A0A087X5X2_POEFO Loading...

XK-related protein

AlphaFold DB , UniProt , Accession A0A087X5X2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 418 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
1M29Very low41.5Very low248 Ų248140.2 Ų140.2100%1.22269%0.687SS**  085.50-88.7165.276.200108.1
2E25.1Very low43.4Very low188 Ų188132.7 Ų132.788%0.87965%0.651SS**  trans-120.1119.5161.5-83.6179.814200105.6R4E2-R4 PolarHBondContact O-N 2.58Å; E2-R4 VanDerWaalsContact O-N 3.16Å
3S25.4Very low45.1Very low102 Ų102124.5 Ų124.571%0.71361%0.612SS**  trans-55.3119.2174.154.60000108.4T5S3-T5 VanDerWaalsContact C-N 3.3Å; S3-T5 PolarHBondContact O-N 2.9Å
4R32.5Very low46.6Very low233 Ų233119.3 Ų119.388%0.87958%0.584SS**  trans-56.7101.5163-75.1-178.2177.5170.51.2106.4E2 A6E2-R4 PolarHBondContact O-N 2.58Å; E2-R4 VanDerWaalsContact O-N 3.16Å; R4-A6 PolarHBondContact O-N 2.89Å
5T32.8Very low48Very low120 Ų120113.2 Ų113.274%0.73656%0.561SS**  trans-65.9103.9-177.139.10000107.2S3 S7S3-T5 VanDerWaalsContact C-N 3.3Å; S3-T5 PolarHBondContact O-N 2.9Å; T5-S7 PolarHBondContact O-N 3.5Å
6A39.3Very low49.1Very low78 Ų78107.9 Ų107.965%0.64553%0.534SS*.  trans-46.2120.8160.300000106.7R4 R8R4-A6 PolarHBondContact O-N 2.89Å; A6-R8 PolarHBondContact O-N 3.3Å
7S44.5Very low50Low50 Ų50104.4 Ų104.435%0.3552%0.522SS..  trans-48.7103.4-175.4142.70000108.9T5 Y9 K201T5-S7 PolarHBondContact O-N 3.5Å; S7-Y9 PolarHBondContact O-N 2.85Å; S7-K201 PolarHBondContact OG-NZ 3.07Å
8R50Low51Low228 Ų228102 Ų10286%0.8651%0.513SS*.  trans-60.9125.8175-79.4-177.8174.2176.8-0.3107.4A6 S10A6-R8 PolarHBondContact O-N 3.3Å; R8-S10 PolarHBondContact O-N 2.85Å
9Y53.8Low52.1Low70 Ų70100.1 Ų100.128%0.27551%0.507SS..  trans-57.7108.4170-169.3-105.2000107.8S7 D13 F14 S17S7-Y9 PolarHBondContact O-N 2.85Å; Y9-D13 HydrophobicContact CD2-CB 3.9Å; Y9-D13 HydrophobicContact CE2-CB 3.73Å; Y9-D13 HydrophobicContact CG-CB 4.38Å; Y9-D13 PolarHBondContact OH-O 3.02Å; Y9-F14 HydrophobicContact CD1-CB 4.43Å; Y9-F14 HydrophobicContact CE1-CB 3.66Å; Y9-F14 HydrophobicContact CE1-CD2 4.11Å; Y9-F14 HydrophobicContact CE1-CG 4.38Å; Y9-S17 WeakPolarHBondContact OH-CB 3.31Å
10S63Low52.8Low45 Ų4595.1 Ų95.132%0.31548%0.482SS..  trans-76154-174.6177.50000110.1R8 I12 D13 F14R8-S10 PolarHBondContact O-N 2.85Å; S10-I12 PolarHBondContact O-N 3.37Å; S10-I12 VanDerWaalsContact O-N 3.11Å; S10-I12 PolarHBondContact OG-N 2.7Å; S10-D13 PolarHBondContact N-OD2 3.39Å; S10-D13 VanDerWaalsContact N-OD2 3.1Å; S10-D13 WeakPolarHBondContact O-CA 3.39Å; S10-D13 WeakPolarHBondContact O-CB 3.3Å; S10-D13 PolarHBondContact O-N 3.33Å; S10-F14 PolarHBondContact O-N 3.39Å
11W61.3Low53.5Low180 Ų18092 Ų9268%0.68247%0.468SS*.Hα-helixtrans-54.4-28.4167.5-179.586.4000111.7F14 A15W11-F14 WeakPolarHBondContact O-CB 3.16Å; W11-F14 PolarHBondContact O-N 2.82Å; W11-A15 WeakPolarHBondContact O-CB 3.49Å; W11-A15 PolarHBondContact O-N 3.32Å
12I64.4Low55.5Low50 Ų5083.3 Ų83.326%0.25643%0.431SS..Hα-helixtrans-69.6-40.9174.6-50.5173.9000111S10 F14 A15 F16 W206S10-I12 PolarHBondContact O-N 3.37Å; S10-I12 VanDerWaalsContact O-N 3.11Å; S10-I12 PolarHBondContact OG-N 2.7Å; I12-F14 VanDerWaalsContact C-N 3.26Å; I12-F14 PolarHBondContact O-N 3.18Å; I12-A15 PolarHBondContact O-N 3.37Å; I12-F16 HydrophobicContact CG2-CD2 3.9Å; I12-F16 HydrophobicContact CG2-CE2 3.81Å; I12-F16 WeakPolarHBondContact O-CB 3.39Å; I12-F16 WeakPolarHBondContact O-CD2 3.44Å; I12-F16 PolarHBondContact O-N 3.25Å; I12-F16 VanDerWaalsContact O-N 3.07Å; I12-W206 HydrophobicContact CD1-CZ2 4.29Å
13D64.8Low57.7Low27 Ų2775.9 Ų75.914%0.14440%0.398CS..Hα-helixtrans-64.2-38.2176.1-61.2-33.6000109.7Y9 S10 S17 R192 K201Y9-D13 HydrophobicContact CD2-CB 3.9Å; Y9-D13 HydrophobicContact CE2-CB 3.73Å; Y9-D13 HydrophobicContact CG-CB 4.38Å; Y9-D13 PolarHBondContact OH-O 3.02Å; S10-D13 PolarHBondContact N-OD2 3.39Å; S10-D13 VanDerWaalsContact N-OD2 3.1Å; S10-D13 WeakPolarHBondContact O-CA 3.39Å; S10-D13 WeakPolarHBondContact O-CB 3.3Å; S10-D13 PolarHBondContact O-N 3.33Å; D13-S17 WeakPolarHBondContact O-CB 3.47Å; D13-S17 PolarHBondContact O-N 3.29Å; D13-R192 IonicContact OD1-CZ 3.2Å; D13-R192 VanDerWaalsContact OD1-CZ 3.27Å; D13-R192 IonicContact OD1-NE 3.6Å; D13-R192 PolarHBondContact OD1-NE 2.8Å; D13-R192 IonicContact OD1-NH2 3.27Å; D13-R192 PolarHBondContact OD1-NH2 3.05Å; D13-K201 IonicContact OD2-NZ 3.41Å; D13-K201 PolarHBondContact OD2-NZ 3.22Å; D13-K201 VanDerWaalsContact OD2-NZ 3.08Å
14F65.8Low59.7Low51 Ų5172.1 Ų72.122%0.22437%0.369CS..Hα-helixtrans-64-51.1173.3-177.3-107.1000113.4Y9 S10 W11 I12 F16 S17 V18 W122Y9-F14 HydrophobicContact CD1-CB 4.43Å; Y9-F14 HydrophobicContact CE1-CB 3.66Å; Y9-F14 HydrophobicContact CE1-CD2 4.11Å; Y9-F14 HydrophobicContact CE1-CG 4.38Å; S10-F14 PolarHBondContact O-N 3.39Å; W11-F14 WeakPolarHBondContact O-CB 3.16Å; W11-F14 PolarHBondContact O-N 2.82Å; I12-F14 VanDerWaalsContact C-N 3.26Å; I12-F14 PolarHBondContact O-N 3.18Å; F14-F16 VanDerWaalsContact C-N 3.29Å; F14-F16 PolarHBondContact O-N 3.16Å; F14-S17 WeakPolarHBondContact O-CB 3.37Å; F14-S17 PolarHBondContact O-N 3.08Å; F14-S17 VanDerWaalsContact O-N 3.11Å; F14-V18 HydrophobicContact CD1-CG2 4.19Å; F14-V18 HydrophobicContact CD2-CG2 4.37Å; F14-V18 HydrophobicContact CE1-CG2 3.77Å; F14-V18 HydrophobicContact CE2-CG2 3.96Å; F14-V18 HydrophobicContact CG-CG2 4.48Å; F14-V18 HydrophobicContact CZ-CG2 3.65Å; F14-V18 WeakPolarHBondContact O-CG2 3.39Å; F14-V18 PolarHBondContact O-N 3.12Å; F14-W122 HydrophobicContact CE2-CD2 4.49Å
15A68.1Low61.5Low28 Ų2866.4 Ų66.423%0.23136%0.355CS..Hα-helixtrans-59.5-40.7-179.700000111.7W11 I12 V18 V19W11-A15 WeakPolarHBondContact O-CB 3.49Å; W11-A15 PolarHBondContact O-N 3.32Å; I12-A15 PolarHBondContact O-N 3.37Å; A15-V18 PolarHBondContact O-N 2.68Å; A15-V19 WeakPolarHBondContact O-CB 3.47Å; A15-V19 VanDerWaalsContact O-CG2 3.29Å; A15-V19 WeakPolarHBondContact O-CG2 3.32Å; A15-V19 PolarHBondContact O-N 2.96Å
16F66.1Low63.4Low29 Ų2966.6 Ų66.613%0.12735%0.351CS..Hα-helixtrans-64.5-42174.5-88.7-110.5000112.3I12 F14 V19 G20 W185 R192I12-F16 HydrophobicContact CG2-CD2 3.9Å; I12-F16 HydrophobicContact CG2-CE2 3.81Å; I12-F16 WeakPolarHBondContact O-CB 3.39Å; I12-F16 WeakPolarHBondContact O-CD2 3.44Å; I12-F16 PolarHBondContact O-N 3.25Å; I12-F16 VanDerWaalsContact O-N 3.07Å; F14-F16 VanDerWaalsContact C-N 3.29Å; F14-F16 PolarHBondContact O-N 3.16Å; F16-V19 PolarHBondContact O-N 3Å; F16-G20 PolarHBondContact O-N 2.88Å; F16-W185 HydrophobicContact CB-CZ2 4.45Å; F16-W185 AromaticContact CD1-CH2 3.32Å; F16-W185 HydrophobicContact CD1-CH2 3.32Å; F16-W185 AromaticContact CD1-CZ2 3.27Å; F16-W185 HydrophobicContact CD1-CZ2 3.27Å; F16-W185 HydrophobicContact CD1-CZ3 4.3Å; F16-W185 HydrophobicContact CD2-CH2 4.48Å; F16-W185 AromaticContact CE1-CH2 3.08Å; F16-W185 HydrophobicContact CE1-CH2 3.08Å; F16-W185 AromaticContact CE1-CZ2 3.58Å; F16-W185 HydrophobicContact CE1-CZ2 3.58Å; F16-W185 AromaticContact CE1-CZ3 3.73Å; F16-W185 HydrophobicContact CE1-CZ3 3.73Å; F16-W185 HydrophobicContact CE2-CH2 4.32Å; F16-W185 HydrophobicContact CG-CH2 4.05Å; F16-W185 AromaticContact CG-CZ2 3.93Å; F16-W185 HydrophobicContact CG-CZ2 3.93Å; F16-W185 AromaticContact CZ-CH2 3.65Å; F16-W185 HydrophobicContact CZ-CH2 3.65Å; F16-W185 HydrophobicContact CZ-CZ2 4.45Å; F16-W185 HydrophobicContact CZ-CZ3 4.28Å; F16-R192 VanDerWaalsContact CD1-NH1 3.3Å; F16-R192 VanDerWaalsContact CZ-NH1 3.33Å
17S64.2Low65Low47 Ų4764.2 Ų64.233%0.32933%0.328SS..Hα-helixtrans-60.9-44.9175.2-173.10000111.6Y9 D13 F14 G20 V21Y9-S17 WeakPolarHBondContact OH-CB 3.31Å; D13-S17 WeakPolarHBondContact O-CB 3.47Å; D13-S17 PolarHBondContact O-N 3.29Å; F14-S17 WeakPolarHBondContact O-CB 3.37Å; F14-S17 PolarHBondContact O-N 3.08Å; F14-S17 VanDerWaalsContact O-N 3.11Å; S17-G20 PolarHBondContact O-N 3.5Å; S17-V21 WeakPolarHBondContact O-CG2 3.4Å; S17-V21 PolarHBondContact O-N 2.96Å
18V68.3Low66.3Low62 Ų6267.5 Ų67.538%0.37633%0.333SS..Hα-helixtrans-62.9-48176.91730000111.4F14 A15 G20 V21 C22F14-V18 HydrophobicContact CD1-CG2 4.19Å; F14-V18 HydrophobicContact CD2-CG2 4.37Å; F14-V18 HydrophobicContact CE1-CG2 3.77Å; F14-V18 HydrophobicContact CE2-CG2 3.96Å; F14-V18 HydrophobicContact CG-CG2 4.48Å; F14-V18 HydrophobicContact CZ-CG2 3.65Å; F14-V18 WeakPolarHBondContact O-CG2 3.39Å; F14-V18 PolarHBondContact O-N 3.12Å; A15-V18 PolarHBondContact O-N 2.68Å; V18-G20 VanDerWaalsContact C-N 3.28Å; V18-G20 PolarHBondContact O-N 3.21Å; V18-V21 PolarHBondContact O-N 3.31Å; V18-V21 VanDerWaalsContact O-N 3.15Å; V18-C22 PolarHBondContact O-N 3.43Å; V18-C22 PolarHBondContact O-SG 3.24Å; V18-C22 VanDerWaalsContact O-SG 3.33Å
19V71.5Confident67.5Low66 Ų6658.5 Ų58.540%0.431%0.311SS..Hα-helixtrans-57.4-45.2175.6169.60000110.2A15 F16 V21 C22 T23 W185A15-V19 WeakPolarHBondContact O-CB 3.47Å; A15-V19 VanDerWaalsContact O-CG2 3.29Å; A15-V19 WeakPolarHBondContact O-CG2 3.32Å; A15-V19 PolarHBondContact O-N 2.96Å; F16-V19 PolarHBondContact O-N 3Å; V19-V21 PolarHBondContact O-N 3.11Å; V19-C22 PolarHBondContact O-N 2.81Å; V19-T23 HydrophobicContact CG1-CG2 4.31Å; V19-T23 WeakPolarHBondContact O-CG2 3.3Å; V19-T23 PolarHBondContact O-N 3.21Å; V19-T23 PolarHBondContact O-OG1 3.28Å; V19-W185 HydrophobicContact CB-CZ2 4.18Å; V19-W185 HydrophobicContact CG1-CH2 4.45Å; V19-W185 HydrophobicContact CG1-CZ2 3.75Å
20G66.8Low68.6Low0 Ų057.4 Ų57.40%031%0.313CS..Hα-helixtrans-59.7-41.317600000113.1F16 S17 V18 T23 F24 R143F16-G20 PolarHBondContact O-N 2.88Å; S17-G20 PolarHBondContact O-N 3.5Å; V18-G20 VanDerWaalsContact C-N 3.28Å; V18-G20 PolarHBondContact O-N 3.21Å; G20-T23 PolarHBondContact O-OG1 3.35Å; G20-F24 WeakPolarHBondContact O-CB 3.45Å; G20-F24 PolarHBondContact O-N 3.36Å; G20-F24 VanDerWaalsContact O-N 3.09Å; G20-R143 PolarHBondContact O-NH1 2.83Å; G20-R143 PolarHBondContact O-NH2 3.11Å
21V67.4Low69.5Low31 Ų3155.8 Ų55.819%0.18830%0.301CS..Hα-helixtrans-67.1-43176.2173.10000111S17 V18 V19 F24 L25 I115S17-V21 WeakPolarHBondContact O-CG2 3.4Å; S17-V21 PolarHBondContact O-N 2.96Å; V18-V21 PolarHBondContact O-N 3.31Å; V18-V21 VanDerWaalsContact O-N 3.15Å; V19-V21 PolarHBondContact O-N 3.11Å; V21-F24 WeakPolarHBondContact O-CB 3.47Å; V21-F24 PolarHBondContact O-N 3.47Å; V21-L25 HydrophobicContact CG1-CD1 4.2Å; V21-L25 WeakPolarHBondContact O-CG 3.49Å; V21-L25 PolarHBondContact O-N 3.17Å; V21-I115 HydrophobicContact CB-CD1 4.49Å; V21-I115 HydrophobicContact CG1-CD1 3.92Å; V21-I115 HydrophobicContact CG2-CD1 3.64Å; V21-I115 HydrophobicContact CG2-CG1 3.91Å
22C70.9Confident70.5Confident64 Ų6451.3 Ų51.343%0.43229%0.29SS..Hα-helixtrans-61.8-44.9177.3-69.10000111.8V18 V19 F24 L25 L26V18-C22 PolarHBondContact O-N 3.43Å; V18-C22 PolarHBondContact O-SG 3.24Å; V18-C22 VanDerWaalsContact O-SG 3.33Å; V19-C22 PolarHBondContact O-N 2.81Å; C22-F24 VanDerWaalsContact C-N 3.31Å; C22-F24 PolarHBondContact O-N 2.84Å; C22-L25 PolarHBondContact O-N 2.9Å; C22-L26 WeakPolarHBondContact O-CB 3.5Å; C22-L26 VanDerWaalsContact O-CG 3.27Å; C22-L26 WeakPolarHBondContact O-CG 3.48Å; C22-L26 PolarHBondContact O-N 3.44Å
23T70.1Confident71.4Confident33 Ų3357 Ų5720%0.20231%0.308CS..Hα-helixtrans-64.4-37.8177.857.50000111.8V19 G20 L26 D27V19-T23 HydrophobicContact CG1-CG2 4.31Å; V19-T23 WeakPolarHBondContact O-CG2 3.3Å; V19-T23 PolarHBondContact O-N 3.21Å; V19-T23 PolarHBondContact O-OG1 3.28Å; G20-T23 PolarHBondContact O-OG1 3.35Å; T23-L26 PolarHBondContact O-N 3.05Å; T23-D27 WeakPolarHBondContact O-CB 3.23Å; T23-D27 PolarHBondContact O-N 2.85Å
24F68.8Low72.2Confident23 Ų2357.4 Ų57.410%0.10131%0.31CS..Hα-helixtrans-61.3-48.6175171-101.7000112.4G20 V21 C22 L26 D27 W28 F107 L108G20-F24 WeakPolarHBondContact O-CB 3.45Å; G20-F24 PolarHBondContact O-N 3.36Å; G20-F24 VanDerWaalsContact O-N 3.09Å; V21-F24 WeakPolarHBondContact O-CB 3.47Å; V21-F24 PolarHBondContact O-N 3.47Å; C22-F24 VanDerWaalsContact C-N 3.31Å; C22-F24 PolarHBondContact O-N 2.84Å; F24-L26 VanDerWaalsContact C-N 3.27Å; F24-L26 PolarHBondContact O-N 3.32Å; F24-D27 PolarHBondContact O-N 2.84Å; F24-W28 PolarHBondContact O-N 3.49Å; F24-F107 AromaticContact CE2-CE1 3.73Å; F24-F107 HydrophobicContact CE2-CE1 3.73Å; F24-F107 HydrophobicContact CE2-CZ 4.34Å; F24-F107 AromaticContact CZ-CE1 3.86Å; F24-F107 HydrophobicContact CZ-CE1 3.86Å; F24-L108 HydrophobicContact CE1-CD2 4.36Å; F24-L108 HydrophobicContact CZ-CD2 4.17Å
25L70.5Confident73.1Confident112 Ų11255.4 Ų55.459%0.58630%0.304SS*.Hα-helixtrans-63.6-36178.5-69.3174.6000112.1V21 C22 G29V21-L25 HydrophobicContact CG1-CD1 4.2Å; V21-L25 WeakPolarHBondContact O-CG 3.49Å; V21-L25 PolarHBondContact O-N 3.17Å; C22-L25 PolarHBondContact O-N 2.9Å; L25-G29 PolarHBondContact O-N 3.27Å
26L72.1Confident74Confident125 Ų12560 Ų6065%0.65432%0.318SS*.Hα-helixtrans-67-43.4175.2-72.2171.9000111.8C22 T23 F24 G29 S30C22-L26 WeakPolarHBondContact O-CB 3.5Å; C22-L26 VanDerWaalsContact O-CG 3.27Å; C22-L26 WeakPolarHBondContact O-CG 3.48Å; C22-L26 PolarHBondContact O-N 3.44Å; T23-L26 PolarHBondContact O-N 3.05Å; F24-L26 VanDerWaalsContact C-N 3.27Å; F24-L26 PolarHBondContact O-N 3.32Å; L26-G29 PolarHBondContact O-N 3.18Å; L26-S30 WeakPolarHBondContact O-CB 3.33Å; L26-S30 PolarHBondContact O-N 2.88Å; L26-S30 PolarHBondContact O-OG 3.24Å; L26-S30 VanDerWaalsContact O-OG 3.05Å
27D72.8Confident74.9Confident28 Ų2861.7 Ų61.715%0.1533%0.326CS..Hα-helixtrans-58.9-50.1177.5-147.346.6000110.2T23 F24 G29 S30 D31 S151T23-D27 WeakPolarHBondContact O-CB 3.23Å; T23-D27 PolarHBondContact O-N 2.85Å; F24-D27 PolarHBondContact O-N 2.84Å; D27-G29 VanDerWaalsContact C-N 3.32Å; D27-G29 PolarHBondContact O-N 2.97Å; D27-S30 WeakPolarHBondContact CA-OG 3.03Å; D27-S30 PolarHBondContact O-N 3.11Å; D27-S30 VanDerWaalsContact O-N 3.11Å; D27-S30 PolarHBondContact O-OG 3.04Å; D27-D31 PolarHBondContact O-N 2.63Å; D27-S151 PolarHBondContact OD2-OG 3.03Å
28W72.2Confident75.9Confident119 Ų11959.7 Ų59.745%0.45131%0.312SS..Hα-helixtrans-61-40.8178.8-146.972.8000112.5F24 L32F24-W28 PolarHBondContact O-N 3.49Å; W28-L32 HydrophobicContact CD2-CD1 4.35Å; W28-L32 HydrophobicContact CE3-CD1 3.66Å; W28-L32 HydrophobicContact CH2-CD1 4.1Å; W28-L32 HydrophobicContact CZ3-CD1 3.53Å; W28-L32 WeakPolarHBondContact O-CG 3.09Å; W28-L32 PolarHBondContact O-N 3.29Å
29G75.5Confident76.9Confident39 Ų3963.7 Ų63.740%0.40232%0.321SS..Hα-helixtrans-66.1-41.8174.800000112.8L25 L26 D27 W33L25-G29 PolarHBondContact O-N 3.27Å; L26-G29 PolarHBondContact O-N 3.18Å; D27-G29 VanDerWaalsContact C-N 3.32Å; D27-G29 PolarHBondContact O-N 2.97Å; G29-W33 WeakPolarHBondContact O-CB 3.3Å; G29-W33 PolarHBondContact O-N 3.26Å
30S76.9Confident77.8Confident47 Ų4764.7 Ų64.733%0.32933%0.33SS..Hα-helixtrans-67.9-35.4178.652.50000112.8L26 D27 W33 L34L26-S30 WeakPolarHBondContact O-CB 3.33Å; L26-S30 PolarHBondContact O-N 2.88Å; L26-S30 PolarHBondContact O-OG 3.24Å; L26-S30 VanDerWaalsContact O-OG 3.05Å; D27-S30 WeakPolarHBondContact CA-OG 3.03Å; D27-S30 PolarHBondContact O-N 3.11Å; D27-S30 VanDerWaalsContact O-N 3.11Å; D27-S30 PolarHBondContact O-OG 3.04Å; S30-W33 PolarHBondContact O-N 3.03Å; S30-L34 WeakPolarHBondContact O-CB 3.22Å; S30-L34 PolarHBondContact O-N 3.11Å
31D80.6Confident78.7Confident10 Ų1070.7 Ų70.75%0.05335%0.353CS..Hα-helixtrans-68.7-44.6179-73-8.9000111.9D27 W33 L34 A35 M54 Q154D27-D31 PolarHBondContact O-N 2.63Å; D31-W33 VanDerWaalsContact C-N 3.3Å; D31-W33 PolarHBondContact O-N 2.67Å; D31-L34 PolarHBondContact O-N 3.49Å; D31-A35 WeakPolarHBondContact O-CB 3.19Å; D31-A35 PolarHBondContact O-N 2.94Å; D31-M54 HydrophobicContact CB-CE 3.7Å; D31-M54 HydrophobicContact CB-SD 4.27Å; D31-Q154 VanDerWaalsContact CG-NE2 3.3Å; D31-Q154 PolarHBondContact OD1-OE1 2.93Å; D31-Q154 PolarHBondContact OD2-NE2 3.18Å; D31-Q154 PolarHBondContact OD2-OE1 3.12Å; D31-Q154 VanDerWaalsContact OD2-OE1 3.12Å
32L82.5Confident79.6Confident87 Ų8771.6 Ų71.646%0.45537%0.368SS..Hα-helixtrans-62.6-39.9174.2-71.8176.2000111.8W28 K36W28-L32 HydrophobicContact CD2-CD1 4.35Å; W28-L32 HydrophobicContact CE3-CD1 3.66Å; W28-L32 HydrophobicContact CH2-CD1 4.1Å; W28-L32 HydrophobicContact CZ3-CD1 3.53Å; W28-L32 WeakPolarHBondContact O-CG 3.09Å; W28-L32 PolarHBondContact O-N 3.29Å; L32-K36 WeakPolarHBondContact O-CB 3.44Å; L32-K36 PolarHBondContact O-N 3.45Å
33W83.4Confident80.4Confident168 Ų16871.9 Ų71.964%0.63637%0.366SS*.Hα-helixtrans-62-46.3174.6178.1-90.3000111.5G29 S30 D31 K36 E37G29-W33 WeakPolarHBondContact O-CB 3.3Å; G29-W33 PolarHBondContact O-N 3.26Å; S30-W33 PolarHBondContact O-N 3.03Å; D31-W33 VanDerWaalsContact C-N 3.3Å; D31-W33 PolarHBondContact O-N 2.67Å; W33-K36 WeakPolarHBondContact O-CB 2.96Å; W33-K36 PolarHBondContact O-N 2.94Å; W33-E37 PolarHBondContact O-N 3.46Å
34L82.6Confident81.3Confident36 Ų3675.6 Ų75.619%0.18838%0.384CS..Hα-helixtrans-65.2-40.5179.4-175.362.7000111.9S30 D31 E37 F38 L50S30-L34 WeakPolarHBondContact O-CB 3.22Å; S30-L34 PolarHBondContact O-N 3.11Å; D31-L34 PolarHBondContact O-N 3.49Å; L34-E37 PolarHBondContact O-N 2.97Å; L34-F38 HydrophobicContact CD1-CD2 4.31Å; L34-F38 HydrophobicContact CD1-CE2 3.85Å; L34-F38 HydrophobicContact CD1-CZ 4.29Å; L34-F38 HydrophobicContact CD2-CE2 4.12Å; L34-F38 HydrophobicContact CG-CD2 4.06Å; L34-F38 HydrophobicContact CG-CE2 3.69Å; L34-F38 VanDerWaalsContact O-CD2 3.32Å; L34-F38 WeakPolarHBondContact O-CD2 3.36Å; L34-F38 PolarHBondContact O-N 3.32Å; L34-L50 HydrophobicContact CB-CD2 4.11Å; L34-L50 HydrophobicContact CD2-CD1 4.34Å; L34-L50 HydrophobicContact CD2-CD2 4.05Å; L34-L50 HydrophobicContact CG-CD2 3.87Å
35A85Confident82.2Confident10 Ų1081.3 Ų81.38%0.08341%0.409CS..Hα-helixtrans-61.5-44.5174.700000111.6D31 E37 F38 Y39 F47 L50D31-A35 WeakPolarHBondContact O-CB 3.19Å; D31-A35 PolarHBondContact O-N 2.94Å; A35-E37 VanDerWaalsContact C-N 3.32Å; A35-E37 PolarHBondContact O-N 3.34Å; A35-F38 PolarHBondContact O-N 2.9Å; A35-Y39 WeakPolarHBondContact O-CB 3.45Å; A35-Y39 PolarHBondContact O-N 3.23Å; A35-F47 HydrophobicContact CB-CD2 4.29Å; A35-F47 HydrophobicContact CB-CE2 4.1Å; A35-F47 VanDerWaalsContact O-CD2 3.29Å; A35-F47 WeakPolarHBondContact O-CD2 3.34Å; A35-L50 HydrophobicContact CB-CD2 3.82Å
36K85.8Confident82.9Confident125 Ų12578.8 Ų78.854%0.54339%0.391SS..Hα-helixtrans-59.4-44173.8-177.7-171.9175.2-171.40111.4L32 W33 Y39 C40L32-K36 WeakPolarHBondContact O-CB 3.44Å; L32-K36 PolarHBondContact O-N 3.45Å; W33-K36 WeakPolarHBondContact O-CB 2.96Å; W33-K36 PolarHBondContact O-N 2.94Å; K36-Y39 PolarHBondContact O-N 3.42Å; K36-C40 WeakPolarHBondContact O-CB 3.24Å; K36-C40 PolarHBondContact O-N 3.43Å; K36-C40 PolarHBondContact O-SG 2.99Å; K36-C40 VanDerWaalsContact O-SG 3.35Å
37E85.4Confident83.7Confident63 Ų6375.7 Ų75.729%0.29437%0.373SS..Hα-helixtrans-61.4-46180-173.368.8-172.200111.7W33 L34 A35 Y39 C40 R41W33-E37 PolarHBondContact O-N 3.46Å; L34-E37 PolarHBondContact O-N 2.97Å; A35-E37 VanDerWaalsContact C-N 3.32Å; A35-E37 PolarHBondContact O-N 3.34Å; E37-Y39 VanDerWaalsContact C-N 3.34Å; E37-Y39 PolarHBondContact O-N 3.31Å; E37-C40 PolarHBondContact O-N 3.22Å; E37-R41 WeakPolarHBondContact O-CB 3.12Å; E37-R41 VanDerWaalsContact O-CG 3.28Å; E37-R41 WeakPolarHBondContact O-CG 3.49Å; E37-R41 PolarHBondContact O-N 3.3Å; E37-R41 IonicContact OE1-CZ 3.48Å; E37-R41 IonicContact OE1-NE 2.67Å; E37-R41 PolarHBondContact OE1-NE 2.95Å; E37-R41 IonicContact OE1-NH2 2.76Å; E37-R41 PolarHBondContact OE1-NH2 3.26Å
38F85.8Confident84.5Confident6 Ų676.3 Ų76.33%0.02639%0.385CS..Hα-helixtrans-62.9-40.4176.2-75.6-56000112.7L34 A35 R41 G42 D43 W46 F47 L50 L157 V161L34-F38 HydrophobicContact CD1-CD2 4.31Å; L34-F38 HydrophobicContact CD1-CE2 3.85Å; L34-F38 HydrophobicContact CD1-CZ 4.29Å; L34-F38 HydrophobicContact CD2-CE2 4.12Å; L34-F38 HydrophobicContact CG-CD2 4.06Å; L34-F38 HydrophobicContact CG-CE2 3.69Å; L34-F38 VanDerWaalsContact O-CD2 3.32Å; L34-F38 WeakPolarHBondContact O-CD2 3.36Å; L34-F38 PolarHBondContact O-N 3.32Å; A35-F38 PolarHBondContact O-N 2.9Å; F38-R41 PolarHBondContact O-N 3.26Å; F38-G42 PolarHBondContact O-N 3.32Å; F38-D43 HydrophobicContact CD1-CB 3.99Å; F38-D43 PolarHBondContact O-N 3.16Å; F38-W46 HydrophobicContact CD1-CB 3.99Å; F38-W46 HydrophobicContact CE1-CB 3.83Å; F38-W46 HydrophobicContact CG-CB 4.4Å; F38-W46 HydrophobicContact CZ-CB 4.08Å; F38-F47 HydrophobicContact CB-CB 3.88Å; F38-L50 HydrophobicContact CD2-CD2 3.92Å; F38-L50 HydrophobicContact CE2-CD2 4.11Å; F38-L157 HydrophobicContact CE2-CD2 4.27Å; F38-L157 HydrophobicContact CZ-CD2 4.5Å; F38-V161 HydrophobicContact CE1-CG2 4.09Å; F38-V161 HydrophobicContact CZ-CG2 3.77Å
39Y89.5Confident85.4Confident146 Ų14673.1 Ų73.157%0.57338%0.379SS*.Hα-helixtrans-63.3-47.5176.4-176.7-98.1000111.6A35 K36 E37 R41 G42 L44 F47A35-Y39 WeakPolarHBondContact O-CB 3.45Å; A35-Y39 PolarHBondContact O-N 3.23Å; K36-Y39 PolarHBondContact O-N 3.42Å; E37-Y39 VanDerWaalsContact C-N 3.34Å; E37-Y39 PolarHBondContact O-N 3.31Å; Y39-R41 VanDerWaalsContact C-N 3.29Å; Y39-R41 PolarHBondContact O-N 3.11Å; Y39-G42 PolarHBondContact O-N 3.25Å; Y39-G42 VanDerWaalsContact O-N 3.1Å; Y39-L44 HydrophobicContact CD2-CD2 4.33Å; Y39-F47 HydrophobicContact CD2-CZ 4.5Å
40C89.3Confident86Confident87 Ų8771.3 Ų71.359%0.58836%0.36SS*.Hα-helixtrans-65-30.4178.5-72.30000113.1K36 E37 G42K36-C40 WeakPolarHBondContact O-CB 3.24Å; K36-C40 PolarHBondContact O-N 3.43Å; K36-C40 PolarHBondContact O-SG 2.99Å; K36-C40 VanDerWaalsContact O-SG 3.35Å; E37-C40 PolarHBondContact O-N 3.22Å; C40-G42 VanDerWaalsContact C-N 3.31Å
41R86.2Confident86.6Confident126 Ų12671.4 Ų71.448%0.47536%0.358SS..Hα-helixtrans-79.1-11174.8-71.7-179.7-175.3-175.77.2114E37 F38 Y39 D43E37-R41 WeakPolarHBondContact O-CB 3.12Å; E37-R41 VanDerWaalsContact O-CG 3.28Å; E37-R41 WeakPolarHBondContact O-CG 3.49Å; E37-R41 PolarHBondContact O-N 3.3Å; E37-R41 IonicContact OE1-CZ 3.48Å; E37-R41 IonicContact OE1-NE 2.67Å; E37-R41 PolarHBondContact OE1-NE 2.95Å; E37-R41 IonicContact OE1-NH2 2.76Å; E37-R41 PolarHBondContact OE1-NH2 3.26Å; F38-R41 PolarHBondContact O-N 3.26Å; Y39-R41 VanDerWaalsContact C-N 3.29Å; Y39-R41 PolarHBondContact O-N 3.11Å; R41-D43 VanDerWaalsContact C-N 3.31Å
42G86.9Confident87Confident49 Ų4972.8 Ų72.851%0.50538%0.375SS..THydrogen-bonded Turntrans79.110.1-176.500000114.5F38 Y39 C40 L44F38-G42 PolarHBondContact O-N 3.32Å; Y39-G42 PolarHBondContact O-N 3.25Å; Y39-G42 VanDerWaalsContact O-N 3.1Å; C40-G42 VanDerWaalsContact C-N 3.31Å; G42-L44 PolarHBondContact O-N 3.41Å
43D86.4Confident87.4Confident71 Ų7170.4 Ų70.438%0.3836%0.363SS..  trans-80.162.3179.3-75-39.2000111F38 R41 F45 W46 F47F38-D43 HydrophobicContact CD1-CB 3.99Å; F38-D43 PolarHBondContact O-N 3.16Å; R41-D43 VanDerWaalsContact C-N 3.31Å; D43-F45 PolarHBondContact O-N 2.92Å; D43-F45 VanDerWaalsContact O-N 3.17Å; D43-W46 PolarHBondContact O-N 2.77Å; D43-F47 PolarHBondContact O-N 3.47Å
44L88.4Confident87.5Confident111 Ų11163.8 Ų63.858%0.58134%0.339SS*.Hα-helixtrans-59.4-31.1-171.6-64.6179.9000113.8Y39 G42 G48Y39-L44 HydrophobicContact CD2-CD2 4.33Å; G42-L44 PolarHBondContact O-N 3.41Å; L44-G48 PolarHBondContact O-N 3.26Å
