A0A060VYH6_ONCMY Loading...

Cyclin D1

AlphaFold DB , UniProt , Accession A0A060VYH6, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ccnd1, Length 292 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
1M41.6Very low45.5Very low226 Ų226156.7 Ų156.7100%1.11380%0.802SS**  090.10-98.6-173.5-73.800106.9
2E35.3Very low46.9Very low178 Ų178151.9 Ų151.983%0.83279%0.786SS**  trans-130.6101.3165.8-80.4-175.7159.600105.9Q4E2-Q4 VanDerWaalsContact C-N 3.34Å; E2-Q4 PolarHBondContact O-N 2.94Å
3H44.5Very low48.5Very low177 Ų177147.5 Ų147.582%0.81976%0.763SS**  trans-77.690.6166.5-77.1-83.9000107L5H3-L5 PolarHBondContact O-N 3.48Å; H3-L5 VanDerWaalsContact O-N 3.1Å
4Q42.9Very low50Low162 Ų162153.5 Ų153.576%0.75777%0.771SS**  trans-72.498.7161.1-88.4-178.9-9.800107.7E2 L6E2-Q4 VanDerWaalsContact C-N 3.34Å; E2-Q4 PolarHBondContact O-N 2.94Å; Q4-L6 VanDerWaalsContact C-N 3.32Å; Q4-L6 PolarHBondContact O-N 3.13Å
5L44.5Very low51.6Low156 Ų156155 Ų15582%0.81776%0.764SS**  trans-59.799.9158.6-75.8159.2000107H3 C7H3-L5 PolarHBondContact O-N 3.48Å; H3-L5 VanDerWaalsContact O-N 3.1Å; L5-C7 PolarHBondContact O-N 2.81Å
6L44.8Very low53.1Low145 Ų145151.3 Ų151.376%0.75977%0.765SS**  trans-68.280.1164.9-77.4150.3000107.6Q4 C8Q4-L6 VanDerWaalsContact C-N 3.32Å; Q4-L6 PolarHBondContact O-N 3.13Å; L6-C8 PolarHBondContact O-N 2.62Å
7C44.9Very low54.5Low107 Ų107154.3 Ų154.372%0.72377%0.767SS**  trans-69.374.3157-66.70000107.4L5 E9L5-C7 PolarHBondContact O-N 2.81Å; C7-E9 PolarHBondContact O-N 2.95Å
8C44.9Very low55.7Low94 Ų94153.8 Ų153.864%0.63576%0.762SS**  trans-71.977.2159.6-67.10000107L6 V10L6-C8 PolarHBondContact O-N 2.62Å; C8-V10 HydrophobicContact CB-CG2 4.09Å; C8-V10 PolarHBondContact O-N 3.46Å
9E50.7Low57.2Low187 Ų187148.6 Ų148.687%0.87474%0.738SS**  trans-66.976.8153.2-75-174.3166.500106.7C7C7-E9 PolarHBondContact O-N 2.95Å
10V51.5Low58.3Low94 Ų94144.8 Ų144.857%0.5773%0.73SS**  trans-75.6125157.1-164.20000104.2C8 T12C8-V10 HydrophobicContact CB-CG2 4.09Å; C8-V10 PolarHBondContact O-N 3.46Å; V10-T12 HydrophobicContact CB-CG2 4.18Å; V10-T12 HydrophobicContact CG1-CG2 3.64Å; V10-T12 PolarHBondContact O-N 3.38Å; V10-T12 PolarHBondContact O-OG1 3.39Å
11E55.2Low59.6Low198 Ų198142.7 Ų142.793%0.92572%0.721SS**  trans-64.850.8162.9-70.3-179.6149.700110I13E11-I13 PolarHBondContact O-N 2.95Å
12T62.6Low61.7Low99 Ų99136.7 Ų136.761%0.60769%0.693SS**  trans-75.5106.8167.733.40000106.4V10 R14V10-T12 HydrophobicContact CB-CG2 4.18Å; V10-T12 HydrophobicContact CG1-CG2 3.64Å; V10-T12 PolarHBondContact O-N 3.38Å; V10-T12 PolarHBondContact O-OG1 3.39Å; T12-R14 PolarHBondContact O-N 2.91Å
13I67Low64.1Low94 Ų94130.1 Ų130.148%0.48266%0.664SS.*  trans-45.1112.4164-64.2173.3000106.9E11 R15 T116E11-I13 PolarHBondContact O-N 2.95Å; I13-R15 HydrophobicContact CG2-CG 4.32Å; I13-R15 PolarHBondContact O-N 3.15Å; I13-T116 HydrophobicContact CG2-CG2 4.11Å; I13-T116 WeakPolarHBondContact CG2-OG1 3.31Å
14R70.2Confident66.3Low232 Ų232125.6 Ų125.688%0.87565%0.645SS**  trans-71.8102.5-178-73.5-171.5178.8-174.21.6108.2T12T12-R14 PolarHBondContact O-N 2.91Å
15R73.3Confident68.5Low176 Ų176122.4 Ų122.466%0.66463%0.633SS**PPolyproline II helixtrans-88.7140.6175.6-67.3-173.8170.1150.9-6.9110.6I13 E74I13-R15 HydrophobicContact CG2-CG 4.32Å; I13-R15 PolarHBondContact O-N 3.15Å; R15-E74 IonicContact CZ-OE1 3.8Å; R15-E74 IonicContact NE-OE1 3.52Å; R15-E74 IonicContact NH2-OE1 2.64Å; R15-E74 PolarHBondContact NH2-OE1 3.14Å; R15-E74 IonicContact NH2-OE2 3.86Å
16A76.4Confident70.8Confident96 Ų96123.6 Ų123.679%0.79363%0.627SS**PPolyproline II helixtrans-63.7152167.900000110
17Y76.3Confident73.1Confident202 Ų202118 Ų11879%0.79260%0.599SS**PPolyproline II helixtrans-67.8152.6170.460.2-92.2000109.9D19Y17-D19 PolarHBondContact O-N 3.28Å
18Q76.6Confident75.4Confident146 Ų146113.1 Ų113.168%0.68257%0.566SS**PPolyproline II helixtrans-67.9119.4176.5-168.4175.219.900109.7A20Q18-A20 PolarHBondContact O-N 2.91Å
19D83.1Confident77.7Confident55 Ų55112.7 Ų112.729%0.29455%0.554SS.*  trans-85.2107.6174.6-177.94.1000109.9Y17 N21 L22Y17-D19 PolarHBondContact O-N 3.28Å; D19-N21 PolarHBondContact O-N 3.33Å; D19-N21 VanDerWaalsContact O-N 3.15Å; D19-N21 VanDerWaalsContact OD1-CB 3.26Å; D19-N21 WeakPolarHBondContact OD1-CB 3.3Å; D19-N21 PolarHBondContact OD1-N 3.42Å; D19-N21 PolarHBondContact OD1-ND2 3.15Å; D19-L22 HydrophobicContact CB-CD1 3.95Å; D19-L22 HydrophobicContact CB-CG 3.92Å; D19-L22 WeakPolarHBondContact O-CB 3.31Å; D19-L22 PolarHBondContact O-N 3.28Å
20A80.3Confident79.8Confident71 Ų71107.5 Ų107.559%0.58754%0.536SS*.G310 helixtrans-59.6-23.9178.300000112.8Q18 L22 L23Q18-A20 PolarHBondContact O-N 2.91Å; A20-L22 PolarHBondContact O-N 3.3Å; A20-L23 PolarHBondContact O-N 3.14Å
21N84.9Confident81.8Confident102 Ų102104.1 Ų104.155%0.54551%0.514SS..G310 helixtrans-67-22.7177.7-62.9-61.3000112.9D19 L23 N24 V27D19-N21 PolarHBondContact O-N 3.33Å; D19-N21 VanDerWaalsContact O-N 3.15Å; D19-N21 VanDerWaalsContact OD1-CB 3.26Å; D19-N21 WeakPolarHBondContact OD1-CB 3.3Å; D19-N21 PolarHBondContact OD1-N 3.42Å; D19-N21 PolarHBondContact OD1-ND2 3.15Å; N21-L23 PolarHBondContact O-N 2.94Å; N21-N24 PolarHBondContact O-ND2 2.97Å; N21-V27 WeakPolarHBondContact O-CG2 3.32Å
22L85.4Confident83.7Confident100 Ų10095.5 Ų95.552%0.52447%0.474SS..G310 helixtrans-70.1-17.2176.7-62.9177.7000112.7D19 A20 V27 H163D19-L22 HydrophobicContact CB-CD1 3.95Å; D19-L22 HydrophobicContact CB-CG 3.92Å; D19-L22 WeakPolarHBondContact O-CB 3.31Å; D19-L22 PolarHBondContact O-N 3.28Å; A20-L22 PolarHBondContact O-N 3.3Å; L22-V27 VanDerWaalsContact O-CG1 3.28Å; L22-V27 WeakPolarHBondContact O-CG1 3.35Å; L22-H163 PolarHBondContact O-CE1 2.64Å; L22-H163 PolarHBondContact O-NE2 2.94Å
23L86.4Confident85.2Confident40 Ų4097.4 Ų97.421%0.20947%0.474CS..G310 helixtrans-99.910.1-176.3-60.1175.4000113.7A20 N21 D162A20-L23 PolarHBondContact O-N 3.14Å; N21-L23 PolarHBondContact O-N 2.94Å; L23-D162 HydrophobicContact CD2-CB 4.37Å
24N90.5Very high86.4Confident82 Ų8294.1 Ų94.144%0.43946%0.461SS..SBendtrans-80.4155.8-178-73.7-31.5000112.8N21 R26 V27 L28N21-N24 PolarHBondContact O-ND2 2.97Å; N24-R26 PolarHBondContact O-N 3.3Å; N24-R26 VanDerWaalsContact O-N 3.13Å; N24-V27 WeakPolarHBondContact O-CB 3.38Å; N24-V27 PolarHBondContact O-N 2.92Å; N24-L28 PolarHBondContact O-N 3.17Å; N24-L28 VanDerWaalsContact O-N 3.12Å
25D89.8Confident87.5Confident94 Ų9483.6 Ų83.650%0.50342%0.422SS..Hα-helixtrans-56.2-34.1-179.7-72.9-22.1000114.1V27 L28 Q29 K167D25-V27 VanDerWaalsContact C-N 3.32Å; D25-V27 PolarHBondContact O-N 2.97Å; D25-L28 PolarHBondContact O-N 3.34Å; D25-Q29 VanDerWaalsContact O-CG 3.3Å; D25-Q29 WeakPolarHBondContact O-CG 3.22Å; D25-Q29 PolarHBondContact O-N 3.21Å; D25-K167 VanDerWaalsContact OD1-CE 3.31Å; D25-K167 WeakPolarHBondContact OD1-CE 3.48Å; D25-K167 IonicContact OD1-NZ 3.26Å; D25-K167 PolarHBondContact OD1-NZ 2.86Å
26R93Very high88.3Confident181 Ų18182 Ų8268%0.68342%0.422SS*.Hα-helixtrans-63.2-39.4176.1-174.8-177.865.484.31.1112N24 T30N24-R26 PolarHBondContact O-N 3.3Å; N24-R26 VanDerWaalsContact O-N 3.13Å; R26-T30 PolarHBondContact O-N 3.16Å; R26-T30 VanDerWaalsContact O-N 3.15Å; R26-T30 PolarHBondContact O-OG1 3.12Å
27V93.2Very high89Confident27 Ų2783 Ų8316%0.16441%0.413CS..Hα-helixtrans-70.2-47.2178.9179.70000109.3N21 L22 N24 D25 Q29 T30 M31N21-V27 WeakPolarHBondContact O-CG2 3.32Å; L22-V27 VanDerWaalsContact O-CG1 3.28Å; L22-V27 WeakPolarHBondContact O-CG1 3.35Å; N24-V27 WeakPolarHBondContact O-CB 3.38Å; N24-V27 PolarHBondContact O-N 2.92Å; D25-V27 VanDerWaalsContact C-N 3.32Å; D25-V27 PolarHBondContact O-N 2.97Å; V27-Q29 VanDerWaalsContact C-N 3.32Å; V27-Q29 PolarHBondContact O-N 3.05Å; V27-T30 CarbonylContact O-C 3.54Å; V27-T30 WeakPolarHBondContact O-CA 3.33Å; V27-T30 WeakPolarHBondContact O-CB 3.49Å; V27-T30 PolarHBondContact O-N 3.42Å; V27-M31 HydrophobicContact CG1-CG 4.36Å; V27-M31 HydrophobicContact CG1-SD 3.94Å; V27-M31 WeakPolarHBondContact O-CG 3.26Å; V27-M31 PolarHBondContact O-N 3.36Å
28L93.3Very high89.7Confident6 Ų674.6 Ų74.63%0.03138%0.381CS..Hα-helixtrans-53.6-46.8174.2178.564.4000112.5N24 D25 T30 M31 L32 F160 H163 F164 V236N24-L28 PolarHBondContact O-N 3.17Å; N24-L28 VanDerWaalsContact O-N 3.12Å; D25-L28 PolarHBondContact O-N 3.34Å; L28-T30 PolarHBondContact O-N 2.9Å; L28-M31 WeakPolarHBondContact O-CB 3.41Å; L28-M31 PolarHBondContact O-N 2.94Å; L28-L32 HydrophobicContact CD1-CG 4.42Å; L28-L32 HydrophobicContact CG-CD1 4.29Å; L28-L32 WeakPolarHBondContact O-CG 3.28Å; L28-L32 PolarHBondContact O-N 2.92Å; L28-F160 HydrophobicContact CD1-CD1 3.72Å; L28-F160 HydrophobicContact CD1-CE1 3.82Å; L28-H163 HydrophobicContact CD1-CB 4.35Å; L28-F164 HydrophobicContact CD1-CE1 4.49Å; L28-V236 HydrophobicContact CD2-CG1 3.48Å; L28-V236 VanDerWaalsContact CD2-CG1 3.48Å
29Q92.6Very high90.5Very high84 Ų8470.9 Ų70.939%0.39337%0.365SS..Hα-helixtrans-63.3-31.7176.9-73.2179.115.500113D25 V27 K33D25-Q29 VanDerWaalsContact O-CG 3.3Å; D25-Q29 WeakPolarHBondContact O-CG 3.22Å; D25-Q29 PolarHBondContact O-N 3.21Å; V27-Q29 VanDerWaalsContact C-N 3.32Å; V27-Q29 PolarHBondContact O-N 3.05Å; Q29-K33 WeakPolarHBondContact O-CG 3.36Å; Q29-K33 PolarHBondContact O-N 2.76Å
30T93.7Very high90.9Very high79 Ų7968.9 Ų68.949%0.48536%0.355SS..Hα-helixtrans-71.9-41.3175.8-55.50000110.4R26 V27 L28 K33 A34R26-T30 PolarHBondContact O-N 3.16Å; R26-T30 VanDerWaalsContact O-N 3.15Å; R26-T30 PolarHBondContact O-OG1 3.12Å; V27-T30 CarbonylContact O-C 3.54Å; V27-T30 WeakPolarHBondContact O-CA 3.33Å; V27-T30 WeakPolarHBondContact O-CB 3.49Å; V27-T30 PolarHBondContact O-N 3.42Å; L28-T30 PolarHBondContact O-N 2.9Å; T30-K33 PolarHBondContact O-N 3.43Å; T30-A34 VanDerWaalsContact O-CB 3.32Å; T30-A34 WeakPolarHBondContact O-CB 3.43Å; T30-A34 PolarHBondContact O-N 3.24Å
31M94.6Very high91.5Very high22 Ų2267.7 Ų67.711%0.10834%0.342CS..Hα-helixtrans-62.9-45.2175.9-69.4167.356.400112.4V27 L28 K33 A34 E35 V155 D159 F160 H163V27-M31 HydrophobicContact CG1-CG 4.36Å; V27-M31 HydrophobicContact CG1-SD 3.94Å; V27-M31 WeakPolarHBondContact O-CG 3.26Å; V27-M31 PolarHBondContact O-N 3.36Å; L28-M31 WeakPolarHBondContact O-CB 3.41Å; L28-M31 PolarHBondContact O-N 2.94Å; M31-K33 VanDerWaalsContact C-N 3.27Å; M31-K33 PolarHBondContact O-N 3.07Å; M31-A34 PolarHBondContact O-N 3.36Å; M31-A34 VanDerWaalsContact O-N 3.07Å; M31-E35 PolarHBondContact O-N 2.93Å; M31-V155 HydrophobicContact CB-CG1 4.23Å; M31-V155 HydrophobicContact CB-CG2 4.39Å; M31-V155 HydrophobicContact CE-CG1 3.72Å; M31-V155 HydrophobicContact CG-CG1 4.39Å; M31-V155 HydrophobicContact CG-CG2 4.46Å; M31-D159 HydrophobicContact CE-CB 3.38Å; M31-F160 HydrophobicContact CB-CE1 3.92Å; M31-F160 HydrophobicContact CB-CZ 3.83Å; M31-F160 HydrophobicContact CE-CD1 3.92Å; M31-F160 HydrophobicContact CE-CD2 4.21Å; M31-F160 HydrophobicContact CE-CE1 3.95Å; M31-F160 HydrophobicContact CE-CE2 4.25Å; M31-F160 HydrophobicContact CE-CG 4.06Å; M31-F160 HydrophobicContact CE-CZ 4.13Å; M31-H163 PolarHBondContact SD-CE1 3.45Å
32L94.8Very high91.7Very high17 Ų1766.3 Ų66.39%0.08934%0.339CS..Hα-helixtrans-60.6-35.6175.9-70.5171.5000112.3L28 E35 F160 I237L28-L32 HydrophobicContact CD1-CG 4.42Å; L28-L32 HydrophobicContact CG-CD1 4.29Å; L28-L32 WeakPolarHBondContact O-CG 3.28Å; L28-L32 PolarHBondContact O-N 2.92Å; L32-E35 WeakPolarHBondContact CD2-OE1 3.34Å; L32-E35 WeakPolarHBondContact O-CG 3.23Å; L32-F160 HydrophobicContact CD2-CE1 3.63Å; L32-F160 HydrophobicContact CD2-CZ 4.09Å; L32-F160 HydrophobicContact CG-CE1 3.99Å; L32-I237 HydrophobicContact CD2-CB 4.35Å
33K93.1Very high92Very high140 Ų14066.3 Ų66.361%0.60934%0.339SS*.Hα-helixtrans-73.9-34.2173.6-70.9176.2-177.8-1770112.4Q29 T30 M31Q29-K33 WeakPolarHBondContact O-CG 3.36Å; Q29-K33 PolarHBondContact O-N 2.76Å; T30-K33 PolarHBondContact O-N 3.43Å; M31-K33 VanDerWaalsContact C-N 3.27Å; M31-K33 PolarHBondContact O-N 3.07Å
34A93.2Very high92.4Very high25 Ų2564.4 Ų64.421%0.20733%0.329CS..Hα-helixtrans-72.9-37.5-177.100000111.7T30 M31 E36 N37 Y38 V155T30-A34 VanDerWaalsContact O-CB 3.32Å; T30-A34 WeakPolarHBondContact O-CB 3.43Å; T30-A34 PolarHBondContact O-N 3.24Å; M31-A34 PolarHBondContact O-N 3.36Å; M31-A34 VanDerWaalsContact O-N 3.07Å; A34-E36 PolarHBondContact O-N 3.19Å; A34-N37 WeakPolarHBondContact O-CB 3.46Å; A34-N37 PolarHBondContact O-N 3.29Å; A34-N37 PolarHBondContact O-ND2 2.96Å; A34-Y38 HydrophobicContact CB-CE2 4.33Å; A34-Y38 WeakPolarHBondContact O-CD2 3.35Å; A34-Y38 VanDerWaalsContact O-CE2 3.29Å; A34-Y38 WeakPolarHBondContact O-CE2 3.41Å; A34-V155 HydrophobicContact CB-CG2 4.01Å
35E94.3Very high92.7Very high11 Ų1162.4 Ų62.45%0.05132%0.317CS..Hα-helixtrans-60.2-31.3-173.780.9-176151.500113.8M31 L32 N37 Y38 F160 P199 P200 S201M31-E35 PolarHBondContact O-N 2.93Å; L32-E35 WeakPolarHBondContact CD2-OE1 3.34Å; L32-E35 WeakPolarHBondContact O-CG 3.23Å; E35-N37 PolarHBondContact O-N 2.93Å; E35-Y38 PolarHBondContact O-N 2.93Å; E35-F160 WeakPolarHBondContact OE2-CE2 3.29Å; E35-P199 HydrophobicContact CG-CB 4.15Å; E35-P200 HydrophobicContact CB-CG 4.35Å; E35-P200 WeakPolarHBondContact OE2-CD 3.41Å; E35-S201 VanDerWaalsContact CD-OG 3.22Å; E35-S201 VanDerWaalsContact OE1-CB 3.27Å; E35-S201 WeakPolarHBondContact OE1-CB 3.43Å; E35-S201 PolarHBondContact OE1-OG 2.94Å; E35-S201 WeakPolarHBondContact OE2-CB 3.06Å; E35-S201 PolarHBondContact OE2-N 2.91Å; E35-S201 PolarHBondContact OE2-OG 3.47Å; E35-S201 VanDerWaalsContact OE2-OG 3.06Å
36E88.4Confident92.9Very high143 Ų14366.8 Ų66.867%0.66833%0.332SS*.G310 helixtrans-59.2-30.5176.9-64.7-178.5179.800112.4A34 Y38A34-E36 PolarHBondContact O-N 3.19Å; E36-Y38 PolarHBondContact O-N 3.46Å
37N91.2Very high93Very high115 Ų11562.8 Ų62.862%0.61533%0.33SS*.G310 helixtrans-74.8-15.8179.9-59.1-52.8000113.2A34 E35A34-N37 WeakPolarHBondContact O-CB 3.46Å; A34-N37 PolarHBondContact O-N 3.29Å; A34-N37 PolarHBondContact O-ND2 2.96Å; E35-N37 PolarHBondContact O-N 2.93Å
38Y91.6Very high93.2Very high27 Ų2763 Ų6311%0.10633%0.332CS..G310 helixtrans-110.15.7-173.4-57.1-74.9000113.1A34 E35 E36 N83 R87 D151 A153 S154A34-Y38 HydrophobicContact CB-CE2 4.33Å; A34-Y38 WeakPolarHBondContact O-CD2 3.35Å; A34-Y38 VanDerWaalsContact O-CE2 3.29Å; A34-Y38 WeakPolarHBondContact O-CE2 3.41Å; E35-Y38 PolarHBondContact O-N 2.93Å; E36-Y38 PolarHBondContact O-N 3.46Å; Y38-N83 PolarHBondContact O-ND2 3.03Å; Y38-R87 WeakPolarHBondContact O-CD 3.44Å; Y38-D151 VanDerWaalsContact CE1-CG 3.44Å; Y38-D151 VanDerWaalsContact CE1-OD1 3.29Å; Y38-D151 WeakPolarHBondContact CE1-OD1 3.09Å; Y38-D151 WeakPolarHBondContact CE1-OD2 3.49Å; Y38-D151 PolarHBondContact OH-OD1 3.47Å; Y38-D151 VanDerWaalsContact OH-OD1 3.12Å; Y38-A153 PolarHBondContact OH-O 3.27Å; Y38-S154 VanDerWaalsContact CG-CB 3.46Å
39L92.6Very high93.4Very high68 Ų6863.3 Ų63.336%0.35633%0.333SS..PPolyproline II helixtrans-71.1125.3176-77.7175.5000110.8P199L39-P199 HydrophobicContact CD2-CB 4.44Å
40P93.1Very high93.6Very high13 Ų1368.5 Ų68.58%0.08435%0.354CS..PPolyproline II helixtrans-69.9162171.231.5-35.5000111.1P42 D86 R87 S90 I196P40-P42 WeakPolarHBondContact O-CD 3.36Å; P40-D86 HydrophobicContact CB-CB 3.65Å; P40-D86 HydrophobicContact CG-CB 3.79Å; P40-R87 HydrophobicContact CB-CG 4.38Å; P40-S90 WeakPolarHBondContact CB-OG 3.28Å; P40-I196 HydrophobicContact CB-CG2 4.29Å; P40-I196 HydrophobicContact CG-CG2 3.61Å; P40-I196 VanDerWaalsContact CG-O 3.32Å; P40-I196 WeakPolarHBondContact CG-O 3.42Å
41S92.1Very high93.7Very high46 Ų4668.8 Ų68.832%0.32235%0.35SS..PPolyproline II helixtrans-69.9120.1175.7175.60000110N43 Y44 S90S41-N43 PolarHBondContact O-N 3.1Å; S41-Y44 WeakPolarHBondContact O-CD1 3.39Å; S41-Y44 PolarHBondContact O-N 3.4Å; S41-S90 PolarHBondContact N-OG 2.91Å
42P88.2Confident93.8Very high73 Ų7367.9 Ų67.947%0.47435%0.346SS..THydrogen-bonded Turntrans-64-19.2-17426.8-36.4000113.4P40 A197P40-P42 WeakPolarHBondContact O-CD 3.36Å; P42-A197 HydrophobicContact CB-CB 3.73Å
43N91.9Very high93.9Very high99 Ų9971.1 Ų71.153%0.52936%0.362SS..THydrogen-bonded Turntrans-112.220.3-175.7-66.2-52.1000113S41 F45 K46 C47S41-N43 PolarHBondContact O-N 3.1Å; N43-F45 PolarHBondContact O-N 3.24Å; N43-F45 VanDerWaalsContact O-N 3.14Å; N43-K46 PolarHBondContact O-N 3.29Å; N43-C47 PolarHBondContact O-N 3.08Å
44Y95.9Very high94.1Very high0 Ų067.3 Ų67.30%035%0.351CS..Hα-helixtrans-59-29.6-17771.5-111.5000113.2S41 K46 V48 Q49 R57 D86 L89 I196S41-Y44 WeakPolarHBondContact O-CD1 3.39Å; S41-Y44 PolarHBondContact O-N 3.4Å; Y44-K46 PolarHBondContact O-N 2.82Å; Y44-V48 WeakPolarHBondContact O-CB 3.22Å; Y44-V48 PolarHBondContact O-N 3.48Å; Y44-Q49 HydrophobicContact CD2-CG 3.76Å; Y44-Q49 HydrophobicContact CE2-CG 4.3Å; Y44-Q49 PolarHBondContact O-N 3.18Å; Y44-R57 WeakPolarHBondContact OH-CD 3.4Å; Y44-D86 HydrophobicContact CE1-CB 4.18Å; Y44-D86 PolarHBondContact OH-OD1 2.91Å; Y44-L89 HydrophobicContact CD2-CB 3.78Å; Y44-L89 HydrophobicContact CE2-CB 3.68Å; Y44-L89 HydrophobicContact CE2-CD1 3.83Å; Y44-L89 HydrophobicContact CE2-CG 4.41Å; Y44-L89 HydrophobicContact CG-CB 4.34Å; Y44-I196 HydrophobicContact CE1-CD1 4.11Å; Y44-I196 HydrophobicContact CE1-CG2 3.97Å
45F95.8Very high94.2Very high40 Ų4073.4 Ų73.418%0.17537%0.373CS..Hα-helixtrans-61.1-31174.4-72.3-69.9000113.6N43 I52 I53 P54 R57 V193 I196N43-F45 PolarHBondContact O-N 3.24Å; N43-F45 VanDerWaalsContact O-N 3.14Å; F45-I52 WeakPolarHBondContact CD1-O 3.39Å; F45-I52 HydrophobicContact CE1-CG2 4.07Å; F45-I53 VanDerWaalsContact CE1-C 3.44Å; F45-P54 HydrophobicContact CD1-CG 4.21Å; F45-P54 HydrophobicContact CD2-CG 4.1Å; F45-P54 HydrophobicContact CE1-CG 4.24Å; F45-P54 HydrophobicContact CE2-CG 4.13Å; F45-P54 HydrophobicContact CG-CG 4.12Å; F45-P54 HydrophobicContact CZ-CB 4.4Å; F45-P54 HydrophobicContact CZ-CG 4.2Å; F45-R57 HydrophobicContact CE1-CB 4.34Å; F45-R57 HydrophobicContact CZ-CB 3.86Å; F45-R57 HydrophobicContact CZ-CG 4.35Å; F45-V193 HydrophobicContact CE2-CG1 4.08Å; F45-V193 HydrophobicContact CZ-CG1 4.32Å; F45-I196 HydrophobicContact CE2-CD1 3.9Å
46K94.3Very high94.4Very high187 Ų18775.5 Ų75.581%0.81338%0.384SS*.Hα-helixtrans-94.6-38-179.4-175.4179178.7-178.20111.9N43 Y44N43-K46 PolarHBondContact O-N 3.29Å; Y44-K46 PolarHBondContact O-N 2.82Å
47C95.5Very high94.8Very high96 Ų9668.9 Ų68.965%0.64935%0.353SS*.Hα-helixtrans-93.6-26.4-169.3-63.60000113.8N43N43-C47 PolarHBondContact O-N 3.08Å
48V97.1Very high95Very high33 Ų3366.2 Ų66.220%0.234%0.336CS..THydrogen-bonded Turntrans-123.4-49.4-170.9-176.50000111.2Y44 P93Y44-V48 WeakPolarHBondContact O-CB 3.22Å; Y44-V48 PolarHBondContact O-N 3.48Å; V48-P93 HydrophobicContact CG1-CG 4.13Å
49Q97.8Very high95.3Very high11 Ų1169.9 Ų69.95%0.05136%0.356CS..  trans-79.8136.7-175.5-57.4-56.3-41.700111.5Y44 I52 L89 E92Y44-Q49 HydrophobicContact CD2-CG 3.76Å; Y44-Q49 HydrophobicContact CE2-CG 4.3Å; Y44-Q49 PolarHBondContact O-N 3.18Å; Q49-I52 HydrophobicContact CB-CB 4.08Å; Q49-I52 HydrophobicContact CG-CB 4.18Å; Q49-I52 HydrophobicContact CG-CG1 4.49Å; Q49-L89 PolarHBondContact NE2-O 3.38Å; Q49-E92 PolarHBondContact NE2-O 3.18Å
50K95.8Very high95.6Very high193 Ų19367.3 Ų67.384%0.83934%0.343SS*.SBendtrans-105.1-38.4176.6-61.6-179.1-177.2177.40112.3
51E96.7Very high95.8Very high85 Ų8566.7 Ų66.740%0.39734%0.339SS..SBendtrans-105.8-32.5-177.5-62.4-170.2177.400113.3I53 N95 K96E51-I53 PolarHBondContact O-N 2.95Å; E51-N95 WeakPolarHBondContact OE2-CA 3.49Å; E51-K96 HydrophobicContact CB-CB 4.46Å; E51-K96 PolarHBondContact OE2-N 3.14Å
52I97.3Very high96Very high4 Ų466.9 Ų66.92%0.02134%0.338CS..  trans-75.5125.9-175.9-47.6-54.5000109.3F45 Q49 M56 T94 K96 L99F45-I52 WeakPolarHBondContact CD1-O 3.39Å; F45-I52 HydrophobicContact CE1-CG2 4.07Å; Q49-I52 HydrophobicContact CB-CB 4.08Å; Q49-I52 HydrophobicContact CG-CB 4.18Å; Q49-I52 HydrophobicContact CG-CG1 4.49Å; I52-M56 HydrophobicContact CG2-CB 4.5Å; I52-T94 WeakPolarHBondContact CD1-O 3.31Å; I52-T94 VanDerWaalsContact CG1-O 3.3Å; I52-T94 WeakPolarHBondContact CG1-O 3.35Å; I52-K96 HydrophobicContact CD1-CB 4.22Å; I52-L99 HydrophobicContact CD1-CB 4.22Å; I52-L99 HydrophobicContact CD1-CD1 4.31Å; I52-L99 HydrophobicContact CD1-CD2 4.33Å; I52-L99 HydrophobicContact CG2-CD1 4.26Å; I52-L99 HydrophobicContact CG2-CD2 4.09Å
53I96.7Very high96.5Very high84 Ų8465.1 Ų65.143%0.43132%0.322SS..  trans-114.7157.9175.761.6171.8000110.9F45 E51 K55 M56 R57F45-I53 VanDerWaalsContact CE1-C 3.44Å; E51-I53 PolarHBondContact O-N 2.95Å; I53-K55 HydrophobicContact CD1-CB 4.21Å; I53-K55 HydrophobicContact CG1-CB 4.37Å; I53-K55 PolarHBondContact O-N 3.26Å; I53-K55 VanDerWaalsContact O-N 3.08Å; I53-M56 HydrophobicContact CD1-CE 4.24Å; I53-M56 HydrophobicContact CD1-CG 4.44Å; I53-M56 HydrophobicContact CG1-CB 4.34Å; I53-M56 HydrophobicContact CG1-CE 4.01Å; I53-M56 HydrophobicContact CG1-CG 3.69Å; I53-M56 HydrophobicContact CG1-SD 3.94Å; I53-M56 WeakPolarHBondContact O-CB 3.45Å; I53-M56 PolarHBondContact O-N 3.15Å; I53-R57 PolarHBondContact O-N 2.92Å
