8-179.800112.4I259 E261 E265 T266 E267I259-E263 WeakPolarHBondContact O-CG 3.48Å; I259-E263 PolarHBondContact O-N 3.2Å; E261-E263 VanDerWaalsContact C-N 3.32Å; E261-E263 PolarHBondContact O-N 2.69Å; E263-E265 VanDerWaalsContact C-N 3.32Å; E263-E265 PolarHBondContact O-N 2.85Å; E263-T266 WeakPolarHBondContact O-CA 3.37Å; E263-T266 WeakPolarHBondContact O-CB 3.39Å; E263-T266 PolarHBondContact O-N 3.34Å; E263-E267 PolarHBondContact O-N 2.97Å
264S38.6Very low52Low63 Ų63103 Ų10344%0.44152%0.52SS..Hα-helixtrans-65.9-31.3176.6670000113.9L260 E261 T266L260-S264 PolarHBondContact O-N 3.37Å; L260-S264 VanDerWaalsContact O-N 3.07Å; E261-S264 WeakPolarHBondContact CA-OG 3.29Å; E261-S264 PolarHBondContact O-N 3.15Å; E261-S264 PolarHBondContact O-OG 3.43Å; S264-T266 VanDerWaalsContact C-N 3.27Å
265E31.4Very low49Very low147 Ų147108 Ų10869%0.68754%0.54SS*.Hα-helixtrans-72.6-22170.7-70.6-175.5166.700112.3E261 E263 L269E261-E265 PolarHBondContact O-N 3.12Å; E263-E265 VanDerWaalsContact C-N 3.32Å; E263-E265 PolarHBondContact O-N 2.85Å; E265-L269 WeakPolarHBondContact O-CG 3.44Å
266T34.3Very low46Very low74 Ų74114.2 Ų114.245%0.45457%0.569SS.*Hα-helixtrans-83.1-39.3179.2-50.20000111.6S262 E263 S264 E268 L269 E270S262-T266 PolarHBondContact O-N 3.27Å; S262-T266 PolarHBondContact O-OG1 3.49Å; E263-T266 WeakPolarHBondContact O-CA 3.37Å; E263-T266 WeakPolarHBondContact O-CB 3.39Å; E263-T266 PolarHBondContact O-N 3.34Å; S264-T266 VanDerWaalsContact C-N 3.27Å; T266-E268 PolarHBondContact O-N 3.5Å; T266-L269 WeakPolarHBondContact O-CB 3.23Å; T266-L269 PolarHBondContact O-N 2.93Å; T266-L269 VanDerWaalsContact O-N 3.13Å; T266-E270 PolarHBondContact O-N 2.95Å
267E30.8Very low43.1Very low121 Ų121117.8 Ų117.857%0.56560%0.597SS**Hα-helixtrans-66.9-31.4177.5-71.2-166.5163.500113.3E263 L269 E270E263-E267 PolarHBondContact O-N 2.97Å; E267-L269 PolarHBondContact O-N 3.14Å; E267-E270 PolarHBondContact O-N 3.49Å
268E30.5Very low40Very low158 Ų158121.5 Ų121.574%0.73862%0.617SS**Hα-helixtrans-67.1-16.6174.2-73.9-166.4174.400113.2T266T266-E268 PolarHBondContact O-N 3.5Å
269L31.4Very low37.4Very low134 Ų134124.3 Ų124.370%0.70263%0.627SS**Hα-helixtrans-90.2-29178.8-64.1171.2000112.7E265 T266 E267E265-L269 WeakPolarHBondContact O-CG 3.44Å; T266-L269 WeakPolarHBondContact O-CB 3.23Å; T266-L269 PolarHBondContact O-N 2.93Å; T266-L269 VanDerWaalsContact O-N 3.13Å; E267-L269 PolarHBondContact O-N 3.14Å
270E29.1Very low34.6Very low140 Ų140132.8 Ų132.865%0.65467%0.666SS**Hα-helixtrans-80.5-27-178.1-66.6-165.1167.800113.5T266 E267 K272 S273T266-E270 PolarHBondContact O-N 2.95Å; E267-E270 PolarHBondContact O-N 3.49Å; E270-K272 PolarHBondContact O-N 3.27Å; E270-S273 PolarHBondContact O-N 3.25Å; E270-S273 PolarHBondContact O-OG 3.32Å
271E29.4Very low32.1Very low184 Ų184137.2 Ų137.286%0.8670%0.695SS**THydrogen-bonded Turntrans-68.7-5.4177.4-77.3-160159.700114.3
272K30Very low29.8Very low194 Ų194140.3 Ų140.384%0.84371%0.709SS**THydrogen-bonded Turntrans-1043.6-179.4-75.8-168.5-179169.30116.2E270E270-K272 PolarHBondContact O-N 3.27Å
273S29Very low28.6Very low88 Ų88146.6 Ų146.662%0.61573%0.733SS**SBendtrans-97.6-3.3-178.849.60000117E270E270-S273 PolarHBondContact O-N 3.25Å; E270-S273 PolarHBondContact O-OG 3.32Å
274D26.3Very low27.6Very low154 Ų154148.6 Ų148.682%0.82476%0.759SS**  trans-120.837-171.2-79.1-11.6000116.4
275E25Very low27.1Very low192 Ų192152.2 Ų152.290%0.89778%0.779SS**  trans-122.560.7162.1-73-162.4172.900112.7
276E23.5Very low26.8Very low189 Ų189150.4 Ų150.488%0.88379%0.789SS**  trans-131.484.7158.2-77-157.2166.700111.4
277T23.8Very low26.5Very low133 Ų133150 Ų15082%0.81680%0.8SS**SBendtrans-156120.4142.2-6.30000112.5
278D23.4Very low26.4Very low143 Ų143153.6 Ų153.677%0.76582%0.817SS**  trans64.788.2156.5-67-25.6000119.9
279K27.4Very low26.4Very low201 Ų201153.3 Ų153.387%0.87482%0.82SS**  -144.1107.3124.3-69.6-163.8-179.9160.10112.4T281K279-T281 PolarHBondContact O-N 3.01Å
280Q21.2Very low26.5Very low191 Ų191151.1 Ų151.189%0.89382%0.821SS**  trans-54.2114157.8-69175.3-6.500110.1
281T25.5Very low26.9Very low133 Ų133151.9 Ų151.982%0.81683%0.828SS**  trans-152.7124.7143.6-30000109.7K279 Q283K279-T281 PolarHBondContact O-N 3.01Å; T281-Q283 PolarHBondContact O-N 3.39Å
282E21Very low27.3Very low187 Ų187148.1 Ų148.187%0.87482%0.818SS**  trans-53.4128.3173.8-60.8170.7147.400111.5
283Q25.9Very low27.8Very low192 Ų192144.2 Ų144.290%0.89781%0.806SS**  trans-167125.6132.7-106.1165.531.100110.6T281 T285T281-Q283 PolarHBondContact O-N 3.39Å; Q283-T285 PolarHBondContact O-N 3.49Å
284A22.6Very low28.7Very low103 Ų103145.6 Ų145.685%0.85181%0.806SS**  trans-70.4119.1175.400000110.9
285T27.2Very low30.5Very low139 Ų139142.1 Ų142.185%0.85379%0.79SS**  trans-138.9114.9149.1360000108.7Q283Q283-T285 PolarHBondContact O-N 3.49Å
286A26.5Very low32.6Very low108 Ų108139.6 Ų139.689%0.89378%0.779SS**  trans-67.6137.2-179.600000112.1
287G27.1Very low35.1Very low66 Ų66135.9 Ų135.968%0.6876%0.764SS**  trans81.378.613500000116.7
288Q29.4Very low37.7Very low197 Ų197132.4 Ų132.492%0.92174%0.74SS**  trans-126.9118146.7-82.5-177.2-1900109.4A290Q288-A290 PolarHBondContact O-N 3.28Å; Q288-A290 VanDerWaalsContact O-N 3.12Å
289N30.1Very low40.3Very low152 Ų152128.1 Ų128.181%0.81372%0.717SS**  trans-63.9102.9-177.4-59.4-31.5000109.8I291N289-I291 HydrophobicContact CB-CG1 4.32Å; N289-I291 PolarHBondContact O-N 3.31Å
290A33.8Very low42.7Very low88 Ų88122 Ų12273%0.72769%0.693SS**  trans-81.293156.600000106.7Q288 T292Q288-A290 PolarHBondContact O-N 3.28Å; Q288-A290 VanDerWaalsContact O-N 3.12Å; A290-T292 PolarHBondContact O-N 2.96Å
291I37.1Very low45.4Very low156 Ų156116.4 Ų116.480%0.867%0.672SS**  trans-76.286.8168.6-59.9173.4000105.3N289 D293N289-I291 HydrophobicContact CB-CG1 4.32Å; N289-I291 PolarHBondContact O-N 3.31Å; I291-D293 PolarHBondContact O-N 2.91Å
292T37.1Very low48.3Very low104 Ų104110.9 Ų110.964%0.63864%0.637SS**  trans-69.9122.9170.7-36.20000107.6A290 L294A290-T292 PolarHBondContact O-N 2.96Å; T292-L294 VanDerWaalsContact C-N 3.34Å; T292-L294 PolarHBondContact O-N 3.46Å
293D40.4Very low51.3Low112 Ų112106.8 Ų106.860%0.59961%0.613SS**  trans-73.884.5-175.8-158.9-17.1000110.8I291 T295I291-D293 PolarHBondContact O-N 2.91Å; D293-T295 PolarHBondContact O-N 3.46Å; D293-T295 PolarHBondContact OD1-N 3.24Å; D293-T295 PolarHBondContact OD1-OG1 3.13Å
294L47.9Very low53.9Low117 Ų117101.8 Ų101.861%0.61359%0.586SS**  trans-72.62.9-177.8-70160.5000113.2T292 N298T292-L294 VanDerWaalsContact C-N 3.34Å; T292-L294 PolarHBondContact O-N 3.46Å; L294-N298 PolarHBondContact O-ND2 2.94Å
295T65.6Low57Low81 Ų8199.6 Ų99.650%0.49756%0.562SS.*Hα-helixtrans-81.5-43.7-166.559.50000114.1D293 N298 L299D293-T295 PolarHBondContact O-N 3.46Å; D293-T295 PolarHBondContact OD1-N 3.24Å; D293-T295 PolarHBondContact OD1-OG1 3.13Å; T295-N298 PolarHBondContact O-N 3.23Å; T295-L299 PolarHBondContact O-N 3.07Å
296E68.6Low60Low139 Ų13993 Ų9365%0.6552%0.522SS*.Hα-helixtrans-69.2-42.1-177.9-67.7-174.4161.300112.8N298 L299 I300E296-N298 VanDerWaalsContact C-N 3.27Å; E296-N298 PolarHBondContact O-N 3.5Å; E296-L299 WeakPolarHBondContact O-CB 3.45Å; E296-L299 PolarHBondContact O-N 3.27Å; E296-I300 PolarHBondContact O-N 3.37Å
297I75.1Confident62.9Low111 Ų11191.6 Ų91.657%0.56949%0.494SS*.Hα-helixtrans-60.1-39.8176.6-60.8172.5000110.9L299 I300 T301I297-L299 VanDerWaalsContact C-N 3.32Å; I297-L299 PolarHBondContact O-N 3.43Å; I297-I300 PolarHBondContact O-N 3.06Å; I297-T301 WeakPolarHBondContact O-CB 3.47Å; I297-T301 PolarHBondContact O-N 3.35Å; I297-T301 PolarHBondContact O-OG1 2.9Å
298N78.1Confident65.5Low61 Ų6192.2 Ų92.233%0.32648%0.481SS..Hα-helixtrans-66.4-34176.8-80.1-52.8000112L294 T295 E296 F302 Y332L294-N298 PolarHBondContact O-ND2 2.94Å; T295-N298 PolarHBondContact O-N 3.23Å; E296-N298 VanDerWaalsContact C-N 3.27Å; E296-N298 PolarHBondContact O-N 3.5Å; N298-F302 VanDerWaalsContact O-CB 3.22Å; N298-F302 WeakPolarHBondContact O-CB 3.4Å; N298-F302 PolarHBondContact O-N 3.28Å; N298-Y332 WeakPolarHBondContact CB-OH 3.36Å
299L77.8Confident68.2Low52 Ų5283.8 Ų83.827%0.27244%0.443SS..Hα-helixtrans-68.6-46.8175.4-78.7167.3000111.8T295 E296 I297 T301 F302 R303 Y332 E335T295-L299 PolarHBondContact O-N 3.07Å; E296-L299 WeakPolarHBondContact O-CB 3.45Å; E296-L299 PolarHBondContact O-N 3.27Å; I297-L299 VanDerWaalsContact C-N 3.32Å; I297-L299 PolarHBondContact O-N 3.43Å; L299-T301 VanDerWaalsContact C-N 3.35Å; L299-T301 PolarHBondContact O-N 2.96Å; L299-F302 WeakPolarHBondContact O-CB 3.49Å; L299-F302 PolarHBondContact O-N 3.05Å; L299-R303 WeakPolarHBondContact O-CG 3.34Å; L299-R303 PolarHBondContact O-N 3Å; L299-Y332 HydrophobicContact CD2-CD1 3.79Å; L299-Y332 HydrophobicContact CD2-CE1 3.39Å; L299-Y332 HydrophobicContact CG-CE1 3.95Å; L299-E335 HydrophobicContact CD2-CG 4.23Å
300I79.1Confident70.9Confident74 Ų7476.8 Ų76.838%0.37941%0.406SS..Hα-helixtrans-59.5-48.5176.7-64.2168.8000109.9E296 I297 F302 R303 R304E296-I300 PolarHBondContact O-N 3.37Å; I297-I300 PolarHBondContact O-N 3.06Å; I300-F302 VanDerWaalsContact C-N 3.28Å; I300-F302 PolarHBondContact O-N 3.37Å; I300-R303 PolarHBondContact O-N 3.43Å; I300-R304 HydrophobicContact CG2-CG 4.48Å; I300-R304 WeakPolarHBondContact O-CG 3.48Å; I300-R304 PolarHBondContact O-N 3.44Å
301T77Confident73.2Confident72 Ų7276.8 Ų76.844%0.44239%0.391SS..Hα-helixtrans-59.1-40.8176.8-54.90000111.6I297 L299 T305I297-T301 WeakPolarHBondContact O-CB 3.47Å; I297-T301 PolarHBondContact O-N 3.35Å; I297-T301 PolarHBondContact O-OG1 2.9Å; L299-T301 VanDerWaalsContact C-N 3.35Å; L299-T301 PolarHBondContact O-N 2.96Å; T301-T305 WeakPolarHBondContact O-CB 3.25Å; T301-T305 PolarHBondContact O-N 3.21Å; T301-T305 PolarHBondContact O-OG1 2.82Å
302F86.4Confident75.5Confident17 Ų1773.3 Ų73.38%0.07538%0.38CS..Hα-helixtrans-63.5-48.7176.2178.6-105.1000111.9N298 L299 I300 R304 T305 V306 M326 I328 Y332 E335 L336N298-F302 VanDerWaalsContact O-CB 3.22Å; N298-F302 WeakPolarHBondContact O-CB 3.4Å; N298-F302 PolarHBondContact O-N 3.28Å; L299-F302 WeakPolarHBondContact O-CB 3.49Å; L299-F302 PolarHBondContact O-N 3.05Å; I300-F302 VanDerWaalsContact C-N 3.28Å; I300-F302 PolarHBondContact O-N 3.37Å; F302-R304 PolarHBondContact O-N 3.19Å; F302-T305 PolarHBondContact O-N 2.99Å; F302-V306 HydrophobicContact CD1-CG2 4.31Å; F302-V306 HydrophobicContact CD2-CG2 4.32Å; F302-V306 HydrophobicContact CE1-CG2 3.9Å; F302-V306 HydrophobicContact CE2-CG2 3.92Å; F302-V306 HydrophobicContact CZ-CG2 3.7Å; F302-V306 WeakPolarHBondContact O-CG2 3.32Å; F302-V306 PolarHBondContact O-N 3.32Å; F302-M326 HydrophobicContact CD2-CE 4.23Å; F302-M326 HydrophobicContact CE2-CE 4.12Å; F302-I328 HydrophobicContact CE2-CG1 4.31Å; F302-I328 HydrophobicContact CE2-CG2 4.41Å; F302-I328 HydrophobicContact CZ-CG2 4.3Å; F302-Y332 HydrophobicContact CB-CD2 3.89Å; F302-Y332 HydrophobicContact CB-CE2 3.86Å; F302-Y332 AromaticContact CD1-CD2 3.89Å; F302-Y332 HydrophobicContact CD1-CD2 3.89Å; F302-Y332 HydrophobicContact CD1-CG 4.22Å; F302-Y332 AromaticContact CD2-CD2 3.69Å; F302-Y332 HydrophobicContact CD2-CD2 3.69Å; F302-Y332 HydrophobicContact CD2-CE2 4.39Å; F302-Y332 HydrophobicContact CE1-CD2 4.34Å; F302-Y332 HydrophobicContact CE1-CG 4.38Å; F302-Y332 HydrophobicContact CE2-CD2 4.15Å; F302-Y332 AromaticContact CG-CD2 3.53Å; F302-Y332 HydrophobicContact CG-CD2 3.53Å; F302-Y332 HydrophobicContact CG-CE2 4.05Å; F302-Y332 HydrophobicContact CG-CG 4.31Å; F302-Y332 HydrophobicContact CZ-CD2 4.45Å; F302-E335 HydrophobicContact CD1-CB 4.22Å; F302-E335 HydrophobicContact CD1-CG 4.01Å; F302-E335 HydrophobicContact CE1-CB 4.01Å; F302-E335 HydrophobicContact CE1-CG 4.21Å; F302-L336 HydrophobicContact CE1-CB 4.26Å; F302-L336 HydrophobicContact CZ-CB 4.08Å
303R85.1Confident77.9Confident102 Ų10269.1 Ų69.139%0.38536%0.355SS..Hα-helixtrans-56-50.2176.6-72.6-178172.8162.45.5111.6L299 I300 T305 V306 Y307 E335 M339L299-R303 WeakPolarHBondContact O-CG 3.34Å; L299-R303 PolarHBondContact O-N 3Å; I300-R303 PolarHBondContact O-N 3.43Å; R303-T305 VanDerWaalsContact C-N 3.33Å; R303-T305 PolarHBondContact O-N 2.88Å; R303-V306 PolarHBondContact O-N 3.29Å; R303-Y307 WeakPolarHBondContact O-CB 3.44Å; R303-Y307 PolarHBondContact O-N 3.48Å; R303-E335 HydrophobicContact CG-CG 4.03Å; R303-E335 IonicContact CZ-OE1 3.66Å; R303-E335 VanDerWaalsContact CZ-OE1 3.26Å; R303-E335 IonicContact CZ-OE2 3.87Å; R303-E335 IonicContact NE-OE1 3.87Å; R303-E335 PolarHBondContact NE-OE1 3.06Å; R303-E335 IonicContact NE-OE2 2.82Å; R303-E335 IonicContact NH2-OE1 3.74Å; R303-E335 PolarHBondContact NH2-OE1 3.08Å; R303-E335 IonicContact NH2-OE2 2.89Å; R303-E335 PolarHBondContact NH2-OE2 2.64Å; R303-M339 HydrophobicContact CB-CE 4.13Å; R303-M339 HydrophobicContact CB-CG 4.27Å; R303-M339 HydrophobicContact CB-SD 3.73Å; R303-M339 HydrophobicContact CG-CG 3.95Å; R303-M339 HydrophobicContact CG-SD 3.59Å; R303-M339 VanDerWaalsContact CG-SD 3.59Å
304R80.7Confident79.9Confident87 Ų8771.4 Ų71.433%0.32837%0.366SS..Hα-helixtrans-56.3-46.9176.5-71178.4-179.1-159.3-1.2111.6E215 E217 I300 F302 V306 Y307 L308E215-R304 IonicContact OE2-CZ 2.97Å; E215-R304 IonicContact OE2-NH1 2.78Å; E215-R304 PolarHBondContact OE2-NH1 3.25Å; E215-R304 IonicContact OE2-NH2 3.2Å; E215-R304 PolarHBondContact OE2-NH2 3.3Å; E217-R304 IonicContact OE1-CZ 3.02Å; E217-R304 IonicContact OE1-NE 2.69Å; E217-R304 PolarHBondContact OE1-NE 2.97Å; E217-R304 IonicContact OE1-NH2 3.35Å; E217-R304 PolarHBondContact OE1-NH2 2.83Å; E217-R304 WeakPolarHBondContact OE2-CG 3.38Å; E217-R304 IonicContact OE2-NE 2.78Å; E217-R304 PolarHBondContact OE2-NE 3.26Å; I300-R304 HydrophobicContact CG2-CG 4.48Å; I300-R304 WeakPolarHBondContact O-CG 3.48Å; I300-R304 PolarHBondContact O-N 3.44Å; F302-R304 PolarHBondContact O-N 3.19Å; R304-V306 PolarHBondContact O-N 3.42Å; R304-Y307 PolarHBondContact O-N 2.89Å; R304-L308 WeakPolarHBondContact O-CB 3.26Å; R304-L308 WeakPolarHBondContact O-CG 2.85Å; R304-L308 PolarHBondContact O-N 3.06Å
305T86.2Confident81.6Confident57 Ų5769.4 Ų69.435%0.3536%0.357SS..Hα-helixtrans-63.2-42.6179.9-52.10000111.9T301 F302 R303 T309 M326T301-T305 WeakPolarHBondContact O-CB 3.25Å; T301-T305 PolarHBondContact O-N 3.21Å; T301-T305 PolarHBondContact O-OG1 2.82Å; F302-T305 PolarHBondContact O-N 2.99Å; R303-T305 VanDerWaalsContact C-N 3.33Å; R303-T305 PolarHBondContact O-N 2.88Å; T305-T309 VanDerWaalsContact O-CB 3.25Å; T305-T309 WeakPolarHBondContact O-CB 3.39Å; T305-T309 PolarHBondContact O-N 3.08Å; T305-T309 PolarHBondContact O-OG1 3.38Å; T305-M326 HydrophobicContact CG2-CE 3.31Å; T305-M326 HydrophobicContact CG2-SD 3.93Å
306V89.9Confident82.7Confident0 Ų068 Ų680%034%0.343CS..Hα-helixtrans-63.5-48176.9171.20000110.8F302 R303 R304 T309 I310 L323 M326 L336 M339F302-V306 HydrophobicContact CD1-CG2 4.31Å; F302-V306 HydrophobicContact CD2-CG2 4.32Å; F302-V306 HydrophobicContact CE1-CG2 3.9Å; F302-V306 HydrophobicContact CE2-CG2 3.92Å; F302-V306 HydrophobicContact CZ-CG2 3.7Å; F302-V306 WeakPolarHBondContact O-CG2 3.32Å; F302-V306 PolarHBondContact O-N 3.32Å; R303-V306 PolarHBondContact O-N 3.29Å; R304-V306 PolarHBondContact O-N 3.42Å; V306-T309 PolarHBondContact O-N 3.11Å; V306-I310 HydrophobicContact CG1-CD1 3.78Å; V306-I310 WeakPolarHBondContact O-CG1 3.36Å; V306-I310 PolarHBondContact O-N 2.9Å; V306-L323 HydrophobicContact CB-CD2 4.27Å; V306-L323 HydrophobicContact CG1-CD2 4Å; V306-L323 HydrophobicContact CG2-CD2 4.12Å; V306-M326 HydrophobicContact CG2-CE 4.15Å; V306-L336 HydrophobicContact CB-CD1 4.4Å; V306-L336 HydrophobicContact CG1-CD1 3.61Å; V306-L336 HydrophobicContact CG2-CD1 3.79Å; V306-M339 HydrophobicContact CB-CB 4.36Å; V306-M339 HydrophobicContact CG1-CB 3.65Å; V306-M339 HydrophobicContact CG1-CG 4.34Å
307Y87.5Confident83.8Confident78 Ų7865.6 Ų65.631%0.30633%0.332SS..Hα-helixtrans-57.7-53.6179.4178.5-93.2000111.7R303 R304 T309 I310 Q311R303-Y307 WeakPolarHBondContact O-CB 3.44Å; R303-Y307 PolarHBondContact O-N 3.48Å; R304-Y307 PolarHBondContact O-N 2.89Å; Y307-T309 VanDerWaalsContact C-N 3.27Å; Y307-T309 PolarHBondContact O-N 2.94Å; Y307-I310 PolarHBondContact O-N 3.37Å; Y307-I310 VanDerWaalsContact O-N 3.14Å; Y307-Q311 HydrophobicContact CD1-CG 4.09Å; Y307-Q311 HydrophobicContact CD2-CG 4.4Å; Y307-Q311 HydrophobicContact CE1-CG 3.69Å; Y307-Q311 HydrophobicContact CE2-CG 4.05Å; Y307-Q311 HydrophobicContact CG-CG 4.42Å; Y307-Q311 WeakPolarHBondContact O-CG 3.26Å; Y307-Q311 PolarHBondContact O-N 3.04Å
308L82.6Confident84.5Confident80 Ų8063.8 Ų63.842%0.41932%0.322SS..Hα-helixtrans-61.1-37179-70.4173.9000112R304 S312R304-L308 WeakPolarHBondContact O-CB 3.26Å; R304-L308 WeakPolarHBondContact O-CG 2.85Å; R304-L308 PolarHBondContact O-N 3.06Å; L308-S312 VanDerWaalsContact O-CB 3.23Å; L308-S312 WeakPolarHBondContact O-CB 3.38Å; L308-S312 PolarHBondContact O-N 3.1Å; L308-S312 PolarHBondContact O-OG 3.17Å
309T85.1Confident85.1Confident20 Ų2060.9 Ų60.912%0.12331%0.306CS..Hα-helixtrans-64.7-42176.5-61.70000111.6T305 V306 Y307 S312 S313 K322 L323T305-T309 VanDerWaalsContact O-CB 3.25Å; T305-T309 WeakPolarHBondContact O-CB 3.39Å; T305-T309 PolarHBondContact O-N 3.08Å; T305-T309 PolarHBondContact O-OG1 3.38Å; V306-T309 PolarHBondContact O-N 3.11Å; Y307-T309 VanDerWaalsContact C-N 3.27Å; Y307-T309 PolarHBondContact O-N 2.94Å; T309-S312 PolarHBondContact O-OG 3.37Å; T309-S313 WeakPolarHBondContact O-CB 3.42Å; T309-S313 PolarHBondContact O-N 3.1Å; T309-S313 PolarHBondContact O-OG 3.34Å; T309-K322 HydrophobicContact CG2-CB 3.44Å; T309-K322 VanDerWaalsContact CG2-CB 3.44Å; T309-K322 HydrophobicContact CG2-CD 4.04Å; T309-K322 HydrophobicContact CG2-CG 4.41Å; T309-L323 HydrophobicContact CG2-CD2 3.82Å; T309-L323 HydrophobicContact CG2-CG 3.91Å
310I88.1Confident85.8Confident5 Ų558.7 Ų58.73%0.02629%0.294CS..Hα-helixtrans-66.8-51.2177.6-70.4169.1000110.5V306 Y307 S312 S313 L323 I340 C343 F353 F354 M357V306-I310 HydrophobicContact CG1-CD1 3.78Å; V306-I310 WeakPolarHBondContact O-CG1 3.36Å; V306-I310 PolarHBondContact O-N 2.9Å; Y307-I310 PolarHBondContact O-N 3.37Å; Y307-I310 VanDerWaalsContact O-N 3.14Å; I310-S312 VanDerWaalsContact C-N 3.33Å; I310-S312 PolarHBondContact O-N 3.13Å; I310-S313 PolarHBondContact O-N 3.09Å; I310-L323 HydrophobicContact CD1-CD1 4.48Å; I310-L323 HydrophobicContact CG1-CD1 4.1Å; I310-I340 HydrophobicContact CD1-CG1 4.12Å; I310-C343 HydrophobicContact CD1-CB 4.5Å; I310-C343 HydrophobicContact CG2-CB 4.46Å; I310-F353 HydrophobicContact CG2-CE1 3.89Å; I310-F353 HydrophobicContact CG2-CZ 4.23Å; I310-F354 HydrophobicContact CG2-CE1 3.96Å; I310-F354 HydrophobicContact CG2-CZ 4.38Å; I310-M357 HydrophobicContact CD1-CE 4.01Å; I310-M357 HydrophobicContact CG1-CE 4.25Å; I310-M357 HydrophobicContact CG1-SD 4.38Å
311Q82.6Confident86.3Confident88 Ų8860.3 Ų60.341%0.41130%0.3SS..Hα-helixtrans-65.6-33.2-175.8-66.5-65-13.500113.5Y307 S313Y307-Q311 HydrophobicContact CD1-CG 4.09Å; Y307-Q311 HydrophobicContact CD2-CG 4.4Å; Y307-Q311 HydrophobicContact CE1-CG 3.69Å; Y307-Q311 HydrophobicContact CE2-CG 4.05Å; Y307-Q311 HydrophobicContact CG-CG 4.42Å; Y307-Q311 WeakPolarHBondContact O-CG 3.26Å; Y307-Q311 PolarHBondContact O-N 3.04Å; Q311-S313 VanDerWaalsContact C-N 3.32Å
312S85.1Confident87Confident83 Ų8360.1 Ų60.158%0.5829%0.293SS*.THydrogen-bonded Turntrans-84.6-2.2179.764.80000114.3L308 T309 I310L308-S312 VanDerWaalsContact O-CB 3.23Å; L308-S312 WeakPolarHBondContact O-CB 3.38Å; L308-S312 PolarHBondContact O-N 3.1Å; L308-S312 PolarHBondContact O-OG 3.17Å; T309-S312 PolarHBondContact O-OG 3.37Å; I310-S312 VanDerWaalsContact C-N 3.33Å; I310-S312 PolarHBondContact O-N 3.13Å
313S87.2Confident87.3Confident15 Ų1559.3 Ų59.311%0.10529%0.29CS..  trans-92.9137.2-177.8-66.70000111.5T309 I310 Q311 A319 K322T309-S313 WeakPolarHBondContact O-CB 3.42Å; T309-S313 PolarHBondContact O-N 3.1Å; T309-S313 PolarHBondContact O-OG 3.34Å; I310-S313 PolarHBondContact O-N 3.09Å; Q311-S313 VanDerWaalsContact C-N 3.32Å; S313-A319 WeakPolarHBondContact OG-CA 3.45Å; S313-K322 PolarHBondContact OG-NZ 3.29Å
314L82Confident87.4Confident160 Ų16058.3 Ų58.384%0.83829%0.292SS*.SBendtrans-76.2-37.3-176.8-178.166.7000112E318L314-E318 WeakPolarHBondContact CB-OE2 3.24Å; L314-E318 PolarHBondContact N-OE2 2.95Å