45F88.8Confident87.7Confident143 Ų14365.1 Ų65.163%0.62735%0.349SS*.Hα-helixtrans-64.3-51.5176.4177.8-97.3000111.6D43 G48 V49D43-F45 PolarHBondContact O-N 2.92Å; D43-F45 VanDerWaalsContact O-N 3.17Å; F45-G48 PolarHBondContact O-N 2.74Å; F45-V49 HydrophobicContact CD1-CG2 4.38Å; F45-V49 HydrophobicContact CE1-CG2 3.97Å; F45-V49 HydrophobicContact CZ-CG2 4.04Å; F45-V49 WeakPolarHBondContact O-CG2 3.45Å; F45-V49 PolarHBondContact O-N 3.01Å
46W85.8Confident87.9Confident58 Ų5869.5 Ų69.522%0.2237%0.37CS..Hα-helixtrans-70.7-33.6-179.4-65.2112.5000112.2F38 D43 V49 L50 L157 Y160F38-W46 HydrophobicContact CD1-CB 3.99Å; F38-W46 HydrophobicContact CE1-CB 3.83Å; F38-W46 HydrophobicContact CG-CB 4.4Å; F38-W46 HydrophobicContact CZ-CB 4.08Å; D43-W46 PolarHBondContact O-N 2.77Å; W46-V49 PolarHBondContact O-N 3.04Å; W46-L50 WeakPolarHBondContact O-CB 3.26Å; W46-L50 PolarHBondContact O-N 2.94Å; W46-L157 HydrophobicContact CD2-CD1 4.11Å; W46-L157 HydrophobicContact CE3-CD1 3.24Å; W46-L157 HydrophobicContact CZ3-CD1 3.51Å; W46-Y160 HydrophobicContact CD2-CE1 4.28Å; W46-Y160 AromaticContact CE2-CE1 3.7Å; W46-Y160 HydrophobicContact CE3-CE1 4.42Å; W46-Y160 HydrophobicContact CH2-CD1 4.1Å; W46-Y160 AromaticContact CH2-CE1 3.44Å; W46-Y160 HydrophobicContact CH2-CE1 3.44Å; W46-Y160 VanDerWaalsContact CH2-CE1 3.44Å; W46-Y160 AromaticContact CH2-CZ 3.7Å; W46-Y160 HydrophobicContact CZ2-CD1 4.34Å; W46-Y160 AromaticContact CZ2-CE1 3.29Å; W46-Y160 HydrophobicContact CZ2-CE1 3.29Å; W46-Y160 AromaticContact CZ2-CZ 3.44Å; W46-Y160 VanDerWaalsContact CZ2-CZ 3.44Å; W46-Y160 WeakPolarHBondContact CZ2-OH 3.07Å; W46-Y160 HydrophobicContact CZ3-CD1 4.35Å; W46-Y160 HydrophobicContact CZ3-CE1 4.03Å
47F88.8Confident88.1Confident61 Ų6163.6 Ų63.627%0.26834%0.344SS..Hα-helixtrans-56.4-49.6166.9173-102.3000111.5A35 F38 Y39 D43 V49 L50 V51A35-F47 HydrophobicContact CB-CD2 4.29Å; A35-F47 HydrophobicContact CB-CE2 4.1Å; A35-F47 VanDerWaalsContact O-CD2 3.29Å; A35-F47 WeakPolarHBondContact O-CD2 3.34Å; F38-F47 HydrophobicContact CB-CB 3.88Å; Y39-F47 HydrophobicContact CD2-CZ 4.5Å; D43-F47 PolarHBondContact O-N 3.47Å; F47-V49 PolarHBondContact O-N 3.14Å; F47-L50 PolarHBondContact O-N 3.23Å; F47-V51 HydrophobicContact CD2-CG2 4.11Å; F47-V51 HydrophobicContact CE1-CG2 4.21Å; F47-V51 HydrophobicContact CE2-CG2 3.69Å; F47-V51 HydrophobicContact CZ-CG2 3.75Å; F47-V51 WeakPolarHBondContact O-CG2 3.45Å; F47-V51 PolarHBondContact O-N 3.06Å
48G89.9Confident88.1Confident40 Ų4061.6 Ų61.641%0.41234%0.338SS..Hα-helixtrans-62.5-40.5178.500000113.1L44 F45 G52L44-G48 PolarHBondContact O-N 3.26Å; F45-G48 PolarHBondContact O-N 2.74Å; G48-G52 WeakPolarHBondContact O-CA 3.47Å; G48-G52 PolarHBondContact O-N 2.94Å
49V89.3Confident88.2Confident53 Ų5364.6 Ų64.632%0.32136%0.356SS..Hα-helixtrans-62.3-47.4174.1171.70000110.9F45 W46 F47 G52 L53F45-V49 HydrophobicContact CD1-CG2 4.38Å; F45-V49 HydrophobicContact CE1-CG2 3.97Å; F45-V49 HydrophobicContact CZ-CG2 4.04Å; F45-V49 WeakPolarHBondContact O-CG2 3.45Å; F45-V49 PolarHBondContact O-N 3.01Å; W46-V49 PolarHBondContact O-N 3.04Å; F47-V49 PolarHBondContact O-N 3.14Å; V49-G52 PolarHBondContact O-N 3.3Å; V49-L53 HydrophobicContact CG1-CD1 4.3Å; V49-L53 WeakPolarHBondContact O-CG 3.31Å; V49-L53 PolarHBondContact O-N 3.47Å
50L89.1Confident88.1Confident0 Ų058.6 Ų58.60%034%0.335CS..Hα-helixtrans-60.9-54.1179.7178.464.6000111.5L34 A35 F38 W46 F47 G52 L53 M54 Q154 L157L34-L50 HydrophobicContact CB-CD2 4.11Å; L34-L50 HydrophobicContact CD2-CD1 4.34Å; L34-L50 HydrophobicContact CD2-CD2 4.05Å; L34-L50 HydrophobicContact CG-CD2 3.87Å; A35-L50 HydrophobicContact CB-CD2 3.82Å; F38-L50 HydrophobicContact CD2-CD2 3.92Å; F38-L50 HydrophobicContact CE2-CD2 4.11Å; W46-L50 WeakPolarHBondContact O-CB 3.26Å; W46-L50 PolarHBondContact O-N 2.94Å; F47-L50 PolarHBondContact O-N 3.23Å; L50-G52 VanDerWaalsContact C-N 3.27Å; L50-G52 PolarHBondContact O-N 2.92Å; L50-L53 WeakPolarHBondContact O-CB 3.16Å; L50-L53 PolarHBondContact O-N 3.45Å; L50-M54 WeakPolarHBondContact O-CG 3.49Å; L50-M54 PolarHBondContact O-N 3.24Å; L50-M54 VanDerWaalsContact O-N 3.11Å; L50-Q154 HydrophobicContact CD1-CG 3.66Å; L50-L157 HydrophobicContact CB-CD2 4.2Å; L50-L157 HydrophobicContact CD1-CD2 4.36Å
51V89.3Confident88Confident49 Ų4954.5 Ų54.530%0.29731%0.307SS..Hα-helixtrans-63.5-36.5179.2174.70000110.9F47 L53 M54 V55F47-V51 HydrophobicContact CD2-CG2 4.11Å; F47-V51 HydrophobicContact CE1-CG2 4.21Å; F47-V51 HydrophobicContact CE2-CG2 3.69Å; F47-V51 HydrophobicContact CZ-CG2 3.75Å; F47-V51 WeakPolarHBondContact O-CG2 3.45Å; F47-V51 PolarHBondContact O-N 3.06Å; V51-L53 VanDerWaalsContact C-N 3.34Å; V51-L53 PolarHBondContact O-N 2.95Å; V51-M54 PolarHBondContact O-N 2.86Å; V51-V55 HydrophobicContact CG1-CG2 4.18Å; V51-V55 WeakPolarHBondContact O-CG2 3.49Å; V51-V55 PolarHBondContact O-N 2.68Å
52G89.9Confident87.8Confident39 Ų3949.2 Ų49.240%0.40229%0.288SS..Hα-helixtrans-59.8-42.2174.900000112.7G48 V49 L50 L56G48-G52 WeakPolarHBondContact O-CA 3.47Å; G48-G52 PolarHBondContact O-N 2.94Å; V49-G52 PolarHBondContact O-N 3.3Å; L50-G52 VanDerWaalsContact C-N 3.27Å; L50-G52 PolarHBondContact O-N 2.92Å; G52-L56 WeakPolarHBondContact O-CB 3.49Å; G52-L56 PolarHBondContact O-N 3.25Å
53L89.6Confident87.8Confident38 Ų3850.7 Ų50.720%0.19928%0.282CS..Hα-helixtrans-63.3-45.2174-71.2167.7000111.7V49 L50 V51 L56 S57 P153 Q154V49-L53 HydrophobicContact CG1-CD1 4.3Å; V49-L53 WeakPolarHBondContact O-CG 3.31Å; V49-L53 PolarHBondContact O-N 3.47Å; L50-L53 WeakPolarHBondContact O-CB 3.16Å; L50-L53 PolarHBondContact O-N 3.45Å; V51-L53 VanDerWaalsContact C-N 3.34Å; V51-L53 PolarHBondContact O-N 2.95Å; L53-L56 PolarHBondContact O-N 3.29Å; L53-S57 VanDerWaalsContact O-CB 3.29Å; L53-S57 WeakPolarHBondContact O-CB 3.14Å; L53-S57 PolarHBondContact O-N 3.43Å; L53-P153 HydrophobicContact CD1-CB 3.84Å; L53-P153 HydrophobicContact CD2-CB 3.84Å; L53-P153 HydrophobicContact CD2-CG 4.36Å; L53-P153 HydrophobicContact CG-CB 4.46Å; L53-Q154 HydrophobicContact CD1-CG 4.4Å
54M86.3Confident87.7Confident29 Ų2947.3 Ų47.314%0.14326%0.264CS..Hα-helixtrans-60.3-47.4177.3-59.9178.480.300111.4D31 L50 V51 S58 E150D31-M54 HydrophobicContact CB-CE 3.7Å; D31-M54 HydrophobicContact CB-SD 4.27Å; L50-M54 WeakPolarHBondContact O-CG 3.49Å; L50-M54 PolarHBondContact O-N 3.24Å; L50-M54 VanDerWaalsContact O-N 3.11Å; V51-M54 PolarHBondContact O-N 2.86Å; M54-S58 VanDerWaalsContact O-CB 3.28Å; M54-S58 WeakPolarHBondContact O-CB 3.46Å; M54-S58 PolarHBondContact O-N 3.38Å; M54-E150 WeakPolarHBondContact CG-OE1 3.12Å
55V86.9Confident87.4Confident64 Ų6442 Ų4239%0.38824%0.237SC..Hα-helixtrans-65.5-43.5179.1171.90000110.9V51 S58 V59V51-V55 HydrophobicContact CG1-CG2 4.18Å; V51-V55 WeakPolarHBondContact O-CG2 3.49Å; V51-V55 PolarHBondContact O-N 2.68Å; V55-S58 PolarHBondContact O-N 3.37Å; V55-V59 HydrophobicContact CG1-CG2 4.48Å; V55-V59 WeakPolarHBondContact O-CG2 3.41Å; V55-V59 PolarHBondContact O-N 3.49Å
56L89.6Confident87Confident102 Ų10238.2 Ų38.253%0.53422%0.218SC..Hα-helixtrans-62-47.4178.7178.763.2000111.4G52 L53 V59 V60G52-L56 WeakPolarHBondContact O-CB 3.49Å; G52-L56 PolarHBondContact O-N 3.25Å; L53-L56 PolarHBondContact O-N 3.29Å; L56-V59 PolarHBondContact O-N 3.29Å; L56-V60 WeakPolarHBondContact O-CG2 3.19Å; L56-V60 PolarHBondContact O-N 3.4Å
57S89.6Confident86.9Confident0 Ų037.6 Ų37.60%022%0.217CC..Hα-helixtrans-57.9-49.4175.3175.10000111.5L53 V59 V60 V61 E150L53-S57 VanDerWaalsContact O-CB 3.29Å; L53-S57 WeakPolarHBondContact O-CB 3.14Å; L53-S57 PolarHBondContact O-N 3.43Å; S57-V59 VanDerWaalsContact C-N 3.32Å; S57-V59 PolarHBondContact O-N 2.94Å; S57-V60 PolarHBondContact O-N 3.11Å; S57-V60 VanDerWaalsContact O-N 3.11Å; S57-V61 WeakPolarHBondContact O-CB 3.42Å; S57-V61 WeakPolarHBondContact O-CG2 3.23Å; S57-V61 PolarHBondContact O-N 3.47Å; S57-E150 VanDerWaalsContact CB-OE2 3.29Å; S57-E150 WeakPolarHBondContact CB-OE2 3.41Å; S57-E150 WeakPolarHBondContact OG-CB 3.3Å; S57-E150 PolarHBondContact OG-OE2 3.09Å
58S85.1Confident86.4Confident22 Ų2234.8 Ų34.815%0.15421%0.205CC..Hα-helixtrans-56.2-44.7175.3-172.60000111.7M54 V55 V60 Q62M54-S58 VanDerWaalsContact O-CB 3.28Å; M54-S58 WeakPolarHBondContact O-CB 3.46Å; M54-S58 PolarHBondContact O-N 3.38Å; V55-S58 PolarHBondContact O-N 3.37Å; S58-V60 PolarHBondContact O-N 2.88Å; S58-Q62 WeakPolarHBondContact O-CB 3.38Å; S58-Q62 VanDerWaalsContact O-CG 3.31Å; S58-Q62 WeakPolarHBondContact O-CG 3.38Å; S58-Q62 PolarHBondContact O-N 2.92Å; S58-Q62 PolarHBondContact O-OE1 3.07Å; S58-Q62 PolarHBondContact OG-NE2 2.86Å
59V86.6Confident85.7Confident68 Ų6833.7 Ų33.741%0.41219%0.189SC..Hα-helixtrans-61.2-46.4176.6169.90000111.2V55 L56 S57 Q62 M63V55-V59 HydrophobicContact CG1-CG2 4.48Å; V55-V59 WeakPolarHBondContact O-CG2 3.41Å; V55-V59 PolarHBondContact O-N 3.49Å; L56-V59 PolarHBondContact O-N 3.29Å; S57-V59 VanDerWaalsContact C-N 3.32Å; S57-V59 PolarHBondContact O-N 2.94Å; V59-Q62 PolarHBondContact O-N 2.83Å; V59-M63 HydrophobicContact CG1-CG 4.46Å; V59-M63 HydrophobicContact CG1-SD 4.07Å; V59-M63 VanDerWaalsContact O-CG 3.25Å; V59-M63 WeakPolarHBondContact O-CG 3.4Å; V59-M63 PolarHBondContact O-N 3.4Å
60V88.9Confident85.2Confident20 Ų2034.2 Ų34.212%0.12119%0.188CC..Hα-helixtrans-62-50.6-179.2171.50000111.1L56 S57 S58 Q62 M63 F64 I145L56-V60 WeakPolarHBondContact O-CG2 3.19Å; L56-V60 PolarHBondContact O-N 3.4Å; S57-V60 PolarHBondContact O-N 3.11Å; S57-V60 VanDerWaalsContact O-N 3.11Å; S58-V60 PolarHBondContact O-N 2.88Å; V60-Q62 VanDerWaalsContact C-N 3.27Å; V60-Q62 PolarHBondContact O-N 3.41Å; V60-M63 WeakPolarHBondContact O-CB 3.21Å; V60-M63 PolarHBondContact O-N 2.89Å; V60-F64 HydrophobicContact CG1-CD2 3.86Å; V60-F64 HydrophobicContact CG1-CE2 3.64Å; V60-F64 VanDerWaalsContact O-CD2 3.23Å; V60-F64 WeakPolarHBondContact O-CD2 3.42Å; V60-F64 PolarHBondContact O-N 3.3Å; V60-I145 HydrophobicContact CG1-CG2 3.85Å
61V85.9Confident84.8Confident1 Ų135.1 Ų35.11%0.00619%0.191CC..Hα-helixtrans-61.1-38.5179.4173.20000110.9S57 F64 S65 F107 L142 I145 E146S57-V61 WeakPolarHBondContact O-CB 3.42Å; S57-V61 WeakPolarHBondContact O-CG2 3.23Å; S57-V61 PolarHBondContact O-N 3.47Å; V61-F64 PolarHBondContact O-N 3.32Å; V61-S65 WeakPolarHBondContact O-CB 3.26Å; V61-S65 PolarHBondContact O-N 3.05Å; V61-F107 HydrophobicContact CG1-CB 4.33Å; V61-F107 HydrophobicContact CG1-CD2 3.23Å; V61-F107 HydrophobicContact CG1-CE2 3.54Å; V61-F107 HydrophobicContact CG1-CG 3.88Å; V61-F107 HydrophobicContact CG1-CZ 4.41Å; V61-L142 HydrophobicContact CG1-CB 4.4Å; V61-L142 HydrophobicContact CG1-CD2 4.19Å; V61-I145 HydrophobicContact CG2-CG2 4.27Å; V61-E146 HydrophobicContact CG2-CB 3.78Å; V61-E146 HydrophobicContact CG2-CG 4.38Å
62Q83.7Confident84.1Confident15 Ų1533 Ų337%0.0718%0.178CC..Hα-helixtrans-71.6-36.8-178.3-85.550.6-15.900109.8S58 V59 V60 W66 H101 Q104 F107S58-Q62 WeakPolarHBondContact O-CB 3.38Å; S58-Q62 VanDerWaalsContact O-CG 3.31Å; S58-Q62 WeakPolarHBondContact O-CG 3.38Å; S58-Q62 PolarHBondContact O-N 2.92Å; S58-Q62 PolarHBondContact O-OE1 3.07Å; S58-Q62 PolarHBondContact OG-NE2 2.86Å; V59-Q62 PolarHBondContact O-N 2.83Å; V60-Q62 VanDerWaalsContact C-N 3.27Å; V60-Q62 PolarHBondContact O-N 3.41Å; Q62-W66 VanDerWaalsContact O-CB 3.26Å; Q62-W66 WeakPolarHBondContact O-CB 3.41Å; Q62-W66 PolarHBondContact O-N 2.95Å; Q62-H101 PolarHBondContact O-ND1 3.45Å; Q62-Q104 PolarHBondContact NE2-O 3.45Å; Q62-F107 VanDerWaalsContact NE2-CB 3.27Å
63M85Confident83.2Confident80 Ų8036.6 Ų36.639%0.39418%0.18SC..Hα-helixtrans-62.5-46.6172.1-72.6176.874.700111.7V59 V60 W66 F67 L269V59-M63 HydrophobicContact CG1-CG 4.46Å; V59-M63 HydrophobicContact CG1-SD 4.07Å; V59-M63 VanDerWaalsContact O-CG 3.25Å; V59-M63 WeakPolarHBondContact O-CG 3.4Å; V59-M63 PolarHBondContact O-N 3.4Å; V60-M63 WeakPolarHBondContact O-CB 3.21Å; V60-M63 PolarHBondContact O-N 2.89Å; M63-W66 PolarHBondContact O-N 3.04Å; M63-F67 HydrophobicContact CE-CE2 4.36Å; M63-F67 WeakPolarHBondContact O-CD2 3.49Å; M63-F67 PolarHBondContact O-N 3.47Å; M63-L269 HydrophobicContact CB-CD2 3.69Å; M63-L269 HydrophobicContact CE-CD1 4.4Å; M63-L269 HydrophobicContact CE-CD2 4.16Å; M63-L269 HydrophobicContact SD-CD1 4.49Å
64F85.3Confident82.4Confident0 Ų041.9 Ų41.90%020%0.203CC..Hα-helixtrans-60.2-49.3175.8-82.6-72.8000111.9V60 V61 W66 F67 W68 L142 I145 M261 L269 Y270 T273V60-F64 HydrophobicContact CG1-CD2 3.86Å; V60-F64 HydrophobicContact CG1-CE2 3.64Å; V60-F64 VanDerWaalsContact O-CD2 3.23Å; V60-F64 WeakPolarHBondContact O-CD2 3.42Å; V60-F64 PolarHBondContact O-N 3.3Å; V61-F64 PolarHBondContact O-N 3.32Å; F64-W66 VanDerWaalsContact C-N 3.25Å; F64-W66 PolarHBondContact O-N 3.36Å; F64-F67 PolarHBondContact O-N 3.4Å; F64-W68 HydrophobicContact CB-CZ2 4.4Å; F64-W68 HydrophobicContact CD1-CZ2 4.16Å; F64-W68 VanDerWaalsContact O-CG 3.27Å; F64-W68 PolarHBondContact O-N 3.47Å; F64-L142 HydrophobicContact CB-CD2 3.59Å; F64-I145 HydrophobicContact CD1-CD1 4.2Å; F64-I145 HydrophobicContact CD2-CD1 3.76Å; F64-I145 HydrophobicContact CD2-CG2 4.09Å; F64-I145 HydrophobicContact CE1-CD1 4.23Å; F64-I145 HydrophobicContact CE2-CD1 3.79Å; F64-I145 HydrophobicContact CE2-CG2 4.01Å; F64-I145 HydrophobicContact CG-CD1 3.98Å; F64-I145 HydrophobicContact CZ-CD1 4.03Å; F64-M261 HydrophobicContact CD1-SD 4.3Å; F64-M261 HydrophobicContact CE1-SD 4.45Å; F64-L269 HydrophobicContact CD1-CD2 4.34Å; F64-L269 HydrophobicContact CD2-CD2 3.98Å; F64-L269 HydrophobicContact CD2-CG 4.46Å; F64-L269 HydrophobicContact CE1-CD2 4.22Å; F64-L269 HydrophobicContact CE1-CG 4.32Å; F64-L269 HydrophobicContact CE2-CD1 4.48Å; F64-L269 HydrophobicContact CE2-CD2 3.84Å; F64-L269 HydrophobicContact CE2-CG 3.82Å; F64-L269 HydrophobicContact CG-CD2 4.22Å; F64-L269 HydrophobicContact CZ-CD2 3.97Å; F64-L269 HydrophobicContact CZ-CG 3.74Å; F64-Y270 HydrophobicContact CE1-CD2 4.34Å; F64-T273 HydrophobicContact CE2-CG2 4.12Å; F64-T273 WeakPolarHBondContact CE2-OG1 3.39Å; F64-T273 HydrophobicContact CZ-CG2 4.29Å; F64-T273 WeakPolarHBondContact CZ-OG1 3.42Å
65S81.8Confident81.6Confident0 Ų044.1 Ų44.10%022%0.215CC..Hα-helixtrans-61.6-35.9179.2176.50000112V61 F69 H101 R110V61-S65 WeakPolarHBondContact O-CB 3.26Å; V61-S65 PolarHBondContact O-N 3.05Å; S65-F69 VanDerWaalsContact O-CB 3.3Å; S65-F69 WeakPolarHBondContact O-CB 3.23Å; S65-F69 PolarHBondContact O-N 3.21Å; S65-H101 VanDerWaalsContact CB-CE1 3.49Å; S65-H101 WeakPolarHBondContact CB-CE1 3.22Å; S65-H101 PolarHBondContact OG-CE1 2.97Å; S65-H101 VanDerWaalsContact OG-CE1 3.22Å; S65-H101 PolarHBondContact OG-NE2 2.99Å; S65-R110 PolarHBondContact O-NH1 2.86Å; S65-R110 PolarHBondContact OG-NH1 3.36Å
66W80.3Confident80.4Confident63 Ų6347.2 Ų47.224%0.23924%0.237CC..Hα-helixtrans-67.2-47.4175.4174.6-104.2000112.4Q62 M63 F64 W68 F69 Q70 F97 C98Q62-W66 VanDerWaalsContact O-CB 3.26Å; Q62-W66 WeakPolarHBondContact O-CB 3.41Å; Q62-W66 PolarHBondContact O-N 2.95Å; M63-W66 PolarHBondContact O-N 3.04Å; F64-W66 VanDerWaalsContact C-N 3.25Å; F64-W66 PolarHBondContact O-N 3.36Å; W66-W68 VanDerWaalsContact C-N 3.32Å; W66-W68 PolarHBondContact O-N 2.95Å; W66-F69 HydrophobicContact CE3-CD1 4.4Å; W66-F69 HydrophobicContact CZ3-CD1 4.26Å; W66-F69 PolarHBondContact O-N 3.34Å; W66-Q70 HydrophobicContact CD2-CG 4.42Å; W66-Q70 HydrophobicContact CZ2-CG 4.22Å; W66-Q70 WeakPolarHBondContact O-CG 3.41Å; W66-Q70 PolarHBondContact O-N 3.17Å; W66-F97 HydrophobicContact CE3-CD1 4.08Å; W66-F97 HydrophobicContact CE3-CE1 4.43Å; W66-F97 HydrophobicContact CZ3-CD1 4.07Å; W66-C98 HydrophobicContact CH2-CB 3.67Å; W66-C98 HydrophobicContact CZ3-CB 3.64Å
67F83.1Confident79.1Confident46 Ų4644.1 Ų44.120%0.20223%0.23CC..Hα-helixtrans-59.2-45.7176.5-78.9-57.1000111.2M63 F64 F69 Q70 Y71 L269M63-F67 HydrophobicContact CE-CE2 4.36Å; M63-F67 WeakPolarHBondContact O-CD2 3.49Å; M63-F67 PolarHBondContact O-N 3.47Å; F64-F67 PolarHBondContact O-N 3.4Å; F67-F69 VanDerWaalsContact C-N 3.35Å; F67-F69 PolarHBondContact O-N 3.2Å; F67-Q70 WeakPolarHBondContact O-CB 3.47Å; F67-Q70 PolarHBondContact O-N 2.83Å; F67-Y71 HydrophobicContact CB-CE2 3.87Å; F67-Y71 WeakPolarHBondContact O-CD2 3.47Å; F67-Y71 WeakPolarHBondContact O-CE2 3.33Å; F67-Y71 PolarHBondContact O-N 3.11Å; F67-L269 HydrophobicContact CD2-CD2 4.27Å; F67-L269 HydrophobicContact CE2-CD2 4.16Å
68W80.1Confident77.8Confident1 Ų145.5 Ų45.50%0.00424%0.236CC..Hα-helixtrans-62.3-44.1177.1-62.8-10.1000111.7F64 W66 Q70 Y71 D72 D138 M141 L142 F260 M261 R390F64-W68 HydrophobicContact CB-CZ2 4.4Å; F64-W68 HydrophobicContact CD1-CZ2 4.16Å; F64-W68 VanDerWaalsContact O-CG 3.27Å; F64-W68 PolarHBondContact O-N 3.47Å; W66-W68 VanDerWaalsContact C-N 3.32Å; W66-W68 PolarHBondContact O-N 2.95Å; W68-Q70 VanDerWaalsContact C-N 3.29Å; W68-Q70 PolarHBondContact O-N 2.9Å; W68-Y71 PolarHBondContact O-N 3.45Å; W68-D72 WeakPolarHBondContact O-CB 3.32Å; W68-D72 PolarHBondContact O-N 2.93Å; W68-D138 HydrophobicContact CE3-CB 3.98Å; W68-D138 HydrophobicContact CZ3-CB 3.79Å; W68-D138 WeakPolarHBondContact CZ3-O 3.25Å; W68-M141 HydrophobicContact CH2-CB 3.9Å; W68-M141 HydrophobicContact CH2-CG 3.76Å; W68-M141 HydrophobicContact CZ2-CG 4.24Å; W68-L142 HydrophobicContact CE3-CD1 4.17Å; W68-L142 HydrophobicContact CE3-CD2 4.19Å; W68-L142 HydrophobicContact CE3-CG 4.14Å; W68-L142 HydrophobicContact CH2-CD2 3.75Å; W68-L142 HydrophobicContact CH2-CG 3.76Å; W68-L142 HydrophobicContact CZ2-CD2 4.48Å; W68-L142 HydrophobicContact CZ3-CD1 3.77Å; W68-L142 HydrophobicContact CZ3-CD2 3.62Å; W68-L142 HydrophobicContact CZ3-CG 3.34Å; W68-F260 AromaticContact CZ2-CE1 3.92Å; W68-F260 HydrophobicContact CZ2-CE1 3.92Å; W68-F260 HydrophobicContact CZ2-CZ 4.03Å; W68-M261 PolarHBondContact NE1-SD 3.48Å; W68-R390 VanDerWaalsContact CD1-NH1 3.3Å; W68-R390 VanDerWaalsContact CG-NH1 3.29Å
69F75.3Confident76.5Confident17 Ų1748.7 Ų48.78%0.07526%0.258CS..Hα-helixtrans-58.5-39.7175.8177.3-102.5000113.1S65 W66 F67 R73 F97S65-F69 VanDerWaalsContact O-CB 3.3Å; S65-F69 WeakPolarHBondContact O-CB 3.23Å; S65-F69 PolarHBondContact O-N 3.21Å; W66-F69 HydrophobicContact CE3-CD1 4.4Å; W66-F69 HydrophobicContact CZ3-CD1 4.26Å; W66-F69 PolarHBondContact O-N 3.34Å; F67-F69 VanDerWaalsContact C-N 3.35Å; F67-F69 PolarHBondContact O-N 3.2Å; F69-R73 VanDerWaalsContact CE1-CD 3.49Å; F69-R73 HydrophobicContact CE1-CG 4.31Å; F69-R73 HydrophobicContact CE2-CG 4.38Å; F69-R73 HydrophobicContact CZ-CG 4.16Å; F69-R73 VanDerWaalsContact O-CG 3.32Å; F69-R73 WeakPolarHBondContact O-CG 3.28Å; F69-R73 PolarHBondContact O-N 3.36Å; F69-F97 HydrophobicContact CB-CD1 4.24Å; F69-F97 HydrophobicContact CB-CE1 3.52Å; F69-F97 HydrophobicContact CB-CZ 4.24Å; F69-F97 AromaticContact CD1-CD1 3.42Å; F69-F97 HydrophobicContact CD1-CD1 3.42Å; F69-F97 VanDerWaalsContact CD1-CD1 3.42Å; F69-F97 AromaticContact CD1-CE1 3.64Å; F69-F97 HydrophobicContact CD1-CE1 3.64Å; F69-F97 HydrophobicContact CD1-CG 4.39Å; F69-F97 AromaticContact CD2-CD1 3.96Å; F69-F97 HydrophobicContact CD2-CD1 3.96Å; F69-F97 AromaticContact CD2-CE1 3.67Å; F69-F97 HydrophobicContact CD2-CE1 3.67Å; F69-F97 HydrophobicContact CD2-CZ 4.04Å; F69-F97 HydrophobicContact CE1-CB 4.32Å; F69-F97 AromaticContact CE1-CD1 3.6Å; F69-F97 HydrophobicContact CE1-CD1 3.6Å; F69-F97 HydrophobicContact CE1-CE1 4.22Å; F69-F97 HydrophobicContact CE1-CG 4.17Å; F69-F97 HydrophobicContact CE2-CD1 4.12Å; F69-F97 HydrophobicContact CE2-CE1 4.26Å; F69-F97 HydrophobicContact CE2-CG 4.35Å; F69-F97 AromaticContact CG-CD1 3.59Å; F69-F97 HydrophobicContact CG-CD1 3.59Å; F69-F97 AromaticContact CG-CE1 3.31Å; F69-F97 HydrophobicContact CG-CE1 3.31Å; F69-F97 HydrophobicContact CG-CZ 4.1Å; F69-F97 HydrophobicContact CZ-CB 4.31Å; F69-F97 AromaticContact CZ-CD1 3.95Å; F69-F97 HydrophobicContact CZ-CD1 3.95Å; F69-F97 HydrophobicContact CZ-CE1 4.5Å; F69-F97 HydrophobicContact CZ-CG 4.14Å
70Q78.2Confident74.9Confident65 Ų6553 Ų5330%0.30427%0.274SS..Hα-helixtrans-61.5-51.2175.4-72.6-9230.800111.2W66 F67 W68 D72 R73W66-Q70 HydrophobicContact CD2-CG 4.42Å; W66-Q70 HydrophobicContact CZ2-CG 4.22Å; W66-Q70 WeakPolarHBondContact O-CG 3.41Å; W66-Q70 PolarHBondContact O-N 3.17Å; F67-Q70 WeakPolarHBondContact O-CB 3.47Å; F67-Q70 PolarHBondContact O-N 2.83Å; W68-Q70 VanDerWaalsContact C-N 3.29Å; W68-Q70 PolarHBondContact O-N 2.9Å; Q70-D72 VanDerWaalsContact C-N 3.33Å; Q70-D72 PolarHBondContact O-N 3.03Å; Q70-R73 WeakPolarHBondContact O-CB 3.47Å; Q70-R73 PolarHBondContact O-N 3Å
71Y79.9Confident73.3Confident18 Ų1856.5 Ų56.57%0.07129%0.289CS..Hα-helixtrans-63.4-39.3180-54.5-33000112.3F67 W68 R73 E74 M261 D262 S263 R390F67-Y71 HydrophobicContact CB-CE2 3.87Å; F67-Y71 WeakPolarHBondContact O-CD2 3.47Å; F67-Y71 WeakPolarHBondContact O-CE2 3.33Å; F67-Y71 PolarHBondContact O-N 3.11Å; W68-Y71 PolarHBondContact O-N 3.45Å; Y71-R73 VanDerWaalsContact C-N 3.26Å; Y71-R73 PolarHBondContact O-N 3.35Å; Y71-E74 WeakPolarHBondContact O-CB 3.5Å; Y71-E74 PolarHBondContact O-N 3.34Å; Y71-E74 VanDerWaalsContact O-N 3.11Å; Y71-M261 HydrophobicContact CE2-CB 4.49Å; Y71-M261 HydrophobicContact CE2-CE 4.34Å; Y71-M261 HydrophobicContact CE2-SD 4.01Å; Y71-D262 HydrophobicContact CD1-CB 3.99Å; Y71-D262 HydrophobicContact CD2-CB 4.49Å; Y71-D262 WeakPolarHBondContact CD2-OD2 3.35Å; Y71-D262 HydrophobicContact CE1-CB 3.87Å; Y71-D262 HydrophobicContact CE2-CB 4.37Å; Y71-D262 HydrophobicContact CG-CB 4.32Å; Y71-S263 VanDerWaalsContact OH-CB 3.24Å; Y71-S263 WeakPolarHBondContact OH-CB 3.29Å; Y71-S263 PolarHBondContact OH-N 2.76Å; Y71-S263 VanDerWaalsContact OH-N 3.11Å; Y71-S263 PolarHBondContact OH-OG 2.87Å; Y71-R390 VanDerWaalsContact CD2-NH2 3.3Å
72D74.5Confident71.6Confident5 Ų556.9 Ų56.93%0.02729%0.291CS..Hα-helixtrans-70-26.4-177.5-56.4-13.3000111.3W68 Q70 E74 L75 F78 R110 Y134 R390W68-D72 WeakPolarHBondContact O-CB 3.32Å; W68-D72 PolarHBondContact O-N 2.93Å; Q70-D72 VanDerWaalsContact C-N 3.33Å; Q70-D72 PolarHBondContact O-N 3.03Å; D72-E74 VanDerWaalsContact C-N 3.3Å; D72-L75 HydrophobicContact CB-CD1 4.47Å; D72-L75 WeakPolarHBondContact O-CB 3.5Å; D72-L75 PolarHBondContact O-N 3.26Å; D72-F78 HydrophobicContact CB-CD2 4.28Å; D72-F78 HydrophobicContact CB-CE2 3.89Å; D72-F78 HydrophobicContact CB-CZ 4.29Å; D72-F78 WeakPolarHBondContact O-CB 3.4Å; D72-F78 WeakPolarHBondContact O-CD2 3.19Å; D72-F78 WeakPolarHBondContact O-CG 3.35Å; D72-R110 IonicContact OD2-NH2 3.87Å; D72-Y134 VanDerWaalsContact CG-OH 3.26Å; D72-Y134 PolarHBondContact OD1-OH 3.35Å; D72-Y134 PolarHBondContact OD2-OH 3.23Å; D72-R390 IonicContact OD1-CZ 3.62Å; D72-R390 IonicContact OD1-NH1 3.16Å; D72-R390 PolarHBondContact OD1-NH1 2.88Å; D72-R390 IonicContact OD1-NH2 3.65Å; D72-R390 PolarHBondContact OD1-NH2 2.87Å; D72-R390 VanDerWaalsContact OD1-NH2 3.16Å