54P96.4Very high96.8Very high60 Ų6060.4 Ų60.439%0.3930%0.297SS..Hα-helixtrans-46.6-40.6178.4-36.240.2000115F45 M56 R57 K58 V193F45-P54 HydrophobicContact CD1-CG 4.21Å; F45-P54 HydrophobicContact CD2-CG 4.1Å; F45-P54 HydrophobicContact CE1-CG 4.24Å; F45-P54 HydrophobicContact CE2-CG 4.13Å; F45-P54 HydrophobicContact CG-CG 4.12Å; F45-P54 HydrophobicContact CZ-CB 4.4Å; F45-P54 HydrophobicContact CZ-CG 4.2Å; P54-M56 VanDerWaalsContact C-N 3.34Å; P54-M56 PolarHBondContact O-N 3.21Å; P54-R57 PolarHBondContact O-N 3.38Å; P54-K58 PolarHBondContact O-N 3.27Å; P54-V193 HydrophobicContact CB-CG1 3.85Å; P54-V193 HydrophobicContact CB-CG2 4.44Å
55K96.1Very high96.9Very high154 Ų15461.8 Ų61.867%0.6730%0.304SS*.Hα-helixtrans-61.5-39.6178-174.7177.7178.4-179.60112.7I53 K58 I59I53-K55 HydrophobicContact CD1-CB 4.21Å; I53-K55 HydrophobicContact CG1-CB 4.37Å; I53-K55 PolarHBondContact O-N 3.26Å; I53-K55 VanDerWaalsContact O-N 3.08Å; K55-K58 PolarHBondContact O-N 3.36Å; K55-I59 HydrophobicContact CG-CD1 4.25Å; K55-I59 WeakPolarHBondContact O-CG1 3.35Å; K55-I59 PolarHBondContact O-N 2.9Å; K55-I59 VanDerWaalsContact O-N 3.09Å
56M97.4Very high97Very high54 Ų5465.1 Ų65.127%0.26632%0.32SS..Hα-helixtrans-68.2-40.1178.5-65.4174.3-176.800111.3I52 I53 P54 I59 V60 K96 L99I52-M56 HydrophobicContact CG2-CB 4.5Å; I53-M56 HydrophobicContact CD1-CE 4.24Å; I53-M56 HydrophobicContact CD1-CG 4.44Å; I53-M56 HydrophobicContact CG1-CB 4.34Å; I53-M56 HydrophobicContact CG1-CE 4.01Å; I53-M56 HydrophobicContact CG1-CG 3.69Å; I53-M56 HydrophobicContact CG1-SD 3.94Å; I53-M56 WeakPolarHBondContact O-CB 3.45Å; I53-M56 PolarHBondContact O-N 3.15Å; P54-M56 VanDerWaalsContact C-N 3.34Å; P54-M56 PolarHBondContact O-N 3.21Å; M56-I59 PolarHBondContact O-N 3.43Å; M56-V60 PolarHBondContact O-N 3.17Å; M56-K96 HydrophobicContact CE-CB 4.35Å; M56-K96 HydrophobicContact CE-CD 4.36Å; M56-K96 HydrophobicContact SD-CB 3.98Å; M56-L99 HydrophobicContact CB-CD2 3.8Å
57R97.4Very high97.2Very high4 Ų456.3 Ų56.32%0.01528%0.282CS..Hα-helixtrans-58.5-47.4172.8-175.2-151.3177.4-105.54.5110.8Y44 F45 I53 P54 I59 V60 A61 M82 L85 D86 A190 T191Y44-R57 WeakPolarHBondContact OH-CD 3.4Å; F45-R57 HydrophobicContact CE1-CB 4.34Å; F45-R57 HydrophobicContact CZ-CB 3.86Å; F45-R57 HydrophobicContact CZ-CG 4.35Å; I53-R57 PolarHBondContact O-N 2.92Å; P54-R57 PolarHBondContact O-N 3.38Å; R57-I59 VanDerWaalsContact C-N 3.34Å; R57-I59 PolarHBondContact O-N 3.2Å; R57-V60 PolarHBondContact O-N 2.99Å; R57-A61 VanDerWaalsContact O-CB 3.29Å; R57-A61 WeakPolarHBondContact O-CB 3.25Å; R57-A61 PolarHBondContact O-N 2.88Å; R57-M82 HydrophobicContact CG-CE 4.49Å; R57-M82 VanDerWaalsContact CZ-CE 3.43Å; R57-M82 VanDerWaalsContact NH2-CE 3.26Å; R57-L85 HydrophobicContact CG-CD2 4.16Å; R57-D86 IonicContact CZ-OD1 3.47Å; R57-D86 IonicContact CZ-OD2 2.69Å; R57-D86 IonicContact NE-OD1 3.88Å; R57-D86 PolarHBondContact NE-OD1 2.85Å; R57-D86 IonicContact NE-OD2 3.5Å; R57-D86 IonicContact NH2-OD1 2.8Å; R57-D86 PolarHBondContact NH2-OD1 2.78Å; R57-D86 IonicContact NH2-OD2 3.56Å; R57-D86 PolarHBondContact NH2-OD2 3.45Å; R57-A190 VanDerWaalsContact CZ-O 3.32Å; R57-A190 PolarHBondContact NH1-O 2.88Å; R57-A190 PolarHBondContact NH2-O 3.07Å; R57-T191 PolarHBondContact NH1-O 3.27Å
58K96.3Very high97.3Very high60 Ų6052.1 Ų52.126%0.26125%0.254SS..Hα-helixtrans-58.3-45178.1-176.3170.8179.51740111.8P54 K55 V60 A61 T62P54-K58 PolarHBondContact O-N 3.27Å; K55-K58 PolarHBondContact O-N 3.36Å; K58-V60 PolarHBondContact O-N 3.01Å; K58-A61 PolarHBondContact O-N 2.99Å; K58-T62 PolarHBondContact O-N 3.46Å; K58-T62 PolarHBondContact O-OG1 2.69Å; K58-T62 VanDerWaalsContact O-OG1 3.08Å
59I96.9Very high97.3Very high103 Ų10356.6 Ų56.653%0.52827%0.273SS..Hα-helixtrans-59-48.9177.6-68.4164.2000111.2K55 M56 R57 T62 W63K55-I59 HydrophobicContact CG-CD1 4.25Å; K55-I59 WeakPolarHBondContact O-CG1 3.35Å; K55-I59 PolarHBondContact O-N 2.9Å; K55-I59 VanDerWaalsContact O-N 3.09Å; M56-I59 PolarHBondContact O-N 3.43Å; R57-I59 VanDerWaalsContact C-N 3.34Å; R57-I59 PolarHBondContact O-N 3.2Å; I59-T62 PolarHBondContact O-N 2.96Å; I59-W63 PolarHBondContact O-N 3Å
60V98.1Very high97.3Very high14 Ų1462.5 Ų62.59%0.08530%0.3CS..Hα-helixtrans-68.4-37180172.70000111.7M56 R57 K58 W63 M64 L85 L99M56-V60 PolarHBondContact O-N 3.17Å; R57-V60 PolarHBondContact O-N 2.99Å; K58-V60 PolarHBondContact O-N 3.01Å; V60-W63 HydrophobicContact CG1-CE3 4.23Å; V60-W63 PolarHBondContact O-N 3.23Å; V60-M64 HydrophobicContact CG1-CG 4.25Å; V60-M64 HydrophobicContact CG1-SD 3.82Å; V60-M64 WeakPolarHBondContact O-CB 3.44Å; V60-M64 WeakPolarHBondContact O-CG 3.33Å; V60-M64 PolarHBondContact O-N 3.02Å; V60-L85 HydrophobicContact CG1-CD1 4.19Å; V60-L99 HydrophobicContact CB-CD2 4.32Å; V60-L99 HydrophobicContact CB-CG 4.37Å; V60-L99 HydrophobicContact CG2-CB 4.49Å; V60-L99 HydrophobicContact CG2-CD2 3.7Å; V60-L99 HydrophobicContact CG2-CG 3.82Å
61A98.1Very high97.3Very high0 Ų056 Ų560%027%0.273CS..Hα-helixtrans-63.9-42.3175.400000112.2R57 K58 M64 L65 F78 M82 T191R57-A61 VanDerWaalsContact O-CB 3.29Å; R57-A61 WeakPolarHBondContact O-CB 3.25Å; R57-A61 PolarHBondContact O-N 2.88Å; K58-A61 PolarHBondContact O-N 2.99Å; A61-M64 PolarHBondContact O-N 2.87Å; A61-L65 PolarHBondContact O-N 3.05Å; A61-F78 VanDerWaalsContact O-CE2 3.23Å; A61-F78 WeakPolarHBondContact O-CE2 3.41Å; A61-M82 HydrophobicContact CB-CE 3.61Å; A61-M82 HydrophobicContact CB-SD 3.65Å; A61-T191 HydrophobicContact CB-CG2 4.28Å
62T97.1Very high97.3Very high50 Ų5060.8 Ų60.831%0.30729%0.292SS..Hα-helixtrans-62.7-46.6175-61.90000111.1K58 I59 M64 L65 E66K58-T62 PolarHBondContact O-N 3.46Å; K58-T62 PolarHBondContact O-OG1 2.69Å; K58-T62 VanDerWaalsContact O-OG1 3.08Å; I59-T62 PolarHBondContact O-N 2.96Å; T62-M64 PolarHBondContact O-N 3.22Å; T62-L65 WeakPolarHBondContact O-CB 3.44Å; T62-L65 PolarHBondContact O-N 3.21Å; T62-E66 WeakPolarHBondContact O-CG 3.39Å; T62-E66 PolarHBondContact O-N 3.1Å
63W98Very high97.2Very high36 Ų3661.2 Ų61.214%0.13630%0.296CS..Hα-helixtrans-59.7-43.8174.5166.477.1000112.3I59 V60 L65 E66 V67 Q100 A104 M107 Y127 T128I59-W63 PolarHBondContact O-N 3Å; V60-W63 HydrophobicContact CG1-CE3 4.23Å; V60-W63 PolarHBondContact O-N 3.23Å; W63-L65 VanDerWaalsContact C-N 3.3Å; W63-L65 PolarHBondContact O-N 3.22Å; W63-E66 PolarHBondContact O-N 3.19Å; W63-V67 HydrophobicContact CD2-CG2 4.37Å; W63-V67 HydrophobicContact CZ2-CG2 4.05Å; W63-V67 VanDerWaalsContact O-CG2 3.31Å; W63-V67 WeakPolarHBondContact O-CG2 3.29Å; W63-V67 PolarHBondContact O-N 3.38Å; W63-Q100 HydrophobicContact CE3-CG 4.32Å; W63-Q100 HydrophobicContact CH2-CG 4.11Å; W63-Q100 HydrophobicContact CZ2-CG 4.35Å; W63-Q100 HydrophobicContact CZ3-CG 4.08Å; W63-A104 HydrophobicContact CH2-CB 3.94Å; W63-M107 HydrophobicContact CE3-CE 4.24Å; W63-M107 HydrophobicContact CH2-CE 3.36Å; W63-M107 HydrophobicContact CZ2-CE 4.07Å; W63-M107 HydrophobicContact CZ3-CE 3.48Å; W63-M107 VanDerWaalsContact CZ3-CE 3.48Å; W63-Y127 PolarHBondContact NE1-O 3.05Å; W63-T128 HydrophobicContact CH2-CG2 3.99Å; W63-T128 HydrophobicContact CZ2-CG2 3.67Å
64M98.7Very high97.1Very high0 Ų060.1 Ų60.10%029%0.289CS..Hα-helixtrans-60.3-40.1176.4-74.2166.769.300112.1V60 A61 T62 C68 F78 A81 M82 L85 C106 M107V60-M64 HydrophobicContact CG1-CG 4.25Å; V60-M64 HydrophobicContact CG1-SD 3.82Å; V60-M64 WeakPolarHBondContact O-CB 3.44Å; V60-M64 WeakPolarHBondContact O-CG 3.33Å; V60-M64 PolarHBondContact O-N 3.02Å; A61-M64 PolarHBondContact O-N 2.87Å; T62-M64 PolarHBondContact O-N 3.22Å; M64-C68 PolarHBondContact O-N 3.28Å; M64-C68 PolarHBondContact O-SG 3.24Å; M64-F78 HydrophobicContact CB-CD2 4.01Å; M64-F78 HydrophobicContact CB-CE2 3.82Å; M64-A81 HydrophobicContact CE-CB 3.53Å; M64-M82 HydrophobicContact CE-SD 3.83Å; M64-M82 HydrophobicContact SD-SD 3.86Å; M64-L85 HydrophobicContact CE-CD1 4.42Å; M64-L85 HydrophobicContact SD-CD1 3.78Å; M64-C106 HydrophobicContact CE-CB 4.28Å; M64-M107 VanDerWaalsContact CA-SD 3.6Å; M64-M107 HydrophobicContact CB-CE 4.28Å; M64-M107 HydrophobicContact CB-CG 4.3Å; M64-M107 HydrophobicContact CB-SD 3.68Å; M64-M107 HydrophobicContact CE-CG 3.85Å; M64-M107 HydrophobicContact CG-CE 3.83Å; M64-M107 HydrophobicContact CG-CG 4.11Å; M64-M107 HydrophobicContact CG-SD 3.79Å; M64-M107 VanDerWaalsContact O-SD 3.42Å
65L97.9Very high97Very high30 Ų3062.1 Ų62.116%0.15729%0.293CS..Hα-helixtrans-63.1-49.5176.1177.659.2000111.1A61 T62 W63 V67 C68 E69 F78 A187 T191A61-L65 PolarHBondContact O-N 3.05Å; T62-L65 WeakPolarHBondContact O-CB 3.44Å; T62-L65 PolarHBondContact O-N 3.21Å; W63-L65 VanDerWaalsContact C-N 3.3Å; W63-L65 PolarHBondContact O-N 3.22Å; L65-V67 VanDerWaalsContact C-N 3.3Å; L65-V67 PolarHBondContact O-N 3.34Å; L65-C68 PolarHBondContact O-N 3.07Å; L65-C68 VanDerWaalsContact O-N 3.09Å; L65-E69 HydrophobicContact CD1-CG 4.14Å; L65-E69 HydrophobicContact CG-CG 4.47Å; L65-E69 WeakPolarHBondContact O-CG 3.46Å; L65-E69 PolarHBondContact O-N 3.12Å; L65-F78 HydrophobicContact CB-CD1 4.46Å; L65-F78 HydrophobicContact CB-CD2 4.17Å; L65-F78 HydrophobicContact CB-CE1 4.12Å; L65-F78 HydrophobicContact CB-CE2 3.85Å; L65-F78 HydrophobicContact CB-CG 4.47Å; L65-F78 HydrophobicContact CB-CZ 3.82Å; L65-F78 HydrophobicContact CD1-CD1 3.77Å; L65-F78 HydrophobicContact CD1-CE1 3.99Å; L65-F78 HydrophobicContact CD1-CG 4.1Å; L65-F78 HydrophobicContact CD2-CE1 4.48Å; L65-F78 HydrophobicContact CG-CE1 4.43Å; L65-A187 HydrophobicContact CD1-CB 4.02Å; L65-A187 HydrophobicContact CD2-CB 4.35Å; L65-T191 HydrophobicContact CD2-CG2 4.37Å
66E97.8Very high96.9Very high109 Ų10957.1 Ų57.151%0.50927%0.272SS..Hα-helixtrans-56.6-43.5177.7-69.7166.2179.200111.7T62 W63 C68 E69 E70T62-E66 WeakPolarHBondContact O-CG 3.39Å; T62-E66 PolarHBondContact O-N 3.1Å; W63-E66 PolarHBondContact O-N 3.19Å; E66-C68 PolarHBondContact O-N 2.97Å; E66-E69 PolarHBondContact O-N 3.27Å; E66-E70 WeakPolarHBondContact O-CB 3.19Å; E66-E70 PolarHBondContact O-N 3.19Å
67V98.2Very high97Very high3 Ų354.5 Ų54.52%0.01826%0.259CS..Hα-helixtrans-62.6-43.2176.2173.30000111.5W63 L65 Q71 M107 L124 Y127W63-V67 HydrophobicContact CD2-CG2 4.37Å; W63-V67 HydrophobicContact CZ2-CG2 4.05Å; W63-V67 VanDerWaalsContact O-CG2 3.31Å; W63-V67 WeakPolarHBondContact O-CG2 3.29Å; W63-V67 PolarHBondContact O-N 3.38Å; L65-V67 VanDerWaalsContact C-N 3.3Å; L65-V67 PolarHBondContact O-N 3.34Å; V67-Q71 WeakPolarHBondContact O-CB 3.44Å; V67-Q71 WeakPolarHBondContact O-CG 3.12Å; V67-Q71 PolarHBondContact O-N 2.83Å; V67-M107 HydrophobicContact CB-CE 4.19Å; V67-M107 HydrophobicContact CB-SD 4.1Å; V67-M107 HydrophobicContact CG1-CE 4.06Å; V67-M107 HydrophobicContact CG1-SD 4.08Å; V67-M107 HydrophobicContact CG2-CE 4.45Å; V67-L124 HydrophobicContact CG1-CD2 4.33Å; V67-Y127 HydrophobicContact CB-CD1 4.49Å; V67-Y127 HydrophobicContact CB-CG 4.43Å; V67-Y127 HydrophobicContact CG1-CD1 4.32Å; V67-Y127 HydrophobicContact CG1-CD2 3.73Å; V67-Y127 HydrophobicContact CG1-CE2 4.06Å; V67-Y127 HydrophobicContact CG1-CG 3.88Å; V67-Y127 HydrophobicContact CG2-CD1 3.72Å; V67-Y127 HydrophobicContact CG2-CD2 4.46Å; V67-Y127 HydrophobicContact CG2-CE1 4.41Å; V67-Y127 HydrophobicContact CG2-CG 3.76Å
68C98.1Very high97Very high8 Ų854.7 Ų54.75%0.05426%0.26CS..Hα-helixtrans-66.1-38.9178.6-680000111.9M64 L65 E66 K72 C73 F78M64-C68 PolarHBondContact O-N 3.28Å; M64-C68 PolarHBondContact O-SG 3.24Å; L65-C68 PolarHBondContact O-N 3.07Å; L65-C68 VanDerWaalsContact O-N 3.09Å; E66-C68 PolarHBondContact O-N 2.97Å; C68-K72 PolarHBondContact O-N 3.06Å; C68-C73 HydrophobicContact CB-CB 4.14Å; C68-C73 PolarHBondContact O-N 2.64Å; C68-F78 HydrophobicContact CB-CB 4.21Å
69E96.5Very high97.1Very high127 Ų12752.4 Ų52.459%0.59325%0.251SS*.Hα-helixtrans-66.9-45.5176.3-71.7-179.1156.700111.6L65 E66 Q71 K72L65-E69 HydrophobicContact CD1-CG 4.14Å; L65-E69 HydrophobicContact CG-CG 4.47Å; L65-E69 WeakPolarHBondContact O-CG 3.46Å; L65-E69 PolarHBondContact O-N 3.12Å; E66-E69 PolarHBondContact O-N 3.27Å; E69-Q71 VanDerWaalsContact C-N 3.3Å; E69-Q71 PolarHBondContact O-N 2.78Å; E69-K72 PolarHBondContact O-N 2.81Å
70E97.3Very high97.1Very high135 Ų13547.6 Ų47.663%0.63123%0.227SC*.Hα-helixtrans-64.6-34.7178.5-172.164.1-153.400111.9E66 K72 Y127E66-E70 WeakPolarHBondContact O-CB 3.19Å; E66-E70 PolarHBondContact O-N 3.19Å; E70-K72 VanDerWaalsContact C-N 3.32Å; E70-Y127 HydrophobicContact CB-CE1 4.43Å; E70-Y127 HydrophobicContact CG-CE1 4.17Å; E70-Y127 WeakPolarHBondContact CG-OH 3.4Å
71Q96.3Very high97.1Very high56 Ų5647 Ų4726%0.26222%0.223SC..THydrogen-bonded Turntrans-85-3.7174.2-65.6-57.4-95.100114.2V67 E69 C73 L119 K123 Y127V67-Q71 WeakPolarHBondContact O-CB 3.44Å; V67-Q71 WeakPolarHBondContact O-CG 3.12Å; V67-Q71 PolarHBondContact O-N 2.83Å; E69-Q71 VanDerWaalsContact C-N 3.3Å; E69-Q71 PolarHBondContact O-N 2.78Å; Q71-C73 PolarHBondContact O-N 3Å; Q71-L119 HydrophobicContact CB-CD2 3.73Å; Q71-L119 HydrophobicContact CG-CD2 3.75Å; Q71-K123 VanDerWaalsContact OE1-CE 3.23Å; Q71-Y127 VanDerWaalsContact CD-OH 3.32Å; Q71-Y127 HydrophobicContact CG-CE2 3.64Å; Q71-Y127 PolarHBondContact NE2-OH 3.32Å
72K95.9Very high97.1Very high185 Ų18547.1 Ų47.180%0.80422%0.224SC*.THydrogen-bonded Turntrans51.841.8-177.4-54.4176.2-176.9174.20111.5C68 E69 E70C68-K72 PolarHBondContact O-N 3.06Å; E69-K72 PolarHBondContact O-N 2.81Å; E70-K72 VanDerWaalsContact C-N 3.32Å
73C96.3Very high97.2Very high14 Ų1446 Ų4610%0.09522%0.215CC..  trans-58.1156.6176.6-64.70000110.5C68 Q71 V77 E115C68-C73 HydrophobicContact CB-CB 4.14Å; C68-C73 PolarHBondContact O-N 2.64Å; Q71-C73 PolarHBondContact O-N 3Å; C73-V77 HydrophobicContact CB-CB 4.02Å; C73-V77 HydrophobicContact CB-CG1 4.26Å; C73-V77 HydrophobicContact CB-CG2 4.09Å; C73-E115 WeakPolarHBondContact CA-OE1 3.06Å
74E94.6Very high97.2Very high61 Ų6144.2 Ų44.229%0.28521%0.209SC..  trans-58.6142.3167.9-62.8-70.1175.200110R15 E76 V77 E115R15-E74 IonicContact CZ-OE1 3.8Å; R15-E74 IonicContact NE-OE1 3.52Å; R15-E74 IonicContact NH2-OE1 2.64Å; R15-E74 PolarHBondContact NH2-OE1 3.14Å; R15-E74 IonicContact NH2-OE2 3.86Å; E74-E76 PolarHBondContact O-N 2.91Å; E74-V77 HydrophobicContact CB-CG2 4.3Å; E74-V77 VanDerWaalsContact O-CB 3.31Å; E74-V77 WeakPolarHBondContact O-CB 3.14Å; E74-V77 WeakPolarHBondContact O-CG2 3.44Å; E74-V77 PolarHBondContact O-N 2.89Å; E74-E115 HydrophobicContact CG-CG 4.38Å
75E93.9Very high97.2Very high102 Ų10244.2 Ų44.248%0.47721%0.209SC..THydrogen-bonded Turntrans-61.3-23.5-167.7-61-78.8173.600112.7P79 H158E75-P79 WeakPolarHBondContact O-CD 3.49Å; E75-H158 PolarHBondContact O-CE1 3.28Å
76E94.9Very high97.2Very high48 Ų4843.1 Ų43.122%0.22420%0.203CC..THydrogen-bonded Turntrans-74.5-21.6175.9-60.298.2129.500114.2E74 F78 P79 L80 K114 H158E74-E76 PolarHBondContact O-N 2.91Å; E76-F78 PolarHBondContact O-N 3.04Å; E76-P79 WeakPolarHBondContact O-CD 3.44Å; E76-L80 WeakPolarHBondContact O-CB 3.09Å; E76-L80 PolarHBondContact O-N 2.64Å; E76-L80 VanDerWaalsContact O-N 3.09Å; E76-K114 HydrophobicContact CB-CD 3.92Å; E76-K114 HydrophobicContact CB-CG 4.01Å; E76-H158 HydrophobicContact CG-CB 3.61Å
77V97.9Very high97.2Very high0 Ų039.2 Ų39.20%018%0.184CC..Hα-helixtrans-61.2-48.5-173.8173.70000110.9C73 E74 L80 A81 A110 K114 E115C73-V77 HydrophobicContact CB-CB 4.02Å; C73-V77 HydrophobicContact CB-CG1 4.26Å; C73-V77 HydrophobicContact CB-CG2 4.09Å; E74-V77 HydrophobicContact CB-CG2 4.3Å; E74-V77 VanDerWaalsContact O-CB 3.31Å; E74-V77 WeakPolarHBondContact O-CB 3.14Å; E74-V77 WeakPolarHBondContact O-CG2 3.44Å; E74-V77 PolarHBondContact O-N 2.89Å; V77-L80 PolarHBondContact O-N 3.16Å; V77-A81 VanDerWaalsContact O-CB 3.32Å; V77-A81 WeakPolarHBondContact O-CB 3.27Å; V77-A81 PolarHBondContact O-N 2.75Å; V77-A110 HydrophobicContact CG1-CB 4.04Å; V77-A110 WeakPolarHBondContact O-CB 3.41Å; V77-K114 HydrophobicContact CG2-CB 3.92Å; V77-E115 HydrophobicContact CG2-CG 3.64Å
78F98.3Very high97.2Very high7 Ų739.2 Ų39.23%0.03118%0.183CC..Hα-helixtrans-66.3-51.8-176.3169.8-110.7000113.2A61 M64 L65 C68 E76 L80 A81 M82 A187 A190 T191A61-F78 VanDerWaalsContact O-CE2 3.23Å; A61-F78 WeakPolarHBondContact O-CE2 3.41Å; M64-F78 HydrophobicContact CB-CD2 4.01Å; M64-F78 HydrophobicContact CB-CE2 3.82Å; L65-F78 HydrophobicContact CB-CD1 4.46Å; L65-F78 HydrophobicContact CB-CD2 4.17Å; L65-F78 HydrophobicContact CB-CE1 4.12Å; L65-F78 HydrophobicContact CB-CE2 3.85Å; L65-F78 HydrophobicContact CB-CG 4.47Å; L65-F78 HydrophobicContact CB-CZ 3.82Å; L65-F78 HydrophobicContact CD1-CD1 3.77Å; L65-F78 HydrophobicContact CD1-CE1 3.99Å; L65-F78 HydrophobicContact CD1-CG 4.1Å; L65-F78 HydrophobicContact CD2-CE1 4.48Å; L65-F78 HydrophobicContact CG-CE1 4.43Å; C68-F78 HydrophobicContact CB-CB 4.21Å; E76-F78 PolarHBondContact O-N 3.04Å; F78-L80 VanDerWaalsContact C-N 3.26Å; F78-L80 PolarHBondContact O-N 3.16Å; F78-A81 WeakPolarHBondContact O-CB 3.18Å; F78-A81 PolarHBondContact O-N 2.93Å; F78-M82 HydrophobicContact CD2-CG 4.16Å; F78-M82 HydrophobicContact CE1-CG 4.36Å; F78-M82 HydrophobicContact CE2-CG 3.59Å; F78-M82 HydrophobicContact CE2-SD 3.94Å; F78-M82 HydrophobicContact CZ-CG 3.72Å; F78-M82 HydrophobicContact CZ-SD 4.29Å; F78-M82 WeakPolarHBondContact O-CG 3.37Å; F78-M82 PolarHBondContact O-N 2.91Å; F78-A187 HydrophobicContact CD1-CB 4.21Å; F78-A187 HydrophobicContact CE1-CB 4.2Å; F78-A190 HydrophobicContact CD1-CB 4.46Å; F78-A190 HydrophobicContact CE1-CB 3.72Å; F78-A190 HydrophobicContact CZ-CB 4.16Å; F78-T191 HydrophobicContact CE1-CG2 4.43Å; F78-T191 HydrophobicContact CZ-CG2 4.01Å
79P97.6Very high97.2Very high13 Ų1338.8 Ų38.88%0.08418%0.181CC..Hα-helixtrans-60.9-35.2176.5-22.932.8000113.2E75 E76 M82 N83 V186E75-P79 WeakPolarHBondContact O-CD 3.49Å; E76-P79 WeakPolarHBondContact O-CD 3.44Å; P79-M82 PolarHBondContact O-N 3.49Å; P79-N83 PolarHBondContact O-N 3.34Å; P79-V186 HydrophobicContact CB-CG1 4.23Å; P79-V186 HydrophobicContact CG-CG1 3.74Å
80L98Very high97.2Very high2 Ų233.7 Ų33.71%0.0116%0.159CC..Hα-helixtrans-66.4-43.7175.9-176.360.5000111.4E76 V77 F78 M82 N83 Y84 A110 M113 K114 S154 T156E76-L80 WeakPolarHBondContact O-CB 3.09Å; E76-L80 PolarHBondContact O-N 2.64Å; E76-L80 VanDerWaalsContact O-N 3.09Å; V77-L80 PolarHBondContact O-N 3.16Å; F78-L80 VanDerWaalsContact C-N 3.26Å; F78-L80 PolarHBondContact O-N 3.16Å; L80-M82 VanDerWaalsContact C-N 3.3Å; L80-M82 PolarHBondContact O-N 3.37Å; L80-N83 WeakPolarHBondContact O-CB 3.42Å; L80-N83 PolarHBondContact O-N 2.91Å; L80-Y84 HydrophobicContact CD1-CD1 4.45Å; L80-Y84 HydrophobicContact CD1-CE1 3.59Å; L80-Y84 HydrophobicContact CD1-CE2 4.38Å; L80-Y84 WeakPolarHBondContact CD1-OH 3.18Å; L80-Y84 HydrophobicContact CD2-CE2 4.41Å; L80-Y84 WeakPolarHBondContact CD2-OH 3.27Å; L80-Y84 HydrophobicContact CG-CE1 4.02Å; L80-Y84 HydrophobicContact CG-CE2 3.89Å; L80-Y84 WeakPolarHBondContact CG-OH 3.44Å; L80-Y84 PolarHBondContact O-N 3.13Å; L80-A110 HydrophobicContact CB-CB 4.05Å; L80-A110 HydrophobicContact CD2-CB 4.04Å; L80-A110 HydrophobicContact CG-CB 3.97Å; L80-M113 HydrophobicContact CD2-CB 3.99Å; L80-K114 HydrophobicContact CD2-CD 4.33Å; L80-K114 HydrophobicContact CD2-CG 3.55Å; L80-S154 WeakPolarHBondContact CD1-OG 3.4Å; L80-T156 HydrophobicContact CB-CG2 4.16Å; L80-T156 HydrophobicContact CD1-CG2 4.17Å
81A98.6Very high97.2Very high0 Ų031.1 Ų31.10%015%0.152CC..Hα-helixtrans-61.2-39.2174.100000111.8M64 V77 F78 Y84 L85 C106 M107 A110M64-A81 HydrophobicContact CE-CB 3.53Å; V77-A81 VanDerWaalsContact O-CB 3.32Å; V77-A81 WeakPolarHBondContact O-CB 3.27Å; V77-A81 PolarHBondContact O-N 2.75Å; F78-A81 WeakPolarHBondContact O-CB 3.18Å; F78-A81 PolarHBondContact O-N 2.93Å; A81-Y84 PolarHBondContact O-N 2.72Å; A81-L85 WeakPolarHBondContact O-CB 3.29Å; A81-L85 PolarHBondContact O-N 3.23Å; A81-C106 HydrophobicContact CB-CB 4.1Å; A81-C106 WeakPolarHBondContact O-CB 3.47Å; A81-M107 HydrophobicContact CB-CG 4.04Å; A81-A110 HydrophobicContact CB-CB 3.86Å