315D83.1Confident87.7Confident76 Ų7661.5 Ų61.541%0.40631%0.308SS..SBendtrans-137.7167.3179.678.323.5000112.5Q317 E318 A319D315-Q317 VanDerWaalsContact C-N 3.28Å; D315-Q317 PolarHBondContact O-N 2.92Å; D315-Q317 WeakPolarHBondContact OD1-CA 3.4Å; D315-Q317 WeakPolarHBondContact OD1-CB 3.41Å; D315-Q317 PolarHBondContact OD1-N 3.47Å; D315-E318 PolarHBondContact O-N 2.94Å; D315-E318 WeakPolarHBondContact OD1-CB 3.3Å; D315-E318 PolarHBondContact OD1-N 3.41Å; D315-A319 PolarHBondContact O-N 2.92Å; D315-A319 VanDerWaalsContact O-N 3.08Å
316F90.5Very high87.6Confident50 Ų5060.7 Ų60.722%0.21930%0.301CS..Hα-helixtrans-67.2-28.8-175.677.4-80.1000112.4I320 F353 L356 M357F316-I320 HydrophobicContact CD2-CD1 3.81Å; F316-I320 HydrophobicContact CE2-CD1 4.49Å; F316-I320 WeakPolarHBondContact O-CB 3.28Å; F316-I320 WeakPolarHBondContact O-CD1 3.12Å; F316-I320 WeakPolarHBondContact O-CG1 3.23Å; F316-I320 PolarHBondContact O-N 3.35Å; F316-F353 VanDerWaalsContact CA-CE2 3.43Å; F316-F353 HydrophobicContact CB-CD2 3.75Å; F316-F353 HydrophobicContact CB-CE2 3.97Å; F316-F353 HydrophobicContact CB-CG 4.29Å; F316-F353 VanDerWaalsContact N-CE2 3.32Å; F316-L356 HydrophobicContact CB-CB 4.45Å; F316-L356 HydrophobicContact CD1-CB 4.21Å; F316-L356 HydrophobicContact CD1-CD1 3.92Å; F316-L356 HydrophobicContact CD2-CB 3.58Å; F316-L356 HydrophobicContact CE1-CB 4.34Å; F316-L356 HydrophobicContact CE1-CD1 3.76Å; F316-L356 HydrophobicContact CE2-CB 3.71Å; F316-L356 HydrophobicContact CG-CB 3.83Å; F316-L356 HydrophobicContact CG-CD1 4.39Å; F316-L356 HydrophobicContact CZ-CB 4.09Å; F316-L356 HydrophobicContact CZ-CD1 4.07Å; F316-L356 HydrophobicContact CZ-CG 4.48Å; F316-M357 HydrophobicContact CB-CB 4.46Å
317Q91.1Very high86.8Confident90 Ų9068 Ų6842%0.42134%0.34SS..Hα-helixtrans-71.3-42.3179.8-68.2-70.4-24.300110.9D315 H321D315-Q317 VanDerWaalsContact C-N 3.28Å; D315-Q317 PolarHBondContact O-N 2.92Å; D315-Q317 WeakPolarHBondContact OD1-CA 3.4Å; D315-Q317 WeakPolarHBondContact OD1-CB 3.41Å; D315-Q317 PolarHBondContact OD1-N 3.47Å; Q317-H321 WeakPolarHBondContact O-CB 3.33Å; Q317-H321 PolarHBondContact O-N 2.71Å
318E89Confident86.4Confident73 Ų7365.7 Ų65.734%0.34133%0.332SS..Hα-helixtrans-61.3-48173.9-172.5-171.5176.900110.8L314 D315 I320 H321 K322L314-E318 WeakPolarHBondContact CB-OE2 3.24Å; L314-E318 PolarHBondContact N-OE2 2.95Å; D315-E318 PolarHBondContact O-N 2.94Å; D315-E318 WeakPolarHBondContact OD1-CB 3.3Å; D315-E318 PolarHBondContact OD1-N 3.41Å; E318-I320 PolarHBondContact O-N 3.46Å; E318-H321 PolarHBondContact O-N 2.89Å; E318-K322 HydrophobicContact CG-CD 4.39Å; E318-K322 WeakPolarHBondContact O-CG 3.4Å; E318-K322 PolarHBondContact O-N 3.02Å; E318-K322 WeakPolarHBondContact OE1-CE 3.43Å; E318-K322 IonicContact OE1-NZ 3.89Å; E318-K322 PolarHBondContact OE1-NZ 2.71Å
319A91.4Very high86.4Confident0 Ų066.5 Ų66.50%033%0.332CS..Hα-helixtrans-57-49.8178.200000111.5S313 D315 H321 K322 L323 F353 M357S313-A319 WeakPolarHBondContact OG-CA 3.45Å; D315-A319 PolarHBondContact O-N 2.92Å; D315-A319 VanDerWaalsContact O-N 3.08Å; A319-H321 VanDerWaalsContact C-N 3.35Å; A319-H321 PolarHBondContact O-N 3.46Å; A319-K322 PolarHBondContact O-N 3.4Å; A319-L323 WeakPolarHBondContact O-CB 3.04Å; A319-L323 VanDerWaalsContact O-CG 3.24Å; A319-L323 WeakPolarHBondContact O-CG 3.27Å; A319-L323 PolarHBondContact O-N 3.35Å; A319-F353 HydrophobicContact CB-CE2 4.21Å; A319-F353 HydrophobicContact CB-CZ 3.74Å; A319-M357 HydrophobicContact CB-SD 4.15Å
320I91.8Very high86Confident6 Ų671.5 Ų71.53%0.03137%0.365CS..Hα-helixtrans-60.8-44.7177.9-65.5157.9000111.1F316 E318 K322 L323 L324 M357 R360 F361 L364F316-I320 HydrophobicContact CD2-CD1 3.81Å; F316-I320 HydrophobicContact CE2-CD1 4.49Å; F316-I320 WeakPolarHBondContact O-CB 3.28Å; F316-I320 WeakPolarHBondContact O-CD1 3.12Å; F316-I320 WeakPolarHBondContact O-CG1 3.23Å; F316-I320 PolarHBondContact O-N 3.35Å; E318-I320 PolarHBondContact O-N 3.46Å; I320-K322 VanDerWaalsContact C-N 3.32Å; I320-K322 PolarHBondContact O-N 2.98Å; I320-L323 PolarHBondContact O-N 2.96Å; I320-L324 HydrophobicContact CG2-CD1 3.59Å; I320-L324 HydrophobicContact CG2-CG 4.07Å; I320-L324 WeakPolarHBondContact O-CB 3.27Å; I320-L324 VanDerWaalsContact O-CG 3.25Å; I320-L324 WeakPolarHBondContact O-CG 3.35Å; I320-L324 PolarHBondContact O-N 3.22Å; I320-M357 HydrophobicContact CD1-CG 4.32Å; I320-M357 HydrophobicContact CG1-CB 4.44Å; I320-M357 HydrophobicContact CG1-CG 3.75Å; I320-R360 HydrophobicContact CD1-CB 3.59Å; I320-R360 HydrophobicContact CD1-CG 3.67Å; I320-R360 HydrophobicContact CG2-CG 4.33Å; I320-F361 HydrophobicContact CG1-CE2 4Å; I320-F361 HydrophobicContact CG2-CZ 4.36Å; I320-L364 HydrophobicContact CG2-CD1 4.45Å
321H89.8Confident85.7Confident108 Ų10873.9 Ų73.950%0.539%0.391SS..Hα-helixtrans-63.6-38.1-179.4-174.766.4000112.3Q317 E318 A319 K325Q317-H321 WeakPolarHBondContact O-CB 3.33Å; Q317-H321 PolarHBondContact O-N 2.71Å; E318-H321 PolarHBondContact O-N 2.89Å; A319-H321 VanDerWaalsContact C-N 3.35Å; A319-H321 PolarHBondContact O-N 3.46Å; H321-K325 WeakPolarHBondContact NE2-CE 3.22Å; H321-K325 PolarHBondContact NE2-NZ 3.02Å; H321-K325 VanDerWaalsContact O-CG 3.31Å; H321-K325 WeakPolarHBondContact O-CG 3.26Å; H321-K325 PolarHBondContact O-N 3.14Å
322K91.6Very high86Confident67 Ų6771.3 Ų71.329%0.29138%0.378SS..Hα-helixtrans-67.4-47.5173.6-70.9176.5-174.8162.30111.3T309 S313 E318 A319 I320 L324 K325 M326T309-K322 HydrophobicContact CG2-CB 3.44Å; T309-K322 VanDerWaalsContact CG2-CB 3.44Å; T309-K322 HydrophobicContact CG2-CD 4.04Å; T309-K322 HydrophobicContact CG2-CG 4.41Å; S313-K322 PolarHBondContact OG-NZ 3.29Å; E318-K322 HydrophobicContact CG-CD 4.39Å; E318-K322 WeakPolarHBondContact O-CG 3.4Å; E318-K322 PolarHBondContact O-N 3.02Å; E318-K322 WeakPolarHBondContact OE1-CE 3.43Å; E318-K322 IonicContact OE1-NZ 3.89Å; E318-K322 PolarHBondContact OE1-NZ 2.71Å; A319-K322 PolarHBondContact O-N 3.4Å; I320-K322 VanDerWaalsContact C-N 3.32Å; I320-K322 PolarHBondContact O-N 2.98Å; K322-L324 VanDerWaalsContact C-N 3.35Å; K322-L324 PolarHBondContact O-N 2.89Å; K322-K325 WeakPolarHBondContact O-CB 3.25Å; K322-K325 PolarHBondContact O-N 3.03Å; K322-K325 VanDerWaalsContact O-N 3.13Å; K322-M326 PolarHBondContact O-N 3.1Å
323L92.6Very high86.2Confident1 Ų168.4 Ų68.41%0.00536%0.355CS..Hα-helixtrans-61.8-39.6179.4-70.4170.8000112.3V306 T309 I310 A319 I320 K325 M326 L336 M357 F361V306-L323 HydrophobicContact CB-CD2 4.27Å; V306-L323 HydrophobicContact CG1-CD2 4Å; V306-L323 HydrophobicContact CG2-CD2 4.12Å; T309-L323 HydrophobicContact CG2-CD2 3.82Å; T309-L323 HydrophobicContact CG2-CG 3.91Å; I310-L323 HydrophobicContact CD1-CD1 4.48Å; I310-L323 HydrophobicContact CG1-CD1 4.1Å; A319-L323 WeakPolarHBondContact O-CB 3.04Å; A319-L323 VanDerWaalsContact O-CG 3.24Å; A319-L323 WeakPolarHBondContact O-CG 3.27Å; A319-L323 PolarHBondContact O-N 3.35Å; I320-L323 PolarHBondContact O-N 2.96Å; L323-K325 VanDerWaalsContact C-N 3.29Å; L323-K325 PolarHBondContact O-N 3.21Å; L323-M326 HydrophobicContact CD2-SD 3.85Å; L323-M326 WeakPolarHBondContact O-CB 3.42Å; L323-M326 PolarHBondContact O-N 3.05Å; L323-L336 HydrophobicContact CD1-CD1 4.32Å; L323-L336 HydrophobicContact CD2-CD1 4.15Å; L323-M357 HydrophobicContact CD1-SD 4.05Å; L323-F361 HydrophobicContact CB-CZ 3.93Å; L323-F361 HydrophobicContact CD1-CE2 4.03Å; L323-F361 HydrophobicContact CD1-CZ 3.93Å
324L88.9Confident86.5Confident81 Ų8169.2 Ų69.242%0.42436%0.363SS..Hα-helixtrans-72-21176.7-71173.7000113.8I320 K322 M326 F361 L364I320-L324 HydrophobicContact CG2-CD1 3.59Å; I320-L324 HydrophobicContact CG2-CG 4.07Å; I320-L324 WeakPolarHBondContact O-CB 3.27Å; I320-L324 VanDerWaalsContact O-CG 3.25Å; I320-L324 WeakPolarHBondContact O-CG 3.35Å; I320-L324 PolarHBondContact O-N 3.22Å; K322-L324 VanDerWaalsContact C-N 3.35Å; K322-L324 PolarHBondContact O-N 2.89Å; L324-M326 VanDerWaalsContact C-N 3.32Å; L324-F361 HydrophobicContact CD2-CE1 3.88Å; L324-F361 HydrophobicContact CG-CE1 4.28Å; L324-L364 HydrophobicContact CD1-CD1 3.67Å; L324-L364 HydrophobicContact CD2-CD1 4.09Å; L324-L364 HydrophobicContact CG-CD1 4.42Å
325K85.4Confident86.9Confident153 Ų15362.8 Ų62.867%0.66533%0.328SS*.Hα-helixtrans-80.3-16.3173-80.4178.4172.7-1770112.7H321 K322 L323H321-K325 WeakPolarHBondContact NE2-CE 3.22Å; H321-K325 PolarHBondContact NE2-NZ 3.02Å; H321-K325 VanDerWaalsContact O-CG 3.31Å; H321-K325 WeakPolarHBondContact O-CG 3.26Å; H321-K325 PolarHBondContact O-N 3.14Å; K322-K325 WeakPolarHBondContact O-CB 3.25Å; K322-K325 PolarHBondContact O-N 3.03Å; K322-K325 VanDerWaalsContact O-N 3.13Å; L323-K325 VanDerWaalsContact C-N 3.29Å; L323-K325 PolarHBondContact O-N 3.21Å
326M83.8Confident87.4Confident41 Ų4159.1 Ų59.120%0.20231%0.309CS..SBendtrans-68139.8170.5-61.6172.354.700108.6F302 T305 V306 K322 L323 L324 I328F302-M326 HydrophobicContact CD2-CE 4.23Å; F302-M326 HydrophobicContact CE2-CE 4.12Å; T305-M326 HydrophobicContact CG2-CE 3.31Å; T305-M326 HydrophobicContact CG2-SD 3.93Å; V306-M326 HydrophobicContact CG2-CE 4.15Å; K322-M326 PolarHBondContact O-N 3.1Å; L323-M326 HydrophobicContact CD2-SD 3.85Å; L323-M326 WeakPolarHBondContact O-CB 3.42Å; L323-M326 PolarHBondContact O-N 3.05Å; L324-M326 VanDerWaalsContact C-N 3.32Å; M326-I328 HydrophobicContact CB-CG1 4.46Å; M326-I328 PolarHBondContact O-N 3.32Å
327D73Confident87.7Confident154 Ų15456.8 Ų56.882%0.82430%0.298SS*.  trans-74.981.5172.4-164.719.4000108.7K329D327-K329 PolarHBondContact O-N 3.34Å; D327-K329 VanDerWaalsContact O-N 3.08Å
328I80.7Confident87.8Confident28 Ų2854.8 Ų54.814%0.14429%0.291CS..  trans-68.9106.3178.3-57.7165.5000107.2F302 M326 E333 L336F302-I328 HydrophobicContact CE2-CG1 4.31Å; F302-I328 HydrophobicContact CE2-CG2 4.41Å; F302-I328 HydrophobicContact CZ-CG2 4.3Å; M326-I328 HydrophobicContact CB-CG1 4.46Å; M326-I328 PolarHBondContact O-N 3.32Å; I328-E333 HydrophobicContact CG2-CG 4.31Å; I328-L336 HydrophobicContact CD1-CD2 3.74Å
329K81.4Confident88Confident97 Ų9752.4 Ų52.442%0.42228%0.28SS..  trans-61142176-66.5179.5-176.8170.20109.7D327 G331 Y332D327-K329 PolarHBondContact O-N 3.34Å; D327-K329 VanDerWaalsContact O-N 3.08Å; K329-G331 PolarHBondContact O-N 2.97Å; K329-Y332 HydrophobicContact CB-CD2 4.28Å; K329-Y332 HydrophobicContact CB-CG 4.48Å; K329-Y332 HydrophobicContact CD-CE2 4.4Å; K329-Y332 WeakPolarHBondContact O-CB 3.25Å; K329-Y332 PolarHBondContact O-N 2.89Å
330P77.2Confident88.2Confident125 Ų12552.4 Ų52.481%0.81228%0.28SS*.THydrogen-bonded Turntrans-54.3127.2175.5-23.532.1000111.3
331G82Confident88.4Confident55 Ų5552.4 Ų52.457%0.56728%0.28SS*.THydrogen-bonded Turntrans105.5-19.8-175.400000114K329 E333K329-G331 PolarHBondContact O-N 2.97Å; G331-E333 VanDerWaalsContact C-N 3.32Å; G331-E333 WeakPolarHBondContact CA-OE2 3.36Å; G331-E333 PolarHBondContact N-OE2 3.43Å
332Y88.3Confident88.5Confident35 Ų3550.3 Ų50.314%0.13727%0.272CS..THydrogen-bonded Turntrans-85.1-5.5178.4-72.36.5000112.9N298 L299 F302 K329 A334 E335 L336N298-Y332 WeakPolarHBondContact CB-OH 3.36Å; L299-Y332 HydrophobicContact CD2-CD1 3.79Å; L299-Y332 HydrophobicContact CD2-CE1 3.39Å; L299-Y332 HydrophobicContact CG-CE1 3.95Å; F302-Y332 HydrophobicContact CB-CD2 3.89Å; F302-Y332 HydrophobicContact CB-CE2 3.86Å; F302-Y332 AromaticContact CD1-CD2 3.89Å; F302-Y332 HydrophobicContact CD1-CD2 3.89Å; F302-Y332 HydrophobicContact CD1-CG 4.22Å; F302-Y332 AromaticContact CD2-CD2 3.69Å; F302-Y332 HydrophobicContact CD2-CD2 3.69Å; F302-Y332 HydrophobicContact CD2-CE2 4.39Å; F302-Y332 HydrophobicContact CE1-CD2 4.34Å; F302-Y332 HydrophobicContact CE1-CG 4.38Å; F302-Y332 HydrophobicContact CE2-CD2 4.15Å; F302-Y332 AromaticContact CG-CD2 3.53Å; F302-Y332 HydrophobicContact CG-CD2 3.53Å; F302-Y332 HydrophobicContact CG-CE2 4.05Å; F302-Y332 HydrophobicContact CG-CG 4.31Å; F302-Y332 HydrophobicContact CZ-CD2 4.45Å; K329-Y332 HydrophobicContact CB-CD2 4.28Å; K329-Y332 HydrophobicContact CB-CG 4.48Å; K329-Y332 HydrophobicContact CD-CE2 4.4Å; K329-Y332 WeakPolarHBondContact O-CB 3.25Å; K329-Y332 PolarHBondContact O-N 2.89Å; Y332-A334 VanDerWaalsContact C-N 3.27Å; Y332-A334 PolarHBondContact O-N 3.23Å; Y332-E335 WeakPolarHBondContact O-CB 3.36Å; Y332-E335 PolarHBondContact O-N 3.22Å; Y332-E335 VanDerWaalsContact O-N 3.12Å; Y332-L336 PolarHBondContact O-N 3.29Å
333E90.8Very high88.4Confident22 Ų2247.3 Ų47.310%0.10326%0.26CS..Hα-helixtrans-59.8-38.3175.9-65.187.4167.800112.2I328 G331 L336 C337 Y368I328-E333 HydrophobicContact CG2-CG 4.31Å; G331-E333 VanDerWaalsContact C-N 3.32Å; G331-E333 WeakPolarHBondContact CA-OE2 3.36Å; G331-E333 PolarHBondContact N-OE2 3.43Å; E333-L336 PolarHBondContact O-N 2.93Å; E333-C337 PolarHBondContact O-N 3.43Å; E333-C337 VanDerWaalsContact O-N 3.15Å; E333-Y368 HydrophobicContact CB-CD1 4.2Å; E333-Y368 HydrophobicContact CB-CE1 3.65Å; E333-Y368 HydrophobicContact CG-CE1 3.83Å
334A92.1Very high88.5Confident32 Ų3247.2 Ų47.226%0.26426%0.259SS..Hα-helixtrans-62.8-44.617400000111.4Y332 L336 C337 N338Y332-A334 VanDerWaalsContact C-N 3.27Å; Y332-A334 PolarHBondContact O-N 3.23Å; A334-L336 VanDerWaalsContact C-N 3.33Å; A334-L336 PolarHBondContact O-N 2.95Å; A334-C337 WeakPolarHBondContact O-CB 3.5Å; A334-C337 PolarHBondContact O-N 3.36Å; A334-N338 PolarHBondContact O-N 3.45Å
335E90.4Very high88.5Confident24 Ų2443.5 Ų43.511%0.11224%0.24CC..Hα-helixtrans-66.9-36.1179.7-165.357.1-122.800111.6L299 F302 R303 Y332 N338 M339L299-E335 HydrophobicContact CD2-CG 4.23Å; F302-E335 HydrophobicContact CD1-CB 4.22Å; F302-E335 HydrophobicContact CD1-CG 4.01Å; F302-E335 HydrophobicContact CE1-CB 4.01Å; F302-E335 HydrophobicContact CE1-CG 4.21Å; R303-E335 HydrophobicContact CG-CG 4.03Å; R303-E335 IonicContact CZ-OE1 3.66Å; R303-E335 VanDerWaalsContact CZ-OE1 3.26Å; R303-E335 IonicContact CZ-OE2 3.87Å; R303-E335 IonicContact NE-OE1 3.87Å; R303-E335 PolarHBondContact NE-OE1 3.06Å; R303-E335 IonicContact NE-OE2 2.82Å; R303-E335 IonicContact NH2-OE1 3.74Å; R303-E335 PolarHBondContact NH2-OE1 3.08Å; R303-E335 IonicContact NH2-OE2 2.89Å; R303-E335 PolarHBondContact NH2-OE2 2.64Å; Y332-E335 WeakPolarHBondContact O-CB 3.36Å; Y332-E335 PolarHBondContact O-N 3.22Å; Y332-E335 VanDerWaalsContact O-N 3.12Å; E335-N338 WeakPolarHBondContact O-CB 3.44Å; E335-N338 PolarHBondContact O-N 3.39Å; E335-M339 WeakPolarHBondContact O-CB 3.45Å; E335-M339 WeakPolarHBondContact O-CG 3.44Å; E335-M339 PolarHBondContact O-N 3.31Å
336L93.9Very high88.6Confident0 Ų042.8 Ų42.80%024%0.239CC..Hα-helixtrans-60.8-46.5172.6179.659.3000111.5F302 V306 L323 I328 Y332 E333 A334 N338 M339 I340 F361 Y368F302-L336 HydrophobicContact CE1-CB 4.26Å; F302-L336 HydrophobicContact CZ-CB 4.08Å; V306-L336 HydrophobicContact CB-CD1 4.4Å; V306-L336 HydrophobicContact CG1-CD1 3.61Å; V306-L336 HydrophobicContact CG2-CD1 3.79Å; L323-L336 HydrophobicContact CD1-CD1 4.32Å; L323-L336 HydrophobicContact CD2-CD1 4.15Å; I328-L336 HydrophobicContact CD1-CD2 3.74Å; Y332-L336 PolarHBondContact O-N 3.29Å; E333-L336 PolarHBondContact O-N 2.93Å; A334-L336 VanDerWaalsContact C-N 3.33Å; A334-L336 PolarHBondContact O-N 2.95Å; L336-N338 VanDerWaalsContact C-N 3.33Å; L336-N338 PolarHBondContact O-N 3.11Å; L336-M339 PolarHBondContact O-N 3.19Å; L336-I340 HydrophobicContact CD1-CD1 4.28Å; L336-I340 HydrophobicContact CD1-CG1 4.46Å; L336-I340 HydrophobicContact CG-CD1 4.15Å; L336-I340 VanDerWaalsContact O-CG1 3.29Å; L336-I340 WeakPolarHBondContact O-CG1 3.4Å; L336-I340 PolarHBondContact O-N 3.04Å; L336-F361 HydrophobicContact CD2-CD1 4.43Å; L336-F361 HydrophobicContact CD2-CE1 3.87Å; L336-F361 HydrophobicContact CD2-CZ 4.07Å; L336-Y368 HydrophobicContact CD2-CE1 4Å
337C96.1Very high88.8Confident0 Ų042.9 Ų42.90%024%0.239CC..Hα-helixtrans-60.8-41.9175.7-73.80000112E333 A334 I340 L341 H371 F372 L375E333-C337 PolarHBondContact O-N 3.43Å; E333-C337 VanDerWaalsContact O-N 3.15Å; A334-C337 WeakPolarHBondContact O-CB 3.5Å; A334-C337 PolarHBondContact O-N 3.36Å; C337-I340 PolarHBondContact O-N 3.03Å; C337-L341 PolarHBondContact O-N 3.47Å; C337-L341 VanDerWaalsContact O-N 3.08Å; C337-H371 HydrophobicContact CB-CB 4.02Å; C337-F372 HydrophobicContact CB-CD1 4.44Å; C337-F372 HydrophobicContact CB-CE1 4.15Å; C337-F372 HydrophobicContact CB-CE2 4.24Å; C337-F372 HydrophobicContact CB-CZ 4.04Å; C337-F372 WeakPolarHBondContact SG-CE2 3.37Å; C337-L375 HydrophobicContact CB-CD1 3.64Å
338N93.4Very high89.4Confident48 Ų4845 Ų4526%0.25724%0.235SC..Hα-helixtrans-57.1-52.9173.7-88.9-42000111.2A334 E335 L336 I340 L341 D342 L375A334-N338 PolarHBondContact O-N 3.45Å; E335-N338 WeakPolarHBondContact O-CB 3.44Å; E335-N338 PolarHBondContact O-N 3.39Å; L336-N338 VanDerWaalsContact C-N 3.33Å; L336-N338 PolarHBondContact O-N 3.11Å; N338-I340 VanDerWaalsContact C-N 3.31Å; N338-I340 PolarHBondContact O-N 2.97Å; N338-L341 WeakPolarHBondContact O-CB 3.46Å; N338-L341 PolarHBondContact O-N 3.38Å; N338-L341 VanDerWaalsContact O-N 3.08Å; N338-D342 PolarHBondContact O-N 3.31Å; N338-L375 WeakPolarHBondContact OD1-CD2 3.3Å
339M93.8Very high89.7Confident23 Ų2347.5 Ų47.511%0.11325%0.252CS..Hα-helixtrans-61.1-38.2-179.2-72.5-57.1-57.600112.6R303 V306 E335 L336 D342 C343R303-M339 HydrophobicContact CB-CE 4.13Å; R303-M339 HydrophobicContact CB-CG 4.27Å; R303-M339 HydrophobicContact CB-SD 3.73Å; R303-M339 HydrophobicContact CG-CG 3.95Å; R303-M339 HydrophobicContact CG-SD 3.59Å; R303-M339 VanDerWaalsContact CG-SD 3.59Å; V306-M339 HydrophobicContact CB-CB 4.36Å; V306-M339 HydrophobicContact CG1-CB 3.65Å; V306-M339 HydrophobicContact CG1-CG 4.34Å; E335-M339 WeakPolarHBondContact O-CB 3.45Å; E335-M339 WeakPolarHBondContact O-CG 3.44Å; E335-M339 PolarHBondContact O-N 3.31Å; L336-M339 PolarHBondContact O-N 3.19Å; M339-D342 PolarHBondContact O-N 2.88Å; M339-C343 VanDerWaalsContact O-CB 3.26Å; M339-C343 WeakPolarHBondContact O-CB 3.31Å; M339-C343 PolarHBondContact O-N 3.07Å; M339-C343 PolarHBondContact O-SG 3.08Å
340I94.7Very high90.3Very high0 Ų044.3 Ų44.30%024%0.238CC..Hα-helixtrans-61.4-45.7174.3-71169.1000111I310 L336 C337 N338 C344 M357 A358 F361 F372I310-I340 HydrophobicContact CD1-CG1 4.12Å; L336-I340 HydrophobicContact CD1-CD1 4.28Å; L336-I340 HydrophobicContact CD1-CG1 4.46Å; L336-I340 HydrophobicContact CG-CD1 4.15Å; L336-I340 VanDerWaalsContact O-CG1 3.29Å; L336-I340 WeakPolarHBondContact O-CG1 3.4Å; L336-I340 PolarHBondContact O-N 3.04Å; C337-I340 PolarHBondContact O-N 3.03Å; N338-I340 VanDerWaalsContact C-N 3.31Å; N338-I340 PolarHBondContact O-N 2.97Å; I340-C344 WeakPolarHBondContact O-CB 3.4Å; I340-C344 PolarHBondContact O-N 3.04Å; I340-M357 HydrophobicContact CB-CE 4.24Å; I340-M357 HydrophobicContact CD1-CE 4.31Å; I340-M357 HydrophobicContact CD1-CG 4.43Å; I340-M357 HydrophobicContact CG1-CE 3.79Å; I340-M357 HydrophobicContact CG1-SD 4.5Å; I340-M357 HydrophobicContact CG2-CE 3.72Å; I340-A358 HydrophobicContact CG2-CB 4.42Å; I340-F361 HydrophobicContact CD1-CD2 3.71Å; I340-F361 HydrophobicContact CD1-CE2 3.74Å; I340-F372 HydrophobicContact CB-CZ 4.37Å; I340-F372 HydrophobicContact CD1-CZ 4.39Å; I340-F372 HydrophobicContact CG2-CE1 4.41Å; I340-F372 HydrophobicContact CG2-CZ 4.09Å
341L95.9Very high91Very high7 Ų742.6 Ų42.64%0.03722%0.219CC..Hα-helixtrans-64.4-47.6177.8168.967.5000111.1C337 N338 C344 A345 L375 V379 L397 F398C337-L341 PolarHBondContact O-N 3.47Å; C337-L341 VanDerWaalsContact O-N 3.08Å; N338-L341 WeakPolarHBondContact O-CB 3.46Å; N338-L341 PolarHBondContact O-N 3.38Å; N338-L341 VanDerWaalsContact O-N 3.08Å; L341-C344 CarbonylContact O-C 3.22Å; L341-C344 WeakPolarHBondContact O-CB 3.21Å; L341-C344 PolarHBondContact O-N 3.24Å; L341-C344 VanDerWaalsContact O-N 3.16Å; L341-A345 VanDerWaalsContact O-CB 3.26Å; L341-A345 WeakPolarHBondContact O-CB 3.36Å; L341-A345 PolarHBondContact O-N 3.37Å; L341-L375 HydrophobicContact CD2-CB 4.23Å; L341-L375 HydrophobicContact CD2-CD1 4.32Å; L341-V379 HydrophobicContact CD2-CG2 3.45Å; L341-V379 VanDerWaalsContact CD2-CG2 3.45Å; L341-L397 HydrophobicContact CB-CD2 4.39Å; L341-L397 HydrophobicContact CD1-CD2 3.74Å; L341-F398 HydrophobicContact CD1-CE2 4.08Å; L341-F398 HydrophobicContact CD1-CZ 4.23Å; L341-F398 HydrophobicContact CD2-CZ 4.32Å
342D91.5Very high91.6Very high64 Ų6446.2 Ų46.234%0.34222%0.219SC..Hα-helixtrans-64.9-41.4-179.6-82.3-37.6000111.7N338 M339 C344 A345 Q346 K390N338-D342 PolarHBondContact O-N 3.31Å; M339-D342 PolarHBondContact O-N 2.88Å; D342-C344 VanDerWaalsContact C-N 3.3Å; D342-C344 PolarHBondContact O-N 3.11Å; D342-A345 PolarHBondContact O-N 2.95Å; D342-A345 VanDerWaalsContact O-N 3.1Å; D342-Q346 WeakPolarHBondContact O-CB 3.28Å; D342-Q346 PolarHBondContact O-N 2.94Å; D342-K390 IonicContact OD1-NZ 2.97Å; D342-K390 PolarHBondContact OD1-NZ 3.09Å