73R72Confident69.8Low114 Ų11461.2 Ų61.243%0.4332%0.319SS..Hα-helixtrans-69.5-26172-76.7178.570.2-157.42.8113.6F69 Q70 Y71 F78F69-R73 VanDerWaalsContact CE1-CD 3.49Å; F69-R73 HydrophobicContact CE1-CG 4.31Å; F69-R73 HydrophobicContact CE2-CG 4.38Å; F69-R73 HydrophobicContact CZ-CG 4.16Å; F69-R73 VanDerWaalsContact O-CG 3.32Å; F69-R73 WeakPolarHBondContact O-CG 3.28Å; F69-R73 PolarHBondContact O-N 3.36Å; Q70-R73 WeakPolarHBondContact O-CB 3.47Å; Q70-R73 PolarHBondContact O-N 3Å; Y71-R73 VanDerWaalsContact C-N 3.26Å; Y71-R73 PolarHBondContact O-N 3.35Å; R73-F78 HydrophobicContact CG-CD1 4.47Å; R73-F78 HydrophobicContact CG-CE1 4.25Å
74E72.3Confident67.9Low150 Ų15060.8 Ų60.870%0.70133%0.334SS*.THydrogen-bonded Turntrans-80.2-10.5178.5-64.1175.5-177.400111.6Y71 D72Y71-E74 WeakPolarHBondContact O-CB 3.5Å; Y71-E74 PolarHBondContact O-N 3.34Å; Y71-E74 VanDerWaalsContact O-N 3.11Å; D72-E74 VanDerWaalsContact C-N 3.3Å
75L70.2Confident66Low75 Ų7562.9 Ų62.939%0.39335%0.347SS..SBendtrans-73.7133.5178.1-67.7170000112.1D72 G77 F78D72-L75 HydrophobicContact CB-CD1 4.47Å; D72-L75 WeakPolarHBondContact O-CB 3.5Å; D72-L75 PolarHBondContact O-N 3.26Å; L75-G77 PolarHBondContact O-N 3.27Å; L75-F78 PolarHBondContact O-N 2.92Å
76P61.6Low64.1Low129 Ų12964.7 Ų64.784%0.83837%0.366SS*.THydrogen-bonded Turntrans-64.3129176.925.1-31.7000110.9
77G62.2Low62.2Low37 Ų3762.7 Ų62.738%0.38136%0.362SS..THydrogen-bonded Turntrans92.5-6.6178.700000116L75 S79 E80 Q81L75-G77 PolarHBondContact O-N 3.27Å; G77-S79 VanDerWaalsContact C-N 3.31Å; G77-S79 PolarHBondContact O-N 3.39Å; G77-E80 PolarHBondContact O-N 2.98Å; G77-Q81 PolarHBondContact O-N 3.35Å
78F62.7Low60.4Low29 Ų2965.7 Ų65.713%0.12738%0.384CS..Hα-helixtrans-60-38.7-179.8-174.5-98.4000113.1D72 R73 L75 T82 Y131D72-F78 HydrophobicContact CB-CD2 4.28Å; D72-F78 HydrophobicContact CB-CE2 3.89Å; D72-F78 HydrophobicContact CB-CZ 4.29Å; D72-F78 WeakPolarHBondContact O-CB 3.4Å; D72-F78 WeakPolarHBondContact O-CD2 3.19Å; D72-F78 WeakPolarHBondContact O-CG 3.35Å; R73-F78 HydrophobicContact CG-CD1 4.47Å; R73-F78 HydrophobicContact CG-CE1 4.25Å; L75-F78 PolarHBondContact O-N 2.92Å; F78-T82 WeakPolarHBondContact O-CB 3.43Å; F78-T82 PolarHBondContact O-N 3.42Å; F78-T82 PolarHBondContact O-OG1 2.88Å; F78-Y131 HydrophobicContact CE2-CE2 4.35Å
79S56.2Low58.7Low90 Ų9070.3 Ų70.363%0.62940%0.404SS*.Hα-helixtrans-63.5-46.9179.3-173.30000112G77 T82 T83G77-S79 VanDerWaalsContact C-N 3.31Å; G77-S79 PolarHBondContact O-N 3.39Å; S79-T82 PolarHBondContact O-N 2.88Å; S79-T83 PolarHBondContact O-N 2.69Å; S79-T83 PolarHBondContact O-OG1 3.25Å
80E54.7Low57.2Low158 Ų15871 Ų7174%0.73841%0.411SS*.Hα-helixtrans-66.8-42.5-174-65.4-174.9166.500112.4G77 T83 G84G77-E80 PolarHBondContact O-N 2.98Å; E80-T83 WeakPolarHBondContact CA-OG1 3Å; E80-T83 PolarHBondContact O-OG1 3.08Å; E80-G84 PolarHBondContact O-N 2.93Å; E80-G84 VanDerWaalsContact O-N 3.12Å
81Q53.5Low55.5Low94 Ų9470 Ų7044%0.43942%0.417SS..Hα-helixtrans-70.3-32.4178.2-95.8162.2-1800113.3G77 T85G77-Q81 PolarHBondContact O-N 3.35Å; Q81-T85 PolarHBondContact O-N 2.95Å; Q81-T85 PolarHBondContact O-OG1 2.92Å
82T52.3Low54Low8 Ų877 Ų775%0.04946%0.456CS..Hα-helixtrans-71.7-35.9178.3-540000111.8F78 S79 C90F78-T82 WeakPolarHBondContact O-CB 3.43Å; F78-T82 PolarHBondContact O-N 3.42Å; F78-T82 PolarHBondContact O-OG1 2.88Å; S79-T82 PolarHBondContact O-N 2.88Å; T82-C90 HydrophobicContact CG2-CB 3.55Å; T82-C90 WeakPolarHBondContact CG2-O 3.38Å
83T45.3Very low53.2Low107 Ų10785.1 Ų85.166%0.65649%0.486SS*.Hα-helixtrans-70-39.2172.730.30000113.3S79 E80 T85S79-T83 PolarHBondContact O-N 2.69Å; S79-T83 PolarHBondContact O-OG1 3.25Å; E80-T83 WeakPolarHBondContact CA-OG1 3Å; E80-T83 PolarHBondContact O-OG1 3.08Å; T83-T85 PolarHBondContact O-N 2.73Å
84G43.9Very low52.7Low70 Ų7080.8 Ų80.872%0.72248%0.475SS*.Hα-helixtrans-72.7-25.2-17900000114.7E80E80-G84 PolarHBondContact O-N 2.93Å; E80-G84 VanDerWaalsContact O-N 3.12Å
85T46.3Very low52.1Low44 Ų4482.6 Ų82.627%0.2748%0.48SS..THydrogen-bonded Turntrans-99.817.2-176.248.80000114.3Q81 T83 S87 R120Q81-T85 PolarHBondContact O-N 2.95Å; Q81-T85 PolarHBondContact O-OG1 2.92Å; T83-T85 PolarHBondContact O-N 2.73Å; T85-S87 PolarHBondContact O-N 3.31Å; T85-S87 VanDerWaalsContact O-N 3.08Å; T85-R120 PolarHBondContact O-NH1 3.34Å
86G41.4Very low51.8Low38 Ų3881.8 Ų81.839%0.39248%0.476SS..THydrogen-bonded Turntrans51.740.617300000113.2V88 R116G86-V88 PolarHBondContact O-N 3.33Å; G86-R116 PolarHBondContact O-NH2 2.89Å
87S41.4Very low51.9Low21 Ų2176.2 Ų76.215%0.14744%0.438CS..  trans-76.1100167177.70000107.3T85 F89T85-S87 PolarHBondContact O-N 3.31Å; T85-S87 VanDerWaalsContact O-N 3.08Å; S87-F89 PolarHBondContact O-N 2.97Å; S87-F89 VanDerWaalsContact O-N 3.16Å
88V44.8Very low51.8Low110 Ų11076.7 Ų76.767%0.66744%0.435SS*.THydrogen-bonded Turntrans-70.9-7.9-171.6175.80000112.5G86G86-V88 PolarHBondContact O-N 3.33Å
89F43.3Very low51.8Low98 Ų9879.7 Ų79.743%0.4345%0.453SS..THydrogen-bonded Turntrans-120.3-7-174-86.9-85.7000115.9S87 L100S87-F89 PolarHBondContact O-N 2.97Å; S87-F89 VanDerWaalsContact O-N 3.16Å; F89-L100 HydrophobicContact CD1-CD1 3.85Å; F89-L100 HydrophobicContact CE1-CD1 4.05Å
90C44.7Very low52.1Low32 Ų3276.5 Ų76.522%0.21643%0.428CS..  trans-114.923.5-176.3-69.10000114.1T82T82-C90 HydrophobicContact CG2-CB 3.55Å; T82-C90 WeakPolarHBondContact CG2-O 3.38Å
91G42.6Very low52.5Low43 Ų4369.7 Ų69.744%0.44340%0.396SS..SBendtrans-87.3132.3166.600000110.2R93G91-R93 WeakPolarHBondContact O-CB 3.32Å; G91-R93 WeakPolarHBondContact O-CG 3.36Å; G91-R93 PolarHBondContact O-N 3.5Å
92D48.2Very low53Low164 Ų16470.5 Ų70.588%0.87741%0.408SS*.SBendtrans27.111.1162.7-134.410.8000121.1
93R58.4Low53.3Low177 Ų17775 Ų7567%0.66843%0.431SS*.  trans-11556.3-173.8-60.6-167.2-167.7-172.45.6108.7G91 K95 L96 F97G91-R93 WeakPolarHBondContact O-CB 3.32Å; G91-R93 WeakPolarHBondContact O-CG 3.36Å; G91-R93 PolarHBondContact O-N 3.5Å; R93-K95 PolarHBondContact O-N 2.99Å; R93-L96 HydrophobicContact CB-CB 3.79Å; R93-L96 WeakPolarHBondContact O-CB 3.27Å; R93-L96 PolarHBondContact O-N 3.34Å; R93-F97 PolarHBondContact O-N 3.35Å
94A60.5Low54.2Low22 Ų2274 Ų7418%0.18242%0.418CS..Hα-helixtrans-50-3117200000112C98A94-C98 WeakPolarHBondContact O-CB 3.34Å; A94-C98 PolarHBondContact O-N 3.22Å
95K60.4Low54.9Low188 Ų18874.6 Ų74.682%0.81741%0.405SS*.Hα-helixtrans-66.6-38.6173.8-63.3-177.3-178.3177.70113.7R93 L99R93-K95 PolarHBondContact O-N 2.99Å; K95-L99 VanDerWaalsContact O-CB 3.3Å; K95-L99 WeakPolarHBondContact O-CB 3.13Å; K95-L99 PolarHBondContact O-N 3.23Å
96L63.1Low55.5Low58 Ų5872.5 Ų72.530%0.30439%0.392SS..Hα-helixtrans-72.4-40176.4-178.963.8000110.9R93 L99 L100R93-L96 HydrophobicContact CB-CB 3.79Å; R93-L96 WeakPolarHBondContact O-CB 3.27Å; R93-L96 PolarHBondContact O-N 3.34Å; L96-L99 HydrophobicContact CD1-CD2 4.48Å; L96-L99 PolarHBondContact O-N 3.32Å; L96-L100 HydrophobicContact CG-CD1 4.25Å; L96-L100 WeakPolarHBondContact O-CB 3.34Å; L96-L100 VanDerWaalsContact O-CG 3.31Å; L96-L100 WeakPolarHBondContact O-CG 3.3Å; L96-L100 PolarHBondContact O-N 3.39Å
97F63.5Low56.4Low12 Ų1271.2 Ų71.25%0.05338%0.375CS..Hα-helixtrans-65.9-41.8174.9-166.7-104.6000111.3W66 F69 R93 L99 L100 H101W66-F97 HydrophobicContact CE3-CD1 4.08Å; W66-F97 HydrophobicContact CE3-CE1 4.43Å; W66-F97 HydrophobicContact CZ3-CD1 4.07Å; F69-F97 HydrophobicContact CB-CD1 4.24Å; F69-F97 HydrophobicContact CB-CE1 3.52Å; F69-F97 HydrophobicContact CB-CZ 4.24Å; F69-F97 AromaticContact CD1-CD1 3.42Å; F69-F97 HydrophobicContact CD1-CD1 3.42Å; F69-F97 VanDerWaalsContact CD1-CD1 3.42Å; F69-F97 AromaticContact CD1-CE1 3.64Å; F69-F97 HydrophobicContact CD1-CE1 3.64Å; F69-F97 HydrophobicContact CD1-CG 4.39Å; F69-F97 AromaticContact CD2-CD1 3.96Å; F69-F97 HydrophobicContact CD2-CD1 3.96Å; F69-F97 AromaticContact CD2-CE1 3.67Å; F69-F97 HydrophobicContact CD2-CE1 3.67Å; F69-F97 HydrophobicContact CD2-CZ 4.04Å; F69-F97 HydrophobicContact CE1-CB 4.32Å; F69-F97 AromaticContact CE1-CD1 3.6Å; F69-F97 HydrophobicContact CE1-CD1 3.6Å; F69-F97 HydrophobicContact CE1-CE1 4.22Å; F69-F97 HydrophobicContact CE1-CG 4.17Å; F69-F97 HydrophobicContact CE2-CD1 4.12Å; F69-F97 HydrophobicContact CE2-CE1 4.26Å; F69-F97 HydrophobicContact CE2-CG 4.35Å; F69-F97 AromaticContact CG-CD1 3.59Å; F69-F97 HydrophobicContact CG-CD1 3.59Å; F69-F97 AromaticContact CG-CE1 3.31Å; F69-F97 HydrophobicContact CG-CE1 3.31Å; F69-F97 HydrophobicContact CG-CZ 4.1Å; F69-F97 HydrophobicContact CZ-CB 4.31Å; F69-F97 AromaticContact CZ-CD1 3.95Å; F69-F97 HydrophobicContact CZ-CD1 3.95Å; F69-F97 HydrophobicContact CZ-CE1 4.5Å; F69-F97 HydrophobicContact CZ-CG 4.14Å; R93-F97 PolarHBondContact O-N 3.35Å; F97-L99 PolarHBondContact O-N 3.02Å; F97-L100 PolarHBondContact O-N 3.49Å; F97-H101 AromaticContact CD1-CD2 3.51Å; F97-H101 AromaticContact CD1-NE2 3.89Å; F97-H101 AromaticContact CE1-CD2 3.22Å; F97-H101 WeakPolarHBondContact CE1-CD2 3.41Å; F97-H101 AromaticContact CE1-NE2 3.09Å; F97-H101 WeakPolarHBondContact CE1-NE2 3.4Å; F97-H101 AromaticContact CE2-NE2 3.8Å; F97-H101 AromaticContact CZ-CD2 3.55Å; F97-H101 AromaticContact CZ-NE2 3.03Å; F97-H101 WeakPolarHBondContact CZ-NE2 3.41Å; F97-H101 WeakPolarHBondContact O-CB 3.35Å; F97-H101 PolarHBondContact O-CD2 2.69Å; F97-H101 VanDerWaalsContact O-CD2 3.27Å; F97-H101 PolarHBondContact O-N 3.22Å
98C61.6Low57.3Low47 Ų4773.3 Ų73.332%0.31839%0.385SS..Hα-helixtrans-58.5-46.6170.6-173.20000111.4W66 A94 L100 H101 V102W66-C98 HydrophobicContact CH2-CB 3.67Å; W66-C98 HydrophobicContact CZ3-CB 3.64Å; A94-C98 WeakPolarHBondContact O-CB 3.34Å; A94-C98 PolarHBondContact O-N 3.22Å; C98-L100 PolarHBondContact O-N 2.92Å; C98-H101 WeakPolarHBondContact O-CB 3.32Å; C98-H101 PolarHBondContact O-N 3.22Å; C98-V102 VanDerWaalsContact O-CG2 3.3Å; C98-V102 WeakPolarHBondContact O-CG2 3.39Å; C98-V102 PolarHBondContact O-N 2.97Å
99L61.5Low57.9Low93 Ų9369.3 Ų69.349%0.48736%0.362SS..Hα-helixtrans-60.5-42.6176.4-174.270.2000111.9K95 L96 F97 H101 V102 L103K95-L99 VanDerWaalsContact O-CB 3.3Å; K95-L99 WeakPolarHBondContact O-CB 3.13Å; K95-L99 PolarHBondContact O-N 3.23Å; L96-L99 HydrophobicContact CD1-CD2 4.48Å; L96-L99 PolarHBondContact O-N 3.32Å; F97-L99 PolarHBondContact O-N 3.02Å; L99-H101 VanDerWaalsContact C-N 3.33Å; L99-H101 PolarHBondContact O-N 2.95Å; L99-V102 PolarHBondContact O-N 3.16Å; L99-L103 HydrophobicContact CD1-CD1 4.47Å; L99-L103 HydrophobicContact CG-CD1 4Å; L99-L103 WeakPolarHBondContact O-CB 3.29Å; L99-L103 VanDerWaalsContact O-CG 3.23Å; L99-L103 WeakPolarHBondContact O-CG 3.34Å; L99-L103 PolarHBondContact O-N 2.8Å
100L63.1Low58.8Low22 Ų2265.8 Ų65.812%0.11535%0.345CS..Hα-helixtrans-65.2-36.1175.7-74.6165.4000112.2F89 L96 F97 C98 L103 Q104 L105 G106F89-L100 HydrophobicContact CD1-CD1 3.85Å; F89-L100 HydrophobicContact CE1-CD1 4.05Å; L96-L100 HydrophobicContact CG-CD1 4.25Å; L96-L100 WeakPolarHBondContact O-CB 3.34Å; L96-L100 VanDerWaalsContact O-CG 3.31Å; L96-L100 WeakPolarHBondContact O-CG 3.3Å; L96-L100 PolarHBondContact O-N 3.39Å; F97-L100 PolarHBondContact O-N 3.49Å; C98-L100 PolarHBondContact O-N 2.92Å; L100-L103 CarbonylContact O-C 3.55Å; L100-L103 PolarHBondContact O-N 3.02Å; L100-Q104 PolarHBondContact O-N 3.05Å; L100-L105 HydrophobicContact CD2-CB 4Å; L100-L105 HydrophobicContact CD2-CD2 4.42Å; L100-L105 PolarHBondContact O-N 3.36Å; L100-G106 PolarHBondContact O-N 2.91Å
101H63.6Low59.5Low16 Ų1664.6 Ų64.67%0.07434%0.337CS..Hα-helixtrans-68.3-41.1173.5-91-76.1000112.3Q62 S65 F97 C98 L99 L103 Q104Q62-H101 PolarHBondContact O-ND1 3.45Å; S65-H101 VanDerWaalsContact CB-CE1 3.49Å; S65-H101 WeakPolarHBondContact CB-CE1 3.22Å; S65-H101 PolarHBondContact OG-CE1 2.97Å; S65-H101 VanDerWaalsContact OG-CE1 3.22Å; S65-H101 PolarHBondContact OG-NE2 2.99Å; F97-H101 AromaticContact CD1-CD2 3.51Å; F97-H101 AromaticContact CD1-NE2 3.89Å; F97-H101 AromaticContact CE1-CD2 3.22Å; F97-H101 WeakPolarHBondContact CE1-CD2 3.41Å; F97-H101 AromaticContact CE1-NE2 3.09Å; F97-H101 WeakPolarHBondContact CE1-NE2 3.4Å; F97-H101 AromaticContact CE2-NE2 3.8Å; F97-H101 AromaticContact CZ-CD2 3.55Å; F97-H101 AromaticContact CZ-NE2 3.03Å; F97-H101 WeakPolarHBondContact CZ-NE2 3.41Å; F97-H101 WeakPolarHBondContact O-CB 3.35Å; F97-H101 PolarHBondContact O-CD2 2.69Å; F97-H101 VanDerWaalsContact O-CD2 3.27Å; F97-H101 PolarHBondContact O-N 3.22Å; C98-H101 WeakPolarHBondContact O-CB 3.32Å; C98-H101 PolarHBondContact O-N 3.22Å; L99-H101 VanDerWaalsContact C-N 3.33Å; L99-H101 PolarHBondContact O-N 2.95Å; H101-L103 VanDerWaalsContact C-N 3.31Å; H101-Q104 PolarHBondContact O-N 2.98Å; H101-Q104 VanDerWaalsContact O-N 3.11Å
102V63.1Low60.4Low111 Ų11167 Ų6767%0.67334%0.343SS*.Hα-helixtrans-64.7-36.7173.8171.10000111.1C98 L99 Q104C98-V102 VanDerWaalsContact O-CG2 3.3Å; C98-V102 WeakPolarHBondContact O-CG2 3.39Å; C98-V102 PolarHBondContact O-N 2.97Å; L99-V102 PolarHBondContact O-N 3.16Å; V102-Q104 PolarHBondContact O-N 2.86Å
103L58.9Low60.9Low102 Ų10260.8 Ų60.853%0.53431%0.312SS..THydrogen-bonded Turntrans-797.3174.3-68.9171.3000113.6L99 L100 H101 L105L99-L103 HydrophobicContact CD1-CD1 4.47Å; L99-L103 HydrophobicContact CG-CD1 4Å; L99-L103 WeakPolarHBondContact O-CB 3.29Å; L99-L103 VanDerWaalsContact O-CG 3.23Å; L99-L103 WeakPolarHBondContact O-CG 3.34Å; L99-L103 PolarHBondContact O-N 2.8Å; L100-L103 CarbonylContact O-C 3.55Å; L100-L103 PolarHBondContact O-N 3.02Å; H101-L103 VanDerWaalsContact C-N 3.31Å; L103-L105 HydrophobicContact CB-CD1 4.31Å; L103-L105 WeakPolarHBondContact O-CD1 3.34Å; L103-L105 PolarHBondContact O-N 3.47Å
104Q63.4Low60.9Low85 Ų8553.1 Ų53.140%0.39729%0.286SS..THydrogen-bonded Turntrans630.4-176.8-58.8-179.1-34.200116.2Q62 L100 H101 V102Q62-Q104 PolarHBondContact NE2-O 3.45Å; L100-Q104 PolarHBondContact O-N 3.05Å; H101-Q104 PolarHBondContact O-N 2.98Å; H101-Q104 VanDerWaalsContact O-N 3.11Å; V102-Q104 PolarHBondContact O-N 2.86Å
105L59.2Low60.9Low84 Ų8455.7 Ų55.744%0.4430%0.296SS..  trans-79.5-13.5177.7-88.377.4000114.2L100 L103 F107 L108 C109L100-L105 HydrophobicContact CD2-CB 4Å; L100-L105 HydrophobicContact CD2-CD2 4.42Å; L100-L105 PolarHBondContact O-N 3.36Å; L103-L105 HydrophobicContact CB-CD1 4.31Å; L103-L105 WeakPolarHBondContact O-CD1 3.34Å; L103-L105 PolarHBondContact O-N 3.47Å; L105-F107 VanDerWaalsContact C-N 3.28Å; L105-F107 PolarHBondContact O-N 3.4Å; L105-L108 PolarHBondContact O-N 2.83Å; L105-L108 VanDerWaalsContact O-N 3.14Å; L105-C109 PolarHBondContact O-N 3.41Å; L105-C109 PolarHBondContact O-SG 2.9Å
106G58Low60.9Low0 Ų052.7 Ų52.70%028%0.28CS..Hα-helixtrans-55.6-39.4-175.500000114L100 C109 R110L100-G106 PolarHBondContact O-N 2.91Å; G106-C109 PolarHBondContact O-N 2.47Å; G106-R110 PolarHBondContact O-N 3.47Å
107F61.7Low60.7Low10 Ų1050.8 Ų50.84%0.04427%0.269CS..Hα-helixtrans-66.9-43.8177177.6-109.7000113.2F24 V61 Q62 L105 C109 R110 H111 L142 E146F24-F107 AromaticContact CE2-CE1 3.73Å; F24-F107 HydrophobicContact CE2-CE1 3.73Å; F24-F107 HydrophobicContact CE2-CZ 4.34Å; F24-F107 AromaticContact CZ-CE1 3.86Å; F24-F107 HydrophobicContact CZ-CE1 3.86Å; V61-F107 HydrophobicContact CG1-CB 4.33Å; V61-F107 HydrophobicContact CG1-CD2 3.23Å; V61-F107 HydrophobicContact CG1-CE2 3.54Å; V61-F107 HydrophobicContact CG1-CG 3.88Å; V61-F107 HydrophobicContact CG1-CZ 4.41Å; Q62-F107 VanDerWaalsContact NE2-CB 3.27Å; L105-F107 VanDerWaalsContact C-N 3.28Å; L105-F107 PolarHBondContact O-N 3.4Å; F107-C109 VanDerWaalsContact C-N 3.34Å; F107-C109 PolarHBondContact O-N 3.22Å; F107-R110 PolarHBondContact O-N 2.82Å; F107-H111 AromaticContact CD2-ND1 3.82Å; F107-H111 AromaticContact CE1-CE1 3.73Å; F107-H111 AromaticContact CE1-ND1 3.73Å; F107-H111 AromaticContact CE2-CE1 3.19Å; F107-H111 WeakPolarHBondContact CE2-CE1 3.41Å; F107-H111 AromaticContact CE2-ND1 3.43Å; F107-H111 WeakPolarHBondContact CE2-ND1 3.41Å; F107-H111 AromaticContact CZ-CE1 3Å; F107-H111 WeakPolarHBondContact CZ-CE1 3.29Å; F107-H111 AromaticContact CZ-ND1 3.38Å; F107-H111 WeakPolarHBondContact CZ-ND1 3.45Å; F107-H111 AromaticContact CZ-NE2 3.91Å; F107-H111 PolarHBondContact O-N 3.22Å; F107-H111 PolarHBondContact O-ND1 3.38Å; F107-L142 HydrophobicContact CE2-CB 4.11Å; F107-E146 WeakPolarHBondContact CE1-OE1 3.44Å; F107-E146 WeakPolarHBondContact CZ-OE2 3.4Å
108L59.4Low60.3Low66 Ų6651.1 Ų51.135%0.34628%0.276SS..Hα-helixtrans-63.9-40.3175.8-67.1174.3000111F24 L105 R110 H111 V112F24-L108 HydrophobicContact CE1-CD2 4.36Å; F24-L108 HydrophobicContact CZ-CD2 4.17Å; L105-L108 PolarHBondContact O-N 2.83Å; L105-L108 VanDerWaalsContact O-N 3.14Å; L108-R110 PolarHBondContact O-N 3.23Å; L108-H111 PolarHBondContact O-N 3.41Å; L108-V112 WeakPolarHBondContact O-CB 3.2Å; L108-V112 VanDerWaalsContact O-CG2 3.3Å; L108-V112 WeakPolarHBondContact O-CG2 3.36Å; L108-V112 PolarHBondContact O-N 2.9Å
109C58.4Low60.2Low26 Ų2654 Ų5418%0.17628%0.283CS..Hα-helixtrans-62.2-40.5174.9-720000112.3L105 G106 F107 S113L105-C109 PolarHBondContact O-N 3.41Å; L105-C109 PolarHBondContact O-SG 2.9Å; G106-C109 PolarHBondContact O-N 2.47Å; F107-C109 VanDerWaalsContact C-N 3.34Å; F107-C109 PolarHBondContact O-N 3.22Å; C109-S113 VanDerWaalsContact O-CB 3.23Å; C109-S113 WeakPolarHBondContact O-CB 3.33Å; C109-S113 PolarHBondContact O-N 2.9Å; C109-S113 PolarHBondContact O-OG 3.06Å
110R61.7Low60.1Low23 Ų2353.2 Ų53.29%0.08727%0.274CS..Hα-helixtrans-66.1-41.5175.7-159.9-179.4-168.11221.3111.1S65 D72 G106 F107 L108 S113 A114 L135 D138S65-R110 PolarHBondContact O-NH1 2.86Å; S65-R110 PolarHBondContact OG-NH1 3.36Å; D72-R110 IonicContact OD2-NH2 3.87Å; G106-R110 PolarHBondContact O-N 3.47Å; F107-R110 PolarHBondContact O-N 2.82Å; L108-R110 PolarHBondContact O-N 3.23Å; R110-S113 PolarHBondContact O-N 3.25Å; R110-A114 WeakPolarHBondContact O-CB 3.48Å; R110-A114 PolarHBondContact O-N 3.38Å; R110-L135 HydrophobicContact CG-CD1 4.12Å; R110-D138 IonicContact CZ-OD2 3.23Å; R110-D138 IonicContact NH2-OD2 3.8Å; R110-D138 PolarHBondContact NH2-OD2 3.24Å
111H59.6Low59.8Low8 Ų853.7 Ų53.74%0.03728%0.278CS..Hα-helixtrans-61.5-51.4174.9-92.773.2000112.9F107 L108 S113 A114 I115 L139F107-H111 AromaticContact CD2-ND1 3.82Å; F107-H111 AromaticContact CE1-CE1 3.73Å; F107-H111 AromaticContact CE1-ND1 3.73Å; F107-H111 AromaticContact CE2-CE1 3.19Å; F107-H111 WeakPolarHBondContact CE2-CE1 3.41Å; F107-H111 AromaticContact CE2-ND1 3.43Å; F107-H111 WeakPolarHBondContact CE2-ND1 3.41Å; F107-H111 AromaticContact CZ-CE1 3Å; F107-H111 WeakPolarHBondContact CZ-CE1 3.29Å; F107-H111 AromaticContact CZ-ND1 3.38Å; F107-H111 WeakPolarHBondContact CZ-ND1 3.45Å; F107-H111 AromaticContact CZ-NE2 3.91Å; F107-H111 PolarHBondContact O-N 3.22Å; F107-H111 PolarHBondContact O-ND1 3.38Å; L108-H111 PolarHBondContact O-N 3.41Å; H111-S113 VanDerWaalsContact C-N 3.27Å; H111-S113 PolarHBondContact O-N 3.29Å; H111-A114 PolarHBondContact O-N 3.45Å; H111-I115 VanDerWaalsContact O-CG1 3.3Å; H111-I115 WeakPolarHBondContact O-CG1 3.4Å; H111-I115 PolarHBondContact O-N 2.89Å; H111-L139 HydrophobicContact CB-CD1 4.4Å
112V60.4Low59.5Low94 Ų9458.1 Ų58.157%0.5729%0.294SS*.Hα-helixtrans-61.9-38.2177.9172.20000110.8L108 R116L108-V112 WeakPolarHBondContact O-CB 3.2Å; L108-V112 VanDerWaalsContact O-CG2 3.3Å; L108-V112 WeakPolarHBondContact O-CG2 3.36Å; L108-V112 PolarHBondContact O-N 2.9Å; V112-R116 WeakPolarHBondContact O-CB 3.34Å; V112-R116 PolarHBondContact O-N 3.27Å
113S59.9Low59Low32 Ų3261.3 Ų61.322%0.22429%0.294CS..Hα-helixtrans-65.2-43.1176.7-60.90000112.1C109 R110 H111 R116 Q117C109-S113 VanDerWaalsContact O-CB 3.23Å; C109-S113 WeakPolarHBondContact O-CB 3.33Å; C109-S113 PolarHBondContact O-N 2.9Å; C109-S113 PolarHBondContact O-OG 3.06Å; R110-S113 PolarHBondContact O-N 3.25Å; H111-S113 VanDerWaalsContact C-N 3.27Å; H111-S113 PolarHBondContact O-N 3.29Å; S113-R116 PolarHBondContact O-N 3.38Å; S113-Q117 WeakPolarHBondContact O-CB 3.29Å; S113-Q117 PolarHBondContact O-N 3.33Å
114A58.8Low58.6Low16 Ų1664.1 Ų64.113%0.13230%0.297CS..Hα-helixtrans-64.2-45.2176.700000112.4R110 H111 Q117 G118 L135 L139R110-A114 WeakPolarHBondContact O-CB 3.48Å; R110-A114 PolarHBondContact O-N 3.38Å; H111-A114 PolarHBondContact O-N 3.45Å; A114-Q117 PolarHBondContact O-N 2.83Å; A114-G118 PolarHBondContact O-N 3.11Å; A114-L135 HydrophobicContact CB-CD2 3.68Å; A114-L135 HydrophobicContact CB-CG 3.86Å; A114-L139 HydrophobicContact CB-CD1 3.67Å
115I59.6Low58.2Low76 Ų7669.5 Ų69.539%0.3932%0.32SS..Hα-helixtrans-63.6-44.2176.9-65.8166.1000110.4V21 H111 Q117 G118 F119V21-I115 HydrophobicContact CB-CD1 4.49Å; V21-I115 HydrophobicContact CG1-CD1 3.92Å; V21-I115 HydrophobicContact CG2-CD1 3.64Å; V21-I115 HydrophobicContact CG2-CG1 3.91Å; H111-I115 VanDerWaalsContact O-CG1 3.3Å; H111-I115 WeakPolarHBondContact O-CG1 3.4Å; H111-I115 PolarHBondContact O-N 2.89Å; I115-Q117 PolarHBondContact O-N 3.47Å; I115-G118 PolarHBondContact O-N 2.92Å; I115-F119 VanDerWaalsContact O-CB 3.29Å; I115-F119 WeakPolarHBondContact O-CB 3.4Å; I115-F119 PolarHBondContact O-N 2.88Å
116R61.4Low57.7Low125 Ų12571.3 Ų71.347%0.47233%0.326SS..Hα-helixtrans-65.5-38180-170173.9115.1147.70.5112.2G86 V112 S113 R120G86-R116 PolarHBondContact O-NH2 2.89Å; V112-R116 WeakPolarHBondContact O-CB 3.34Å; V112-R116 PolarHBondContact O-N 3.27Å; S113-R116 PolarHBondContact O-N 3.38Å; R116-R120 WeakPolarHBondContact O-CB 3.47Å; R116-R120 PolarHBondContact O-N 3.38Å
117Q56.9Low57.1Low18 Ų1876.7 Ų76.78%0.08437%0.37CS..Hα-helixtrans-72.5-43.5174.7-82.3178.2-10.300112.1S113 A114 I115 F119 R120 V121 Y131S113-Q117 WeakPolarHBondContact O-CB 3.29Å; S113-Q117 PolarHBondContact O-N 3.33Å; A114-Q117 PolarHBondContact O-N 2.83Å; I115-Q117 PolarHBondContact O-N 3.47Å; Q117-F119 VanDerWaalsContact C-N 3.3Å; Q117-F119 PolarHBondContact O-N 2.88Å; Q117-R120 PolarHBondContact O-N 3.26Å; Q117-R120 VanDerWaalsContact O-N 3.11Å; Q117-V121 WeakPolarHBondContact O-CG2 3.45Å; Q117-V121 PolarHBondContact O-N 2.92Å; Q117-Y131 VanDerWaalsContact OE1-CD1 3.31Å
118G56.8Low56.6Low19 Ų1977.5 Ų77.520%0.19638%0.381CS..Hα-helixtrans-57.5-43.8174.200000111.9A114 I115 W122A114-G118 PolarHBondContact O-N 3.11Å; I115-G118 PolarHBondContact O-N 2.92Å; G118-W122 WeakPolarHBondContact O-CB 3.41Å; G118-W122 PolarHBondContact O-N 2.88Å
119F59.3Low56.5Low108 Ų10876 Ų7647%0.47438%0.377SS..Hα-helixtrans-63.4-41.6174.2-173-98.8000112.3I115 Q117 W122 W123I115-F119 VanDerWaalsContact O-CB 3.29Å; I115-F119 WeakPolarHBondContact O-CB 3.4Å; I115-F119 PolarHBondContact O-N 2.88Å; Q117-F119 VanDerWaalsContact C-N 3.3Å; Q117-F119 PolarHBondContact O-N 2.88Å; F119-W122 HydrophobicContact CD2-CE3 4.32Å; F119-W122 HydrophobicContact CE2-CE3 4.23Å; F119-W122 HydrophobicContact CE2-CZ3 4.14Å; F119-W122 PolarHBondContact O-N 3.46Å; F119-W123 HydrophobicContact CE1-CB 4.45Å; F119-W123 HydrophobicContact CZ-CD2 4.49Å; F119-W123 HydrophobicContact CZ-CE3 4.18Å; F119-W123 WeakPolarHBondContact O-CB 3.36Å; F119-W123 PolarHBondContact O-N 3.16Å
120R58.8Low56.5Low77 Ų7778.5 Ų78.529%0.29139%0.386SS..Hα-helixtrans-66.5-43.1178.9-169.8-174.4-62.2173.30.9112.6T85 R116 Q117 W122 W123 R124T85-R120 PolarHBondContact O-NH1 3.34Å; R116-R120 WeakPolarHBondContact O-CB 3.47Å; R116-R120 PolarHBondContact O-N 3.38Å; Q117-R120 PolarHBondContact O-N 3.26Å; Q117-R120 VanDerWaalsContact O-N 3.11Å; R120-W122 VanDerWaalsContact C-N 3.34Å; R120-W123 PolarHBondContact O-N 3.07Å; R120-R124 WeakPolarHBondContact O-CB 3.36Å; R120-R124 PolarHBondContact O-N 3.47Å