82M98.2Very high97.3Very high4 Ų430.8 Ų30.82%0.0215%0.151CC..Hα-helixtrans-65.6-38.7174.4-71.7-54.4-56.300112.4R57 A61 M64 F78 P79 L80 Y84 L85 D86 A190R57-M82 HydrophobicContact CG-CE 4.49Å; R57-M82 VanDerWaalsContact CZ-CE 3.43Å; R57-M82 VanDerWaalsContact NH2-CE 3.26Å; A61-M82 HydrophobicContact CB-CE 3.61Å; A61-M82 HydrophobicContact CB-SD 3.65Å; M64-M82 HydrophobicContact CE-SD 3.83Å; M64-M82 HydrophobicContact SD-SD 3.86Å; F78-M82 HydrophobicContact CD2-CG 4.16Å; F78-M82 HydrophobicContact CE1-CG 4.36Å; F78-M82 HydrophobicContact CE2-CG 3.59Å; F78-M82 HydrophobicContact CE2-SD 3.94Å; F78-M82 HydrophobicContact CZ-CG 3.72Å; F78-M82 HydrophobicContact CZ-SD 4.29Å; F78-M82 WeakPolarHBondContact O-CG 3.37Å; F78-M82 PolarHBondContact O-N 2.91Å; P79-M82 PolarHBondContact O-N 3.49Å; L80-M82 VanDerWaalsContact C-N 3.3Å; L80-M82 PolarHBondContact O-N 3.37Å; M82-Y84 VanDerWaalsContact C-N 3.34Å; M82-Y84 PolarHBondContact O-N 2.91Å; M82-L85 HydrophobicContact CE-CD2 4.22Å; M82-L85 PolarHBondContact O-N 3.19Å; M82-D86 PolarHBondContact O-N 3.16Å; M82-A190 HydrophobicContact CB-CB 4.3Å; M82-A190 HydrophobicContact CG-CB 4.09Å
83N97.6Very high97.3Very high25 Ų2525.3 Ų25.313%0.13413%0.134CC..Hα-helixtrans-58.6-45.8172.2-178.9-93.7000111.6Y38 P79 L80 D86 R87 S154Y38-N83 PolarHBondContact O-ND2 3.03Å; P79-N83 PolarHBondContact O-N 3.34Å; L80-N83 WeakPolarHBondContact O-CB 3.42Å; L80-N83 PolarHBondContact O-N 2.91Å; N83-D86 PolarHBondContact O-N 2.95Å; N83-R87 WeakPolarHBondContact O-CB 3.44Å; N83-R87 VanDerWaalsContact O-CG 3.31Å; N83-R87 WeakPolarHBondContact O-CG 3.43Å; N83-R87 PolarHBondContact O-N 3.43Å; N83-R87 WeakPolarHBondContact OD1-CD 3.41Å; N83-S154 PolarHBondContact OD1-OG 2.96Å
84Y98.5Very high97.4Very high0 Ų025.1 Ų25.10%013%0.132CC..Hα-helixtrans-62.7-43.5177.1-61.2-16.6000112L80 A81 M82 F88 L109 A110 L148 L152L80-Y84 HydrophobicContact CD1-CD1 4.45Å; L80-Y84 HydrophobicContact CD1-CE1 3.59Å; L80-Y84 HydrophobicContact CD1-CE2 4.38Å; L80-Y84 WeakPolarHBondContact CD1-OH 3.18Å; L80-Y84 HydrophobicContact CD2-CE2 4.41Å; L80-Y84 WeakPolarHBondContact CD2-OH 3.27Å; L80-Y84 HydrophobicContact CG-CE1 4.02Å; L80-Y84 HydrophobicContact CG-CE2 3.89Å; L80-Y84 WeakPolarHBondContact CG-OH 3.44Å; L80-Y84 PolarHBondContact O-N 3.13Å; A81-Y84 PolarHBondContact O-N 2.72Å; M82-Y84 VanDerWaalsContact C-N 3.34Å; M82-Y84 PolarHBondContact O-N 2.91Å; Y84-F88 VanDerWaalsContact O-CB 3.24Å; Y84-F88 WeakPolarHBondContact O-CB 3.47Å; Y84-F88 PolarHBondContact O-N 2.88Å; Y84-L109 HydrophobicContact CD2-CB 4Å; Y84-L109 HydrophobicContact CE2-CB 3.88Å; Y84-A110 HydrophobicContact CD2-CB 4.41Å; Y84-A110 HydrophobicContact CE2-CB 4.02Å; Y84-L148 HydrophobicContact CD1-CD1 3.99Å; Y84-L148 HydrophobicContact CG-CD1 4.06Å; Y84-L152 HydrophobicContact CD1-CD2 4.29Å; Y84-L152 HydrophobicContact CE1-CB 4.3Å; Y84-L152 HydrophobicContact CE1-CD2 3.88Å; Y84-L152 WeakPolarHBondContact CE1-O 3.25Å; Y84-L152 HydrophobicContact CE2-CD2 4.11Å; Y84-L152 WeakPolarHBondContact OH-CB 3.19Å; Y84-L152 PolarHBondContact OH-O 2.94Å
85L98.4Very high97.4Very high0 Ų026.2 Ų26.20%014%0.14CC..Hα-helixtrans-59.7-51.4178.3-177.2148.6000110.9R57 V60 M64 A81 M82 F88 L89 L102 C106R57-L85 HydrophobicContact CG-CD2 4.16Å; V60-L85 HydrophobicContact CG1-CD1 4.19Å; M64-L85 HydrophobicContact CE-CD1 4.42Å; M64-L85 HydrophobicContact SD-CD1 3.78Å; A81-L85 WeakPolarHBondContact O-CB 3.29Å; A81-L85 PolarHBondContact O-N 3.23Å; M82-L85 HydrophobicContact CE-CD2 4.22Å; M82-L85 PolarHBondContact O-N 3.19Å; L85-F88 PolarHBondContact O-N 3.24Å; L85-L89 HydrophobicContact CD2-CD1 3.55Å; L85-L89 HydrophobicContact CD2-CG 4.37Å; L85-L89 HydrophobicContact CG-CD1 4.3Å; L85-L89 VanDerWaalsContact O-CG 3.3Å; L85-L89 WeakPolarHBondContact O-CG 3.48Å; L85-L89 PolarHBondContact O-N 3.08Å; L85-L102 HydrophobicContact CG-CD2 4.44Å; L85-C106 PolarHBondContact N-SG 3.45Å; L85-C106 VanDerWaalsContact N-SG 3.44Å
86D97.9Very high97.5Very high7 Ų727.3 Ų27.34%0.03714%0.143CC..Hα-helixtrans-70-37.2-176.6-67-31000112.3P40 Y44 R57 M82 N83 L89 S90P40-D86 HydrophobicContact CB-CB 3.65Å; P40-D86 HydrophobicContact CG-CB 3.79Å; Y44-D86 HydrophobicContact CE1-CB 4.18Å; Y44-D86 PolarHBondContact OH-OD1 2.91Å; R57-D86 IonicContact CZ-OD1 3.47Å; R57-D86 IonicContact CZ-OD2 2.69Å; R57-D86 IonicContact NE-OD1 3.88Å; R57-D86 PolarHBondContact NE-OD1 2.85Å; R57-D86 IonicContact NE-OD2 3.5Å; R57-D86 IonicContact NH2-OD1 2.8Å; R57-D86 PolarHBondContact NH2-OD1 2.78Å; R57-D86 IonicContact NH2-OD2 3.56Å; R57-D86 PolarHBondContact NH2-OD2 3.45Å; M82-D86 PolarHBondContact O-N 3.16Å; N83-D86 PolarHBondContact O-N 2.95Å; D86-L89 PolarHBondContact O-N 3.41Å; D86-S90 WeakPolarHBondContact O-CB 3.27Å; D86-S90 PolarHBondContact O-N 3.19Å; D86-S90 PolarHBondContact O-OG 3.29Å
87R97.5Very high97.5Very high27 Ų2730.5 Ų30.510%0.10217%0.167CC..Hα-helixtrans-65.8-39.6174.1-74.6173.269.6-154.44.1111.7Y38 P40 N83 S90 L148 D151Y38-R87 WeakPolarHBondContact O-CD 3.44Å; P40-R87 HydrophobicContact CB-CG 4.38Å; N83-R87 WeakPolarHBondContact O-CB 3.44Å; N83-R87 VanDerWaalsContact O-CG 3.31Å; N83-R87 WeakPolarHBondContact O-CG 3.43Å; N83-R87 PolarHBondContact O-N 3.43Å; N83-R87 WeakPolarHBondContact OD1-CD 3.41Å; R87-S90 WeakPolarHBondContact O-CB 3.26Å; R87-S90 PolarHBondContact O-N 3.46Å; R87-L148 HydrophobicContact CB-CD2 3.57Å; R87-D151 PolarHBondContact NH1-O 3.01Å; R87-D151 PolarHBondContact NH2-O 3.23Å; R87-D151 IonicContact NH2-OD2 2.78Å; R87-D151 PolarHBondContact NH2-OD2 3.01Å
88F98.3Very high97.4Very high2 Ų235.5 Ų35.51%0.00919%0.186CC..Hα-helixtrans-63.7-48.3174.8-174.3-84.7000111.1Y84 L85 S90 V91 E92 L102 M140 L143 T144 K147Y84-F88 VanDerWaalsContact O-CB 3.24Å; Y84-F88 WeakPolarHBondContact O-CB 3.47Å; Y84-F88 PolarHBondContact O-N 2.88Å; L85-F88 PolarHBondContact O-N 3.24Å; F88-S90 PolarHBondContact O-N 3.25Å; F88-S90 VanDerWaalsContact O-N 3.17Å; F88-V91 WeakPolarHBondContact O-CG2 3.36Å; F88-V91 PolarHBondContact O-N 2.92Å; F88-E92 HydrophobicContact CD1-CB 4.1Å; F88-E92 HydrophobicContact CE1-CB 3.65Å; F88-E92 HydrophobicContact CE1-CG 3.8Å; F88-E92 HydrophobicContact CE2-CB 4.41Å; F88-E92 HydrophobicContact CZ-CB 3.83Å; F88-E92 HydrophobicContact CZ-CG 3.74Å; F88-E92 PolarHBondContact O-N 3.19Å; F88-L102 HydrophobicContact CB-CD1 4.18Å; F88-L102 HydrophobicContact CB-CD2 4.48Å; F88-L102 HydrophobicContact CD1-CD1 3.65Å; F88-L102 HydrophobicContact CD1-CD2 3.48Å; F88-L102 VanDerWaalsContact CD1-CD2 3.48Å; F88-L102 HydrophobicContact CD1-CG 4.24Å; F88-L102 HydrophobicContact CD2-CD1 4.19Å; F88-L102 HydrophobicContact CE1-CD1 4.02Å; F88-L102 HydrophobicContact CE1-CD2 4.02Å; F88-L102 HydrophobicContact CG-CD1 3.73Å; F88-L102 HydrophobicContact CG-CD2 4.22Å; F88-L102 HydrophobicContact CZ-CD1 4.44Å; F88-M140 HydrophobicContact CE1-CE 3.86Å; F88-M140 HydrophobicContact CE2-CE 4.18Å; F88-M140 HydrophobicContact CZ-CE 3.56Å; F88-L143 HydrophobicContact CE2-CG 4.14Å; F88-L143 HydrophobicContact CZ-CD2 4.15Å; F88-L143 HydrophobicContact CZ-CG 4.18Å; F88-T144 HydrophobicContact CD2-CG2 4.06Å; F88-K147 HydrophobicContact CD2-CB 3.87Å; F88-K147 HydrophobicContact CD2-CG 4.29Å; F88-K147 HydrophobicContact CE2-CB 3.85Å; F88-K147 HydrophobicContact CE2-CG 3.76Å
89L98Very high97.4Very high0 Ų035.4 Ų35.40%019%0.185CC..Hα-helixtrans-64.3-19176.4-66.7179.1000113Y44 Q49 L85 D86 V91 T94 L99 L102Y44-L89 HydrophobicContact CD2-CB 3.78Å; Y44-L89 HydrophobicContact CE2-CB 3.68Å; Y44-L89 HydrophobicContact CE2-CD1 3.83Å; Y44-L89 HydrophobicContact CE2-CG 4.41Å; Y44-L89 HydrophobicContact CG-CB 4.34Å; Q49-L89 PolarHBondContact NE2-O 3.38Å; L85-L89 HydrophobicContact CD2-CD1 3.55Å; L85-L89 HydrophobicContact CD2-CG 4.37Å; L85-L89 HydrophobicContact CG-CD1 4.3Å; L85-L89 VanDerWaalsContact O-CG 3.3Å; L85-L89 WeakPolarHBondContact O-CG 3.48Å; L85-L89 PolarHBondContact O-N 3.08Å; D86-L89 PolarHBondContact O-N 3.41Å; L89-V91 VanDerWaalsContact C-N 3.3Å; L89-T94 HydrophobicContact CD2-CG2 4.42Å; L89-L99 HydrophobicContact CD1-CD1 4.24Å; L89-L99 HydrophobicContact CD2-CD1 4.32Å; L89-L102 HydrophobicContact CD2-CD2 3.83Å; L89-L102 HydrophobicContact CG-CD2 4.11Å
90S97.3Very high97.4Very high19 Ų1937.8 Ų37.813%0.13320%0.195CC..THydrogen-bonded Turntrans-75.1-15.9174-62.20000114.1P40 S41 D86 R87 F88P40-S90 WeakPolarHBondContact CB-OG 3.28Å; S41-S90 PolarHBondContact N-OG 2.91Å; D86-S90 WeakPolarHBondContact O-CB 3.27Å; D86-S90 PolarHBondContact O-N 3.19Å; D86-S90 PolarHBondContact O-OG 3.29Å; R87-S90 WeakPolarHBondContact O-CB 3.26Å; R87-S90 PolarHBondContact O-N 3.46Å; F88-S90 PolarHBondContact O-N 3.25Å; F88-S90 VanDerWaalsContact O-N 3.17Å
91V97.3Very high97.5Very high81 Ų8138.6 Ų38.649%0.49120%0.199SC..THydrogen-bonded Turntrans-127.6-19.8-175.3-58.90000114.1F88 L89 K147F88-V91 WeakPolarHBondContact O-CG2 3.36Å; F88-V91 PolarHBondContact O-N 2.92Å; L89-V91 VanDerWaalsContact C-N 3.3Å; V91-K147 HydrophobicContact CG2-CB 4.27Å
92E97.6Very high97.5Very high49 Ų4938.6 Ų38.623%0.22920%0.199CC..SBendtrans-125.7117-175.8-170.669.1178.900112.1Q49 F88 T94 K147Q49-E92 PolarHBondContact NE2-O 3.18Å; F88-E92 HydrophobicContact CD1-CB 4.1Å; F88-E92 HydrophobicContact CE1-CB 3.65Å; F88-E92 HydrophobicContact CE1-CG 3.8Å; F88-E92 HydrophobicContact CE2-CB 4.41Å; F88-E92 HydrophobicContact CZ-CB 3.83Å; F88-E92 HydrophobicContact CZ-CG 3.74Å; F88-E92 PolarHBondContact O-N 3.19Å; E92-T94 PolarHBondContact O-N 3.36Å; E92-T94 PolarHBondContact O-OG1 2.72Å; E92-K147 HydrophobicContact CB-CD 4.49Å; E92-K147 IonicContact OE1-NZ 3.81Å; E92-K147 WeakPolarHBondContact OE2-CE 3.4Å; E92-K147 IonicContact OE2-NZ 3.24Å; E92-K147 PolarHBondContact OE2-NZ 3.29Å
93P97.3Very high97.5Very high70 Ų7038.4 Ų38.446%0.45520%0.198SC..  trans-60.1122.9170.3-21.533.1000110.7V48V48-P93 HydrophobicContact CG1-CG 4.13Å
94T97Very high97.6Very high10 Ų1037.2 Ų37.26%0.06119%0.192CC..  trans-118.5138.8-174.2-60.40000110.8I52 L89 E92 R98I52-T94 WeakPolarHBondContact CD1-O 3.31Å; I52-T94 VanDerWaalsContact CG1-O 3.3Å; I52-T94 WeakPolarHBondContact CG1-O 3.35Å; L89-T94 HydrophobicContact CD2-CG2 4.42Å; E92-T94 PolarHBondContact O-N 3.36Å; E92-T94 PolarHBondContact O-OG1 2.72Å; T94-R98 HydrophobicContact CG2-CB 4.18Å
95N96.3Very high97.6Very high84 Ų8437.2 Ų37.245%0.44919%0.192SC..  trans-79146.9174.4-65.5-15.4000110.3E51 T97 R98 L99E51-N95 WeakPolarHBondContact OE2-CA 3.49Å; N95-T97 PolarHBondContact O-N 2.85Å; N95-T97 VanDerWaalsContact O-N 3.11Å; N95-R98 PolarHBondContact O-N 2.94Å; N95-L99 PolarHBondContact O-N 2.92Å
96K95.3Very high97.6Very high125 Ų12537.2 Ų37.254%0.54319%0.192SC..G310 helixtrans-56.6-32.6-178.567.9-173.9177.4178.30113.6E51 I52 M56 R98 L99E51-K96 HydrophobicContact CB-CB 4.46Å; E51-K96 PolarHBondContact OE2-N 3.14Å; I52-K96 HydrophobicContact CD1-CB 4.22Å; M56-K96 HydrophobicContact CE-CB 4.35Å; M56-K96 HydrophobicContact CE-CD 4.36Å; M56-K96 HydrophobicContact SD-CB 3.98Å; K96-R98 VanDerWaalsContact C-N 3.26Å; K96-R98 PolarHBondContact O-N 3.15Å; K96-L99 PolarHBondContact O-N 3.38Å
97T94.9Very high97.6Very high116 Ų11636.9 Ų36.971%0.71219%0.19SC*.G310 helixtrans-70.1-21.3178.855.80000113.4N95N95-T97 PolarHBondContact O-N 2.85Å; N95-T97 VanDerWaalsContact O-N 3.11Å
98R96.6Very high97.7Very high105 Ų10536.3 Ų36.340%0.39619%0.188SC..G310 helixtrans-96.7-3.6179.6-64-17568.7-168.20.6113T94 N95 K96 L101 L102 M140T94-R98 HydrophobicContact CG2-CB 4.18Å; N95-R98 PolarHBondContact O-N 2.94Å; K96-R98 VanDerWaalsContact C-N 3.26Å; K96-R98 PolarHBondContact O-N 3.15Å; R98-L101 WeakPolarHBondContact O-CB 3.38Å; R98-L101 PolarHBondContact O-N 3.49Å; R98-L102 PolarHBondContact O-N 3.08Å; R98-M140 PolarHBondContact NH2-SD 3.17Å
99L97.8Very high97.7Very high4 Ų436.4 Ų36.42%0.02119%0.189CC..Hα-helixtrans-66.4-40.4-175-171.867.1000112.3I52 M56 V60 L89 N95 K96 L102 G103I52-L99 HydrophobicContact CD1-CB 4.22Å; I52-L99 HydrophobicContact CD1-CD1 4.31Å; I52-L99 HydrophobicContact CD1-CD2 4.33Å; I52-L99 HydrophobicContact CG2-CD1 4.26Å; I52-L99 HydrophobicContact CG2-CD2 4.09Å; M56-L99 HydrophobicContact CB-CD2 3.8Å; V60-L99 HydrophobicContact CB-CD2 4.32Å; V60-L99 HydrophobicContact CB-CG 4.37Å; V60-L99 HydrophobicContact CG2-CB 4.49Å; V60-L99 HydrophobicContact CG2-CD2 3.7Å; V60-L99 HydrophobicContact CG2-CG 3.82Å; L89-L99 HydrophobicContact CD1-CD1 4.24Å; L89-L99 HydrophobicContact CD2-CD1 4.32Å; N95-L99 PolarHBondContact O-N 2.92Å; K96-L99 PolarHBondContact O-N 3.38Å; L99-L102 HydrophobicContact CD1-CD2 4.47Å; L99-L102 PolarHBondContact O-N 2.87Å; L99-G103 PolarHBondContact O-N 3.38Å
100Q98.3Very high97.7Very high64 Ų6436.4 Ų36.430%0.29919%0.189SC..Hα-helixtrans-67-39.1176.1-168177.226.300111.7W63 L102 G103 A104 T128W63-Q100 HydrophobicContact CE3-CG 4.32Å; W63-Q100 HydrophobicContact CH2-CG 4.11Å; W63-Q100 HydrophobicContact CZ2-CG 4.35Å; W63-Q100 HydrophobicContact CZ3-CG 4.08Å; Q100-L102 PolarHBondContact O-N 3.19Å; Q100-G103 PolarHBondContact O-N 2.99Å; Q100-A104 WeakPolarHBondContact O-CB 3.34Å; Q100-A104 PolarHBondContact O-N 2.88Å; Q100-T128 HydrophobicContact CG-CG2 4.09Å
101L98.6Very high97.8Very high18 Ų1835.5 Ų35.59%0.09418%0.183CC..Hα-helixtrans-60.1-44.4172.5176.560.7000111.7R98 A104 T105 I132 D136 L137 M140R98-L101 WeakPolarHBondContact O-CB 3.38Å; R98-L101 PolarHBondContact O-N 3.49Å; L101-A104 PolarHBondContact O-N 3.42Å; L101-T105 WeakPolarHBondContact O-CB 3.29Å; L101-T105 PolarHBondContact O-N 3.47Å; L101-T105 PolarHBondContact O-OG1 2.88Å; L101-I132 HydrophobicContact CB-CG2 3.95Å; L101-I132 HydrophobicContact CD1-CB 4.11Å; L101-I132 HydrophobicContact CD1-CD1 3.81Å; L101-I132 HydrophobicContact CD1-CG2 3.99Å; L101-I132 HydrophobicContact CG-CG2 4.48Å; L101-D136 HydrophobicContact CD1-CB 4.28Å; L101-D136 HydrophobicContact CD2-CB 4.27Å; L101-L137 HydrophobicContact CD1-CB 4.35Å; L101-M140 HydrophobicContact CD1-CB 4.27Å; L101-M140 HydrophobicContact CD2-CB 4.19Å; L101-M140 HydrophobicContact CD2-CG 4.37Å; L101-M140 HydrophobicContact CD2-SD 4.46Å; L101-M140 HydrophobicContact CG-CB 4.03Å; L101-M140 HydrophobicContact CG-CG 4.02Å
102L98.7Very high97.8Very high0 Ų036.1 Ų36.10%018%0.179CC..Hα-helixtrans-60.1-47.717417661000110.9L85 F88 L89 R98 L99 Q100 A104 T105 C106 M140L85-L102 HydrophobicContact CG-CD2 4.44Å; F88-L102 HydrophobicContact CB-CD1 4.18Å; F88-L102 HydrophobicContact CB-CD2 4.48Å; F88-L102 HydrophobicContact CD1-CD1 3.65Å; F88-L102 HydrophobicContact CD1-CD2 3.48Å; F88-L102 VanDerWaalsContact CD1-CD2 3.48Å; F88-L102 HydrophobicContact CD1-CG 4.24Å; F88-L102 HydrophobicContact CD2-CD1 4.19Å; F88-L102 HydrophobicContact CE1-CD1 4.02Å; F88-L102 HydrophobicContact CE1-CD2 4.02Å; F88-L102 HydrophobicContact CG-CD1 3.73Å; F88-L102 HydrophobicContact CG-CD2 4.22Å; F88-L102 HydrophobicContact CZ-CD1 4.44Å; L89-L102 HydrophobicContact CD2-CD2 3.83Å; L89-L102 HydrophobicContact CG-CD2 4.11Å; R98-L102 PolarHBondContact O-N 3.08Å; L99-L102 HydrophobicContact CD1-CD2 4.47Å; L99-L102 PolarHBondContact O-N 2.87Å; Q100-L102 PolarHBondContact O-N 3.19Å; L102-A104 PolarHBondContact O-N 3.34Å; L102-T105 WeakPolarHBondContact O-CB 3.43Å; L102-T105 PolarHBondContact O-N 3.06Å; L102-C106 PolarHBondContact O-N 3.4Å; L102-C106 PolarHBondContact O-SG 3.14Å; L102-M140 HydrophobicContact CB-CE 3.92Å; L102-M140 HydrophobicContact CD1-CE 3.54Å; L102-M140 HydrophobicContact CG-CE 4.24Å
103G98.6Very high97.8Very high0 Ų038 Ų380%019%0.189CC..Hα-helixtrans-57.9-47.3177.200000113.1L99 Q100 T105 C106 M107L99-G103 PolarHBondContact O-N 3.38Å; Q100-G103 PolarHBondContact O-N 2.99Å; G103-T105 VanDerWaalsContact C-N 3.31Å; G103-T105 PolarHBondContact O-N 3.42Å; G103-C106 PolarHBondContact O-N 2.91Å; G103-M107 PolarHBondContact O-N 3.43Å
104A98.7Very high97.6Very high0 Ų037.8 Ų37.80%018%0.181CC..Hα-helixtrans-57.7-44.2174.400000111.7W63 Q100 L101 L102 M107 F108 I132 L137W63-A104 HydrophobicContact CH2-CB 3.94Å; Q100-A104 WeakPolarHBondContact O-CB 3.34Å; Q100-A104 PolarHBondContact O-N 2.88Å; L101-A104 PolarHBondContact O-N 3.42Å; L102-A104 PolarHBondContact O-N 3.34Å; A104-M107 PolarHBondContact O-N 2.89Å; A104-F108 PolarHBondContact O-N 3.23Å; A104-I132 HydrophobicContact CB-CD1 3.73Å; A104-L137 HydrophobicContact CB-CD1 4.16Å
105T98.8Very high97.4Very high0 Ų039 Ų390%019%0.186CC..Hα-helixtrans-65.2-40.4178.9-55.90000111.9L101 L102 G103 F108 L109 M140 E141L101-T105 WeakPolarHBondContact O-CB 3.29Å; L101-T105 PolarHBondContact O-N 3.47Å; L101-T105 PolarHBondContact O-OG1 2.88Å; L102-T105 WeakPolarHBondContact O-CB 3.43Å; L102-T105 PolarHBondContact O-N 3.06Å; G103-T105 VanDerWaalsContact C-N 3.31Å; G103-T105 PolarHBondContact O-N 3.42Å; T105-F108 WeakPolarHBondContact O-CB 3.46Å; T105-F108 PolarHBondContact O-N 2.92Å; T105-L109 HydrophobicContact CG2-CD1 4.41Å; T105-L109 PolarHBondContact O-N 2.95Å; T105-M140 HydrophobicContact CG2-CB 4.19Å; T105-M140 HydrophobicContact CG2-CG 4.04Å; T105-M140 WeakPolarHBondContact OG1-CB 3.34Å; T105-M140 VanDerWaalsContact OG1-CG 3.28Å; T105-M140 WeakPolarHBondContact OG1-CG 3.46Å; T105-E141 VanDerWaalsContact CG2-CA 3.41Å; T105-E141 HydrophobicContact CG2-CB 4.06Å
106C98.8Very high97.2Very high0 Ų039.4 Ų39.40%019%0.191CC..Hα-helixtrans-64.2-40.4176.5-69.50000111.7M64 A81 L85 L102 G103 L109 A110M64-C106 HydrophobicContact CE-CB 4.28Å; A81-C106 HydrophobicContact CB-CB 4.1Å; A81-C106 WeakPolarHBondContact O-CB 3.47Å; L85-C106 PolarHBondContact N-SG 3.45Å; L85-C106 VanDerWaalsContact N-SG 3.44Å; L102-C106 PolarHBondContact O-N 3.4Å; L102-C106 PolarHBondContact O-SG 3.14Å; G103-C106 PolarHBondContact O-N 2.91Å; C106-L109 PolarHBondContact O-N 2.7Å; C106-A110 VanDerWaalsContact O-CB 3.29Å; C106-A110 WeakPolarHBondContact O-CB 3.48Å; C106-A110 PolarHBondContact O-N 2.87Å
107M98.7Very high97.1Very high0 Ų038.8 Ų38.80%020%0.198CC..Hα-helixtrans-63.7-41.7172.6-69.5-170.8-69.100111.8W63 M64 V67 A81 G103 A104 L109 A110 S111 L119 L124W63-M107 HydrophobicContact CE3-CE 4.24Å; W63-M107 HydrophobicContact CH2-CE 3.36Å; W63-M107 HydrophobicContact CZ2-CE 4.07Å; W63-M107 HydrophobicContact CZ3-CE 3.48Å; W63-M107 VanDerWaalsContact CZ3-CE 3.48Å; M64-M107 VanDerWaalsContact CA-SD 3.6Å; M64-M107 HydrophobicContact CB-CE 4.28Å; M64-M107 HydrophobicContact CB-CG 4.3Å; M64-M107 HydrophobicContact CB-SD 3.68Å; M64-M107 HydrophobicContact CE-CG 3.85Å; M64-M107 HydrophobicContact CG-CE 3.83Å; M64-M107 HydrophobicContact CG-CG 4.11Å; M64-M107 HydrophobicContact CG-SD 3.79Å; M64-M107 VanDerWaalsContact O-SD 3.42Å; V67-M107 HydrophobicContact CB-CE 4.19Å; V67-M107 HydrophobicContact CB-SD 4.1Å; V67-M107 HydrophobicContact CG1-CE 4.06Å; V67-M107 HydrophobicContact CG1-SD 4.08Å; V67-M107 HydrophobicContact CG2-CE 4.45Å; A81-M107 HydrophobicContact CB-CG 4.04Å; G103-M107 PolarHBondContact O-N 3.43Å; A104-M107 PolarHBondContact O-N 2.89Å; M107-L109 VanDerWaalsContact C-N 3.35Å; M107-L109 PolarHBondContact O-N 2.92Å; M107-A110 PolarHBondContact O-N 2.77Å; M107-S111 WeakPolarHBondContact O-CB 3.25Å; M107-S111 PolarHBondContact O-N 3.33Å; M107-S111 PolarHBondContact O-OG 3.45Å; M107-L119 HydrophobicContact CB-CD1 4.44Å; M107-L124 HydrophobicContact CB-CD2 4.27Å; M107-L124 HydrophobicContact CE-CD2 3.86Å
108F98.7Very high97.1Very high15 Ų1535.5 Ų35.57%0.06618%0.178CC..Hα-helixtrans-60.8-41.6176.6-171.6-126.9000113A104 T105 S111 K112 L119 A121 L124 L137 L138 E141A104-F108 PolarHBondContact O-N 3.23Å; T105-F108 WeakPolarHBondContact O-CB 3.46Å; T105-F108 PolarHBondContact O-N 2.92Å; F108-S111 PolarHBondContact O-OG 3.42Å; F108-K112 VanDerWaalsContact CZ-NZ 3.29Å; F108-K112 WeakPolarHBondContact O-CG 3.49Å; F108-K112 PolarHBondContact O-N 3.25Å; F108-L119 WeakPolarHBondContact CD2-O 3.44Å; F108-L119 WeakPolarHBondContact CE2-O 3.4Å; F108-A121 HydrophobicContact CE2-CB 4.36Å; F108-A121 HydrophobicContact CZ-CB 4.29Å; F108-L124 HydrophobicContact CB-CD1 3.52Å; F108-L124 HydrophobicContact CD2-CD1 3.88Å; F108-L124 HydrophobicContact CG-CD1 4.08Å; F108-L137 HydrophobicContact CB-CD2 4.07Å; F108-L137 HydrophobicContact CD1-CD2 3.38Å; F108-L137 HydrophobicContact CD2-CD2 4.39Å; F108-L137 HydrophobicContact CE1-CD2 3.75Å; F108-L137 HydrophobicContact CG-CD2 3.72Å; F108-L137 HydrophobicContact CZ-CD2 4.42Å; F108-L138 HydrophobicContact CE1-CD2 3.98Å; F108-L138 HydrophobicContact CZ-CD2 4.34Å; F108-E141 HydrophobicContact CD1-CG 4.45Å; F108-E141 WeakPolarHBondContact CE1-OE2 3.38Å
109L98.7Very high97.2Very high5 Ų531.1 Ų31.13%0.02616%0.163CC..Hα-helixtrans-70.1-43.8176.2-75.5173.7000111.3Y84 T105 C106 M107 K112 M113 E141 T144 L145 L152Y84-L109 HydrophobicContact CD2-CB 4Å; Y84-L109 HydrophobicContact CE2-CB 3.88Å; T105-L109 HydrophobicContact CG2-CD1 4.41Å; T105-L109 PolarHBondContact O-N 2.95Å; C106-L109 PolarHBondContact O-N 2.7Å; M107-L109 VanDerWaalsContact C-N 3.35Å; M107-L109 PolarHBondContact O-N 2.92Å; L109-K112 PolarHBondContact O-N 2.89Å; L109-M113 WeakPolarHBondContact O-CG 3.41Å; L109-M113 PolarHBondContact O-N 3.37Å; L109-E141 HydrophobicContact CD2-CG 3.7Å; L109-E141 WeakPolarHBondContact CD2-OE1 3.43Å; L109-E141 HydrophobicContact CG-CG 4.21Å; L109-T144 HydrophobicContact CD1-CG2 3.66Å; L109-L145 HydrophobicContact CD1-CD2 4.42Å; L109-L145 HydrophobicContact CD1-CG 4.36Å; L109-L145 HydrophobicContact CD2-CD1 4.27Å; L109-L145 HydrophobicContact CD2-CD2 3.81Å; L109-L145 HydrophobicContact CD2-CG 3.98Å; L109-L152 HydrophobicContact CD2-CD1 4.28Å