343C91.1Very high91.9Very high3 Ų346.1 Ų46.12%0.0222%0.219CC..Hα-helixtrans-58.3-43172.1-69.50000111.5I310 M339 A345 Q347 F354I310-C343 HydrophobicContact CD1-CB 4.5Å; I310-C343 HydrophobicContact CG2-CB 4.46Å; M339-C343 VanDerWaalsContact O-CB 3.26Å; M339-C343 WeakPolarHBondContact O-CB 3.31Å; M339-C343 PolarHBondContact O-N 3.07Å; M339-C343 PolarHBondContact O-SG 3.08Å; C343-A345 VanDerWaalsContact C-N 3.34Å; C343-Q347 WeakPolarHBondContact O-CG 3.42Å; C343-F354 HydrophobicContact CB-CD1 4.46Å; C343-F354 HydrophobicContact CB-CE1 3.57Å; C343-F354 HydrophobicContact CB-CZ 4.17Å
344C93.4Very high92.2Very high0 Ų045.3 Ų45.30%022%0.215CC..Hα-helixtrans-64.2-40175.2-177.60000111.9I340 L341 D342 F354 N393 L397I340-C344 WeakPolarHBondContact O-CB 3.4Å; I340-C344 PolarHBondContact O-N 3.04Å; L341-C344 CarbonylContact O-C 3.22Å; L341-C344 WeakPolarHBondContact O-CB 3.21Å; L341-C344 PolarHBondContact O-N 3.24Å; L341-C344 VanDerWaalsContact O-N 3.16Å; D342-C344 VanDerWaalsContact C-N 3.3Å; D342-C344 PolarHBondContact O-N 3.11Å; C344-F354 HydrophobicContact CB-CB 3.69Å; C344-F354 HydrophobicContact CB-CD1 3.65Å; C344-F354 HydrophobicContact CB-CD2 3.96Å; C344-F354 HydrophobicContact CB-CE1 4.29Å; C344-F354 HydrophobicContact CB-CG 3.47Å; C344-F354 VanDerWaalsContact CB-CG 3.47Å; C344-N393 WeakPolarHBondContact O-CB 3.34Å; C344-N393 PolarHBondContact O-ND2 2.87Å; C344-L397 HydrophobicContact CB-CD2 4.18Å
345A89.5Confident92.5Very high2 Ų243.8 Ų43.82%0.01720%0.203CC..Hα-helixtrans-76.8-28-172.600000112.3L341 D342 C343 Q347 K390L341-A345 VanDerWaalsContact O-CB 3.26Å; L341-A345 WeakPolarHBondContact O-CB 3.36Å; L341-A345 PolarHBondContact O-N 3.37Å; D342-A345 PolarHBondContact O-N 2.95Å; D342-A345 VanDerWaalsContact O-N 3.1Å; C343-A345 VanDerWaalsContact C-N 3.34Å; A345-Q347 VanDerWaalsContact C-N 3.33Å; A345-K390 HydrophobicContact CB-CD 4.38Å; A345-K390 HydrophobicContact CB-CG 3.53Å; A345-K390 WeakPolarHBondContact O-CA 3.42Å
346Q88.3Confident92.8Very high139 Ų13944.5 Ų44.565%0.6521%0.207SC*.Hα-helixtrans-76.3-17.4176.3-165.161.615.500113.6D342D342-Q346 WeakPolarHBondContact O-CB 3.28Å; D342-Q346 PolarHBondContact O-N 2.94Å
347Q87Confident92.9Very high43 Ų4344.5 Ų44.520%0.20121%0.207CC..SBendtrans-62.7145.9177.5-65.4-56.4-31.700112.1C343 A345 T349 F354 T389 N393C343-Q347 WeakPolarHBondContact O-CG 3.42Å; A345-Q347 VanDerWaalsContact C-N 3.33Å; Q347-T349 VanDerWaalsContact C-N 3.27Å; Q347-T349 WeakPolarHBondContact CB-O 3.26Å; Q347-T349 PolarHBondContact O-N 3.34Å; Q347-F354 HydrophobicContact CG-CE2 3.65Å; Q347-F354 HydrophobicContact CG-CZ 4.06Å; Q347-T389 WeakPolarHBondContact O-CG2 3.39Å; Q347-N393 PolarHBondContact O-ND2 3.41Å
348R86.2Confident92.9Very high198 Ų19844.5 Ų44.575%0.74721%0.207SC*.SBendtrans-61.4-38.8175.5-173.4177.9-179.7-179.12.4112R392R348-R392 PolarHBondContact O-NH2 2.81Å
349T87.6Confident93.1Very high81 Ų8143.3 Ų43.350%0.49720%0.2SC..SBendtrans-132.1147.9178.248.80000110.1Q347 E351Q347-T349 VanDerWaalsContact C-N 3.27Å; Q347-T349 WeakPolarHBondContact CB-O 3.26Å; Q347-T349 PolarHBondContact O-N 3.34Å; T349-E351 PolarHBondContact O-N 2.98Å
350Y93.4Very high93.2Very high29 Ų2947.4 Ų47.411%0.11421%0.214CC..  trans-62.7127.3175176.5-106.5000111.1N393 R396 L397Y350-N393 PolarHBondContact N-OD1 3.16Å; Y350-N393 VanDerWaalsContact N-OD1 3.15Å; Y350-R396 HydrophobicContact CD1-CB 3.69Å; Y350-R396 HydrophobicContact CD1-CG 4.3Å; Y350-R396 HydrophobicContact CD2-CB 3.55Å; Y350-R396 HydrophobicContact CE1-CB 3.91Å; Y350-R396 HydrophobicContact CE2-CB 3.81Å; Y350-R396 HydrophobicContact CG-CB 3.49Å; Y350-R396 VanDerWaalsContact CG-CB 3.49Å; Y350-R396 HydrophobicContact CG-CG 4.19Å; Y350-L397 HydrophobicContact CE2-CB 4.02Å
351E92.1Very high93.3Very high89 Ų8947.4 Ų47.442%0.41621%0.214SC..  trans-110.1133.5174.6-61.5-170.8168.300110.5T349 F353 F354T349-E351 PolarHBondContact O-N 2.98Å; E351-F353 HydrophobicContact CB-CB 4.29Å; E351-F353 PolarHBondContact O-N 3.39Å; E351-F354 HydrophobicContact CB-CD2 4.18Å; E351-F354 HydrophobicContact CB-CE2 4.34Å; E351-F354 PolarHBondContact O-N 2.93Å
352K94.3Very high93.3Very high131 Ų13147.6 Ų47.657%0.5722%0.216SC*.Hα-helixtrans-59.2-22.4178.6-168.6178.6179.81790113F354 G355 L356K352-F354 PolarHBondContact O-N 2.92Å; K352-G355 PolarHBondContact O-N 3.26Å; K352-L356 HydrophobicContact CD-CD1 4.24Å; K352-L356 HydrophobicContact CG-CD1 3.94Å; K352-L356 HydrophobicContact CG-CG 4.03Å; K352-L356 WeakPolarHBondContact O-CG 3.36Å; K352-L356 PolarHBondContact O-N 2.91Å
353F95.1Very high93.4Very high34 Ų3451.6 Ų51.615%0.14923%0.226CC..Hα-helixtrans-44.7-48.5173.1171.9-85.1000112.4I310 F316 A319 E351 M357I310-F353 HydrophobicContact CG2-CE1 3.89Å; I310-F353 HydrophobicContact CG2-CZ 4.23Å; F316-F353 VanDerWaalsContact CA-CE2 3.43Å; F316-F353 HydrophobicContact CB-CD2 3.75Å; F316-F353 HydrophobicContact CB-CE2 3.97Å; F316-F353 HydrophobicContact CB-CG 4.29Å; F316-F353 VanDerWaalsContact N-CE2 3.32Å; A319-F353 HydrophobicContact CB-CE2 4.21Å; A319-F353 HydrophobicContact CB-CZ 3.74Å; E351-F353 HydrophobicContact CB-CB 4.29Å; E351-F353 PolarHBondContact O-N 3.39Å; F353-M357 HydrophobicContact CD1-CE 4.49Å; F353-M357 HydrophobicContact CE1-CE 3.81Å; F353-M357 HydrophobicContact CE1-SD 4.22Å; F353-M357 HydrophobicContact CZ-SD 4.43Å; F353-M357 WeakPolarHBondContact O-CB 3.37Å; F353-M357 PolarHBondContact O-N 3.29Å
354F97Very high93.5Very high4 Ų455.1 Ų55.12%0.01824%0.244CC..Hα-helixtrans-71.4-40.2-176.6-65.8-80.9000112.7I310 C343 C344 Q347 E351 K352 M357 A358 L397I310-F354 HydrophobicContact CG2-CE1 3.96Å; I310-F354 HydrophobicContact CG2-CZ 4.38Å; C343-F354 HydrophobicContact CB-CD1 4.46Å; C343-F354 HydrophobicContact CB-CE1 3.57Å; C343-F354 HydrophobicContact CB-CZ 4.17Å; C344-F354 HydrophobicContact CB-CB 3.69Å; C344-F354 HydrophobicContact CB-CD1 3.65Å; C344-F354 HydrophobicContact CB-CD2 3.96Å; C344-F354 HydrophobicContact CB-CE1 4.29Å; C344-F354 HydrophobicContact CB-CG 3.47Å; C344-F354 VanDerWaalsContact CB-CG 3.47Å; Q347-F354 HydrophobicContact CG-CE2 3.65Å; Q347-F354 HydrophobicContact CG-CZ 4.06Å; E351-F354 HydrophobicContact CB-CD2 4.18Å; E351-F354 HydrophobicContact CB-CE2 4.34Å; E351-F354 PolarHBondContact O-N 2.93Å; K352-F354 PolarHBondContact O-N 2.92Å; F354-M357 HydrophobicContact CD1-CE 3.87Å; F354-M357 HydrophobicContact CE1-CE 4.3Å; F354-M357 PolarHBondContact O-N 3.46Å; F354-A358 WeakPolarHBondContact O-CB 3.4Å; F354-A358 PolarHBondContact O-N 3.45Å; F354-L397 HydrophobicContact CB-CD1 4.02Å
355G96.7Very high93.4Very high0 Ų059.8 Ų59.80%027%0.265CS..Hα-helixtrans-60.2-46174.800000112.5K352 M357 E359 H400K352-G355 PolarHBondContact O-N 3.26Å; G355-M357 VanDerWaalsContact C-N 3.34Å; G355-M357 PolarHBondContact O-N 2.94Å; G355-E359 VanDerWaalsContact O-CB 3.22Å; G355-E359 WeakPolarHBondContact O-CB 3.26Å; G355-E359 PolarHBondContact O-N 2.72Å; G355-H400 VanDerWaalsContact C-CD2 3.48Å; G355-H400 PolarHBondContact O-CD2 3.47Å; G355-H400 VanDerWaalsContact O-CD2 3.31Å; G355-H400 PolarHBondContact O-NE2 2.92Å
356L97.4Very high93.6Very high39 Ų3966 Ų6620%0.20429%0.294CS..Hα-helixtrans-66-36.5177.1-67.7169.7000112.4F316 K352 R360F316-L356 HydrophobicContact CB-CB 4.45Å; F316-L356 HydrophobicContact CD1-CB 4.21Å; F316-L356 HydrophobicContact CD1-CD1 3.92Å; F316-L356 HydrophobicContact CD2-CB 3.58Å; F316-L356 HydrophobicContact CE1-CB 4.34Å; F316-L356 HydrophobicContact CE1-CD1 3.76Å; F316-L356 HydrophobicContact CE2-CB 3.71Å; F316-L356 HydrophobicContact CG-CB 3.83Å; F316-L356 HydrophobicContact CG-CD1 4.39Å; F316-L356 HydrophobicContact CZ-CB 4.09Å; F316-L356 HydrophobicContact CZ-CD1 4.07Å; F316-L356 HydrophobicContact CZ-CG 4.48Å; K352-L356 HydrophobicContact CD-CD1 4.24Å; K352-L356 HydrophobicContact CG-CD1 3.94Å; K352-L356 HydrophobicContact CG-CG 4.03Å; K352-L356 WeakPolarHBondContact O-CG 3.36Å; K352-L356 PolarHBondContact O-N 2.91Å; L356-R360 WeakPolarHBondContact O-CB 3.43Å; L356-R360 PolarHBondContact O-N 3.33Å; L356-R360 VanDerWaalsContact O-N 3.12Å
357M95.5Very high93.8Very high0 Ų064.1 Ų64.10%029%0.285CS..Hα-helixtrans-65.5-52.8176.2-177.3167.560.200111.8I310 F316 A319 I320 L323 I340 F353 F354 G355 E359 R360 F361I310-M357 HydrophobicContact CD1-CE 4.01Å; I310-M357 HydrophobicContact CG1-CE 4.25Å; I310-M357 HydrophobicContact CG1-SD 4.38Å; F316-M357 HydrophobicContact CB-CB 4.46Å; A319-M357 HydrophobicContact CB-SD 4.15Å; I320-M357 HydrophobicContact CD1-CG 4.32Å; I320-M357 HydrophobicContact CG1-CB 4.44Å; I320-M357 HydrophobicContact CG1-CG 3.75Å; L323-M357 HydrophobicContact CD1-SD 4.05Å; I340-M357 HydrophobicContact CB-CE 4.24Å; I340-M357 HydrophobicContact CD1-CE 4.31Å; I340-M357 HydrophobicContact CD1-CG 4.43Å; I340-M357 HydrophobicContact CG1-CE 3.79Å; I340-M357 HydrophobicContact CG1-SD 4.5Å; I340-M357 HydrophobicContact CG2-CE 3.72Å; F353-M357 HydrophobicContact CD1-CE 4.49Å; F353-M357 HydrophobicContact CE1-CE 3.81Å; F353-M357 HydrophobicContact CE1-SD 4.22Å; F353-M357 HydrophobicContact CZ-SD 4.43Å; F353-M357 WeakPolarHBondContact O-CB 3.37Å; F353-M357 PolarHBondContact O-N 3.29Å; F354-M357 HydrophobicContact CD1-CE 3.87Å; F354-M357 HydrophobicContact CE1-CE 4.3Å; F354-M357 PolarHBondContact O-N 3.46Å; G355-M357 VanDerWaalsContact C-N 3.34Å; G355-M357 PolarHBondContact O-N 2.94Å; M357-E359 PolarHBondContact O-N 3.06Å; M357-R360 PolarHBondContact O-N 2.73Å; M357-R360 VanDerWaalsContact O-N 3.15Å; M357-F361 HydrophobicContact CG-CD2 3.91Å; M357-F361 HydrophobicContact CG-CE2 3.72Å; M357-F361 VanDerWaalsContact O-CD2 3.3Å; M357-F361 WeakPolarHBondContact O-CD2 3.47Å; M357-F361 PolarHBondContact O-N 3.32Å; M357-F361 HydrophobicContact SD-CE2 4.34Å
358A97.3Very high94.2Very high0 Ų062.3 Ų62.30%028%0.276CS..Hα-helixtrans-61.4-43.1178.500000111.9I340 F354 R360 F361 C362 F372 L397 L401I340-A358 HydrophobicContact CG2-CB 4.42Å; F354-A358 WeakPolarHBondContact O-CB 3.4Å; F354-A358 PolarHBondContact O-N 3.45Å; A358-R360 VanDerWaalsContact C-N 3.28Å; A358-R360 PolarHBondContact O-N 3.24Å; A358-F361 PolarHBondContact O-N 3.42Å; A358-C362 PolarHBondContact O-N 3.23Å; A358-C362 PolarHBondContact O-SG 3.36Å; A358-C362 VanDerWaalsContact O-SG 3.35Å; A358-F372 HydrophobicContact CB-CE1 4.03Å; A358-F372 HydrophobicContact CB-CE2 3.84Å; A358-F372 HydrophobicContact CB-CZ 3.53Å; A358-L397 HydrophobicContact CB-CD1 4.22Å; A358-L401 HydrophobicContact CB-CD1 4.23Å; A358-L401 HydrophobicContact CB-CD2 3.75Å; A358-L401 HydrophobicContact CB-CG 4.39Å
359E97.1Very high94.6Very high24 Ų2455.1 Ų55.111%0.11225%0.251CS..Hα-helixtrans-53.2-45.3172.7166.9-176.117100111.7G355 M357 C362 R363 H400 S406G355-E359 VanDerWaalsContact O-CB 3.22Å; G355-E359 WeakPolarHBondContact O-CB 3.26Å; G355-E359 PolarHBondContact O-N 2.72Å; M357-E359 PolarHBondContact O-N 3.06Å; E359-C362 PolarHBondContact O-N 3.22Å; E359-R363 WeakPolarHBondContact O-CG 3.25Å; E359-R363 PolarHBondContact O-N 2.88Å; E359-R363 IonicContact OE1-CZ 3.83Å; E359-R363 IonicContact OE1-NE 3.3Å; E359-R363 IonicContact OE1-NH1 3.01Å; E359-R363 PolarHBondContact OE1-NH1 2.97Å; E359-R363 IonicContact OE1-NH2 3.14Å; E359-R363 PolarHBondContact OE1-NH2 2.98Å; E359-H400 IonicContact OE2-CD2 2.7Å; E359-H400 IonicContact OE2-CE1 2.7Å; E359-H400 IonicContact OE2-NE2 2.94Å; E359-H400 PolarHBondContact OE2-NE2 2.7Å; E359-S406 WeakPolarHBondContact CG-OG 3.11Å
360R96.1Very high95Very high109 Ų10955.8 Ų55.841%0.41125%0.248SC..Hα-helixtrans-68.7-40.7-178.6-172.758.8169-164.50.3111.9I320 L356 M357 A358 R363 L364I320-R360 HydrophobicContact CD1-CB 3.59Å; I320-R360 HydrophobicContact CD1-CG 3.67Å; I320-R360 HydrophobicContact CG2-CG 4.33Å; L356-R360 WeakPolarHBondContact O-CB 3.43Å; L356-R360 PolarHBondContact O-N 3.33Å; L356-R360 VanDerWaalsContact O-N 3.12Å; M357-R360 PolarHBondContact O-N 2.73Å; M357-R360 VanDerWaalsContact O-N 3.15Å; A358-R360 VanDerWaalsContact C-N 3.28Å; A358-R360 PolarHBondContact O-N 3.24Å; R360-R363 PolarHBondContact O-N 2.84Å; R360-L364 HydrophobicContact CG-CD1 4.41Å; R360-L364 VanDerWaalsContact O-CG 3.27Å; R360-L364 WeakPolarHBondContact O-CG 3.33Å; R360-L364 PolarHBondContact O-N 3.2Å; R360-L364 VanDerWaalsContact O-N 3.11Å
361F95.9Very high95.1Very high0 Ų057.2 Ų57.20%026%0.256CS..Hα-helixtrans-61.4-46174.2-82.5-71.4000111.9I320 L323 L324 L336 I340 M357 A358 R363 L364 K365 Y368I320-F361 HydrophobicContact CG1-CE2 4Å; I320-F361 HydrophobicContact CG2-CZ 4.36Å; L323-F361 HydrophobicContact CB-CZ 3.93Å; L323-F361 HydrophobicContact CD1-CE2 4.03Å; L323-F361 HydrophobicContact CD1-CZ 3.93Å; L324-F361 HydrophobicContact CD2-CE1 3.88Å; L324-F361 HydrophobicContact CG-CE1 4.28Å; L336-F361 HydrophobicContact CD2-CD1 4.43Å; L336-F361 HydrophobicContact CD2-CE1 3.87Å; L336-F361 HydrophobicContact CD2-CZ 4.07Å; I340-F361 HydrophobicContact CD1-CD2 3.71Å; I340-F361 HydrophobicContact CD1-CE2 3.74Å; M357-F361 HydrophobicContact CG-CD2 3.91Å; M357-F361 HydrophobicContact CG-CE2 3.72Å; M357-F361 VanDerWaalsContact O-CD2 3.3Å; M357-F361 WeakPolarHBondContact O-CD2 3.47Å; M357-F361 PolarHBondContact O-N 3.32Å; M357-F361 HydrophobicContact SD-CE2 4.34Å; A358-F361 PolarHBondContact O-N 3.42Å; F361-R363 VanDerWaalsContact C-N 3.25Å; F361-R363 PolarHBondContact O-N 3.02Å; F361-L364 PolarHBondContact O-N 3.18Å; F361-K365 PolarHBondContact O-N 3.37Å; F361-Y368 HydrophobicContact CB-CD2 4.18Å; F361-Y368 HydrophobicContact CB-CG 4.12Å; F361-Y368 HydrophobicContact CD1-CD2 4.14Å; F361-Y368 HydrophobicContact CD1-CE1 4.37Å; F361-Y368 AromaticContact CD1-CE2 3.89Å; F361-Y368 HydrophobicContact CD1-CE2 3.89Å; F361-Y368 HydrophobicContact CD1-CG 4.5Å; F361-Y368 WeakPolarHBondContact O-CD2 3.15Å
362C96.5Very high95.4Very high10 Ų1053 Ų537%0.06824%0.236CC..Hα-helixtrans-57.4-37.9175.2-680000112.6A358 E359 L364 Q369 F372 S406A358-C362 PolarHBondContact O-N 3.23Å; A358-C362 PolarHBondContact O-SG 3.36Å; A358-C362 VanDerWaalsContact O-SG 3.35Å; E359-C362 PolarHBondContact O-N 3.22Å; C362-L364 VanDerWaalsContact C-N 3.34Å; C362-Q369 HydrophobicContact CB-CB 4.4Å; C362-F372 VanDerWaalsContact SG-CD2 3.54Å; C362-S406 VanDerWaalsContact CB-O 3.29Å; C362-S406 WeakPolarHBondContact CB-O 3.47Å
363R94.3Very high95.5Very high148 Ų14847.3 Ų47.356%0.55821%0.212SC*.Hα-helixtrans-72.9-22.5176.6-74.1-176.9179.4151.311.2114.4E359 R360 F361E359-R363 WeakPolarHBondContact O-CG 3.25Å; E359-R363 PolarHBondContact O-N 2.88Å; E359-R363 IonicContact OE1-CZ 3.83Å; E359-R363 IonicContact OE1-NE 3.3Å; E359-R363 IonicContact OE1-NH1 3.01Å; E359-R363 PolarHBondContact OE1-NH1 2.97Å; E359-R363 IonicContact OE1-NH2 3.14Å; E359-R363 PolarHBondContact OE1-NH2 2.98Å; R360-R363 PolarHBondContact O-N 2.84Å; F361-R363 VanDerWaalsContact C-N 3.25Å; F361-R363 PolarHBondContact O-N 3.02Å
364L92.5Very high95.5Very high77 Ų7748.6 Ų48.640%0.40323%0.225SC..Hα-helixtrans-80-44.5-179.3-74.3168.5000111.9I320 L324 R360 F361 C362I320-L364 HydrophobicContact CG2-CD1 4.45Å; L324-L364 HydrophobicContact CD1-CD1 3.67Å; L324-L364 HydrophobicContact CD2-CD1 4.09Å; L324-L364 HydrophobicContact CG-CD1 4.42Å; R360-L364 HydrophobicContact CG-CD1 4.41Å; R360-L364 VanDerWaalsContact O-CG 3.27Å; R360-L364 WeakPolarHBondContact O-CG 3.33Å; R360-L364 PolarHBondContact O-N 3.2Å; R360-L364 VanDerWaalsContact O-N 3.11Å; F361-L364 PolarHBondContact O-N 3.18Å; C362-L364 VanDerWaalsContact C-N 3.34Å
365K91.6Very high95.4Very high99 Ų9949 Ų4943%0.4323%0.227SC..  trans-143.1139.6177.3-60.9-175.3178.6-178.30111F361 E367 Y368F361-K365 PolarHBondContact O-N 3.37Å; K365-E367 IonicContact NZ-OE2 3.18Å; K365-E367 PolarHBondContact O-N 3.26Å; K365-Y368 HydrophobicContact CB-CD2 3.77Å; K365-Y368 HydrophobicContact CB-CE2 4.06Å; K365-Y368 HydrophobicContact CD-CE2 3.97Å; K365-Y368 HydrophobicContact CG-CD2 4.38Å; K365-Y368 HydrophobicContact CG-CE2 4.18Å; K365-Y368 PolarHBondContact O-N 2.96Å
366Q93.4Very high95.5Very high133 Ų13349 Ų4962%0.62123%0.227SC*.Hα-helixtrans-63.4-24.1176-157-173.7-8.400112.6Y368 Q369 H370Q366-Y368 PolarHBondContact O-N 3.25Å; Q366-Q369 WeakPolarHBondContact O-CB 3.32Å; Q366-Q369 PolarHBondContact O-N 3.25Å; Q366-H370 PolarHBondContact NE2-CE1 3.36Å; Q366-H370 PolarHBondContact O-N 3.06Å; Q366-H370 PolarHBondContact O-ND1 2.75Å
367E92.7Very high95.4Very high99 Ų9950.3 Ų50.346%0.46323%0.231SC..Hα-helixtrans-57.5-46.8175.5-68165.1173.700111.6K365 Q369 H370 H371K365-E367 IonicContact NZ-OE2 3.18Å; K365-E367 PolarHBondContact O-N 3.26Å; E367-Q369 VanDerWaalsContact C-N 3.29Å; E367-Q369 PolarHBondContact O-N 2.56Å; E367-H370 PolarHBondContact O-N 3.25Å; E367-H371 PolarHBondContact O-CD2 3.23Å; E367-H371 PolarHBondContact O-N 3.27Å
368Y95Very high95.2Very high5 Ų554.4 Ų54.42%0.0225%0.253CS..Hα-helixtrans-63.1-36.2177.5-63.9-61000112.6E333 L336 F361 K365 Q366 H371 F372E333-Y368 HydrophobicContact CB-CD1 4.2Å; E333-Y368 HydrophobicContact CB-CE1 3.65Å; E333-Y368 HydrophobicContact CG-CE1 3.83Å; L336-Y368 HydrophobicContact CD2-CE1 4Å; F361-Y368 HydrophobicContact CB-CD2 4.18Å; F361-Y368 HydrophobicContact CB-CG 4.12Å; F361-Y368 HydrophobicContact CD1-CD2 4.14Å; F361-Y368 HydrophobicContact CD1-CE1 4.37Å; F361-Y368 AromaticContact CD1-CE2 3.89Å; F361-Y368 HydrophobicContact CD1-CE2 3.89Å; F361-Y368 HydrophobicContact CD1-CG 4.5Å; F361-Y368 WeakPolarHBondContact O-CD2 3.15Å; K365-Y368 HydrophobicContact CB-CD2 3.77Å; K365-Y368 HydrophobicContact CB-CE2 4.06Å; K365-Y368 HydrophobicContact CD-CE2 3.97Å; K365-Y368 HydrophobicContact CG-CD2 4.38Å; K365-Y368 HydrophobicContact CG-CE2 4.18Å; K365-Y368 PolarHBondContact O-N 2.96Å; Q366-Y368 PolarHBondContact O-N 3.25Å; Y368-H371 PolarHBondContact O-N 3.02Å; Y368-F372 VanDerWaalsContact O-CD2 3.27Å; Y368-F372 WeakPolarHBondContact O-CD2 3.47Å; Y368-F372 PolarHBondContact O-N 3.11Å
369Q95.9Very high95.1Very high46 Ų4654.8 Ų54.822%0.21526%0.255CS..Hα-helixtrans-58.2-50.4174.2173.9177.60.900110.9C362 Q366 E367 H371 F372 E373 S406 I407C362-Q369 HydrophobicContact CB-CB 4.4Å; Q366-Q369 WeakPolarHBondContact O-CB 3.32Å; Q366-Q369 PolarHBondContact O-N 3.25Å; E367-Q369 VanDerWaalsContact C-N 3.29Å; E367-Q369 PolarHBondContact O-N 2.56Å; Q369-H371 VanDerWaalsContact C-N 3.3Å; Q369-H371 PolarHBondContact O-N 2.96Å; Q369-F372 PolarHBondContact O-N 2.97Å; Q369-E373 VanDerWaalsContact CG-OE1 3.32Å; Q369-E373 WeakPolarHBondContact CG-OE1 3.4Å; Q369-E373 PolarHBondContact NE2-OE1 3.22Å; Q369-E373 VanDerWaalsContact O-CG 3.29Å; Q369-E373 WeakPolarHBondContact O-CG 3.09Å; Q369-E373 PolarHBondContact O-N 3.28Å; Q369-S406 WeakPolarHBondContact CG-O 3.36Å; Q369-I407 HydrophobicContact CG-CG2 4.33Å
370H96.1Very high95Very high96 Ų9654.4 Ų54.444%0.44425%0.253SS..Hα-helixtrans-63.7-35.7179.2-65.896.4000112.4Q366 E367 E373 S374Q366-H370 PolarHBondContact NE2-CE1 3.36Å; Q366-H370 PolarHBondContact O-N 3.06Å; Q366-H370 PolarHBondContact O-ND1 2.75Å; E367-H370 PolarHBondContact O-N 3.25Å; H370-E373 PolarHBondContact O-N 3.28Å; H370-S374 PolarHBondContact O-N 3.43Å
371H95.5Very high94.8Very high59 Ų5954.7 Ų54.727%0.27326%0.262SS..Hα-helixtrans-63.6-49.9175-69.8-49.8000111.4C337 E367 Y368 Q369 E373 S374 L375C337-H371 HydrophobicContact CB-CB 4.02Å; E367-H371 PolarHBondContact O-CD2 3.23Å; E367-H371 PolarHBondContact O-N 3.27Å; Y368-H371 PolarHBondContact O-N 3.02Å; Q369-H371 VanDerWaalsContact C-N 3.3Å; Q369-H371 PolarHBondContact O-N 2.96Å; H371-E373 VanDerWaalsContact C-N 3.27Å; H371-E373 PolarHBondContact O-N 3.42Å; H371-S374 WeakPolarHBondContact O-CB 3.27Å; H371-S374 PolarHBondContact O-N 2.77Å; H371-S374 VanDerWaalsContact O-N 3.07Å; H371-L375 VanDerWaalsContact O-CG 3.31Å; H371-L375 WeakPolarHBondContact O-CG 3.45Å; H371-L375 PolarHBondContact O-N 3.18Å