121V57.4Low56.5Low32 Ų3279.1 Ų79.119%0.19439%0.388CS..Hα-helixtrans-64.2-42.1177.3172.30000110.4Q117 K125 A132Q117-V121 WeakPolarHBondContact O-CG2 3.45Å; Q117-V121 PolarHBondContact O-N 2.92Å; V121-K125 PolarHBondContact O-N 2.91Å; V121-K125 VanDerWaalsContact O-N 3.07Å; V121-A132 HydrophobicContact CG2-CB 4.03Å
122W57.4Low56.5Low109 Ų10979.3 Ų79.341%0.41339%0.391SS..Hα-helixtrans-65.5-44.8176.1-178.971.3000112.7F14 G118 F119 R120F14-W122 HydrophobicContact CE2-CD2 4.49Å; G118-W122 WeakPolarHBondContact O-CB 3.41Å; G118-W122 PolarHBondContact O-N 2.88Å; F119-W122 HydrophobicContact CD2-CE3 4.32Å; F119-W122 HydrophobicContact CE2-CE3 4.23Å; F119-W122 HydrophobicContact CE2-CZ3 4.14Å; F119-W122 PolarHBondContact O-N 3.46Å; R120-W122 VanDerWaalsContact C-N 3.34Å
123W51.2Low56.7Low177 Ų17777.2 Ų77.267%0.6738%0.376SS*.Hα-helixtrans-74.9-36.3-176.6-168.4-94.9000113.6F119 R120F119-W123 HydrophobicContact CE1-CB 4.45Å; F119-W123 HydrophobicContact CZ-CD2 4.49Å; F119-W123 HydrophobicContact CZ-CE3 4.18Å; F119-W123 WeakPolarHBondContact O-CB 3.36Å; F119-W123 PolarHBondContact O-N 3.16Å; R120-W123 PolarHBondContact O-N 3.07Å
124R51.9Low56.9Low162 Ų16276.4 Ų76.461%0.61137%0.368SS*.Hα-helixtrans-103.3-8.4-174.7-69.1-165.9-179.9-160.3-1115.9R120 E126R120-R124 WeakPolarHBondContact O-CB 3.36Å; R120-R124 PolarHBondContact O-N 3.47Å; R124-E126 HydrophobicContact CB-CB 4.38Å; R124-E126 HydrophobicContact CB-CG 4.35Å; R124-E126 PolarHBondContact O-N 3.25Å
125K54.2Low57.1Low198 Ų19876.1 Ų76.186%0.86137%0.365SS*.  trans49.328.6-177-69-178.2177173.80114.2V121V121-K125 PolarHBondContact O-N 2.91Å; V121-K125 VanDerWaalsContact O-N 3.07Å
126E49.4Very low57.5Low122 Ų12275 Ų7557%0.5736%0.361SS*.  trans-94.7163.6-173.6-92.1174.4168.300113.9R124 G128R124-E126 HydrophobicContact CB-CB 4.38Å; R124-E126 HydrophobicContact CB-CG 4.35Å; R124-E126 PolarHBondContact O-N 3.25Å; E126-G128 PolarHBondContact O-N 3.46Å
127A45.3Very low58Low113 Ų11369.6 Ų69.693%0.93434%0.341SS*.SBendtrans-5995.6175.100000111.8
128G51.4Low58.9Low27 Ų2768.9 Ų68.928%0.27834%0.338SS..  trans-177.98176.200000113.2E126 E130 A132E126-G128 PolarHBondContact O-N 3.46Å; G128-E130 PolarHBondContact O-N 2.96Å; G128-A132 PolarHBondContact O-N 2.85Å
129S56.3Low59.6Low35 Ų3568.9 Ų68.925%0.24533%0.333CS..Hα-helixtrans-59.7-34-178.4-174.40000112.3I133S129-I133 WeakPolarHBondContact O-CB 3.47Å; S129-I133 WeakPolarHBondContact O-CD1 3.37Å; S129-I133 WeakPolarHBondContact O-CG1 3.45Å; S129-I133 PolarHBondContact O-N 3.22Å
130E59.5Low60.5Low78 Ų7863.8 Ų63.836%0.36431%0.311SS..Hα-helixtrans-70.5-45-175.4-63.4-176-174.900112.1G128 A132 I133 Y134 L385G128-E130 PolarHBondContact O-N 2.96Å; E130-A132 PolarHBondContact O-N 3.16Å; E130-I133 PolarHBondContact O-N 3.36Å; E130-Y134 WeakPolarHBondContact O-CB 3.34Å; E130-Y134 PolarHBondContact O-N 2.92Å; E130-L385 WeakPolarHBondContact OE1-CD1 3.17Å
131Y60.6Low61.7Low36 Ų3660.2 Ų60.214%0.14130%0.298CS..Hα-helixtrans-65.8-38.1175.6-172.4-97.6000112.1F78 Q117 Y134 L135 L386F78-Y131 HydrophobicContact CE2-CE2 4.35Å; Q117-Y131 VanDerWaalsContact OE1-CD1 3.31Å; Y131-Y134 WeakPolarHBondContact O-CB 3.08Å; Y131-Y134 PolarHBondContact O-N 3.17Å; Y131-L135 WeakPolarHBondContact O-CB 3.44Å; Y131-L135 PolarHBondContact O-N 3.37Å; Y131-L386 HydrophobicContact CD2-CD1 4.41Å; Y131-L386 HydrophobicContact CD2-CD2 4.48Å
132A60.2Low62.9Low12 Ų1258.8 Ų58.810%0.09929%0.289CS..Hα-helixtrans-65-38.7175.300000112.3V121 G128 E130 L135 T136V121-A132 HydrophobicContact CG2-CB 4.03Å; G128-A132 PolarHBondContact O-N 2.85Å; E130-A132 PolarHBondContact O-N 3.16Å; A132-L135 PolarHBondContact O-N 2.82Å; A132-T136 WeakPolarHBondContact O-CB 3.34Å; A132-T136 PolarHBondContact O-N 2.88Å; A132-T136 PolarHBondContact O-OG1 3.11Å
133I63.8Low64.1Low49 Ų4954.2 Ų54.225%0.25127%0.272SS..Hα-helixtrans-65.4-46.3174.1-71.6165.1000110.3S129 E130 L135 T136 H137S129-I133 WeakPolarHBondContact O-CB 3.47Å; S129-I133 WeakPolarHBondContact O-CD1 3.37Å; S129-I133 WeakPolarHBondContact O-CG1 3.45Å; S129-I133 PolarHBondContact O-N 3.22Å; E130-I133 PolarHBondContact O-N 3.36Å; I133-L135 VanDerWaalsContact C-N 3.33Å; I133-L135 PolarHBondContact O-N 2.86Å; I133-T136 PolarHBondContact O-N 2.66Å; I133-H137 WeakPolarHBondContact CG2-NE2 3.18Å; I133-H137 PolarHBondContact O-CD2 3.33Å; I133-H137 VanDerWaalsContact O-CG 3.26Å; I133-H137 PolarHBondContact O-N 3.48Å
134Y64.4Low65.8Low15 Ų1545.8 Ų45.86%0.05924%0.24CC..Hα-helixtrans-54.6-47.1174.6178-80.6000112.2D72 E130 Y131 H137 D138 L386 N388D72-Y134 VanDerWaalsContact CG-OH 3.26Å; D72-Y134 PolarHBondContact OD1-OH 3.35Å; D72-Y134 PolarHBondContact OD2-OH 3.23Å; E130-Y134 WeakPolarHBondContact O-CB 3.34Å; E130-Y134 PolarHBondContact O-N 2.92Å; Y131-Y134 WeakPolarHBondContact O-CB 3.08Å; Y131-Y134 PolarHBondContact O-N 3.17Å; Y134-H137 WeakPolarHBondContact O-CB 3.21Å; Y134-H137 PolarHBondContact O-N 3.25Å; Y134-D138 WeakPolarHBondContact CE1-OD2 3.39Å; Y134-D138 PolarHBondContact O-N 3.38Å; Y134-L386 HydrophobicContact CD1-CD2 4.34Å; Y134-L386 HydrophobicContact CD2-CD2 3.49Å; Y134-L386 VanDerWaalsContact CD2-CD2 3.49Å; Y134-L386 HydrophobicContact CE2-CD2 3.96Å; Y134-L386 HydrophobicContact CG-CD2 3.72Å; Y134-N388 HydrophobicContact CD2-CB 3.5Å; Y134-N388 HydrophobicContact CE2-CB 3.61Å; Y134-N388 HydrophobicContact CG-CB 4.38Å
135L63.8Low67.6Low11 Ų1138.1 Ų38.16%0.05821%0.211CC..Hα-helixtrans-70-34.2-179.1-173.860.5000112.3R110 A114 Y131 A132 I133 H137 L139R110-L135 HydrophobicContact CG-CD1 4.12Å; A114-L135 HydrophobicContact CB-CD2 3.68Å; A114-L135 HydrophobicContact CB-CG 3.86Å; Y131-L135 WeakPolarHBondContact O-CB 3.44Å; Y131-L135 PolarHBondContact O-N 3.37Å; A132-L135 PolarHBondContact O-N 2.82Å; I133-L135 VanDerWaalsContact C-N 3.33Å; I133-L135 PolarHBondContact O-N 2.86Å; L135-H137 VanDerWaalsContact C-N 3.31Å; L135-L139 VanDerWaalsContact O-CB 3.27Å; L135-L139 WeakPolarHBondContact O-CB 3.42Å; L135-L139 PolarHBondContact O-N 3.05Å
136T67.3Low69.2Low51 Ų5129.8 Ų29.831%0.31318%0.175SC..Hα-helixtrans-63.6-39.5174.6-57.50000111A132 I133 L139 S140A132-T136 WeakPolarHBondContact O-CB 3.34Å; A132-T136 PolarHBondContact O-N 2.88Å; A132-T136 PolarHBondContact O-OG1 3.11Å; I133-T136 PolarHBondContact O-N 2.66Å; T136-L139 PolarHBondContact O-N 3.37Å; T136-S140 PolarHBondContact O-N 3.43Å; T136-S140 PolarHBondContact O-OG 3.4Å
137H72.4Confident71.2Confident12 Ų1224.3 Ų24.36%0.05615%0.15CC..Hα-helixtrans-60.2-52.9175.6-73-20.6000112.3I133 Y134 L135 L139 S140 M141 S193 S196 F197 M391I133-H137 WeakPolarHBondContact CG2-NE2 3.18Å; I133-H137 PolarHBondContact O-CD2 3.33Å; I133-H137 VanDerWaalsContact O-CG 3.26Å; I133-H137 PolarHBondContact O-N 3.48Å; Y134-H137 WeakPolarHBondContact O-CB 3.21Å; Y134-H137 PolarHBondContact O-N 3.25Å; L135-H137 VanDerWaalsContact C-N 3.31Å; H137-L139 VanDerWaalsContact C-N 3.28Å; H137-L139 PolarHBondContact O-N 3.02Å; H137-S140 PolarHBondContact O-N 3.15Å; H137-M141 PolarHBondContact O-N 3.28Å; H137-M141 VanDerWaalsContact O-N 3.16Å; H137-S193 PolarHBondContact CE1-O 2.84Å; H137-S193 PolarHBondContact ND1-O 3.11Å; H137-S196 PolarHBondContact CE1-OG 3.03Å; H137-S196 PolarHBondContact NE2-OG 3.25Å; H137-F197 AromaticContact CD2-CE2 3.83Å; H137-F197 AromaticContact CD2-CZ 3.62Å; H137-F197 AromaticContact NE2-CE2 3.86Å; H137-F197 AromaticContact NE2-CZ 3.97Å; H137-M391 VanDerWaalsContact CA-SD 3.51Å; H137-M391 HydrophobicContact CB-CG 4.15Å; H137-M391 HydrophobicContact CB-SD 3.36Å; H137-M391 WeakPolarHBondContact CB-SD 3.28Å
138D74.6Confident73.5Confident3 Ų319.1 Ų19.12%0.01611%0.106CC..Hα-helixtrans-57.9-43175-80.5-6.3000112.2W68 R110 Y134 M141 L142 N388W68-D138 HydrophobicContact CE3-CB 3.98Å; W68-D138 HydrophobicContact CZ3-CB 3.79Å; W68-D138 WeakPolarHBondContact CZ3-O 3.25Å; R110-D138 IonicContact CZ-OD2 3.23Å; R110-D138 IonicContact NH2-OD2 3.8Å; R110-D138 PolarHBondContact NH2-OD2 3.24Å; Y134-D138 WeakPolarHBondContact CE1-OD2 3.39Å; Y134-D138 PolarHBondContact O-N 3.38Å; D138-M141 PolarHBondContact O-N 3.21Å; D138-L142 WeakPolarHBondContact O-CG 3.38Å; D138-L142 PolarHBondContact O-N 3.04Å; D138-N388 PolarHBondContact OD1-ND2 2.79Å
139L72.6Confident75.3Confident20 Ų2018.1 Ų18.111%0.10510%0.095CC..Hα-helixtrans-64.6-43.7-178.3-169.4127.5000111.9H111 A114 L135 T136 H137 M141 L142 R143H111-L139 HydrophobicContact CB-CD1 4.4Å; A114-L139 HydrophobicContact CB-CD1 3.67Å; L135-L139 VanDerWaalsContact O-CB 3.27Å; L135-L139 WeakPolarHBondContact O-CB 3.42Å; L135-L139 PolarHBondContact O-N 3.05Å; T136-L139 PolarHBondContact O-N 3.37Å; H137-L139 VanDerWaalsContact C-N 3.28Å; H137-L139 PolarHBondContact O-N 3.02Å; L139-M141 VanDerWaalsContact C-N 3.27Å; L139-M141 PolarHBondContact O-N 2.9Å; L139-L142 PolarHBondContact O-N 3.08Å; L139-R143 HydrophobicContact CD2-CG 4.41Å; L139-R143 WeakPolarHBondContact O-CB 3.5Å; L139-R143 WeakPolarHBondContact O-CG 3.43Å; L139-R143 PolarHBondContact O-N 3.22Å
140S77.6Confident77Confident1 Ų117 Ų171%0.0079%0.086CC..Hα-helixtrans-59.3-38174-67.70000112.1T136 H137 L144 D189 S193T136-S140 PolarHBondContact O-N 3.43Å; T136-S140 PolarHBondContact O-OG 3.4Å; H137-S140 PolarHBondContact O-N 3.15Å; S140-L144 WeakPolarHBondContact O-CB 3.42Å; S140-L144 PolarHBondContact O-N 3.28Å; S140-L144 VanDerWaalsContact O-N 3.07Å; S140-D189 WeakPolarHBondContact CB-OD2 3.41Å; S140-D189 PolarHBondContact OG-OD2 2.89Å; S140-S193 WeakPolarHBondContact CB-OG 3.38Å; S140-S193 PolarHBondContact OG-OG 3.31Å
141M83.5Confident78.4Confident2 Ų213.7 Ų13.71%0.017%0.072CC..Hα-helixtrans-71.9-42.7177.6-174.761.9178.300112.5W68 H137 D138 L139 R143 L144 I145 Y190 F260 Y270 F283W68-M141 HydrophobicContact CH2-CB 3.9Å; W68-M141 HydrophobicContact CH2-CG 3.76Å; W68-M141 HydrophobicContact CZ2-CG 4.24Å; H137-M141 PolarHBondContact O-N 3.28Å; H137-M141 VanDerWaalsContact O-N 3.16Å; D138-M141 PolarHBondContact O-N 3.21Å; L139-M141 VanDerWaalsContact C-N 3.27Å; L139-M141 PolarHBondContact O-N 2.9Å; M141-R143 VanDerWaalsContact C-N 3.32Å; M141-R143 PolarHBondContact O-N 3.48Å; M141-L144 WeakPolarHBondContact O-CB 3.49Å; M141-L144 PolarHBondContact O-N 3.47Å; M141-L144 HydrophobicContact SD-CD2 4.16Å; M141-I145 HydrophobicContact CE-CD1 4.29Å; M141-I145 HydrophobicContact CG-CD1 4.38Å; M141-I145 WeakPolarHBondContact O-CG1 3.47Å; M141-I145 PolarHBondContact O-N 3.41Å; M141-I145 VanDerWaalsContact O-N 3.07Å; M141-Y190 HydrophobicContact CB-CD2 4.41Å; M141-Y190 HydrophobicContact CB-CE2 4.36Å; M141-Y190 HydrophobicContact CG-CE2 4.43Å; M141-Y190 HydrophobicContact SD-CD2 3.87Å; M141-Y190 HydrophobicContact SD-CE2 3.36Å; M141-Y190 WeakPolarHBondContact SD-CE2 3.44Å; M141-F260 HydrophobicContact CE-CE1 4.46Å; M141-F260 HydrophobicContact CE-CZ 4.27Å; M141-F260 HydrophobicContact CG-CZ 4.39Å; M141-Y270 HydrophobicContact CE-CE2 4.03Å; M141-F283 HydrophobicContact CE-CE1 4.38Å; M141-F283 HydrophobicContact CE-CZ 4.04Å; M141-F283 HydrophobicContact SD-CZ 4.35Å
142L82.6Confident79.9Confident1 Ų112 Ų121%0.0057%0.065CC..Hα-helixtrans-61.9-42.2175.9-71.8166.7000111.6V61 F64 W68 F107 D138 L139 L144 I145 E146V61-L142 HydrophobicContact CG1-CB 4.4Å; V61-L142 HydrophobicContact CG1-CD2 4.19Å; F64-L142 HydrophobicContact CB-CD2 3.59Å; W68-L142 HydrophobicContact CE3-CD1 4.17Å; W68-L142 HydrophobicContact CE3-CD2 4.19Å; W68-L142 HydrophobicContact CE3-CG 4.14Å; W68-L142 HydrophobicContact CH2-CD2 3.75Å; W68-L142 HydrophobicContact CH2-CG 3.76Å; W68-L142 HydrophobicContact CZ2-CD2 4.48Å; W68-L142 HydrophobicContact CZ3-CD1 3.77Å; W68-L142 HydrophobicContact CZ3-CD2 3.62Å; W68-L142 HydrophobicContact CZ3-CG 3.34Å; F107-L142 HydrophobicContact CE2-CB 4.11Å; D138-L142 WeakPolarHBondContact O-CG 3.38Å; D138-L142 PolarHBondContact O-N 3.04Å; L139-L142 PolarHBondContact O-N 3.08Å; L142-L144 VanDerWaalsContact C-N 3.32Å; L142-L144 PolarHBondContact O-N 2.99Å; L142-I145 WeakPolarHBondContact O-CB 3.42Å; L142-I145 PolarHBondContact O-N 3.1Å; L142-I145 VanDerWaalsContact O-N 3.16Å; L142-E146 WeakPolarHBondContact O-CB 3.02Å; L142-E146 PolarHBondContact O-N 3.47Å
143R82.4Confident81.5Confident13 Ų1312.5 Ų12.55%0.0497%0.067CC..Hα-helixtrans-63.2-38.7176.5-72.5175.865.5143.817.1112.1G20 L139 M141 I145 E146 T147 M186G20-R143 PolarHBondContact O-NH1 2.83Å; G20-R143 PolarHBondContact O-NH2 3.11Å; L139-R143 HydrophobicContact CD2-CG 4.41Å; L139-R143 WeakPolarHBondContact O-CB 3.5Å; L139-R143 WeakPolarHBondContact O-CG 3.43Å; L139-R143 PolarHBondContact O-N 3.22Å; M141-R143 VanDerWaalsContact C-N 3.32Å; M141-R143 PolarHBondContact O-N 3.48Å; R143-I145 VanDerWaalsContact C-N 3.31Å; R143-I145 PolarHBondContact O-N 3.04Å; R143-E146 PolarHBondContact O-N 2.8Å; R143-T147 WeakPolarHBondContact O-CB 3.46Å; R143-T147 PolarHBondContact O-N 3.27Å; R143-T147 PolarHBondContact O-OG1 3.38Å; R143-M186 HydrophobicContact CB-SD 4.05Å; R143-M186 PolarHBondContact NE-SD 2.96Å; R143-M186 PolarHBondContact NH2-SD 3.25Å
144L88Confident82.8Confident1 Ų110.5 Ų10.51%0.0056%0.057CC..Hα-helixtrans-59.8-44.8173.4-173.173.9000111S140 M141 L142 T147 F148 V187 Y190 F283S140-L144 WeakPolarHBondContact O-CB 3.42Å; S140-L144 PolarHBondContact O-N 3.28Å; S140-L144 VanDerWaalsContact O-N 3.07Å; M141-L144 WeakPolarHBondContact O-CB 3.49Å; M141-L144 PolarHBondContact O-N 3.47Å; M141-L144 HydrophobicContact SD-CD2 4.16Å; L142-L144 VanDerWaalsContact C-N 3.32Å; L142-L144 PolarHBondContact O-N 2.99Å; L144-T147 PolarHBondContact O-N 3.32Å; L144-F148 HydrophobicContact CD1-CD2 4.18Å; L144-F148 HydrophobicContact CD1-CE2 3.7Å; L144-F148 HydrophobicContact CG-CD2 4.24Å; L144-F148 HydrophobicContact CG-CE2 4.18Å; L144-F148 VanDerWaalsContact O-CD2 3.29Å; L144-F148 WeakPolarHBondContact O-CD2 3.44Å; L144-F148 PolarHBondContact O-N 3.42Å; L144-V187 HydrophobicContact CD1-CB 4.4Å; L144-V187 HydrophobicContact CD1-CG2 4Å; L144-Y190 HydrophobicContact CD2-CD1 3.92Å; L144-Y190 HydrophobicContact CD2-CD2 4.08Å; L144-Y190 HydrophobicContact CD2-CE1 4.32Å; L144-Y190 HydrophobicContact CD2-CE2 4.47Å; L144-Y190 HydrophobicContact CD2-CG 3.77Å; L144-F283 HydrophobicContact CD2-CD2 4.07Å; L144-F283 HydrophobicContact CD2-CE2 3.45Å; L144-F283 VanDerWaalsContact CD2-CE2 3.45Å; L144-F283 HydrophobicContact CD2-CZ 4.05Å
145I89.8Confident84.2Confident1 Ų110 Ų101%0.0056%0.055CC..Hα-helixtrans-62.8-50.3178.4-67.8167000110.7V60 V61 F64 M141 L142 R143 T147 F148 C149 T273V60-I145 HydrophobicContact CG1-CG2 3.85Å; V61-I145 HydrophobicContact CG2-CG2 4.27Å; F64-I145 HydrophobicContact CD1-CD1 4.2Å; F64-I145 HydrophobicContact CD2-CD1 3.76Å; F64-I145 HydrophobicContact CD2-CG2 4.09Å; F64-I145 HydrophobicContact CE1-CD1 4.23Å; F64-I145 HydrophobicContact CE2-CD1 3.79Å; F64-I145 HydrophobicContact CE2-CG2 4.01Å; F64-I145 HydrophobicContact CG-CD1 3.98Å; F64-I145 HydrophobicContact CZ-CD1 4.03Å; M141-I145 HydrophobicContact CE-CD1 4.29Å; M141-I145 HydrophobicContact CG-CD1 4.38Å; M141-I145 WeakPolarHBondContact O-CG1 3.47Å; M141-I145 PolarHBondContact O-N 3.41Å; M141-I145 VanDerWaalsContact O-N 3.07Å; L142-I145 WeakPolarHBondContact O-CB 3.42Å; L142-I145 PolarHBondContact O-N 3.1Å; L142-I145 VanDerWaalsContact O-N 3.16Å; R143-I145 VanDerWaalsContact C-N 3.31Å; R143-I145 PolarHBondContact O-N 3.04Å; I145-T147 VanDerWaalsContact C-N 3.33Å; I145-T147 PolarHBondContact O-N 3.09Å; I145-F148 PolarHBondContact O-N 3.21Å; I145-C149 WeakPolarHBondContact O-CB 3.5Å; I145-C149 PolarHBondContact O-N 3.16Å; I145-C149 PolarHBondContact O-SG 3.13Å; I145-T273 HydrophobicContact CB-CG2 4.34Å; I145-T273 HydrophobicContact CG1-CG2 3.97Å; I145-T273 HydrophobicContact CG2-CG2 3.72Å
146E88.5Confident85.6Confident23 Ų2310.2 Ų10.211%0.1076%0.056CC..Hα-helixtrans-53.1-50.4175.4-174.9-177.7-154.200111V61 F107 L142 R143 F148 C149 E150V61-E146 HydrophobicContact CG2-CB 3.78Å; V61-E146 HydrophobicContact CG2-CG 4.38Å; F107-E146 WeakPolarHBondContact CE1-OE1 3.44Å; F107-E146 WeakPolarHBondContact CZ-OE2 3.4Å; L142-E146 WeakPolarHBondContact O-CB 3.02Å; L142-E146 PolarHBondContact O-N 3.47Å; R143-E146 PolarHBondContact O-N 2.8Å; E146-F148 VanDerWaalsContact C-N 3.27Å; E146-F148 PolarHBondContact O-N 2.89Å; E146-C149 PolarHBondContact O-N 3.12Å; E146-E150 WeakPolarHBondContact O-CB 3.37Å; E146-E150 PolarHBondContact O-N 3.36Å
147T90.4Very high86.7Confident6 Ų68.3 Ų8.34%0.0374%0.044CC..Hα-helixtrans-53.9-42.2-179.4-58.10000112.5R143 L144 I145 S151 A152 V183 M186R143-T147 WeakPolarHBondContact O-CB 3.46Å; R143-T147 PolarHBondContact O-N 3.27Å; R143-T147 PolarHBondContact O-OG1 3.38Å; L144-T147 PolarHBondContact O-N 3.32Å; I145-T147 VanDerWaalsContact C-N 3.33Å; I145-T147 PolarHBondContact O-N 3.09Å; T147-S151 PolarHBondContact O-N 3.33Å; T147-A152 PolarHBondContact O-N 3.48Å; T147-V183 HydrophobicContact CG2-CB 3.96Å; T147-V183 HydrophobicContact CG2-CG1 3.79Å; T147-V183 HydrophobicContact CG2-CG2 3.78Å; T147-M186 HydrophobicContact CG2-CB 4.1Å; T147-M186 HydrophobicContact CG2-CG 4.27Å; T147-M186 WeakPolarHBondContact OG1-CB 3.33Å; T147-M186 VanDerWaalsContact OG1-CG 3.25Å; T147-M186 WeakPolarHBondContact OG1-CG 3.44Å
148F92.7Very high87.5Confident4 Ų49.5 Ų9.52%0.0185%0.05CC..Hα-helixtrans-85.8-19.4-180-74.2-69.6000113.8L144 I145 E146 A152 P153 V187 I220 I277 F280L144-F148 HydrophobicContact CD1-CD2 4.18Å; L144-F148 HydrophobicContact CD1-CE2 3.7Å; L144-F148 HydrophobicContact CG-CD2 4.24Å; L144-F148 HydrophobicContact CG-CE2 4.18Å; L144-F148 VanDerWaalsContact O-CD2 3.29Å; L144-F148 WeakPolarHBondContact O-CD2 3.44Å; L144-F148 PolarHBondContact O-N 3.42Å; I145-F148 PolarHBondContact O-N 3.21Å; E146-F148 VanDerWaalsContact C-N 3.27Å; E146-F148 PolarHBondContact O-N 2.89Å; F148-A152 HydrophobicContact CD1-CB 4.2Å; F148-P153 WeakPolarHBondContact O-CD 3.36Å; F148-V187 HydrophobicContact CE2-CG2 4.06Å; F148-V187 HydrophobicContact CZ-CG2 3.92Å; F148-I220 HydrophobicContact CE1-CD1 4.34Å; F148-I220 HydrophobicContact CZ-CD1 4.15Å; F148-I277 HydrophobicContact CB-CG1 3.85Å; F148-I277 HydrophobicContact CD2-CB 4.35Å; F148-I277 HydrophobicContact CD2-CD1 4.47Å; F148-I277 HydrophobicContact CD2-CG1 3.82Å; F148-I277 HydrophobicContact CD2-CG2 3.89Å; F148-I277 HydrophobicContact CE2-CG2 3.93Å; F148-I277 HydrophobicContact CG-CB 4.38Å; F148-I277 HydrophobicContact CG-CG1 3.96Å; F148-I277 HydrophobicContact CG-CG2 4.23Å; F148-I277 HydrophobicContact CZ-CG2 4.31Å; F148-F280 HydrophobicContact CD1-CB 3.75Å; F148-F280 HydrophobicContact CD1-CD2 4.11Å; F148-F280 HydrophobicContact CD1-CG 4.23Å; F148-F280 HydrophobicContact CE1-CB 3.76Å
149C91.2Very high88.3Confident6 Ų610 Ų104%0.0415%0.054CC..Hα-helixtrans-82.4-29.4173.5-64.10000112.9I145 E146 L276I145-C149 WeakPolarHBondContact O-CB 3.5Å; I145-C149 PolarHBondContact O-N 3.16Å; I145-C149 PolarHBondContact O-SG 3.13Å; E146-C149 PolarHBondContact O-N 3.12Å; C149-L276 HydrophobicContact CB-CD2 4.27Å; C149-L276 VanDerWaalsContact SG-CD2 3.53Å
150E90.1Very high89.1Confident11 Ų119.5 Ų9.55%0.0515%0.051CC..THydrogen-bonded Turntrans-124.2-71.4-170.5-177.2164.8-173.100112M54 S57 E146 A152 P153 Q154M54-E150 WeakPolarHBondContact CG-OE1 3.12Å; S57-E150 VanDerWaalsContact CB-OE2 3.29Å; S57-E150 WeakPolarHBondContact CB-OE2 3.41Å; S57-E150 WeakPolarHBondContact OG-CB 3.3Å; S57-E150 PolarHBondContact OG-OE2 3.09Å; E146-E150 WeakPolarHBondContact O-CB 3.37Å; E146-E150 PolarHBondContact O-N 3.36Å; E150-A152 VanDerWaalsContact C-N 3.34Å; E150-A152 PolarHBondContact O-N 2.85Å; E150-P153 VanDerWaalsContact O-CD 3.26Å; E150-P153 WeakPolarHBondContact O-CD 3.23Å; E150-Q154 HydrophobicContact CG-CG 4.45Å; E150-Q154 WeakPolarHBondContact O-CB 3.23Å; E150-Q154 WeakPolarHBondContact O-CG 3.38Å; E150-Q154 PolarHBondContact O-N 3.44Å
151S89.8Confident89.5Confident10 Ų1010.8 Ų10.87%0.076%0.058CC..Hα-helixtrans-60.4-38.5-169-41.40000113D27 T147 L155D27-S151 PolarHBondContact OD2-OG 3.03Å; T147-S151 PolarHBondContact O-N 3.33Å; S151-L155 VanDerWaalsContact O-CB 3.26Å; S151-L155 WeakPolarHBondContact O-CB 3.44Å; S151-L155 PolarHBondContact O-N 3.36Å
152A92.9Very high89.7Confident0 Ų012.3 Ų12.30%07%0.065CC..Hα-helixtrans-70.2-50.9179.200000113.3T147 F148 E150 Q154 L155 V156 F280T147-A152 PolarHBondContact O-N 3.48Å; F148-A152 HydrophobicContact CD1-CB 4.2Å; E150-A152 VanDerWaalsContact C-N 3.34Å; E150-A152 PolarHBondContact O-N 2.85Å; A152-Q154 VanDerWaalsContact C-N 3.33Å; A152-Q154 PolarHBondContact O-N 3.29Å; A152-L155 WeakPolarHBondContact O-CB 3.44Å; A152-L155 PolarHBondContact O-N 2.73Å; A152-V156 PolarHBondContact O-N 2.87Å; A152-V156 VanDerWaalsContact O-N 3.12Å; A152-F280 HydrophobicContact CB-CD1 4.13Å; A152-F280 HydrophobicContact CB-CD2 4.2Å; A152-F280 HydrophobicContact CB-CE1 4.19Å; A152-F280 HydrophobicContact CB-CE2 4.25Å; A152-F280 HydrophobicContact CB-CG 4.14Å; A152-F280 HydrophobicContact CB-CZ 4.25Å
153P93.3Very high89.9Confident22 Ų2213.8 Ų13.814%0.1437%0.073CC..Hα-helixtrans-56.5-40.9168.9-26.432000114.2L53 F148 E150 L155 V156 L157 F280L53-P153 HydrophobicContact CD1-CB 3.84Å; L53-P153 HydrophobicContact CD2-CB 3.84Å; L53-P153 HydrophobicContact CD2-CG 4.36Å; L53-P153 HydrophobicContact CG-CB 4.46Å; F148-P153 WeakPolarHBondContact O-CD 3.36Å; E150-P153 VanDerWaalsContact O-CD 3.26Å; E150-P153 WeakPolarHBondContact O-CD 3.23Å; P153-L155 VanDerWaalsContact C-N 3.33Å; P153-L155 PolarHBondContact O-N 3.48Å; P153-V156 WeakPolarHBondContact O-CB 3.41Å; P153-V156 PolarHBondContact O-N 3.07Å; P153-L157 PolarHBondContact O-N 3.07Å; P153-F280 HydrophobicContact CB-CZ 4.39Å; P153-F280 HydrophobicContact CG-CE2 3.88Å; P153-F280 HydrophobicContact CG-CZ 3.74Å
154Q91.5Very high90Very high8 Ų820 Ų204%0.03710%0.097CC..Hα-helixtrans-64.1-38175.8-74.5173.1-27.300112.1D31 L50 L53 E150 A152 V156 L157 M158D31-Q154 VanDerWaalsContact CG-NE2 3.3Å; D31-Q154 PolarHBondContact OD1-OE1 2.93Å; D31-Q154 PolarHBondContact OD2-NE2 3.18Å; D31-Q154 PolarHBondContact OD2-OE1 3.12Å; D31-Q154 VanDerWaalsContact OD2-OE1 3.12Å; L50-Q154 HydrophobicContact CD1-CG 3.66Å; L53-Q154 HydrophobicContact CD1-CG 4.4Å; E150-Q154 HydrophobicContact CG-CG 4.45Å; E150-Q154 WeakPolarHBondContact O-CB 3.23Å; E150-Q154 WeakPolarHBondContact O-CG 3.38Å; E150-Q154 PolarHBondContact O-N 3.44Å; A152-Q154 VanDerWaalsContact C-N 3.33Å; A152-Q154 PolarHBondContact O-N 3.29Å; Q154-V156 VanDerWaalsContact C-N 3.32Å; Q154-V156 PolarHBondContact O-N 3.01Å; Q154-L157 CarbonylContact O-C 3.53Å; Q154-L157 WeakPolarHBondContact O-CB 3.45Å; Q154-L157 PolarHBondContact O-N 2.95Å; Q154-L157 VanDerWaalsContact O-N 3.13Å; Q154-M158 WeakPolarHBondContact O-CB 3.48Å; Q154-M158 PolarHBondContact O-N 3.44Å