110A98.4Very high97.2Very high0 Ų034.6 Ų34.60%018%0.184CC..Hα-helixtrans-65.5-39.6-179.500000112.2V77 L80 A81 Y84 C106 M107 K112 M113 K114V77-A110 HydrophobicContact CG1-CB 4.04Å; V77-A110 WeakPolarHBondContact O-CB 3.41Å; L80-A110 HydrophobicContact CB-CB 4.05Å; L80-A110 HydrophobicContact CD2-CB 4.04Å; L80-A110 HydrophobicContact CG-CB 3.97Å; A81-A110 HydrophobicContact CB-CB 3.86Å; Y84-A110 HydrophobicContact CD2-CB 4.41Å; Y84-A110 HydrophobicContact CE2-CB 4.02Å; C106-A110 VanDerWaalsContact O-CB 3.29Å; C106-A110 WeakPolarHBondContact O-CB 3.48Å; C106-A110 PolarHBondContact O-N 2.87Å; M107-A110 PolarHBondContact O-N 2.77Å; A110-K112 VanDerWaalsContact C-N 3.34Å; A110-K112 PolarHBondContact O-N 3.24Å; A110-M113 PolarHBondContact O-N 3.33Å; A110-M113 VanDerWaalsContact O-N 3.09Å; A110-K114 PolarHBondContact O-N 3.03Å
111S98.1Very high97.1Very high0 Ų032.2 Ų32.20%018%0.175CC..Hα-helixtrans-62-41.7175.6640000111.7M107 F108 M113 K114 E115 L119M107-S111 WeakPolarHBondContact O-CB 3.25Å; M107-S111 PolarHBondContact O-N 3.33Å; M107-S111 PolarHBondContact O-OG 3.45Å; F108-S111 PolarHBondContact O-OG 3.42Å; S111-M113 PolarHBondContact O-N 3.47Å; S111-K114 PolarHBondContact O-N 3.09Å; S111-E115 WeakPolarHBondContact CB-OE2 3.47Å; S111-E115 WeakPolarHBondContact O-CA 3.37Å; S111-E115 VanDerWaalsContact O-CB 3.28Å; S111-E115 WeakPolarHBondContact O-CB 3.33Å; S111-E115 PolarHBondContact O-N 3.31Å; S111-L119 PolarHBondContact OG-N 3.09Å
112K97.7Very high97.1Very high93 Ų9338 Ų3840%0.40420%0.202SC..Hα-helixtrans-61-28.9174.2-72.8177.4-177-173.80113.5F108 L109 A110 P118 E141F108-K112 VanDerWaalsContact CZ-NZ 3.29Å; F108-K112 WeakPolarHBondContact O-CG 3.49Å; F108-K112 PolarHBondContact O-N 3.25Å; L109-K112 PolarHBondContact O-N 2.89Å; A110-K112 VanDerWaalsContact C-N 3.34Å; A110-K112 PolarHBondContact O-N 3.24Å; K112-P118 HydrophobicContact CB-CG 4.47Å; K112-P118 HydrophobicContact CG-CB 3.94Å; K112-P118 HydrophobicContact CG-CG 4.12Å; K112-E141 IonicContact NZ-OE1 3.56Å; K112-E141 PolarHBondContact NZ-OE1 2.92Å; K112-E141 IonicContact NZ-OE2 2.64Å
113M97.2Very high97Very high88 Ų8842.3 Ų42.343%0.43322%0.221SC..Hα-helixtrans-85.9-28.3-178.6-68.6-59.5-60.300113.4L80 L109 A110 S111 L152L80-M113 HydrophobicContact CD2-CB 3.99Å; L109-M113 WeakPolarHBondContact O-CG 3.41Å; L109-M113 PolarHBondContact O-N 3.37Å; A110-M113 PolarHBondContact O-N 3.33Å; A110-M113 VanDerWaalsContact O-N 3.09Å; S111-M113 PolarHBondContact O-N 3.47Å; M113-L152 HydrophobicContact CE-CB 4.26Å; M113-L152 HydrophobicContact CG-CB 4.29Å; M113-L152 HydrophobicContact CG-CD1 4.27Å; M113-L152 HydrophobicContact SD-CB 4.17Å; M113-L152 HydrophobicContact SD-CD1 4.12Å
114K94.9Very high97Very high67 Ų6742.3 Ų42.329%0.29122%0.221SC..Hα-helixtrans-120.1-20.8-169.1-67.4-67.1-171.3166.90114.6E76 V77 L80 A110 S111 D159E76-K114 HydrophobicContact CB-CD 3.92Å; E76-K114 HydrophobicContact CB-CG 4.01Å; V77-K114 HydrophobicContact CG2-CB 3.92Å; L80-K114 HydrophobicContact CD2-CD 4.33Å; L80-K114 HydrophobicContact CD2-CG 3.55Å; A110-K114 PolarHBondContact O-N 3.03Å; S111-K114 PolarHBondContact O-N 3.09Å; K114-D159 IonicContact NZ-OD1 3.88Å
115E92.8Very high96.9Very high35 Ų3542.5 Ų42.516%0.16422%0.222CC..  trans-101.2148.8-177.5-57-165.192.100112.5C73 E74 V77 S111C73-E115 WeakPolarHBondContact CA-OE1 3.06Å; E74-E115 HydrophobicContact CG-CG 4.38Å; V77-E115 HydrophobicContact CG2-CG 3.64Å; S111-E115 WeakPolarHBondContact CB-OE2 3.47Å; S111-E115 WeakPolarHBondContact O-CA 3.37Å; S111-E115 VanDerWaalsContact O-CB 3.28Å; S111-E115 WeakPolarHBondContact O-CB 3.33Å; S111-E115 PolarHBondContact O-N 3.31Å
116T91Very high96.9Very high92 Ų9247.1 Ų47.156%0.56425%0.246SC*.SBendtrans-71.6-36.8170.9-56.20000111.4I13I13-T116 HydrophobicContact CG2-CG2 4.11Å; I13-T116 WeakPolarHBondContact CG2-OG1 3.31Å
117V92.8Very high96.8Very high112 Ų11249.9 Ų49.968%0.67926%0.256SS*.SBendtrans-122.696175.2-1770000107.4
118P96.3Very high96.7Very high47 Ų4750 Ų5031%0.30526%0.257SS..PPolyproline II helixtrans-66.3152.4-176-23.735.6000113.1K112 T120K112-P118 HydrophobicContact CB-CG 4.47Å; K112-P118 HydrophobicContact CG-CB 3.94Å; K112-P118 HydrophobicContact CG-CG 4.12Å; P118-T120 PolarHBondContact O-N 3.45Å
119L96.8Very high96.5Very high14 Ų1456.5 Ų56.57%0.07329%0.293CS..PPolyproline II helixtrans-49.3134.5166.1-60.3178.7000111.6Q71 M107 F108 S111 L124Q71-L119 HydrophobicContact CB-CD2 3.73Å; Q71-L119 HydrophobicContact CG-CD2 3.75Å; M107-L119 HydrophobicContact CB-CD1 4.44Å; F108-L119 WeakPolarHBondContact CD2-O 3.44Å; F108-L119 WeakPolarHBondContact CE2-O 3.4Å; S111-L119 PolarHBondContact OG-N 3.09Å; L119-L124 HydrophobicContact CB-CD1 4.24Å; L119-L124 HydrophobicContact CB-CG 4.29Å; L119-L124 HydrophobicContact CD1-CD2 4Å; L119-L124 HydrophobicContact CD1-CG 4.49Å
120T97.8Very high96.3Very high76 Ų7661.5 Ų61.547%0.46632%0.32SS..PPolyproline II helixtrans-84.3151.5176.970.60000111.4P118 E122 K123 L124P118-T120 PolarHBondContact O-N 3.45Å; T120-E122 VanDerWaalsContact C-N 3.26Å; T120-E122 PolarHBondContact O-N 3.36Å; T120-K123 PolarHBondContact O-N 3.48Å; T120-K123 VanDerWaalsContact OG1-CB 3.3Å; T120-K123 WeakPolarHBondContact OG1-CB 3.43Å; T120-K123 PolarHBondContact OG1-N 2.89Å; T120-L124 PolarHBondContact O-N 3.08Å
121A97.8Very high96.1Very high14 Ų1465.3 Ų65.312%0.11635%0.346CS..Hα-helixtrans-58.7-39.5176.200000111.9F108 L124 C125 P134 L137F108-A121 HydrophobicContact CE2-CB 4.36Å; F108-A121 HydrophobicContact CZ-CB 4.29Å; A121-L124 PolarHBondContact O-N 3.21Å; A121-C125 PolarHBondContact O-N 2.95Å; A121-C125 PolarHBondContact O-SG 3.38Å; A121-P134 HydrophobicContact CB-CB 4.3Å; A121-L137 HydrophobicContact CB-CD2 4.08Å
122E97.6Very high96Very high141 Ų14166 Ų6666%0.65935%0.35SS*.Hα-helixtrans-61.2-46.7176.2-66.5177.6177.900111.8T120 L124 C125 I126 P134T120-E122 VanDerWaalsContact C-N 3.26Å; T120-E122 PolarHBondContact O-N 3.36Å; E122-L124 VanDerWaalsContact C-N 3.33Å; E122-L124 PolarHBondContact O-N 2.93Å; E122-C125 WeakPolarHBondContact O-CB 3.28Å; E122-C125 PolarHBondContact O-N 3.33Å; E122-C125 VanDerWaalsContact O-N 3.17Å; E122-I126 WeakPolarHBondContact O-CG1 3.42Å; E122-I126 PolarHBondContact O-N 2.91Å; E122-P134 HydrophobicContact CG-CG 4.36Å
123K96.8Very high96Very high89 Ų8970 Ų7039%0.38736%0.362SS..Hα-helixtrans-60.5-44.5178.3-174.776.686.31760111.2Q71 T120 C125 I126 Y127Q71-K123 VanDerWaalsContact OE1-CE 3.23Å; T120-K123 PolarHBondContact O-N 3.48Å; T120-K123 VanDerWaalsContact OG1-CB 3.3Å; T120-K123 WeakPolarHBondContact OG1-CB 3.43Å; T120-K123 PolarHBondContact OG1-N 2.89Å; K123-C125 VanDerWaalsContact C-N 3.32Å; K123-C125 PolarHBondContact O-N 2.94Å; K123-I126 WeakPolarHBondContact O-CB 3.3Å; K123-I126 PolarHBondContact O-N 3.3Å; K123-Y127 HydrophobicContact CD-CE2 4.04Å; K123-Y127 HydrophobicContact CG-CD2 4.13Å; K123-Y127 HydrophobicContact CG-CE2 3.81Å; K123-Y127 VanDerWaalsContact O-CD2 3.27Å; K123-Y127 WeakPolarHBondContact O-CD2 3.41Å; K123-Y127 PolarHBondContact O-N 3Å
124L97.8Very high96Very high1 Ų168.3 Ų68.31%0.00536%0.358CS..Hα-helixtrans-63.3-37.1176.9-75.5169.2000112.4V67 M107 F108 L119 T120 A121 E122 I126 Y127 T128 L137V67-L124 HydrophobicContact CG1-CD2 4.33Å; M107-L124 HydrophobicContact CB-CD2 4.27Å; M107-L124 HydrophobicContact CE-CD2 3.86Å; F108-L124 HydrophobicContact CB-CD1 3.52Å; F108-L124 HydrophobicContact CD2-CD1 3.88Å; F108-L124 HydrophobicContact CG-CD1 4.08Å; L119-L124 HydrophobicContact CB-CD1 4.24Å; L119-L124 HydrophobicContact CB-CG 4.29Å; L119-L124 HydrophobicContact CD1-CD2 4Å; L119-L124 HydrophobicContact CD1-CG 4.49Å; T120-L124 PolarHBondContact O-N 3.08Å; A121-L124 PolarHBondContact O-N 3.21Å; E122-L124 VanDerWaalsContact C-N 3.33Å; E122-L124 PolarHBondContact O-N 2.93Å; L124-I126 VanDerWaalsContact C-N 3.33Å; L124-I126 PolarHBondContact O-N 3.42Å; L124-Y127 PolarHBondContact O-N 3.24Å; L124-T128 WeakPolarHBondContact O-CG2 3.41Å; L124-T128 PolarHBondContact O-N 3.47Å; L124-L137 HydrophobicContact CB-CD1 3.86Å; L124-L137 HydrophobicContact CD1-CD1 4.1Å
125C97.6Very high96.1Very high4 Ų468 Ų683%0.02736%0.364CS..Hα-helixtrans-63.7-38.7174-640000111.7A121 E122 K123 Y127 T128 N130 I132 P134A121-C125 PolarHBondContact O-N 2.95Å; A121-C125 PolarHBondContact O-SG 3.38Å; E122-C125 WeakPolarHBondContact O-CB 3.28Å; E122-C125 PolarHBondContact O-N 3.33Å; E122-C125 VanDerWaalsContact O-N 3.17Å; K123-C125 VanDerWaalsContact C-N 3.32Å; K123-C125 PolarHBondContact O-N 2.94Å; C125-Y127 VanDerWaalsContact C-N 3.32Å; C125-Y127 PolarHBondContact O-N 2.84Å; C125-T128 PolarHBondContact O-N 3.34Å; C125-T128 VanDerWaalsContact O-N 3.08Å; C125-T128 PolarHBondContact O-OG1 2.84Å; C125-N130 WeakPolarHBondContact O-CA 3.4Å; C125-N130 PolarHBondContact O-N 3.34Å; C125-I132 HydrophobicContact CB-CG1 4.43Å; C125-I132 WeakPolarHBondContact CB-O 3.47Å; C125-P134 VanDerWaalsContact SG-N 3.37Å
126I97.8Very high96.4Very high96 Ų9669.1 Ų69.149%0.49237%0.371SS..Hα-helixtrans-59-43.9175-66.2166.3000110.8E122 K123 L124 T128 D129E122-I126 WeakPolarHBondContact O-CG1 3.42Å; E122-I126 PolarHBondContact O-N 2.91Å; K123-I126 WeakPolarHBondContact O-CB 3.3Å; K123-I126 PolarHBondContact O-N 3.3Å; L124-I126 VanDerWaalsContact C-N 3.33Å; L124-I126 PolarHBondContact O-N 3.42Å; I126-T128 PolarHBondContact O-N 2.91Å; I126-T128 VanDerWaalsContact O-N 3.1Å; I126-D129 PolarHBondContact O-N 3.46Å
127Y97.8Very high96.7Very high58 Ų5864.7 Ų64.723%0.22734%0.344CS..THydrogen-bonded Turntrans-65.8-10.5177.8-81.3-66.2000115.3W63 V67 E70 Q71 K123 L124 C125W63-Y127 PolarHBondContact NE1-O 3.05Å; V67-Y127 HydrophobicContact CB-CD1 4.49Å; V67-Y127 HydrophobicContact CB-CG 4.43Å; V67-Y127 HydrophobicContact CG1-CD1 4.32Å; V67-Y127 HydrophobicContact CG1-CD2 3.73Å; V67-Y127 HydrophobicContact CG1-CE2 4.06Å; V67-Y127 HydrophobicContact CG1-CG 3.88Å; V67-Y127 HydrophobicContact CG2-CD1 3.72Å; V67-Y127 HydrophobicContact CG2-CD2 4.46Å; V67-Y127 HydrophobicContact CG2-CE1 4.41Å; V67-Y127 HydrophobicContact CG2-CG 3.76Å; E70-Y127 HydrophobicContact CB-CE1 4.43Å; E70-Y127 HydrophobicContact CG-CE1 4.17Å; E70-Y127 WeakPolarHBondContact CG-OH 3.4Å; Q71-Y127 VanDerWaalsContact CD-OH 3.32Å; Q71-Y127 HydrophobicContact CG-CE2 3.64Å; Q71-Y127 PolarHBondContact NE2-OH 3.32Å; K123-Y127 HydrophobicContact CD-CE2 4.04Å; K123-Y127 HydrophobicContact CG-CD2 4.13Å; K123-Y127 HydrophobicContact CG-CE2 3.81Å; K123-Y127 VanDerWaalsContact O-CD2 3.27Å; K123-Y127 WeakPolarHBondContact O-CD2 3.41Å; K123-Y127 PolarHBondContact O-N 3Å; L124-Y127 PolarHBondContact O-N 3.24Å; C125-Y127 VanDerWaalsContact C-N 3.32Å; C125-Y127 PolarHBondContact O-N 2.84Å
128T95.6Very high97Very high3 Ų363.3 Ų63.32%0.01833%0.332CS..THydrogen-bonded Turntrans-99.315.8172.769.20000112.7W63 Q100 L124 C125 I126 N130 S131 I132W63-T128 HydrophobicContact CH2-CG2 3.99Å; W63-T128 HydrophobicContact CZ2-CG2 3.67Å; Q100-T128 HydrophobicContact CG-CG2 4.09Å; L124-T128 WeakPolarHBondContact O-CG2 3.41Å; L124-T128 PolarHBondContact O-N 3.47Å; C125-T128 PolarHBondContact O-N 3.34Å; C125-T128 VanDerWaalsContact O-N 3.08Å; C125-T128 PolarHBondContact O-OG1 2.84Å; I126-T128 PolarHBondContact O-N 2.91Å; I126-T128 VanDerWaalsContact O-N 3.1Å; T128-N130 PolarHBondContact O-N 3.04Å; T128-S131 WeakPolarHBondContact CB-OG 3.39Å; T128-S131 VanDerWaalsContact O-CB 3.23Å; T128-S131 WeakPolarHBondContact O-CB 2.95Å; T128-S131 PolarHBondContact O-N 3.12Å; T128-S131 PolarHBondContact O-OG 3.36Å; T128-S131 PolarHBondContact OG1-N 3.32Å; T128-I132 HydrophobicContact CG2-CD1 3.81Å; T128-I132 HydrophobicContact CG2-CG1 3.76Å; T128-I132 VanDerWaalsContact OG1-CG1 3.24Å; T128-I132 WeakPolarHBondContact OG1-CG1 3.22Å; T128-I132 PolarHBondContact OG1-N 3.09Å
129D95.6Very high97.1Very high151 Ų15167.5 Ų67.581%0.80735%0.348SS*.THydrogen-bonded Turntrans52.936.1-168.5-66.6-29.8000112.5I126 S131I126-D129 PolarHBondContact O-N 3.46Å; D129-S131 PolarHBondContact O-N 2.88Å; D129-S131 VanDerWaalsContact O-N 3.14Å
130N94.6Very high97.1Very high111 Ų11167 Ų6759%0.59435%0.345SS*.THydrogen-bonded Turntrans55.924.4-175.4-54.8-73.3000114.3C125 T128 I132C125-N130 WeakPolarHBondContact O-CA 3.4Å; C125-N130 PolarHBondContact O-N 3.34Å; T128-N130 PolarHBondContact O-N 3.04Å; N130-I132 PolarHBondContact O-N 3.29Å
131S93.9Very high97.2Very high79 Ų7964.5 Ų64.555%0.55233%0.328SS*.SBendtrans-69.1-21.9173.563.90000112.8T128 D129T128-S131 WeakPolarHBondContact CB-OG 3.39Å; T128-S131 VanDerWaalsContact O-CB 3.23Å; T128-S131 WeakPolarHBondContact O-CB 2.95Å; T128-S131 PolarHBondContact O-N 3.12Å; T128-S131 PolarHBondContact O-OG 3.36Å; T128-S131 PolarHBondContact OG1-N 3.32Å; D129-S131 PolarHBondContact O-N 2.88Å; D129-S131 VanDerWaalsContact O-N 3.14Å
132I95.7Very high97.2Very high16 Ų1668.4 Ų68.48%0.08235%0.347CS..SBendtrans-113.8152.2170.163.9164.9000111L101 A104 C125 T128 N130 L137L101-I132 HydrophobicContact CB-CG2 3.95Å; L101-I132 HydrophobicContact CD1-CB 4.11Å; L101-I132 HydrophobicContact CD1-CD1 3.81Å; L101-I132 HydrophobicContact CD1-CG2 3.99Å; L101-I132 HydrophobicContact CG-CG2 4.48Å; A104-I132 HydrophobicContact CB-CD1 3.73Å; C125-I132 HydrophobicContact CB-CG1 4.43Å; C125-I132 WeakPolarHBondContact CB-O 3.47Å; T128-I132 HydrophobicContact CG2-CD1 3.81Å; T128-I132 HydrophobicContact CG2-CG1 3.76Å; T128-I132 VanDerWaalsContact OG1-CG1 3.24Å; T128-I132 WeakPolarHBondContact OG1-CG1 3.22Å; T128-I132 PolarHBondContact OG1-N 3.09Å; N130-I132 PolarHBondContact O-N 3.29Å; I132-L137 HydrophobicContact CD1-CD1 4.08Å
133R96.9Very high97.2Very high176 Ų17664.1 Ų64.166%0.66433%0.328SS*.  trans-102.7155.5174.9-60.4178.7172.1-159-3.1111.3S135 D136 L137R133-S135 PolarHBondContact O-N 2.92Å; R133-D136 WeakPolarHBondContact CB-OD2 3.35Å; R133-D136 PolarHBondContact N-OD2 3.07Å; R133-D136 WeakPolarHBondContact O-CB 3.35Å; R133-D136 PolarHBondContact O-N 3.17Å; R133-L137 PolarHBondContact O-N 3.09Å; R133-L137 VanDerWaalsContact O-N 3.12Å
134P97.9Very high97.3Very high53 Ų5359.9 Ų59.934%0.34431%0.31SS..Hα-helixtrans-57-35.6176.2-27.435.2000113.3A121 E122 C125 D136 L137 L138A121-P134 HydrophobicContact CB-CB 4.3Å; E122-P134 HydrophobicContact CG-CG 4.36Å; C125-P134 VanDerWaalsContact SG-N 3.37Å; P134-D136 VanDerWaalsContact C-N 3.3Å; P134-D136 PolarHBondContact O-N 3.1Å; P134-L137 PolarHBondContact O-N 3.11Å; P134-L138 VanDerWaalsContact O-CG 3.31Å; P134-L138 WeakPolarHBondContact O-CG 3.1Å; P134-L138 PolarHBondContact O-N 3.18Å
135S97.9Very high97.4Very high61 Ų6160.4 Ų60.443%0.42731%0.312SS..Hα-helixtrans-59.7-40.6174.953.60000112.7R133 L138 Q139R133-S135 PolarHBondContact O-N 2.92Å; S135-L138 PolarHBondContact O-N 3.15Å; S135-Q139 WeakPolarHBondContact O-CG 3.49Å; S135-Q139 PolarHBondContact O-N 2.87Å
136D97.4Very high97.4Very high57 Ų5765 Ų6531%0.30534%0.337SS..Hα-helixtrans-70.9-38.6-178.8-51.9-29.7000110L101 R133 P134 Q139 M140L101-D136 HydrophobicContact CD1-CB 4.28Å; L101-D136 HydrophobicContact CD2-CB 4.27Å; R133-D136 WeakPolarHBondContact CB-OD2 3.35Å; R133-D136 PolarHBondContact N-OD2 3.07Å; R133-D136 WeakPolarHBondContact O-CB 3.35Å; R133-D136 PolarHBondContact O-N 3.17Å; P134-D136 VanDerWaalsContact C-N 3.3Å; P134-D136 PolarHBondContact O-N 3.1Å; D136-Q139 PolarHBondContact O-N 3.19Å; D136-M140 VanDerWaalsContact O-CB 3.3Å; D136-M140 WeakPolarHBondContact O-CB 3.49Å; D136-M140 PolarHBondContact O-N 2.64Å
137L98.4Very high97.4Very high0 Ų064.2 Ų64.20%033%0.33CS..Hα-helixtrans-62.5-46.4175.4-167.3151.8000111.3L101 A104 F108 A121 L124 I132 R133 P134 Q139 M140 E141L101-L137 HydrophobicContact CD1-CB 4.35Å; A104-L137 HydrophobicContact CB-CD1 4.16Å; F108-L137 HydrophobicContact CB-CD2 4.07Å; F108-L137 HydrophobicContact CD1-CD2 3.38Å; F108-L137 HydrophobicContact CD2-CD2 4.39Å; F108-L137 HydrophobicContact CE1-CD2 3.75Å; F108-L137 HydrophobicContact CG-CD2 3.72Å; F108-L137 HydrophobicContact CZ-CD2 4.42Å; A121-L137 HydrophobicContact CB-CD2 4.08Å; L124-L137 HydrophobicContact CB-CD1 3.86Å; L124-L137 HydrophobicContact CD1-CD1 4.1Å; I132-L137 HydrophobicContact CD1-CD1 4.08Å; R133-L137 PolarHBondContact O-N 3.09Å; R133-L137 VanDerWaalsContact O-N 3.12Å; P134-L137 PolarHBondContact O-N 3.11Å; L137-Q139 PolarHBondContact O-N 3Å; L137-M140 PolarHBondContact O-N 3.04Å; L137-E141 WeakPolarHBondContact O-CB 3.26Å; L137-E141 PolarHBondContact O-N 3.23Å
138L98.3Very high97.4Very high82 Ų8261.8 Ų61.843%0.42932%0.321SS..Hα-helixtrans-67-34.7178.5-65.8176.1000112.7F108 P134 S135 E141 L142F108-L138 HydrophobicContact CE1-CD2 3.98Å; F108-L138 HydrophobicContact CZ-CD2 4.34Å; P134-L138 VanDerWaalsContact O-CG 3.31Å; P134-L138 WeakPolarHBondContact O-CG 3.1Å; P134-L138 PolarHBondContact O-N 3.18Å; S135-L138 PolarHBondContact O-N 3.15Å; L138-E141 WeakPolarHBondContact O-CB 3.32Å; L138-E141 PolarHBondContact O-N 3.04Å; L138-L142 PolarHBondContact O-N 2.71Å
139Q98.3Very high97.5Very high135 Ų13570.2 Ų70.263%0.63136%0.357SS*.Hα-helixtrans-68-42.3172.6-73.8178.14.400111.7S135 D136 L137 E141 L142 L143S135-Q139 WeakPolarHBondContact O-CG 3.49Å; S135-Q139 PolarHBondContact O-N 2.87Å; D136-Q139 PolarHBondContact O-N 3.19Å; L137-Q139 PolarHBondContact O-N 3Å; Q139-E141 VanDerWaalsContact C-N 3.29Å; Q139-E141 PolarHBondContact O-N 2.95Å; Q139-L142 PolarHBondContact O-N 2.9Å; Q139-L143 PolarHBondContact O-N 3.22Å
140M98.4Very high97.6Very high4 Ų470.8 Ų70.82%0.0235%0.348CS..Hα-helixtrans-64.8-35.8176.3-167.869.6-16800111.2F88 R98 L101 L102 T105 D136 L137 L142 L143 T144F88-M140 HydrophobicContact CE1-CE 3.86Å; F88-M140 HydrophobicContact CE2-CE 4.18Å; F88-M140 HydrophobicContact CZ-CE 3.56Å; R98-M140 PolarHBondContact NH2-SD 3.17Å; L101-M140 HydrophobicContact CD1-CB 4.27Å; L101-M140 HydrophobicContact CD2-CB 4.19Å; L101-M140 HydrophobicContact CD2-CG 4.37Å; L101-M140 HydrophobicContact CD2-SD 4.46Å; L101-M140 HydrophobicContact CG-CB 4.03Å; L101-M140 HydrophobicContact CG-CG 4.02Å; L102-M140 HydrophobicContact CB-CE 3.92Å; L102-M140 HydrophobicContact CD1-CE 3.54Å; L102-M140 HydrophobicContact CG-CE 4.24Å; T105-M140 HydrophobicContact CG2-CB 4.19Å; T105-M140 HydrophobicContact CG2-CG 4.04Å; T105-M140 WeakPolarHBondContact OG1-CB 3.34Å; T105-M140 VanDerWaalsContact OG1-CG 3.28Å; T105-M140 WeakPolarHBondContact OG1-CG 3.46Å; D136-M140 VanDerWaalsContact O-CB 3.3Å; D136-M140 WeakPolarHBondContact O-CB 3.49Å; D136-M140 PolarHBondContact O-N 2.64Å; L137-M140 PolarHBondContact O-N 3.04Å; M140-L142 PolarHBondContact O-N 3.44Å; M140-L143 HydrophobicContact CE-CD2 4.34Å; M140-L143 PolarHBondContact O-N 3.42Å; M140-L143 HydrophobicContact SD-CD2 4.04Å; M140-T144 WeakPolarHBondContact O-CB 3.29Å; M140-T144 PolarHBondContact O-N 2.89Å; M140-T144 PolarHBondContact O-OG1 3.24Å
141E98.6Very high97.6Very high23 Ų2368.2 Ų68.211%0.10734%0.335CS..Hα-helixtrans-55.2-52.3174.7-178.3-178.5-149.700111.3T105 F108 L109 K112 L137 L138 Q139 L143 T144 L145T105-E141 VanDerWaalsContact CG2-CA 3.41Å; T105-E141 HydrophobicContact CG2-CB 4.06Å; F108-E141 HydrophobicContact CD1-CG 4.45Å; F108-E141 WeakPolarHBondContact CE1-OE2 3.38Å; L109-E141 HydrophobicContact CD2-CG 3.7Å; L109-E141 WeakPolarHBondContact CD2-OE1 3.43Å; L109-E141 HydrophobicContact CG-CG 4.21Å; K112-E141 IonicContact NZ-OE1 3.56Å; K112-E141 PolarHBondContact NZ-OE1 2.92Å; K112-E141 IonicContact NZ-OE2 2.64Å; L137-E141 WeakPolarHBondContact O-CB 3.26Å; L137-E141 PolarHBondContact O-N 3.23Å; L138-E141 WeakPolarHBondContact O-CB 3.32Å; L138-E141 PolarHBondContact O-N 3.04Å; Q139-E141 VanDerWaalsContact C-N 3.29Å; Q139-E141 PolarHBondContact O-N 2.95Å; E141-L143 VanDerWaalsContact C-N 3.3Å; E141-L143 PolarHBondContact O-N 3.24Å; E141-T144 PolarHBondContact O-N 2.93Å; E141-L145 HydrophobicContact CG-CD1 3.93Å; E141-L145 HydrophobicContact CG-CG 4.43Å; E141-L145 WeakPolarHBondContact O-CB 3.43Å; E141-L145 VanDerWaalsContact O-CG 3.3Å; E141-L145 WeakPolarHBondContact O-CG 3.28Å; E141-L145 PolarHBondContact O-N 2.86Å
142L98.4Very high97.7Very high97 Ų9765.3 Ų65.351%0.50831%0.312SS..Hα-helixtrans-61.4-39.1178.5-66.9173.5000112L138 Q139 M140 N146L138-L142 PolarHBondContact O-N 2.71Å; Q139-L142 PolarHBondContact O-N 2.9Å; M140-L142 PolarHBondContact O-N 3.44Å; L142-N146 WeakPolarHBondContact O-CB 3.48Å; L142-N146 VanDerWaalsContact O-CG 3.27Å; L142-N146 PolarHBondContact O-N 3.21Å; L142-N146 PolarHBondContact O-ND2 2.91Å