372F97.3Very high94.6Very high0 Ų056 Ų560%027%0.273CS..Hα-helixtrans-61.7-33.6175.6-79-65.9000113.2C337 I340 A358 C362 Y368 Q369 L375 F376 L401 I407C337-F372 HydrophobicContact CB-CD1 4.44Å; C337-F372 HydrophobicContact CB-CE1 4.15Å; C337-F372 HydrophobicContact CB-CE2 4.24Å; C337-F372 HydrophobicContact CB-CZ 4.04Å; C337-F372 WeakPolarHBondContact SG-CE2 3.37Å; I340-F372 HydrophobicContact CB-CZ 4.37Å; I340-F372 HydrophobicContact CD1-CZ 4.39Å; I340-F372 HydrophobicContact CG2-CE1 4.41Å; I340-F372 HydrophobicContact CG2-CZ 4.09Å; A358-F372 HydrophobicContact CB-CE1 4.03Å; A358-F372 HydrophobicContact CB-CE2 3.84Å; A358-F372 HydrophobicContact CB-CZ 3.53Å; C362-F372 VanDerWaalsContact SG-CD2 3.54Å; Y368-F372 VanDerWaalsContact O-CD2 3.27Å; Y368-F372 WeakPolarHBondContact O-CD2 3.47Å; Y368-F372 PolarHBondContact O-N 3.11Å; Q369-F372 PolarHBondContact O-N 2.97Å; F372-L375 HydrophobicContact CD1-CD1 4.18Å; F372-L375 HydrophobicContact CE1-CD1 4.47Å; F372-L375 PolarHBondContact O-N 3.46Å; F372-F376 PolarHBondContact O-N 2.93Å; F372-L401 HydrophobicContact CB-CD1 4.16Å; F372-L401 HydrophobicContact CD1-CD1 4.01Å; F372-L401 HydrophobicContact CG-CD1 4.03Å; F372-I407 HydrophobicContact CB-CG2 3.83Å
373E96.4Very high94.4Very high12 Ų1255.7 Ų55.76%0.05627%0.271CS..Hα-helixtrans-64.2-38.5172.7-72.8175-17000112.7Q369 H370 H371 I407 S408 P412Q369-E373 VanDerWaalsContact CG-OE1 3.32Å; Q369-E373 WeakPolarHBondContact CG-OE1 3.4Å; Q369-E373 PolarHBondContact NE2-OE1 3.22Å; Q369-E373 VanDerWaalsContact O-CG 3.29Å; Q369-E373 WeakPolarHBondContact O-CG 3.09Å; Q369-E373 PolarHBondContact O-N 3.28Å; H370-E373 PolarHBondContact O-N 3.28Å; H371-E373 VanDerWaalsContact C-N 3.27Å; H371-E373 PolarHBondContact O-N 3.42Å; E373-I407 HydrophobicContact CG-CB 3.83Å; E373-I407 HydrophobicContact CG-CG2 4.21Å; E373-S408 WeakPolarHBondContact OE1-CB 3.48Å; E373-S408 PolarHBondContact OE1-N 2.94Å; E373-P412 HydrophobicContact CB-CG 3.85Å; E373-P412 HydrophobicContact CG-CG 3.74Å
374S95.5Very high93.9Very high60 Ų6053.6 Ų53.642%0.4227%0.267SS..Hα-helixtrans-67.3-47172.6-164.90000111.2H370 H371 F376 K377 D378H370-S374 PolarHBondContact O-N 3.43Å; H371-S374 WeakPolarHBondContact O-CB 3.27Å; H371-S374 PolarHBondContact O-N 2.77Å; H371-S374 VanDerWaalsContact O-N 3.07Å; S374-F376 PolarHBondContact O-N 3.31Å; S374-K377 WeakPolarHBondContact O-CB 3.08Å; S374-K377 PolarHBondContact O-N 3.35Å; S374-D378 PolarHBondContact O-N 2.96Å; S374-D378 VanDerWaalsContact O-N 3.09Å
375L95.4Very high93.6Very high12 Ų1259.5 Ų59.56%0.06328%0.284CS..Hα-helixtrans-59-35.9-179.9-68-178000112.9C337 N338 L341 H371 F372 K377 D378 V379 F398C337-L375 HydrophobicContact CB-CD1 3.64Å; N338-L375 WeakPolarHBondContact OD1-CD2 3.3Å; L341-L375 HydrophobicContact CD2-CB 4.23Å; L341-L375 HydrophobicContact CD2-CD1 4.32Å; H371-L375 VanDerWaalsContact O-CG 3.31Å; H371-L375 WeakPolarHBondContact O-CG 3.45Å; H371-L375 PolarHBondContact O-N 3.18Å; F372-L375 HydrophobicContact CD1-CD1 4.18Å; F372-L375 HydrophobicContact CE1-CD1 4.47Å; F372-L375 PolarHBondContact O-N 3.46Å; L375-K377 VanDerWaalsContact C-N 3.27Å; L375-K377 PolarHBondContact O-N 3.31Å; L375-D378 PolarHBondContact O-N 3.12Å; L375-V379 VanDerWaalsContact O-CB 3.28Å; L375-V379 WeakPolarHBondContact O-CB 3.47Å; L375-V379 WeakPolarHBondContact O-CG2 3.48Å; L375-V379 PolarHBondContact O-N 3.15Å; L375-F398 HydrophobicContact CB-CZ 4.22Å
376F97.3Very high93.2Very high0 Ų056.8 Ų56.80%027%0.272CS..Hα-helixtrans-56.2-44.6173.5179.7-90.4000111.9F372 S374 Y380 F398 F402 P412 L413 I416 F430 L434F372-F376 PolarHBondContact O-N 2.93Å; S374-F376 PolarHBondContact O-N 3.31Å; F376-Y380 VanDerWaalsContact O-CB 3.31Å; F376-Y380 WeakPolarHBondContact O-CB 3.36Å; F376-Y380 PolarHBondContact O-N 3.26Å; F376-F398 VanDerWaalsContact CA-CZ 3.48Å; F376-F398 HydrophobicContact CB-CD1 4.03Å; F376-F398 HydrophobicContact CB-CE1 3.75Å; F376-F398 HydrophobicContact CB-CZ 4.03Å; F376-F398 HydrophobicContact CD2-CB 3.74Å; F376-F398 AromaticContact CD2-CD1 3.72Å; F376-F398 HydrophobicContact CD2-CD1 3.72Å; F376-F398 AromaticContact CD2-CD2 3.73Å; F376-F398 HydrophobicContact CD2-CD2 3.73Å; F376-F398 HydrophobicContact CD2-CE1 4.21Å; F376-F398 HydrophobicContact CD2-CE2 4.23Å; F376-F398 AromaticContact CD2-CG 3.47Å; F376-F398 HydrophobicContact CD2-CG 3.47Å; F376-F398 VanDerWaalsContact CD2-CG 3.47Å; F376-F398 HydrophobicContact CD2-CZ 4.45Å; F376-F398 HydrophobicContact CE2-CB 3.98Å; F376-F398 HydrophobicContact CE2-CD2 4.36Å; F376-F398 HydrophobicContact CE2-CG 4.16Å; F376-F398 HydrophobicContact CG-CD1 4.38Å; F376-F398 HydrophobicContact CG-CG 4.49Å; F376-F402 AromaticContact CD2-CE2 3.89Å; F376-F402 HydrophobicContact CD2-CE2 3.89Å; F376-F402 AromaticContact CD2-CZ 3.98Å; F376-F402 HydrophobicContact CD2-CZ 3.98Å; F376-F402 HydrophobicContact CE1-CZ 4.49Å; F376-F402 AromaticContact CE2-CE2 3.53Å; F376-F402 HydrophobicContact CE2-CE2 3.53Å; F376-F402 AromaticContact CE2-CZ 3.89Å; F376-F402 HydrophobicContact CE2-CZ 3.89Å; F376-F402 HydrophobicContact CG-CZ 4.33Å; F376-F402 HydrophobicContact CZ-CE2 4.02Å; F376-F402 HydrophobicContact CZ-CZ 4.13Å; F376-P412 HydrophobicContact CB-CB 3.92Å; F376-P412 HydrophobicContact CD1-CB 3.31Å; F376-P412 HydrophobicContact CE1-CB 3.98Å; F376-P412 WeakPolarHBondContact CE1-O 3.46Å; F376-P412 HydrophobicContact CG-CB 3.71Å; F376-L413 HydrophobicContact CE1-CD2 4.14Å; F376-L413 HydrophobicContact CZ-CD2 3.79Å; F376-I416 HydrophobicContact CE1-CD1 3.85Å; F376-I416 HydrophobicContact CE1-CG1 4.35Å; F376-I416 HydrophobicContact CZ-CD1 3.72Å; F376-F430 AromaticContact CE2-CE1 3.95Å; F376-F430 HydrophobicContact CE2-CE1 3.95Å; F376-F430 HydrophobicContact CE2-CZ 4.2Å; F376-F430 HydrophobicContact CZ-CE1 4.22Å; F376-L434 HydrophobicContact CE2-CD2 4.3Å; F376-L434 HydrophobicContact CZ-CD2 4.24Å
377K95.2Very high92.9Very high67 Ų6758 Ų5829%0.29128%0.278SS..Hα-helixtrans-66.1-46.7179.9-62.9177.5179.9177.50110.6S374 L375 V379 Y380 L381 V411 C415S374-K377 WeakPolarHBondContact O-CB 3.08Å; S374-K377 PolarHBondContact O-N 3.35Å; L375-K377 VanDerWaalsContact C-N 3.27Å; L375-K377 PolarHBondContact O-N 3.31Å; K377-V379 VanDerWaalsContact C-N 3.35Å; K377-V379 PolarHBondContact O-N 3.47Å; K377-Y380 PolarHBondContact O-N 2.91Å; K377-L381 WeakPolarHBondContact O-CB 3.32Å; K377-L381 VanDerWaalsContact O-CG 3.26Å; K377-L381 WeakPolarHBondContact O-CG 3.45Å; K377-L381 PolarHBondContact O-N 3.49Å; K377-V411 WeakPolarHBondContact CE-O 3.47Å; K377-C415 HydrophobicContact CG-CB 4.39Å
378D93.3Very high92.6Very high87 Ų8759.1 Ų59.147%0.46529%0.286SS..Hα-helixtrans-61.8-45.2-179-60.7-30.7000110.8S374 L375 L381 A382S374-D378 PolarHBondContact O-N 2.96Å; S374-D378 VanDerWaalsContact O-N 3.09Å; L375-D378 PolarHBondContact O-N 3.12Å; D378-L381 PolarHBondContact O-N 3.3Å; D378-A382 VanDerWaalsContact O-CB 3.25Å; D378-A382 WeakPolarHBondContact O-CB 3.37Å; D378-A382 PolarHBondContact O-N 2.98Å
379V93.2Very high92Very high8 Ų861.1 Ų61.15%0.04830%0.299CS..Hα-helixtrans-60.7-48.1174.3166.50000111.7L341 L375 K377 L381 A382 V383 F386 F398 F430L341-V379 HydrophobicContact CD2-CG2 3.45Å; L341-V379 VanDerWaalsContact CD2-CG2 3.45Å; L375-V379 VanDerWaalsContact O-CB 3.28Å; L375-V379 WeakPolarHBondContact O-CB 3.47Å; L375-V379 WeakPolarHBondContact O-CG2 3.48Å; L375-V379 PolarHBondContact O-N 3.15Å; K377-V379 VanDerWaalsContact C-N 3.35Å; K377-V379 PolarHBondContact O-N 3.47Å; V379-L381 VanDerWaalsContact C-N 3.34Å; V379-L381 PolarHBondContact O-N 2.96Å; V379-A382 CarbonylContact O-C 3.5Å; V379-A382 PolarHBondContact O-N 3.22Å; V379-V383 WeakPolarHBondContact O-CA 3.27Å; V379-V383 WeakPolarHBondContact O-CB 3.29Å; V379-V383 PolarHBondContact O-N 3.22Å; V379-F386 HydrophobicContact CB-CE2 4.45Å; V379-F386 HydrophobicContact CG1-CE2 3.76Å; V379-F386 HydrophobicContact CG1-CZ 4.38Å; V379-F386 HydrophobicContact CG2-CE2 4.34Å; V379-F386 HydrophobicContact CG2-CZ 4.36Å; V379-F398 HydrophobicContact CB-CE2 4.1Å; V379-F398 HydrophobicContact CG1-CE2 4.11Å; V379-F398 HydrophobicContact CG2-CE2 4.05Å; V379-F398 HydrophobicContact CG2-CZ 4.35Å; V379-F430 HydrophobicContact CG1-CE2 3.82Å; V379-F430 HydrophobicContact CG1-CZ 4.16Å
380Y95Very high91.8Very high16 Ų1661.9 Ų61.96%0.06330%0.301CS..Hα-helixtrans-63.9-41.1-178.2-179-98.9000111.7F376 K377 V383 I416 F430 I431F376-Y380 VanDerWaalsContact O-CB 3.31Å; F376-Y380 WeakPolarHBondContact O-CB 3.36Å; F376-Y380 PolarHBondContact O-N 3.26Å; K377-Y380 PolarHBondContact O-N 2.91Å; Y380-V383 WeakPolarHBondContact O-CB 3.29Å; Y380-V383 WeakPolarHBondContact O-CG1 3.4Å; Y380-V383 PolarHBondContact O-N 3.34Å; Y380-I416 HydrophobicContact CD1-CG1 3.94Å; Y380-I416 HydrophobicContact CD2-CD1 3.95Å; Y380-I416 HydrophobicContact CD2-CG1 4.01Å; Y380-I416 HydrophobicContact CE1-CB 4.28Å; Y380-I416 HydrophobicContact CE1-CG1 3.78Å; Y380-I416 HydrophobicContact CE1-CG2 4.39Å; Y380-I416 HydrophobicContact CE2-CD1 3.92Å; Y380-I416 HydrophobicContact CE2-CG1 3.85Å; Y380-I416 HydrophobicContact CE2-CG2 4.24Å; Y380-I416 HydrophobicContact CG-CD1 4.37Å; Y380-I416 HydrophobicContact CG-CG1 4.06Å; Y380-F430 AromaticContact CD2-CD1 3.92Å; Y380-F430 HydrophobicContact CD2-CD1 3.92Å; Y380-F430 HydrophobicContact CD2-CE1 4.19Å; Y380-F430 HydrophobicContact CE2-CD1 4.44Å; Y380-I431 HydrophobicContact CE2-CD1 4.2Å; Y380-I431 HydrophobicContact CE2-CG1 4.09Å
381L92.5Very high91.7Very high114 Ų11457.5 Ų57.560%0.59728%0.281SS*.Hα-helixtrans-67.3-37.1176.8-68.7173.3000111.9K377 D378 V379 H384K377-L381 WeakPolarHBondContact O-CB 3.32Å; K377-L381 VanDerWaalsContact O-CG 3.26Å; K377-L381 WeakPolarHBondContact O-CG 3.45Å; K377-L381 PolarHBondContact O-N 3.49Å; D378-L381 PolarHBondContact O-N 3.3Å; V379-L381 VanDerWaalsContact C-N 3.34Å; V379-L381 PolarHBondContact O-N 2.96Å; L381-H384 PolarHBondContact O-CE1 3.01Å; L381-H384 VanDerWaalsContact O-CE1 3.23Å; L381-H384 PolarHBondContact O-ND1 3.05Å
382A92.2Very high91.6Very high29 Ų2957.7 Ų57.724%0.2428%0.28CS..Hα-helixtrans-85.3-2.917900000114.4D378 V379 H384 R385 F386D378-A382 VanDerWaalsContact O-CB 3.25Å; D378-A382 WeakPolarHBondContact O-CB 3.37Å; D378-A382 PolarHBondContact O-N 2.98Å; V379-A382 CarbonylContact O-C 3.5Å; V379-A382 PolarHBondContact O-N 3.22Å; A382-H384 PolarHBondContact O-N 3.09Å; A382-R385 WeakPolarHBondContact O-CB 3.07Å; A382-R385 PolarHBondContact O-N 3.28Å; A382-F386 HydrophobicContact CB-CE1 4.07Å
383V91.4Very high91.5Very high3 Ų357.7 Ų57.72%0.01828%0.28CS..G310 helixtrans-58.5-23.6-169.7780000114.7V379 Y380 R385 F386 L391 P426 F430V379-V383 WeakPolarHBondContact O-CA 3.27Å; V379-V383 WeakPolarHBondContact O-CB 3.29Å; V379-V383 PolarHBondContact O-N 3.22Å; Y380-V383 WeakPolarHBondContact O-CB 3.29Å; Y380-V383 WeakPolarHBondContact O-CG1 3.4Å; Y380-V383 PolarHBondContact O-N 3.34Å; V383-R385 PolarHBondContact O-N 2.95Å; V383-F386 PolarHBondContact O-N 3.27Å; V383-L391 HydrophobicContact CG2-CD1 3.66Å; V383-L391 HydrophobicContact CG2-CG 3.72Å; V383-P426 HydrophobicContact CG1-CB 4.42Å; V383-F430 HydrophobicContact CG2-CB 3.86Å; V383-F430 HydrophobicContact CG2-CD2 3.82Å; V383-F430 HydrophobicContact CG2-CG 4.08Å
384H84.1Confident91.6Very high104 Ų10457.2 Ų57.248%0.48128%0.277SS..G310 helixtrans-68.7-19.2176.463.1-82.7000113.3L381 A382L381-H384 PolarHBondContact O-CE1 3.01Å; L381-H384 VanDerWaalsContact O-CE1 3.23Å; L381-H384 PolarHBondContact O-ND1 3.05Å; A382-H384 PolarHBondContact O-N 3.09Å
385R86.2Confident91.7Very high200 Ų20054.3 Ų54.376%0.75526%0.257SS*.G310 helixtrans-92.9-7.7175.9-51.4-176-177.4-176.7-3.6112.5A382 V383A382-R385 WeakPolarHBondContact O-CB 3.07Å; A382-R385 PolarHBondContact O-N 3.28Å; V383-R385 PolarHBondContact O-N 2.95Å
386F83.6Confident91.8Very high43 Ų4357.2 Ų57.219%0.18927%0.267CS..SBendtrans-86.3138.9-174.4-75.215.9000110.8V379 A382 V383 K390 L391V379-F386 HydrophobicContact CB-CE2 4.45Å; V379-F386 HydrophobicContact CG1-CE2 3.76Å; V379-F386 HydrophobicContact CG1-CZ 4.38Å; V379-F386 HydrophobicContact CG2-CE2 4.34Å; V379-F386 HydrophobicContact CG2-CZ 4.36Å; A382-F386 HydrophobicContact CB-CE1 4.07Å; V383-F386 PolarHBondContact O-N 3.27Å; F386-K390 HydrophobicContact CB-CB 4.39Å; F386-K390 HydrophobicContact CD1-CD 4.18Å; F386-K390 HydrophobicContact CD2-CB 4.32Å; F386-K390 HydrophobicContact CD2-CD 4.06Å; F386-K390 HydrophobicContact CD2-CG 3.9Å; F386-K390 HydrophobicContact CE1-CD 4.26Å; F386-K390 HydrophobicContact CE2-CD 4.12Å; F386-K390 HydrophobicContact CE2-CG 4.15Å; F386-K390 HydrophobicContact CG-CB 4.47Å; F386-K390 HydrophobicContact CG-CD 4.1Å; F386-K390 HydrophobicContact CG-CG 4.27Å; F386-K390 HydrophobicContact CZ-CD 4.24Å; F386-L391 HydrophobicContact CB-CB 4.15Å
387E87.4Confident91.9Very high157 Ų15757.2 Ų57.273%0.73427%0.267SS*.  trans-67159.5163.9-59.8-172.2166.800111.3T389 K390 L391E387-T389 VanDerWaalsContact C-N 3.25Å; E387-T389 PolarHBondContact O-N 3.49Å; E387-K390 PolarHBondContact O-N 3.4Å; E387-L391 WeakPolarHBondContact O-CB 3.06Å; E387-L391 PolarHBondContact O-N 3.47Å
388I85.2Confident92Very high124 Ų12454 Ų5464%0.63625%0.253SS*.Hα-helixtrans-56.3-39.2-174.4-62.6173.4000112R392I388-R392 VanDerWaalsContact O-CB 3.26Å; I388-R392 WeakPolarHBondContact O-CB 3.31Å; I388-R392 PolarHBondContact O-N 3Å
389T84.2Confident92.2Very high47 Ų4749.9 Ų49.929%0.28823%0.231SC..Hα-helixtrans-68.5-49.6-180-62.70000111.6Q347 E387 L391 R392 N393Q347-T389 WeakPolarHBondContact O-CG2 3.39Å; E387-T389 VanDerWaalsContact C-N 3.25Å; E387-T389 PolarHBondContact O-N 3.49Å; T389-L391 VanDerWaalsContact C-N 3.31Å; T389-L391 PolarHBondContact O-N 3.32Å; T389-R392 PolarHBondContact O-N 3.15Å; T389-R392 PolarHBondContact OG1-NH2 3.07Å; T389-N393 PolarHBondContact O-N 3.2Å
390K90.3Very high92.5Very high61 Ų6149.8 Ų49.827%0.26523%0.23SC..Hα-helixtrans-57.1-46.9177.9-164.5177.1178.7151.50111D342 A345 F386 E387 S394D342-K390 IonicContact OD1-NZ 2.97Å; D342-K390 PolarHBondContact OD1-NZ 3.09Å; A345-K390 HydrophobicContact CB-CD 4.38Å; A345-K390 HydrophobicContact CB-CG 3.53Å; A345-K390 WeakPolarHBondContact O-CA 3.42Å; F386-K390 HydrophobicContact CB-CB 4.39Å; F386-K390 HydrophobicContact CD1-CD 4.18Å; F386-K390 HydrophobicContact CD2-CB 4.32Å; F386-K390 HydrophobicContact CD2-CD 4.06Å; F386-K390 HydrophobicContact CD2-CG 3.9Å; F386-K390 HydrophobicContact CE1-CD 4.26Å; F386-K390 HydrophobicContact CE2-CD 4.12Å; F386-K390 HydrophobicContact CE2-CG 4.15Å; F386-K390 HydrophobicContact CG-CB 4.47Å; F386-K390 HydrophobicContact CG-CD 4.1Å; F386-K390 HydrophobicContact CG-CG 4.27Å; F386-K390 HydrophobicContact CZ-CD 4.24Å; E387-K390 PolarHBondContact O-N 3.4Å; K390-S394 WeakPolarHBondContact O-CB 3.14Å; K390-S394 PolarHBondContact O-N 2.98Å; K390-S394 PolarHBondContact O-OG 2.99Å
391L93.8Very high92.6Very high5 Ų549 Ų493%0.02623%0.227CC..Hα-helixtrans-57.8-51.5176-177165.6000111.8V383 F386 E387 T389 S394 A395 P426 I429 F430 I433V383-L391 HydrophobicContact CG2-CD1 3.66Å; V383-L391 HydrophobicContact CG2-CG 3.72Å; F386-L391 HydrophobicContact CB-CB 4.15Å; E387-L391 WeakPolarHBondContact O-CB 3.06Å; E387-L391 PolarHBondContact O-N 3.47Å; T389-L391 VanDerWaalsContact C-N 3.31Å; T389-L391 PolarHBondContact O-N 3.32Å; L391-S394 PolarHBondContact O-N 3.17Å; L391-A395 WeakPolarHBondContact O-CB 3.26Å; L391-A395 PolarHBondContact O-N 3.27Å; L391-P426 HydrophobicContact CD1-CB 4.07Å; L391-I429 HydrophobicContact CD1-CG2 4.47Å; L391-I429 HydrophobicContact CD2-CG2 3.89Å; L391-F430 HydrophobicContact CD2-CB 3.94Å; L391-F430 HydrophobicContact CD2-CD2 4.13Å; L391-F430 HydrophobicContact CG-CB 4.18Å; L391-F430 HydrophobicContact CG-CD2 4.07Å; L391-I433 HydrophobicContact CD2-CD1 3.82Å
392R95Very high92.8Very high63 Ų6343.6 Ų43.624%0.23820%0.199CC..Hα-helixtrans-59.9-49.3-177.7174.5-179.363.3-129.2-1.2111.7R348 I388 T389 A395 R396 I433R348-R392 PolarHBondContact O-NH2 2.81Å; I388-R392 VanDerWaalsContact O-CB 3.26Å; I388-R392 WeakPolarHBondContact O-CB 3.31Å; I388-R392 PolarHBondContact O-N 3Å; T389-R392 PolarHBondContact O-N 3.15Å; T389-R392 PolarHBondContact OG1-NH2 3.07Å; R392-A395 PolarHBondContact O-N 3.47Å; R392-R396 WeakPolarHBondContact O-CG 3.48Å; R392-R396 PolarHBondContact O-N 3.1Å; R392-R396 VanDerWaalsContact O-N 3.1Å; R392-I433 HydrophobicContact CB-CD1 3.93Å; R392-I433 HydrophobicContact CG-CD1 4.14Å; R392-I433 HydrophobicContact CG-CG2 4.45Å
393N95.4Very high93Very high0 Ų045.8 Ų45.80%020%0.203CC..Hα-helixtrans-68.4-39.9-176.2-68.52.7000111.5C344 Q347 Y350 T389 A395 R396 L397C344-N393 WeakPolarHBondContact O-CB 3.34Å; C344-N393 PolarHBondContact O-ND2 2.87Å; Q347-N393 PolarHBondContact O-ND2 3.41Å; Y350-N393 PolarHBondContact N-OD1 3.16Å; Y350-N393 VanDerWaalsContact N-OD1 3.15Å; T389-N393 PolarHBondContact O-N 3.2Å; N393-A395 PolarHBondContact O-N 3.39Å; N393-R396 PolarHBondContact O-N 2.87Å; N393-L397 PolarHBondContact O-N 2.98Å
394S97Very high93.2Very high1 Ų147 Ų471%0.00721%0.21CC..Hα-helixtrans-59.7-47.2174.7-55.30000111.1K390 L391 R396 L397 F398K390-S394 WeakPolarHBondContact O-CB 3.14Å; K390-S394 PolarHBondContact O-N 2.98Å; K390-S394 PolarHBondContact O-OG 2.99Å; L391-S394 PolarHBondContact O-N 3.17Å; S394-R396 VanDerWaalsContact C-N 3.3Å; S394-R396 PolarHBondContact O-N 3.07Å; S394-L397 PolarHBondContact O-N 2.96Å; S394-F398 WeakPolarHBondContact O-CD2 3.45Å; S394-F398 PolarHBondContact O-N 3.47Å; S394-F398 VanDerWaalsContact O-N 3.09Å
395A97.7Very high93.8Very high0 Ų046.1 Ų46.10%021%0.209CC..Hα-helixtrans-59.1-40.217800000112.4L391 R392 N393 A399 F430 I433 L434L391-A395 WeakPolarHBondContact O-CB 3.26Å; L391-A395 PolarHBondContact O-N 3.27Å; R392-A395 PolarHBondContact O-N 3.47Å; N393-A395 PolarHBondContact O-N 3.39Å; A395-A399 WeakPolarHBondContact O-CB 3.28Å; A395-A399 PolarHBondContact O-N 3Å; A395-F430 HydrophobicContact CB-CD2 3.77Å; A395-F430 HydrophobicContact CB-CE2 3.72Å; A395-F430 HydrophobicContact CB-CG 4.21Å; A395-F430 HydrophobicContact CB-CZ 4.11Å; A395-I433 HydrophobicContact CB-CB 4.01Å; A395-I433 HydrophobicContact CB-CG2 3.74Å; A395-L434 WeakPolarHBondContact O-CD1 3.43Å
396R98.2Very high94.2Very high72 Ų7236.9 Ų36.927%0.27218%0.175SC..Hα-helixtrans-69.7-39.4177.9-72.2-175.3163.8170.30.8113.4Y350 R392 N393 S394 F398 A399 H400 I433 E437Y350-R396 HydrophobicContact CD1-CB 3.69Å; Y350-R396 HydrophobicContact CD1-CG 4.3Å; Y350-R396 HydrophobicContact CD2-CB 3.55Å; Y350-R396 HydrophobicContact CE1-CB 3.91Å; Y350-R396 HydrophobicContact CE2-CB 3.81Å; Y350-R396 HydrophobicContact CG-CB 3.49Å; Y350-R396 VanDerWaalsContact CG-CB 3.49Å; Y350-R396 HydrophobicContact CG-CG 4.19Å; R392-R396 WeakPolarHBondContact O-CG 3.48Å; R392-R396 PolarHBondContact O-N 3.1Å; R392-R396 VanDerWaalsContact O-N 3.1Å; N393-R396 PolarHBondContact O-N 2.87Å; S394-R396 VanDerWaalsContact C-N 3.3Å; S394-R396 PolarHBondContact O-N 3.07Å; R396-F398 VanDerWaalsContact C-N 3.34Å; R396-F398 PolarHBondContact O-N 3.39Å; R396-A399 WeakPolarHBondContact O-CB 3.32Å; R396-A399 PolarHBondContact O-N 3.32Å; R396-H400 PolarHBondContact O-N 2.92Å; R396-I433 HydrophobicContact CG-CG2 4.04Å; R396-E437 WeakPolarHBondContact CD-OE2 3.45Å; R396-E437 HydrophobicContact CG-CG 4.16Å; R396-E437 WeakPolarHBondContact CG-OE2 3.32Å; R396-E437 IonicContact CZ-OE2 3.3Å; R396-E437 IonicContact NE-OE1 3.62Å; R396-E437 IonicContact NE-OE2 3.92Å; R396-E437 PolarHBondContact NE-OE2 3.13Å; R396-E437 IonicContact NH2-OE2 3.38Å
397L98.3Very high94.8Very high0 Ų034.9 Ų34.90%017%0.167CC..Hα-helixtrans-58.4-49.2174.3-179.864.1000110.6L341 C344 Y350 F354 A358 N393 S394 A399 H400 L401L341-L397 HydrophobicContact CB-CD2 4.39Å; L341-L397 HydrophobicContact CD1-CD2 3.74Å; C344-L397 HydrophobicContact CB-CD2 4.18Å; Y350-L397 HydrophobicContact CE2-CB 4.02Å; F354-L397 HydrophobicContact CB-CD1 4.02Å; A358-L397 HydrophobicContact CB-CD1 4.22Å; N393-L397 PolarHBondContact O-N 2.98Å; S394-L397 PolarHBondContact O-N 2.96Å; L397-A399 PolarHBondContact O-N 3.05Å; L397-H400 WeakPolarHBondContact O-CB 3.42Å; L397-H400 PolarHBondContact O-N 3.07Å; L397-L401 WeakPolarHBondContact O-CG 3.41Å; L397-L401 PolarHBondContact O-N 2.91Å