155L92.4Very high89.5Confident4 Ų422.9 Ų22.92%0.02112%0.115CC..Hα-helixtrans-62.6-40174-175.560.2000111.5S151 A152 P153 L157 M158 V159 V176 A180 V224S151-L155 VanDerWaalsContact O-CB 3.26Å; S151-L155 WeakPolarHBondContact O-CB 3.44Å; S151-L155 PolarHBondContact O-N 3.36Å; A152-L155 WeakPolarHBondContact O-CB 3.44Å; A152-L155 PolarHBondContact O-N 2.73Å; P153-L155 VanDerWaalsContact C-N 3.33Å; P153-L155 PolarHBondContact O-N 3.48Å; L155-L157 VanDerWaalsContact C-N 3.32Å; L155-L157 PolarHBondContact O-N 3.49Å; L155-M158 HydrophobicContact CD1-CE 3.95Å; L155-M158 PolarHBondContact O-N 2.65Å; L155-V159 HydrophobicContact CD1-CG2 4.48Å; L155-V159 VanDerWaalsContact O-CG2 3.3Å; L155-V159 WeakPolarHBondContact O-CG2 3.3Å; L155-V159 PolarHBondContact O-N 3.23Å; L155-V176 HydrophobicContact CD1-CB 4.49Å; L155-V176 HydrophobicContact CD1-CG1 4.04Å; L155-A180 HydrophobicContact CD2-CB 3.83Å; L155-V224 HydrophobicContact CB-CG1 4.26Å; L155-V224 HydrophobicContact CD2-CG1 3.9Å; L155-V224 HydrophobicContact CD2-CG2 4.46Å; L155-V224 HydrophobicContact CG-CG1 3.73Å
156V94.4Very high88.7Confident15 Ų1526.9 Ų26.99%0.09114%0.136CC..Hα-helixtrans-58.9-45.4171.8176.40000110.4A152 P153 Q154 V159 Y160 V224 L227 A228 F280A152-V156 PolarHBondContact O-N 2.87Å; A152-V156 VanDerWaalsContact O-N 3.12Å; P153-V156 WeakPolarHBondContact O-CB 3.41Å; P153-V156 PolarHBondContact O-N 3.07Å; Q154-V156 VanDerWaalsContact C-N 3.32Å; Q154-V156 PolarHBondContact O-N 3.01Å; V156-V159 PolarHBondContact O-N 3.26Å; V156-Y160 WeakPolarHBondContact O-CB 3.38Å; V156-Y160 PolarHBondContact O-N 3.48Å; V156-V224 HydrophobicContact CG2-CB 4.26Å; V156-V224 HydrophobicContact CG2-CG1 3.81Å; V156-V224 HydrophobicContact CG2-CG2 4.25Å; V156-L227 HydrophobicContact CG1-CB 3.97Å; V156-L227 HydrophobicContact CG2-CB 4.16Å; V156-L227 HydrophobicContact CG2-CD1 4.2Å; V156-A228 HydrophobicContact CG1-CB 4.2Å; V156-F280 HydrophobicContact CG2-CE1 4Å
157L90.2Very high87.5Confident11 Ų1134.3 Ų34.36%0.05816%0.163CC..Hα-helixtrans-61.7-43.5177.3177.962.2000111.9F38 W46 L50 P153 Q154 L155 Y160 V161F38-L157 HydrophobicContact CE2-CD2 4.27Å; F38-L157 HydrophobicContact CZ-CD2 4.5Å; W46-L157 HydrophobicContact CD2-CD1 4.11Å; W46-L157 HydrophobicContact CE3-CD1 3.24Å; W46-L157 HydrophobicContact CZ3-CD1 3.51Å; L50-L157 HydrophobicContact CB-CD2 4.2Å; L50-L157 HydrophobicContact CD1-CD2 4.36Å; P153-L157 PolarHBondContact O-N 3.07Å; Q154-L157 CarbonylContact O-C 3.53Å; Q154-L157 WeakPolarHBondContact O-CB 3.45Å; Q154-L157 PolarHBondContact O-N 2.95Å; Q154-L157 VanDerWaalsContact O-N 3.13Å; L155-L157 VanDerWaalsContact C-N 3.32Å; L155-L157 PolarHBondContact O-N 3.49Å; L157-Y160 HydrophobicContact CD1-CD1 4.04Å; L157-Y160 WeakPolarHBondContact O-CB 3.47Å; L157-Y160 PolarHBondContact O-N 3.29Å; L157-V161 HydrophobicContact CD1-CG2 4.35Å; L157-V161 VanDerWaalsContact O-CG2 3.29Å; L157-V161 WeakPolarHBondContact O-CG2 3.21Å; L157-V161 PolarHBondContact O-N 3.38Å
158M88.8Confident86.1Confident37 Ų3737.6 Ų37.618%0.18219%0.191CC..Hα-helixtrans-65.4-42.4-179.6-170.8160.47100111.8Q154 L155 V161 M162 V176Q154-M158 WeakPolarHBondContact O-CB 3.48Å; Q154-M158 PolarHBondContact O-N 3.44Å; L155-M158 HydrophobicContact CD1-CE 3.95Å; L155-M158 PolarHBondContact O-N 2.65Å; M158-V161 PolarHBondContact O-N 2.92Å; M158-M162 WeakPolarHBondContact O-CB 3.38Å; M158-M162 PolarHBondContact O-N 3.18Å; M158-V176 HydrophobicContact CE-CB 4.3Å; M158-V176 HydrophobicContact CE-CG2 3.77Å; M158-V176 HydrophobicContact CG-CG2 4.04Å
159V91.4Very high85Confident14 Ų1445.2 Ų45.29%0.08522%0.22CC..Hα-helixtrans-64.3-41.3173.3178.50000110.7L155 V156 V161 M162 L163 V176 A228L155-V159 HydrophobicContact CD1-CG2 4.48Å; L155-V159 VanDerWaalsContact O-CG2 3.3Å; L155-V159 WeakPolarHBondContact O-CG2 3.3Å; L155-V159 PolarHBondContact O-N 3.23Å; V156-V159 PolarHBondContact O-N 3.26Å; V159-V161 PolarHBondContact O-N 3.17Å; V159-M162 WeakPolarHBondContact O-CB 3.36Å; V159-M162 PolarHBondContact O-N 2.9Å; V159-L163 HydrophobicContact CG1-CD1 4.11Å; V159-L163 HydrophobicContact CG1-CG 4.41Å; V159-L163 VanDerWaalsContact O-CG 3.31Å; V159-L163 WeakPolarHBondContact O-CG 3.21Å; V159-L163 PolarHBondContact O-N 3.28Å; V159-V176 HydrophobicContact CG2-CG1 3.58Å; V159-V176 HydrophobicContact CG2-CG2 4.16Å; V159-A228 HydrophobicContact CB-CB 3.6Å; V159-A228 HydrophobicContact CG1-CB 3.41Å; V159-A228 VanDerWaalsContact CG1-CB 3.41Å
160Y90.4Very high84.3Confident10 Ų1050.4 Ų50.44%0.03925%0.251CS..Hα-helixtrans-58.4-46.9175.3161.3-95.4000112.3W46 V156 L157 M162 L163 R164 S231 P235W46-Y160 HydrophobicContact CD2-CE1 4.28Å; W46-Y160 AromaticContact CE2-CE1 3.7Å; W46-Y160 HydrophobicContact CE3-CE1 4.42Å; W46-Y160 HydrophobicContact CH2-CD1 4.1Å; W46-Y160 AromaticContact CH2-CE1 3.44Å; W46-Y160 HydrophobicContact CH2-CE1 3.44Å; W46-Y160 VanDerWaalsContact CH2-CE1 3.44Å; W46-Y160 AromaticContact CH2-CZ 3.7Å; W46-Y160 HydrophobicContact CZ2-CD1 4.34Å; W46-Y160 AromaticContact CZ2-CE1 3.29Å; W46-Y160 HydrophobicContact CZ2-CE1 3.29Å; W46-Y160 AromaticContact CZ2-CZ 3.44Å; W46-Y160 VanDerWaalsContact CZ2-CZ 3.44Å; W46-Y160 WeakPolarHBondContact CZ2-OH 3.07Å; W46-Y160 HydrophobicContact CZ3-CD1 4.35Å; W46-Y160 HydrophobicContact CZ3-CE1 4.03Å; V156-Y160 WeakPolarHBondContact O-CB 3.38Å; V156-Y160 PolarHBondContact O-N 3.48Å; L157-Y160 HydrophobicContact CD1-CD1 4.04Å; L157-Y160 WeakPolarHBondContact O-CB 3.47Å; L157-Y160 PolarHBondContact O-N 3.29Å; Y160-M162 VanDerWaalsContact C-N 3.33Å; Y160-M162 PolarHBondContact O-N 2.98Å; Y160-L163 PolarHBondContact O-N 3.22Å; Y160-R164 HydrophobicContact CD2-CG 4.06Å; Y160-R164 HydrophobicContact CE1-CG 4.07Å; Y160-R164 HydrophobicContact CE2-CG 3.56Å; Y160-R164 WeakPolarHBondContact O-CB 3.26Å; Y160-R164 WeakPolarHBondContact O-CG 3.33Å; Y160-R164 PolarHBondContact O-N 3.48Å; Y160-R164 PolarHBondContact OH-NH1 2.93Å; Y160-S231 VanDerWaalsContact CD2-OG 3.32Å; Y160-S231 WeakPolarHBondContact CD2-OG 3.41Å; Y160-S231 WeakPolarHBondContact CE2-O 3.44Å; Y160-P235 HydrophobicContact CE2-CB 4.43Å
161V85.9Confident83.5Confident27 Ų2755.4 Ų55.416%0.16428%0.282CS..Hα-helixtrans-63.5-40.5177.8173.80000111.1F38 L157 M158 V159 L163 R164 T165F38-V161 HydrophobicContact CE1-CG2 4.09Å; F38-V161 HydrophobicContact CZ-CG2 3.77Å; L157-V161 HydrophobicContact CD1-CG2 4.35Å; L157-V161 VanDerWaalsContact O-CG2 3.29Å; L157-V161 WeakPolarHBondContact O-CG2 3.21Å; L157-V161 PolarHBondContact O-N 3.38Å; M158-V161 PolarHBondContact O-N 2.92Å; V159-V161 PolarHBondContact O-N 3.17Å; V161-L163 VanDerWaalsContact C-N 3.34Å; V161-L163 PolarHBondContact O-N 2.9Å; V161-R164 PolarHBondContact O-N 2.98Å; V161-T165 HydrophobicContact CG1-CG2 4.32Å; V161-T165 WeakPolarHBondContact O-CB 3.4Å; V161-T165 WeakPolarHBondContact O-CG2 3.5Å; V161-T165 PolarHBondContact O-N 3.42Å; V161-T165 PolarHBondContact O-OG1 2.99Å
162M86.9Confident83Confident34 Ų3457.7 Ų57.717%0.16729%0.292CS..Hα-helixtrans-60.7-43.8175.6-173.6-178.371.100111.3M158 V159 Y160 T165 N166 Q172 V176M158-M162 WeakPolarHBondContact O-CB 3.38Å; M158-M162 PolarHBondContact O-N 3.18Å; V159-M162 WeakPolarHBondContact O-CB 3.36Å; V159-M162 PolarHBondContact O-N 2.9Å; Y160-M162 VanDerWaalsContact C-N 3.33Å; Y160-M162 PolarHBondContact O-N 2.98Å; M162-T165 PolarHBondContact O-OG1 3.18Å; M162-N166 PolarHBondContact O-N 2.93Å; M162-Q172 HydrophobicContact SD-CB 4.38Å; M162-V176 HydrophobicContact SD-CG2 4.35Å
163L87.4Confident82.5Confident33 Ų3364.1 Ų64.117%0.17332%0.32CS..Hα-helixtrans-64.8-43.2176.5-69.8170.3000111.9V159 Y160 V161 N166 A228 L229 Y324V159-L163 HydrophobicContact CG1-CD1 4.11Å; V159-L163 HydrophobicContact CG1-CG 4.41Å; V159-L163 VanDerWaalsContact O-CG 3.31Å; V159-L163 WeakPolarHBondContact O-CG 3.21Å; V159-L163 PolarHBondContact O-N 3.28Å; Y160-L163 PolarHBondContact O-N 3.22Å; V161-L163 VanDerWaalsContact C-N 3.34Å; V161-L163 PolarHBondContact O-N 2.9Å; L163-N166 PolarHBondContact O-N 3.24Å; L163-A228 HydrophobicContact CD1-CB 4.33Å; L163-L229 HydrophobicContact CD1-CD2 3.78Å; L163-L229 HydrophobicContact CD1-CG 4.15Å; L163-L229 HydrophobicContact CD2-CD2 4.15Å; L163-Y324 HydrophobicContact CD2-CE2 4.36Å
164R83.8Confident81.9Confident144 Ų14467.3 Ų67.354%0.54334%0.339SS..Hα-helixtrans-67.4-35.6-179.7-75.7-71.3-65.7-122.6-3.9113.8Y160 V161 N166Y160-R164 HydrophobicContact CD2-CG 4.06Å; Y160-R164 HydrophobicContact CE1-CG 4.07Å; Y160-R164 HydrophobicContact CE2-CG 3.56Å; Y160-R164 WeakPolarHBondContact O-CB 3.26Å; Y160-R164 WeakPolarHBondContact O-CG 3.33Å; Y160-R164 PolarHBondContact O-N 3.48Å; Y160-R164 PolarHBondContact OH-NH1 2.93Å; V161-R164 PolarHBondContact O-N 2.98Å; R164-N166 VanDerWaalsContact C-N 3.27Å
165T78.8Confident81.5Confident61 Ų6169 Ų6937%0.37435%0.352SS..Hα-helixtrans-81.1-11.3-179.853.10000112.7V161 M162 R167V161-T165 HydrophobicContact CG1-CG2 4.32Å; V161-T165 WeakPolarHBondContact O-CB 3.4Å; V161-T165 WeakPolarHBondContact O-CG2 3.5Å; V161-T165 PolarHBondContact O-N 3.42Å; V161-T165 PolarHBondContact O-OG1 2.99Å; M162-T165 PolarHBondContact O-OG1 3.18Å; T165-R167 WeakPolarHBondContact O-CG 3.29Å; T165-R167 PolarHBondContact O-N 3.18Å
166N71.8Confident81.3Confident84 Ų8469.9 Ų69.945%0.44936%0.357SS..THydrogen-bonded Turntrans43.530-178.8-157.322.4000114M162 L163 R164M162-N166 PolarHBondContact O-N 2.93Å; L163-N166 PolarHBondContact O-N 3.24Å; R164-N166 VanDerWaalsContact C-N 3.27Å
167R64.4Low80.9Confident179 Ų17971.4 Ų71.468%0.67537%0.371SS*.  trans-129.579.7179.5-74.5-158-175.9179.54.5108.3T165 R169 Q172T165-R167 WeakPolarHBondContact O-CG 3.29Å; T165-R167 PolarHBondContact O-N 3.18Å; R167-R169 PolarHBondContact O-N 2.9Å; R167-Q172 PolarHBondContact O-OE1 2.82Å
168A59.5Low80.7Confident76 Ų7673.7 Ų73.763%0.62839%0.391SS*.  trans-71.978.8172.100000109.9
169R70.1Confident80.7Confident164 Ų16472.8 Ų72.862%0.61939%0.389SS*.  trans-62.6139.4165.5-62.8-174.6-148.5175.96.5107.2R167 V171 Q172 F173R167-R169 PolarHBondContact O-N 2.9Å; R169-V171 PolarHBondContact O-N 3.02Å; R169-Q172 WeakPolarHBondContact O-CB 3.42Å; R169-Q172 PolarHBondContact O-N 2.96Å; R169-F173 PolarHBondContact O-N 3.42Å
170T76.6Confident80.7Confident114 Ų11472.9 Ų72.970%0.69939%0.391SS*.Hα-helixtrans-48.1-37179.2-46.40000112.4Q172 F173 V174T170-Q172 PolarHBondContact O-N 3.18Å; T170-F173 PolarHBondContact O-N 3.44Å; T170-V174 HydrophobicContact CG2-CG2 4.48Å; T170-V174 VanDerWaalsContact O-CG2 3.3Å; T170-V174 WeakPolarHBondContact O-CG2 3.48Å; T170-V174 PolarHBondContact O-N 3.48Å
171V74.1Confident80.6Confident116 Ų11673.9 Ų73.970%0.70340%0.402SS*.Hα-helixtrans-59.6-40.4177-178.60000113R169 S175R169-V171 PolarHBondContact O-N 3.02Å; V171-S175 WeakPolarHBondContact O-CB 3.29Å; V171-S175 PolarHBondContact O-N 3.07Å
172Q78.9Confident80.7Confident59 Ų5973.4 Ų73.428%0.27640%0.4SS..Hα-helixtrans-70.5-40.3178.9-70.6179.1-25.400111.6M162 R167 R169 T170 V174 S175 V176M162-Q172 HydrophobicContact SD-CB 4.38Å; R167-Q172 PolarHBondContact O-OE1 2.82Å; R169-Q172 WeakPolarHBondContact O-CB 3.42Å; R169-Q172 PolarHBondContact O-N 2.96Å; T170-Q172 PolarHBondContact O-N 3.18Å; Q172-V174 VanDerWaalsContact C-N 3.34Å; Q172-V174 PolarHBondContact O-N 3.25Å; Q172-S175 PolarHBondContact O-N 3.27Å; Q172-V176 WeakPolarHBondContact O-CG2 3.32Å; Q172-V176 PolarHBondContact O-N 3.49Å
173F81.7Confident80.8Confident135 Ų13571.9 Ų71.959%0.59239%0.392SS*.Hα-helixtrans-62.2-44.3175.3-176.1-94.5000111.4R169 T170 S175 V176 A177R169-F173 PolarHBondContact O-N 3.42Å; T170-F173 PolarHBondContact O-N 3.44Å; F173-S175 VanDerWaalsContact C-N 3.31Å; F173-S175 PolarHBondContact O-N 2.89Å; F173-V176 PolarHBondContact O-N 3.1Å; F173-A177 WeakPolarHBondContact O-CB 3.38Å; F173-A177 PolarHBondContact O-N 3.36Å
174V81.7Confident81Confident88 Ų8870.3 Ų70.353%0.53338%0.384SS..Hα-helixtrans-60.5-42175.1171.40000111.1T170 Q172 A177 A178T170-V174 HydrophobicContact CG2-CG2 4.48Å; T170-V174 VanDerWaalsContact O-CG2 3.3Å; T170-V174 WeakPolarHBondContact O-CG2 3.48Å; T170-V174 PolarHBondContact O-N 3.48Å; Q172-V174 VanDerWaalsContact C-N 3.34Å; Q172-V174 PolarHBondContact O-N 3.25Å; V174-A177 PolarHBondContact O-N 3.02Å; V174-A178 VanDerWaalsContact O-CB 3.26Å; V174-A178 WeakPolarHBondContact O-CB 3.25Å; V174-A178 PolarHBondContact O-N 3.18Å
175S83Confident81.1Confident45 Ų4565.9 Ų65.932%0.31537%0.367SS..Hα-helixtrans-63.5-47.3176.71760000112.3V171 Q172 F173 A177 A178 S179V171-S175 WeakPolarHBondContact O-CB 3.29Å; V171-S175 PolarHBondContact O-N 3.07Å; Q172-S175 PolarHBondContact O-N 3.27Å; F173-S175 VanDerWaalsContact C-N 3.31Å; F173-S175 PolarHBondContact O-N 2.89Å; S175-A177 VanDerWaalsContact C-N 3.34Å; S175-A177 PolarHBondContact O-N 3.45Å; S175-A178 PolarHBondContact O-N 3.4Å; S175-S179 PolarHBondContact O-N 3.03Å; S175-S179 PolarHBondContact O-OG 3.45Å
176V87Confident81.5Confident21 Ų2163.3 Ų63.313%0.12735%0.351CS..Hα-helixtrans-59.5-44.5175.1169.90000111.5L155 M158 V159 M162 Q172 F173 S179 A180L155-V176 HydrophobicContact CD1-CB 4.49Å; L155-V176 HydrophobicContact CD1-CG1 4.04Å; M158-V176 HydrophobicContact CE-CB 4.3Å; M158-V176 HydrophobicContact CE-CG2 3.77Å; M158-V176 HydrophobicContact CG-CG2 4.04Å; V159-V176 HydrophobicContact CG2-CG1 3.58Å; V159-V176 HydrophobicContact CG2-CG2 4.16Å; M162-V176 HydrophobicContact SD-CG2 4.35Å; Q172-V176 WeakPolarHBondContact O-CG2 3.32Å; Q172-V176 PolarHBondContact O-N 3.49Å; F173-V176 PolarHBondContact O-N 3.1Å; V176-S179 PolarHBondContact O-N 3.3Å; V176-A180 WeakPolarHBondContact O-CB 3.33Å; V176-A180 PolarHBondContact O-N 3.02Å
177A87.3Confident82.3Confident47 Ų4759.7 Ų59.739%0.38833%0.332SS..Hα-helixtrans-64.6-41177.900000111.9F173 V174 S175 A180 A181F173-A177 WeakPolarHBondContact O-CB 3.38Å; F173-A177 PolarHBondContact O-N 3.36Å; V174-A177 PolarHBondContact O-N 3.02Å; S175-A177 VanDerWaalsContact C-N 3.34Å; S175-A177 PolarHBondContact O-N 3.45Å; A177-A180 PolarHBondContact O-N 3.23Å; A177-A181 VanDerWaalsContact O-CB 3.32Å; A177-A181 WeakPolarHBondContact O-CB 3.38Å; A177-A181 PolarHBondContact O-N 2.86Å
178A85.3Confident83.2Confident59 Ų5951.4 Ų51.449%0.48830%0.301SS..Hα-helixtrans-64.5-44.5176.800000111.8V174 S175 A181 S182V174-A178 VanDerWaalsContact O-CB 3.26Å; V174-A178 WeakPolarHBondContact O-CB 3.25Å; V174-A178 PolarHBondContact O-N 3.18Å; S175-A178 PolarHBondContact O-N 3.4Å; A178-A181 PolarHBondContact O-N 3.12Å; A178-S182 WeakPolarHBondContact O-CB 3.47Å; A178-S182 PolarHBondContact O-N 3.37Å
179S88.6Confident84.2Confident19 Ų1948.6 Ų48.613%0.13328%0.276CS..Hα-helixtrans-65.1-41.3176-63.20000111.9S175 V176 A181 S182 V183S175-S179 PolarHBondContact O-N 3.03Å; S175-S179 PolarHBondContact O-OG 3.45Å; V176-S179 PolarHBondContact O-N 3.3Å; S179-A181 VanDerWaalsContact C-N 3.34Å; S179-A181 PolarHBondContact O-N 3.47Å; S179-S182 WeakPolarHBondContact O-CB 3.39Å; S179-S182 PolarHBondContact O-N 3.4Å; S179-V183 WeakPolarHBondContact O-CG2 3.4Å; S179-V183 PolarHBondContact O-N 3.25Å
180A91.2Very high84.8Confident15 Ų1541.1 Ų41.112%0.12425%0.248CC..Hα-helixtrans-61.8-41.8173.700000112.3L155 V176 A177 S182 V183 A184 L217L155-A180 HydrophobicContact CD2-CB 3.83Å; V176-A180 WeakPolarHBondContact O-CB 3.33Å; V176-A180 PolarHBondContact O-N 3.02Å; A177-A180 PolarHBondContact O-N 3.23Å; A180-S182 VanDerWaalsContact C-N 3.35Å; A180-V183 PolarHBondContact O-N 3.24Å; A180-A184 PolarHBondContact O-N 3.45Å; A180-A184 VanDerWaalsContact O-N 3.08Å; A180-L217 HydrophobicContact CB-CD1 3.96Å
181A89.1Confident85.1Confident32 Ų3235.9 Ų35.926%0.26422%0.215SC..Hα-helixtrans-64.5-38.917400000111.7A177 A178 S179 A184 W185 F213A177-A181 VanDerWaalsContact O-CB 3.32Å; A177-A181 WeakPolarHBondContact O-CB 3.38Å; A177-A181 PolarHBondContact O-N 2.86Å; A178-A181 PolarHBondContact O-N 3.12Å; S179-A181 VanDerWaalsContact C-N 3.34Å; S179-A181 PolarHBondContact O-N 3.47Å; A181-A184 PolarHBondContact O-N 3.08Å; A181-W185 VanDerWaalsContact O-CB 3.24Å; A181-W185 WeakPolarHBondContact O-CB 3.42Å; A181-W185 PolarHBondContact O-N 3.2Å; A181-F213 HydrophobicContact CB-CZ 3.99Å; A181-F213 WeakPolarHBondContact O-CE2 3.36Å
182S87.1Confident85.2Confident17 Ų1732.8 Ų32.812%0.11919%0.191CC..Hα-helixtrans-59.9-47.4175.1-169.40000111.3A178 S179 A180 A184 W185 M186A178-S182 WeakPolarHBondContact O-CB 3.47Å; A178-S182 PolarHBondContact O-N 3.37Å; S179-S182 WeakPolarHBondContact O-CB 3.39Å; S179-S182 PolarHBondContact O-N 3.4Å; A180-S182 VanDerWaalsContact C-N 3.35Å; S182-A184 PolarHBondContact O-N 2.97Å; S182-W185 WeakPolarHBondContact O-CB 3.48Å; S182-W185 PolarHBondContact O-N 2.86Å; S182-W185 VanDerWaalsContact O-N 3.15Å; S182-M186 WeakPolarHBondContact O-CG 3.37Å; S182-M186 PolarHBondContact O-N 2.64Å
183V90.3Very high85Confident1 Ų130.4 Ų30.41%0.00618%0.181CC..Hα-helixtrans-58.6-48.5176.2172.50000111.2T147 S179 A180 W185 M186 V187 I220T147-V183 HydrophobicContact CG2-CB 3.96Å; T147-V183 HydrophobicContact CG2-CG1 3.79Å; T147-V183 HydrophobicContact CG2-CG2 3.78Å; S179-V183 WeakPolarHBondContact O-CG2 3.4Å; S179-V183 PolarHBondContact O-N 3.25Å; A180-V183 PolarHBondContact O-N 3.24Å; V183-W185 VanDerWaalsContact C-N 3.3Å; V183-W185 PolarHBondContact O-N 2.99Å; V183-M186 PolarHBondContact O-N 2.92Å; V183-V187 PolarHBondContact O-N 3.49Å; V183-I220 HydrophobicContact CG1-CD1 4.06Å; V183-I220 HydrophobicContact CG1-CG2 4.01Å
184A90.8Very high84.5Confident1 Ų124.2 Ų24.21%0.00815%0.154CC..Hα-helixtrans-63.8-35.9177.800000112.4A180 A181 S182 V187 V188 F213 N216 L217A180-A184 PolarHBondContact O-N 3.45Å; A180-A184 VanDerWaalsContact O-N 3.08Å; A181-A184 PolarHBondContact O-N 3.08Å; S182-A184 PolarHBondContact O-N 2.97Å; A184-V187 PolarHBondContact O-N 3.25Å; A184-V188 WeakPolarHBondContact O-CG2 3.49Å; A184-V188 PolarHBondContact O-N 3.43Å; A184-F213 HydrophobicContact CB-CD2 3.98Å; A184-F213 HydrophobicContact CB-CE2 3.76Å; A184-F213 HydrophobicContact CB-CZ 4.42Å; A184-N216 HydrophobicContact CB-CB 4.45Å; A184-L217 HydrophobicContact CB-CB 3.95Å; A184-L217 HydrophobicContact CB-CD1 4.28Å
185W86.3Confident84Confident50 Ų5021.3 Ų21.319%0.18913%0.133CC..Hα-helixtrans-64.6-39.6176.6-177.8-102.5000112F16 V19 A181 S182 V183 V187 V188 D189 F213F16-W185 HydrophobicContact CB-CZ2 4.45Å; F16-W185 AromaticContact CD1-CH2 3.32Å; F16-W185 HydrophobicContact CD1-CH2 3.32Å; F16-W185 AromaticContact CD1-CZ2 3.27Å; F16-W185 HydrophobicContact CD1-CZ2 3.27Å; F16-W185 HydrophobicContact CD1-CZ3 4.3Å; F16-W185 HydrophobicContact CD2-CH2 4.48Å; F16-W185 AromaticContact CE1-CH2 3.08Å; F16-W185 HydrophobicContact CE1-CH2 3.08Å; F16-W185 AromaticContact CE1-CZ2 3.58Å; F16-W185 HydrophobicContact CE1-CZ2 3.58Å; F16-W185 AromaticContact CE1-CZ3 3.73Å; F16-W185 HydrophobicContact CE1-CZ3 3.73Å; F16-W185 HydrophobicContact CE2-CH2 4.32Å; F16-W185 HydrophobicContact CG-CH2 4.05Å; F16-W185 AromaticContact CG-CZ2 3.93Å; F16-W185 HydrophobicContact CG-CZ2 3.93Å; F16-W185 AromaticContact CZ-CH2 3.65Å; F16-W185 HydrophobicContact CZ-CH2 3.65Å; F16-W185 HydrophobicContact CZ-CZ2 4.45Å; F16-W185 HydrophobicContact CZ-CZ3 4.28Å; V19-W185 HydrophobicContact CB-CZ2 4.18Å; V19-W185 HydrophobicContact CG1-CH2 4.45Å; V19-W185 HydrophobicContact CG1-CZ2 3.75Å; A181-W185 VanDerWaalsContact O-CB 3.24Å; A181-W185 WeakPolarHBondContact O-CB 3.42Å; A181-W185 PolarHBondContact O-N 3.2Å; S182-W185 WeakPolarHBondContact O-CB 3.48Å; S182-W185 PolarHBondContact O-N 2.86Å; S182-W185 VanDerWaalsContact O-N 3.15Å; V183-W185 VanDerWaalsContact C-N 3.3Å; V183-W185 PolarHBondContact O-N 2.99Å; W185-V187 VanDerWaalsContact C-N 3.29Å; W185-V187 PolarHBondContact O-N 3.34Å; W185-V188 WeakPolarHBondContact O-CB 3.36Å; W185-V188 PolarHBondContact O-N 3.11Å; W185-V188 VanDerWaalsContact O-N 3.09Å; W185-D189 PolarHBondContact O-N 2.86Å; W185-F213 HydrophobicContact CB-CE2 4.24Å; W185-F213 HydrophobicContact CE3-CD2 4.4Å
186M86.1Confident83.2Confident7 Ų721.2 Ų21.23%0.03413%0.133CC..Hα-helixtrans-62.3-35.5175.7-67.4-66.510000112.6R143 T147 S182 V183 D189 Y190R143-M186 HydrophobicContact CB-SD 4.05Å; R143-M186 PolarHBondContact NE-SD 2.96Å; R143-M186 PolarHBondContact NH2-SD 3.25Å; T147-M186 HydrophobicContact CG2-CB 4.1Å; T147-M186 HydrophobicContact CG2-CG 4.27Å; T147-M186 WeakPolarHBondContact OG1-CB 3.33Å; T147-M186 VanDerWaalsContact OG1-CG 3.25Å; T147-M186 WeakPolarHBondContact OG1-CG 3.44Å; S182-M186 WeakPolarHBondContact O-CG 3.37Å; S182-M186 PolarHBondContact O-N 2.64Å; V183-M186 PolarHBondContact O-N 2.92Å; M186-D189 PolarHBondContact O-N 3.12Å; M186-Y190 PolarHBondContact O-N 3.36Å; M186-Y190 VanDerWaalsContact O-N 3.08Å
187V88.4Confident82.1Confident9 Ų922.5 Ų22.56%0.05514%0.137CC..Hα-helixtrans-66.6-38.2173.2-171.70000111.5L144 F148 V183 A184 W185 H191 Y212 I220L144-V187 HydrophobicContact CD1-CB 4.4Å; L144-V187 HydrophobicContact CD1-CG2 4Å; F148-V187 HydrophobicContact CE2-CG2 4.06Å; F148-V187 HydrophobicContact CZ-CG2 3.92Å; V183-V187 PolarHBondContact O-N 3.49Å; A184-V187 PolarHBondContact O-N 3.25Å; W185-V187 VanDerWaalsContact C-N 3.29Å; W185-V187 PolarHBondContact O-N 3.34Å; V187-H191 WeakPolarHBondContact O-CB 3.46Å; V187-H191 PolarHBondContact O-N 2.87Å; V187-Y212 HydrophobicContact CG1-CE1 4.08Å; V187-I220 HydrophobicContact CG2-CD1 4.19Å
188V85.1Confident80.9Confident4 Ų421.3 Ų21.32%0.02412%0.123CC..Hα-helixtrans-67.9-42.4176.4176.60000111.3A184 W185 H191 R192 Y212 F213A184-V188 WeakPolarHBondContact O-CG2 3.49Å; A184-V188 PolarHBondContact O-N 3.43Å; W185-V188 WeakPolarHBondContact O-CB 3.36Å; W185-V188 PolarHBondContact O-N 3.11Å; W185-V188 VanDerWaalsContact O-N 3.09Å; V188-H191 PolarHBondContact O-N 2.95Å; V188-R192 WeakPolarHBondContact O-CB 3.39Å; V188-R192 PolarHBondContact O-N 3.38Å; V188-Y212 HydrophobicContact CB-CD1 4.48Å; V188-Y212 HydrophobicContact CG2-CD1 3.89Å; V188-F213 HydrophobicContact CG2-CB 3.69Å; V188-F213 HydrophobicContact CG2-CD2 4.09Å; V188-F213 HydrophobicContact CG2-CG 4.41Å
189D80.4Confident79.3Confident18 Ų1823.5 Ų23.510%0.09613%0.133CC..Hα-helixtrans-58.3-49.1177.2-173.268.9000110.6S140 W185 M186 H191 R192 S193S140-D189 WeakPolarHBondContact CB-OD2 3.41Å; S140-D189 PolarHBondContact OG-OD2 2.89Å; W185-D189 PolarHBondContact O-N 2.86Å; M186-D189 PolarHBondContact O-N 3.12Å; D189-H191 PolarHBondContact O-N 3.32Å; D189-R192 PolarHBondContact O-N 3.04Å; D189-S193 PolarHBondContact O-N 3.03Å
190Y82.8Confident77.7Confident7 Ų729.6 Ų29.63%0.02716%0.164CC..Hα-helixtrans-57.5-47172.6172.3-101.4000112.9M141 L144 M186 R192 S193 L194 F283 M391 H394M141-Y190 HydrophobicContact CB-CD2 4.41Å; M141-Y190 HydrophobicContact CB-CE2 4.36Å; M141-Y190 HydrophobicContact CG-CE2 4.43Å; M141-Y190 HydrophobicContact SD-CD2 3.87Å; M141-Y190 HydrophobicContact SD-CE2 3.36Å; M141-Y190 WeakPolarHBondContact SD-CE2 3.44Å; L144-Y190 HydrophobicContact CD2-CD1 3.92Å; L144-Y190 HydrophobicContact CD2-CD2 4.08Å; L144-Y190 HydrophobicContact CD2-CE1 4.32Å; L144-Y190 HydrophobicContact CD2-CE2 4.47Å; L144-Y190 HydrophobicContact CD2-CG 3.77Å; M186-Y190 PolarHBondContact O-N 3.36Å; M186-Y190 VanDerWaalsContact O-N 3.08Å; Y190-R192 VanDerWaalsContact C-N 3.29Å; Y190-R192 PolarHBondContact O-N 3.41Å; Y190-S193 CarbonylContact O-C 3.57Å; Y190-S193 WeakPolarHBondContact O-CA 3.27Å; Y190-S193 WeakPolarHBondContact O-CB 3.47Å; Y190-S193 PolarHBondContact O-N 3.35Å; Y190-S193 VanDerWaalsContact O-N 3.12Å; Y190-L194 HydrophobicContact CD1-CD1 4.04Å; Y190-L194 HydrophobicContact CD1-CG 4.42Å; Y190-L194 HydrophobicContact CE1-CD1 3.24Å; Y190-L194 HydrophobicContact CE1-CD2 4.5Å; Y190-L194 HydrophobicContact CE1-CG 3.82Å; Y190-L194 HydrophobicContact CE2-CD1 4.41Å; Y190-L194 HydrophobicContact CE2-CD2 4.3Å; Y190-L194 HydrophobicContact CE2-CG 4.15Å; Y190-L194 VanDerWaalsContact CZ-CD1 3.5Å; Y190-L194 PolarHBondContact O-N 3.38Å; Y190-F283 AromaticContact CD1-CE2 3.96Å; Y190-F283 HydrophobicContact CD1-CE2 3.96Å; Y190-F283 HydrophobicContact CE1-CD2 4.38Å; Y190-F283 AromaticContact CE1-CE2 3.31Å; Y190-F283 HydrophobicContact CE1-CE2 3.31Å; Y190-F283 AromaticContact CE1-CZ 3.86Å; Y190-F283 HydrophobicContact CE1-CZ 3.86Å; Y190-F283 AromaticContact CZ-CE2 3.68Å; Y190-F283 AromaticContact CZ-CZ 3.71Å; Y190-F283 WeakPolarHBondContact OH-CZ 3.4Å; Y190-M391 HydrophobicContact CD2-CE 4.24Å; Y190-M391 HydrophobicContact CE2-CE 3.83Å; Y190-H394 VanDerWaalsContact OH-CG 3.3Å