143L98.4Very high97.6Very high51 Ų5168 Ų6827%0.26734%0.337SS..Hα-helixtrans-63.8-48176179.460.7000111.1F88 Q139 M140 E141 N146 K147F88-L143 HydrophobicContact CE2-CG 4.14Å; F88-L143 HydrophobicContact CZ-CD2 4.15Å; F88-L143 HydrophobicContact CZ-CG 4.18Å; Q139-L143 PolarHBondContact O-N 3.22Å; M140-L143 HydrophobicContact CE-CD2 4.34Å; M140-L143 PolarHBondContact O-N 3.42Å; M140-L143 HydrophobicContact SD-CD2 4.04Å; E141-L143 VanDerWaalsContact C-N 3.3Å; E141-L143 PolarHBondContact O-N 3.24Å; L143-N146 PolarHBondContact O-N 3.18Å; L143-K147 HydrophobicContact CD1-CG 4.06Å; L143-K147 HydrophobicContact CG-CG 4.45Å; L143-K147 WeakPolarHBondContact O-CB 3.32Å; L143-K147 VanDerWaalsContact O-CG 3.25Å; L143-K147 WeakPolarHBondContact O-CG 3.31Å; L143-K147 PolarHBondContact O-N 2.98Å
144T98.5Very high97.4Very high0 Ų059.9 Ų59.90%031%0.307CS..Hα-helixtrans-61.8-47.3179.3-59.20000111.1F88 L109 M140 E141 N146 K147 L148F88-T144 HydrophobicContact CD2-CG2 4.06Å; L109-T144 HydrophobicContact CD1-CG2 3.66Å; M140-T144 WeakPolarHBondContact O-CB 3.29Å; M140-T144 PolarHBondContact O-N 2.89Å; M140-T144 PolarHBondContact O-OG1 3.24Å; E141-T144 PolarHBondContact O-N 2.93Å; T144-N146 VanDerWaalsContact C-N 3.34Å; T144-N146 PolarHBondContact O-N 3.38Å; T144-K147 PolarHBondContact O-N 3.44Å; T144-L148 HydrophobicContact CG2-CD1 3.87Å; T144-L148 HydrophobicContact CG2-CG 4.3Å; T144-L148 WeakPolarHBondContact O-CB 3.16Å; T144-L148 WeakPolarHBondContact O-CG 3.37Å; T144-L148 PolarHBondContact O-N 2.69Å
145L98.5Very high97.2Very high11 Ų1158.2 Ų58.26%0.05830%0.296CS..Hα-helixtrans-55.5-47.4175.5-75.6170.3000112L109 E141 L148 K149 W150 L152L109-L145 HydrophobicContact CD1-CD2 4.42Å; L109-L145 HydrophobicContact CD1-CG 4.36Å; L109-L145 HydrophobicContact CD2-CD1 4.27Å; L109-L145 HydrophobicContact CD2-CD2 3.81Å; L109-L145 HydrophobicContact CD2-CG 3.98Å; E141-L145 HydrophobicContact CG-CD1 3.93Å; E141-L145 HydrophobicContact CG-CG 4.43Å; E141-L145 WeakPolarHBondContact O-CB 3.43Å; E141-L145 VanDerWaalsContact O-CG 3.3Å; E141-L145 WeakPolarHBondContact O-CG 3.28Å; E141-L145 PolarHBondContact O-N 2.86Å; L145-L148 CarbonylContact O-C 3.58Å; L145-L148 PolarHBondContact O-N 2.84Å; L145-K149 PolarHBondContact O-N 3.24Å; L145-W150 HydrophobicContact CB-CD2 4.37Å; L145-W150 HydrophobicContact CB-CZ2 4.38Å; L145-W150 HydrophobicContact CD1-CH2 3.93Å; L145-W150 HydrophobicContact CD1-CZ2 4.22Å; L145-W150 HydrophobicContact CD1-CZ3 4.1Å; L145-W150 HydrophobicContact CD2-CD2 4.35Å; L145-W150 HydrophobicContact CD2-CE3 4.1Å; L145-W150 HydrophobicContact CD2-CZ3 4.37Å; L145-W150 PolarHBondContact O-N 3.49Å; L145-L152 HydrophobicContact CD2-CD1 3.56Å; L145-L152 HydrophobicContact CD2-CD2 4.26Å; L145-L152 HydrophobicContact CD2-CG 4.12Å
146N98.1Very high97Very high101 Ų10155.5 Ų55.554%0.5428%0.277SS..Hα-helixtrans-67.2-39.5-179.8-75.2-41.1000112.4L142 L143 T144 K149 W150L142-N146 WeakPolarHBondContact O-CB 3.48Å; L142-N146 VanDerWaalsContact O-CG 3.27Å; L142-N146 PolarHBondContact O-N 3.21Å; L142-N146 PolarHBondContact O-ND2 2.91Å; L143-N146 PolarHBondContact O-N 3.18Å; T144-N146 VanDerWaalsContact C-N 3.34Å; T144-N146 PolarHBondContact O-N 3.38Å; N146-K149 PolarHBondContact O-N 3.01Å; N146-K149 VanDerWaalsContact O-N 3.15Å; N146-W150 PolarHBondContact OD1-NE1 3.35Å
147K97.9Very high97Very high80 Ų8053.3 Ų53.335%0.34827%0.266SS..Hα-helixtrans-69.1-34.7177.8-69-71.7173.1168.30112.3F88 V91 E92 L143 T144 K149F88-K147 HydrophobicContact CD2-CB 3.87Å; F88-K147 HydrophobicContact CD2-CG 4.29Å; F88-K147 HydrophobicContact CE2-CB 3.85Å; F88-K147 HydrophobicContact CE2-CG 3.76Å; V91-K147 HydrophobicContact CG2-CB 4.27Å; E92-K147 HydrophobicContact CB-CD 4.49Å; E92-K147 IonicContact OE1-NZ 3.81Å; E92-K147 WeakPolarHBondContact OE2-CE 3.4Å; E92-K147 IonicContact OE2-NZ 3.24Å; E92-K147 PolarHBondContact OE2-NZ 3.29Å; L143-K147 HydrophobicContact CD1-CG 4.06Å; L143-K147 HydrophobicContact CG-CG 4.45Å; L143-K147 WeakPolarHBondContact O-CB 3.32Å; L143-K147 VanDerWaalsContact O-CG 3.25Å; L143-K147 WeakPolarHBondContact O-CG 3.31Å; L143-K147 PolarHBondContact O-N 2.98Å; T144-K147 PolarHBondContact O-N 3.44Å; K147-K149 VanDerWaalsContact C-N 3.25Å; K147-K149 PolarHBondContact O-N 2.93Å
148L97.5Very high96.9Very high7 Ų753.8 Ų53.84%0.03727%0.268CS..THydrogen-bonded Turntrans-83.42.7172.7-60.3-176.9000113.1Y84 R87 T144 L145 W150 D151 L152Y84-L148 HydrophobicContact CD1-CD1 3.99Å; Y84-L148 HydrophobicContact CG-CD1 4.06Å; R87-L148 HydrophobicContact CB-CD2 3.57Å; T144-L148 HydrophobicContact CG2-CD1 3.87Å; T144-L148 HydrophobicContact CG2-CG 4.3Å; T144-L148 WeakPolarHBondContact O-CB 3.16Å; T144-L148 WeakPolarHBondContact O-CG 3.37Å; T144-L148 PolarHBondContact O-N 2.69Å; L145-L148 CarbonylContact O-C 3.58Å; L145-L148 PolarHBondContact O-N 2.84Å; L148-W150 PolarHBondContact O-N 2.94Å; L148-D151 VanDerWaalsContact O-CB 3.27Å; L148-D151 WeakPolarHBondContact O-CB 3.43Å; L148-D151 PolarHBondContact O-N 3.46Å; L148-L152 HydrophobicContact CD1-CD2 3.98Å
149K97.4Very high96.6Very high180 Ų18052 Ų5278%0.78326%0.259SS*.THydrogen-bonded Turntrans53.235.4-178.9-55.3178.5-179175.60113.4L145 N146 K147 D151L145-K149 PolarHBondContact O-N 3.24Å; N146-K149 PolarHBondContact O-N 3.01Å; N146-K149 VanDerWaalsContact O-N 3.15Å; K147-K149 VanDerWaalsContact C-N 3.25Å; K147-K149 PolarHBondContact O-N 2.93Å; K149-D151 PolarHBondContact O-N 3.49Å; K149-D151 VanDerWaalsContact O-N 3.07Å
150W97.5Very high96.5Very high162 Ų16245.6 Ų45.661%0.61423%0.229SC*.THydrogen-bonded Turntrans59.712.9-176.2-63.374000114.5L145 N146 L148 L152L145-W150 HydrophobicContact CB-CD2 4.37Å; L145-W150 HydrophobicContact CB-CZ2 4.38Å; L145-W150 HydrophobicContact CD1-CH2 3.93Å; L145-W150 HydrophobicContact CD1-CZ2 4.22Å; L145-W150 HydrophobicContact CD1-CZ3 4.1Å; L145-W150 HydrophobicContact CD2-CD2 4.35Å; L145-W150 HydrophobicContact CD2-CE3 4.1Å; L145-W150 HydrophobicContact CD2-CZ3 4.37Å; L145-W150 PolarHBondContact O-N 3.49Å; N146-W150 PolarHBondContact OD1-NE1 3.35Å; L148-W150 PolarHBondContact O-N 2.94Å; W150-L152 VanDerWaalsContact C-N 3.32Å; W150-L152 PolarHBondContact O-N 3.33Å
151D96.1Very high96.4Very high58 Ų5845.5 Ų45.531%0.3123%0.229SC..  trans-8873.2-177.3-173.327.3000110.6Y38 R87 L148 K149Y38-D151 VanDerWaalsContact CE1-CG 3.44Å; Y38-D151 VanDerWaalsContact CE1-OD1 3.29Å; Y38-D151 WeakPolarHBondContact CE1-OD1 3.09Å; Y38-D151 WeakPolarHBondContact CE1-OD2 3.49Å; Y38-D151 PolarHBondContact OH-OD1 3.47Å; Y38-D151 VanDerWaalsContact OH-OD1 3.12Å; R87-D151 PolarHBondContact NH1-O 3.01Å; R87-D151 PolarHBondContact NH2-O 3.23Å; R87-D151 IonicContact NH2-OD2 2.78Å; R87-D151 PolarHBondContact NH2-OD2 3.01Å; L148-D151 VanDerWaalsContact O-CB 3.27Å; L148-D151 WeakPolarHBondContact O-CB 3.43Å; L148-D151 PolarHBondContact O-N 3.46Å; K149-D151 PolarHBondContact O-N 3.49Å; K149-D151 VanDerWaalsContact O-N 3.07Å
152L96Very high96Very high17 Ų1746.8 Ų46.89%0.08924%0.236CC..  trans-94.1-16.6-173.7-65.8-173.2000113.9Y84 L109 M113 L145 L148 W150 S154Y84-L152 HydrophobicContact CD1-CD2 4.29Å; Y84-L152 HydrophobicContact CE1-CB 4.3Å; Y84-L152 HydrophobicContact CE1-CD2 3.88Å; Y84-L152 WeakPolarHBondContact CE1-O 3.25Å; Y84-L152 HydrophobicContact CE2-CD2 4.11Å; Y84-L152 WeakPolarHBondContact OH-CB 3.19Å; Y84-L152 PolarHBondContact OH-O 2.94Å; L109-L152 HydrophobicContact CD2-CD1 4.28Å; M113-L152 HydrophobicContact CE-CB 4.26Å; M113-L152 HydrophobicContact CG-CB 4.29Å; M113-L152 HydrophobicContact CG-CD1 4.27Å; M113-L152 HydrophobicContact SD-CB 4.17Å; M113-L152 HydrophobicContact SD-CD1 4.12Å; L145-L152 HydrophobicContact CD2-CD1 3.56Å; L145-L152 HydrophobicContact CD2-CD2 4.26Å; L145-L152 HydrophobicContact CD2-CG 4.12Å; L148-L152 HydrophobicContact CD1-CD2 3.98Å; W150-L152 VanDerWaalsContact C-N 3.32Å; W150-L152 PolarHBondContact O-N 3.33Å; L152-S154 PolarHBondContact O-N 3.48Å
153A93.3Very high95.8Very high72 Ų7242.4 Ų42.460%0.59521%0.213SC*.  trans-81.148.1-17400000112.5Y38Y38-A153 PolarHBondContact OH-O 3.27Å
154S92.6Very high95.5Very high6 Ų640 Ų404%0.04220%0.201CC..  trans-70.8140178.6620000111.4Y38 L80 N83 L152Y38-S154 VanDerWaalsContact CG-CB 3.46Å; L80-S154 WeakPolarHBondContact CD1-OG 3.4Å; N83-S154 PolarHBondContact OD1-OG 2.96Å; L152-S154 PolarHBondContact O-N 3.48Å
155V93.8Very high95.1Very high19 Ų1940 Ų4012%0.11520%0.201CC..  trans-68.9136171.6-170.70000109.4M31 A34 D159 F160 P200M31-V155 HydrophobicContact CB-CG1 4.23Å; M31-V155 HydrophobicContact CB-CG2 4.39Å; M31-V155 HydrophobicContact CE-CG1 3.72Å; M31-V155 HydrophobicContact CG-CG1 4.39Å; M31-V155 HydrophobicContact CG-CG2 4.46Å; A34-V155 HydrophobicContact CB-CG2 4.01Å; V155-D159 HydrophobicContact CG1-CB 3.98Å; V155-F160 HydrophobicContact CB-CE2 4.29Å; V155-F160 HydrophobicContact CG1-CD2 3.92Å; V155-F160 HydrophobicContact CG1-CE2 3.31Å; V155-F160 HydrophobicContact CG1-CZ 3.9Å; V155-P200 WeakPolarHBondContact O-CG 3.04Å
156T94.8Very high94.7Very high3 Ų341.7 Ų41.72%0.01821%0.213CC..  trans-108.8161.1179.868.60000110.8L80 H158 D159 F160L80-T156 HydrophobicContact CB-CG2 4.16Å; L80-T156 HydrophobicContact CD1-CG2 4.17Å; T156-H158 PolarHBondContact O-N 3.48Å; T156-H158 VanDerWaalsContact O-N 3.16Å; T156-D159 WeakPolarHBondContact CA-OD2 3.46Å; T156-D159 WeakPolarHBondContact CB-OD2 3.35Å; T156-D159 PolarHBondContact N-OD2 3.45Å; T156-D159 PolarHBondContact O-N 3.4Å; T156-D159 VanDerWaalsContact O-N 3.16Å; T156-D159 PolarHBondContact OG1-OD2 3.03Å; T156-F160 WeakPolarHBondContact O-CD2 3.49Å
157P96.9Very high94.2Very high12 Ų1240 Ų408%0.07820%0.201CC..Hα-helixtrans-57.8-29.7174.9-26.436.1000113D159 F160 I161 V186 P200 I203 A204P157-D159 VanDerWaalsContact C-N 3.35Å; P157-D159 PolarHBondContact O-N 3.31Å; P157-F160 PolarHBondContact O-N 3.18Å; P157-I161 WeakPolarHBondContact O-CG1 3.34Å; P157-I161 PolarHBondContact O-N 3.41Å; P157-V186 HydrophobicContact CB-CB 4.41Å; P157-V186 HydrophobicContact CB-CG1 3.83Å; P157-V186 HydrophobicContact CB-CG2 3.61Å; P157-V186 HydrophobicContact CG-CG1 3.88Å; P157-V186 HydrophobicContact CG-CG2 4.41Å; P157-P200 HydrophobicContact CG-CB 4.05Å; P157-I203 HydrophobicContact CB-CG2 4.34Å; P157-I203 HydrophobicContact CG-CB 4.24Å; P157-I203 HydrophobicContact CG-CG2 4.13Å; P157-A204 HydrophobicContact CB-CB 4.02Å; P157-A204 VanDerWaalsContact O-CB 3.26Å; P157-A204 WeakPolarHBondContact O-CB 3.27Å
158H94.9Very high93.6Very high9 Ų936.5 Ų36.54%0.04219%0.186CC..Hα-helixtrans-60.2-41.9177.4-70.791.9000112.9E75 E76 T156 F160 I161 D162 Q183E75-H158 PolarHBondContact O-CE1 3.28Å; E76-H158 HydrophobicContact CG-CB 3.61Å; T156-H158 PolarHBondContact O-N 3.48Å; T156-H158 VanDerWaalsContact O-N 3.16Å; H158-F160 PolarHBondContact O-N 2.95Å; H158-I161 PolarHBondContact O-N 3.34Å; H158-I161 VanDerWaalsContact O-N 3.16Å; H158-D162 PolarHBondContact O-N 2.93Å; H158-Q183 WeakPolarHBondContact NE2-CG 3.44Å
159D93.4Very high92.9Very high45 Ų4541.9 Ų41.924%0.24122%0.222CC..Hα-helixtrans-60.3-34.3178.9-55.6-64.3000111M31 K114 V155 T156 P157 H163M31-D159 HydrophobicContact CE-CB 3.38Å; K114-D159 IonicContact NZ-OD1 3.88Å; V155-D159 HydrophobicContact CG1-CB 3.98Å; T156-D159 WeakPolarHBondContact CA-OD2 3.46Å; T156-D159 WeakPolarHBondContact CB-OD2 3.35Å; T156-D159 PolarHBondContact N-OD2 3.45Å; T156-D159 PolarHBondContact O-N 3.4Å; T156-D159 VanDerWaalsContact O-N 3.16Å; T156-D159 PolarHBondContact OG1-OD2 3.03Å; P157-D159 VanDerWaalsContact C-N 3.35Å; P157-D159 PolarHBondContact O-N 3.31Å; D159-H163 PolarHBondContact O-ND1 2.97Å
160F95.9Very high92.3Very high0 Ų034.4 Ų34.40%019%0.19CC..Hα-helixtrans-79.4-37.2176.2-70.9-76.6000113.3L28 M31 L32 E35 V155 T156 P157 H158 D162 H163 F164 P200 A204L28-F160 HydrophobicContact CD1-CD1 3.72Å; L28-F160 HydrophobicContact CD1-CE1 3.82Å; M31-F160 HydrophobicContact CB-CE1 3.92Å; M31-F160 HydrophobicContact CB-CZ 3.83Å; M31-F160 HydrophobicContact CE-CD1 3.92Å; M31-F160 HydrophobicContact CE-CD2 4.21Å; M31-F160 HydrophobicContact CE-CE1 3.95Å; M31-F160 HydrophobicContact CE-CE2 4.25Å; M31-F160 HydrophobicContact CE-CG 4.06Å; M31-F160 HydrophobicContact CE-CZ 4.13Å; L32-F160 HydrophobicContact CD2-CE1 3.63Å; L32-F160 HydrophobicContact CD2-CZ 4.09Å; L32-F160 HydrophobicContact CG-CE1 3.99Å; E35-F160 WeakPolarHBondContact OE2-CE2 3.29Å; V155-F160 HydrophobicContact CB-CE2 4.29Å; V155-F160 HydrophobicContact CG1-CD2 3.92Å; V155-F160 HydrophobicContact CG1-CE2 3.31Å; V155-F160 HydrophobicContact CG1-CZ 3.9Å; T156-F160 WeakPolarHBondContact O-CD2 3.49Å; P157-F160 PolarHBondContact O-N 3.18Å; H158-F160 PolarHBondContact O-N 2.95Å; F160-D162 VanDerWaalsContact C-N 3.29Å; F160-D162 PolarHBondContact O-N 2.96Å; F160-H163 WeakPolarHBondContact O-CB 3.49Å; F160-H163 PolarHBondContact O-N 3.08Å; F160-F164 HydrophobicContact CB-CE2 3.86Å; F160-F164 HydrophobicContact CB-CZ 3.86Å; F160-F164 HydrophobicContact CD1-CZ 4.17Å; F160-F164 HydrophobicContact CG-CZ 4.4Å; F160-F164 VanDerWaalsContact O-CD2 3.31Å; F160-F164 WeakPolarHBondContact O-CD2 3.31Å; F160-F164 WeakPolarHBondContact O-CG 3.42Å; F160-F164 PolarHBondContact O-N 3.46Å; F160-P200 HydrophobicContact CD2-CB 4.15Å; F160-P200 HydrophobicContact CE2-CB 3.96Å; F160-A204 HydrophobicContact CB-CB 3.54Å; F160-A204 HydrophobicContact CG-CB 4.5Å
161I95.4Very high91.7Very high2 Ų234.1 Ų34.11%0.0120%0.195CC..Hα-helixtrans-55.5-47.4176.4-72.7167.7000110.1P157 H158 H163 F164 L165 R179 A182 V186 A204 V208P157-I161 WeakPolarHBondContact O-CG1 3.34Å; P157-I161 PolarHBondContact O-N 3.41Å; H158-I161 PolarHBondContact O-N 3.34Å; H158-I161 VanDerWaalsContact O-N 3.16Å; I161-H163 VanDerWaalsContact C-N 3.33Å; I161-H163 PolarHBondContact O-N 3.31Å; I161-F164 PolarHBondContact O-N 3.44Å; I161-L165 HydrophobicContact CG2-CD1 3.7Å; I161-L165 HydrophobicContact CG2-CG 4.12Å; I161-L165 WeakPolarHBondContact O-CB 3.32Å; I161-L165 VanDerWaalsContact O-CG 3.29Å; I161-L165 WeakPolarHBondContact O-CG 3.24Å; I161-L165 PolarHBondContact O-N 3.38Å; I161-R179 HydrophobicContact CG2-CG 4.38Å; I161-A182 HydrophobicContact CD1-CB 3.79Å; I161-A182 HydrophobicContact CG1-CB 4.3Å; I161-A182 HydrophobicContact CG2-CB 4.4Å; I161-V186 HydrophobicContact CD1-CG2 3.74Å; I161-A204 HydrophobicContact CG1-CB 3.98Å; I161-V208 HydrophobicContact CG1-CG2 4.03Å; I161-V208 HydrophobicContact CG2-CG2 4.32Å
162D91.5Very high91.3Very high50 Ų5037 Ų3727%0.26721%0.207SC..Hα-helixtrans-65-37.3179.9-81.1-30.4000112.6L23 H158 F160 S166 R179L23-D162 HydrophobicContact CD2-CB 4.37Å; H158-D162 PolarHBondContact O-N 2.93Å; F160-D162 VanDerWaalsContact C-N 3.29Å; F160-D162 PolarHBondContact O-N 2.96Å; D162-S166 WeakPolarHBondContact O-CB 3.45Å; D162-S166 PolarHBondContact O-N 3.36Å; D162-R179 IonicContact OD1-CZ 2.87Å; D162-R179 VanDerWaalsContact OD1-CZ 3.26Å; D162-R179 IonicContact OD1-NE 2.62Å; D162-R179 PolarHBondContact OD1-NE 3.42Å; D162-R179 IonicContact OD1-NH2 3.78Å; D162-R179 PolarHBondContact OD1-NH2 3.23Å
163H92.5Very high90.9Very high6 Ų642.1 Ų42.13%0.02823%0.23CC..Hα-helixtrans-59.8-48171.1-86.385.9000112.1L22 L28 M31 D159 F160 I161 S166 K167L22-H163 PolarHBondContact O-CE1 2.64Å; L22-H163 PolarHBondContact O-NE2 2.94Å; L28-H163 HydrophobicContact CD1-CB 4.35Å; M31-H163 PolarHBondContact SD-CE1 3.45Å; D159-H163 PolarHBondContact O-ND1 2.97Å; F160-H163 WeakPolarHBondContact O-CB 3.49Å; F160-H163 PolarHBondContact O-N 3.08Å; I161-H163 VanDerWaalsContact C-N 3.33Å; I161-H163 PolarHBondContact O-N 3.31Å; H163-S166 PolarHBondContact O-N 3.44Å; H163-S166 PolarHBondContact O-OG 2.87Å; H163-K167 PolarHBondContact O-N 3.08Å
164F92.9Very high90.6Very high0 Ų040.6 Ų40.60%021%0.213CC..Hα-helixtrans-64.9-48.6-179.2-57.7-25.5000111.1L28 F160 I161 S166 K167 L168 A204 A205 V208 L233 V236 I237L28-F164 HydrophobicContact CD1-CE1 4.49Å; F160-F164 HydrophobicContact CB-CE2 3.86Å; F160-F164 HydrophobicContact CB-CZ 3.86Å; F160-F164 HydrophobicContact CD1-CZ 4.17Å; F160-F164 HydrophobicContact CG-CZ 4.4Å; F160-F164 VanDerWaalsContact O-CD2 3.31Å; F160-F164 WeakPolarHBondContact O-CD2 3.31Å; F160-F164 WeakPolarHBondContact O-CG 3.42Å; F160-F164 PolarHBondContact O-N 3.46Å; I161-F164 PolarHBondContact O-N 3.44Å; F164-S166 PolarHBondContact O-N 2.93Å; F164-K167 PolarHBondContact O-N 3.34Å; F164-K167 VanDerWaalsContact O-N 3.07Å; F164-L168 WeakPolarHBondContact O-CG 3.48Å; F164-L168 PolarHBondContact O-N 3.26Å; F164-A204 HydrophobicContact CD2-CB 4.43Å; F164-A204 HydrophobicContact CE2-CB 3.79Å; F164-A205 HydrophobicContact CE2-CB 3.86Å; F164-A205 HydrophobicContact CZ-CB 4.36Å; F164-V208 HydrophobicContact CD2-CG2 4.33Å; F164-L233 HydrophobicContact CB-CD2 3.9Å; F164-L233 HydrophobicContact CD1-CD2 3.95Å; F164-L233 HydrophobicContact CD2-CD2 3.97Å; F164-L233 HydrophobicContact CG-CD2 3.66Å; F164-V236 HydrophobicContact CD1-CG1 4.07Å; F164-V236 HydrophobicContact CE1-CG1 3.72Å; F164-I237 HydrophobicContact CE1-CG2 3.94Å; F164-I237 HydrophobicContact CE2-CG2 4.45Å; F164-I237 HydrophobicContact CZ-CG2 3.47Å; F164-I237 VanDerWaalsContact CZ-CG2 3.47Å
165L91.1Very high90.5Very high1 Ų141.8 Ų41.81%0.00522%0.218CC..Hα-helixtrans-61.3-32.1178.4-67.7179.5000112.4I161 K167 L168 K175 L178 R179I161-L165 HydrophobicContact CG2-CD1 3.7Å; I161-L165 HydrophobicContact CG2-CG 4.12Å; I161-L165 WeakPolarHBondContact O-CB 3.32Å; I161-L165 VanDerWaalsContact O-CG 3.29Å; I161-L165 WeakPolarHBondContact O-CG 3.24Å; I161-L165 PolarHBondContact O-N 3.38Å; L165-K167 VanDerWaalsContact C-N 3.28Å; L165-K167 PolarHBondContact O-N 2.93Å; L165-L168 HydrophobicContact CD2-CD1 4.24Å; L165-L168 PolarHBondContact O-N 3.33Å; L165-K175 WeakPolarHBondContact O-CD 3.24Å; L165-K175 WeakPolarHBondContact O-CE 3.35Å; L165-K175 PolarHBondContact O-NZ 2.94Å; L165-L178 HydrophobicContact CD2-CB 4.02Å; L165-L178 HydrophobicContact CD2-CD1 4.28Å; L165-R179 HydrophobicContact CD1-CB 3.73Å; L165-R179 HydrophobicContact CD1-CG 4.29Å
166S89.5Confident90.3Very high46 Ų4645.7 Ų45.732%0.32224%0.235SC..Hα-helixtrans-62.4-3617679.40000112.4D162 H163 F164D162-S166 WeakPolarHBondContact O-CB 3.45Å; D162-S166 PolarHBondContact O-N 3.36Å; H163-S166 PolarHBondContact O-N 3.44Å; H163-S166 PolarHBondContact O-OG 2.87Å; F164-S166 PolarHBondContact O-N 2.93Å
167K87.5Confident90.2Very high64 Ų6448.3 Ų48.328%0.27825%0.248SC..Hα-helixtrans-84.4-15.7-177.9-63.9-177.2176.2-171.80114.2D25 H163 F164 L165 F232D25-K167 VanDerWaalsContact OD1-CE 3.31Å; D25-K167 WeakPolarHBondContact OD1-CE 3.48Å; D25-K167 IonicContact OD1-NZ 3.26Å; D25-K167 PolarHBondContact OD1-NZ 2.86Å; H163-K167 PolarHBondContact O-N 3.08Å; F164-K167 PolarHBondContact O-N 3.34Å; F164-K167 VanDerWaalsContact O-N 3.07Å; L165-K167 VanDerWaalsContact C-N 3.28Å; L165-K167 PolarHBondContact O-N 2.93Å; K167-F232 HydrophobicContact CB-CE1 4.34Å; K167-F232 HydrophobicContact CB-CZ 3.84Å; K167-F232 HydrophobicContact CD-CZ 4.03Å
168L84.7Confident89.9Confident7 Ų747.9 Ų47.94%0.03725%0.245CC..SBendtrans-78.6130.8178.5-63.9178.9000111.3F164 L165 I170 K175 V208 L224 L229 F232F164-L168 WeakPolarHBondContact O-CG 3.48Å; F164-L168 PolarHBondContact O-N 3.26Å; L165-L168 HydrophobicContact CD2-CD1 4.24Å; L165-L168 PolarHBondContact O-N 3.33Å; L168-I170 HydrophobicContact CB-CD1 4.08Å; L168-I170 HydrophobicContact CB-CG1 3.83Å; L168-I170 HydrophobicContact CD1-CD1 4.28Å; L168-I170 PolarHBondContact O-N 2.93Å; L168-K175 WeakPolarHBondContact O-CE 3.44Å; L168-K175 PolarHBondContact O-NZ 3.21Å; L168-K175 VanDerWaalsContact O-NZ 3.16Å; L168-V208 HydrophobicContact CD1-CG1 4.46Å; L168-L224 HydrophobicContact CD2-CD2 4.2Å; L168-L229 HydrophobicContact CD1-CD1 4.32Å; L168-L229 HydrophobicContact CD2-CD1 3.59Å; L168-F232 HydrophobicContact CD2-CD1 4.38Å; L168-F232 HydrophobicContact CD2-CE1 4.24Å
169P83.4Confident89.9Confident120 Ų12050.1 Ų50.178%0.77925%0.253SS*.  trans-80.561.8179.234.9-36.6000111.3
170I83.8Confident89.9Confident24 Ų2455 Ų5512%0.12327%0.272CS..  trans-124.7154.1-177.553.7169.4000111.7L168 K175 L178 L224L168-I170 HydrophobicContact CB-CD1 4.08Å; L168-I170 HydrophobicContact CB-CG1 3.83Å; L168-I170 HydrophobicContact CD1-CD1 4.28Å; L168-I170 PolarHBondContact O-N 2.93Å; I170-K175 HydrophobicContact CD1-CG 3.61Å; I170-K175 HydrophobicContact CG1-CD 4.26Å; I170-K175 HydrophobicContact CG1-CG 3.57Å; I170-K175 WeakPolarHBondContact O-CE 3.5Å; I170-L178 HydrophobicContact CD1-CD1 3.36Å; I170-L224 HydrophobicContact CG2-CD1 3.5Å; I170-L224 VanDerWaalsContact CG2-CD1 3.5Å
171H86Confident89.9Confident155 Ų15558.7 Ų58.772%0.71829%0.289SS*.  trans-63.4147.7179.3-65.2-63.7000112.5H173 T174 K175H171-H173 VanDerWaalsContact C-N 3.28Å; H171-H173 PolarHBondContact O-N 2.86Å; H171-T174 WeakPolarHBondContact O-CB 3.46Å; H171-T174 PolarHBondContact O-N 3.19Å; H171-K175 PolarHBondContact O-N 3.05Å