398F98.2Very high95.1Very high0 Ų029.2 Ų29.20%014%0.144CC..Hα-helixtrans-68.1-34.7178.8-68.5-63.1000112.8L341 L375 F376 V379 S394 R396 H400 L401 F402 I407 F430 L434L341-F398 HydrophobicContact CD1-CE2 4.08Å; L341-F398 HydrophobicContact CD1-CZ 4.23Å; L341-F398 HydrophobicContact CD2-CZ 4.32Å; L375-F398 HydrophobicContact CB-CZ 4.22Å; F376-F398 VanDerWaalsContact CA-CZ 3.48Å; F376-F398 HydrophobicContact CB-CD1 4.03Å; F376-F398 HydrophobicContact CB-CE1 3.75Å; F376-F398 HydrophobicContact CB-CZ 4.03Å; F376-F398 HydrophobicContact CD2-CB 3.74Å; F376-F398 AromaticContact CD2-CD1 3.72Å; F376-F398 HydrophobicContact CD2-CD1 3.72Å; F376-F398 AromaticContact CD2-CD2 3.73Å; F376-F398 HydrophobicContact CD2-CD2 3.73Å; F376-F398 HydrophobicContact CD2-CE1 4.21Å; F376-F398 HydrophobicContact CD2-CE2 4.23Å; F376-F398 AromaticContact CD2-CG 3.47Å; F376-F398 HydrophobicContact CD2-CG 3.47Å; F376-F398 VanDerWaalsContact CD2-CG 3.47Å; F376-F398 HydrophobicContact CD2-CZ 4.45Å; F376-F398 HydrophobicContact CE2-CB 3.98Å; F376-F398 HydrophobicContact CE2-CD2 4.36Å; F376-F398 HydrophobicContact CE2-CG 4.16Å; F376-F398 HydrophobicContact CG-CD1 4.38Å; F376-F398 HydrophobicContact CG-CG 4.49Å; V379-F398 HydrophobicContact CB-CE2 4.1Å; V379-F398 HydrophobicContact CG1-CE2 4.11Å; V379-F398 HydrophobicContact CG2-CE2 4.05Å; V379-F398 HydrophobicContact CG2-CZ 4.35Å; S394-F398 WeakPolarHBondContact O-CD2 3.45Å; S394-F398 PolarHBondContact O-N 3.47Å; S394-F398 VanDerWaalsContact O-N 3.09Å; R396-F398 VanDerWaalsContact C-N 3.34Å; R396-F398 PolarHBondContact O-N 3.39Å; F398-H400 VanDerWaalsContact C-N 3.3Å; F398-H400 PolarHBondContact O-N 2.95Å; F398-L401 HydrophobicContact CD1-CD1 4.16Å; F398-L401 PolarHBondContact O-N 3.16Å; F398-F402 HydrophobicContact CB-CD2 4.46Å; F398-F402 HydrophobicContact CB-CE2 4.19Å; F398-F402 WeakPolarHBondContact O-CD2 3.4Å; F398-F402 PolarHBondContact O-N 2.82Å; F398-I407 HydrophobicContact CD1-CD1 4.24Å; F398-F430 HydrophobicContact CD2-CZ 4.2Å; F398-L434 HydrophobicContact CB-CD1 4.27Å
399A98Very high95.5Very high0 Ų023.6 Ų23.60%012%0.115CC..Hα-helixtrans-57.6-43.8171.300000111.8A395 R396 L397 F402 F403 L434 E437 L438 F441A395-A399 WeakPolarHBondContact O-CB 3.28Å; A395-A399 PolarHBondContact O-N 3Å; R396-A399 WeakPolarHBondContact O-CB 3.32Å; R396-A399 PolarHBondContact O-N 3.32Å; L397-A399 PolarHBondContact O-N 3.05Å; A399-F402 PolarHBondContact O-N 3.01Å; A399-F403 VanDerWaalsContact O-CB 3.26Å; A399-F403 WeakPolarHBondContact O-CB 2.95Å; A399-F403 PolarHBondContact O-N 3.31Å; A399-L434 HydrophobicContact CB-CD1 3.96Å; A399-E437 HydrophobicContact CB-CB 3.63Å; A399-E437 HydrophobicContact CB-CG 3.79Å; A399-L438 HydrophobicContact CB-CD2 4.36Å; A399-L438 HydrophobicContact CB-CG 4.25Å; A399-L438 WeakPolarHBondContact O-CD2 3.33Å; A399-F441 HydrophobicContact CB-CE2 4.23Å
400H98.2Very high95.8Very high6 Ų624.5 Ų24.53%0.02812%0.117CC..Hα-helixtrans-61.3-44.8175.4-176.7109.8000111.4G355 E359 R396 L397 F398 F403 T404 F441G355-H400 VanDerWaalsContact C-CD2 3.48Å; G355-H400 PolarHBondContact O-CD2 3.47Å; G355-H400 VanDerWaalsContact O-CD2 3.31Å; G355-H400 PolarHBondContact O-NE2 2.92Å; E359-H400 IonicContact OE2-CD2 2.7Å; E359-H400 IonicContact OE2-CE1 2.7Å; E359-H400 IonicContact OE2-NE2 2.94Å; E359-H400 PolarHBondContact OE2-NE2 2.7Å; R396-H400 PolarHBondContact O-N 2.92Å; L397-H400 WeakPolarHBondContact O-CB 3.42Å; L397-H400 PolarHBondContact O-N 3.07Å; F398-H400 VanDerWaalsContact C-N 3.3Å; F398-H400 PolarHBondContact O-N 2.95Å; H400-F403 PolarHBondContact O-N 3.27Å; H400-T404 WeakPolarHBondContact O-CB 3.24Å; H400-T404 WeakPolarHBondContact O-CG2 3.46Å; H400-T404 PolarHBondContact O-N 2.81Å; H400-T404 PolarHBondContact O-OG1 3.46Å; H400-F441 HydrophobicContact CB-CE2 4.33Å
401L98Very high95.5Very high0 Ų024.9 Ų24.90%012%0.124CC..Hα-helixtrans-65.3-40.2-179.9-68.6178.5000112.9A358 F372 L397 F398 T404 D405 S406 I407A358-L401 HydrophobicContact CB-CD1 4.23Å; A358-L401 HydrophobicContact CB-CD2 3.75Å; A358-L401 HydrophobicContact CB-CG 4.39Å; F372-L401 HydrophobicContact CB-CD1 4.16Å; F372-L401 HydrophobicContact CD1-CD1 4.01Å; F372-L401 HydrophobicContact CG-CD1 4.03Å; L397-L401 WeakPolarHBondContact O-CG 3.41Å; L397-L401 PolarHBondContact O-N 2.91Å; F398-L401 HydrophobicContact CD1-CD1 4.16Å; F398-L401 PolarHBondContact O-N 3.16Å; L401-T404 PolarHBondContact O-OG1 3.36Å; L401-D405 PolarHBondContact O-N 2.78Å; L401-S406 PolarHBondContact O-N 3.42Å; L401-I407 HydrophobicContact CB-CD1 3.77Å; L401-I407 HydrophobicContact CB-CG1 3.83Å; L401-I407 HydrophobicContact CB-CG2 4.29Å; L401-I407 HydrophobicContact CD1-CD1 4.38Å; L401-I407 HydrophobicContact CD1-CG2 4.3Å; L401-I407 PolarHBondContact O-N 3.49Å
402F97.3Very high95.3Very high0 Ų024.6 Ų24.60%012%0.123CC..Hα-helixtrans-67.6-46.7173.8-73.2-54.5000111.8F376 F398 A399 T404 D405 I407 S408 W409 P412 L413 L434 L438F376-F402 AromaticContact CD2-CE2 3.89Å; F376-F402 HydrophobicContact CD2-CE2 3.89Å; F376-F402 AromaticContact CD2-CZ 3.98Å; F376-F402 HydrophobicContact CD2-CZ 3.98Å; F376-F402 HydrophobicContact CE1-CZ 4.49Å; F376-F402 AromaticContact CE2-CE2 3.53Å; F376-F402 HydrophobicContact CE2-CE2 3.53Å; F376-F402 AromaticContact CE2-CZ 3.89Å; F376-F402 HydrophobicContact CE2-CZ 3.89Å; F376-F402 HydrophobicContact CG-CZ 4.33Å; F376-F402 HydrophobicContact CZ-CE2 4.02Å; F376-F402 HydrophobicContact CZ-CZ 4.13Å; F398-F402 HydrophobicContact CB-CD2 4.46Å; F398-F402 HydrophobicContact CB-CE2 4.19Å; F398-F402 WeakPolarHBondContact O-CD2 3.4Å; F398-F402 PolarHBondContact O-N 2.82Å; A399-F402 PolarHBondContact O-N 3.01Å; F402-T404 VanDerWaalsContact C-N 3.3Å; F402-T404 PolarHBondContact O-N 3.32Å; F402-D405 PolarHBondContact O-N 3.48Å; F402-I407 HydrophobicContact CD1-CD1 3.87Å; F402-I407 HydrophobicContact CD1-CG1 3.69Å; F402-I407 HydrophobicContact CE1-CD1 3.58Å; F402-I407 HydrophobicContact CE1-CG1 3.76Å; F402-I407 HydrophobicContact CE2-CD1 4.29Å; F402-I407 HydrophobicContact CG-CD1 4.32Å; F402-I407 HydrophobicContact CG-CG1 4.35Å; F402-I407 HydrophobicContact CZ-CD1 3.81Å; F402-I407 HydrophobicContact CZ-CG1 4.48Å; F402-S408 WeakPolarHBondContact CE1-O 3.42Å; F402-W409 HydrophobicContact CB-CD2 4.22Å; F402-W409 HydrophobicContact CB-CH2 4.21Å; F402-W409 HydrophobicContact CB-CZ2 3.71Å; F402-W409 HydrophobicContact CD1-CB 4.42Å; F402-W409 HydrophobicContact CD1-CD2 4.03Å; F402-W409 AromaticContact CD1-CG 3.91Å; F402-W409 HydrophobicContact CD1-CG 3.91Å; F402-W409 HydrophobicContact CG-CD2 4.38Å; F402-W409 VanDerWaalsContact O-CE2 3.32Å; F402-W409 VanDerWaalsContact O-CZ2 3.29Å; F402-W409 WeakPolarHBondContact O-CZ2 3.22Å; F402-W409 PolarHBondContact O-NE1 3.5Å; F402-P412 HydrophobicContact CE1-CB 4.32Å; F402-P412 HydrophobicContact CE1-CG 4.23Å; F402-P412 HydrophobicContact CZ-CB 4.02Å; F402-P412 HydrophobicContact CZ-CG 4.38Å; F402-L413 HydrophobicContact CE1-CD2 4.37Å; F402-L413 HydrophobicContact CE1-CG 4.14Å; F402-L413 HydrophobicContact CE2-CD2 3.86Å; F402-L413 HydrophobicContact CZ-CD2 3.69Å; F402-L413 HydrophobicContact CZ-CG 3.93Å; F402-L434 HydrophobicContact CD2-CD1 4.13Å; F402-L434 HydrophobicContact CE2-CD1 4.26Å; F402-L438 HydrophobicContact CB-CD2 4.05Å
403F95.9Very high95.1Very high75 Ų7521.8 Ų21.833%0.32911%0.113SC..Hα-helixtrans-58-43.1179.7162.3-118.5000112.4A399 H400 D405 L438 F441 M442A399-F403 VanDerWaalsContact O-CB 3.26Å; A399-F403 WeakPolarHBondContact O-CB 2.95Å; A399-F403 PolarHBondContact O-N 3.31Å; H400-F403 PolarHBondContact O-N 3.27Å; F403-D405 PolarHBondContact O-N 2.91Å; F403-L438 HydrophobicContact CB-CD2 4.25Å; F403-F441 HydrophobicContact CB-CB 4.12Å; F403-F441 HydrophobicContact CB-CD2 3.83Å; F403-F441 HydrophobicContact CB-CG 4.29Å; F403-F441 HydrophobicContact CD1-CB 3.74Å; F403-F441 HydrophobicContact CD1-CD1 4.39Å; F403-F441 HydrophobicContact CD1-CD2 4Å; F403-F441 AromaticContact CD1-CG 3.81Å; F403-F441 HydrophobicContact CD1-CG 3.81Å; F403-F441 HydrophobicContact CD2-CB 3.64Å; F403-F441 HydrophobicContact CE1-CB 4.02Å; F403-F441 HydrophobicContact CE1-CG 4.27Å; F403-F441 HydrophobicContact CE2-CB 3.9Å; F403-F441 HydrophobicContact CG-CB 3.52Å; F403-F441 AromaticContact CG-CD2 3.98Å; F403-F441 HydrophobicContact CG-CD2 3.98Å; F403-F441 AromaticContact CG-CG 3.94Å; F403-F441 HydrophobicContact CG-CG 3.94Å; F403-F441 HydrophobicContact CZ-CB 4.08Å; F403-M442 HydrophobicContact CD2-CG 3.26Å; F403-M442 HydrophobicContact CD2-SD 3.94Å; F403-M442 HydrophobicContact CE2-CG 3.68Å; F403-M442 HydrophobicContact CG-CG 4.34Å
404T95.9Very high94.9Very high28 Ų2827 Ų2717%0.17214%0.137CC..THydrogen-bonded Turntrans-80.72.7-179.6560000113.7H400 L401 F402 S406H400-T404 WeakPolarHBondContact O-CB 3.24Å; H400-T404 WeakPolarHBondContact O-CG2 3.46Å; H400-T404 PolarHBondContact O-N 2.81Å; H400-T404 PolarHBondContact O-OG1 3.46Å; L401-T404 PolarHBondContact O-OG1 3.36Å; F402-T404 VanDerWaalsContact C-N 3.3Å; F402-T404 PolarHBondContact O-N 3.32Å; T404-S406 PolarHBondContact O-N 3.22Å; T404-S406 VanDerWaalsContact O-N 3.16Å; T404-S406 PolarHBondContact OG1-OG 3.01Å
405D95.3Very high94.5Very high86 Ų8629 Ų2946%0.4615%0.15SC..THydrogen-bonded Turntrans51.432.6-173.7-63.5-40.2000112.2L401 F402 F403 I407 W409 R450L401-D405 PolarHBondContact O-N 2.78Å; F402-D405 PolarHBondContact O-N 3.48Å; F403-D405 PolarHBondContact O-N 2.91Å; D405-I407 VanDerWaalsContact C-N 3.33Å; D405-W409 PolarHBondContact OD1-NE1 3.14Å; D405-R450 IonicContact OD1-CZ 3.7Å; D405-R450 IonicContact OD1-NH1 3.86Å; D405-R450 PolarHBondContact OD1-NH1 3.21Å; D405-R450 IonicContact OD1-NH2 2.74Å; D405-R450 IonicContact OD2-CZ 2.96Å; D405-R450 IonicContact OD2-NH1 3.94Å; D405-R450 PolarHBondContact OD2-NH1 3.06Å; D405-R450 IonicContact OD2-NH2 3.34Å; D405-R450 PolarHBondContact OD2-NH2 3.34Å
406S95.7Very high94.3Very high6 Ų629 Ų294%0.04215%0.15CC..SBendtrans-76.9-23.7176.6-63.40000112.3E359 C362 Q369 L401 T404E359-S406 WeakPolarHBondContact CG-OG 3.11Å; C362-S406 VanDerWaalsContact CB-O 3.29Å; C362-S406 WeakPolarHBondContact CB-O 3.47Å; Q369-S406 WeakPolarHBondContact CG-O 3.36Å; L401-S406 PolarHBondContact O-N 3.42Å; T404-S406 PolarHBondContact O-N 3.22Å; T404-S406 VanDerWaalsContact O-N 3.16Å; T404-S406 PolarHBondContact OG1-OG 3.01Å
407I96Very high94.1Very high2 Ų232.8 Ų32.81%0.0116%0.164CC..SBendtrans-128153.6170.865.1178.9000110.1Q369 F372 E373 F398 L401 F402 D405Q369-I407 HydrophobicContact CG-CG2 4.33Å; F372-I407 HydrophobicContact CB-CG2 3.83Å; E373-I407 HydrophobicContact CG-CB 3.83Å; E373-I407 HydrophobicContact CG-CG2 4.21Å; F398-I407 HydrophobicContact CD1-CD1 4.24Å; L401-I407 HydrophobicContact CB-CD1 3.77Å; L401-I407 HydrophobicContact CB-CG1 3.83Å; L401-I407 HydrophobicContact CB-CG2 4.29Å; L401-I407 HydrophobicContact CD1-CD1 4.38Å; L401-I407 HydrophobicContact CD1-CG2 4.3Å; L401-I407 PolarHBondContact O-N 3.49Å; F402-I407 HydrophobicContact CD1-CD1 3.87Å; F402-I407 HydrophobicContact CD1-CG1 3.69Å; F402-I407 HydrophobicContact CE1-CD1 3.58Å; F402-I407 HydrophobicContact CE1-CG1 3.76Å; F402-I407 HydrophobicContact CE2-CD1 4.29Å; F402-I407 HydrophobicContact CG-CD1 4.32Å; F402-I407 HydrophobicContact CG-CG1 4.35Å; F402-I407 HydrophobicContact CZ-CD1 3.81Å; F402-I407 HydrophobicContact CZ-CG1 4.48Å; D405-I407 VanDerWaalsContact C-N 3.33Å
408S93.9Very high93.8Very high37 Ų3732.8 Ų32.826%0.25916%0.164SC..  trans-67.4140174.8-1770000110.2E373 F402 M410 P412E373-S408 WeakPolarHBondContact OE1-CB 3.48Å; E373-S408 PolarHBondContact OE1-N 2.94Å; F402-S408 WeakPolarHBondContact CE1-O 3.42Å; S408-M410 PolarHBondContact OG-N 3.3Å; S408-P412 WeakPolarHBondContact O-CD 3.36Å; S408-P412 VanDerWaalsContact O-CG 3.24Å; S408-P412 WeakPolarHBondContact O-CG 3.38Å
409W94Very high93.5Very high7 Ų733.3 Ų33.33%0.02717%0.168CC..SBendtrans-78.8-27.4172.4-63.958.1000111.5F402 D405 L413 L438 M442 L447 R450 M456 F460F402-W409 HydrophobicContact CB-CD2 4.22Å; F402-W409 HydrophobicContact CB-CH2 4.21Å; F402-W409 HydrophobicContact CB-CZ2 3.71Å; F402-W409 HydrophobicContact CD1-CB 4.42Å; F402-W409 HydrophobicContact CD1-CD2 4.03Å; F402-W409 AromaticContact CD1-CG 3.91Å; F402-W409 HydrophobicContact CD1-CG 3.91Å; F402-W409 HydrophobicContact CG-CD2 4.38Å; F402-W409 VanDerWaalsContact O-CE2 3.32Å; F402-W409 VanDerWaalsContact O-CZ2 3.29Å; F402-W409 WeakPolarHBondContact O-CZ2 3.22Å; F402-W409 PolarHBondContact O-NE1 3.5Å; D405-W409 PolarHBondContact OD1-NE1 3.14Å; W409-L413 HydrophobicContact CB-CD1 4.06Å; W409-L413 HydrophobicContact CD2-CD1 4.34Å; W409-L413 HydrophobicContact CE3-CD1 3.62Å; W409-L413 HydrophobicContact CZ3-CD1 4.44Å; W409-L413 VanDerWaalsContact O-CB 3.27Å; W409-L413 WeakPolarHBondContact O-CB 3.27Å; W409-L413 WeakPolarHBondContact O-CG 3.04Å; W409-L413 PolarHBondContact O-N 3.39Å; W409-L438 HydrophobicContact CH2-CD1 4.07Å; W409-L438 HydrophobicContact CH2-CD2 3.9Å; W409-L438 HydrophobicContact CZ2-CD2 4.36Å; W409-L438 HydrophobicContact CZ3-CD1 4.14Å; W409-M442 HydrophobicContact CH2-SD 4.34Å; W409-M442 HydrophobicContact CZ2-SD 4.4Å; W409-L447 HydrophobicContact CH2-CD1 3.95Å; W409-L447 HydrophobicContact CZ3-CD1 4.09Å; W409-R450 VanDerWaalsContact CZ2-NH1 3.35Å; W409-M456 HydrophobicContact CB-CE 3.53Å; W409-M456 HydrophobicContact CG-CE 4.01Å; W409-F460 AromaticContact CE3-CE1 3.98Å; W409-F460 HydrophobicContact CE3-CE1 3.98Å; W409-F460 AromaticContact CE3-CZ 3.52Å; W409-F460 HydrophobicContact CE3-CZ 3.52Å; W409-F460 HydrophobicContact CZ3-CE1 4.18Å; W409-F460 AromaticContact CZ3-CZ 3.84Å; W409-F460 HydrophobicContact CZ3-CZ 3.84Å
410M89.3Confident92.9Very high65 Ų6538.7 Ų38.732%0.3219%0.193SC..Hα-helixtrans-66.3-51-169.9-66.7-71-7700112.8S408 H414 M456 A458 A459S408-M410 PolarHBondContact OG-N 3.3Å; M410-H414 WeakPolarHBondContact O-CB 3.44Å; M410-M456 HydrophobicContact CG-CE 4.29Å; M410-M456 HydrophobicContact CG-SD 4.29Å; M410-M456 HydrophobicContact SD-CE 4.29Å; M410-M456 HydrophobicContact SD-SD 3.99Å; M410-A458 HydrophobicContact CE-CB 3.97Å; M410-A459 HydrophobicContact SD-CB 3.77Å
411V85.3Confident92.3Very high69 Ų6943 Ų4342%0.41823%0.229SC..Hα-helixtrans-75.9-44.7-171.7177.40000112.6K377K377-V411 WeakPolarHBondContact CE-O 3.47Å
412P88.7Confident91.8Very high0 Ų047 Ų470%025%0.251CS..Hα-helixtrans-77.4-42.3-176.3-16.733.2000112.9E373 F376 F402 S408 H414 C415E373-P412 HydrophobicContact CB-CG 3.85Å; E373-P412 HydrophobicContact CG-CG 3.74Å; F376-P412 HydrophobicContact CB-CB 3.92Å; F376-P412 HydrophobicContact CD1-CB 3.31Å; F376-P412 HydrophobicContact CE1-CB 3.98Å; F376-P412 WeakPolarHBondContact CE1-O 3.46Å; F376-P412 HydrophobicContact CG-CB 3.71Å; F402-P412 HydrophobicContact CE1-CB 4.32Å; F402-P412 HydrophobicContact CE1-CG 4.23Å; F402-P412 HydrophobicContact CZ-CB 4.02Å; F402-P412 HydrophobicContact CZ-CG 4.38Å; S408-P412 WeakPolarHBondContact O-CD 3.36Å; S408-P412 VanDerWaalsContact O-CG 3.24Å; S408-P412 WeakPolarHBondContact O-CG 3.38Å; P412-H414 VanDerWaalsContact C-N 3.27Å; P412-H414 PolarHBondContact O-N 3.39Å; P412-C415 PolarHBondContact O-N 3.43Å; P412-C415 PolarHBondContact O-SG 2.9Å
413L92Very high91.4Very high4 Ų447.4 Ų47.42%0.02125%0.253CS..Hα-helixtrans-70.9-24.4-175.4-62.6179.2000113.1F376 F402 W409 C415 I416 L434 A459 F460 L463F376-L413 HydrophobicContact CE1-CD2 4.14Å; F376-L413 HydrophobicContact CZ-CD2 3.79Å; F402-L413 HydrophobicContact CE1-CD2 4.37Å; F402-L413 HydrophobicContact CE1-CG 4.14Å; F402-L413 HydrophobicContact CE2-CD2 3.86Å; F402-L413 HydrophobicContact CZ-CD2 3.69Å; F402-L413 HydrophobicContact CZ-CG 3.93Å; W409-L413 HydrophobicContact CB-CD1 4.06Å; W409-L413 HydrophobicContact CD2-CD1 4.34Å; W409-L413 HydrophobicContact CE3-CD1 3.62Å; W409-L413 HydrophobicContact CZ3-CD1 4.44Å; W409-L413 VanDerWaalsContact O-CB 3.27Å; W409-L413 WeakPolarHBondContact O-CB 3.27Å; W409-L413 WeakPolarHBondContact O-CG 3.04Å; W409-L413 PolarHBondContact O-N 3.39Å; L413-C415 PolarHBondContact O-N 2.9Å; L413-C415 VanDerWaalsContact O-N 3.14Å; L413-I416 HydrophobicContact CD2-CD1 4.3Å; L413-I416 WeakPolarHBondContact O-CB 3.41Å; L413-I416 PolarHBondContact O-N 3Å; L413-L434 HydrophobicContact CD2-CD2 4.36Å; L413-A459 CarbonylContact C-O 3.57Å; L413-A459 WeakPolarHBondContact CB-O 3.41Å; L413-F460 HydrophobicContact CD1-CD1 4.4Å; L413-F460 HydrophobicContact CD1-CE1 3.8Å; L413-F460 HydrophobicContact CD1-CZ 4.36Å; L413-L463 HydrophobicContact CB-CD1 4.16Å; L413-L463 HydrophobicContact CD2-CD1 4.26Å
414H89.4Confident91.1Very high110 Ų11047 Ų4751%0.50926%0.257SS..THydrogen-bonded Turntrans-61.1-22.1178.4-170.779.6000113.9M410 P412 I416 A458M410-H414 WeakPolarHBondContact O-CB 3.44Å; P412-H414 VanDerWaalsContact C-N 3.27Å; P412-H414 PolarHBondContact O-N 3.39Å; H414-I416 PolarHBondContact O-N 3.33Å; H414-A458 PolarHBondContact ND1-O 3.01Å
415C89.3Confident90.7Very high42 Ų4249.6 Ų49.628%0.28428%0.276SS..THydrogen-bonded Turntrans-74-14176.375.20000113.2K377 P412 L413K377-C415 HydrophobicContact CG-CB 4.39Å; P412-C415 PolarHBondContact O-N 3.43Å; P412-C415 PolarHBondContact O-SG 2.9Å; L413-C415 PolarHBondContact O-N 2.9Å; L413-C415 VanDerWaalsContact O-N 3.14Å
416I93.9Very high90.4Very high0 Ų047.4 Ų47.40%027%0.267CS..  trans-89.3123.7-176.6-57.7-178.6000110F376 Y380 L413 H414 I431 G462 L463F376-I416 HydrophobicContact CE1-CD1 3.85Å; F376-I416 HydrophobicContact CE1-CG1 4.35Å; F376-I416 HydrophobicContact CZ-CD1 3.72Å; Y380-I416 HydrophobicContact CD1-CG1 3.94Å; Y380-I416 HydrophobicContact CD2-CD1 3.95Å; Y380-I416 HydrophobicContact CD2-CG1 4.01Å; Y380-I416 HydrophobicContact CE1-CB 4.28Å; Y380-I416 HydrophobicContact CE1-CG1 3.78Å; Y380-I416 HydrophobicContact CE1-CG2 4.39Å; Y380-I416 HydrophobicContact CE2-CD1 3.92Å; Y380-I416 HydrophobicContact CE2-CG1 3.85Å; Y380-I416 HydrophobicContact CE2-CG2 4.24Å; Y380-I416 HydrophobicContact CG-CD1 4.37Å; Y380-I416 HydrophobicContact CG-CG1 4.06Å; L413-I416 HydrophobicContact CD2-CD1 4.3Å; L413-I416 WeakPolarHBondContact O-CB 3.41Å; L413-I416 PolarHBondContact O-N 3Å; H414-I416 PolarHBondContact O-N 3.33Å; I416-I431 HydrophobicContact CG2-CD1 3.66Å; I416-I431 HydrophobicContact CG2-CG1 4.25Å; I416-G462 CarbonylContact O-C 3.5Å; I416-G462 VanDerWaalsContact O-C 3.28Å; I416-G462 WeakPolarHBondContact O-CA 3.41Å; I416-L463 HydrophobicContact CB-CD2 4.19Å; I416-L463 HydrophobicContact CB-CG 4.12Å; I416-L463 HydrophobicContact CG2-CD2 3.47Å; I416-L463 VanDerWaalsContact CG2-CD2 3.47Å; I416-L463 HydrophobicContact CG2-CG 3.87Å
417R92.8Very high90.2Very high151 Ų15147.3 Ų47.357%0.5727%0.266SS*.  trans-118.2106.4170.6-65.5-176.8-176.8174.50.5109.8T419 D422 T423 G462R417-T419 PolarHBondContact O-N 2.96Å; R417-D422 HydrophobicContact CB-CB 3.85Å; R417-D422 WeakPolarHBondContact CB-OD2 3.48Å; R417-D422 WeakPolarHBondContact O-CB 3.39Å; R417-T423 WeakPolarHBondContact O-CG2 3.25Å; R417-G462 CarbonylContact C-O 3.46Å; R417-G462 WeakPolarHBondContact CA-O 3.33Å
418L93.7Very high90Very high0 Ų050.6 Ų50.60%028%0.278CS..  trans-8171.7178.7-173.361.9000110.6T423 I431 G462 F474 A475 F478 Y479L418-T423 HydrophobicContact CD1-CG2 3.99Å; L418-I431 HydrophobicContact CD1-CD1 4.06Å; L418-G462 PolarHBondContact N-O 2.88Å; L418-F474 HydrophobicContact CD1-CE1 4.16Å; L418-F474 HydrophobicContact CG-CE1 4.4Å; L418-A475 HydrophobicContact CD2-CB 3.88Å; L418-A475 HydrophobicContact CG-CB 4.26Å; L418-F478 HydrophobicContact CD1-CD1 4.07Å; L418-F478 HydrophobicContact CD1-CD2 4.47Å; L418-F478 HydrophobicContact CD1-CE1 4.39Å; L418-F478 HydrophobicContact CD1-CG 4.09Å; L418-F478 HydrophobicContact CD2-CB 4.29Å; L418-F478 HydrophobicContact CD2-CD1 3.5Å; L418-F478 VanDerWaalsContact CD2-CD1 3.5Å; L418-F478 HydrophobicContact CD2-CE1 4.11Å; L418-F478 HydrophobicContact CD2-CG 4.08Å; L418-F478 HydrophobicContact CG-CD1 4.39Å; L418-Y479 HydrophobicContact CD2-CD2 4.16Å; L418-Y479 HydrophobicContact CD2-CE2 3.56Å
419T90.6Very high89.9Confident12 Ų1252.4 Ų52.47%0.07429%0.285CS..SBendtrans-122.3163.717474.50000110.4R417 A421 D422 T423 N471 F474R417-T419 PolarHBondContact O-N 2.96Å; T419-A421 PolarHBondContact O-N 3.29Å; T419-D422 VanDerWaalsContact OG1-CB 3.32Å; T419-D422 WeakPolarHBondContact OG1-CB 3.5Å; T419-D422 VanDerWaalsContact OG1-CG 3.25Å; T419-D422 PolarHBondContact OG1-N 2.91Å; T419-D422 PolarHBondContact OG1-OD2 3.24Å; T419-T423 WeakPolarHBondContact O-CB 3.21Å; T419-T423 PolarHBondContact O-N 2.89Å; T419-T423 PolarHBondContact O-OG1 3.46Å; T419-N471 HydrophobicContact CG2-CB 4.22Å; T419-F474 VanDerWaalsContact C-CE1 3.47Å
420E85.5Confident90Very high112 Ų11252.1 Ų52.152%0.52328%0.283SS..THydrogen-bonded Turntrans-62-34.3176.9-172.6172.6-170.200112.3R428 H470 F474E420-R428 PolarHBondContact O-NH2 3.33Å; E420-H470 IonicContact OE2-CE1 3.6Å; E420-H470 IonicContact OE2-NE2 3.97Å; E420-H470 PolarHBondContact OE2-NE2 3.39Å; E420-F474 HydrophobicContact CB-CD2 3.79Å; E420-F474 HydrophobicContact CB-CE2 3.74Å; E420-F474 HydrophobicContact CB-CG 4.37Å; E420-F474 HydrophobicContact CB-CZ 4.29Å; E420-F474 HydrophobicContact CG-CD2 4.37Å; E420-F474 HydrophobicContact CG-CE2 4.06Å