191H81.1Confident75.8Confident3 Ų332.9 Ų32.91%0.01418%0.176CC..Hα-helixtrans-61.3-38.9179.3178.968.9000112.3V187 V188 D189 S193 L194 R195 Y212 Y346 F398 Y399V187-H191 WeakPolarHBondContact O-CB 3.46Å; V187-H191 PolarHBondContact O-N 2.87Å; V188-H191 PolarHBondContact O-N 2.95Å; D189-H191 PolarHBondContact O-N 3.32Å; H191-S193 VanDerWaalsContact C-N 3.33Å; H191-L194 PolarHBondContact O-N 3.04Å; H191-R195 PolarHBondContact O-N 2.99Å; H191-Y212 HydrophobicContact CB-CD1 4.07Å; H191-Y212 HydrophobicContact CB-CE1 3.43Å; H191-Y212 VanDerWaalsContact CB-CE1 3.43Å; H191-Y212 HydrophobicContact CB-CE2 4.44Å; H191-Y212 AromaticContact CE1-CE2 3.9Å; H191-Y212 AromaticContact CG-CE1 3.66Å; H191-Y212 AromaticContact CG-CE2 3.8Å; H191-Y212 AromaticContact CG-CZ 3.49Å; H191-Y212 VanDerWaalsContact CG-CZ 3.49Å; H191-Y212 AromaticContact ND1-CE2 3.73Å; H191-Y212 AromaticContact ND1-CZ 3.65Å; H191-Y346 PolarHBondContact CE1-OH 3.25Å; H191-Y346 PolarHBondContact NE2-OH 3.44Å; H191-F398 AromaticContact CE1-CE1 3.44Å; H191-F398 VanDerWaalsContact CE1-CE1 3.44Å; H191-F398 WeakPolarHBondContact CE1-CE1 3.21Å; H191-F398 AromaticContact CE1-CZ 3.74Å; H191-F398 AromaticContact ND1-CE1 3.9Å; H191-F398 AromaticContact ND1-CZ 3.86Å; H191-Y399 PolarHBondContact CE1-OH 2.87Å
192R77.4Confident73.7Confident51 Ų5136.1 Ų36.119%0.19220%0.202CC..Hα-helixtrans-66-39.1175.6-166-171.1-179.2140.40.7111.1D13 F16 V188 D189 Y190 L194 R195 S196D13-R192 IonicContact OD1-CZ 3.2Å; D13-R192 VanDerWaalsContact OD1-CZ 3.27Å; D13-R192 IonicContact OD1-NE 3.6Å; D13-R192 PolarHBondContact OD1-NE 2.8Å; D13-R192 IonicContact OD1-NH2 3.27Å; D13-R192 PolarHBondContact OD1-NH2 3.05Å; F16-R192 VanDerWaalsContact CD1-NH1 3.3Å; F16-R192 VanDerWaalsContact CZ-NH1 3.33Å; V188-R192 WeakPolarHBondContact O-CB 3.39Å; V188-R192 PolarHBondContact O-N 3.38Å; D189-R192 PolarHBondContact O-N 3.04Å; Y190-R192 VanDerWaalsContact C-N 3.29Å; Y190-R192 PolarHBondContact O-N 3.41Å; R192-L194 VanDerWaalsContact C-N 3.32Å; R192-L194 PolarHBondContact O-N 2.91Å; R192-R195 PolarHBondContact O-N 3.07Å; R192-R195 VanDerWaalsContact O-N 3.11Å; R192-S196 PolarHBondContact O-N 2.9Å
193S74.3Confident71.8Confident10 Ų1043.5 Ų43.57%0.0724%0.235CC..Hα-helixtrans-62.3-35.3172.3-83.10000112.7H137 S140 D189 Y190 H191 R195 S196 F197H137-S193 PolarHBondContact CE1-O 2.84Å; H137-S193 PolarHBondContact ND1-O 3.11Å; S140-S193 WeakPolarHBondContact CB-OG 3.38Å; S140-S193 PolarHBondContact OG-OG 3.31Å; D189-S193 PolarHBondContact O-N 3.03Å; Y190-S193 CarbonylContact O-C 3.57Å; Y190-S193 WeakPolarHBondContact O-CA 3.27Å; Y190-S193 WeakPolarHBondContact O-CB 3.47Å; Y190-S193 PolarHBondContact O-N 3.35Å; Y190-S193 VanDerWaalsContact O-N 3.12Å; H191-S193 VanDerWaalsContact C-N 3.33Å; S193-R195 VanDerWaalsContact C-N 3.33Å; S193-S196 PolarHBondContact O-OG 3.33Å; S193-F197 WeakPolarHBondContact O-CE2 3.49Å
194L71.5Confident69.9Low4 Ų446.7 Ų46.72%0.02125%0.249CC..Hα-helixtrans-69.7-30.3171.1-71.7177.9000113.3Y190 H191 R192 S196 F197 M391 H394 A395 Y399Y190-L194 HydrophobicContact CD1-CD1 4.04Å; Y190-L194 HydrophobicContact CD1-CG 4.42Å; Y190-L194 HydrophobicContact CE1-CD1 3.24Å; Y190-L194 HydrophobicContact CE1-CD2 4.5Å; Y190-L194 HydrophobicContact CE1-CG 3.82Å; Y190-L194 HydrophobicContact CE2-CD1 4.41Å; Y190-L194 HydrophobicContact CE2-CD2 4.3Å; Y190-L194 HydrophobicContact CE2-CG 4.15Å; Y190-L194 VanDerWaalsContact CZ-CD1 3.5Å; Y190-L194 PolarHBondContact O-N 3.38Å; H191-L194 PolarHBondContact O-N 3.04Å; R192-L194 VanDerWaalsContact C-N 3.32Å; R192-L194 PolarHBondContact O-N 2.91Å; L194-S196 VanDerWaalsContact C-N 3.28Å; L194-S196 PolarHBondContact O-N 3.37Å; L194-F197 WeakPolarHBondContact O-CD2 3.49Å; L194-F197 PolarHBondContact O-N 2.72Å; L194-M391 HydrophobicContact CD2-CE 3.41Å; L194-M391 VanDerWaalsContact CD2-CE 3.41Å; L194-M391 HydrophobicContact CG-CE 3.83Å; L194-H394 HydrophobicContact CD2-CB 3.47Å; L194-H394 VanDerWaalsContact CD2-CB 3.47Å; L194-A395 HydrophobicContact CB-CB 4.46Å; L194-A395 HydrophobicContact CD2-CB 4.16Å; L194-A395 WeakPolarHBondContact O-CB 3.47Å; L194-Y399 HydrophobicContact CB-CE2 4.49Å
195R71Confident68.4Low28 Ų2856.3 Ų56.311%0.10629%0.285CS..Hα-helixtrans-75-19.9-176.3-153177-128.1169.25.4113.1H191 R192 S193 F197 L198 S208 Y346 F350 Y399H191-R195 PolarHBondContact O-N 2.99Å; R192-R195 PolarHBondContact O-N 3.07Å; R192-R195 VanDerWaalsContact O-N 3.11Å; S193-R195 VanDerWaalsContact C-N 3.33Å; R195-F197 PolarHBondContact O-N 3.02Å; R195-F197 VanDerWaalsContact O-N 3.11Å; R195-L198 HydrophobicContact CB-CD1 4.33Å; R195-L198 HydrophobicContact CG-CD1 3.51Å; R195-L198 PolarHBondContact O-N 3.09Å; R195-S208 PolarHBondContact NH1-OG 3.45Å; R195-Y346 PolarHBondContact NH2-OH 2.59Å; R195-F350 PolarHBondContact NH2-O 2.87Å; R195-Y399 WeakPolarHBondContact CB-OH 3.5Å; R195-Y399 WeakPolarHBondContact CG-OH 3.36Å
196S66.9Low67.4Low43 Ų4361.7 Ų61.730%0.30131%0.306SS..THydrogen-bonded Turntrans-57.9-22.9175.567.70000113.1H137 R192 S193 L194 L198H137-S196 PolarHBondContact CE1-OG 3.03Å; H137-S196 PolarHBondContact NE2-OG 3.25Å; R192-S196 PolarHBondContact O-N 2.9Å; S193-S196 PolarHBondContact O-OG 3.33Å; L194-S196 VanDerWaalsContact C-N 3.28Å; L194-S196 PolarHBondContact O-N 3.37Å; S196-L198 VanDerWaalsContact C-N 3.29Å; S196-L198 PolarHBondContact O-N 3.31Å
197F62.3Low66.8Low48 Ų4863 Ų6321%0.21132%0.321CS..THydrogen-bonded Turntrans-79.1-6.9179-63.5-87.7000113.3H137 S193 L194 R195 L387 N388 M391 A392 A395H137-F197 AromaticContact CD2-CE2 3.83Å; H137-F197 AromaticContact CD2-CZ 3.62Å; H137-F197 AromaticContact NE2-CE2 3.86Å; H137-F197 AromaticContact NE2-CZ 3.97Å; S193-F197 WeakPolarHBondContact O-CE2 3.49Å; L194-F197 WeakPolarHBondContact O-CD2 3.49Å; L194-F197 PolarHBondContact O-N 2.72Å; R195-F197 PolarHBondContact O-N 3.02Å; R195-F197 VanDerWaalsContact O-N 3.11Å; F197-L387 HydrophobicContact CD1-CD1 3.8Å; F197-L387 HydrophobicContact CE1-CD1 3.61Å; F197-L387 HydrophobicContact CE1-CG 4.15Å; F197-N388 HydrophobicContact CZ-CB 4.26Å; F197-M391 HydrophobicContact CE2-CB 3.59Å; F197-M391 HydrophobicContact CE2-CE 4.38Å; F197-M391 HydrophobicContact CZ-CB 3.49Å; F197-M391 VanDerWaalsContact CZ-CB 3.49Å; F197-A392 HydrophobicContact CD1-CB 3.74Å; F197-A392 HydrophobicContact CE1-CB 3.72Å; F197-A395 HydrophobicContact CB-CB 3.76Å; F197-A395 HydrophobicContact CD2-CB 3.95Å; F197-A395 HydrophobicContact CG-CB 3.99Å
198L62.6Low66.4Low21 Ų2162.9 Ų62.911%0.1132%0.321CS..SBendtrans-84.4138.2173.8-79.3114.8000112.2R195 S196 D200 P352 L354 Y399R195-L198 HydrophobicContact CB-CD1 4.33Å; R195-L198 HydrophobicContact CG-CD1 3.51Å; R195-L198 PolarHBondContact O-N 3.09Å; S196-L198 VanDerWaalsContact C-N 3.29Å; S196-L198 PolarHBondContact O-N 3.31Å; L198-D200 VanDerWaalsContact C-N 3.33Å; L198-D200 PolarHBondContact O-N 3.28Å; L198-P352 HydrophobicContact CD2-CB 4.02Å; L198-P352 HydrophobicContact CD2-CG 4.08Å; L198-L354 HydrophobicContact CD2-CD1 3.24Å; L198-L354 HydrophobicContact CD2-CG 4.38Å; L198-L354 HydrophobicContact CG-CD1 3.62Å; L198-Y399 HydrophobicContact CD1-CD1 4.05Å; L198-Y399 HydrophobicContact CD1-CD2 3.49Å; L198-Y399 VanDerWaalsContact CD1-CD2 3.49Å; L198-Y399 HydrophobicContact CD1-CE1 3.9Å; L198-Y399 HydrophobicContact CD1-CE2 3.31Å; L198-Y399 HydrophobicContact CD1-CG 3.86Å; L198-Y399 HydrophobicContact CD2-CG 4.49Å; L198-Y399 HydrophobicContact CG-CD2 4.3Å; L198-Y399 HydrophobicContact CG-CG 4.47Å
199P52.7Low66.2Low106 Ų10663.6 Ų63.669%0.68833%0.326SS*.SBendtrans-66.1-30.6177.824.1-31.4000113.5K201P199-K201 PolarHBondContact O-N 3.2Å
200D54.2Low66.4Low146 Ų14667.4 Ų67.478%0.78135%0.345SS*.  trans-92.857.5-178.9-65.4-33.3000112.5L198 A202L198-D200 VanDerWaalsContact C-N 3.33Å; L198-D200 PolarHBondContact O-N 3.28Å; D200-A202 PolarHBondContact O-N 3.01Å; D200-A202 VanDerWaalsContact O-N 3.13Å
201K51.2Low66.7Low85 Ų8568.5 Ų68.537%0.3735%0.353SS..G310 helixtrans-60.9-16.8175.8-171.5-179.8178.9-169.30113.1S7 D13 P199 E203S7-K201 PolarHBondContact OG-NZ 3.07Å; D13-K201 IonicContact OD2-NZ 3.41Å; D13-K201 PolarHBondContact OD2-NZ 3.22Å; D13-K201 VanDerWaalsContact OD2-NZ 3.08Å; P199-K201 PolarHBondContact O-N 3.2Å; K201-E203 PolarHBondContact O-N 2.87Å
202A44.6Very low66.9Low99 Ų9969.1 Ų69.182%0.81836%0.355SS*.G310 helixtrans-74.9-16.5-158.500000116.8D200D200-A202 PolarHBondContact O-N 3.01Å; D200-A202 VanDerWaalsContact O-N 3.13Å
203E47.3Very low67.5Low172 Ų17269 Ų6980%0.80436%0.356SS*.G310 helixtrans-123.536.5-171-62.6-149.7165.500115.6K201 R205K201-E203 PolarHBondContact O-N 2.87Å; E203-R205 PolarHBondContact O-N 3.25Å
204Q50.8Low68.4Low68 Ų6872 Ų7232%0.31837%0.371SS..  trans-74.895.6173.3-167.5145-17.800111.4W206 S209Q204-W206 PolarHBondContact O-N 3.38Å; Q204-S209 PolarHBondContact NE2-OG 3.03Å
205R59.3Low69.4Low203 Ų20372 Ų7277%0.76637%0.37SS*.  trans-62.3128.6162.9-69.2-178.9178.6-177.7-0.6108.5E203 G207 S208E203-R205 PolarHBondContact O-N 3.25Å; R205-G207 PolarHBondContact O-N 2.9Å; R205-S208 PolarHBondContact O-N 2.86Å
206W64.6Low70.4Confident163 Ų16370.7 Ų70.762%0.61737%0.366SS*.Hα-helixtrans-42.6-32.1178.4-71.668.1000113.6I12 Q204 S208 S209 I210I12-W206 HydrophobicContact CD1-CZ2 4.29Å; Q204-W206 PolarHBondContact O-N 3.38Å; W206-S208 VanDerWaalsContact C-N 3.34Å; W206-S208 PolarHBondContact O-N 3.42Å; W206-S209 PolarHBondContact O-N 2.92Å; W206-I210 WeakPolarHBondContact O-CG1 3.18Å; W206-I210 PolarHBondContact O-N 3.11Å
207G74.2Confident71.7Confident34 Ų3470.8 Ų70.835%0.35136%0.362SS..Hα-helixtrans-56.3-36.5176.400000115.1R205 S209 I210 V211R205-G207 PolarHBondContact O-N 2.9Å; G207-S209 PolarHBondContact O-N 3.33Å; G207-I210 PolarHBondContact O-N 3.35Å; G207-V211 WeakPolarHBondContact O-CB 3.29Å; G207-V211 VanDerWaalsContact O-CG2 3.25Å; G207-V211 WeakPolarHBondContact O-CG2 3.45Å; G207-V211 PolarHBondContact O-N 3.07Å
208S79.5Confident73.2Confident8 Ų869.8 Ų69.86%0.05636%0.359CS..Hα-helixtrans-65.5-41.6-178.2-179.90000112R195 R205 W206 Y212 Y346R195-S208 PolarHBondContact NH1-OG 3.45Å; R205-S208 PolarHBondContact O-N 2.86Å; W206-S208 VanDerWaalsContact C-N 3.34Å; W206-S208 PolarHBondContact O-N 3.42Å; S208-Y212 WeakPolarHBondContact O-CB 3.13Å; S208-Y212 PolarHBondContact O-N 2.67Å; S208-Y346 WeakPolarHBondContact OG-CE2 3.35Å
209S81.6Confident74.7Confident18 Ų1869.2 Ų69.213%0.12636%0.356CS..Hα-helixtrans-70-37.7176.3-57.30000112.1Q204 W206 G207 Y212 F213Q204-S209 PolarHBondContact NE2-OG 3.03Å; W206-S209 PolarHBondContact O-N 2.92Å; G207-S209 PolarHBondContact O-N 3.33Å; S209-Y212 CarbonylContact O-C 3.49Å; S209-Y212 PolarHBondContact O-N 2.92Å; S209-F213 WeakPolarHBondContact O-CB 3.44Å; S209-F213 PolarHBondContact O-N 2.87Å
210I85.2Confident76.7Confident99 Ų9964.3 Ų64.351%0.50832%0.324SS..Hα-helixtrans-66.3-45.4178.1-67167.6000110.3W206 G207 Y212 F213 L214W206-I210 WeakPolarHBondContact O-CG1 3.18Å; W206-I210 PolarHBondContact O-N 3.11Å; G207-I210 PolarHBondContact O-N 3.35Å; I210-Y212 VanDerWaalsContact C-N 3.25Å; I210-Y212 PolarHBondContact O-N 3.46Å; I210-F213 WeakPolarHBondContact O-CB 3.46Å; I210-F213 PolarHBondContact O-N 3.24Å; I210-L214 WeakPolarHBondContact O-CB 3.45Å; I210-L214 PolarHBondContact O-N 3.42Å
211V87.8Confident78.6Confident30 Ų3058.4 Ų58.418%0.18230%0.298CS..Hα-helixtrans-60.2-41.7173.6174.50000109.6G207 F213 L214 W215 Y346G207-V211 WeakPolarHBondContact O-CB 3.29Å; G207-V211 VanDerWaalsContact O-CG2 3.25Å; G207-V211 WeakPolarHBondContact O-CG2 3.45Å; G207-V211 PolarHBondContact O-N 3.07Å; V211-F213 VanDerWaalsContact C-N 3.34Å; V211-F213 PolarHBondContact O-N 3.33Å; V211-L214 PolarHBondContact O-N 2.93Å; V211-W215 PolarHBondContact O-N 3.26Å; V211-W215 VanDerWaalsContact O-N 3.12Å; V211-Y346 HydrophobicContact CB-CD2 4.5Å; V211-Y346 HydrophobicContact CG1-CD2 4.13Å
212Y86.6Confident80.7Confident15 Ų1554.8 Ų54.86%0.05928%0.283CS..Hα-helixtrans-66.2-31.4177.7-163-88.6000113.8V187 V188 H191 S208 S209 I210 W215 N216 Y346 F398V187-Y212 HydrophobicContact CG1-CE1 4.08Å; V188-Y212 HydrophobicContact CB-CD1 4.48Å; V188-Y212 HydrophobicContact CG2-CD1 3.89Å; H191-Y212 HydrophobicContact CB-CD1 4.07Å; H191-Y212 HydrophobicContact CB-CE1 3.43Å; H191-Y212 VanDerWaalsContact CB-CE1 3.43Å; H191-Y212 HydrophobicContact CB-CE2 4.44Å; H191-Y212 AromaticContact CE1-CE2 3.9Å; H191-Y212 AromaticContact CG-CE1 3.66Å; H191-Y212 AromaticContact CG-CE2 3.8Å; H191-Y212 AromaticContact CG-CZ 3.49Å; H191-Y212 VanDerWaalsContact CG-CZ 3.49Å; H191-Y212 AromaticContact ND1-CE2 3.73Å; H191-Y212 AromaticContact ND1-CZ 3.65Å; S208-Y212 WeakPolarHBondContact O-CB 3.13Å; S208-Y212 PolarHBondContact O-N 2.67Å; S209-Y212 CarbonylContact O-C 3.49Å; S209-Y212 PolarHBondContact O-N 2.92Å; I210-Y212 VanDerWaalsContact C-N 3.25Å; I210-Y212 PolarHBondContact O-N 3.46Å; Y212-W215 VanDerWaalsContact CA-NE1 3.27Å; Y212-W215 AromaticContact CD1-NE1 3.99Å; Y212-W215 AromaticContact CD2-CE2 3.96Å; Y212-W215 AromaticContact CD2-CZ2 3.99Å; Y212-W215 HydrophobicContact CD2-CZ2 3.99Å; Y212-W215 AromaticContact CD2-NE1 3.36Å; Y212-W215 AromaticContact CE2-CE2 4Å; Y212-W215 AromaticContact CE2-CZ2 3.55Å; Y212-W215 HydrophobicContact CE2-CZ2 3.55Å; Y212-W215 AromaticContact CE2-NE1 3.8Å; Y212-W215 AromaticContact CG-NE1 3.48Å; Y212-W215 AromaticContact CZ-CZ2 3.95Å; Y212-W215 PolarHBondContact O-NE1 2.86Å; Y212-N216 WeakPolarHBondContact CD1-ND2 2.98Å; Y212-N216 VanDerWaalsContact CE1-ND2 3.25Å; Y212-N216 WeakPolarHBondContact CE1-ND2 3.19Å; Y212-N216 PolarHBondContact O-ND2 2.84Å; Y212-Y346 HydrophobicContact CD2-CD1 4.49Å; Y212-Y346 HydrophobicContact CD2-CD2 4.37Å; Y212-Y346 HydrophobicContact CD2-CE1 4.01Å; Y212-Y346 AromaticContact CD2-CE2 3.85Å; Y212-Y346 HydrophobicContact CD2-CE2 3.85Å; Y212-Y346 AromaticContact CD2-CZ 3.68Å; Y212-Y346 HydrophobicContact CE2-CE1 4.39Å; Y212-Y346 HydrophobicContact CG-CE2 4.44Å; Y212-F398 HydrophobicContact CE2-CZ 4.28Å
213F89.9Confident83.1Confident49 Ų4950.2 Ų50.222%0.21524%0.244CC..Hα-helixtrans-70.3-49171.9173-97.7000110.9A181 A184 W185 V188 S209 I210 V211 N216 L217A181-F213 HydrophobicContact CB-CZ 3.99Å; A181-F213 WeakPolarHBondContact O-CE2 3.36Å; A184-F213 HydrophobicContact CB-CD2 3.98Å; A184-F213 HydrophobicContact CB-CE2 3.76Å; A184-F213 HydrophobicContact CB-CZ 4.42Å; W185-F213 HydrophobicContact CB-CE2 4.24Å; W185-F213 HydrophobicContact CE3-CD2 4.4Å; V188-F213 HydrophobicContact CG2-CB 3.69Å; V188-F213 HydrophobicContact CG2-CD2 4.09Å; V188-F213 HydrophobicContact CG2-CG 4.41Å; S209-F213 WeakPolarHBondContact O-CB 3.44Å; S209-F213 PolarHBondContact O-N 2.87Å; I210-F213 WeakPolarHBondContact O-CB 3.46Å; I210-F213 PolarHBondContact O-N 3.24Å; V211-F213 VanDerWaalsContact C-N 3.34Å; V211-F213 PolarHBondContact O-N 3.33Å; F213-N216 PolarHBondContact O-N 3.13Å; F213-L217 HydrophobicContact CE1-CD2 4.01Å; F213-L217 HydrophobicContact CZ-CD2 4.28Å; F213-L217 PolarHBondContact O-N 3.24Å
214L92.1Very high85.5Confident72 Ų7242.2 Ų42.238%0.37721%0.207SC..Hα-helixtrans-66-43.6-170.9-173.460.7000112.7I210 V211 L217 L218 L342I210-L214 WeakPolarHBondContact O-CB 3.45Å; I210-L214 PolarHBondContact O-N 3.42Å; V211-L214 PolarHBondContact O-N 2.93Å; L214-L217 PolarHBondContact O-N 3.26Å; L214-L218 HydrophobicContact CD1-CD1 4.16Å; L214-L218 HydrophobicContact CD1-CG 4.37Å; L214-L218 HydrophobicContact CG-CD1 4.02Å; L214-L218 WeakPolarHBondContact O-CB 3.22Å; L214-L218 VanDerWaalsContact O-CG 3.3Å; L214-L218 WeakPolarHBondContact O-CG 3.33Å; L214-L218 PolarHBondContact O-N 3.26Å; L214-L342 HydrophobicContact CB-CD1 4.18Å; L214-L342 HydrophobicContact CD2-CD1 3.57Å; L214-L342 HydrophobicContact CG-CD1 3.6Å
215W92.1Very high87.6Confident4 Ų440 Ų402%0.01520%0.201CC..Hα-helixtrans-66.4-37.6176.878.5-58.1000112.4V211 Y212 L218 L219 L342 K343 Y347V211-W215 PolarHBondContact O-N 3.26Å; V211-W215 VanDerWaalsContact O-N 3.12Å; Y212-W215 VanDerWaalsContact CA-NE1 3.27Å; Y212-W215 AromaticContact CD1-NE1 3.99Å; Y212-W215 AromaticContact CD2-CE2 3.96Å; Y212-W215 AromaticContact CD2-CZ2 3.99Å; Y212-W215 HydrophobicContact CD2-CZ2 3.99Å; Y212-W215 AromaticContact CD2-NE1 3.36Å; Y212-W215 AromaticContact CE2-CE2 4Å; Y212-W215 AromaticContact CE2-CZ2 3.55Å; Y212-W215 HydrophobicContact CE2-CZ2 3.55Å; Y212-W215 AromaticContact CE2-NE1 3.8Å; Y212-W215 AromaticContact CG-NE1 3.48Å; Y212-W215 AromaticContact CZ-CZ2 3.95Å; Y212-W215 PolarHBondContact O-NE1 2.86Å; W215-L218 PolarHBondContact O-N 3.41Å; W215-L219 HydrophobicContact CE3-CD1 3.44Å; W215-L219 VanDerWaalsContact CE3-CD1 3.44Å; W215-L219 HydrophobicContact CE3-CG 4.48Å; W215-L219 HydrophobicContact CZ3-CD1 3.65Å; W215-L219 WeakPolarHBondContact O-CB 3.46Å; W215-L219 VanDerWaalsContact O-CG 3.27Å; W215-L219 WeakPolarHBondContact O-CG 3.45Å; W215-L219 PolarHBondContact O-N 2.95Å; W215-L342 HydrophobicContact CB-CB 3.74Å; W215-K343 HydrophobicContact CD2-CB 3.96Å; W215-K343 HydrophobicContact CD2-CG 4.1Å; W215-K343 HydrophobicContact CE3-CB 3.32Å; W215-K343 HydrophobicContact CE3-CD 3.62Å; W215-K343 HydrophobicContact CE3-CG 3.33Å; W215-K343 HydrophobicContact CH2-CD 3.99Å; W215-K343 HydrophobicContact CH2-CG 3.92Å; W215-K343 HydrophobicContact CZ3-CB 3.84Å; W215-K343 HydrophobicContact CZ3-CD 3.17Å; W215-K343 HydrophobicContact CZ3-CG 3.27Å; W215-Y347 HydrophobicContact CH2-CE2 4.44Å
216N93.1Very high89.4Confident1 Ų130.3 Ų30.31%0.00516%0.164CC..Hα-helixtrans-64.8-44175.3-84.2-64.4000111.1A184 Y212 F213 L218 L219 I220A184-N216 HydrophobicContact CB-CB 4.45Å; Y212-N216 WeakPolarHBondContact CD1-ND2 2.98Å; Y212-N216 VanDerWaalsContact CE1-ND2 3.25Å; Y212-N216 WeakPolarHBondContact CE1-ND2 3.19Å; Y212-N216 PolarHBondContact O-ND2 2.84Å; F213-N216 PolarHBondContact O-N 3.13Å; N216-L218 VanDerWaalsContact C-N 3.3Å; N216-L218 PolarHBondContact O-N 3.24Å; N216-L219 PolarHBondContact O-N 3.45Å; N216-I220 HydrophobicContact CB-CD1 4.46Å; N216-I220 WeakPolarHBondContact O-CB 3.28Å; N216-I220 VanDerWaalsContact O-CG1 3.28Å; N216-I220 WeakPolarHBondContact O-CG1 3.42Å; N216-I220 PolarHBondContact O-N 3.35Å
217L93.9Very high90.9Very high45 Ų4522.6 Ų22.624%0.23614%0.135CC..Hα-helixtrans-58.1-43.5174.7-177.963.3000111.6A180 A184 F213 L214 L219 G221A180-L217 HydrophobicContact CB-CD1 3.96Å; A184-L217 HydrophobicContact CB-CB 3.95Å; A184-L217 HydrophobicContact CB-CD1 4.28Å; F213-L217 HydrophobicContact CE1-CD2 4.01Å; F213-L217 HydrophobicContact CZ-CD2 4.28Å; F213-L217 PolarHBondContact O-N 3.24Å; L214-L217 PolarHBondContact O-N 3.26Å; L217-L219 VanDerWaalsContact C-N 3.34Å; L217-L219 PolarHBondContact O-N 3.31Å; L217-G221 WeakPolarHBondContact O-CA 3.43Å; L217-G221 PolarHBondContact O-N 2.88Å
218L94.8Very high91.9Very high28 Ų2821 Ų2115%0.14712%0.119CC..Hα-helixtrans-76.4-14.3-179.7-71.4174000114.6L214 W215 N216 P222 C335 L338 L342L214-L218 HydrophobicContact CD1-CD1 4.16Å; L214-L218 HydrophobicContact CD1-CG 4.37Å; L214-L218 HydrophobicContact CG-CD1 4.02Å; L214-L218 WeakPolarHBondContact O-CB 3.22Å; L214-L218 VanDerWaalsContact O-CG 3.3Å; L214-L218 WeakPolarHBondContact O-CG 3.33Å; L214-L218 PolarHBondContact O-N 3.26Å; W215-L218 PolarHBondContact O-N 3.41Å; N216-L218 VanDerWaalsContact C-N 3.3Å; N216-L218 PolarHBondContact O-N 3.24Å; L218-P222 WeakPolarHBondContact O-CD 3.37Å; L218-P222 WeakPolarHBondContact O-CG 3.38Å; L218-C335 HydrophobicContact CD2-CB 4.13Å; L218-L338 HydrophobicContact CD1-CB 4.4Å; L218-L338 HydrophobicContact CD1-CD2 3.83Å; L218-L338 HydrophobicContact CD1-CG 3.87Å; L218-L342 HydrophobicContact CD1-CD1 3.74Å
219L93.9Very high92.6Very high8 Ų820.9 Ų20.94%0.04212%0.117CC..Hα-helixtrans-92.7-45171.2-69.3-179.9000111.6W215 N216 L217 R223 Y336 L340W215-L219 HydrophobicContact CE3-CD1 3.44Å; W215-L219 VanDerWaalsContact CE3-CD1 3.44Å; W215-L219 HydrophobicContact CE3-CG 4.48Å; W215-L219 HydrophobicContact CZ3-CD1 3.65Å; W215-L219 WeakPolarHBondContact O-CB 3.46Å; W215-L219 VanDerWaalsContact O-CG 3.27Å; W215-L219 WeakPolarHBondContact O-CG 3.45Å; W215-L219 PolarHBondContact O-N 2.95Å; N216-L219 PolarHBondContact O-N 3.45Å; L217-L219 VanDerWaalsContact C-N 3.34Å; L217-L219 PolarHBondContact O-N 3.31Å; L219-R223 WeakPolarHBondContact O-CB 3.38Å; L219-Y336 HydrophobicContact CB-CE2 4.38Å; L219-Y336 HydrophobicContact CD2-CD1 4.44Å; L219-Y336 HydrophobicContact CD2-CD2 3.74Å; L219-Y336 HydrophobicContact CD2-CE1 4.32Å; L219-Y336 HydrophobicContact CD2-CE2 3.58Å; L219-Y336 HydrophobicContact CD2-CG 4.18Å; L219-L340 HydrophobicContact CD2-CD2 4.17Å; L219-L340 HydrophobicContact CD2-CG 4.07Å
220I94.3Very high93.3Very high4 Ų420.9 Ų20.92%0.02112%0.115CC..Hα-helixtrans-73.7-43.4-177.5-62.4172.1000110.8F148 V183 V187 N216 R223 V224F148-I220 HydrophobicContact CE1-CD1 4.34Å; F148-I220 HydrophobicContact CZ-CD1 4.15Å; V183-I220 HydrophobicContact CG1-CD1 4.06Å; V183-I220 HydrophobicContact CG1-CG2 4.01Å; V187-I220 HydrophobicContact CG2-CD1 4.19Å; N216-I220 HydrophobicContact CB-CD1 4.46Å; N216-I220 WeakPolarHBondContact O-CB 3.28Å; N216-I220 VanDerWaalsContact O-CG1 3.28Å; N216-I220 WeakPolarHBondContact O-CG1 3.42Å; N216-I220 PolarHBondContact O-N 3.35Å; I220-R223 WeakPolarHBondContact O-CB 3.39Å; I220-R223 PolarHBondContact O-N 2.97Å; I220-V224 HydrophobicContact CG2-CG2 4.03Å; I220-V224 WeakPolarHBondContact O-CB 3.47Å; I220-V224 WeakPolarHBondContact O-CG2 3.44Å; I220-V224 PolarHBondContact O-N 3.03Å
221G94.1Very high93.7Very high22 Ų2216.5 Ų16.523%0.2279%0.093CC..Hα-helixtrans-56.4-55.7-177.600000112.9L217 R223 V224 A225L217-G221 WeakPolarHBondContact O-CA 3.43Å; L217-G221 PolarHBondContact O-N 2.88Å; G221-R223 VanDerWaalsContact C-N 3.29Å; G221-R223 PolarHBondContact O-N 3.17Å; G221-V224 PolarHBondContact O-N 2.85Å; G221-A225 WeakPolarHBondContact O-CB 3.24Å; G221-A225 PolarHBondContact O-N 3.18Å
222P95.1Very high93.9Very high8 Ų816.3 Ų16.35%0.0529%0.093CC..Hα-helixtrans-62.3-34.3177.4-26.937.6000113.9L218 A225 A226 L332 C335L218-P222 WeakPolarHBondContact O-CD 3.37Å; L218-P222 WeakPolarHBondContact O-CG 3.38Å; P222-A225 PolarHBondContact O-N 3.17Å; P222-A226 WeakPolarHBondContact O-CB 3.49Å; P222-A226 PolarHBondContact O-N 3.11Å; P222-L332 HydrophobicContact CB-CB 4.35Å; P222-L332 HydrophobicContact CB-CD2 4.27Å; P222-C335 HydrophobicContact CG-CB 3.6Å