172Q86.5Confident89.9Confident118 Ų11858.6 Ų58.655%0.55129%0.289SS*.Hα-helixtrans-57-38.3-175.7-174.664.43.600113.4K175 Q176Q172-K175 WeakPolarHBondContact O-CB 3.45Å; Q172-K175 PolarHBondContact O-N 3.34Å; Q172-Q176 PolarHBondContact O-N 3.29Å; Q172-Q176 VanDerWaalsContact O-N 3.08Å
173H88.2Confident90.1Very high126 Ų12657.3 Ų57.358%0.58328%0.281SS*.Hα-helixtrans-61-45.2175.5179.1-97000111.8H171 K175 Q176 I177H171-H173 VanDerWaalsContact C-N 3.28Å; H171-H173 PolarHBondContact O-N 2.86Å; H173-K175 VanDerWaalsContact C-N 3.34Å; H173-K175 PolarHBondContact O-N 3.19Å; H173-Q176 WeakPolarHBondContact O-CB 3.49Å; H173-Q176 PolarHBondContact O-N 2.97Å; H173-I177 VanDerWaalsContact CE1-CD1 3.4Å; H173-I177 WeakPolarHBondContact CE1-CD1 3.33Å; H173-I177 PolarHBondContact O-N 2.88Å
174T87.4Confident90.3Very high40 Ų4060.8 Ų60.825%0.24530%0.303CS..Hα-helixtrans-64.3-38175.4-48.60000111.6H171 Q176 I177 L178H171-T174 WeakPolarHBondContact O-CB 3.46Å; H171-T174 PolarHBondContact O-N 3.19Å; T174-Q176 VanDerWaalsContact C-N 3.29Å; T174-Q176 PolarHBondContact O-N 3.39Å; T174-I177 PolarHBondContact O-N 3.48Å; T174-L178 HydrophobicContact CG2-CD1 4.22Å; T174-L178 WeakPolarHBondContact O-CB 3.43Å; T174-L178 WeakPolarHBondContact O-CG 3.47Å; T174-L178 PolarHBondContact O-N 3.37Å
175K89.9Confident90.5Very high30 Ų3061.7 Ų61.713%0.1331%0.307CS..Hα-helixtrans-58.5-40173.5-66.3-171.2-176.3-163.70111.9L165 L168 I170 H171 Q172 H173 R179L165-K175 WeakPolarHBondContact O-CD 3.24Å; L165-K175 WeakPolarHBondContact O-CE 3.35Å; L165-K175 PolarHBondContact O-NZ 2.94Å; L168-K175 WeakPolarHBondContact O-CE 3.44Å; L168-K175 PolarHBondContact O-NZ 3.21Å; L168-K175 VanDerWaalsContact O-NZ 3.16Å; I170-K175 HydrophobicContact CD1-CG 3.61Å; I170-K175 HydrophobicContact CG1-CD 4.26Å; I170-K175 HydrophobicContact CG1-CG 3.57Å; I170-K175 WeakPolarHBondContact O-CE 3.5Å; H171-K175 PolarHBondContact O-N 3.05Å; Q172-K175 WeakPolarHBondContact O-CB 3.45Å; Q172-K175 PolarHBondContact O-N 3.34Å; H173-K175 VanDerWaalsContact C-N 3.34Å; H173-K175 PolarHBondContact O-N 3.19Å; K175-R179 VanDerWaalsContact O-CB 3.29Å; K175-R179 WeakPolarHBondContact O-CB 3.47Å; K175-R179 PolarHBondContact O-N 3.05Å
176Q90.8Very high90.8Very high101 Ų10161.8 Ų61.847%0.47231%0.307SS..Hα-helixtrans-66.8-42.4178.2-71174.4-11.900112.4Q172 H173 T174 R179 K180Q172-Q176 PolarHBondContact O-N 3.29Å; Q172-Q176 VanDerWaalsContact O-N 3.08Å; H173-Q176 WeakPolarHBondContact O-CB 3.49Å; H173-Q176 PolarHBondContact O-N 2.97Å; T174-Q176 VanDerWaalsContact C-N 3.29Å; T174-Q176 PolarHBondContact O-N 3.39Å; Q176-R179 PolarHBondContact O-N 3.41Å; Q176-K180 PolarHBondContact O-N 3.29Å; Q176-K180 VanDerWaalsContact O-N 3.1Å
177I91.4Very high91.1Very high59 Ų5960.3 Ų60.330%0.30330%0.298SS..Hα-helixtrans-64.5-46.8176.6-63.8171.1000110.3H173 T174 R179 K180 H181 L215H173-I177 VanDerWaalsContact CE1-CD1 3.4Å; H173-I177 WeakPolarHBondContact CE1-CD1 3.33Å; H173-I177 PolarHBondContact O-N 2.88Å; T174-I177 PolarHBondContact O-N 3.48Å; I177-R179 VanDerWaalsContact C-N 3.33Å; I177-R179 PolarHBondContact O-N 3.31Å; I177-K180 PolarHBondContact O-N 2.95Å; I177-H181 PolarHBondContact O-CD2 3.14Å; I177-H181 PolarHBondContact O-N 2.96Å; I177-H181 VanDerWaalsContact O-N 3.09Å; I177-L215 HydrophobicContact CB-CD1 4.46Å; I177-L215 HydrophobicContact CG2-CD1 3.7Å; I177-L215 HydrophobicContact CG2-CD2 3.86Å; I177-L215 HydrophobicContact CG2-CG 4.44Å
178L91.9Very high91.5Very high2 Ų258.6 Ų58.61%0.0129%0.292CS..Hα-helixtrans-60.1-43.1176.6-80.1172000112.4L165 I170 T174 H181 A182 A211 V212 L215L165-L178 HydrophobicContact CD2-CB 4.02Å; L165-L178 HydrophobicContact CD2-CD1 4.28Å; I170-L178 HydrophobicContact CD1-CD1 3.36Å; T174-L178 HydrophobicContact CG2-CD1 4.22Å; T174-L178 WeakPolarHBondContact O-CB 3.43Å; T174-L178 WeakPolarHBondContact O-CG 3.47Å; T174-L178 PolarHBondContact O-N 3.37Å; L178-H181 PolarHBondContact O-N 2.95Å; L178-A182 VanDerWaalsContact O-CB 3.32Å; L178-A182 WeakPolarHBondContact O-CB 3.46Å; L178-A182 PolarHBondContact O-N 3.31Å; L178-A211 HydrophobicContact CD2-CB 3.85Å; L178-V212 HydrophobicContact CD1-CG2 3.95Å; L178-V212 HydrophobicContact CD2-CB 4.28Å; L178-V212 HydrophobicContact CD2-CG2 3.5Å; L178-V212 HydrophobicContact CG-CG2 4.41Å; L178-L215 HydrophobicContact CD2-CD1 3.41Å; L178-L215 VanDerWaalsContact CD2-CD1 3.41Å; L178-L215 HydrophobicContact CD2-CG 4.39Å; L178-L215 HydrophobicContact CG-CD1 3.71Å
179R94.6Very high92.1Very high56 Ų5658.3 Ų58.321%0.21129%0.291CS..Hα-helixtrans-55.3-54.3175.6-174-177.8-70.996.5-0.2110I161 D162 L165 K175 Q176 I177 H181 A182 Q183I161-R179 HydrophobicContact CG2-CG 4.38Å; D162-R179 IonicContact OD1-CZ 2.87Å; D162-R179 VanDerWaalsContact OD1-CZ 3.26Å; D162-R179 IonicContact OD1-NE 2.62Å; D162-R179 PolarHBondContact OD1-NE 3.42Å; D162-R179 IonicContact OD1-NH2 3.78Å; D162-R179 PolarHBondContact OD1-NH2 3.23Å; L165-R179 HydrophobicContact CD1-CB 3.73Å; L165-R179 HydrophobicContact CD1-CG 4.29Å; K175-R179 VanDerWaalsContact O-CB 3.29Å; K175-R179 WeakPolarHBondContact O-CB 3.47Å; K175-R179 PolarHBondContact O-N 3.05Å; Q176-R179 PolarHBondContact O-N 3.41Å; I177-R179 VanDerWaalsContact C-N 3.33Å; I177-R179 PolarHBondContact O-N 3.31Å; R179-H181 VanDerWaalsContact C-N 3.34Å; R179-H181 PolarHBondContact O-N 3.05Å; R179-A182 PolarHBondContact O-N 3.1Å; R179-A182 VanDerWaalsContact O-N 3.12Å; R179-Q183 HydrophobicContact CG-CG 4.16Å; R179-Q183 WeakPolarHBondContact O-CG 3.33Å; R179-Q183 PolarHBondContact O-N 3.16Å
180K93.8Very high92.7Very high148 Ų14853.4 Ų53.464%0.64326%0.26SS*.Hα-helixtrans-55.4-46.6179.9-73.1-174.3174.8-171.50112.8Q176 I177 Q183 T184Q176-K180 PolarHBondContact O-N 3.29Å; Q176-K180 VanDerWaalsContact O-N 3.1Å; I177-K180 PolarHBondContact O-N 2.95Å; K180-Q183 PolarHBondContact O-N 3.25Å; K180-T184 PolarHBondContact O-N 2.94Å; K180-T184 PolarHBondContact O-OG1 3.38Å; K180-T184 VanDerWaalsContact O-OG1 3.1Å
181H94.1Very high93.3Very high78 Ų7852.6 Ų52.636%0.36126%0.256SS..Hα-helixtrans-64-43177.3-73.1-58.7000112.8I177 L178 R179 Q183 T184 F185 A211I177-H181 PolarHBondContact O-CD2 3.14Å; I177-H181 PolarHBondContact O-N 2.96Å; I177-H181 VanDerWaalsContact O-N 3.09Å; L178-H181 PolarHBondContact O-N 2.95Å; R179-H181 VanDerWaalsContact C-N 3.34Å; R179-H181 PolarHBondContact O-N 3.05Å; H181-Q183 VanDerWaalsContact C-N 3.32Å; H181-Q183 PolarHBondContact O-N 2.81Å; H181-T184 PolarHBondContact O-N 3.02Å; H181-F185 WeakPolarHBondContact O-CD2 3.33Å; H181-F185 WeakPolarHBondContact O-CG 3.29Å; H181-F185 PolarHBondContact O-N 3.22Å; H181-A211 HydrophobicContact CB-CB 3.71Å
182A96.4Very high93.6Very high0 Ų046.3 Ų46.30%023%0.228CC..Hα-helixtrans-63.2-38.9176.900000111.6I161 L178 R179 F185 V186 V208 A211I161-A182 HydrophobicContact CD1-CB 3.79Å; I161-A182 HydrophobicContact CG1-CB 4.3Å; I161-A182 HydrophobicContact CG2-CB 4.4Å; L178-A182 VanDerWaalsContact O-CB 3.32Å; L178-A182 WeakPolarHBondContact O-CB 3.46Å; L178-A182 PolarHBondContact O-N 3.31Å; R179-A182 PolarHBondContact O-N 3.1Å; R179-A182 VanDerWaalsContact O-N 3.12Å; A182-F185 PolarHBondContact O-N 2.9Å; A182-V186 WeakPolarHBondContact O-CG2 3.5Å; A182-V186 PolarHBondContact O-N 2.94Å; A182-V208 HydrophobicContact CB-CG2 4.13Å; A182-A211 HydrophobicContact CB-CB 4.47Å
183Q96.4Very high93.9Very high23 Ų2343.3 Ų43.311%0.10722%0.218CC..Hα-helixtrans-62.1-43.9175.5-66.9173.4-54.900111.5H158 R179 K180 H181 F185 V186 A187H158-Q183 WeakPolarHBondContact NE2-CG 3.44Å; R179-Q183 HydrophobicContact CG-CG 4.16Å; R179-Q183 WeakPolarHBondContact O-CG 3.33Å; R179-Q183 PolarHBondContact O-N 3.16Å; K180-Q183 PolarHBondContact O-N 3.25Å; H181-Q183 VanDerWaalsContact C-N 3.32Å; H181-Q183 PolarHBondContact O-N 2.81Å; Q183-F185 VanDerWaalsContact C-N 3.32Å; Q183-F185 PolarHBondContact O-N 2.74Å; Q183-V186 WeakPolarHBondContact O-CB 3.39Å; Q183-V186 PolarHBondContact O-N 2.8Å; Q183-A187 PolarHBondContact O-N 2.94Å
184T95.4Very high94Very high78 Ų7843.4 Ų43.448%0.47922%0.216SC..Hα-helixtrans-58.6-43.1172.8-53.40000111.8K180 H181 A187 L188K180-T184 PolarHBondContact O-N 2.94Å; K180-T184 PolarHBondContact O-OG1 3.38Å; K180-T184 VanDerWaalsContact O-OG1 3.1Å; H181-T184 PolarHBondContact O-N 3.02Å; T184-A187 PolarHBondContact O-N 3.21Å; T184-L188 HydrophobicContact CG2-CD1 4.4Å; T184-L188 WeakPolarHBondContact O-CG 3.42Å; T184-L188 PolarHBondContact O-N 3.26Å
185F96.9Very high94.1Very high20 Ų2041.9 Ų41.99%0.08821%0.206CC..Hα-helixtrans-65.3-40.5176.5-68.4-45.6000112.8H181 A182 Q183 A187 L188 C189 S207 A210 A211 I251 L255H181-F185 WeakPolarHBondContact O-CD2 3.33Å; H181-F185 WeakPolarHBondContact O-CG 3.29Å; H181-F185 PolarHBondContact O-N 3.22Å; A182-F185 PolarHBondContact O-N 2.9Å; Q183-F185 VanDerWaalsContact C-N 3.32Å; Q183-F185 PolarHBondContact O-N 2.74Å; F185-A187 VanDerWaalsContact C-N 3.34Å; F185-A187 PolarHBondContact O-N 2.87Å; F185-L188 HydrophobicContact CD1-CD1 4.27Å; F185-L188 PolarHBondContact O-N 3.47Å; F185-C189 WeakPolarHBondContact O-CB 3.14Å; F185-C189 PolarHBondContact O-N 2.87Å; F185-C189 PolarHBondContact O-SG 3.05Å; F185-S207 WeakPolarHBondContact CB-OG 3.36Å; F185-S207 WeakPolarHBondContact CD2-O 3.28Å; F185-A210 HydrophobicContact CD2-CB 4.06Å; F185-A210 HydrophobicContact CE2-CB 3.81Å; F185-A210 HydrophobicContact CZ-CB 4.25Å; F185-A211 HydrophobicContact CD2-CB 4.31Å; F185-A211 HydrophobicContact CE2-CB 4.06Å; F185-I251 HydrophobicContact CB-CG2 3.79Å; F185-I251 HydrophobicContact CD1-CG2 3.49Å; F185-I251 VanDerWaalsContact CD1-CG2 3.49Å; F185-I251 HydrophobicContact CD2-CG2 4.43Å; F185-I251 HydrophobicContact CE1-CG2 4.18Å; F185-I251 HydrophobicContact CG-CG2 3.66Å; F185-L255 HydrophobicContact CE1-CB 4.24Å; F185-L255 HydrophobicContact CE1-CD1 4.16Å; F185-L255 HydrophobicContact CE1-CD2 3.89Å; F185-L255 HydrophobicContact CE1-CG 4.29Å; F185-L255 HydrophobicContact CZ-CD2 4.34Å
186V97.8Very high94.1Very high2 Ų241 Ų411%0.01220%0.203CC..Hα-helixtrans-59.1-46.3174.4167.90000110.9P79 P157 I161 A182 Q183 C189 A190 I203P79-V186 HydrophobicContact CB-CG1 4.23Å; P79-V186 HydrophobicContact CG-CG1 3.74Å; P157-V186 HydrophobicContact CB-CB 4.41Å; P157-V186 HydrophobicContact CB-CG1 3.83Å; P157-V186 HydrophobicContact CB-CG2 3.61Å; P157-V186 HydrophobicContact CG-CG1 3.88Å; P157-V186 HydrophobicContact CG-CG2 4.41Å; I161-V186 HydrophobicContact CD1-CG2 3.74Å; A182-V186 WeakPolarHBondContact O-CG2 3.5Å; A182-V186 PolarHBondContact O-N 2.94Å; Q183-V186 WeakPolarHBondContact O-CB 3.39Å; Q183-V186 PolarHBondContact O-N 2.8Å; V186-C189 WeakPolarHBondContact O-CB 3.38Å; V186-C189 PolarHBondContact O-N 3.38Å; V186-A190 PolarHBondContact O-N 3.48Å; V186-I203 HydrophobicContact CG2-CG2 4.27Å
187A96.5Very high94Very high16 Ų1638.7 Ų38.713%0.13220%0.201CC..Hα-helixtrans-60.8-4617700000111.5L65 F78 Q183 T184 F185 C189 A190 T191L65-A187 HydrophobicContact CD1-CB 4.02Å; L65-A187 HydrophobicContact CD2-CB 4.35Å; F78-A187 HydrophobicContact CD1-CB 4.21Å; F78-A187 HydrophobicContact CE1-CB 4.2Å; Q183-A187 PolarHBondContact O-N 2.94Å; T184-A187 PolarHBondContact O-N 3.21Å; F185-A187 VanDerWaalsContact C-N 3.34Å; F185-A187 PolarHBondContact O-N 2.87Å; A187-C189 PolarHBondContact O-N 2.92Å; A187-A190 PolarHBondContact O-N 3.42Å; A187-T191 PolarHBondContact O-N 3.47Å
188L95.7Very high94.1Very high28 Ų2838 Ų3815%0.14720%0.198CC..Hα-helixtrans-57.5-48.7174.9-74.4172.1000111.7T184 F185 A190 T191 L254 L255T184-L188 HydrophobicContact CG2-CD1 4.4Å; T184-L188 WeakPolarHBondContact O-CG 3.42Å; T184-L188 PolarHBondContact O-N 3.26Å; F185-L188 HydrophobicContact CD1-CD1 4.27Å; F185-L188 PolarHBondContact O-N 3.47Å; L188-A190 VanDerWaalsContact C-N 3.3Å; L188-A190 PolarHBondContact O-N 3.48Å; L188-T191 PolarHBondContact O-N 2.82Å; L188-T191 VanDerWaalsContact O-N 3.14Å; L188-T191 PolarHBondContact O-OG1 3.27Å; L188-L254 HydrophobicContact CB-CD2 4.12Å; L188-L254 WeakPolarHBondContact O-CD2 3.32Å; L188-L255 HydrophobicContact CD1-CB 4.44Å; L188-L255 HydrophobicContact CD1-CD1 3.65Å
189C97.1Very high94.3Very high1 Ų139.5 Ų39.51%0.00721%0.207CC..Hα-helixtrans-56.9-44177.7-67.10000111.8F185 V186 A187 T191 D192 F195 I203 I251F185-C189 WeakPolarHBondContact O-CB 3.14Å; F185-C189 PolarHBondContact O-N 2.87Å; F185-C189 PolarHBondContact O-SG 3.05Å; V186-C189 WeakPolarHBondContact O-CB 3.38Å; V186-C189 PolarHBondContact O-N 3.38Å; A187-C189 PolarHBondContact O-N 2.92Å; C189-T191 PolarHBondContact O-N 2.88Å; C189-D192 PolarHBondContact O-N 2.86Å; C189-F195 HydrophobicContact CB-CB 4.07Å; C189-F195 HydrophobicContact CB-CD1 3.78Å; C189-F195 HydrophobicContact CB-CD2 4.13Å; C189-F195 HydrophobicContact CB-CE1 4.28Å; C189-F195 HydrophobicContact CB-CG 3.71Å; C189-F195 VanDerWaalsContact SG-CE1 3.52Å; C189-I203 HydrophobicContact CB-CG2 3.88Å; C189-I251 VanDerWaalsContact SG-CG1 3.57Å
190A96.5Very high94.3Very high16 Ų1637.4 Ų37.413%0.13220%0.201CC..Hα-helixtrans-61.4-29.8-178.600000112.4R57 F78 M82 V186 A187 L188R57-A190 VanDerWaalsContact CZ-O 3.32Å; R57-A190 PolarHBondContact NH1-O 2.88Å; R57-A190 PolarHBondContact NH2-O 3.07Å; F78-A190 HydrophobicContact CD1-CB 4.46Å; F78-A190 HydrophobicContact CE1-CB 3.72Å; F78-A190 HydrophobicContact CZ-CB 4.16Å; M82-A190 HydrophobicContact CB-CB 4.3Å; M82-A190 HydrophobicContact CG-CB 4.09Å; V186-A190 PolarHBondContact O-N 3.48Å; A187-A190 PolarHBondContact O-N 3.42Å; L188-A190 VanDerWaalsContact C-N 3.3Å; L188-A190 PolarHBondContact O-N 3.48Å
191T95.1Very high94.5Very high8 Ų830.5 Ų30.55%0.04917%0.172CC..Hα-helixtrans-74.2-24.3175.8710000114.2R57 A61 L65 F78 A187 L188 C189R57-T191 PolarHBondContact NH1-O 3.27Å; A61-T191 HydrophobicContact CB-CG2 4.28Å; L65-T191 HydrophobicContact CD2-CG2 4.37Å; F78-T191 HydrophobicContact CE1-CG2 4.43Å; F78-T191 HydrophobicContact CZ-CG2 4.01Å; A187-T191 PolarHBondContact O-N 3.47Å; L188-T191 PolarHBondContact O-N 2.82Å; L188-T191 VanDerWaalsContact O-N 3.14Å; L188-T191 PolarHBondContact O-OG1 3.27Å; C189-T191 PolarHBondContact O-N 2.88Å
192D94Very high94.6Very high23 Ų2327.6 Ų27.612%0.12316%0.158CC..SBendtrans-98.5141-173.4-166-75.6000112.4C189 K194 F195 L254C189-D192 PolarHBondContact O-N 2.86Å; D192-K194 VanDerWaalsContact C-N 3.29Å; D192-K194 PolarHBondContact O-N 3.17Å; D192-K194 VanDerWaalsContact OD1-CB 3.27Å; D192-K194 WeakPolarHBondContact OD1-CB 3.19Å; D192-K194 WeakPolarHBondContact OD1-CG 3.2Å; D192-K194 PolarHBondContact OD1-N 3.48Å; D192-F195 HydrophobicContact CB-CD2 4.06Å; D192-F195 HydrophobicContact CB-CE2 4.44Å; D192-F195 PolarHBondContact O-N 2.96Å; D192-L254 HydrophobicContact CB-CD1 3.96Å; D192-L254 HydrophobicContact CB-CD2 3.8Å; D192-L254 WeakPolarHBondContact OD2-CD1 3.17Å
193V91.5Very high94.6Very high55 Ų5528.5 Ų28.533%0.33316%0.163SC..G310 helixtrans-72.5-20.1-175.6-64.60000114F45 P54 F195 I196F45-V193 HydrophobicContact CE2-CG1 4.08Å; F45-V193 HydrophobicContact CZ-CG1 4.32Å; P54-V193 HydrophobicContact CB-CG1 3.85Å; P54-V193 HydrophobicContact CB-CG2 4.44Å; V193-F195 PolarHBondContact O-N 3.25Å; V193-I196 HydrophobicContact CB-CD1 3.86Å; V193-I196 HydrophobicContact CG1-CD1 3.94Å; V193-I196 WeakPolarHBondContact O-CG1 3.5Å; V193-I196 PolarHBondContact O-N 2.71Å
194K90.1Very high94.7Very high128 Ų12827.4 Ų27.456%0.55716%0.158SC*.G310 helixtrans-63.1-26.7178.7-66.8172.6-175.3177.20112.4D192D192-K194 VanDerWaalsContact C-N 3.29Å; D192-K194 PolarHBondContact O-N 3.17Å; D192-K194 VanDerWaalsContact OD1-CB 3.27Å; D192-K194 WeakPolarHBondContact OD1-CB 3.19Å; D192-K194 WeakPolarHBondContact OD1-CG 3.2Å; D192-K194 PolarHBondContact OD1-N 3.48Å
195F89.4Confident94.7Very high7 Ų723.7 Ų23.73%0.03114%0.135CC..G310 helixtrans-94.8-5.2-174.1-63.8-94.1000113.6C189 D192 V193 A197 L198 I203 Q250 I251 L254C189-F195 HydrophobicContact CB-CB 4.07Å; C189-F195 HydrophobicContact CB-CD1 3.78Å; C189-F195 HydrophobicContact CB-CD2 4.13Å; C189-F195 HydrophobicContact CB-CE1 4.28Å; C189-F195 HydrophobicContact CB-CG 3.71Å; C189-F195 VanDerWaalsContact SG-CE1 3.52Å; D192-F195 HydrophobicContact CB-CD2 4.06Å; D192-F195 HydrophobicContact CB-CE2 4.44Å; D192-F195 PolarHBondContact O-N 2.96Å; V193-F195 PolarHBondContact O-N 3.25Å; F195-A197 PolarHBondContact O-N 3.47Å; F195-L198 HydrophobicContact CD1-CD1 3.65Å; F195-L198 HydrophobicContact CE1-CD1 4.13Å; F195-L198 HydrophobicContact CG-CD1 4.4Å; F195-L198 PolarHBondContact O-N 3.25Å; F195-L198 VanDerWaalsContact O-N 3.08Å; F195-I203 HydrophobicContact CB-CD1 4.27Å; F195-I203 HydrophobicContact CD1-CG1 4.35Å; F195-Q250 HydrophobicContact CZ-CB 3.97Å; F195-I251 HydrophobicContact CE1-CD1 4.25Å; F195-I251 HydrophobicContact CE1-CG1 3.58Å; F195-I251 HydrophobicContact CZ-CG1 3.74Å; F195-L254 HydrophobicContact CD2-CD2 4.43Å; F195-L254 HydrophobicContact CE2-CD2 3.84Å
196I90.6Very high94.7Very high13 Ų1322.7 Ų22.77%0.06713%0.131CC..THydrogen-bonded Turntrans-55.4-39.6179.1-68171.4000111.5P40 Y44 F45 V193P40-I196 HydrophobicContact CB-CG2 4.29Å; P40-I196 HydrophobicContact CG-CG2 3.61Å; P40-I196 VanDerWaalsContact CG-O 3.32Å; P40-I196 WeakPolarHBondContact CG-O 3.42Å; Y44-I196 HydrophobicContact CE1-CD1 4.11Å; Y44-I196 HydrophobicContact CE1-CG2 3.97Å; F45-I196 HydrophobicContact CE2-CD1 3.9Å; V193-I196 HydrophobicContact CB-CD1 3.86Å; V193-I196 HydrophobicContact CG1-CD1 3.94Å; V193-I196 WeakPolarHBondContact O-CG1 3.5Å; V193-I196 PolarHBondContact O-N 2.71Å
197A89.1Confident94.7Very high52 Ų5222.6 Ų22.643%0.4313%0.13SC..THydrogen-bonded Turntrans-84.5-9.1-175.900000113.7P42 F195P42-A197 HydrophobicContact CB-CB 3.73Å; F195-A197 PolarHBondContact O-N 3.47Å
198L93.2Very high94.6Very high45 Ų4522 Ų2224%0.23612%0.124CC..SBendtrans-88.5136.1-174.4-66.3-179.2000110.4F195 M202 I203F195-L198 HydrophobicContact CD1-CD1 3.65Å; F195-L198 HydrophobicContact CE1-CD1 4.13Å; F195-L198 HydrophobicContact CG-CD1 4.4Å; F195-L198 PolarHBondContact O-N 3.25Å; F195-L198 VanDerWaalsContact O-N 3.08Å; L198-M202 HydrophobicContact CD2-CG 4.41Å; L198-I203 HydrophobicContact CB-CD1 4.25Å; L198-I203 HydrophobicContact CB-CG1 3.93Å
199P95.3Very high94.5Very high32 Ų3220.7 Ų20.721%0.20812%0.118CC..  trans-64.9147.4176.125.2-31000111.2E35 L39 S201 M202 I203E35-P199 HydrophobicContact CG-CB 4.15Å; L39-P199 HydrophobicContact CD2-CB 4.44Å; P199-S201 PolarHBondContact O-N 3.32Å; P199-S201 VanDerWaalsContact O-N 3.14Å; P199-M202 HydrophobicContact CG-CB 3.8Å; P199-M202 WeakPolarHBondContact O-CB 3.36Å; P199-M202 PolarHBondContact O-N 3.14Å; P199-I203 PolarHBondContact O-N 3.25Å; P199-I203 VanDerWaalsContact O-N 3.14Å
200P96.3Very high94.3Very high12 Ų1220.8 Ų20.88%0.07812%0.119CC..Hα-helixtrans-50-36.4176.3-28.132.9000114.3E35 V155 P157 F160 I203 A204E35-P200 HydrophobicContact CB-CG 4.35Å; E35-P200 WeakPolarHBondContact OE2-CD 3.41Å; V155-P200 WeakPolarHBondContact O-CG 3.04Å; P157-P200 HydrophobicContact CG-CB 4.05Å; F160-P200 HydrophobicContact CD2-CB 4.15Å; F160-P200 HydrophobicContact CE2-CB 3.96Å; P200-I203 PolarHBondContact O-N 3.23Å; P200-A204 VanDerWaalsContact O-CB 3.27Å; P200-A204 WeakPolarHBondContact O-CB 3.47Å; P200-A204 PolarHBondContact O-N 2.91Å
201S96.9Very high94.1Very high4 Ų420.1 Ų20.13%0.02811%0.114CC..Hα-helixtrans-62.1-41.517664.80000113.3E35 P199 A205E35-S201 VanDerWaalsContact CD-OG 3.22Å; E35-S201 VanDerWaalsContact OE1-CB 3.27Å; E35-S201 WeakPolarHBondContact OE1-CB 3.43Å; E35-S201 PolarHBondContact OE1-OG 2.94Å; E35-S201 WeakPolarHBondContact OE2-CB 3.06Å; E35-S201 PolarHBondContact OE2-N 2.91Å; E35-S201 PolarHBondContact OE2-OG 3.47Å; E35-S201 VanDerWaalsContact OE2-OG 3.06Å; P199-S201 PolarHBondContact O-N 3.32Å; P199-S201 VanDerWaalsContact O-N 3.14Å; S201-A205 VanDerWaalsContact O-CB 3.28Å; S201-A205 WeakPolarHBondContact O-CB 3.48Å; S201-A205 PolarHBondContact O-N 3.22Å
202M96.8Very high93.7Very high17 Ų1719.8 Ų19.88%0.08411%0.111CC..Hα-helixtrans-67.1-45.7176.6-178.87074.200110.9L198 P199 A204 A205 G206 I237 S239 C243 L244 C247L198-M202 HydrophobicContact CD2-CG 4.41Å; P199-M202 HydrophobicContact CG-CB 3.8Å; P199-M202 WeakPolarHBondContact O-CB 3.36Å; P199-M202 PolarHBondContact O-N 3.14Å; M202-A204 VanDerWaalsContact C-N 3.32Å; M202-A204 PolarHBondContact O-N 3.06Å; M202-A205 PolarHBondContact O-N 2.71Å; M202-G206 PolarHBondContact O-N 2.93Å; M202-I237 HydrophobicContact CE-CD1 4.44Å; M202-I237 HydrophobicContact SD-CD1 4.23Å; M202-S239 WeakPolarHBondContact CE-OG 3.49Å; M202-C243 HydrophobicContact CE-CB 4.03Å; M202-L244 HydrophobicContact SD-CB 4.26Å; M202-L244 HydrophobicContact SD-CD1 4.02Å; M202-C247 HydrophobicContact CG-CB 4.08Å; M202-C247 HydrophobicContact SD-CB 4.06Å