421A86.4Confident90.3Very high96 Ų9649 Ų4979%0.79327%0.268SS*.THydrogen-bonded Turntrans-82-38.7-177.200000113.1T419T419-A421 PolarHBondContact O-N 3.29Å
422D87.4Confident90.9Very high86 Ų8650 Ų5046%0.4627%0.267SS..THydrogen-bonded Turntrans-87.7-21.4-173.8-60.9-50000112.9R417 T419R417-D422 HydrophobicContact CB-CB 3.85Å; R417-D422 WeakPolarHBondContact CB-OD2 3.48Å; R417-D422 WeakPolarHBondContact O-CB 3.39Å; T419-D422 VanDerWaalsContact OG1-CB 3.32Å; T419-D422 WeakPolarHBondContact OG1-CB 3.5Å; T419-D422 VanDerWaalsContact OG1-CG 3.25Å; T419-D422 PolarHBondContact OG1-N 2.91Å; T419-D422 PolarHBondContact OG1-OD2 3.24Å
423T89.4Confident91.3Very high7 Ų751.4 Ų51.44%0.04327%0.274CS..  trans-103.7135.6-177.364.20000114.1R417 L418 T419 S427 R428R417-T423 WeakPolarHBondContact O-CG2 3.25Å; L418-T423 HydrophobicContact CD1-CG2 3.99Å; T419-T423 WeakPolarHBondContact O-CB 3.21Å; T419-T423 PolarHBondContact O-N 2.89Å; T419-T423 PolarHBondContact O-OG1 3.46Å; T423-S427 WeakPolarHBondContact CA-OG 3.39Å; T423-S427 WeakPolarHBondContact CB-OG 3.04Å; T423-R428 PolarHBondContact O-NH2 2.94Å; T423-R428 PolarHBondContact OG1-NE 2.77Å; T423-R428 PolarHBondContact OG1-NH2 2.97Å
424T88.6Confident91.6Very high68 Ų6851.3 Ų51.342%0.41727%0.273SS..  trans-98.5169.5170.861.90000110.8S427 R428T424-S427 PolarHBondContact N-OG 2.98Å; T424-S427 PolarHBondContact O-N 3.34Å; T424-S427 PolarHBondContact O-OG 2.92Å; T424-S427 VanDerWaalsContact O-OG 3.07Å; T424-S427 PolarHBondContact OG1-N 2.65Å; T424-R428 VanDerWaalsContact O-CG 3.28Å; T424-R428 WeakPolarHBondContact O-CG 3.42Å; T424-R428 PolarHBondContact O-N 2.88Å
425S88.7Confident92Very high82 Ų8246.1 Ų46.157%0.57325%0.249SC*.Hα-helixtrans-57.7-45.9176.5-58.30000113.1S427 R428 I429S425-S427 PolarHBondContact O-N 2.7Å; S425-R428 PolarHBondContact O-N 3.38Å; S425-I429 WeakPolarHBondContact O-CG1 3.35Å; S425-I429 PolarHBondContact O-N 3.44Å
426P87.6Confident92.4Very high39 Ų3947.4 Ų47.425%0.25325%0.251SS..Hα-helixtrans-60.2-42.8174.6-26.237.1000113.2V383 L391 R428 I429 F430V383-P426 HydrophobicContact CG1-CB 4.42Å; L391-P426 HydrophobicContact CD1-CB 4.07Å; P426-R428 VanDerWaalsContact C-N 3.31Å; P426-R428 PolarHBondContact O-N 2.97Å; P426-I429 PolarHBondContact O-N 2.7Å; P426-I429 VanDerWaalsContact O-N 3.13Å; P426-F430 PolarHBondContact O-N 3.06Å
427S91.7Very high92.6Very high5 Ų548.2 Ų48.24%0.03526%0.255CS..Hα-helixtrans-65.8-35.7179.274.90000112.3T423 T424 S425 F430 I431T423-S427 WeakPolarHBondContact CA-OG 3.39Å; T423-S427 WeakPolarHBondContact CB-OG 3.04Å; T424-S427 PolarHBondContact N-OG 2.98Å; T424-S427 PolarHBondContact O-N 3.34Å; T424-S427 PolarHBondContact O-OG 2.92Å; T424-S427 VanDerWaalsContact O-OG 3.07Å; T424-S427 PolarHBondContact OG1-N 2.65Å; S425-S427 PolarHBondContact O-N 2.7Å; S427-F430 PolarHBondContact O-N 2.76Å; S427-I431 VanDerWaalsContact O-CG1 3.25Å; S427-I431 WeakPolarHBondContact O-CG1 3.45Å; S427-I431 PolarHBondContact O-N 3.37Å
428R91.6Very high92.8Very high70 Ų7041.2 Ų41.226%0.26423%0.229SC..Hα-helixtrans-64.4-39.1171.7-68.8171.1-162.2172.76.5112.5E420 T423 T424 S425 P426 K432 F478E420-R428 PolarHBondContact O-NH2 3.33Å; T423-R428 PolarHBondContact O-NH2 2.94Å; T423-R428 PolarHBondContact OG1-NE 2.77Å; T423-R428 PolarHBondContact OG1-NH2 2.97Å; T424-R428 VanDerWaalsContact O-CG 3.28Å; T424-R428 WeakPolarHBondContact O-CG 3.42Å; T424-R428 PolarHBondContact O-N 2.88Å; S425-R428 PolarHBondContact O-N 3.38Å; P426-R428 VanDerWaalsContact C-N 3.31Å; P426-R428 PolarHBondContact O-N 2.97Å; R428-K432 VanDerWaalsContact O-CB 3.27Å; R428-K432 WeakPolarHBondContact O-CB 3.29Å; R428-K432 PolarHBondContact O-N 3.35Å; R428-F478 HydrophobicContact CB-CD2 4.46Å; R428-F478 HydrophobicContact CB-CE2 3.84Å; R428-F478 HydrophobicContact CG-CD2 4.49Å; R428-F478 HydrophobicContact CG-CE2 4.28Å; R428-F478 WeakPolarHBondContact O-CZ 3.47Å
429I91.6Very high93Very high76 Ų7642.6 Ų42.639%0.3924%0.237SC..Hα-helixtrans-66-41.3175-66.3165.8000110.4L391 S425 P426 K432 I433L391-I429 HydrophobicContact CD1-CG2 4.47Å; L391-I429 HydrophobicContact CD2-CG2 3.89Å; S425-I429 WeakPolarHBondContact O-CG1 3.35Å; S425-I429 PolarHBondContact O-N 3.44Å; P426-I429 PolarHBondContact O-N 2.7Å; P426-I429 VanDerWaalsContact O-N 3.13Å; I429-K432 WeakPolarHBondContact O-CB 3.4Å; I429-K432 PolarHBondContact O-N 3Å; I429-I433 HydrophobicContact CG2-CD1 3.82Å; I429-I433 HydrophobicContact CG2-CG1 4.44Å; I429-I433 WeakPolarHBondContact O-CG1 3.38Å; I429-I433 PolarHBondContact O-N 2.74Å
430F96.6Very high93.3Very high0 Ų048.7 Ų48.70%027%0.265CS..Hα-helixtrans-61.2-49.9176.7-175.2-84.3000111.4F376 V379 Y380 V383 L391 A395 F398 P426 S427 K432 I433 L434F376-F430 AromaticContact CE2-CE1 3.95Å; F376-F430 HydrophobicContact CE2-CE1 3.95Å; F376-F430 HydrophobicContact CE2-CZ 4.2Å; F376-F430 HydrophobicContact CZ-CE1 4.22Å; V379-F430 HydrophobicContact CG1-CE2 3.82Å; V379-F430 HydrophobicContact CG1-CZ 4.16Å; Y380-F430 AromaticContact CD2-CD1 3.92Å; Y380-F430 HydrophobicContact CD2-CD1 3.92Å; Y380-F430 HydrophobicContact CD2-CE1 4.19Å; Y380-F430 HydrophobicContact CE2-CD1 4.44Å; V383-F430 HydrophobicContact CG2-CB 3.86Å; V383-F430 HydrophobicContact CG2-CD2 3.82Å; V383-F430 HydrophobicContact CG2-CG 4.08Å; L391-F430 HydrophobicContact CD2-CB 3.94Å; L391-F430 HydrophobicContact CD2-CD2 4.13Å; L391-F430 HydrophobicContact CG-CB 4.18Å; L391-F430 HydrophobicContact CG-CD2 4.07Å; A395-F430 HydrophobicContact CB-CD2 3.77Å; A395-F430 HydrophobicContact CB-CE2 3.72Å; A395-F430 HydrophobicContact CB-CG 4.21Å; A395-F430 HydrophobicContact CB-CZ 4.11Å; F398-F430 HydrophobicContact CD2-CZ 4.2Å; P426-F430 PolarHBondContact O-N 3.06Å; S427-F430 PolarHBondContact O-N 2.76Å; F430-K432 VanDerWaalsContact C-N 3.3Å; F430-K432 PolarHBondContact O-N 3.43Å; F430-I433 PolarHBondContact O-N 3.33Å; F430-L434 HydrophobicContact CE1-CD2 4.47Å; F430-L434 WeakPolarHBondContact O-CB 3.22Å; F430-L434 PolarHBondContact O-N 3.16Å
431I96.7Very high93.8Very high0 Ų046.3 Ų46.30%025%0.253CS..Hα-helixtrans-59.3-43.2175.9-64.4165.1000110.4Y380 I416 L418 S427 I433 L434 F435 L463 F478Y380-I431 HydrophobicContact CE2-CD1 4.2Å; Y380-I431 HydrophobicContact CE2-CG1 4.09Å; I416-I431 HydrophobicContact CG2-CD1 3.66Å; I416-I431 HydrophobicContact CG2-CG1 4.25Å; L418-I431 HydrophobicContact CD1-CD1 4.06Å; S427-I431 VanDerWaalsContact O-CG1 3.25Å; S427-I431 WeakPolarHBondContact O-CG1 3.45Å; S427-I431 PolarHBondContact O-N 3.37Å; I431-I433 PolarHBondContact O-N 2.98Å; I431-L434 PolarHBondContact O-N 3.44Å; I431-F435 HydrophobicContact CG2-CD2 3.76Å; I431-F435 HydrophobicContact CG2-CE2 3.99Å; I431-F435 WeakPolarHBondContact O-CD2 3.25Å; I431-F435 PolarHBondContact O-N 2.89Å; I431-L463 HydrophobicContact CD1-CD2 4.36Å; I431-L463 HydrophobicContact CG1-CD2 4.48Å; I431-L463 HydrophobicContact CG2-CD2 4.02Å; I431-F478 HydrophobicContact CB-CE1 4.4Å; I431-F478 HydrophobicContact CB-CZ 4.11Å; I431-F478 HydrophobicContact CG2-CE1 3.69Å; I431-F478 HydrophobicContact CG2-CZ 3.9Å
432K96.9Very high94.2Very high90 Ų9043.4 Ų43.439%0.39122%0.223SC..Hα-helixtrans-56-51.7176.6169.9-178.6179.5-177.70111.2R428 I429 F430 H436 F478 I482R428-K432 VanDerWaalsContact O-CB 3.27Å; R428-K432 WeakPolarHBondContact O-CB 3.29Å; R428-K432 PolarHBondContact O-N 3.35Å; I429-K432 WeakPolarHBondContact O-CB 3.4Å; I429-K432 PolarHBondContact O-N 3Å; F430-K432 VanDerWaalsContact C-N 3.3Å; F430-K432 PolarHBondContact O-N 3.43Å; K432-H436 WeakPolarHBondContact CE-NE2 3.47Å; K432-H436 VanDerWaalsContact CG-CD2 3.47Å; K432-H436 WeakPolarHBondContact CG-CD2 3.29Å; K432-H436 WeakPolarHBondContact O-CB 3.26Å; K432-H436 PolarHBondContact O-CD2 2.91Å; K432-H436 PolarHBondContact O-N 3Å; K432-F478 HydrophobicContact CB-CZ 4.15Å; K432-I482 HydrophobicContact CB-CD1 4.23Å; K432-I482 HydrophobicContact CB-CG2 4.11Å; K432-I482 HydrophobicContact CD-CB 4.27Å; K432-I482 HydrophobicContact CD-CG2 3.68Å; K432-I482 HydrophobicContact CG-CB 4.08Å; K432-I482 HydrophobicContact CG-CD1 4.26Å; K432-I482 HydrophobicContact CG-CG2 3.77Å
433I96.8Very high94.5Very high30 Ų3040.9 Ų40.915%0.15422%0.217CC..Hα-helixtrans-65.3-46.4-177.6-66.2168.7000110.3L391 R392 A395 R396 I429 F430 I431 F435 H436 E437L391-I433 HydrophobicContact CD2-CD1 3.82Å; R392-I433 HydrophobicContact CB-CD1 3.93Å; R392-I433 HydrophobicContact CG-CD1 4.14Å; R392-I433 HydrophobicContact CG-CG2 4.45Å; A395-I433 HydrophobicContact CB-CB 4.01Å; A395-I433 HydrophobicContact CB-CG2 3.74Å; R396-I433 HydrophobicContact CG-CG2 4.04Å; I429-I433 HydrophobicContact CG2-CD1 3.82Å; I429-I433 HydrophobicContact CG2-CG1 4.44Å; I429-I433 WeakPolarHBondContact O-CG1 3.38Å; I429-I433 PolarHBondContact O-N 2.74Å; F430-I433 PolarHBondContact O-N 3.33Å; I431-I433 PolarHBondContact O-N 2.98Å; I433-F435 PolarHBondContact O-N 3.15Å; I433-H436 PolarHBondContact O-N 2.98Å; I433-E437 WeakPolarHBondContact O-CB 3.36Å; I433-E437 PolarHBondContact O-N 3.38Å
434L98Very high94.8Very high1 Ų143.9 Ų43.91%0.00523%0.233CC..Hα-helixtrans-53.1-50.9177.7-178.471.4000111.5F376 A395 F398 A399 F402 L413 F430 I431 E437 L438F376-L434 HydrophobicContact CE2-CD2 4.3Å; F376-L434 HydrophobicContact CZ-CD2 4.24Å; A395-L434 WeakPolarHBondContact O-CD1 3.43Å; F398-L434 HydrophobicContact CB-CD1 4.27Å; A399-L434 HydrophobicContact CB-CD1 3.96Å; F402-L434 HydrophobicContact CD2-CD1 4.13Å; F402-L434 HydrophobicContact CE2-CD1 4.26Å; L413-L434 HydrophobicContact CD2-CD2 4.36Å; F430-L434 HydrophobicContact CE1-CD2 4.47Å; F430-L434 WeakPolarHBondContact O-CB 3.22Å; F430-L434 PolarHBondContact O-N 3.16Å; I431-L434 PolarHBondContact O-N 3.44Å; L434-E437 PolarHBondContact O-N 2.95Å; L434-L438 HydrophobicContact CG-CD1 4.32Å; L434-L438 VanDerWaalsContact O-CG 3.3Å; L434-L438 WeakPolarHBondContact O-CG 3.23Å; L434-L438 PolarHBondContact O-N 2.77Å
435F97.9Very high95Very high1 Ų146.2 Ų46.20%0.00424%0.239CC..Hα-helixtrans-73.7-33.3-178.3-86-96.1000113.6I431 I433 E437 V439 L447 I451 L463 F464 Y479 L484 L487I431-F435 HydrophobicContact CG2-CD2 3.76Å; I431-F435 HydrophobicContact CG2-CE2 3.99Å; I431-F435 WeakPolarHBondContact O-CD2 3.25Å; I431-F435 PolarHBondContact O-N 2.89Å; I433-F435 PolarHBondContact O-N 3.15Å; F435-E437 VanDerWaalsContact C-N 3.34Å; F435-V439 WeakPolarHBondContact O-CB 3.3Å; F435-V439 VanDerWaalsContact O-CG2 3.28Å; F435-V439 WeakPolarHBondContact O-CG2 3.45Å; F435-V439 PolarHBondContact O-N 3.08Å; F435-L447 HydrophobicContact CD1-CD2 4.04Å; F435-I451 HydrophobicContact CE1-CD1 4.18Å; F435-L463 HydrophobicContact CE2-CD1 4.13Å; F435-L463 HydrophobicContact CE2-CD2 3.86Å; F435-L463 HydrophobicContact CZ-CD1 4.04Å; F435-L463 HydrophobicContact CZ-CD2 4.27Å; F435-F464 AromaticContact CE1-CE2 3.95Å; F435-F464 HydrophobicContact CE1-CE2 3.95Å; F435-F464 AromaticContact CE1-CZ 3.9Å; F435-F464 HydrophobicContact CE1-CZ 3.9Å; F435-F464 AromaticContact CZ-CE2 3.94Å; F435-F464 HydrophobicContact CZ-CE2 3.94Å; F435-F464 HydrophobicContact CZ-CZ 4.28Å; F435-Y479 AromaticContact CD1-CE1 3.93Å; F435-Y479 HydrophobicContact CD1-CE1 3.93Å; F435-Y479 HydrophobicContact CD2-CE1 4.32Å; F435-Y479 HydrophobicContact CE1-CE1 4.16Å; F435-Y479 WeakPolarHBondContact CE2-OH 3.46Å; F435-Y479 HydrophobicContact CG-CE1 4.01Å; F435-Y479 HydrophobicContact CZ-CE1 4.45Å; F435-Y479 VanDerWaalsContact CZ-OH 3.29Å; F435-Y479 WeakPolarHBondContact CZ-OH 3.4Å; F435-L484 HydrophobicContact CB-CD1 3.66Å; F435-L487 HydrophobicContact CD1-CD1 3.73Å; F435-L487 HydrophobicContact CE1-CD1 4.23Å
436H98Very high95.3Very high70 Ų7045.1 Ų45.132%0.32423%0.231SC..Hα-helixtrans-61.5-45.1171.9-84.8-61.8000111.4K432 I433 V439 E440 I482K432-H436 WeakPolarHBondContact CE-NE2 3.47Å; K432-H436 VanDerWaalsContact CG-CD2 3.47Å; K432-H436 WeakPolarHBondContact CG-CD2 3.29Å; K432-H436 WeakPolarHBondContact O-CB 3.26Å; K432-H436 PolarHBondContact O-CD2 2.91Å; K432-H436 PolarHBondContact O-N 3Å; I433-H436 PolarHBondContact O-N 2.98Å; H436-V439 PolarHBondContact O-N 3.23Å; H436-E440 PolarHBondContact O-N 3.44Å; H436-I482 PolarHBondContact CE1-O 3.29Å; H436-I482 PolarHBondContact NE2-O 2.99Å
437E97.6Very high95.7Very high17 Ų1743.2 Ų43.28%0.07922%0.219CC..Hα-helixtrans-67.8-39.4-179.7-158.186-175.500111.3R396 A399 I433 L434 F435 V439 E440 F441R396-E437 WeakPolarHBondContact CD-OE2 3.45Å; R396-E437 HydrophobicContact CG-CG 4.16Å; R396-E437 WeakPolarHBondContact CG-OE2 3.32Å; R396-E437 IonicContact CZ-OE2 3.3Å; R396-E437 IonicContact NE-OE1 3.62Å; R396-E437 IonicContact NE-OE2 3.92Å; R396-E437 PolarHBondContact NE-OE2 3.13Å; R396-E437 IonicContact NH2-OE2 3.38Å; A399-E437 HydrophobicContact CB-CB 3.63Å; A399-E437 HydrophobicContact CB-CG 3.79Å; I433-E437 WeakPolarHBondContact O-CB 3.36Å; I433-E437 PolarHBondContact O-N 3.38Å; L434-E437 PolarHBondContact O-N 2.95Å; F435-E437 VanDerWaalsContact C-N 3.34Å; E437-V439 VanDerWaalsContact C-N 3.34Å; E437-V439 PolarHBondContact O-N 3.45Å; E437-E440 WeakPolarHBondContact O-CB 3.45Å; E437-E440 PolarHBondContact O-N 2.97Å; E437-E440 VanDerWaalsContact O-N 3.16Å; E437-F441 HydrophobicContact CG-CD2 4.26Å; E437-F441 HydrophobicContact CG-CE2 3.52Å; E437-F441 HydrophobicContact CG-CZ 3.76Å; E437-F441 VanDerWaalsContact O-CD2 3.25Å; E437-F441 WeakPolarHBondContact O-CD2 3.49Å; E437-F441 WeakPolarHBondContact O-CG 3.27Å; E437-F441 PolarHBondContact O-N 3.1Å
438L97.8Very high95.9Very high3 Ų344.5 Ų44.52%0.01622%0.224CC..Hα-helixtrans-61.1-41172.9-74.1173000112.6A399 F402 F403 W409 L434 E440 F441 M442 L447A399-L438 HydrophobicContact CB-CD2 4.36Å; A399-L438 HydrophobicContact CB-CG 4.25Å; A399-L438 WeakPolarHBondContact O-CD2 3.33Å; F402-L438 HydrophobicContact CB-CD2 4.05Å; F403-L438 HydrophobicContact CB-CD2 4.25Å; W409-L438 HydrophobicContact CH2-CD1 4.07Å; W409-L438 HydrophobicContact CH2-CD2 3.9Å; W409-L438 HydrophobicContact CZ2-CD2 4.36Å; W409-L438 HydrophobicContact CZ3-CD1 4.14Å; L434-L438 HydrophobicContact CG-CD1 4.32Å; L434-L438 VanDerWaalsContact O-CG 3.3Å; L434-L438 WeakPolarHBondContact O-CG 3.23Å; L434-L438 PolarHBondContact O-N 2.77Å; L438-E440 VanDerWaalsContact C-N 3.31Å; L438-F441 PolarHBondContact O-N 2.93Å; L438-M442 WeakPolarHBondContact O-CB 3.47Å; L438-M442 PolarHBondContact O-N 2.75Å; L438-L447 HydrophobicContact CB-CD1 4.36Å; L438-L447 HydrophobicContact CB-CD2 3.94Å; L438-L447 HydrophobicContact CD1-CD1 4.46Å
439V97.5Very high96Very high29 Ų2945.3 Ų45.318%0.17623%0.234CC..Hα-helixtrans-66.9-35.3174.81700000111.2F435 H436 E437 G443 L444 L447 L484F435-V439 WeakPolarHBondContact O-CB 3.3Å; F435-V439 VanDerWaalsContact O-CG2 3.28Å; F435-V439 WeakPolarHBondContact O-CG2 3.45Å; F435-V439 PolarHBondContact O-N 3.08Å; H436-V439 PolarHBondContact O-N 3.23Å; E437-V439 VanDerWaalsContact C-N 3.34Å; E437-V439 PolarHBondContact O-N 3.45Å; V439-G443 WeakPolarHBondContact O-CA 3.44Å; V439-G443 PolarHBondContact O-N 2.91Å; V439-L444 HydrophobicContact CG1-CB 4.27Å; V439-L444 HydrophobicContact CG1-CD1 4.48Å; V439-L444 HydrophobicContact CG2-CD1 4.1Å; V439-L447 HydrophobicContact CG2-CD2 3.5Å; V439-L484 HydrophobicContact CB-CD2 4.43Å; V439-L484 HydrophobicContact CG1-CD2 4.37Å; V439-L484 HydrophobicContact CG2-CD1 4.31Å; V439-L484 HydrophobicContact CG2-CD2 3.96Å
440E96.4Very high96.1Very high140 Ų14044.8 Ų44.865%0.65423%0.226SC*.Hα-helixtrans-64-39.6174.6-171.8171.3173.700111.9H436 E437 L438H436-E440 PolarHBondContact O-N 3.44Å; E437-E440 WeakPolarHBondContact O-CB 3.45Å; E437-E440 PolarHBondContact O-N 2.97Å; E437-E440 VanDerWaalsContact O-N 3.16Å; L438-E440 VanDerWaalsContact C-N 3.31Å
441F95.7Very high95.9Very high63 Ų6345 Ų4528%0.27623%0.227SC..Hα-helixtrans-76.8-41.1178.5-63.8-41.9000114.6A399 H400 F403 E437 L438A399-F441 HydrophobicContact CB-CE2 4.23Å; H400-F441 HydrophobicContact CB-CE2 4.33Å; F403-F441 HydrophobicContact CB-CB 4.12Å; F403-F441 HydrophobicContact CB-CD2 3.83Å; F403-F441 HydrophobicContact CB-CG 4.29Å; F403-F441 HydrophobicContact CD1-CB 3.74Å; F403-F441 HydrophobicContact CD1-CD1 4.39Å; F403-F441 HydrophobicContact CD1-CD2 4Å; F403-F441 AromaticContact CD1-CG 3.81Å; F403-F441 HydrophobicContact CD1-CG 3.81Å; F403-F441 HydrophobicContact CD2-CB 3.64Å; F403-F441 HydrophobicContact CE1-CB 4.02Å; F403-F441 HydrophobicContact CE1-CG 4.27Å; F403-F441 HydrophobicContact CE2-CB 3.9Å; F403-F441 HydrophobicContact CG-CB 3.52Å; F403-F441 AromaticContact CG-CD2 3.98Å; F403-F441 HydrophobicContact CG-CD2 3.98Å; F403-F441 AromaticContact CG-CG 3.94Å; F403-F441 HydrophobicContact CG-CG 3.94Å; F403-F441 HydrophobicContact CZ-CB 4.08Å; E437-F441 HydrophobicContact CG-CD2 4.26Å; E437-F441 HydrophobicContact CG-CE2 3.52Å; E437-F441 HydrophobicContact CG-CZ 3.76Å; E437-F441 VanDerWaalsContact O-CD2 3.25Å; E437-F441 WeakPolarHBondContact O-CD2 3.49Å; E437-F441 WeakPolarHBondContact O-CG 3.27Å; E437-F441 PolarHBondContact O-N 3.1Å; L438-F441 PolarHBondContact O-N 2.93Å
442M95.4Very high95.7Very high35 Ų3547.8 Ų47.817%0.17224%0.241CC..Hα-helixtrans-108.3-19.3-169.2-59.3-177.178.200114.3F403 W409 L438 S446F403-M442 HydrophobicContact CD2-CG 3.26Å; F403-M442 HydrophobicContact CD2-SD 3.94Å; F403-M442 HydrophobicContact CE2-CG 3.68Å; F403-M442 HydrophobicContact CG-CG 4.34Å; W409-M442 HydrophobicContact CH2-SD 4.34Å; W409-M442 HydrophobicContact CZ2-SD 4.4Å; L438-M442 WeakPolarHBondContact O-CB 3.47Å; L438-M442 PolarHBondContact O-N 2.75Å; M442-S446 WeakPolarHBondContact O-CB 3.28Å; M442-S446 PolarHBondContact O-OG 2.97Å
443G94.9Very high95.5Very high32 Ų3246.8 Ų46.833%0.3324%0.24SC..  trans79.7156.1-164.800000113.1V439 Q445 L447V439-G443 WeakPolarHBondContact O-CA 3.44Å; V439-G443 PolarHBondContact O-N 2.91Å; G443-Q445 PolarHBondContact O-N 3.18Å; G443-L447 PolarHBondContact O-N 3.2Å
444L94.3Very high95.1Very high71 Ų7149.5 Ų49.537%0.37227%0.267SS..Hα-helixtrans-62.2-41.1-174.8-173.769.4000113V439 F448 L484 L487V439-L444 HydrophobicContact CG1-CB 4.27Å; V439-L444 HydrophobicContact CG1-CD1 4.48Å; V439-L444 HydrophobicContact CG2-CD1 4.1Å; L444-F448 WeakPolarHBondContact O-CB 3.47Å; L444-F448 PolarHBondContact O-N 2.91Å; L444-L484 HydrophobicContact CD1-CD2 4.28Å; L444-L487 HydrophobicContact CD1-CD2 3.63Å; L444-L487 HydrophobicContact CD1-CG 3.78Å; L444-L487 HydrophobicContact CG-CD2 4.42Å
445Q94Very high94.6Very high116 Ų11654.3 Ų54.354%0.54230%0.296SS..Hα-helixtrans-69.2-48.3-177.5-172.862.146.100111.6G443 L447 F448 D449G443-Q445 PolarHBondContact O-N 3.18Å; Q445-L447 VanDerWaalsContact C-N 3.26Å; Q445-L447 PolarHBondContact O-N 3.41Å; Q445-F448 WeakPolarHBondContact O-CB 3.35Å; Q445-F448 PolarHBondContact O-N 2.98Å; Q445-F448 VanDerWaalsContact O-N 3.09Å; Q445-D449 PolarHBondContact NE2-OD1 3.23Å; Q445-D449 VanDerWaalsContact O-CG 3.24Å; Q445-D449 PolarHBondContact O-N 3.24Å
446S94.7Very high94.2Very high59 Ų5955.9 Ų55.941%0.41330%0.304SS..Hα-helixtrans-61.2-37.8179.7-40.90000111.8M442 R450M442-S446 WeakPolarHBondContact O-CB 3.28Å; M442-S446 PolarHBondContact O-OG 2.97Å; S446-R450 WeakPolarHBondContact O-CB 3.36Å; S446-R450 PolarHBondContact O-N 3.38Å; S446-R450 VanDerWaalsContact O-N 3.1Å
447L95.7Very high93.6Very high0 Ų054.7 Ų54.70%030%0.298CS..Hα-helixtrans-68-41.4174.8-176.361000111.5W409 F435 L438 V439 G443 Q445 R450 I451 L487W409-L447 HydrophobicContact CH2-CD1 3.95Å; W409-L447 HydrophobicContact CZ3-CD1 4.09Å; F435-L447 HydrophobicContact CD1-CD2 4.04Å; L438-L447 HydrophobicContact CB-CD1 4.36Å; L438-L447 HydrophobicContact CB-CD2 3.94Å; L438-L447 HydrophobicContact CD1-CD1 4.46Å; V439-L447 HydrophobicContact CG2-CD2 3.5Å; G443-L447 PolarHBondContact O-N 3.2Å; Q445-L447 VanDerWaalsContact C-N 3.26Å; Q445-L447 PolarHBondContact O-N 3.41Å; L447-R450 PolarHBondContact O-N 3.28Å; L447-I451 HydrophobicContact CD1-CD1 4.3Å; L447-I451 HydrophobicContact CG-CD1 3.87Å; L447-I451 WeakPolarHBondContact O-CD1 3.48Å; L447-I451 VanDerWaalsContact O-CG1 3.26Å; L447-I451 WeakPolarHBondContact O-CG1 3.45Å; L447-I451 PolarHBondContact O-N 2.96Å; L447-L487 HydrophobicContact CB-CD2 4.38Å; L447-L487 HydrophobicContact CD2-CD1 3.98Å; L447-L487 HydrophobicContact CD2-CD2 4.28Å; L447-L487 HydrophobicContact CG-CD2 4.24Å