223R95.9Very high94.3Very high3 Ų317.3 Ų17.31%0.01110%0.101CC..Hα-helixtrans-61.7-50.8175176.959.2177.6170.65.6111.3L219 I220 G221 A226 L227 Y279 D304L219-R223 WeakPolarHBondContact O-CB 3.38Å; I220-R223 WeakPolarHBondContact O-CB 3.39Å; I220-R223 PolarHBondContact O-N 2.97Å; G221-R223 VanDerWaalsContact C-N 3.29Å; G221-R223 PolarHBondContact O-N 3.17Å; R223-A226 PolarHBondContact O-N 2.89Å; R223-L227 HydrophobicContact CG-CD1 4.43Å; R223-L227 WeakPolarHBondContact O-CG 3.41Å; R223-L227 PolarHBondContact O-N 2.85Å; R223-L227 VanDerWaalsContact O-N 3.09Å; R223-Y279 PolarHBondContact NE-O 3.32Å; R223-Y279 VanDerWaalsContact NE-O 3.09Å; R223-D304 IonicContact CZ-OD2 3.13Å; R223-D304 IonicContact NH1-OD2 2.62Å; R223-D304 PolarHBondContact NH1-OD2 3.49Å; R223-D304 IonicContact NH2-OD2 3.08Å; R223-D304 PolarHBondContact NH2-OD2 3.07Å
224V96Very high94.4Very high4 Ų417.1 Ų17.12%0.02410%0.101CC..Hα-helixtrans-60.9-44.7177.41660000111.3L155 V156 I220 G221 A226 L227 A228 F280L155-V224 HydrophobicContact CB-CG1 4.26Å; L155-V224 HydrophobicContact CD2-CG1 3.9Å; L155-V224 HydrophobicContact CD2-CG2 4.46Å; L155-V224 HydrophobicContact CG-CG1 3.73Å; V156-V224 HydrophobicContact CG2-CB 4.26Å; V156-V224 HydrophobicContact CG2-CG1 3.81Å; V156-V224 HydrophobicContact CG2-CG2 4.25Å; I220-V224 HydrophobicContact CG2-CG2 4.03Å; I220-V224 WeakPolarHBondContact O-CB 3.47Å; I220-V224 WeakPolarHBondContact O-CG2 3.44Å; I220-V224 PolarHBondContact O-N 3.03Å; G221-V224 PolarHBondContact O-N 2.85Å; V224-A226 PolarHBondContact O-N 2.8Å; V224-L227 PolarHBondContact O-N 3.46Å; V224-A228 WeakPolarHBondContact O-CB 3.49Å; V224-A228 PolarHBondContact O-N 3.19Å; V224-F280 HydrophobicContact CG2-CD1 4.29Å
225A95.4Very high94.1Very high22 Ų2216 Ų1618%0.18210%0.099CC..Hα-helixtrans-62.7-42177.700000112.2G221 P222 A228 L229 L332G221-A225 WeakPolarHBondContact O-CB 3.24Å; G221-A225 PolarHBondContact O-N 3.18Å; P222-A225 PolarHBondContact O-N 3.17Å; A225-A228 PolarHBondContact O-N 2.85Å; A225-L229 VanDerWaalsContact O-CG 3.28Å; A225-L229 WeakPolarHBondContact O-CG 3.4Å; A225-L229 PolarHBondContact O-N 2.97Å; A225-L332 HydrophobicContact CB-CD1 4.03Å; A225-L332 HydrophobicContact CB-CD2 3.71Å
226A96.6Very high93.7Very high0 Ų018.8 Ų18.80%013%0.129CC..Hα-helixtrans-62.9-42.4176.900000112.3P222 R223 V224 A228 L229 F230 V305 L308 L309P222-A226 WeakPolarHBondContact O-CB 3.49Å; P222-A226 PolarHBondContact O-N 3.11Å; R223-A226 PolarHBondContact O-N 2.89Å; V224-A226 PolarHBondContact O-N 2.8Å; A226-A228 VanDerWaalsContact C-N 3.34Å; A226-A228 PolarHBondContact O-N 2.79Å; A226-L229 PolarHBondContact O-N 3.37Å; A226-F230 WeakPolarHBondContact O-CB 3.26Å; A226-F230 PolarHBondContact O-N 3.08Å; A226-V305 HydrophobicContact CB-CG1 4Å; A226-V305 HydrophobicContact CB-CG2 4.38Å; A226-L308 HydrophobicContact CB-CD1 4.4Å; A226-L309 HydrophobicContact CB-CD2 4.13Å; A226-L309 HydrophobicContact CB-CG 4.42Å
227L96.8Very high93.7Very high1 Ų124.1 Ų24.11%0.00515%0.152CC..Hα-helixtrans-62.3-41.2175.2-69.6171.1000111.9V156 R223 V224 F230 S231 I238 Y279 F280 L308V156-L227 HydrophobicContact CG1-CB 3.97Å; V156-L227 HydrophobicContact CG2-CB 4.16Å; V156-L227 HydrophobicContact CG2-CD1 4.2Å; R223-L227 HydrophobicContact CG-CD1 4.43Å; R223-L227 WeakPolarHBondContact O-CG 3.41Å; R223-L227 PolarHBondContact O-N 2.85Å; R223-L227 VanDerWaalsContact O-N 3.09Å; V224-L227 PolarHBondContact O-N 3.46Å; L227-F230 PolarHBondContact O-N 3.24Å; L227-S231 PolarHBondContact O-N 3.33Å; L227-S231 PolarHBondContact O-OG 3.17Å; L227-I238 HydrophobicContact CB-CD1 4.43Å; L227-I238 HydrophobicContact CD2-CD1 3.93Å; L227-Y279 HydrophobicContact CD1-CE1 3.66Å; L227-Y279 HydrophobicContact CD2-CE1 4.41Å; L227-Y279 VanDerWaalsContact CD2-OH 3.25Å; L227-Y279 WeakPolarHBondContact CD2-OH 3.46Å; L227-F280 HydrophobicContact CD1-CD1 4.28Å; L227-F280 HydrophobicContact CD1-CE1 3.93Å; L227-L308 HydrophobicContact CD2-CD1 3.65Å; L227-L308 HydrophobicContact CG-CD1 4.29Å
228A95.3Very high93.6Very high0 Ų023.9 Ų23.90%015%0.15CC..Hα-helixtrans-70.4-36.2178.400000113.2V156 V159 L163 V224 A225 A226 S231 S232V156-A228 HydrophobicContact CG1-CB 4.2Å; V159-A228 HydrophobicContact CB-CB 3.6Å; V159-A228 HydrophobicContact CG1-CB 3.41Å; V159-A228 VanDerWaalsContact CG1-CB 3.41Å; L163-A228 HydrophobicContact CD1-CB 4.33Å; V224-A228 WeakPolarHBondContact O-CB 3.49Å; V224-A228 PolarHBondContact O-N 3.19Å; A225-A228 PolarHBondContact O-N 2.85Å; A226-A228 VanDerWaalsContact C-N 3.34Å; A226-A228 PolarHBondContact O-N 2.79Å; A228-S231 WeakPolarHBondContact CA-OG 3.38Å; A228-S231 PolarHBondContact O-OG 3.46Å; A228-S232 PolarHBondContact O-N 3.03Å
229L94.9Very high93.4Very high6 Ų625.1 Ų25.13%0.03117%0.165CC..Hα-helixtrans-63.8-48.8172.7-73162.9000110.2L163 A225 A226 S231 S232 L309 W312 V328 L332L163-L229 HydrophobicContact CD1-CD2 3.78Å; L163-L229 HydrophobicContact CD1-CG 4.15Å; L163-L229 HydrophobicContact CD2-CD2 4.15Å; A225-L229 VanDerWaalsContact O-CG 3.28Å; A225-L229 WeakPolarHBondContact O-CG 3.4Å; A225-L229 PolarHBondContact O-N 2.97Å; A226-L229 PolarHBondContact O-N 3.37Å; L229-S231 VanDerWaalsContact C-N 3.34Å; L229-S231 PolarHBondContact O-N 2.95Å; L229-S232 WeakPolarHBondContact O-CB 3.37Å; L229-S232 PolarHBondContact O-N 3.22Å; L229-S232 VanDerWaalsContact O-N 3.07Å; L229-S232 PolarHBondContact O-OG 3.12Å; L229-L309 HydrophobicContact CD1-CD2 3.93Å; L229-W312 HydrophobicContact CB-CB 4.39Å; L229-W312 HydrophobicContact CB-CD2 4.23Å; L229-W312 HydrophobicContact CB-CG 3.86Å; L229-W312 HydrophobicContact CD2-CD2 4.12Å; L229-W312 HydrophobicContact CD2-CH2 4.49Å; L229-W312 HydrophobicContact CD2-CZ2 3.82Å; L229-V328 HydrophobicContact CD1-CG1 3.45Å; L229-V328 VanDerWaalsContact CD1-CG1 3.45Å; L229-V328 HydrophobicContact CD2-CG1 4.4Å; L229-L332 HydrophobicContact CD1-CD1 3.52Å
230F95.9Very high93.4Very high18 Ų1828.9 Ų28.98%0.07919%0.185CC..Hα-helixtrans-57.9-45.3176173.8-99.3000112.4A226 L227 S232 V233 L234 F237 I238 H241 L308 T311A226-F230 WeakPolarHBondContact O-CB 3.26Å; A226-F230 PolarHBondContact O-N 3.08Å; L227-F230 PolarHBondContact O-N 3.24Å; F230-S232 PolarHBondContact O-N 3.49Å; F230-V233 WeakPolarHBondContact O-CG2 3.46Å; F230-V233 PolarHBondContact O-N 3.25Å; F230-L234 HydrophobicContact CE2-CD1 4.13Å; F230-L234 HydrophobicContact CZ-CB 4.37Å; F230-L234 HydrophobicContact CZ-CD1 4.48Å; F230-L234 PolarHBondContact O-N 2.86Å; F230-F237 HydrophobicContact CE1-CB 4.12Å; F230-F237 HydrophobicContact CZ-CB 3.84Å; F230-I238 HydrophobicContact CD1-CD1 4.03Å; F230-I238 HydrophobicContact CE1-CD1 4.45Å; F230-H241 HydrophobicContact CE1-CB 4.46Å; F230-L308 HydrophobicContact CB-CB 4.26Å; F230-L308 HydrophobicContact CB-CD2 3.73Å; F230-L308 HydrophobicContact CD1-CD2 3.83Å; F230-L308 HydrophobicContact CD2-CD2 3.72Å; F230-L308 HydrophobicContact CE1-CD2 4.36Å; F230-L308 HydrophobicContact CE2-CD2 4.26Å; F230-L308 HydrophobicContact CG-CD2 3.47Å; F230-L308 VanDerWaalsContact CG-CD2 3.47Å; F230-T311 HydrophobicContact CD2-CG2 4.08Å; F230-T311 HydrophobicContact CE2-CG2 3.84Å
231S93.8Very high93.4Very high6 Ų629.9 Ų29.94%0.04219%0.189CC..Hα-helixtrans-66.8-23.6177.868.60000113.1Y160 L227 A228 L229 V233 P235Y160-S231 VanDerWaalsContact CD2-OG 3.32Å; Y160-S231 WeakPolarHBondContact CD2-OG 3.41Å; Y160-S231 WeakPolarHBondContact CE2-O 3.44Å; L227-S231 PolarHBondContact O-N 3.33Å; L227-S231 PolarHBondContact O-OG 3.17Å; A228-S231 WeakPolarHBondContact CA-OG 3.38Å; A228-S231 PolarHBondContact O-OG 3.46Å; L229-S231 VanDerWaalsContact C-N 3.34Å; L229-S231 PolarHBondContact O-N 2.95Å; S231-V233 VanDerWaalsContact C-N 3.3Å; S231-V233 PolarHBondContact O-N 2.83Å; S231-P235 VanDerWaalsContact O-CA 3.25Å; S231-P235 WeakPolarHBondContact O-CA 3.43Å; S231-P235 WeakPolarHBondContact O-CB 3.39Å; S231-P235 WeakPolarHBondContact O-CD 3.28Å
232S92.4Very high93.4Very high26 Ų2631.5 Ų31.518%0.18219%0.19CC..Hα-helixtrans-64.8-32.5176.278.10000113.3A228 L229 F230 W312A228-S232 PolarHBondContact O-N 3.03Å; L229-S232 WeakPolarHBondContact O-CB 3.37Å; L229-S232 PolarHBondContact O-N 3.22Å; L229-S232 VanDerWaalsContact O-N 3.07Å; L229-S232 PolarHBondContact O-OG 3.12Å; F230-S232 PolarHBondContact O-N 3.49Å; S232-W312 PolarHBondContact OG-NE1 3.3Å
233V93.1Very high93.4Very high36 Ų3636.2 Ų36.222%0.21821%0.214CC..Hα-helixtrans-94.9-36.6178.5-66.30000112.6F230 S231F230-V233 WeakPolarHBondContact O-CG2 3.46Å; F230-V233 PolarHBondContact O-N 3.25Å; S231-V233 VanDerWaalsContact C-N 3.3Å; S231-V233 PolarHBondContact O-N 2.83Å
234L92.1Very high93.3Very high45 Ų4541.7 Ų41.724%0.23624%0.243CC..  trans-132.967.8-174.9-67.9175.4000111.2F230 G236 F237 T311 Y315F230-L234 HydrophobicContact CE2-CD1 4.13Å; F230-L234 HydrophobicContact CZ-CB 4.37Å; F230-L234 HydrophobicContact CZ-CD1 4.48Å; F230-L234 PolarHBondContact O-N 2.86Å; L234-G236 VanDerWaalsContact C-N 3.28Å; L234-G236 PolarHBondContact O-N 2.8Å; L234-F237 HydrophobicContact CB-CB 4.15Å; L234-F237 HydrophobicContact CB-CD2 3.96Å; L234-F237 HydrophobicContact CB-CG 4.43Å; L234-F237 HydrophobicContact CD1-CD2 4.5Å; L234-F237 HydrophobicContact CD2-CD2 4.07Å; L234-F237 HydrophobicContact CD2-CE2 4.27Å; L234-F237 HydrophobicContact CG-CD2 4.4Å; L234-F237 PolarHBondContact O-N 2.99Å; L234-F237 VanDerWaalsContact O-N 3.08Å; L234-T311 HydrophobicContact CD1-CG2 3.78Å; L234-Y315 HydrophobicContact CD1-CD2 4.47Å
235P87.1Confident93.3Very high50 Ų5042.2 Ų42.233%0.32525%0.246SC..THydrogen-bonded Turntrans-62.6-30.7-172.623.2-33.4000113.6Y160 S231 F237 I238Y160-P235 HydrophobicContact CE2-CB 4.43Å; S231-P235 VanDerWaalsContact O-CA 3.25Å; S231-P235 WeakPolarHBondContact O-CA 3.43Å; S231-P235 WeakPolarHBondContact O-CB 3.39Å; S231-P235 WeakPolarHBondContact O-CD 3.28Å; P235-F237 VanDerWaalsContact C-N 3.32Å; P235-F237 PolarHBondContact O-N 3.43Å; P235-I238 VanDerWaalsContact O-CG2 3.25Å; P235-I238 WeakPolarHBondContact O-CG2 3.48Å
236G84.3Confident93.3Very high62 Ų6244.9 Ų44.964%0.63925%0.251SS*.THydrogen-bonded Turntrans-72.3-22.7177.400000114.2L234L234-G236 VanDerWaalsContact C-N 3.28Å; L234-G236 PolarHBondContact O-N 2.8Å
237F92.3Very high93.2Very high112 Ų11247.2 Ų47.249%0.49127%0.266SS..Hα-helixtrans-89.5-11.3-174.1-73.2-90.3000113.6F230 L234 P235 A239 L240 H241F230-F237 HydrophobicContact CE1-CB 4.12Å; F230-F237 HydrophobicContact CZ-CB 3.84Å; L234-F237 HydrophobicContact CB-CB 4.15Å; L234-F237 HydrophobicContact CB-CD2 3.96Å; L234-F237 HydrophobicContact CB-CG 4.43Å; L234-F237 HydrophobicContact CD1-CD2 4.5Å; L234-F237 HydrophobicContact CD2-CD2 4.07Å; L234-F237 HydrophobicContact CD2-CE2 4.27Å; L234-F237 HydrophobicContact CG-CD2 4.4Å; L234-F237 PolarHBondContact O-N 2.99Å; L234-F237 VanDerWaalsContact O-N 3.08Å; P235-F237 VanDerWaalsContact C-N 3.32Å; P235-F237 PolarHBondContact O-N 3.43Å; F237-A239 VanDerWaalsContact C-N 3.3Å; F237-A239 PolarHBondContact O-N 3.44Å; F237-L240 HydrophobicContact CD1-CD2 3.97Å; F237-L240 HydrophobicContact CE1-CD2 4.34Å; F237-L240 PolarHBondContact O-N 3.15Å; F237-H241 WeakPolarHBondContact O-CB 3.47Å; F237-H241 PolarHBondContact O-N 3.19Å
238I91.4Very high93.2Very high40 Ų4049.8 Ų49.821%0.20529%0.287CS..Hα-helixtrans-63.1-38.3177-169.562.5000111.8L227 F230 P235 H241 F242L227-I238 HydrophobicContact CB-CD1 4.43Å; L227-I238 HydrophobicContact CD2-CD1 3.93Å; F230-I238 HydrophobicContact CD1-CD1 4.03Å; F230-I238 HydrophobicContact CE1-CD1 4.45Å; P235-I238 VanDerWaalsContact O-CG2 3.25Å; P235-I238 WeakPolarHBondContact O-CG2 3.48Å; I238-H241 PolarHBondContact O-N 3.33Å; I238-F242 PolarHBondContact O-N 3.38Å
239A90.9Very high93.1Very high55 Ų5550.2 Ų50.246%0.45529%0.29SS..Hα-helixtrans-65.4-43.5175.800000110.8F237 F242 L243F237-A239 VanDerWaalsContact C-N 3.3Å; F237-A239 PolarHBondContact O-N 3.44Å; A239-F242 PolarHBondContact O-N 2.97Å; A239-L243 WeakPolarHBondContact O-CB 3.42Å; A239-L243 VanDerWaalsContact O-CG 3.22Å; A239-L243 WeakPolarHBondContact O-CG 3.24Å; A239-L243 PolarHBondContact O-N 3.4Å
240L93.3Very high93.1Very high87 Ų8750.6 Ų50.646%0.45529%0.292SS..Hα-helixtrans-61.7-45.6175.6-179.463.2000111.4F237 F242 L243 L244F237-L240 HydrophobicContact CD1-CD2 3.97Å; F237-L240 HydrophobicContact CE1-CD2 4.34Å; F237-L240 PolarHBondContact O-N 3.15Å; L240-F242 PolarHBondContact O-N 3.46Å; L240-L243 PolarHBondContact O-N 2.83Å; L240-L244 HydrophobicContact CD1-CD1 4.24Å; L240-L244 HydrophobicContact CD1-CG 4.25Å; L240-L244 HydrophobicContact CG-CD1 4.03Å; L240-L244 HydrophobicContact CG-CG 4.46Å; L240-L244 VanDerWaalsContact O-CG 3.29Å; L240-L244 WeakPolarHBondContact O-CG 3.29Å; L240-L244 PolarHBondContact O-N 2.84Å
241H95.3Very high93Very high24 Ų2454.7 Ų54.711%0.11131%0.314CS..Hα-helixtrans-56.5-49.8175.717289.8000111.2F230 F237 I238 L243 L244 L245 Y279 D304F230-H241 HydrophobicContact CE1-CB 4.46Å; F237-H241 WeakPolarHBondContact O-CB 3.47Å; F237-H241 PolarHBondContact O-N 3.19Å; I238-H241 PolarHBondContact O-N 3.33Å; H241-L243 PolarHBondContact O-N 3.19Å; H241-L244 PolarHBondContact O-N 3.09Å; H241-L245 WeakPolarHBondContact CE1-CD1 3.41Å; H241-L245 WeakPolarHBondContact ND1-CD1 3.31Å; H241-L245 WeakPolarHBondContact O-CD1 3.07Å; H241-L245 PolarHBondContact O-N 3.48Å; H241-L245 VanDerWaalsContact O-N 3.08Å; H241-Y279 AromaticContact CD2-CE2 3.75Å; H241-Y279 AromaticContact CD2-CZ 3.91Å; H241-Y279 PolarHBondContact CD2-OH 3.23Å; H241-Y279 AromaticContact NE2-CE2 3.72Å; H241-D304 IonicContact CE1-OD1 3.16Å; H241-D304 PolarHBondContact CE1-OD1 2.95Å; H241-D304 IonicContact CE1-OD2 3.2Å; H241-D304 PolarHBondContact CE1-OD2 2.99Å; H241-D304 IonicContact ND1-OD1 3.99Å; H241-D304 IonicContact NE2-OD2 2.75Å; H241-D304 PolarHBondContact NE2-OD2 3.38Å
242F94.4Very high92.9Very high56 Ų5657.2 Ų57.225%0.24632%0.323CS..Hα-helixtrans-59.1-46.8175.1177.3-100.3000112.3I238 A239 L240 L244 L245 W246 L276 Y279I238-F242 PolarHBondContact O-N 3.38Å; A239-F242 PolarHBondContact O-N 2.97Å; L240-F242 PolarHBondContact O-N 3.46Å; F242-L244 PolarHBondContact O-N 2.99Å; F242-L245 PolarHBondContact O-N 3.29Å; F242-W246 HydrophobicContact CD1-CB 4.45Å; F242-W246 HydrophobicContact CD2-CB 4.29Å; F242-W246 HydrophobicContact CE1-CB 4.06Å; F242-W246 HydrophobicContact CE1-CG 4.14Å; F242-W246 HydrophobicContact CE2-CB 3.88Å; F242-W246 HydrophobicContact CE2-CG 4.12Å; F242-W246 HydrophobicContact CZ-CB 3.75Å; F242-W246 AromaticContact CZ-CD1 3.74Å; F242-W246 HydrophobicContact CZ-CD2 4.33Å; F242-W246 AromaticContact CZ-CG 3.66Å; F242-W246 HydrophobicContact CZ-CG 3.66Å; F242-W246 WeakPolarHBondContact O-CB 3.25Å; F242-W246 PolarHBondContact O-N 3.09Å; F242-L276 HydrophobicContact CE2-CD1 3.62Å; F242-L276 HydrophobicContact CZ-CD1 3.8Å; F242-Y279 HydrophobicContact CB-CE2 4.4Å; F242-Y279 HydrophobicContact CD2-CD1 4.06Å; F242-Y279 AromaticContact CD2-CD2 3.93Å; F242-Y279 HydrophobicContact CD2-CD2 3.93Å; F242-Y279 HydrophobicContact CD2-CE1 4.01Å; F242-Y279 AromaticContact CD2-CE2 3.89Å; F242-Y279 HydrophobicContact CD2-CE2 3.89Å; F242-Y279 AromaticContact CD2-CG 4Å; F242-Y279 HydrophobicContact CD2-CG 4Å; F242-Y279 AromaticContact CD2-CZ 3.9Å; F242-Y279 HydrophobicContact CE2-CD1 4.34Å; F242-Y279 HydrophobicContact CE2-CD2 4.47Å; F242-Y279 HydrophobicContact CE2-CG 4.2Å
243L93.6Very high92.8Very high108 Ų10856 Ų5657%0.56531%0.314SS*.Hα-helixtrans-65.3-21.7-179.7-73.4176.4000113.9A239 L240 H241 P247A239-L243 WeakPolarHBondContact O-CB 3.42Å; A239-L243 VanDerWaalsContact O-CG 3.22Å; A239-L243 WeakPolarHBondContact O-CG 3.24Å; A239-L243 PolarHBondContact O-N 3.4Å; L240-L243 PolarHBondContact O-N 2.83Å; H241-L243 PolarHBondContact O-N 3.19Å; L243-P247 WeakPolarHBondContact O-CD 3.25Å; L243-P247 WeakPolarHBondContact O-CG 3.25Å
244L93.9Very high92.7Very high117 Ų11759.8 Ų59.861%0.61333%0.325SS*.Hα-helixtrans-83.8-45.1173.8-71.3170.9000111.8L240 H241 F242L240-L244 HydrophobicContact CD1-CD1 4.24Å; L240-L244 HydrophobicContact CD1-CG 4.25Å; L240-L244 HydrophobicContact CG-CD1 4.03Å; L240-L244 HydrophobicContact CG-CG 4.46Å; L240-L244 VanDerWaalsContact O-CG 3.29Å; L240-L244 WeakPolarHBondContact O-CG 3.29Å; L240-L244 PolarHBondContact O-N 2.84Å; H241-L244 PolarHBondContact O-N 3.09Å; F242-L244 PolarHBondContact O-N 2.99Å
245L95.5Very high92.5Very high15 Ų1567.9 Ų67.98%0.07935%0.352CS..Hα-helixtrans-75.8-42.7-176.9-83.1101.3000112.9H241 F242 A248 L249 Y279 F300H241-L245 WeakPolarHBondContact CE1-CD1 3.41Å; H241-L245 WeakPolarHBondContact ND1-CD1 3.31Å; H241-L245 WeakPolarHBondContact O-CD1 3.07Å; H241-L245 PolarHBondContact O-N 3.48Å; H241-L245 VanDerWaalsContact O-N 3.08Å; F242-L245 PolarHBondContact O-N 3.29Å; L245-A248 WeakPolarHBondContact O-CB 3.17Å; L245-A248 PolarHBondContact O-N 2.96Å; L245-A248 VanDerWaalsContact O-N 3.13Å; L245-L249 WeakPolarHBondContact O-CG 3.21Å; L245-L249 PolarHBondContact O-N 3.19Å; L245-Y279 HydrophobicContact CB-CD2 4.27Å; L245-Y279 HydrophobicContact CB-CE2 4.43Å; L245-F300 HydrophobicContact CD2-CE1 3.56Å; L245-F300 HydrophobicContact CD2-CZ 3.4Å; L245-F300 VanDerWaalsContact CD2-CZ 3.4Å; L245-F300 HydrophobicContact CG-CZ 4.08Å
246W96Very high92.3Very high79 Ų7966.6 Ų66.630%0.29934%0.342SS..Hα-helixtrans-59.8-47.6-173175.878.4000112.8F242 A248 L249 V250 A272F242-W246 HydrophobicContact CD1-CB 4.45Å; F242-W246 HydrophobicContact CD2-CB 4.29Å; F242-W246 HydrophobicContact CE1-CB 4.06Å; F242-W246 HydrophobicContact CE1-CG 4.14Å; F242-W246 HydrophobicContact CE2-CB 3.88Å; F242-W246 HydrophobicContact CE2-CG 4.12Å; F242-W246 HydrophobicContact CZ-CB 3.75Å; F242-W246 AromaticContact CZ-CD1 3.74Å; F242-W246 HydrophobicContact CZ-CD2 4.33Å; F242-W246 AromaticContact CZ-CG 3.66Å; F242-W246 HydrophobicContact CZ-CG 3.66Å; F242-W246 WeakPolarHBondContact O-CB 3.25Å; F242-W246 PolarHBondContact O-N 3.09Å; W246-A248 VanDerWaalsContact C-N 3.3Å; W246-A248 PolarHBondContact O-N 2.67Å; W246-L249 PolarHBondContact O-N 2.82Å; W246-L249 VanDerWaalsContact O-N 3.17Å; W246-V250 HydrophobicContact CD2-CG2 4.03Å; W246-V250 HydrophobicContact CG-CG2 4.38Å; W246-V250 HydrophobicContact CZ2-CG2 3.88Å; W246-V250 WeakPolarHBondContact O-CG2 3.4Å; W246-V250 PolarHBondContact O-N 2.8Å; W246-A272 HydrophobicContact CZ2-CB 3.9Å; W246-A272 PolarHBondContact NE1-O 2.94Å; W246-A272 VanDerWaalsContact NE1-O 3.09Å
247P95.8Very high92Very high48 Ų4866.4 Ų66.431%0.31234%0.34SS..Hα-helixtrans-59.6-40.3175.2-23.735.1000112.4L243 L249 V250 L251L243-P247 WeakPolarHBondContact O-CD 3.25Å; L243-P247 WeakPolarHBondContact O-CG 3.25Å; P247-L249 VanDerWaalsContact C-N 3.33Å; P247-L249 PolarHBondContact O-N 3.35Å; P247-V250 PolarHBondContact O-N 2.75Å; P247-L251 WeakPolarHBondContact O-CB 3.41Å; P247-L251 WeakPolarHBondContact O-CD1 3.37Å; P247-L251 PolarHBondContact O-N 3.13Å
248A94.9Very high91.5Very high55 Ų5561.5 Ų61.546%0.45532%0.32SS..Hα-helixtrans-61.5-41.7177.600000111.9L245 W246 L251 W252L245-A248 WeakPolarHBondContact O-CB 3.17Å; L245-A248 PolarHBondContact O-N 2.96Å; L245-A248 VanDerWaalsContact O-N 3.13Å; W246-A248 VanDerWaalsContact C-N 3.3Å; W246-A248 PolarHBondContact O-N 2.67Å; A248-L251 PolarHBondContact O-N 3.4Å; A248-W252 WeakPolarHBondContact O-CB 3.5Å; A248-W252 PolarHBondContact O-N 3.24Å
249L94.5Very high90.9Very high9 Ų962.7 Ų62.75%0.04734%0.341CS..Hα-helixtrans-66.9-39.6175.4-66.3172.4000112L245 W246 P247 W252 A253 G275 W278 F300L245-L249 WeakPolarHBondContact O-CG 3.21Å; L245-L249 PolarHBondContact O-N 3.19Å; W246-L249 PolarHBondContact O-N 2.82Å; W246-L249 VanDerWaalsContact O-N 3.17Å; P247-L249 VanDerWaalsContact C-N 3.33Å; P247-L249 PolarHBondContact O-N 3.35Å; L249-W252 HydrophobicContact CD2-CE3 4.49Å; L249-W252 WeakPolarHBondContact O-CB 3.41Å; L249-W252 PolarHBondContact O-N 3.08Å; L249-A253 PolarHBondContact O-N 3.26Å; L249-G275 WeakPolarHBondContact CD1-O 3.42Å; L249-W278 HydrophobicContact CB-CE3 4.4Å; L249-W278 HydrophobicContact CD1-CB 4.1Å; L249-W278 HydrophobicContact CD2-CB 4.14Å; L249-W278 HydrophobicContact CD2-CE3 4.46Å; L249-W278 HydrophobicContact CG-CB 4.5Å; L249-F300 HydrophobicContact CD2-CE1 4.35Å
250V94.3Very high90.2Very high14 Ų1460.6 Ų60.69%0.08532%0.322CS..Hα-helixtrans-66.1-42.8175.1173.70000111.4W246 P247 W252 A253 W254W246-V250 HydrophobicContact CD2-CG2 4.03Å; W246-V250 HydrophobicContact CG-CG2 4.38Å; W246-V250 HydrophobicContact CZ2-CG2 3.88Å; W246-V250 WeakPolarHBondContact O-CG2 3.4Å; W246-V250 PolarHBondContact O-N 2.8Å; P247-V250 PolarHBondContact O-N 2.75Å; V250-W252 VanDerWaalsContact C-N 3.26Å; V250-W252 PolarHBondContact O-N 3.36Å; V250-A253 WeakPolarHBondContact O-CB 3.37Å; V250-A253 PolarHBondContact O-N 3.34Å; V250-A253 VanDerWaalsContact O-N 3.16Å; V250-W254 HydrophobicContact CG1-CE3 3.82Å; V250-W254 HydrophobicContact CG1-CZ3 3.85Å; V250-W254 PolarHBondContact O-N 3.26Å
251L93.3Very high89.6Confident104 Ų10457 Ų5755%0.54530%0.303SS..Hα-helixtrans-60.5-40.1173-93.185000110.9P247 A248 A253 W254 R255P247-L251 WeakPolarHBondContact O-CB 3.41Å; P247-L251 WeakPolarHBondContact O-CD1 3.37Å; P247-L251 PolarHBondContact O-N 3.13Å; A248-L251 PolarHBondContact O-N 3.4Å; L251-A253 VanDerWaalsContact C-N 3.34Å; L251-W254 WeakPolarHBondContact O-CB 3.34Å; L251-W254 PolarHBondContact O-N 2.86Å; L251-R255 WeakPolarHBondContact O-CG 3.16Å; L251-R255 PolarHBondContact O-N 3.47Å
252W93.3Very high88.8Confident59 Ų5961.4 Ų61.422%0.22333%0.327CS..Hα-helixtrans-64.4-38.7175.4-17344.7000112.2A248 L249 V250 W254 R255 Q256 W278 W282 R293 Y297A248-W252 WeakPolarHBondContact O-CB 3.5Å; A248-W252 PolarHBondContact O-N 3.24Å; L249-W252 HydrophobicContact CD2-CE3 4.49Å; L249-W252 WeakPolarHBondContact O-CB 3.41Å; L249-W252 PolarHBondContact O-N 3.08Å; V250-W252 VanDerWaalsContact C-N 3.26Å; V250-W252 PolarHBondContact O-N 3.36Å; W252-W254 VanDerWaalsContact C-N 3.34Å; W252-R255 PolarHBondContact O-N 3.22Å; W252-Q256 WeakPolarHBondContact O-CG 3.39Å; W252-Q256 PolarHBondContact O-N 3.47Å; W252-W278 HydrophobicContact CB-CZ3 4.3Å; W252-W278 HydrophobicContact CD2-CE3 4.36Å; W252-W278 HydrophobicContact CD2-CH2 4.21Å; W252-W278 AromaticContact CD2-CZ3 3.79Å; W252-W278 HydrophobicContact CD2-CZ3 3.79Å; W252-W278 HydrophobicContact CE3-CD2 4.01Å; W252-W278 AromaticContact CE3-CE3 3.34Å; W252-W278 HydrophobicContact CE3-CE3 3.34Å; W252-W278 AromaticContact CE3-CH2 3.71Å; W252-W278 HydrophobicContact CE3-CH2 3.71Å; W252-W278 HydrophobicContact CE3-CZ2 4.29Å; W252-W278 AromaticContact CE3-CZ3 3.16Å; W252-W278 HydrophobicContact CE3-CZ3 3.16Å; W252-W278 HydrophobicContact CG-CZ3 4.28Å; W252-W278 AromaticContact CZ3-CD2 3.91Å; W252-W278 HydrophobicContact CZ3-CD2 3.91Å; W252-W278 AromaticContact CZ3-CE3 3.73Å; W252-W278 HydrophobicContact CZ3-CE3 3.73Å; W252-W278 AromaticContact CZ3-CH2 3.94Å; W252-W278 HydrophobicContact CZ3-CH2 3.94Å; W252-W278 HydrophobicContact CZ3-CZ2 4.06Å; W252-W278 AromaticContact CZ3-CZ3 3.75Å; W252-W278 HydrophobicContact CZ3-CZ3 3.75Å; W252-W282 AromaticContact CH2-CH2 3.89Å; W252-W282 HydrophobicContact CH2-CH2 3.89Å; W252-W282 AromaticContact CH2-CZ3 3.48Å; W252-W282 HydrophobicContact CH2-CZ3 3.48Å; W252-W282 VanDerWaalsContact CH2-CZ3 3.48Å; W252-W282 AromaticContact CZ3-CZ3 3.8Å; W252-W282 HydrophobicContact CZ3-CZ3 3.8Å; W252-R293 HydrophobicContact CZ2-CB 4.23Å; W252-Y297 HydrophobicContact CZ3-CD2 4.04Å