203I96.9Very high93.3Very high18 Ų1821.4 Ų21.49%0.09212%0.118CC..Hα-helixtrans-60.8-44.9177.8-61.3175.7000110P157 V186 C189 F195 L198 P199 P200 S207P157-I203 HydrophobicContact CB-CG2 4.34Å; P157-I203 HydrophobicContact CG-CB 4.24Å; P157-I203 HydrophobicContact CG-CG2 4.13Å; V186-I203 HydrophobicContact CG2-CG2 4.27Å; C189-I203 HydrophobicContact CB-CG2 3.88Å; F195-I203 HydrophobicContact CB-CD1 4.27Å; F195-I203 HydrophobicContact CD1-CG1 4.35Å; L198-I203 HydrophobicContact CB-CD1 4.25Å; L198-I203 HydrophobicContact CB-CG1 3.93Å; P199-I203 PolarHBondContact O-N 3.25Å; P199-I203 VanDerWaalsContact O-N 3.14Å; P200-I203 PolarHBondContact O-N 3.23Å; I203-S207 WeakPolarHBondContact O-CB 3.22Å; I203-S207 PolarHBondContact O-N 2.98Å; I203-S207 PolarHBondContact O-OG 3.4Å
204A97.3Very high92.9Very high0 Ų020.6 Ų20.60%012%0.121CC..Hα-helixtrans-61.8-47.3177.200000112.2P157 F160 I161 F164 P200 M202 S207 V208P157-A204 HydrophobicContact CB-CB 4.02Å; P157-A204 VanDerWaalsContact O-CB 3.26Å; P157-A204 WeakPolarHBondContact O-CB 3.27Å; F160-A204 HydrophobicContact CB-CB 3.54Å; F160-A204 HydrophobicContact CG-CB 4.5Å; I161-A204 HydrophobicContact CG1-CB 3.98Å; F164-A204 HydrophobicContact CD2-CB 4.43Å; F164-A204 HydrophobicContact CE2-CB 3.79Å; P200-A204 VanDerWaalsContact O-CB 3.27Å; P200-A204 WeakPolarHBondContact O-CB 3.47Å; P200-A204 PolarHBondContact O-N 2.91Å; M202-A204 VanDerWaalsContact C-N 3.32Å; M202-A204 PolarHBondContact O-N 3.06Å; A204-S207 PolarHBondContact O-N 3.04Å; A204-V208 WeakPolarHBondContact O-CG2 3.3Å; A204-V208 PolarHBondContact O-N 3.42Å
205A96.4Very high92.3Very high0 Ų016.5 Ų16.50%011%0.105CC..Hα-helixtrans-65.1-44.8-178.900000111.4F164 S201 M202 S207 V208 A209 L233 I237 L244F164-A205 HydrophobicContact CE2-CB 3.86Å; F164-A205 HydrophobicContact CZ-CB 4.36Å; S201-A205 VanDerWaalsContact O-CB 3.28Å; S201-A205 WeakPolarHBondContact O-CB 3.48Å; S201-A205 PolarHBondContact O-N 3.22Å; M202-A205 PolarHBondContact O-N 2.71Å; A205-S207 VanDerWaalsContact C-N 3.33Å; A205-S207 PolarHBondContact O-N 3.47Å; A205-V208 PolarHBondContact O-N 3.41Å; A205-A209 WeakPolarHBondContact O-CB 3.31Å; A205-A209 PolarHBondContact O-N 3.49Å; A205-L233 HydrophobicContact CB-CB 4.24Å; A205-L233 HydrophobicContact CB-CD1 4.34Å; A205-I237 HydrophobicContact CB-CD1 3.94Å; A205-I237 HydrophobicContact CB-CG2 4.36Å; A205-L244 HydrophobicContact CB-CD1 3.5Å; A205-L244 HydrophobicContact CB-CD2 4.33Å
206G96.3Very high91.4Very high0 Ų018.8 Ų18.80%011%0.114CC..Hα-helixtrans-62-41.4175.300000111.9M202 A209 A210M202-G206 PolarHBondContact O-N 2.93Å; G206-A209 PolarHBondContact O-N 3.41Å; G206-A210 WeakPolarHBondContact O-CB 3.32Å; G206-A210 PolarHBondContact O-N 3.31Å
207S96.9Very high89.9Confident0 Ų024.4 Ų24.40%014%0.143CC..Hα-helixtrans-64.3-42.6177-62.30000112.4F185 I203 A204 A205 A211F185-S207 WeakPolarHBondContact CB-OG 3.36Å; F185-S207 WeakPolarHBondContact CD2-O 3.28Å; I203-S207 WeakPolarHBondContact O-CB 3.22Å; I203-S207 PolarHBondContact O-N 2.98Å; I203-S207 PolarHBondContact O-OG 3.4Å; A204-S207 PolarHBondContact O-N 3.04Å; A205-S207 VanDerWaalsContact C-N 3.33Å; A205-S207 PolarHBondContact O-N 3.47Å; S207-A211 VanDerWaalsContact O-CB 3.26Å; S207-A211 WeakPolarHBondContact O-CB 3.3Å; S207-A211 PolarHBondContact O-N 3.4Å
208V95Very high88.2Confident2 Ų230.9 Ų30.91%0.01216%0.162CC..Hα-helixtrans-66.9-42.6175.8171.30000110.8I161 F164 L168 A182 A204 A205 A211 V212 L233I161-V208 HydrophobicContact CG1-CG2 4.03Å; I161-V208 HydrophobicContact CG2-CG2 4.32Å; F164-V208 HydrophobicContact CD2-CG2 4.33Å; L168-V208 HydrophobicContact CD1-CG1 4.46Å; A182-V208 HydrophobicContact CB-CG2 4.13Å; A204-V208 WeakPolarHBondContact O-CG2 3.3Å; A204-V208 PolarHBondContact O-N 3.42Å; A205-V208 PolarHBondContact O-N 3.41Å; V208-A211 PolarHBondContact O-N 3.34Å; V208-V212 HydrophobicContact CG1-CG2 4.46Å; V208-V212 WeakPolarHBondContact O-CG2 3.38Å; V208-V212 PolarHBondContact O-N 3.37Å; V208-L233 HydrophobicContact CB-CD1 4.4Å; V208-L233 HydrophobicContact CG1-CD1 4.24Å
209A93Very high86.4Confident1 Ų131.5 Ų31.51%0.00817%0.17CC..Hα-helixtrans-61.2-47.5177.200000111.7A205 G206 A211 V212 Q213 L233 Q248A205-A209 WeakPolarHBondContact O-CB 3.31Å; A205-A209 PolarHBondContact O-N 3.49Å; G206-A209 PolarHBondContact O-N 3.41Å; A209-A211 PolarHBondContact O-N 3.06Å; A209-V212 PolarHBondContact O-N 2.89Å; A209-Q213 WeakPolarHBondContact O-CB 3.43Å; A209-Q213 PolarHBondContact O-N 3.2Å; A209-L233 HydrophobicContact CB-CD1 4.46Å; A209-Q248 HydrophobicContact CB-CG 4.25Å
210A92.9Very high84.3Confident4 Ų440.3 Ų40.33%0.03321%0.205CC..Hα-helixtrans-61.4-41.8175.700000112.1F185 G206 Q213 G214 Q248 I251 E252F185-A210 HydrophobicContact CD2-CB 4.06Å; F185-A210 HydrophobicContact CE2-CB 3.81Å; F185-A210 HydrophobicContact CZ-CB 4.25Å; G206-A210 WeakPolarHBondContact O-CB 3.32Å; G206-A210 PolarHBondContact O-N 3.31Å; A210-Q213 PolarHBondContact O-N 2.96Å; A210-G214 PolarHBondContact O-N 3.36Å; A210-Q248 HydrophobicContact CB-CG 4.07Å; A210-I251 HydrophobicContact CB-CG2 4.28Å; A210-E252 HydrophobicContact CB-CG 4.23Å
211A92.3Very high82.3Confident2 Ų245.6 Ų45.62%0.01723%0.232CC..Hα-helixtrans-64.1-43.1177.800000112.4L178 H181 A182 F185 S207 V208 A209 L215L178-A211 HydrophobicContact CD2-CB 3.85Å; H181-A211 HydrophobicContact CB-CB 3.71Å; A182-A211 HydrophobicContact CB-CB 4.47Å; F185-A211 HydrophobicContact CD2-CB 4.31Å; F185-A211 HydrophobicContact CE2-CB 4.06Å; S207-A211 VanDerWaalsContact O-CB 3.26Å; S207-A211 WeakPolarHBondContact O-CB 3.3Å; S207-A211 PolarHBondContact O-N 3.4Å; V208-A211 PolarHBondContact O-N 3.34Å; A209-A211 PolarHBondContact O-N 3.06Å; A211-L215 WeakPolarHBondContact O-CG 3.44Å; A211-L215 PolarHBondContact O-N 3.21Å; A211-L215 VanDerWaalsContact O-N 3.11Å
212V88.5Confident80.2Confident1 Ų149.1 Ų49.11%0.00627%0.269CS..Hα-helixtrans-62.4-50.4174.3168.80000109.7L178 V208 A209 G214 L215 Y216 L229L178-V212 HydrophobicContact CD1-CG2 3.95Å; L178-V212 HydrophobicContact CD2-CB 4.28Å; L178-V212 HydrophobicContact CD2-CG2 3.5Å; L178-V212 HydrophobicContact CG-CG2 4.41Å; V208-V212 HydrophobicContact CG1-CG2 4.46Å; V208-V212 WeakPolarHBondContact O-CG2 3.38Å; V208-V212 PolarHBondContact O-N 3.37Å; A209-V212 PolarHBondContact O-N 2.89Å; V212-G214 VanDerWaalsContact C-N 3.32Å; V212-G214 PolarHBondContact O-N 3.5Å; V212-L215 PolarHBondContact O-N 3.09Å; V212-Y216 HydrophobicContact CB-CD2 4.33Å; V212-Y216 HydrophobicContact CG1-CD2 3.47Å; V212-Y216 VanDerWaalsContact CG1-CD2 3.47Å; V212-Y216 HydrophobicContact CG1-CE2 3.73Å; V212-Y216 VanDerWaalsContact O-CD2 3.25Å; V212-Y216 WeakPolarHBondContact O-CD2 3.31Å; V212-Y216 PolarHBondContact O-N 3.35Å; V212-L229 HydrophobicContact CB-CD2 3.62Å; V212-L229 HydrophobicContact CG1-CD2 3.66Å; V212-L229 HydrophobicContact CG2-CD2 3.52Å
213Q85.2Confident78.2Confident57 Ų5752.8 Ų52.827%0.26630%0.302SS..Hα-helixtrans-54.2-48.4179-175.765.116.400111.8A209 A210 L215 L217 S226A209-Q213 WeakPolarHBondContact O-CB 3.43Å; A209-Q213 PolarHBondContact O-N 3.2Å; A210-Q213 PolarHBondContact O-N 2.96Å; Q213-L215 PolarHBondContact O-N 3.17Å; Q213-L217 HydrophobicContact CG-CD1 4.13Å; Q213-L217 WeakPolarHBondContact O-CB 3.5Å; Q213-L217 WeakPolarHBondContact O-CD1 3.47Å; Q213-L217 VanDerWaalsContact O-CG 3.29Å; Q213-L217 WeakPolarHBondContact O-CG 3.29Å; Q213-L217 PolarHBondContact O-N 3.06Å; Q213-S226 PolarHBondContact OE1-OG 3.3Å
214G82.5Confident76.4Confident38 Ų3853.2 Ų53.239%0.39231%0.305SS..Hα-helixtrans-63.9-34.6179.900000114.6A210 V212A210-G214 PolarHBondContact O-N 3.36Å; V212-G214 VanDerWaalsContact C-N 3.32Å; V212-G214 PolarHBondContact O-N 3.5Å
215L77.1Confident75.1Confident42 Ų4255.5 Ų55.522%0.2232%0.321CS..Hα-helixtrans-79-41.5177.9-71-179.8000112.8I177 L178 A211 V212 Q213 K218I177-L215 HydrophobicContact CB-CD1 4.46Å; I177-L215 HydrophobicContact CG2-CD1 3.7Å; I177-L215 HydrophobicContact CG2-CD2 3.86Å; I177-L215 HydrophobicContact CG2-CG 4.44Å; L178-L215 HydrophobicContact CD2-CD1 3.41Å; L178-L215 VanDerWaalsContact CD2-CD1 3.41Å; L178-L215 HydrophobicContact CD2-CG 4.39Å; L178-L215 HydrophobicContact CG-CD1 3.71Å; A211-L215 WeakPolarHBondContact O-CG 3.44Å; A211-L215 PolarHBondContact O-N 3.21Å; A211-L215 VanDerWaalsContact O-N 3.11Å; V212-L215 PolarHBondContact O-N 3.09Å; Q213-L215 PolarHBondContact O-N 3.17Å; L215-K218 WeakPolarHBondContact O-CB 3.47Å; L215-K218 PolarHBondContact O-N 3.01Å; L215-K218 VanDerWaalsContact O-N 3.15Å
216Y70.3Confident73.9Confident54 Ų5457.1 Ų57.121%0.21233%0.332CS..Hα-helixtrans-80.5-18.7-177.6-74.4-84.9000113.4V212 K218 S219V212-Y216 HydrophobicContact CB-CD2 4.33Å; V212-Y216 HydrophobicContact CG1-CD2 3.47Å; V212-Y216 VanDerWaalsContact CG1-CD2 3.47Å; V212-Y216 HydrophobicContact CG1-CE2 3.73Å; V212-Y216 VanDerWaalsContact O-CD2 3.25Å; V212-Y216 WeakPolarHBondContact O-CD2 3.31Å; V212-Y216 PolarHBondContact O-N 3.35Å; Y216-K218 PolarHBondContact O-N 2.69Å; Y216-K218 VanDerWaalsContact O-N 3.09Å; Y216-S219 CarbonylContact O-C 3.51Å; Y216-S219 PolarHBondContact O-N 3.17Å
217L59.2Low72.8Confident131 Ų13164.2 Ų64.269%0.68637%0.365SS*.THydrogen-bonded Turntrans-55-23.5162.1-84.4160.6000112.5Q213Q213-L217 HydrophobicContact CG-CD1 4.13Å; Q213-L217 WeakPolarHBondContact O-CB 3.5Å; Q213-L217 WeakPolarHBondContact O-CD1 3.47Å; Q213-L217 VanDerWaalsContact O-CG 3.29Å; Q213-L217 WeakPolarHBondContact O-CG 3.29Å; Q213-L217 PolarHBondContact O-N 3.06Å
218K54.7Low72.1Confident188 Ų18869.3 Ų69.382%0.81739%0.392SS*.THydrogen-bonded Turntrans-96.6-12.3176.7-58.6-177.1180178.10114.1L215 Y216L215-K218 WeakPolarHBondContact O-CB 3.47Å; L215-K218 PolarHBondContact O-N 3.01Å; L215-K218 VanDerWaalsContact O-N 3.15Å; Y216-K218 PolarHBondContact O-N 2.69Å; Y216-K218 VanDerWaalsContact O-N 3.09Å
219S54.4Low71.6Confident59 Ų5969.3 Ų69.341%0.41339%0.392SS..  trans-128.6117.4-174.3-161.60000111.3Y216 D221Y216-S219 CarbonylContact O-C 3.51Å; Y216-S219 PolarHBondContact O-N 3.17Å; S219-D221 PolarHBondContact O-N 3.04Å
220K52.1Low71.3Confident217 Ų21769.8 Ų69.894%0.94340%0.395SS*.  trans-69.52-176.7-77.1-176174.1-179.80115G222K220-G222 PolarHBondContact O-N 2.99Å
221D52.6Low71Confident122 Ų12272.8 Ų72.865%0.65241%0.411SS*.  trans-83.398.7-177.9-82.6-26.4000112.2S219 A223S219-D221 PolarHBondContact O-N 3.04Å; D221-A223 VanDerWaalsContact C-N 3.27Å; D221-A223 PolarHBondContact O-N 3.4Å
222G54.3Low70.9Confident78 Ų7875.8 Ų75.880%0.80442%0.424SS*.THydrogen-bonded Turntrans-76.744.8-175.700000116.5K220K220-G222 PolarHBondContact O-N 2.99Å
223A53.6Low71Confident94 Ų9475.8 Ų75.878%0.77742%0.423SS*.THydrogen-bonded Turntrans-77.9-26.4175.500000113.4D221D221-A223 VanDerWaalsContact C-N 3.27Å; D221-A223 PolarHBondContact O-N 3.4Å
224L60.8Low71.3Confident27 Ų2773.1 Ų73.114%0.14141%0.411CS..SBendtrans-124.896.8174.7-86.2146.6000108L168 I170 S226 L229L168-L224 HydrophobicContact CD2-CD2 4.2Å; I170-L224 HydrophobicContact CG2-CD1 3.5Å; I170-L224 VanDerWaalsContact CG2-CD1 3.5Å; L224-S226 PolarHBondContact O-N 2.91Å; L224-L229 HydrophobicContact CD2-CB 4.29Å; L224-L229 HydrophobicContact CD2-CD1 4.27Å
225S68.9Low71.7Confident48 Ų4878.5 Ų78.534%0.33643%0.426SS..  trans-65.9133.4165.279.70000107.8Q227 N228 L229S225-Q227 PolarHBondContact O-N 3.08Å; S225-Q227 VanDerWaalsContact O-N 3.13Å; S225-N228 PolarHBondContact O-N 3.5Å; S225-N228 VanDerWaalsContact OG-CB 3.25Å; S225-N228 WeakPolarHBondContact OG-CB 3.23Å; S225-N228 PolarHBondContact OG-N 3.37Å; S225-N228 VanDerWaalsContact OG-N 3.14Å; S225-N228 PolarHBondContact OG-ND2 3.33Å; S225-N228 VanDerWaalsContact OG-ND2 3.15Å; S225-N228 PolarHBondContact OG-OD1 3.3Å; S225-L229 PolarHBondContact O-N 3.05Å; S225-L229 VanDerWaalsContact O-N 3.08Å
226S71Confident72.3Confident34 Ų3477.5 Ų77.524%0.23842%0.422CS..Hα-helixtrans-48.9-40.3177.5-173.90000111.7Q213 L224 N228 L229 T230Q213-S226 PolarHBondContact OE1-OG 3.3Å; L224-S226 PolarHBondContact O-N 2.91Å; S226-N228 PolarHBondContact O-N 2.91Å; S226-L229 PolarHBondContact O-N 3.32Å; S226-T230 PolarHBondContact O-N 3.03Å; S226-T230 PolarHBondContact O-OG1 3.39Å
227Q74.1Confident73.3Confident150 Ų15075.6 Ų75.670%0.70142%0.415SS*.Hα-helixtrans-65.8-38178-156.9166.414.700113.6S225 N231S225-Q227 PolarHBondContact O-N 3.08Å; S225-Q227 VanDerWaalsContact O-N 3.13Å; Q227-N231 WeakPolarHBondContact O-CB 3.43Å; Q227-N231 VanDerWaalsContact O-CG 3.24Å; Q227-N231 PolarHBondContact O-N 3.42Å; Q227-N231 VanDerWaalsContact O-N 3.1Å; Q227-N231 PolarHBondContact O-ND2 3.33Å
228N81.1Confident74.8Confident106 Ų10677.3 Ų77.357%0.56741%0.413SS*.Hα-helixtrans-69.4-35.8175.3-70.1-6.2000111.4S225 S226 F232S225-N228 PolarHBondContact O-N 3.5Å; S225-N228 VanDerWaalsContact OG-CB 3.25Å; S225-N228 WeakPolarHBondContact OG-CB 3.23Å; S225-N228 PolarHBondContact OG-N 3.37Å; S225-N228 VanDerWaalsContact OG-N 3.14Å; S225-N228 PolarHBondContact OG-ND2 3.33Å; S225-N228 VanDerWaalsContact OG-ND2 3.15Å; S225-N228 PolarHBondContact OG-OD1 3.3Å; S226-N228 PolarHBondContact O-N 2.91Å; N228-F232 WeakPolarHBondContact O-CB 3.42Å; N228-F232 PolarHBondContact O-N 2.88Å
229L85.7Confident76.5Confident2 Ų270 Ų701%0.0139%0.385CS..Hα-helixtrans-67.3-46.1176.3179.363.5000111.6L168 V212 L224 S225 S226 N231 F232 L233L168-L229 HydrophobicContact CD1-CD1 4.32Å; L168-L229 HydrophobicContact CD2-CD1 3.59Å; V212-L229 HydrophobicContact CB-CD2 3.62Å; V212-L229 HydrophobicContact CG1-CD2 3.66Å; V212-L229 HydrophobicContact CG2-CD2 3.52Å; L224-L229 HydrophobicContact CD2-CB 4.29Å; L224-L229 HydrophobicContact CD2-CD1 4.27Å; S225-L229 PolarHBondContact O-N 3.05Å; S225-L229 VanDerWaalsContact O-N 3.08Å; S226-L229 PolarHBondContact O-N 3.32Å; L229-N231 VanDerWaalsContact C-N 3.29Å; L229-N231 PolarHBondContact O-N 3.5Å; L229-F232 HydrophobicContact CD1-CD1 4.31Å; L229-F232 PolarHBondContact O-N 2.83Å; L229-L233 HydrophobicContact CD1-CD1 3.88Å; L229-L233 HydrophobicContact CD1-CD2 4.38Å; L229-L233 HydrophobicContact CD1-CG 3.84Å; L229-L233 HydrophobicContact CD2-CD1 4.4Å; L229-L233 HydrophobicContact CG-CD1 3.83Å; L229-L233 HydrophobicContact CG-CG 4.18Å; L229-L233 WeakPolarHBondContact O-CB 3.44Å; L229-L233 WeakPolarHBondContact O-CG 3.3Å; L229-L233 PolarHBondContact O-N 3.34Å
230T85.8Confident78.3Confident12 Ų1271.2 Ų71.27%0.07439%0.387CS..Hα-helixtrans-59.6-41.8176.6-52.60000111S226 S234 L244S226-T230 PolarHBondContact O-N 3.03Å; S226-T230 PolarHBondContact O-OG1 3.39Å; T230-S234 WeakPolarHBondContact O-CB 3.43Å; T230-S234 PolarHBondContact O-N 3.4Å; T230-S234 PolarHBondContact O-OG 3.49Å; T230-L244 HydrophobicContact CG2-CB 4.26Å; T230-L244 HydrophobicContact CG2-CD2 3.78Å; T230-L244 HydrophobicContact CG2-CG 3.94Å; T230-L244 WeakPolarHBondContact O-CD2 3.45Å
231N87.3Confident80.1Confident66 Ų6663 Ų6335%0.35336%0.356SS..Hα-helixtrans-66.1-39.2175.2-72.3-19.5000113Q227 L229 S234 Q235Q227-N231 WeakPolarHBondContact O-CB 3.43Å; Q227-N231 VanDerWaalsContact O-CG 3.24Å; Q227-N231 PolarHBondContact O-N 3.42Å; Q227-N231 VanDerWaalsContact O-N 3.1Å; Q227-N231 PolarHBondContact O-ND2 3.33Å; L229-N231 VanDerWaalsContact C-N 3.29Å; L229-N231 PolarHBondContact O-N 3.5Å; N231-S234 WeakPolarHBondContact CA-OG 3.3Å; N231-S234 PolarHBondContact O-OG 3.04Å; N231-Q235 VanDerWaalsContact O-CG 3.22Å; N231-Q235 WeakPolarHBondContact O-CG 3.45Å; N231-Q235 PolarHBondContact O-N 3.42Å
232F89.2Confident82Confident66 Ų6662.8 Ų62.829%0.28936%0.355SS..Hα-helixtrans-65.6-50.6175.8169-103.6000111.3K167 L168 N228 L229 S234 Q235 V236K167-F232 HydrophobicContact CB-CE1 4.34Å; K167-F232 HydrophobicContact CB-CZ 3.84Å; K167-F232 HydrophobicContact CD-CZ 4.03Å; L168-F232 HydrophobicContact CD2-CD1 4.38Å; L168-F232 HydrophobicContact CD2-CE1 4.24Å; N228-F232 WeakPolarHBondContact O-CB 3.42Å; N228-F232 PolarHBondContact O-N 2.88Å; L229-F232 HydrophobicContact CD1-CD1 4.31Å; L229-F232 PolarHBondContact O-N 2.83Å; F232-S234 PolarHBondContact O-N 3.29Å; F232-Q235 PolarHBondContact O-N 3.42Å; F232-V236 HydrophobicContact CD1-CG2 4.4Å; F232-V236 HydrophobicContact CD2-CG2 4.15Å; F232-V236 HydrophobicContact CE1-CG2 4.01Å; F232-V236 HydrophobicContact CE2-CG2 3.74Å; F232-V236 HydrophobicContact CG-CG2 4.47Å; F232-V236 HydrophobicContact CZ-CG2 3.66Å; F232-V236 VanDerWaalsContact O-CG2 3.23Å; F232-V236 WeakPolarHBondContact O-CG2 3.43Å; F232-V236 PolarHBondContact O-N 2.9Å
233L91.4Very high83.9Confident0 Ų062.2 Ų62.20%034%0.338CS..Hα-helixtrans-63.9-40.8-178.5-69.2177.3000111.6F164 A205 V208 A209 L229 Q235 V236 I237 L244F164-L233 HydrophobicContact CB-CD2 3.9Å; F164-L233 HydrophobicContact CD1-CD2 3.95Å; F164-L233 HydrophobicContact CD2-CD2 3.97Å; F164-L233 HydrophobicContact CG-CD2 3.66Å; A205-L233 HydrophobicContact CB-CB 4.24Å; A205-L233 HydrophobicContact CB-CD1 4.34Å; V208-L233 HydrophobicContact CB-CD1 4.4Å; V208-L233 HydrophobicContact CG1-CD1 4.24Å; A209-L233 HydrophobicContact CB-CD1 4.46Å; L229-L233 HydrophobicContact CD1-CD1 3.88Å; L229-L233 HydrophobicContact CD1-CD2 4.38Å; L229-L233 HydrophobicContact CD1-CG 3.84Å; L229-L233 HydrophobicContact CD2-CD1 4.4Å; L229-L233 HydrophobicContact CG-CD1 3.83Å; L229-L233 HydrophobicContact CG-CG 4.18Å; L229-L233 WeakPolarHBondContact O-CB 3.44Å; L229-L233 WeakPolarHBondContact O-CG 3.3Å; L229-L233 PolarHBondContact O-N 3.34Å; L233-Q235 VanDerWaalsContact C-N 3.35Å; L233-Q235 PolarHBondContact O-N 2.85Å; L233-V236 PolarHBondContact O-N 2.96Å; L233-V236 VanDerWaalsContact O-N 3.14Å; L233-I237 WeakPolarHBondContact O-CG1 3.49Å; L233-I237 PolarHBondContact O-N 3.2Å; L233-L244 HydrophobicContact CB-CD2 3.71Å
234S91.4Very high85.8Confident2 Ų257.8 Ų57.81%0.01430%0.301CS..Hα-helixtrans-62.1-40.7176.864.30000112.2T230 N231 F232 R238 S239T230-S234 WeakPolarHBondContact O-CB 3.43Å; T230-S234 PolarHBondContact O-N 3.4Å; T230-S234 PolarHBondContact O-OG 3.49Å; N231-S234 WeakPolarHBondContact CA-OG 3.3Å; N231-S234 PolarHBondContact O-OG 3.04Å; F232-S234 PolarHBondContact O-N 3.29Å; S234-R238 WeakPolarHBondContact O-CA 3.5Å; S234-R238 PolarHBondContact O-N 2.75Å; S234-S239 WeakPolarHBondContact CB-O 3.45Å; S234-S239 PolarHBondContact O-N 3.15Å
235Q90.5Very high87.3Confident150 Ų15061.6 Ų61.670%0.70132%0.316SS*.Hα-helixtrans-63.1-41.5172-73.2174.28.900112.2N231 F232 L233 R238N231-Q235 VanDerWaalsContact O-CG 3.22Å; N231-Q235 WeakPolarHBondContact O-CG 3.45Å; N231-Q235 PolarHBondContact O-N 3.42Å; F232-Q235 PolarHBondContact O-N 3.42Å; L233-Q235 VanDerWaalsContact C-N 3.35Å; L233-Q235 PolarHBondContact O-N 2.85Å; Q235-R238 PolarHBondContact O-N 3.08Å
236V89.8Confident88.5Confident22 Ų2261.7 Ų61.713%0.13332%0.317CS..Hα-helixtrans-65.9-42.6-179.1171.20000111.7L28 F164 F232 L233 R238L28-V236 HydrophobicContact CD2-CG1 3.48Å; L28-V236 VanDerWaalsContact CD2-CG1 3.48Å; F164-V236 HydrophobicContact CD1-CG1 4.07Å; F164-V236 HydrophobicContact CE1-CG1 3.72Å; F232-V236 HydrophobicContact CD1-CG2 4.4Å; F232-V236 HydrophobicContact CD2-CG2 4.15Å; F232-V236 HydrophobicContact CE1-CG2 4.01Å; F232-V236 HydrophobicContact CE2-CG2 3.74Å; F232-V236 HydrophobicContact CG-CG2 4.47Å; F232-V236 HydrophobicContact CZ-CG2 3.66Å; F232-V236 VanDerWaalsContact O-CG2 3.23Å; F232-V236 WeakPolarHBondContact O-CG2 3.43Å; F232-V236 PolarHBondContact O-N 2.9Å; L233-V236 PolarHBondContact O-N 2.96Å; L233-V236 VanDerWaalsContact O-N 3.14Å; V236-R238 VanDerWaalsContact C-N 3.33Å
237I91.9Very high89.7Confident13 Ų1360.2 Ų60.27%0.06731%0.307CS..Hα-helixtrans-86.7-2.7178.172-177.3000113.3L32 F164 M202 A205 L233 S239L32-I237 HydrophobicContact CD2-CB 4.35Å; F164-I237 HydrophobicContact CE1-CG2 3.94Å; F164-I237 HydrophobicContact CE2-CG2 4.45Å; F164-I237 HydrophobicContact CZ-CG2 3.47Å; F164-I237 VanDerWaalsContact CZ-CG2 3.47Å; M202-I237 HydrophobicContact CE-CD1 4.44Å; M202-I237 HydrophobicContact SD-CD1 4.23Å; A205-I237 HydrophobicContact CB-CD1 3.94Å; A205-I237 HydrophobicContact CB-CG2 4.36Å; L233-I237 WeakPolarHBondContact O-CG1 3.49Å; L233-I237 PolarHBondContact O-N 3.2Å; I237-S239 VanDerWaalsContact C-N 3.31Å; I237-S239 PolarHBondContact O-N 3.23Å
238R89.6Confident90.6Very high168 Ų16853.8 Ų53.863%0.63428%0.276SS*.THydrogen-bonded Turntrans56.641.9-176.2-54.9177.7177.6167.2-1.5113.2S234 Q235 V236S234-R238 WeakPolarHBondContact O-CA 3.5Å; S234-R238 PolarHBondContact O-N 2.75Å; Q235-R238 PolarHBondContact O-N 3.08Å; V236-R238 VanDerWaalsContact C-N 3.33Å
239S91Very high91.2Very high33 Ų3353.5 Ų53.523%0.23127%0.272CS..  trans-113.6160.6176.5-177.80000111.2M202 S234 I237M202-S239 WeakPolarHBondContact CE-OG 3.49Å; S234-S239 WeakPolarHBondContact CB-O 3.45Å; S234-S239 PolarHBondContact O-N 3.15Å; I237-S239 VanDerWaalsContact C-N 3.31Å; I237-S239 PolarHBondContact O-N 3.23Å