448F95.3Very high93.1Very high32 Ų3256 Ų5614%0.1431%0.312CS..Hα-helixtrans-59.9-47.3174.3174.9-99.4000112L444 Q445 R450 I451 E452 L487 I489L444-F448 WeakPolarHBondContact O-CB 3.47Å; L444-F448 PolarHBondContact O-N 2.91Å; Q445-F448 WeakPolarHBondContact O-CB 3.35Å; Q445-F448 PolarHBondContact O-N 2.98Å; Q445-F448 VanDerWaalsContact O-N 3.09Å; F448-R450 PolarHBondContact O-N 3.22Å; F448-I451 PolarHBondContact O-N 3.34Å; F448-I451 VanDerWaalsContact O-N 3.07Å; F448-E452 HydrophobicContact CD2-CG 4.21Å; F448-E452 HydrophobicContact CE1-CG 4.03Å; F448-E452 HydrophobicContact CE2-CG 3.65Å; F448-E452 HydrophobicContact CZ-CG 3.56Å; F448-E452 PolarHBondContact O-N 3.36Å; F448-L487 HydrophobicContact CB-CD2 4.02Å; F448-I489 HydrophobicContact CE2-CB 3.9Å; F448-I489 HydrophobicContact CE2-CD1 4.48Å; F448-I489 HydrophobicContact CZ-CB 4.03Å; F448-I489 HydrophobicContact CZ-CD1 4.48Å; F448-I489 HydrophobicContact CZ-CG2 4.46Å
449D94.1Very high92.7Very high87 Ų8755.9 Ų55.947%0.46531%0.311SS..Hα-helixtrans-60.5-37178.7-63-20.9000111.2Q445 D453Q445-D449 PolarHBondContact NE2-OD1 3.23Å; Q445-D449 VanDerWaalsContact O-CG 3.24Å; Q445-D449 PolarHBondContact O-N 3.24Å; D449-D453 PolarHBondContact O-N 3.31Å
450R93.1Very high92.5Very high64 Ų6454.7 Ų54.724%0.24230%0.304CS..Hα-helixtrans-70.5-34.5175.3-174.2168.6-82-157.6-8.2112.9D405 W409 S446 L447 F448 D453D405-R450 IonicContact OD1-CZ 3.7Å; D405-R450 IonicContact OD1-NH1 3.86Å; D405-R450 PolarHBondContact OD1-NH1 3.21Å; D405-R450 IonicContact OD1-NH2 2.74Å; D405-R450 IonicContact OD2-CZ 2.96Å; D405-R450 IonicContact OD2-NH1 3.94Å; D405-R450 PolarHBondContact OD2-NH1 3.06Å; D405-R450 IonicContact OD2-NH2 3.34Å; D405-R450 PolarHBondContact OD2-NH2 3.34Å; W409-R450 VanDerWaalsContact CZ2-NH1 3.35Å; S446-R450 WeakPolarHBondContact O-CB 3.36Å; S446-R450 PolarHBondContact O-N 3.38Å; S446-R450 VanDerWaalsContact O-N 3.1Å; L447-R450 PolarHBondContact O-N 3.28Å; F448-R450 PolarHBondContact O-N 3.22Å; R450-D453 WeakPolarHBondContact O-CB 3.49Å
451I93.2Very high92.2Very high4 Ų452.3 Ų52.32%0.02130%0.296CS..Hα-helixtrans-70.2-39175.7-69.9157.5000111.4F435 L447 F448 D453 Q457 F460 F464 L487F435-I451 HydrophobicContact CE1-CD1 4.18Å; L447-I451 HydrophobicContact CD1-CD1 4.3Å; L447-I451 HydrophobicContact CG-CD1 3.87Å; L447-I451 WeakPolarHBondContact O-CD1 3.48Å; L447-I451 VanDerWaalsContact O-CG1 3.26Å; L447-I451 WeakPolarHBondContact O-CG1 3.45Å; L447-I451 PolarHBondContact O-N 2.96Å; F448-I451 PolarHBondContact O-N 3.34Å; F448-I451 VanDerWaalsContact O-N 3.07Å; I451-D453 VanDerWaalsContact C-N 3.29Å; I451-D453 PolarHBondContact O-N 2.94Å; I451-Q457 PolarHBondContact O-NE2 2.78Å; I451-F460 HydrophobicContact CB-CD2 4.48Å; I451-F460 HydrophobicContact CB-CE2 4.47Å; I451-F460 HydrophobicContact CG1-CD1 4.19Å; I451-F460 HydrophobicContact CG1-CE1 3.89Å; I451-F460 HydrophobicContact CG1-CE2 4.25Å; I451-F460 HydrophobicContact CG1-CG 4.48Å; I451-F460 HydrophobicContact CG1-CZ 3.92Å; I451-F460 HydrophobicContact CG2-CD2 4.45Å; I451-F460 HydrophobicContact CG2-CG 4.29Å; I451-F464 HydrophobicContact CD1-CE1 4.42Å; I451-F464 HydrophobicContact CD1-CE2 3.89Å; I451-F464 HydrophobicContact CD1-CZ 3.61Å; I451-F464 HydrophobicContact CG1-CE2 4.14Å; I451-F464 HydrophobicContact CG1-CZ 4.33Å; I451-F464 HydrophobicContact CG2-CD1 4.34Å; I451-F464 HydrophobicContact CG2-CD2 3.88Å; I451-F464 HydrophobicContact CG2-CE1 4.34Å; I451-F464 HydrophobicContact CG2-CE2 3.84Å; I451-F464 HydrophobicContact CG2-CG 4.14Å; I451-F464 HydrophobicContact CG2-CZ 4.1Å; I451-L487 HydrophobicContact CD1-CB 4.45Å; I451-L487 HydrophobicContact CD1-CD1 4.23Å; I451-L487 HydrophobicContact CD1-CD2 3.98Å; I451-L487 HydrophobicContact CD1-CG 4.45Å
452E92.3Very high92.1Very high60 Ų6050.1 Ų50.128%0.2829%0.291SS..SBendtrans-84.2-0179.4-65.5-66.5169.600113.4F448 A454 R466 G490F448-E452 HydrophobicContact CD2-CG 4.21Å; F448-E452 HydrophobicContact CE1-CG 4.03Å; F448-E452 HydrophobicContact CE2-CG 3.65Å; F448-E452 HydrophobicContact CZ-CG 3.56Å; F448-E452 PolarHBondContact O-N 3.36Å; E452-A454 PolarHBondContact O-N 3.24Å; E452-R466 IonicContact OE1-NH2 2.72Å; E452-R466 PolarHBondContact OE1-NH2 3.49Å; E452-R466 VanDerWaalsContact OE1-NH2 3.12Å; E452-R466 IonicContact OE2-CZ 2.83Å; E452-R466 IonicContact OE2-NH2 3.12Å; E452-R466 PolarHBondContact OE2-NH2 3.49Å; E452-G490 WeakPolarHBondContact OE1-CA 3.49Å
453D92.2Very high92.1Very high69 Ų6948.4 Ų48.437%0.36928%0.283SS..  trans-60.1124.6172.9-171.3-26.6000110.1D449 R450 I451 T455 M456 Q457D449-D453 PolarHBondContact O-N 3.31Å; R450-D453 WeakPolarHBondContact O-CB 3.49Å; I451-D453 VanDerWaalsContact C-N 3.29Å; I451-D453 PolarHBondContact O-N 2.94Å; D453-T455 VanDerWaalsContact CG-OG1 3.26Å; D453-T455 PolarHBondContact O-N 3.07Å; D453-T455 PolarHBondContact OD1-N 3.08Å; D453-T455 PolarHBondContact OD1-OG1 2.95Å; D453-T455 PolarHBondContact OD2-OG1 2.96Å; D453-M456 HydrophobicContact CB-CB 4.23Å; D453-M456 HydrophobicContact CB-CG 4.08Å; D453-M456 PolarHBondContact O-N 3.36Å; D453-M456 VanDerWaalsContact O-N 3.08Å; D453-Q457 PolarHBondContact O-N 3Å; D453-Q457 PolarHBondContact O-NE2 3.13Å; D453-Q457 VanDerWaalsContact O-NE2 3.1Å
454A88.5Confident92.1Very high87 Ų8747.3 Ų47.372%0.71927%0.269SS*.THydrogen-bonded Turntrans-59.5-30.9-179.200000112.7E452 M456E452-A454 PolarHBondContact O-N 3.24Å; A454-M456 VanDerWaalsContact C-N 3.29Å; A454-M456 PolarHBondContact O-N 3.1Å
455T88.9Confident92Very high101 Ų10144.2 Ų44.262%0.6225%0.253SS*.THydrogen-bonded Turntrans-76-18.7179.9630000113D453D453-T455 VanDerWaalsContact CG-OG1 3.26Å; D453-T455 PolarHBondContact O-N 3.07Å; D453-T455 PolarHBondContact OD1-N 3.08Å; D453-T455 PolarHBondContact OD1-OG1 2.95Å; D453-T455 PolarHBondContact OD2-OG1 2.96Å
456M88Confident91.9Very high35 Ų3542.5 Ų42.517%0.17224%0.241CC..THydrogen-bonded Turntrans-107.6-2.5-174.4-58.2-62.9-73.600113.6W409 M410 D453 A454 A458 A459 F460W409-M456 HydrophobicContact CB-CE 3.53Å; W409-M456 HydrophobicContact CG-CE 4.01Å; M410-M456 HydrophobicContact CG-CE 4.29Å; M410-M456 HydrophobicContact CG-SD 4.29Å; M410-M456 HydrophobicContact SD-CE 4.29Å; M410-M456 HydrophobicContact SD-SD 3.99Å; D453-M456 HydrophobicContact CB-CB 4.23Å; D453-M456 HydrophobicContact CB-CG 4.08Å; D453-M456 PolarHBondContact O-N 3.36Å; D453-M456 VanDerWaalsContact O-N 3.08Å; A454-M456 VanDerWaalsContact C-N 3.29Å; A454-M456 PolarHBondContact O-N 3.1Å; M456-A458 VanDerWaalsContact C-N 3.26Å; M456-A458 PolarHBondContact O-N 2.85Å; M456-A458 VanDerWaalsContact O-N 3.13Å; M456-A459 VanDerWaalsContact O-CB 3.22Å; M456-A459 WeakPolarHBondContact O-CB 3.37Å; M456-A459 PolarHBondContact O-N 2.92Å; M456-F460 HydrophobicContact CB-CD2 4.2Å; M456-F460 HydrophobicContact CB-CE2 3.93Å; M456-F460 WeakPolarHBondContact O-CD2 3.17Å
457Q86.8Confident91.5Very high44 Ų4445.2 Ų45.221%0.20625%0.251CS..Hα-helixtrans-51.2-43.2-174.4-69.9-62-66.900113I451 D453 A459 F460 D461I451-Q457 PolarHBondContact O-NE2 2.78Å; D453-Q457 PolarHBondContact O-N 3Å; D453-Q457 PolarHBondContact O-NE2 3.13Å; D453-Q457 VanDerWaalsContact O-NE2 3.1Å; Q457-A459 PolarHBondContact O-N 3.3Å; Q457-A459 VanDerWaalsContact O-N 3.15Å; Q457-F460 CarbonylContact O-C 3.59Å; Q457-F460 PolarHBondContact O-N 2.92Å; Q457-D461 PolarHBondContact O-N 3.42Å
458A86.8Confident91.2Very high45 Ų4549.3 Ų49.337%0.37227%0.27SS..Hα-helixtrans-62.5-23.9-179.100000114.3M410 H414 M456 F460M410-A458 HydrophobicContact CE-CB 3.97Å; H414-A458 PolarHBondContact ND1-O 3.01Å; M456-A458 VanDerWaalsContact C-N 3.26Å; M456-A458 PolarHBondContact O-N 2.85Å; M456-A458 VanDerWaalsContact O-N 3.13Å; A458-F460 VanDerWaalsContact C-N 3.32Å
459A89.1Confident90.9Very high0 Ų048.7 Ų48.70%027%0.269CS..Hα-helixtrans-69.9-32.9172.600000111.9M410 L413 M456 Q457M410-A459 HydrophobicContact SD-CB 3.77Å; L413-A459 CarbonylContact C-O 3.57Å; L413-A459 WeakPolarHBondContact CB-O 3.41Å; M456-A459 VanDerWaalsContact O-CB 3.22Å; M456-A459 WeakPolarHBondContact O-CB 3.37Å; M456-A459 PolarHBondContact O-N 2.92Å; Q457-A459 PolarHBondContact O-N 3.3Å; Q457-A459 VanDerWaalsContact O-N 3.15Å
460F93.4Very high90.6Very high4 Ų448.7 Ų48.72%0.01827%0.267CS..Hα-helixtrans-105.3-10.6-168.3-65.5-63.4000113.8W409 L413 I451 M456 Q457 A458 G462 L463 F464W409-F460 AromaticContact CE3-CE1 3.98Å; W409-F460 HydrophobicContact CE3-CE1 3.98Å; W409-F460 AromaticContact CE3-CZ 3.52Å; W409-F460 HydrophobicContact CE3-CZ 3.52Å; W409-F460 HydrophobicContact CZ3-CE1 4.18Å; W409-F460 AromaticContact CZ3-CZ 3.84Å; W409-F460 HydrophobicContact CZ3-CZ 3.84Å; L413-F460 HydrophobicContact CD1-CD1 4.4Å; L413-F460 HydrophobicContact CD1-CE1 3.8Å; L413-F460 HydrophobicContact CD1-CZ 4.36Å; I451-F460 HydrophobicContact CB-CD2 4.48Å; I451-F460 HydrophobicContact CB-CE2 4.47Å; I451-F460 HydrophobicContact CG1-CD1 4.19Å; I451-F460 HydrophobicContact CG1-CE1 3.89Å; I451-F460 HydrophobicContact CG1-CE2 4.25Å; I451-F460 HydrophobicContact CG1-CG 4.48Å; I451-F460 HydrophobicContact CG1-CZ 3.92Å; I451-F460 HydrophobicContact CG2-CD2 4.45Å; I451-F460 HydrophobicContact CG2-CG 4.29Å; M456-F460 HydrophobicContact CB-CD2 4.2Å; M456-F460 HydrophobicContact CB-CE2 3.93Å; M456-F460 WeakPolarHBondContact O-CD2 3.17Å; Q457-F460 CarbonylContact O-C 3.59Å; Q457-F460 PolarHBondContact O-N 2.92Å; A458-F460 VanDerWaalsContact C-N 3.32Å; F460-G462 PolarHBondContact O-N 2.99Å; F460-G462 VanDerWaalsContact O-N 3.1Å; F460-L463 HydrophobicContact CD1-CD1 4.3Å; F460-L463 CarbonylContact O-C 3.56Å; F460-L463 PolarHBondContact O-N 2.68Å; F460-F464 HydrophobicContact CB-CD2 3.99Å; F460-F464 HydrophobicContact CD1-CD2 4.24Å; F460-F464 HydrophobicContact CD1-CE2 4.16Å; F460-F464 HydrophobicContact CG-CD2 4.45Å; F460-F464 PolarHBondContact O-N 3.22Å
461D90.6Very high90.5Very high90 Ų9047.1 Ų47.148%0.48126%0.263SS..THydrogen-bonded Turntrans-49.7-39.7-178.6-78.6-20.4000113.4Q457 F464 P465Q457-D461 PolarHBondContact O-N 3.42Å; D461-F464 CarbonylContact O-C 3.4Å; D461-P465 VanDerWaalsContact O-CA 3.23Å; D461-P465 WeakPolarHBondContact O-CA 3.26Å
462G92.9Very high90.4Very high17 Ų1747 Ų4718%0.17526%0.262CS..THydrogen-bonded Turntrans-78.3-30.4178.200000114I416 R417 L418 F460I416-G462 CarbonylContact O-C 3.5Å; I416-G462 VanDerWaalsContact O-C 3.28Å; I416-G462 WeakPolarHBondContact O-CA 3.41Å; R417-G462 CarbonylContact C-O 3.46Å; R417-G462 WeakPolarHBondContact CA-O 3.33Å; L418-G462 PolarHBondContact N-O 2.88Å; F460-G462 PolarHBondContact O-N 2.99Å; F460-G462 VanDerWaalsContact O-N 3.1Å
463L95.3Very high90.3Very high0 Ų049.4 Ų49.40%027%0.269CS..THydrogen-bonded Turntrans-81.1-32.2177.9-78.6158.5000112.4L413 I416 I431 F435 F460 P465L413-L463 HydrophobicContact CB-CD1 4.16Å; L413-L463 HydrophobicContact CD2-CD1 4.26Å; I416-L463 HydrophobicContact CB-CD2 4.19Å; I416-L463 HydrophobicContact CB-CG 4.12Å; I416-L463 HydrophobicContact CG2-CD2 3.47Å; I416-L463 VanDerWaalsContact CG2-CD2 3.47Å; I416-L463 HydrophobicContact CG2-CG 3.87Å; I431-L463 HydrophobicContact CD1-CD2 4.36Å; I431-L463 HydrophobicContact CG1-CD2 4.48Å; I431-L463 HydrophobicContact CG2-CD2 4.02Å; F435-L463 HydrophobicContact CE2-CD1 4.13Å; F435-L463 HydrophobicContact CE2-CD2 3.86Å; F435-L463 HydrophobicContact CZ-CD1 4.04Å; F435-L463 HydrophobicContact CZ-CD2 4.27Å; F460-L463 HydrophobicContact CD1-CD1 4.3Å; F460-L463 CarbonylContact O-C 3.56Å; F460-L463 PolarHBondContact O-N 2.68Å; L463-P465 WeakPolarHBondContact O-CD 3.28Å
464F95.2Very high90.1Very high9 Ų947.8 Ų47.84%0.03926%0.259CS..SBendtrans-122.960.7-179.2-63.8-92.8000110.8F435 I451 F460 D461 R466 Y479 L487 M491F435-F464 AromaticContact CE1-CE2 3.95Å; F435-F464 HydrophobicContact CE1-CE2 3.95Å; F435-F464 AromaticContact CE1-CZ 3.9Å; F435-F464 HydrophobicContact CE1-CZ 3.9Å; F435-F464 AromaticContact CZ-CE2 3.94Å; F435-F464 HydrophobicContact CZ-CE2 3.94Å; F435-F464 HydrophobicContact CZ-CZ 4.28Å; I451-F464 HydrophobicContact CD1-CE1 4.42Å; I451-F464 HydrophobicContact CD1-CE2 3.89Å; I451-F464 HydrophobicContact CD1-CZ 3.61Å; I451-F464 HydrophobicContact CG1-CE2 4.14Å; I451-F464 HydrophobicContact CG1-CZ 4.33Å; I451-F464 HydrophobicContact CG2-CD1 4.34Å; I451-F464 HydrophobicContact CG2-CD2 3.88Å; I451-F464 HydrophobicContact CG2-CE1 4.34Å; I451-F464 HydrophobicContact CG2-CE2 3.84Å; I451-F464 HydrophobicContact CG2-CG 4.14Å; I451-F464 HydrophobicContact CG2-CZ 4.1Å; F460-F464 HydrophobicContact CB-CD2 3.99Å; F460-F464 HydrophobicContact CD1-CD2 4.24Å; F460-F464 HydrophobicContact CD1-CE2 4.16Å; F460-F464 HydrophobicContact CG-CD2 4.45Å; F460-F464 PolarHBondContact O-N 3.22Å; D461-F464 CarbonylContact O-C 3.4Å; F464-R466 PolarHBondContact O-N 3.4Å; F464-Y479 HydrophobicContact CD1-CE2 4.1Å; F464-Y479 HydrophobicContact CE1-CD2 4.06Å; F464-Y479 AromaticContact CE1-CE2 3.6Å; F464-Y479 HydrophobicContact CE1-CE2 3.6Å; F464-Y479 AromaticContact CE1-CZ 3.87Å; F464-Y479 HydrophobicContact CE2-CE2 4.36Å; F464-Y479 HydrophobicContact CZ-CE1 4.12Å; F464-Y479 AromaticContact CZ-CE2 3.74Å; F464-Y479 HydrophobicContact CZ-CE2 3.74Å; F464-Y479 AromaticContact CZ-CZ 3.51Å; F464-Y479 WeakPolarHBondContact CZ-OH 3.4Å; F464-L487 HydrophobicContact CE1-CB 3.97Å; F464-L487 WeakPolarHBondContact CE1-O 3.48Å; F464-L487 HydrophobicContact CZ-CB 4.22Å; F464-M491 VanDerWaalsContact CA-SD 3.59Å; F464-M491 HydrophobicContact CB-CG 4.28Å; F464-M491 HydrophobicContact CB-SD 3.91Å; F464-M491 HydrophobicContact CD1-CE 3.61Å; F464-M491 HydrophobicContact CD1-CG 4.44Å; F464-M491 HydrophobicContact CD1-SD 4.01Å; F464-M491 HydrophobicContact CE1-CE 4.24Å; F464-M491 HydrophobicContact CG-SD 4.43Å
465P93.1Very high90.3Very high5 Ų543.7 Ų43.73%0.03222%0.224CC..  trans-63131-170.824.8-34.6000113D461 L463 D467 N471 T472 A475D461-P465 VanDerWaalsContact O-CA 3.23Å; D461-P465 WeakPolarHBondContact O-CA 3.26Å; L463-P465 WeakPolarHBondContact O-CD 3.28Å; P465-D467 WeakPolarHBondContact CB-OD1 3.31Å; P465-N471 HydrophobicContact CB-CB 4.03Å; P465-N471 HydrophobicContact CG-CB 4.05Å; P465-T472 WeakPolarHBondContact O-CA 3.38Å; P465-T472 VanDerWaalsContact O-CB 3.31Å; P465-T472 WeakPolarHBondContact O-CB 3.39Å; P465-T472 PolarHBondContact O-OG1 3.42Å; P465-A475 HydrophobicContact CG-CB 3.91Å
466R90.1Very high90.4Very high80 Ų8039.3 Ų39.330%0.30220%0.197SC..  trans-117.38.4175.9-68178.5-176151.9-4.3112.5E452 F464 H494E452-R466 IonicContact OE1-NH2 2.72Å; E452-R466 PolarHBondContact OE1-NH2 3.49Å; E452-R466 VanDerWaalsContact OE1-NH2 3.12Å; E452-R466 IonicContact OE2-CZ 2.83Å; E452-R466 IonicContact OE2-NH2 3.12Å; E452-R466 PolarHBondContact OE2-NH2 3.49Å; F464-R466 PolarHBondContact O-N 3.4Å; R466-H494 HydrophobicContact CG-CB 4.46Å; R466-H494 PolarHBondContact O-NE2 2.98Å
467D87.9Confident90.4Very high116 Ų11642.8 Ų42.862%0.6222%0.216SC*.SBendtrans-75.3-47.2-174.664.5-37.2000113.2P465 N471P465-D467 WeakPolarHBondContact CB-OD1 3.31Å; D467-N471 PolarHBondContact OD1-ND2 3.01Å; D467-N471 PolarHBondContact OD2-ND2 2.66Å
468H88.8Confident90.8Very high86 Ų8641.6 Ų41.640%0.39821%0.211SC..SBendtrans-134.4134.9-177.5-167.5-91000110.7H470 N471 T472H468-H470 VanDerWaalsContact ND1-CB 3.28Å; H468-H470 WeakPolarHBondContact ND1-CB 3.35Å; H468-H470 PolarHBondContact ND1-N 2.96Å; H468-H470 VanDerWaalsContact ND1-N 3.18Å; H468-H470 PolarHBondContact O-N 2.81Å; H468-N471 HydrophobicContact CB-CB 4.44Å; H468-N471 PolarHBondContact O-N 3.44Å; H468-T472 PolarHBondContact O-N 3.05Å; H468-T472 PolarHBondContact O-OG1 3.22Å
469P88.1Confident91.1Very high19 Ų1939.4 Ų39.412%0.12319%0.193CC..Hα-helixtrans-54.6-30.9-178.3-29.937.8000114.5R473 L495 V498P469-R473 WeakPolarHBondContact O-CB 3.25Å; P469-R473 WeakPolarHBondContact O-CG 3.3Å; P469-R473 PolarHBondContact O-N 3.25Å; P469-R473 VanDerWaalsContact O-N 3.11Å; P469-R473 PolarHBondContact O-NH1 3.38Å; P469-L495 HydrophobicContact CB-CD1 3.9Å; P469-V498 HydrophobicContact CG-CG1 3.92Å
470H88.2Confident91.2Very high88 Ų8842.5 Ų42.541%0.40721%0.212SC..Hα-helixtrans-65.4-50.1174.1-170.269.3000112.3E420 H468 T472 R473 F474E420-H470 IonicContact OE2-CE1 3.6Å; E420-H470 IonicContact OE2-NE2 3.97Å; E420-H470 PolarHBondContact OE2-NE2 3.39Å; H468-H470 VanDerWaalsContact ND1-CB 3.28Å; H468-H470 WeakPolarHBondContact ND1-CB 3.35Å; H468-H470 PolarHBondContact ND1-N 2.96Å; H468-H470 VanDerWaalsContact ND1-N 3.18Å; H468-H470 PolarHBondContact O-N 2.81Å; H470-T472 PolarHBondContact O-N 3.26Å; H470-R473 PolarHBondContact O-N 3.32Å; H470-F474 PolarHBondContact O-N 3.04Å
471N91.1Very high91Very high30 Ų3046.8 Ų46.816%0.1624%0.242CC..Hα-helixtrans-62.4-45-179.8-65.4-13.6000110.7T419 P465 D467 H468 R473 F474 A475T419-N471 HydrophobicContact CG2-CB 4.22Å; P465-N471 HydrophobicContact CB-CB 4.03Å; P465-N471 HydrophobicContact CG-CB 4.05Å; D467-N471 PolarHBondContact OD1-ND2 3.01Å; D467-N471 PolarHBondContact OD2-ND2 2.66Å; H468-N471 HydrophobicContact CB-CB 4.44Å; H468-N471 PolarHBondContact O-N 3.44Å; N471-R473 VanDerWaalsContact C-N 3.35Å; N471-R473 PolarHBondContact O-N 3.38Å; N471-F474 WeakPolarHBondContact O-CB 3.43Å; N471-F474 PolarHBondContact O-N 3.48Å; N471-A475 PolarHBondContact O-N 3.14Å
472T91.3Very high91Very high2 Ų243.3 Ų43.31%0.01222%0.224CC..Hα-helixtrans-58.2-45.4175.3-50.80000111.6P465 H468 H470 A475 I476 M491P465-T472 WeakPolarHBondContact O-CA 3.38Å; P465-T472 VanDerWaalsContact O-CB 3.31Å; P465-T472 WeakPolarHBondContact O-CB 3.39Å; P465-T472 PolarHBondContact O-OG1 3.42Å; H468-T472 PolarHBondContact O-N 3.05Å; H468-T472 PolarHBondContact O-OG1 3.22Å; H470-T472 PolarHBondContact O-N 3.26Å; T472-A475 PolarHBondContact O-N 3.44Å; T472-I476 HydrophobicContact CG2-CD1 3.96Å; T472-I476 WeakPolarHBondContact O-CB 3.49Å; T472-I476 WeakPolarHBondContact O-CD1 3.34Å; T472-I476 WeakPolarHBondContact O-CG1 3.47Å; T472-I476 PolarHBondContact O-N 2.9Å; T472-M491 HydrophobicContact CG2-CB 3.84Å; T472-M491 HydrophobicContact CG2-CG 4.29Å; T472-M491 HydrophobicContact CG2-SD 4.38Å
473R89.8Confident91Very high111 Ų11145.5 Ų45.542%0.41925%0.246SC..Hα-helixtrans-64.6-40.5177.1-74.8176.4-160.5115.22112.2P469 H470 N471 I476 N477 L495P469-R473 WeakPolarHBondContact O-CB 3.25Å; P469-R473 WeakPolarHBondContact O-CG 3.3Å; P469-R473 PolarHBondContact O-N 3.25Å; P469-R473 VanDerWaalsContact O-N 3.11Å; P469-R473 PolarHBondContact O-NH1 3.38Å; H470-R473 PolarHBondContact O-N 3.32Å; N471-R473 VanDerWaalsContact C-N 3.35Å; N471-R473 PolarHBondContact O-N 3.38Å; R473-I476 PolarHBondContact O-N 3.32Å; R473-N477 WeakPolarHBondContact O-CB 3.2Å; R473-N477 PolarHBondContact O-N 3.04Å; R473-N477 PolarHBondContact O-ND2 2.68Å; R473-L495 HydrophobicContact CG-CD1 4.35Å; R473-L495 HydrophobicContact CG-CD2 3.61Å
474F88.8Confident90.9Very high35 Ų3546 Ų4615%0.15425%0.248CC..Hα-helixtrans-59.5-50.3177.2-179.3-90.5000111.3L418 T419 E420 H470 N471 I476 N477 F478L418-F474 HydrophobicContact CD1-CE1 4.16Å; L418-F474 HydrophobicContact CG-CE1 4.4Å; T419-F474 VanDerWaalsContact C-CE1 3.47Å; E420-F474 HydrophobicContact CB-CD2 3.79Å; E420-F474 HydrophobicContact CB-CE2 3.74Å; E420-F474 HydrophobicContact CB-CG 4.37Å; E420-F474 HydrophobicContact CB-CZ 4.29Å; E420-F474 HydrophobicContact CG-CD2 4.37Å; E420-F474 HydrophobicContact CG-CE2 4.06Å; H470-F474 PolarHBondContact O-N 3.04Å; N471-F474 WeakPolarHBondContact O-CB 3.43Å; N471-F474 PolarHBondContact O-N 3.48Å; F474-I476 PolarHBondContact O-N 2.94Å; F474-N477 PolarHBondContact O-N 3.48Å; F474-F478 PolarHBondContact O-N 3.03Å
475A92.8Very high90.7Very high0 Ų046.4 Ų46.40%026%0.255CS..Hα-helixtrans-61.6-44.1176.800000112.2L418 P465 N471 T472 N477 F478 Y479 M491L418-A475 HydrophobicContact CD2-CB 3.88Å; L418-A475 HydrophobicContact CG-CB 4.26Å; P465-A475 HydrophobicContact CG-CB 3.91Å; N471-A475 PolarHBondContact O-N 3.14Å; T472-A475 PolarHBondContact O-N 3.44Å; A475-N477 VanDerWaalsContact C-N 3.31Å; A475-N477 PolarHBondContact O-N 3.11Å; A475-F478 PolarHBondContact O-N 3.49Å; A475-Y479 VanDerWaalsContact O-CD2 3.25Å; A475-Y479 WeakPolarHBondContact O-CD2 3.35Å; A475-Y479 PolarHBondContact O-N 3.2Å; A475-M491 HydrophobicContact CB-CE 4.1Å; A475-M491 HydrophobicContact CB-SD 4Å