240D91.6Very high91.7Very high85 Ų8556.5 Ų56.546%0.45529%0.286SS..  trans-61.3129.7167.9-165.5-44.7000110.5D242 C243 L244D240-D242 PolarHBondContact O-N 3.34Å; D240-D242 WeakPolarHBondContact OD1-CB 3.19Å; D240-D242 PolarHBondContact OD1-N 2.98Å; D240-C243 HydrophobicContact CB-CB 4.24Å; D240-C243 WeakPolarHBondContact O-CB 3.24Å; D240-C243 PolarHBondContact O-N 3.01Å; D240-L244 PolarHBondContact O-N 3.31Å
241P91.3Very high92.2Very high46 Ų4656 Ų5630%0.29928%0.283SS..Hα-helixtrans-53.4-34.4173.1-22.429.8000114.1L244 K245P241-L244 PolarHBondContact O-N 3Å; P241-K245 WeakPolarHBondContact O-CB 3.41Å; P241-K245 PolarHBondContact O-N 3.03Å
242D92.3Very high92.4Very high117 Ų11755.8 Ų55.863%0.62628%0.28SS*.Hα-helixtrans-70.4-36.3-179.5-70-30.7000111.3D240 K245 S246D240-D242 PolarHBondContact O-N 3.34Å; D240-D242 WeakPolarHBondContact OD1-CB 3.19Å; D240-D242 PolarHBondContact OD1-N 2.98Å; D242-K245 PolarHBondContact O-N 3.2Å; D242-S246 WeakPolarHBondContact O-CB 3.38Å; D242-S246 PolarHBondContact O-N 3.12Å
243C93.3Very high92.7Very high66 Ų6655.8 Ų55.845%0.44629%0.287SS..Hα-helixtrans-64-43172.7-67.70000111.5M202 D240 S246 C247M202-C243 HydrophobicContact CE-CB 4.03Å; D240-C243 HydrophobicContact CB-CB 4.24Å; D240-C243 WeakPolarHBondContact O-CB 3.24Å; D240-C243 PolarHBondContact O-N 3.01Å; C243-S246 PolarHBondContact O-N 3.44Å; C243-C247 WeakPolarHBondContact O-CB 3.48Å; C243-C247 PolarHBondContact O-N 3Å
244L94.1Very high92.8Very high0 Ų056.2 Ų56.20%029%0.29CS..Hα-helixtrans-64.4-42.5177.2177.959000111.5M202 A205 T230 L233 D240 P241 C247 Q248M202-L244 HydrophobicContact SD-CB 4.26Å; M202-L244 HydrophobicContact SD-CD1 4.02Å; A205-L244 HydrophobicContact CB-CD1 3.5Å; A205-L244 HydrophobicContact CB-CD2 4.33Å; T230-L244 HydrophobicContact CG2-CB 4.26Å; T230-L244 HydrophobicContact CG2-CD2 3.78Å; T230-L244 HydrophobicContact CG2-CG 3.94Å; T230-L244 WeakPolarHBondContact O-CD2 3.45Å; L233-L244 HydrophobicContact CB-CD2 3.71Å; D240-L244 PolarHBondContact O-N 3.31Å; P241-L244 PolarHBondContact O-N 3Å; L244-C247 WeakPolarHBondContact O-CB 3.36Å; L244-C247 PolarHBondContact O-N 2.93Å; L244-Q248 PolarHBondContact O-N 3.11Å
245K92.5Very high92.8Very high107 Ų10758.8 Ų58.847%0.46530%0.303SS..Hα-helixtrans-62.6-44.1176-171.3-179178.1-169.50111.7P241 D242 C247 Q248 E249P241-K245 WeakPolarHBondContact O-CB 3.41Å; P241-K245 PolarHBondContact O-N 3.03Å; D242-K245 PolarHBondContact O-N 3.2Å; K245-C247 VanDerWaalsContact C-N 3.31Å; K245-C247 PolarHBondContact O-N 2.94Å; K245-Q248 WeakPolarHBondContact O-CB 3.31Å; K245-Q248 PolarHBondContact O-N 3Å; K245-E249 VanDerWaalsContact CE-OE1 3.28Å; K245-E249 WeakPolarHBondContact CE-OE1 3.5Å; K245-E249 WeakPolarHBondContact O-CG 3.38Å; K245-E249 PolarHBondContact O-N 3.46Å
246S94.1Very high92.9Very high51 Ų5156.7 Ų56.736%0.35729%0.293SS..Hα-helixtrans-61.3-40174.8-175.10000111.9D242 C243 E249 Q250D242-S246 WeakPolarHBondContact O-CB 3.38Å; D242-S246 PolarHBondContact O-N 3.12Å; C243-S246 PolarHBondContact O-N 3.44Å; S246-E249 PolarHBondContact O-N 3.28Å; S246-Q250 WeakPolarHBondContact O-CB 3.43Å; S246-Q250 VanDerWaalsContact O-CG 3.24Å; S246-Q250 WeakPolarHBondContact O-CG 3.18Å; S246-Q250 PolarHBondContact O-N 3.48Å; S246-Q250 PolarHBondContact O-NE2 3.44Å; S246-Q250 PolarHBondContact OG-NE2 3.17Å
247C95Very high93Very high3 Ų357.7 Ų57.72%0.0230%0.301CS..Hα-helixtrans-61.5-46.9174.6-1760000111.2M202 C243 L244 K245 E249 Q250 I251M202-C247 HydrophobicContact CG-CB 4.08Å; M202-C247 HydrophobicContact SD-CB 4.06Å; C243-C247 WeakPolarHBondContact O-CB 3.48Å; C243-C247 PolarHBondContact O-N 3Å; L244-C247 WeakPolarHBondContact O-CB 3.36Å; L244-C247 PolarHBondContact O-N 2.93Å; K245-C247 VanDerWaalsContact C-N 3.31Å; K245-C247 PolarHBondContact O-N 2.94Å; C247-E249 PolarHBondContact O-N 3.28Å; C247-Q250 WeakPolarHBondContact O-CB 3.4Å; C247-Q250 PolarHBondContact O-N 3.49Å; C247-I251 VanDerWaalsContact O-CG1 3.31Å; C247-I251 WeakPolarHBondContact O-CG1 3.49Å; C247-I251 PolarHBondContact O-N 3.09Å
248Q94.6Very high92.9Very high14 Ų1458.3 Ų58.37%0.06531%0.307CS..Hα-helixtrans-56.3-50.6175.6-178.7-168.4-19.700112A209 A210 L244 K245 Q250 I251 E252A209-Q248 HydrophobicContact CB-CG 4.25Å; A210-Q248 HydrophobicContact CB-CG 4.07Å; L244-Q248 PolarHBondContact O-N 3.11Å; K245-Q248 WeakPolarHBondContact O-CB 3.31Å; K245-Q248 PolarHBondContact O-N 3Å; Q248-Q250 VanDerWaalsContact C-N 3.27Å; Q248-Q250 PolarHBondContact O-N 3.17Å; Q248-I251 WeakPolarHBondContact O-CB 3.45Å; Q248-I251 PolarHBondContact O-N 3.43Å; Q248-I251 VanDerWaalsContact O-N 3.08Å; Q248-E252 PolarHBondContact NE2-OE1 3.4Å; Q248-E252 WeakPolarHBondContact O-CG 3.35Å; Q248-E252 PolarHBondContact O-N 2.91Å
249E93.5Very high92.9Very high100 Ų10054.8 Ų54.847%0.46730%0.3SS..Hα-helixtrans-60.7-36.7179.3-70.9171.1-17800111.9K245 S246 C247 E252 S253K245-E249 VanDerWaalsContact CE-OE1 3.28Å; K245-E249 WeakPolarHBondContact CE-OE1 3.5Å; K245-E249 WeakPolarHBondContact O-CG 3.38Å; K245-E249 PolarHBondContact O-N 3.46Å; S246-E249 PolarHBondContact O-N 3.28Å; C247-E249 PolarHBondContact O-N 3.28Å; E249-E252 PolarHBondContact O-N 3.41Å; E249-S253 WeakPolarHBondContact O-CB 3.35Å; E249-S253 PolarHBondContact O-N 3.18Å
250Q95.6Very high92.8Very high66 Ų6660.5 Ų60.531%0.30832%0.317SS..Hα-helixtrans-66.4-37.7174.6-73.3176.359.200112.5F195 S246 C247 Q248 L254F195-Q250 HydrophobicContact CZ-CB 3.97Å; S246-Q250 WeakPolarHBondContact O-CB 3.43Å; S246-Q250 VanDerWaalsContact O-CG 3.24Å; S246-Q250 WeakPolarHBondContact O-CG 3.18Å; S246-Q250 PolarHBondContact O-N 3.48Å; S246-Q250 PolarHBondContact O-NE2 3.44Å; S246-Q250 PolarHBondContact OG-NE2 3.17Å; C247-Q250 WeakPolarHBondContact O-CB 3.4Å; C247-Q250 PolarHBondContact O-N 3.49Å; Q248-Q250 VanDerWaalsContact C-N 3.27Å; Q248-Q250 PolarHBondContact O-N 3.17Å; Q250-L254 VanDerWaalsContact O-CB 3.31Å; Q250-L254 WeakPolarHBondContact O-CB 3.27Å; Q250-L254 PolarHBondContact O-N 3.04Å
251I95.4Very high92.6Very high1 Ų160.6 Ų60.61%0.00531%0.314CS..Hα-helixtrans-65.9-45.5175.7-66.9173.6000110.5F185 C189 F195 A210 C247 Q248 L254 L255F185-I251 HydrophobicContact CB-CG2 3.79Å; F185-I251 HydrophobicContact CD1-CG2 3.49Å; F185-I251 VanDerWaalsContact CD1-CG2 3.49Å; F185-I251 HydrophobicContact CD2-CG2 4.43Å; F185-I251 HydrophobicContact CE1-CG2 4.18Å; F185-I251 HydrophobicContact CG-CG2 3.66Å; C189-I251 VanDerWaalsContact SG-CG1 3.57Å; F195-I251 HydrophobicContact CE1-CD1 4.25Å; F195-I251 HydrophobicContact CE1-CG1 3.58Å; F195-I251 HydrophobicContact CZ-CG1 3.74Å; A210-I251 HydrophobicContact CB-CG2 4.28Å; C247-I251 VanDerWaalsContact O-CG1 3.31Å; C247-I251 WeakPolarHBondContact O-CG1 3.49Å; C247-I251 PolarHBondContact O-N 3.09Å; Q248-I251 WeakPolarHBondContact O-CB 3.45Å; Q248-I251 PolarHBondContact O-N 3.43Å; Q248-I251 VanDerWaalsContact O-N 3.08Å; I251-L254 WeakPolarHBondContact O-CB 3.41Å; I251-L254 PolarHBondContact O-N 3.43Å; I251-L255 PolarHBondContact O-N 3.38Å
252E93Very high92.2Very high62 Ų6261.2 Ų61.229%0.2932%0.323SS..Hα-helixtrans-61.8-45.4177.6-69.4173.3-174.600111A210 Q248 E249 L254 L255 E256A210-E252 HydrophobicContact CB-CG 4.23Å; Q248-E252 PolarHBondContact NE2-OE1 3.4Å; Q248-E252 WeakPolarHBondContact O-CG 3.35Å; Q248-E252 PolarHBondContact O-N 2.91Å; E249-E252 PolarHBondContact O-N 3.41Å; E252-L254 VanDerWaalsContact C-N 3.32Å; E252-L254 PolarHBondContact O-N 2.94Å; E252-L255 WeakPolarHBondContact O-CB 3.34Å; E252-L255 PolarHBondContact O-N 3.11Å; E252-E256 PolarHBondContact O-N 3.09Å
253S94.1Very high91.7Very high65 Ų6561.6 Ų61.646%0.45532%0.321SS..Hα-helixtrans-61.9-38.9174.7-178.10000112.5E249 E256 S257E249-S253 WeakPolarHBondContact O-CB 3.35Å; E249-S253 PolarHBondContact O-N 3.18Å; S253-E256 PolarHBondContact O-N 3.04Å; S253-S257 PolarHBondContact O-N 3.42Å
254L93.9Very high90.9Very high10 Ų1065 Ų655%0.05233%0.33CS..Hα-helixtrans-63.5-45.2176.3-177.662.8000110.8L188 D192 F195 Q250 I251 E252 E256 S257 S258L188-L254 HydrophobicContact CB-CD2 4.12Å; L188-L254 WeakPolarHBondContact O-CD2 3.32Å; D192-L254 HydrophobicContact CB-CD1 3.96Å; D192-L254 HydrophobicContact CB-CD2 3.8Å; D192-L254 WeakPolarHBondContact OD2-CD1 3.17Å; F195-L254 HydrophobicContact CD2-CD2 4.43Å; F195-L254 HydrophobicContact CE2-CD2 3.84Å; Q250-L254 VanDerWaalsContact O-CB 3.31Å; Q250-L254 WeakPolarHBondContact O-CB 3.27Å; Q250-L254 PolarHBondContact O-N 3.04Å; I251-L254 WeakPolarHBondContact O-CB 3.41Å; I251-L254 PolarHBondContact O-N 3.43Å; E252-L254 VanDerWaalsContact C-N 3.32Å; E252-L254 PolarHBondContact O-N 2.94Å; L254-E256 PolarHBondContact O-N 3.44Å; L254-S257 PolarHBondContact O-N 3.44Å; L254-S257 PolarHBondContact O-OG 3.01Å; L254-S258 PolarHBondContact O-N 3.14Å; L254-S258 PolarHBondContact O-OG 2.93Å
255L92.7Very high89.6Confident55 Ų5571.1 Ų71.129%0.28836%0.359SS..Hα-helixtrans-56.6-50.2175.2-179.973.9000111.3F185 L188 I251 E252 S257 S258 L259F185-L255 HydrophobicContact CE1-CB 4.24Å; F185-L255 HydrophobicContact CE1-CD1 4.16Å; F185-L255 HydrophobicContact CE1-CD2 3.89Å; F185-L255 HydrophobicContact CE1-CG 4.29Å; F185-L255 HydrophobicContact CZ-CD2 4.34Å; L188-L255 HydrophobicContact CD1-CB 4.44Å; L188-L255 HydrophobicContact CD1-CD1 3.65Å; I251-L255 PolarHBondContact O-N 3.38Å; E252-L255 WeakPolarHBondContact O-CB 3.34Å; E252-L255 PolarHBondContact O-N 3.11Å; L255-S257 VanDerWaalsContact C-N 3.27Å; L255-S257 PolarHBondContact O-N 3.48Å; L255-S258 PolarHBondContact O-N 2.66Å; L255-L259 HydrophobicContact CD1-CD1 4.47Å; L255-L259 HydrophobicContact CD2-CD1 4.44Å; L255-L259 HydrophobicContact CG-CD1 4.05Å; L255-L259 HydrophobicContact CG-CG 4.45Å; L255-L259 WeakPolarHBondContact O-CG 3.31Å; L255-L259 PolarHBondContact O-N 3.37Å
256E91.6Very high88.1Confident107 Ų10769 Ų6950%0.536%0.357SS..Hα-helixtrans-57.7-42.5178.8-72.7-174.8-172.300112E252 S253 L254 L259 R260E252-E256 PolarHBondContact O-N 3.09Å; S253-E256 PolarHBondContact O-N 3.04Å; L254-E256 PolarHBondContact O-N 3.44Å; E256-L259 PolarHBondContact O-N 3.5Å; E256-R260 WeakPolarHBondContact O-CG 3.49Å; E256-R260 PolarHBondContact O-N 3.23Å; E256-R260 VanDerWaalsContact O-N 3.09Å; E256-R260 IonicContact OE2-NH2 2.85Å
257S91.1Very high86.5Confident42 Ų4270.6 Ų70.629%0.29437%0.365SS..Hα-helixtrans-65.3-40178.978.70000112.4S253 L254 L255 R260 Q261S253-S257 PolarHBondContact O-N 3.42Å; L254-S257 PolarHBondContact O-N 3.44Å; L254-S257 PolarHBondContact O-OG 3.01Å; L255-S257 VanDerWaalsContact C-N 3.27Å; L255-S257 PolarHBondContact O-N 3.48Å; S257-R260 PolarHBondContact O-N 2.72Å; S257-Q261 WeakPolarHBondContact O-CG 3.37Å; S257-Q261 PolarHBondContact O-N 3.48Å
258S90.4Very high84.7Confident27 Ų2772.9 Ų72.919%0.18938%0.381CS..Hα-helixtrans-67.6-40.5177.6-64.70000111.7L254 L255 R260 Q261 A262L254-S258 PolarHBondContact O-N 3.14Å; L254-S258 PolarHBondContact O-OG 2.93Å; L255-S258 PolarHBondContact O-N 2.66Å; S258-R260 PolarHBondContact O-N 3.25Å; S258-Q261 PolarHBondContact O-N 3.39Å; S258-A262 WeakPolarHBondContact O-CB 3.39Å; S258-A262 PolarHBondContact O-N 3.04Å
259L89.2Confident82.7Confident94 Ų9475.6 Ų75.649%0.49240%0.398SS..Hα-helixtrans-62.9-41.8175.5-71.2172.1000112L255 E256 A262 Q263L255-L259 HydrophobicContact CD1-CD1 4.47Å; L255-L259 HydrophobicContact CD2-CD1 4.44Å; L255-L259 HydrophobicContact CG-CD1 4.05Å; L255-L259 HydrophobicContact CG-CG 4.45Å; L255-L259 WeakPolarHBondContact O-CG 3.31Å; L255-L259 PolarHBondContact O-N 3.37Å; E256-L259 PolarHBondContact O-N 3.5Å; L259-A262 PolarHBondContact O-N 3.08Å; L259-Q263 VanDerWaalsContact O-CG 3.31Å; L259-Q263 WeakPolarHBondContact O-CG 3.23Å; L259-Q263 PolarHBondContact O-N 3.39Å
260R90.4Very high80.8Confident153 Ų15377 Ų7758%0.57741%0.405SS*.Hα-helixtrans-63.9-41.1175.2-70.2177.6-168.3-175.68.3111.9E256 S257 S258 Q263 Q264E256-R260 WeakPolarHBondContact O-CG 3.49Å; E256-R260 PolarHBondContact O-N 3.23Å; E256-R260 VanDerWaalsContact O-N 3.09Å; E256-R260 IonicContact OE2-NH2 2.85Å; S257-R260 PolarHBondContact O-N 2.72Å; S258-R260 PolarHBondContact O-N 3.25Å; R260-Q263 PolarHBondContact O-N 3.02Å; R260-Q264 VanDerWaalsContact O-CG 3.31Å; R260-Q264 WeakPolarHBondContact O-CG 3.31Å; R260-Q264 PolarHBondContact O-N 3.42Å
261Q85.5Confident78.6Confident87 Ų8777.2 Ų77.241%0.40741%0.411SS..Hα-helixtrans-63.3-43.5176.6-75.2169.516.900111.4S257 S258 Q263 Q264 H265S257-Q261 WeakPolarHBondContact O-CG 3.37Å; S257-Q261 PolarHBondContact O-N 3.48Å; S258-Q261 PolarHBondContact O-N 3.39Å; Q261-Q263 PolarHBondContact O-N 3.03Å; Q261-Q264 PolarHBondContact O-N 2.99Å; Q261-H265 PolarHBondContact O-CD2 3.1Å; Q261-H265 PolarHBondContact O-N 2.98Å
262A84.6Confident76.4Confident59 Ų5984 Ų8449%0.48844%0.441SS..Hα-helixtrans-61.9-43.3176.800000112.3S258 L259 H265 S266S258-A262 WeakPolarHBondContact O-CB 3.39Å; S258-A262 PolarHBondContact O-N 3.04Å; L259-A262 PolarHBondContact O-N 3.08Å; A262-H265 PolarHBondContact O-N 3Å; A262-S266 PolarHBondContact O-N 3Å
263Q82.1Confident74.1Confident125 Ų12589.5 Ų89.558%0.58446%0.459SS*.Hα-helixtrans-65.9-37.9177.4-72.4171.8-12.800113L259 R260 Q261 S266 V267L259-Q263 VanDerWaalsContact O-CG 3.31Å; L259-Q263 WeakPolarHBondContact O-CG 3.23Å; L259-Q263 PolarHBondContact O-N 3.39Å; R260-Q263 PolarHBondContact O-N 3.02Å; Q261-Q263 PolarHBondContact O-N 3.03Å; Q263-S266 PolarHBondContact O-N 2.9Å; Q263-S266 PolarHBondContact O-OG 3.49Å; Q263-V267 VanDerWaalsContact O-CG2 3.3Å; Q263-V267 WeakPolarHBondContact O-CG2 3.3Å; Q263-V267 PolarHBondContact O-N 2.98Å
264Q75.5Confident72.1Confident136 Ų13690.9 Ų90.964%0.63646%0.464SS*.Hα-helixtrans-67.1-39.1175.8-73.1172.5-2.600111.5R260 Q261 S268R260-Q264 VanDerWaalsContact O-CG 3.31Å; R260-Q264 WeakPolarHBondContact O-CG 3.31Å; R260-Q264 PolarHBondContact O-N 3.42Å; Q261-Q264 PolarHBondContact O-N 2.99Å; Q264-S268 WeakPolarHBondContact O-CB 3.42Å; Q264-S268 PolarHBondContact O-N 3.34Å; Q264-S268 PolarHBondContact O-OG 3.25Å
265H66.8Low70.1Confident130 Ų13096.8 Ų96.860%0.60249%0.492SS*.Hα-helixtrans-66-40.9175.6-88.9-66.7000112.6Q261 A262 S268 T269Q261-H265 PolarHBondContact O-CD2 3.1Å; Q261-H265 PolarHBondContact O-N 2.98Å; A262-H265 PolarHBondContact O-N 3Å; H265-S268 WeakPolarHBondContact CA-OG 3.5Å; H265-S268 PolarHBondContact O-N 2.73Å; H265-S268 PolarHBondContact O-OG 3.44Å; H265-T269 WeakPolarHBondContact O-CB 3.43Å; H265-T269 PolarHBondContact O-N 3.17Å; H265-T269 PolarHBondContact O-OG1 3.45Å
266S62Low67.9Low61 Ų61100.8 Ų100.843%0.42751%0.509SS..Hα-helixtrans-62.4-44.7176.864.30000112A262 Q263 T269 E270A262-S266 PolarHBondContact O-N 3Å; Q263-S266 PolarHBondContact O-N 2.9Å; Q263-S266 PolarHBondContact O-OG 3.49Å; S266-T269 PolarHBondContact O-N 3.33Å; S266-E270 PolarHBondContact O-N 3.01Å
267V60.1Low65.9Low85 Ų85101.6 Ų101.652%0.51552%0.517SS..Hα-helixtrans-65-42177.5176.50000111.4Q263 T269 E270 T271Q263-V267 VanDerWaalsContact O-CG2 3.3Å; Q263-V267 WeakPolarHBondContact O-CG2 3.3Å; Q263-V267 PolarHBondContact O-N 2.98Å; V267-T269 VanDerWaalsContact C-N 3.34Å; V267-T269 PolarHBondContact O-N 3.14Å; V267-E270 PolarHBondContact O-N 3.38Å; V267-T271 PolarHBondContact O-N 3.08Å; V267-T271 PolarHBondContact O-OG1 2.9Å
268S56.3Low64Low51 Ų51104.4 Ų104.436%0.35753%0.532SS..Hα-helixtrans-67.5-31.117869.40000113.8Q264 H265 K272Q264-S268 WeakPolarHBondContact O-CB 3.42Å; Q264-S268 PolarHBondContact O-N 3.34Å; Q264-S268 PolarHBondContact O-OG 3.25Å; H265-S268 WeakPolarHBondContact CA-OG 3.5Å; H265-S268 PolarHBondContact O-N 2.73Å; H265-S268 PolarHBondContact O-OG 3.44Å; S268-K272 WeakPolarHBondContact O-CG 3.45Å; S268-K272 PolarHBondContact O-N 2.96Å; S268-K272 VanDerWaalsContact O-N 3.14Å
269T54Low61.9Low71 Ų71110.3 Ų110.344%0.43656%0.561SS.*Hα-helixtrans-77.1-36.8178.1-49.70000111.1H265 S266 V267 R273H265-T269 WeakPolarHBondContact O-CB 3.43Å; H265-T269 PolarHBondContact O-N 3.17Å; H265-T269 PolarHBondContact O-OG1 3.45Å; S266-T269 PolarHBondContact O-N 3.33Å; V267-T269 VanDerWaalsContact C-N 3.34Å; V267-T269 PolarHBondContact O-N 3.14Å; T269-R273 PolarHBondContact O-N 2.66Å; T269-R273 VanDerWaalsContact O-N 3.08Å
270E52.2Low60.1Low129 Ų129112.9 Ų112.960%0.60358%0.575SS**Hα-helixtrans-64.9-42.6170.7-76.8179.2166.100111.7S266 V267 K272 R273 V274S266-E270 PolarHBondContact O-N 3.01Å; V267-E270 PolarHBondContact O-N 3.38Å; E270-K272 VanDerWaalsContact C-N 3.35Å; E270-K272 PolarHBondContact O-N 3.39Å; E270-R273 PolarHBondContact O-N 3.28Å; E270-V274 WeakPolarHBondContact O-CG2 3.33Å; E270-V274 PolarHBondContact O-N 3.03Å
271T50.9Low58Low72 Ų72109.9 Ų109.944%0.44258%0.577SS.*Hα-helixtrans-63.8-40.3178.9-42.50000111.6V267 V274 E275V267-T271 PolarHBondContact O-N 3.08Å; V267-T271 PolarHBondContact O-OG1 2.9Å; T271-V274 PolarHBondContact O-N 3.43Å; T271-E275 PolarHBondContact O-N 3.11Å; T271-E275 VanDerWaalsContact O-N 3.11Å
272K49.1Very low55.8Low143 Ų143111.6 Ų111.662%0.62260%0.597SS**Hα-helixtrans-66.9-38174.9-79.6-176.2174.4-173.90113.6S268 E270 V274 E275 E276S268-K272 WeakPolarHBondContact O-CG 3.45Å; S268-K272 PolarHBondContact O-N 2.96Å; S268-K272 VanDerWaalsContact O-N 3.14Å; E270-K272 VanDerWaalsContact C-N 3.35Å; E270-K272 PolarHBondContact O-N 3.39Å; K272-V274 VanDerWaalsContact C-N 3.33Å; K272-E275 PolarHBondContact O-N 3.49Å; K272-E276 PolarHBondContact O-N 3.06Å
273R44.3Very low53.6Low177 Ų177114.8 Ų114.867%0.66861%0.611SS**Hα-helixtrans-65.6-36.3174.7-81.3-175.5177.5-175.7-0.2112.3T269 E270 E276 D277T269-R273 PolarHBondContact O-N 2.66Å; T269-R273 VanDerWaalsContact O-N 3.08Å; E270-R273 PolarHBondContact O-N 3.28Å; R273-E276 PolarHBondContact O-N 3.06Å; R273-D277 PolarHBondContact O-N 3.37Å
274V52.2Low51.7Low95 Ų95115 Ų11558%0.57662%0.623SS**Hα-helixtrans-68.7-36.6176.1174.30000111.5E270 T271 K272 V278E270-V274 WeakPolarHBondContact O-CG2 3.33Å; E270-V274 PolarHBondContact O-N 3.03Å; T271-V274 PolarHBondContact O-N 3.43Å; K272-V274 VanDerWaalsContact C-N 3.33Å; V274-V278 WeakPolarHBondContact O-CG2 3.19Å; V274-V278 PolarHBondContact O-N 3.35Å
275E50.3Low50.3Low134 Ų134114.1 Ų114.163%0.62663%0.627SS**Hα-helixtrans-68.7-38.6174.4-73.8179.7171.100112.6T271 K272T271-E275 PolarHBondContact O-N 3.11Å; T271-E275 VanDerWaalsContact O-N 3.11Å; K272-E275 PolarHBondContact O-N 3.49Å
276E48.4Very low49Very low138 Ų138115.6 Ų115.665%0.64564%0.639SS**Hα-helixtrans-70.4-34.1177-76.6179.3168.700113.5K272 R273K272-E276 PolarHBondContact O-N 3.06Å; R273-E276 PolarHBondContact O-N 3.06Å
277D47.7Very low48.4Very low125 Ų125118.6 Ų118.667%0.66866%0.655SS**Hα-helixtrans-73.4-24.4177-99.3-16.4000113.1R273R273-D277 PolarHBondContact O-N 3.37Å
278V51.9Low47.6Very low101 Ų101125 Ų12561%0.61267%0.67SS**Hα-helixtrans-75.5-27.7177.71730000111.9V274V274-V278 WeakPolarHBondContact O-CG2 3.19Å; V274-V278 PolarHBondContact O-N 3.35Å
279D47.4Very low47Very low151 Ų151129.5 Ų129.581%0.80769%0.69SS**THydrogen-bonded Turntrans-83.1-12.1-178.9-106.3-4.3000114
280L50.6Low46.5Very low148 Ų148133.6 Ų133.678%0.77571%0.707SS**THydrogen-bonded Turntrans-98.70.2-175.8-79161.8000115.1
281S46Very low45.8Very low90 Ų90134.9 Ų134.963%0.62972%0.719SS**  trans-110.564.8-179.7720000113.6
282C38.7Very low45.6Very low123 Ų123142.4 Ų142.483%0.83175%0.754SS**  trans-14186.6160.5-87.10000110.6P284C282-P284 WeakPolarHBondContact O-CD 3.47Å
283T39.7Very low45.4Very low126 Ų126142.4 Ų142.477%0.77376%0.76SS**  trans-80.4117.5157.847.70000108.7T285T283-T285 PolarHBondContact O-N 3.26Å
284P40.9Very low45.4Very low130 Ų130140.6 Ų140.684%0.84477%0.765SS**  trans-79.5110.8175.929.8-27.2000108.6C282C282-P284 WeakPolarHBondContact O-CD 3.47Å
285T46.8Very low45.1Very low117 Ų117143.1 Ų143.172%0.71878%0.776SS**  trans-108.7101164.6-25.60000105.9T283T283-T285 PolarHBondContact O-N 3.26Å
286D39.6Very low44.7Very low160 Ų160143.6 Ų143.686%0.85679%0.785SS**  trans-148.9102.7156.6-115-22.8000111.1
287V48.9Very low44.5Very low124 Ų124144 Ų14475%0.75279%0.793SS**  trans-87.9112.9168.5175.10000106.2
288R44.5Very low44.3Very low220 Ų220145.3 Ų145.383%0.8380%0.802SS**  trans-179.6106.6152-101.4161.2-149.7-142.57.4110.8
289D43.2Very low43.8Very low145 Ų145148.4 Ų148.478%0.77582%0.815SS**  163.1108.7111.4-80.8-19.2000110.4
290I42.3Very low43.5Very low157 Ų157148.2 Ų148.281%0.80582%0.816SS**  trans-86.4121.2165-62.9166.8000105.9
291N38.6Very low42.9Very low157 Ų157148.3 Ų148.384%0.8482%0.819SS**  trans-119.9113.9160.2-84.1-39000108.8
292I45.5Very low42.6Very low230 Ų230153.5 Ų153.5100%1.17984%0.837SS**  trans-92.90152.6-65.1173.8000106.1

Retrieved 292 of 292 residues in 55.4 ms (Link to these results)

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