476I89.8Confident90.7Very high10 Ų1047.6 Ų47.65%0.05127%0.269CS..Hα-helixtrans-55.9-47.3174.7-70.2165.3000110.9T472 R473 F474 T480 M491 R492 L495T472-I476 HydrophobicContact CG2-CD1 3.96Å; T472-I476 WeakPolarHBondContact O-CB 3.49Å; T472-I476 WeakPolarHBondContact O-CD1 3.34Å; T472-I476 WeakPolarHBondContact O-CG1 3.47Å; T472-I476 PolarHBondContact O-N 2.9Å; R473-I476 PolarHBondContact O-N 3.32Å; F474-I476 PolarHBondContact O-N 2.94Å; I476-T480 VanDerWaalsContact O-CB 3.3Å; I476-T480 WeakPolarHBondContact O-CB 3.41Å; I476-T480 PolarHBondContact O-N 3.21Å; I476-T480 PolarHBondContact O-OG1 2.89Å; I476-M491 HydrophobicContact CD1-CB 3.99Å; I476-M491 HydrophobicContact CG1-CB 3.89Å; I476-M491 HydrophobicContact CG1-CE 3.84Å; I476-M491 HydrophobicContact CG1-SD 4.41Å; I476-R492 HydrophobicContact CD1-CG 3.89Å; I476-R492 HydrophobicContact CG1-CG 4.33Å; I476-R492 HydrophobicContact CG2-CG 4.36Å; I476-L495 HydrophobicContact CD1-CD2 4.38Å
477N88.6Confident90.9Very high107 Ų10743.8 Ų43.857%0.57225%0.254SS*.Hα-helixtrans-65.1-41.7-179.6-71.5-19.3000111.6R473 F474 A475 T480 S481R473-N477 WeakPolarHBondContact O-CB 3.2Å; R473-N477 PolarHBondContact O-N 3.04Å; R473-N477 PolarHBondContact O-ND2 2.68Å; F474-N477 PolarHBondContact O-N 3.48Å; A475-N477 VanDerWaalsContact C-N 3.31Å; A475-N477 PolarHBondContact O-N 3.11Å; N477-T480 PolarHBondContact O-N 2.87Å; N477-S481 WeakPolarHBondContact O-CB 3.19Å; N477-S481 PolarHBondContact O-N 3.5Å; N477-S481 PolarHBondContact O-OG 3.1Å
478F94.2Very high91.1Very high19 Ų1938.3 Ų38.38%0.08323%0.225CC..Hα-helixtrans-56.7-59.4175.2170.7-98000111L418 R428 I431 K432 F474 A475 T480 S481 I482L418-F478 HydrophobicContact CD1-CD1 4.07Å; L418-F478 HydrophobicContact CD1-CD2 4.47Å; L418-F478 HydrophobicContact CD1-CE1 4.39Å; L418-F478 HydrophobicContact CD1-CG 4.09Å; L418-F478 HydrophobicContact CD2-CB 4.29Å; L418-F478 HydrophobicContact CD2-CD1 3.5Å; L418-F478 VanDerWaalsContact CD2-CD1 3.5Å; L418-F478 HydrophobicContact CD2-CE1 4.11Å; L418-F478 HydrophobicContact CD2-CG 4.08Å; L418-F478 HydrophobicContact CG-CD1 4.39Å; R428-F478 HydrophobicContact CB-CD2 4.46Å; R428-F478 HydrophobicContact CB-CE2 3.84Å; R428-F478 HydrophobicContact CG-CD2 4.49Å; R428-F478 HydrophobicContact CG-CE2 4.28Å; R428-F478 WeakPolarHBondContact O-CZ 3.47Å; I431-F478 HydrophobicContact CB-CE1 4.4Å; I431-F478 HydrophobicContact CB-CZ 4.11Å; I431-F478 HydrophobicContact CG2-CE1 3.69Å; I431-F478 HydrophobicContact CG2-CZ 3.9Å; K432-F478 HydrophobicContact CB-CZ 4.15Å; F474-F478 PolarHBondContact O-N 3.03Å; A475-F478 PolarHBondContact O-N 3.49Å; F478-T480 VanDerWaalsContact C-N 3.27Å; F478-T480 PolarHBondContact O-N 3.25Å; F478-S481 PolarHBondContact O-N 3.04Å; F478-S481 PolarHBondContact O-OG 3.41Å; F478-I482 HydrophobicContact CD1-CD1 4.39Å; F478-I482 HydrophobicContact CE1-CD1 3.72Å; F478-I482 HydrophobicContact CE2-CG2 4.24Å; F478-I482 HydrophobicContact CZ-CD1 3.94Å; F478-I482 HydrophobicContact CZ-CG2 4.38Å; F478-I482 PolarHBondContact O-N 3.3Å; F478-I482 VanDerWaalsContact O-N 3.14Å
479Y93Very high91.3Very high0 Ų037.8 Ų37.80%022%0.224CC..Hα-helixtrans-60.8-36.2-178.8-77.2-67.3000112.6L418 F435 F464 A475 I482 G483 L484 G485 L487 T488 M491L418-Y479 HydrophobicContact CD2-CD2 4.16Å; L418-Y479 HydrophobicContact CD2-CE2 3.56Å; F435-Y479 AromaticContact CD1-CE1 3.93Å; F435-Y479 HydrophobicContact CD1-CE1 3.93Å; F435-Y479 HydrophobicContact CD2-CE1 4.32Å; F435-Y479 HydrophobicContact CE1-CE1 4.16Å; F435-Y479 WeakPolarHBondContact CE2-OH 3.46Å; F435-Y479 HydrophobicContact CG-CE1 4.01Å; F435-Y479 HydrophobicContact CZ-CE1 4.45Å; F435-Y479 VanDerWaalsContact CZ-OH 3.29Å; F435-Y479 WeakPolarHBondContact CZ-OH 3.4Å; F464-Y479 HydrophobicContact CD1-CE2 4.1Å; F464-Y479 HydrophobicContact CE1-CD2 4.06Å; F464-Y479 AromaticContact CE1-CE2 3.6Å; F464-Y479 HydrophobicContact CE1-CE2 3.6Å; F464-Y479 AromaticContact CE1-CZ 3.87Å; F464-Y479 HydrophobicContact CE2-CE2 4.36Å; F464-Y479 HydrophobicContact CZ-CE1 4.12Å; F464-Y479 AromaticContact CZ-CE2 3.74Å; F464-Y479 HydrophobicContact CZ-CE2 3.74Å; F464-Y479 AromaticContact CZ-CZ 3.51Å; F464-Y479 WeakPolarHBondContact CZ-OH 3.4Å; A475-Y479 VanDerWaalsContact O-CD2 3.25Å; A475-Y479 WeakPolarHBondContact O-CD2 3.35Å; A475-Y479 PolarHBondContact O-N 3.2Å; Y479-I482 HydrophobicContact CD1-CD1 4.08Å; Y479-I482 WeakPolarHBondContact O-CG1 3.4Å; Y479-I482 PolarHBondContact O-N 3.31Å; Y479-G483 PolarHBondContact O-N 3.02Å; Y479-L484 HydrophobicContact CD1-CB 4.21Å; Y479-L484 CarbonylContact O-C 3.29Å; Y479-L484 VanDerWaalsContact O-C 3.29Å; Y479-L484 WeakPolarHBondContact O-CA 3.45Å; Y479-L484 PolarHBondContact O-N 3.32Å; Y479-G485 PolarHBondContact O-N 3.19Å; Y479-L487 HydrophobicContact CD1-CD1 4.46Å; Y479-L487 HydrophobicContact CE1-CD1 4.45Å; Y479-T488 HydrophobicContact CD2-CG2 3.92Å; Y479-T488 HydrophobicContact CG-CG2 3.94Å; Y479-M491 HydrophobicContact CD2-CE 4.22Å
480T91.5Very high91.4Very high64 Ų6437.4 Ų37.439%0.39322%0.224SC..Hα-helixtrans-64.7-42.6174.9-54.30000111.6I476 N477 F478 I482 G483 R492I476-T480 VanDerWaalsContact O-CB 3.3Å; I476-T480 WeakPolarHBondContact O-CB 3.41Å; I476-T480 PolarHBondContact O-N 3.21Å; I476-T480 PolarHBondContact O-OG1 2.89Å; N477-T480 PolarHBondContact O-N 2.87Å; F478-T480 VanDerWaalsContact C-N 3.27Å; F478-T480 PolarHBondContact O-N 3.25Å; T480-I482 VanDerWaalsContact C-N 3.28Å; T480-I482 PolarHBondContact O-N 2.86Å; T480-G483 PolarHBondContact O-N 3.17Å; T480-R492 PolarHBondContact OG1-NH2 3.04Å
481S90.8Very high91.6Very high95 Ų9533.3 Ų33.366%0.66421%0.205SC*.Hα-helixtrans-68.6-26.1-178.667.40000113.6N477 F478 G483N477-S481 WeakPolarHBondContact O-CB 3.19Å; N477-S481 PolarHBondContact O-N 3.5Å; N477-S481 PolarHBondContact O-OG 3.1Å; F478-S481 PolarHBondContact O-N 3.04Å; F478-S481 PolarHBondContact O-OG 3.41Å; S481-G483 VanDerWaalsContact C-N 3.33Å
482I90.6Very high91.6Very high17 Ų1736.9 Ų36.99%0.08722%0.216CC..THydrogen-bonded Turntrans-90.87.3172.569.1171.5000112.9K432 H436 F478 Y479 T480 L484K432-I482 HydrophobicContact CB-CD1 4.23Å; K432-I482 HydrophobicContact CB-CG2 4.11Å; K432-I482 HydrophobicContact CD-CB 4.27Å; K432-I482 HydrophobicContact CD-CG2 3.68Å; K432-I482 HydrophobicContact CG-CB 4.08Å; K432-I482 HydrophobicContact CG-CD1 4.26Å; K432-I482 HydrophobicContact CG-CG2 3.77Å; H436-I482 PolarHBondContact CE1-O 3.29Å; H436-I482 PolarHBondContact NE2-O 2.99Å; F478-I482 HydrophobicContact CD1-CD1 4.39Å; F478-I482 HydrophobicContact CE1-CD1 3.72Å; F478-I482 HydrophobicContact CE2-CG2 4.24Å; F478-I482 HydrophobicContact CZ-CD1 3.94Å; F478-I482 HydrophobicContact CZ-CG2 4.38Å; F478-I482 PolarHBondContact O-N 3.3Å; F478-I482 VanDerWaalsContact O-N 3.14Å; Y479-I482 HydrophobicContact CD1-CD1 4.08Å; Y479-I482 WeakPolarHBondContact O-CG1 3.4Å; Y479-I482 PolarHBondContact O-N 3.31Å; T480-I482 VanDerWaalsContact C-N 3.28Å; T480-I482 PolarHBondContact O-N 2.86Å; I482-L484 VanDerWaalsContact C-N 3.31Å; I482-L484 HydrophobicContact CD1-CB 4.38Å; I482-L484 HydrophobicContact CD1-CD1 3.89Å; I482-L484 HydrophobicContact CD1-CG 4.21Å; I482-L484 HydrophobicContact CG1-CB 4.16Å; I482-L484 HydrophobicContact CG1-CD1 4.37Å; I482-L484 HydrophobicContact CG1-CG 4.13Å; I482-L484 PolarHBondContact O-N 3.19Å
483G91.1Very high91.5Very high63 Ų6342.6 Ų42.665%0.64924%0.243SC*.THydrogen-bonded Turntrans798.1177.600000115.3Y479 T480 S481Y479-G483 PolarHBondContact O-N 3.02Å; T480-G483 PolarHBondContact O-N 3.17Å; S481-G483 VanDerWaalsContact C-N 3.33Å
484L94.4Very high91.5Very high9 Ų940.1 Ų40.15%0.04724%0.236CC..  trans-10427.9178.2-58.8-174.5000112.5F435 V439 L444 Y479 I482 G486 L487F435-L484 HydrophobicContact CB-CD1 3.66Å; V439-L484 HydrophobicContact CB-CD2 4.43Å; V439-L484 HydrophobicContact CG1-CD2 4.37Å; V439-L484 HydrophobicContact CG2-CD1 4.31Å; V439-L484 HydrophobicContact CG2-CD2 3.96Å; L444-L484 HydrophobicContact CD1-CD2 4.28Å; Y479-L484 HydrophobicContact CD1-CB 4.21Å; Y479-L484 CarbonylContact O-C 3.29Å; Y479-L484 VanDerWaalsContact O-C 3.29Å; Y479-L484 WeakPolarHBondContact O-CA 3.45Å; Y479-L484 PolarHBondContact O-N 3.32Å; I482-L484 VanDerWaalsContact C-N 3.31Å; I482-L484 HydrophobicContact CD1-CB 4.38Å; I482-L484 HydrophobicContact CD1-CD1 3.89Å; I482-L484 HydrophobicContact CD1-CG 4.21Å; I482-L484 HydrophobicContact CG1-CB 4.16Å; I482-L484 HydrophobicContact CG1-CD1 4.37Å; I482-L484 HydrophobicContact CG1-CG 4.13Å; I482-L484 PolarHBondContact O-N 3.19Å; L484-G486 PolarHBondContact O-N 3.09Å; L484-L487 HydrophobicContact CB-CD1 4.13Å; L484-L487 HydrophobicContact CB-CG 4.43Å; L484-L487 HydrophobicContact CD1-CD1 4.3Å; L484-L487 WeakPolarHBondContact O-CB 3.33Å; L484-L487 PolarHBondContact O-N 2.8Å
485G90.8Very high91.3Very high18 Ų1840.5 Ų40.519%0.18624%0.239CC..G310 helixtrans-57.3-23-17900000114.1Y479 L487 T488Y479-G485 PolarHBondContact O-N 3.19Å; G485-L487 PolarHBondContact O-N 3.41Å; G485-T488 WeakPolarHBondContact O-CB 3.33Å; G485-T488 PolarHBondContact O-N 2.83Å; G485-T488 VanDerWaalsContact O-N 3.09Å; G485-T488 PolarHBondContact O-OG1 3Å
486G92.6Very high91.1Very high30 Ų3048.8 Ų48.831%0.30928%0.275SS..G310 helixtrans-62.2-25.8174.300000114.1L484 T488 I489L484-G486 PolarHBondContact O-N 3.09Å; G486-T488 PolarHBondContact O-N 2.94Å; G486-I489 WeakPolarHBondContact O-CD1 3.5Å; G486-I489 WeakPolarHBondContact O-CG1 3.46Å
487L94.4Very high90.8Very high1 Ų152.5 Ų52.51%0.00530%0.302CS..G310 helixtrans-71.5-9.2175.4-59.3-178.7000113F435 L444 L447 F448 I451 F464 Y479 L484 G485F435-L487 HydrophobicContact CD1-CD1 3.73Å; F435-L487 HydrophobicContact CE1-CD1 4.23Å; L444-L487 HydrophobicContact CD1-CD2 3.63Å; L444-L487 HydrophobicContact CD1-CG 3.78Å; L444-L487 HydrophobicContact CG-CD2 4.42Å; L447-L487 HydrophobicContact CB-CD2 4.38Å; L447-L487 HydrophobicContact CD2-CD1 3.98Å; L447-L487 HydrophobicContact CD2-CD2 4.28Å; L447-L487 HydrophobicContact CG-CD2 4.24Å; F448-L487 HydrophobicContact CB-CD2 4.02Å; I451-L487 HydrophobicContact CD1-CB 4.45Å; I451-L487 HydrophobicContact CD1-CD1 4.23Å; I451-L487 HydrophobicContact CD1-CD2 3.98Å; I451-L487 HydrophobicContact CD1-CG 4.45Å; F464-L487 HydrophobicContact CE1-CB 3.97Å; F464-L487 WeakPolarHBondContact CE1-O 3.48Å; F464-L487 HydrophobicContact CZ-CB 4.22Å; Y479-L487 HydrophobicContact CD1-CD1 4.46Å; Y479-L487 HydrophobicContact CE1-CD1 4.45Å; L484-L487 HydrophobicContact CB-CD1 4.13Å; L484-L487 HydrophobicContact CB-CG 4.43Å; L484-L487 HydrophobicContact CD1-CD1 4.3Å; L484-L487 WeakPolarHBondContact O-CB 3.33Å; L484-L487 PolarHBondContact O-N 2.8Å; G485-L487 PolarHBondContact O-N 3.41Å
488T93.2Very high90.3Very high0 Ų049.6 Ų49.60%029%0.288CS..G310 helixtrans-101.79-170.5720000114Y479 G485 G486 G490 M491 R492Y479-T488 HydrophobicContact CD2-CG2 3.92Å; Y479-T488 HydrophobicContact CG-CG2 3.94Å; G485-T488 WeakPolarHBondContact O-CB 3.33Å; G485-T488 PolarHBondContact O-N 2.83Å; G485-T488 VanDerWaalsContact O-N 3.09Å; G485-T488 PolarHBondContact O-OG1 3Å; G486-T488 PolarHBondContact O-N 2.94Å; T488-G490 PolarHBondContact O-N 2.94Å; T488-M491 HydrophobicContact CG2-CE 3.5Å; T488-M491 PolarHBondContact O-N 3.36Å; T488-R492 WeakPolarHBondContact O-CG 3.43Å; T488-R492 PolarHBondContact O-N 3.2Å; T488-R492 PolarHBondContact OG1-NE 3Å
489I92.3Very high89.1Confident76 Ų7654.1 Ų54.139%0.3932%0.32SS..Hα-helixtrans-57.2-51.1-174.1-66164.9000110.9F448 G486 M491 R492 E493F448-I489 HydrophobicContact CE2-CB 3.9Å; F448-I489 HydrophobicContact CE2-CD1 4.48Å; F448-I489 HydrophobicContact CZ-CB 4.03Å; F448-I489 HydrophobicContact CZ-CD1 4.48Å; F448-I489 HydrophobicContact CZ-CG2 4.46Å; G486-I489 WeakPolarHBondContact O-CD1 3.5Å; G486-I489 WeakPolarHBondContact O-CG1 3.46Å; I489-M491 VanDerWaalsContact C-N 3.34Å; I489-M491 PolarHBondContact O-N 3.22Å; I489-R492 WeakPolarHBondContact O-CB 3.19Å; I489-R492 PolarHBondContact O-N 3.09Å; I489-R492 VanDerWaalsContact O-N 3.1Å; I489-E493 PolarHBondContact O-N 2.96Å
490G90.2Very high87.5Confident11 Ų1163.8 Ų63.811%0.11336%0.362CS..Hα-helixtrans-61.2-37.7178.600000113.5E452 T488 R492 E493 H494E452-G490 WeakPolarHBondContact OE1-CA 3.49Å; T488-G490 PolarHBondContact O-N 2.94Å; G490-R492 PolarHBondContact O-N 3.36Å; G490-E493 PolarHBondContact O-N 3.48Å; G490-H494 WeakPolarHBondContact O-CB 3.44Å; G490-H494 PolarHBondContact O-N 3.12Å
491M91.5Very high85.6Confident1 Ų167.2 Ų67.21%0.00537%0.373CS..Hα-helixtrans-64-39.2174-70.8-166.4-65.600112.6F464 T472 A475 I476 Y479 T488 I489 E493 H494 L495F464-M491 VanDerWaalsContact CA-SD 3.59Å; F464-M491 HydrophobicContact CB-CG 4.28Å; F464-M491 HydrophobicContact CB-SD 3.91Å; F464-M491 HydrophobicContact CD1-CE 3.61Å; F464-M491 HydrophobicContact CD1-CG 4.44Å; F464-M491 HydrophobicContact CD1-SD 4.01Å; F464-M491 HydrophobicContact CE1-CE 4.24Å; F464-M491 HydrophobicContact CG-SD 4.43Å; T472-M491 HydrophobicContact CG2-CB 3.84Å; T472-M491 HydrophobicContact CG2-CG 4.29Å; T472-M491 HydrophobicContact CG2-SD 4.38Å; A475-M491 HydrophobicContact CB-CE 4.1Å; A475-M491 HydrophobicContact CB-SD 4Å; I476-M491 HydrophobicContact CD1-CB 3.99Å; I476-M491 HydrophobicContact CG1-CB 3.89Å; I476-M491 HydrophobicContact CG1-CE 3.84Å; I476-M491 HydrophobicContact CG1-SD 4.41Å; Y479-M491 HydrophobicContact CD2-CE 4.22Å; T488-M491 HydrophobicContact CG2-CE 3.5Å; T488-M491 PolarHBondContact O-N 3.36Å; I489-M491 VanDerWaalsContact C-N 3.34Å; I489-M491 PolarHBondContact O-N 3.22Å; M491-E493 VanDerWaalsContact C-N 3.34Å; M491-H494 PolarHBondContact O-N 3.44Å; M491-L495 WeakPolarHBondContact O-CB 3.36Å; M491-L495 PolarHBondContact O-N 2.99Å
492R91.1Very high83.2Confident105 Ų10573.9 Ų73.940%0.39638%0.384SS..Hα-helixtrans-68-36.1177.8-69.6171.1-175.3-100.11.4111.7I476 T480 T488 I489 G490 K496I476-R492 HydrophobicContact CD1-CG 3.89Å; I476-R492 HydrophobicContact CG1-CG 4.33Å; I476-R492 HydrophobicContact CG2-CG 4.36Å; T480-R492 PolarHBondContact OG1-NH2 3.04Å; T488-R492 WeakPolarHBondContact O-CG 3.43Å; T488-R492 PolarHBondContact O-N 3.2Å; T488-R492 PolarHBondContact OG1-NE 3Å; I489-R492 WeakPolarHBondContact O-CB 3.19Å; I489-R492 PolarHBondContact O-N 3.09Å; I489-R492 VanDerWaalsContact O-N 3.1Å; G490-R492 PolarHBondContact O-N 3.36Å; R492-K496 WeakPolarHBondContact O-CG 3.45Å; R492-K496 PolarHBondContact O-N 3.32Å
493E90.4Very high80.9Confident122 Ų12279.2 Ų79.257%0.5742%0.417SS*.Hα-helixtrans-68.9-44.9174.8-69.9-177.3169.600111.6I489 G490 M491 L495 K496 S497I489-E493 PolarHBondContact O-N 2.96Å; G490-E493 PolarHBondContact O-N 3.48Å; M491-E493 VanDerWaalsContact C-N 3.34Å; E493-L495 VanDerWaalsContact C-N 3.34Å; E493-L495 PolarHBondContact O-N 3.1Å; E493-K496 WeakPolarHBondContact O-CB 3.42Å; E493-K496 PolarHBondContact O-N 3.41Å; E493-K496 VanDerWaalsContact O-N 3.12Å; E493-S497 PolarHBondContact O-N 3.14Å
494H88.8Confident78.4Confident60 Ų6082.1 Ų82.128%0.27842%0.421SS..Hα-helixtrans-56.7-45.5173-17668.4000112R466 G490 M491 K496 S497 V498R466-H494 HydrophobicContact CG-CB 4.46Å; R466-H494 PolarHBondContact O-NE2 2.98Å; G490-H494 WeakPolarHBondContact O-CB 3.44Å; G490-H494 PolarHBondContact O-N 3.12Å; M491-H494 PolarHBondContact O-N 3.44Å; H494-K496 PolarHBondContact O-N 2.82Å; H494-K496 VanDerWaalsContact O-N 3.14Å; H494-S497 PolarHBondContact O-N 3.26Å; H494-S497 PolarHBondContact O-OG 3.01Å; H494-V498 WeakPolarHBondContact O-CG2 3.46Å; H494-V498 PolarHBondContact O-N 3.48Å
495L86.1Confident75.6Confident43 Ų4390.4 Ų90.423%0.22546%0.457CS..Hα-helixtrans-63.9-23.7179.9-166.669000113.4P469 R473 I476 M491 E493P469-L495 HydrophobicContact CB-CD1 3.9Å; R473-L495 HydrophobicContact CG-CD1 4.35Å; R473-L495 HydrophobicContact CG-CD2 3.61Å; I476-L495 HydrophobicContact CD1-CD2 4.38Å; M491-L495 WeakPolarHBondContact O-CB 3.36Å; M491-L495 PolarHBondContact O-N 2.99Å; E493-L495 VanDerWaalsContact C-N 3.34Å; E493-L495 PolarHBondContact O-N 3.1Å
496K87.1Confident73.1Confident173 Ų17397.2 Ų97.275%0.75249%0.488SS*.Hα-helixtrans-76.2-28.4174.1-69.7170.2-176.11730112.6R492 E493 H494R492-K496 WeakPolarHBondContact O-CG 3.45Å; R492-K496 PolarHBondContact O-N 3.32Å; E493-K496 WeakPolarHBondContact O-CB 3.42Å; E493-K496 PolarHBondContact O-N 3.41Å; E493-K496 VanDerWaalsContact O-N 3.12Å; H494-K496 PolarHBondContact O-N 2.82Å; H494-K496 VanDerWaalsContact O-N 3.14Å
497S84.9Confident70.6Confident88 Ų88101.4 Ų101.462%0.61551%0.51SS*.Hα-helixtrans-82.7-21.5179.469.60000112.7E493 H494E493-S497 PolarHBondContact O-N 3.14Å; H494-S497 PolarHBondContact O-N 3.26Å; H494-S497 PolarHBondContact O-OG 3.01Å
498V78.2Confident68Low47 Ų47105.7 Ų105.729%0.28555%0.546SS..SBendtrans-69.7128.7175.3-176.70000110.8P469 H494 K500P469-V498 HydrophobicContact CG-CG1 3.92Å; H494-V498 WeakPolarHBondContact O-CG2 3.46Å; H494-V498 PolarHBondContact O-N 3.48Å; V498-K500 PolarHBondContact O-N 2.92Å
499P67.9Low65.6Low114 Ų114110.3 Ų110.374%0.7458%0.584SS**  trans-55.9127.9175.5-22.531.7000111.3E501P499-E501 PolarHBondContact O-N 2.92Å; P499-E501 VanDerWaalsContact O-N 3.07Å
500K59.8Low63.1Low203 Ų203113.8 Ų113.888%0.88360%0.603SS**  trans-57.3115.6176.5-71.8179.8179.1176.70109.7V498 R502V498-K500 PolarHBondContact O-N 2.92Å; K500-R502 PolarHBondContact O-N 3.07Å; K500-R502 VanDerWaalsContact O-N 3.14Å
501E51.4Low60.7Low136 Ų136122.1 Ų122.164%0.63664%0.639SS**  trans-54.6120.6167.3-77.6177.1148.300108.8P499 V503P499-E501 PolarHBondContact O-N 2.92Å; P499-E501 VanDerWaalsContact O-N 3.07Å; E501-V503 PolarHBondContact O-N 2.63Å
502R40.5Very low58.2Low235 Ų235129 Ų12989%0.88767%0.671SS**  trans-62.4106172.9-77.5-179.9176.5-178.3-0.7107.1K500 V504K500-R502 PolarHBondContact O-N 3.07Å; K500-R502 VanDerWaalsContact O-N 3.14Å; R502-V504 VanDerWaalsContact C-N 3.35Å; R502-V504 PolarHBondContact O-N 2.88Å
503V41.5Very low55.9Low128 Ų128130.9 Ų130.978%0.77669%0.694SS**  trans-57.2102.5165.6-177.20000106.8E501 K505E501-V503 PolarHBondContact O-N 2.63Å; V503-K505 VanDerWaalsContact C-N 3.28Å; V503-K505 PolarHBondContact O-N 3.14Å
504V39Very low53.5Low124 Ų124132.6 Ų132.675%0.75270%0.702SS**  trans-66.997.4165.8179.50000105R502 L506R502-V504 VanDerWaalsContact C-N 3.35Å; R502-V504 PolarHBondContact O-N 2.88Å; V504-L506 PolarHBondContact O-N 2.96Å
505K35.1Very low51.2Low184 Ų184133.8 Ų133.880%0.872%0.722SS**  trans-59.1111.8165.6-75.7-175.1175.5-176.20106.3V503V503-K505 VanDerWaalsContact C-N 3.28Å; V503-K505 PolarHBondContact O-N 3.14Å
506L38.4Very low49.1Very low160 Ų160140.2 Ų140.284%0.83875%0.751SS**PPolyproline II helixtrans-52.5132.5166.1-84.7132.6000108.1V504V504-L506 PolarHBondContact O-N 2.96Å
507P40.9Very low46.9Very low118 Ų118141 Ų14177%0.76676%0.757SS**PPolyproline II helixtrans-61.2140.3-17923.3-30.5000110.1A509P507-A509 PolarHBondContact O-N 2.94Å
508A40.3Very low44.6Very low91 Ų91142 Ų14275%0.75276%0.764SS**PPolyproline II helixtrans-53.8134176.800000109.7N510A508-N510 PolarHBondContact O-N 3.12Å
509A42Very low43Very low97 Ų97152.7 Ų152.780%0.80281%0.811SS**PPolyproline II helixtrans-52.1123.8177.400000109.8P507 E511P507-A509 PolarHBondContact O-N 2.94Å; A509-E511 PolarHBondContact O-N 2.82Å
510N40Very low41.8Very low150 Ų150154.7 Ų154.780%0.80282%0.815SS**  trans-55.8109176.9-84.1-15.4000110.2A508 H512A508-N510 PolarHBondContact O-N 3.12Å; N510-H512 PolarHBondContact O-N 3.39Å
511E39.3Very low40.8Very low185 Ų185152.1 Ų152.186%0.86481%0.811SS**  trans-7192.6153-71.5-179.5162.900107.8A509A509-E511 PolarHBondContact O-N 2.82Å
512H39.9Very low40.2Very low147 Ų147153 Ų15368%0.68182%0.821SS**  trans-137.581157.7-86.8-73.8000108.1N510N510-H512 PolarHBondContact O-N 3.39Å
513V41.5Very low40.2Very low143 Ų143148.2 Ų148.287%0.86782%0.817SS**  trans-89.685.5155.3-179.20000105.2A515V513-A515 PolarHBondContact O-N 3.03Å
514E40.3Very low40.1Very low158 Ų158149.4 Ų149.474%0.73882%0.819SS**  trans-79.2108.6164.1-81.7-176.4166.800107.9E516E514-E516 PolarHBondContact O-N 3.41Å
515A41.8Very low40.2Very low85 Ų85151.1 Ų151.170%0.70282%0.824SS**  trans-73.999.5168.100000108.8V513V513-A515 PolarHBondContact O-N 3.03Å
516E41.6Very low40.6Very low178 Ų178148.8 Ų148.883%0.83283%0.826SS**  trans-91.798156.6-75.7-167.3157.300108.4E514 S518E514-E516 PolarHBondContact O-N 3.41Å; E516-S518 PolarHBondContact O-N 3.29Å
517H41.2Very low40.7Very low190 Ų190147.9 Ų147.988%0.8883%0.825SS**  trans-69102.7159.5-84.7-31.1000108.8
518S37Very low40.7Very low110 Ų110150.4 Ų150.477%0.76983%0.83SS**  trans-98.797.1158.552.10000108.7E516E516-S518 PolarHBondContact O-N 3.29Å
519E43.7Very low40.8Very low271 Ų271155.8 Ų155.8100%1.26684%0.837SS**  trans174.90136.6-95.5-179.4-172.600111.1

Retrieved 519 of 519 residues in 1303.6 ms (Link to these results)

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