253A89.8Confident88.4Confident0 Ų060.5 Ų60.50%033%0.328CS..Hα-helixtrans-64-40.9173.900000111.1L249 V250 L251 R255 Q256 R271 V274 W278L249-A253 PolarHBondContact O-N 3.26Å; V250-A253 WeakPolarHBondContact O-CB 3.37Å; V250-A253 PolarHBondContact O-N 3.34Å; V250-A253 VanDerWaalsContact O-N 3.16Å; L251-A253 VanDerWaalsContact C-N 3.34Å; A253-R255 VanDerWaalsContact C-N 3.34Å; A253-R255 PolarHBondContact O-N 3.42Å; A253-Q256 PolarHBondContact O-N 3.08Å; A253-Q256 VanDerWaalsContact O-N 3.09Å; A253-R271 HydrophobicContact CB-CB 4.27Å; A253-R271 HydrophobicContact CB-CG 4.46Å; A253-V274 HydrophobicContact CB-CG1 4.03Å; A253-W278 HydrophobicContact CB-CH2 4.04Å; A253-W278 HydrophobicContact CB-CZ3 3.67Å
254W89.8Confident88.1Confident117 Ų11759 Ų5944%0.44333%0.332SS..Hα-helixtrans-59.6-43.4176.1-129.2-84.9000112.8V250 L251 W252 Q256 G257 R268 R271V250-W254 HydrophobicContact CG1-CE3 3.82Å; V250-W254 HydrophobicContact CG1-CZ3 3.85Å; V250-W254 PolarHBondContact O-N 3.26Å; L251-W254 WeakPolarHBondContact O-CB 3.34Å; L251-W254 PolarHBondContact O-N 2.86Å; W252-W254 VanDerWaalsContact C-N 3.34Å; W254-Q256 PolarHBondContact O-N 2.94Å; W254-G257 PolarHBondContact O-N 3.39Å; W254-R268 HydrophobicContact CH2-CB 3.94Å; W254-R268 HydrophobicContact CH2-CG 3.53Å; W254-R268 HydrophobicContact CZ2-CG 3.74Å; W254-R271 HydrophobicContact CE3-CB 3.9Å; W254-R271 HydrophobicContact CE3-CG 4.4Å; W254-R271 HydrophobicContact CZ3-CB 4Å; W254-R271 VanDerWaalsContact NE1-NH1 3.19Å
255R88.8Confident87.7Confident214 Ų21454.8 Ų54.881%0.80832%0.316SS*.Hα-helixtrans-66.6-19.7177.6-71.6-174.5-176.8-179.32.4113.3L251 W252 A253 G257L251-R255 WeakPolarHBondContact O-CG 3.16Å; L251-R255 PolarHBondContact O-N 3.47Å; W252-R255 PolarHBondContact O-N 3.22Å; A253-R255 VanDerWaalsContact C-N 3.34Å; A253-R255 PolarHBondContact O-N 3.42Å; R255-G257 VanDerWaalsContact C-N 3.32Å
256Q83.6Confident87.2Confident23 Ų2354 Ų5411%0.10731%0.312CS..THydrogen-bonded Turntrans-83.1-7177.7-71.1-173.355.500113.6W252 A253 W254 A286W252-Q256 WeakPolarHBondContact O-CG 3.39Å; W252-Q256 PolarHBondContact O-N 3.47Å; A253-Q256 PolarHBondContact O-N 3.08Å; A253-Q256 VanDerWaalsContact O-N 3.09Å; W254-Q256 PolarHBondContact O-N 2.94Å; Q256-A286 HydrophobicContact CB-CB 3.93Å
257G77.3Confident86.9Confident58 Ų5851 Ų5160%0.59830%0.301SS*.THydrogen-bonded Turntrans62.651.9169.900000113.4W254 R255W254-G257 PolarHBondContact O-N 3.39Å; R255-G257 VanDerWaalsContact C-N 3.32Å
258T81.6Confident86.7Confident10 Ų1055.9 Ų55.96%0.06131%0.313CS..  trans-72.2147.8-178.157.60000111.5E267 Y270 R271 V285T258-E267 VanDerWaalsContact CB-OE1 3.22Å; T258-E267 WeakPolarHBondContact CB-OE1 3.35Å; T258-E267 PolarHBondContact OG1-OE1 3.31Å; T258-Y270 HydrophobicContact CG2-CE1 4.39Å; T258-R271 PolarHBondContact O-NH2 3.45Å; T258-R271 WeakPolarHBondContact OG1-CG 3.3Å; T258-R271 PolarHBondContact OG1-NE 3.3Å; T258-V285 HydrophobicContact CG2-CB 4.27Å; T258-V285 HydrophobicContact CG2-CG1 3.33Å
259G78.3Confident86.6Confident64 Ų6454.4 Ų54.466%0.6630%0.298SS*.  trans-139.567178.500000110.7
260F76.4Confident86.4Confident11 Ų1154.1 Ų54.15%0.04830%0.296CS..  trans-96.7-35.9-177.5179.1-109.9000111.9W68 M141 E267 Y270 R390 H394W68-F260 AromaticContact CZ2-CE1 3.92Å; W68-F260 HydrophobicContact CZ2-CE1 3.92Å; W68-F260 HydrophobicContact CZ2-CZ 4.03Å; M141-F260 HydrophobicContact CE-CE1 4.46Å; M141-F260 HydrophobicContact CE-CZ 4.27Å; M141-F260 HydrophobicContact CG-CZ 4.39Å; F260-E267 PolarHBondContact N-OE2 2.91Å; F260-Y270 HydrophobicContact CB-CD1 3.81Å; F260-Y270 HydrophobicContact CB-CD2 4.2Å; F260-Y270 HydrophobicContact CB-CE1 3.63Å; F260-Y270 HydrophobicContact CB-CE2 4Å; F260-Y270 HydrophobicContact CB-CG 4.07Å; F260-Y270 HydrophobicContact CD1-CD1 4.4Å; F260-Y270 AromaticContact CD1-CD2 3.28Å; F260-Y270 HydrophobicContact CD1-CD2 3.28Å; F260-Y270 HydrophobicContact CD1-CE1 4.49Å; F260-Y270 AromaticContact CD1-CE2 3.37Å; F260-Y270 HydrophobicContact CD1-CE2 3.37Å; F260-Y270 AromaticContact CD1-CG 3.8Å; F260-Y270 HydrophobicContact CD1-CG 3.8Å; F260-Y270 AromaticContact CD1-CZ 3.99Å; F260-Y270 HydrophobicContact CD2-CE2 4.36Å; F260-Y270 AromaticContact CE1-CD2 3.87Å; F260-Y270 HydrophobicContact CE1-CD2 3.87Å; F260-Y270 AromaticContact CE1-CE2 3.88Å; F260-Y270 HydrophobicContact CE1-CE2 3.88Å; F260-Y270 HydrophobicContact CG-CD1 4.46Å; F260-Y270 AromaticContact CG-CD2 3.95Å; F260-Y270 HydrophobicContact CG-CD2 3.95Å; F260-Y270 HydrophobicContact CG-CE1 4.24Å; F260-Y270 AromaticContact CG-CE2 3.66Å; F260-Y270 HydrophobicContact CG-CE2 3.66Å; F260-Y270 HydrophobicContact CG-CG 4.3Å; F260-Y270 AromaticContact CG-CZ 3.79Å; F260-R390 HydrophobicContact CD2-CB 4.09Å; F260-R390 HydrophobicContact CE2-CB 3.59Å; F260-R390 HydrophobicContact CZ-CB 4.16Å; F260-H394 AromaticContact CD2-CD2 3.61Å; F260-H394 AromaticContact CD2-NE2 3.68Å; F260-H394 AromaticContact CE2-CD2 3.51Å; F260-H394 AromaticContact CE2-NE2 3.81Å
261M80.4Confident86.3Confident13 Ų1355.2 Ų55.26%0.06430%0.298CS..SBendtrans-106.5142.9-178.3-62.7-75.980.800111.7F64 W68 Y71 S263 G266 E267F64-M261 HydrophobicContact CD1-SD 4.3Å; F64-M261 HydrophobicContact CE1-SD 4.45Å; W68-M261 PolarHBondContact NE1-SD 3.48Å; Y71-M261 HydrophobicContact CE2-CB 4.49Å; Y71-M261 HydrophobicContact CE2-CE 4.34Å; Y71-M261 HydrophobicContact CE2-SD 4.01Å; M261-S263 PolarHBondContact O-N 3.49Å; M261-G266 VanDerWaalsContact CG-C 3.46Å; M261-G266 WeakPolarHBondContact CG-O 3.35Å; M261-E267 HydrophobicContact CB-CB 4.29Å; M261-E267 PolarHBondContact N-OE2 3.19Å
262D78.6Confident86.4Confident116 Ų11651.4 Ų51.462%0.6228%0.282SS*.SBendtrans-72.5-28.9-177.9-54.2-45.1000112.3Y71 R390Y71-D262 HydrophobicContact CD1-CB 3.99Å; Y71-D262 HydrophobicContact CD2-CB 4.49Å; Y71-D262 WeakPolarHBondContact CD2-OD2 3.35Å; Y71-D262 HydrophobicContact CE1-CB 3.87Å; Y71-D262 HydrophobicContact CE2-CB 4.37Å; Y71-D262 HydrophobicContact CG-CB 4.32Å; D262-R390 IonicContact OD2-NH2 2.67Å
263S86.4Confident86.4Confident36 Ų3649 Ų4925%0.25227%0.274SS..SBendtrans-97146.6175.978.60000113.6Y71 M261 G265 G266 E267Y71-S263 VanDerWaalsContact OH-CB 3.24Å; Y71-S263 WeakPolarHBondContact OH-CB 3.29Å; Y71-S263 PolarHBondContact OH-N 2.76Å; Y71-S263 VanDerWaalsContact OH-N 3.11Å; Y71-S263 PolarHBondContact OH-OG 2.87Å; M261-S263 PolarHBondContact O-N 3.49Å; S263-G265 PolarHBondContact O-N 3.21Å; S263-G266 PolarHBondContact O-N 2.92Å; S263-G266 PolarHBondContact OG-N 3.48Å; S263-E267 PolarHBondContact O-N 3.49Å
264A86.6Confident86.5Confident78 Ų7849 Ų4965%0.64527%0.274SS*.Hα-helixtrans-61.3-29.3173.400000113R268A264-R268 VanDerWaalsContact O-CG 3.26Å; A264-R268 WeakPolarHBondContact O-CG 3.25Å; A264-R268 PolarHBondContact O-N 3.48Å; A264-R268 PolarHBondContact O-NE 3.47Å
265G86.8Confident86.7Confident27 Ų2743.5 Ų43.528%0.27825%0.253SS..Hα-helixtrans-67.8-49.5173.800000112S263 E267 R268 L269S263-G265 PolarHBondContact O-N 3.21Å; G265-E267 VanDerWaalsContact C-N 3.34Å; G265-E267 PolarHBondContact O-N 3.11Å; G265-R268 PolarHBondContact O-N 3.41Å; G265-L269 PolarHBondContact O-N 3.14Å
266G85.5Confident87Confident0 Ų034.7 Ų34.70%022%0.222CC..Hα-helixtrans-61.5-40.917700000112.3M261 S263 R268 L269 Y270M261-G266 VanDerWaalsContact CG-C 3.46Å; M261-G266 WeakPolarHBondContact CG-O 3.35Å; S263-G266 PolarHBondContact O-N 2.92Å; S263-G266 PolarHBondContact OG-N 3.48Å; G266-R268 VanDerWaalsContact C-N 3.32Å; G266-R268 PolarHBondContact O-N 3.23Å; G266-L269 WeakPolarHBondContact O-CB 3.48Å; G266-L269 PolarHBondContact O-N 2.91Å; G266-L269 VanDerWaalsContact O-N 3.17Å; G266-Y270 WeakPolarHBondContact O-CB 3.48Å; G266-Y270 PolarHBondContact O-N 3.37Å
267E89.8Confident87.5Confident14 Ų1433.7 Ų33.77%0.06522%0.218CC..Hα-helixtrans-66.6-35.1-178.5-17157.3-144.400112.1T258 F260 M261 S263 G265 Y270 R271T258-E267 VanDerWaalsContact CB-OE1 3.22Å; T258-E267 WeakPolarHBondContact CB-OE1 3.35Å; T258-E267 PolarHBondContact OG1-OE1 3.31Å; F260-E267 PolarHBondContact N-OE2 2.91Å; M261-E267 HydrophobicContact CB-CB 4.29Å; M261-E267 PolarHBondContact N-OE2 3.19Å; S263-E267 PolarHBondContact O-N 3.49Å; G265-E267 VanDerWaalsContact C-N 3.34Å; G265-E267 PolarHBondContact O-N 3.11Å; E267-Y270 PolarHBondContact O-N 3.09Å; E267-R271 WeakPolarHBondContact O-CG 3.37Å; E267-R271 PolarHBondContact O-N 3.39Å; E267-R271 IonicContact OE1-CZ 2.77Å; E267-R271 IonicContact OE1-NE 3.84Å; E267-R271 PolarHBondContact OE1-NE 2.93Å; E267-R271 IonicContact OE1-NH2 3.99Å
268R91.3Very high88.3Confident151 Ų15131.1 Ų31.157%0.5719%0.19SC*.Hα-helixtrans-64.1-43.6172.1-69.6-174.5-71178.9-0111.7W254 A264 G265 G266 R271 A272W254-R268 HydrophobicContact CH2-CB 3.94Å; W254-R268 HydrophobicContact CH2-CG 3.53Å; W254-R268 HydrophobicContact CZ2-CG 3.74Å; A264-R268 VanDerWaalsContact O-CG 3.26Å; A264-R268 WeakPolarHBondContact O-CG 3.25Å; A264-R268 PolarHBondContact O-N 3.48Å; A264-R268 PolarHBondContact O-NE 3.47Å; G265-R268 PolarHBondContact O-N 3.41Å; G266-R268 VanDerWaalsContact C-N 3.32Å; G266-R268 PolarHBondContact O-N 3.23Å; R268-R271 PolarHBondContact O-N 3.47Å; R268-A272 WeakPolarHBondContact O-CB 3.28Å; R268-A272 PolarHBondContact O-N 3.13Å
269L92.1Very high89Confident25 Ų2531.1 Ų31.113%0.13119%0.189CC..Hα-helixtrans-60.8-45.8174.617868000110.8M63 F64 F67 G265 G266 R271 A272 T273M63-L269 HydrophobicContact CB-CD2 3.69Å; M63-L269 HydrophobicContact CE-CD1 4.4Å; M63-L269 HydrophobicContact CE-CD2 4.16Å; M63-L269 HydrophobicContact SD-CD1 4.49Å; F64-L269 HydrophobicContact CD1-CD2 4.34Å; F64-L269 HydrophobicContact CD2-CD2 3.98Å; F64-L269 HydrophobicContact CD2-CG 4.46Å; F64-L269 HydrophobicContact CE1-CD2 4.22Å; F64-L269 HydrophobicContact CE1-CG 4.32Å; F64-L269 HydrophobicContact CE2-CD1 4.48Å; F64-L269 HydrophobicContact CE2-CD2 3.84Å; F64-L269 HydrophobicContact CE2-CG 3.82Å; F64-L269 HydrophobicContact CG-CD2 4.22Å; F64-L269 HydrophobicContact CZ-CD2 3.97Å; F64-L269 HydrophobicContact CZ-CG 3.74Å; F67-L269 HydrophobicContact CD2-CD2 4.27Å; F67-L269 HydrophobicContact CE2-CD2 4.16Å; G265-L269 PolarHBondContact O-N 3.14Å; G266-L269 WeakPolarHBondContact O-CB 3.48Å; G266-L269 PolarHBondContact O-N 2.91Å; G266-L269 VanDerWaalsContact O-N 3.17Å; L269-R271 PolarHBondContact O-N 3.46Å; L269-A272 WeakPolarHBondContact O-CB 3.44Å; L269-A272 PolarHBondContact O-N 3.08Å; L269-T273 PolarHBondContact O-N 3.22Å; L269-T273 PolarHBondContact O-OG1 3.39Å; L269-T273 VanDerWaalsContact O-OG1 3.06Å
270Y90.3Very high89.7Confident3 Ų328.5 Ų28.51%0.01216%0.159CC..Hα-helixtrans-58-48.5177.5176.5-105.3000112.8F64 M141 T258 F260 G266 E267 A272 T273 V274 V285 H394F64-Y270 HydrophobicContact CE1-CD2 4.34Å; M141-Y270 HydrophobicContact CE-CE2 4.03Å; T258-Y270 HydrophobicContact CG2-CE1 4.39Å; F260-Y270 HydrophobicContact CB-CD1 3.81Å; F260-Y270 HydrophobicContact CB-CD2 4.2Å; F260-Y270 HydrophobicContact CB-CE1 3.63Å; F260-Y270 HydrophobicContact CB-CE2 4Å; F260-Y270 HydrophobicContact CB-CG 4.07Å; F260-Y270 HydrophobicContact CD1-CD1 4.4Å; F260-Y270 AromaticContact CD1-CD2 3.28Å; F260-Y270 HydrophobicContact CD1-CD2 3.28Å; F260-Y270 HydrophobicContact CD1-CE1 4.49Å; F260-Y270 AromaticContact CD1-CE2 3.37Å; F260-Y270 HydrophobicContact CD1-CE2 3.37Å; F260-Y270 AromaticContact CD1-CG 3.8Å; F260-Y270 HydrophobicContact CD1-CG 3.8Å; F260-Y270 AromaticContact CD1-CZ 3.99Å; F260-Y270 HydrophobicContact CD2-CE2 4.36Å; F260-Y270 AromaticContact CE1-CD2 3.87Å; F260-Y270 HydrophobicContact CE1-CD2 3.87Å; F260-Y270 AromaticContact CE1-CE2 3.88Å; F260-Y270 HydrophobicContact CE1-CE2 3.88Å; F260-Y270 HydrophobicContact CG-CD1 4.46Å; F260-Y270 AromaticContact CG-CD2 3.95Å; F260-Y270 HydrophobicContact CG-CD2 3.95Å; F260-Y270 HydrophobicContact CG-CE1 4.24Å; F260-Y270 AromaticContact CG-CE2 3.66Å; F260-Y270 HydrophobicContact CG-CE2 3.66Å; F260-Y270 HydrophobicContact CG-CG 4.3Å; F260-Y270 AromaticContact CG-CZ 3.79Å; G266-Y270 WeakPolarHBondContact O-CB 3.48Å; G266-Y270 PolarHBondContact O-N 3.37Å; E267-Y270 PolarHBondContact O-N 3.09Å; Y270-A272 VanDerWaalsContact C-N 3.32Å; Y270-A272 PolarHBondContact O-N 3.36Å; Y270-T273 PolarHBondContact O-N 2.87Å; Y270-V274 HydrophobicContact CD1-CG2 4.28Å; Y270-V274 HydrophobicContact CD2-CG2 4.38Å; Y270-V274 HydrophobicContact CE1-CG2 3.88Å; Y270-V274 HydrophobicContact CE2-CG2 4.02Å; Y270-V274 WeakPolarHBondContact O-CG2 3.48Å; Y270-V274 PolarHBondContact O-N 2.84Å; Y270-V285 HydrophobicContact CE1-CG1 3.53Å; Y270-V285 VanDerWaalsContact OH-CG1 3.23Å; Y270-V285 WeakPolarHBondContact OH-CG1 3.49Å; Y270-H394 AromaticContact CZ-NE2 3.76Å; Y270-H394 PolarHBondContact OH-CE1 3.02Å; Y270-H394 PolarHBondContact OH-NE2 2.97Å
271R93.4Very high90.5Very high36 Ų3628.2 Ų28.214%0.13616%0.159CC..Hα-helixtrans-62.8-38177-69.9171.7-176.1170.87.4112.5A253 W254 T258 E267 R268 L269 V274 G275A253-R271 HydrophobicContact CB-CB 4.27Å; A253-R271 HydrophobicContact CB-CG 4.46Å; W254-R271 HydrophobicContact CE3-CB 3.9Å; W254-R271 HydrophobicContact CE3-CG 4.4Å; W254-R271 HydrophobicContact CZ3-CB 4Å; W254-R271 VanDerWaalsContact NE1-NH1 3.19Å; T258-R271 PolarHBondContact O-NH2 3.45Å; T258-R271 WeakPolarHBondContact OG1-CG 3.3Å; T258-R271 PolarHBondContact OG1-NE 3.3Å; E267-R271 WeakPolarHBondContact O-CG 3.37Å; E267-R271 PolarHBondContact O-N 3.39Å; E267-R271 IonicContact OE1-CZ 2.77Å; E267-R271 IonicContact OE1-NE 3.84Å; E267-R271 PolarHBondContact OE1-NE 2.93Å; E267-R271 IonicContact OE1-NH2 3.99Å; R268-R271 PolarHBondContact O-N 3.47Å; L269-R271 PolarHBondContact O-N 3.46Å; R271-V274 PolarHBondContact O-N 3.21Å; R271-G275 PolarHBondContact O-N 3.29Å
272A94.4Very high90.9Very high25 Ų2528.7 Ų28.721%0.20716%0.16CC..Hα-helixtrans-61.7-46.1173.800000111.9W246 R268 L269 Y270 G275 L276W246-A272 HydrophobicContact CZ2-CB 3.9Å; W246-A272 PolarHBondContact NE1-O 2.94Å; W246-A272 VanDerWaalsContact NE1-O 3.09Å; R268-A272 WeakPolarHBondContact O-CB 3.28Å; R268-A272 PolarHBondContact O-N 3.13Å; L269-A272 WeakPolarHBondContact O-CB 3.44Å; L269-A272 PolarHBondContact O-N 3.08Å; Y270-A272 VanDerWaalsContact C-N 3.32Å; Y270-A272 PolarHBondContact O-N 3.36Å; A272-G275 PolarHBondContact O-N 3.29Å; A272-L276 PolarHBondContact O-N 2.96Å; A272-L276 VanDerWaalsContact O-N 3.13Å
273T93.2Very high91.1Very high8 Ų823.9 Ų23.95%0.04913%0.133CC..Hα-helixtrans-66.9-39.4176.6-58.40000112.2F64 I145 L269 Y270 G275 L276 I277F64-T273 HydrophobicContact CE2-CG2 4.12Å; F64-T273 WeakPolarHBondContact CE2-OG1 3.39Å; F64-T273 HydrophobicContact CZ-CG2 4.29Å; F64-T273 WeakPolarHBondContact CZ-OG1 3.42Å; I145-T273 HydrophobicContact CB-CG2 4.34Å; I145-T273 HydrophobicContact CG1-CG2 3.97Å; I145-T273 HydrophobicContact CG2-CG2 3.72Å; L269-T273 PolarHBondContact O-N 3.22Å; L269-T273 PolarHBondContact O-OG1 3.39Å; L269-T273 VanDerWaalsContact O-OG1 3.06Å; Y270-T273 PolarHBondContact O-N 2.87Å; T273-G275 VanDerWaalsContact C-N 3.32Å; T273-G275 PolarHBondContact O-N 2.89Å; T273-L276 CarbonylContact O-C 3.6Å; T273-L276 WeakPolarHBondContact O-CA 3.33Å; T273-L276 WeakPolarHBondContact O-CB 3.32Å; T273-L276 PolarHBondContact O-N 3.4Å; T273-L276 VanDerWaalsContact O-N 3.12Å; T273-I277 HydrophobicContact CG2-CD1 4.21Å; T273-I277 WeakPolarHBondContact O-CG1 3.28Å; T273-I277 PolarHBondContact O-N 3.46Å
274V92.4Very high90.8Very high1 Ų123 Ų231%0.00613%0.125CC..Hα-helixtrans-59.3-44.2173162.50000111.1A253 Y270 R271 L276 I277 W278 V285A253-V274 HydrophobicContact CB-CG1 4.03Å; Y270-V274 HydrophobicContact CD1-CG2 4.28Å; Y270-V274 HydrophobicContact CD2-CG2 4.38Å; Y270-V274 HydrophobicContact CE1-CG2 3.88Å; Y270-V274 HydrophobicContact CE2-CG2 4.02Å; Y270-V274 WeakPolarHBondContact O-CG2 3.48Å; Y270-V274 PolarHBondContact O-N 2.84Å; R271-V274 PolarHBondContact O-N 3.21Å; V274-L276 PolarHBondContact O-N 3.24Å; V274-I277 PolarHBondContact O-N 2.79Å; V274-W278 HydrophobicContact CG1-CD2 3.82Å; V274-W278 HydrophobicContact CG1-CE3 3.94Å; V274-W278 HydrophobicContact CG1-CG 4.46Å; V274-W278 HydrophobicContact CG1-CH2 3.83Å; V274-W278 HydrophobicContact CG1-CZ2 3.74Å; V274-W278 HydrophobicContact CG1-CZ3 3.95Å; V274-W278 WeakPolarHBondContact O-CB 3.46Å; V274-W278 PolarHBondContact O-N 3.37Å; V274-V285 HydrophobicContact CB-CG2 4.49Å; V274-V285 HydrophobicContact CG1-CG1 4.31Å; V274-V285 HydrophobicContact CG1-CG2 3.69Å; V274-V285 HydrophobicContact CG2-CG1 3.85Å; V274-V285 HydrophobicContact CG2-CG2 3.93Å
275G94.2Very high90Very high0 Ų019.4 Ų19.40%010%0.096CC..Hα-helixtrans-59.7-36.9175.300000112.5L249 R271 A272 T273 Y279L249-G275 WeakPolarHBondContact CD1-O 3.42Å; R271-G275 PolarHBondContact O-N 3.29Å; A272-G275 PolarHBondContact O-N 3.29Å; T273-G275 VanDerWaalsContact C-N 3.32Å; T273-G275 PolarHBondContact O-N 2.89Å; G275-Y279 PolarHBondContact O-N 3.44Å
276L94.9Very high88.7Confident29 Ų2918.3 Ų18.315%0.1528%0.084CC..Hα-helixtrans-68.3-43.5173.6177.663000112.2C149 F242 A272 T273 V274 W278 Y279 F280C149-L276 HydrophobicContact CB-CD2 4.27Å; C149-L276 VanDerWaalsContact SG-CD2 3.53Å; F242-L276 HydrophobicContact CE2-CD1 3.62Å; F242-L276 HydrophobicContact CZ-CD1 3.8Å; A272-L276 PolarHBondContact O-N 2.96Å; A272-L276 VanDerWaalsContact O-N 3.13Å; T273-L276 CarbonylContact O-C 3.6Å; T273-L276 WeakPolarHBondContact O-CA 3.33Å; T273-L276 WeakPolarHBondContact O-CB 3.32Å; T273-L276 PolarHBondContact O-N 3.4Å; T273-L276 VanDerWaalsContact O-N 3.12Å; V274-L276 PolarHBondContact O-N 3.24Å; L276-W278 VanDerWaalsContact C-N 3.33Å; L276-W278 PolarHBondContact O-N 3.46Å; L276-Y279 VanDerWaalsContact O-CB 3.28Å; L276-Y279 WeakPolarHBondContact O-CB 3.39Å; L276-Y279 PolarHBondContact O-N 3.31Å; L276-Y279 VanDerWaalsContact O-N 3.11Å; L276-F280 HydrophobicContact CD1-CE2 4.31Å
277I93.6Very high87.2Confident3 Ų323.4 Ų23.42%0.01511%0.108CC..Hα-helixtrans-60.3-45.8175.1-65.1167.5000109.8F148 T273 V274 Y279 F280 S281 F283F148-I277 HydrophobicContact CB-CG1 3.85Å; F148-I277 HydrophobicContact CD2-CB 4.35Å; F148-I277 HydrophobicContact CD2-CD1 4.47Å; F148-I277 HydrophobicContact CD2-CG1 3.82Å; F148-I277 HydrophobicContact CD2-CG2 3.89Å; F148-I277 HydrophobicContact CE2-CG2 3.93Å; F148-I277 HydrophobicContact CG-CB 4.38Å; F148-I277 HydrophobicContact CG-CG1 3.96Å; F148-I277 HydrophobicContact CG-CG2 4.23Å; F148-I277 HydrophobicContact CZ-CG2 4.31Å; T273-I277 HydrophobicContact CG2-CD1 4.21Å; T273-I277 WeakPolarHBondContact O-CG1 3.28Å; T273-I277 PolarHBondContact O-N 3.46Å; V274-I277 PolarHBondContact O-N 2.79Å; I277-Y279 PolarHBondContact O-N 2.91Å; I277-F280 PolarHBondContact O-N 3.36Å; I277-S281 CarbonylContact C-O 3.58Å; I277-S281 PolarHBondContact O-N 2.9Å; I277-F283 HydrophobicContact CG2-CB 3.64Å; I277-F283 HydrophobicContact CG2-CG 4.18Å
278W94.7Very high85.6Confident3 Ų325.2 Ų25.21%0.01113%0.13CC..Hα-helixtrans-63.5-15.8176.1-77.2-10.6000114.6L249 W252 A253 V274 L276 F280 S281 F283 V285 Y297L249-W278 HydrophobicContact CB-CE3 4.4Å; L249-W278 HydrophobicContact CD1-CB 4.1Å; L249-W278 HydrophobicContact CD2-CB 4.14Å; L249-W278 HydrophobicContact CD2-CE3 4.46Å; L249-W278 HydrophobicContact CG-CB 4.5Å; W252-W278 HydrophobicContact CB-CZ3 4.3Å; W252-W278 HydrophobicContact CD2-CE3 4.36Å; W252-W278 HydrophobicContact CD2-CH2 4.21Å; W252-W278 AromaticContact CD2-CZ3 3.79Å; W252-W278 HydrophobicContact CD2-CZ3 3.79Å; W252-W278 HydrophobicContact CE3-CD2 4.01Å; W252-W278 AromaticContact CE3-CE3 3.34Å; W252-W278 HydrophobicContact CE3-CE3 3.34Å; W252-W278 AromaticContact CE3-CH2 3.71Å; W252-W278 HydrophobicContact CE3-CH2 3.71Å; W252-W278 HydrophobicContact CE3-CZ2 4.29Å; W252-W278 AromaticContact CE3-CZ3 3.16Å; W252-W278 HydrophobicContact CE3-CZ3 3.16Å; W252-W278 HydrophobicContact CG-CZ3 4.28Å; W252-W278 AromaticContact CZ3-CD2 3.91Å; W252-W278 HydrophobicContact CZ3-CD2 3.91Å; W252-W278 AromaticContact CZ3-CE3 3.73Å; W252-W278 HydrophobicContact CZ3-CE3 3.73Å; W252-W278 AromaticContact CZ3-CH2 3.94Å; W252-W278 HydrophobicContact CZ3-CH2 3.94Å; W252-W278 HydrophobicContact CZ3-CZ2 4.06Å; W252-W278 AromaticContact CZ3-CZ3 3.75Å; W252-W278 HydrophobicContact CZ3-CZ3 3.75Å; A253-W278 HydrophobicContact CB-CH2 4.04Å; A253-W278 HydrophobicContact CB-CZ3 3.67Å; V274-W278 HydrophobicContact CG1-CD2 3.82Å; V274-W278 HydrophobicContact CG1-CE3 3.94Å; V274-W278 HydrophobicContact CG1-CG 4.46Å; V274-W278 HydrophobicContact CG1-CH2 3.83Å; V274-W278 HydrophobicContact CG1-CZ2 3.74Å; V274-W278 HydrophobicContact CG1-CZ3 3.95Å; V274-W278 WeakPolarHBondContact O-CB 3.46Å; V274-W278 PolarHBondContact O-N 3.37Å; L276-W278 VanDerWaalsContact C-N 3.33Å; L276-W278 PolarHBondContact O-N 3.46Å; W278-F280 PolarHBondContact O-N 2.9Å; W278-S281 WeakPolarHBondContact CA-O 3.42Å; W278-F283 PolarHBondContact NE1-O 2.85Å; W278-V285 HydrophobicContact CZ2-CB 4.37Å; W278-V285 HydrophobicContact CZ2-CG2 3.85Å; W278-Y297 HydrophobicContact CB-CE2 3.87Å; W278-Y297 HydrophobicContact CG-CE2 4.09Å; W278-Y297 WeakPolarHBondContact O-CE2 3.26Å; W278-Y297 PolarHBondContact O-OH 3.25Å
279Y95.1Very high84Confident10 Ų1028.4 Ų28.44%0.03914%0.143CC..Hα-helixtrans-69.9-27.5171.2179.1-98.6000112R223 L227 H241 F242 L245 G275 L276 I277R223-Y279 PolarHBondContact NE-O 3.32Å; R223-Y279 VanDerWaalsContact NE-O 3.09Å; L227-Y279 HydrophobicContact CD1-CE1 3.66Å; L227-Y279 HydrophobicContact CD2-CE1 4.41Å; L227-Y279 VanDerWaalsContact CD2-OH 3.25Å; L227-Y279 WeakPolarHBondContact CD2-OH 3.46Å; H241-Y279 AromaticContact CD2-CE2 3.75Å; H241-Y279 AromaticContact CD2-CZ 3.91Å; H241-Y279 PolarHBondContact CD2-OH 3.23Å; H241-Y279 AromaticContact NE2-CE2 3.72Å; F242-Y279 HydrophobicContact CB-CE2 4.4Å; F242-Y279 HydrophobicContact CD2-CD1 4.06Å; F242-Y279 AromaticContact CD2-CD2 3.93Å; F242-Y279 HydrophobicContact CD2-CD2 3.93Å; F242-Y279 HydrophobicContact CD2-CE1 4.01Å; F242-Y279 AromaticContact CD2-CE2 3.89Å; F242-Y279 HydrophobicContact CD2-CE2 3.89Å; F242-Y279 AromaticContact CD2-CG 4Å; F242-Y279 HydrophobicContact CD2-CG 4Å; F242-Y279 AromaticContact CD2-CZ 3.9Å; F242-Y279 HydrophobicContact CE2-CD1 4.34Å; F242-Y279 HydrophobicContact CE2-CD2 4.47Å; F242-Y279 HydrophobicContact CE2-CG 4.2Å; L245-Y279 HydrophobicContact CB-CD2 4.27Å; L245-Y279 HydrophobicContact CB-CE2 4.43Å; G275-Y279 PolarHBondContact O-N 3.44Å; L276-Y279 VanDerWaalsContact O-CB 3.28Å; L276-Y279 WeakPolarHBondContact O-CB 3.39Å; L276-Y279 PolarHBondContact O-N 3.31Å; L276-Y279 VanDerWaalsContact O-N 3.11Å; I277-Y279 PolarHBondContact O-N 2.91Å
280F94.1Very high83Confident10 Ų1029.6 Ų29.64%0.04415%0.151CC..Hα-helixtrans-108.3-43.2-179.2-66.5-75.4000114F148 A152 P153 V156 V224 L227 L276 I277 W278F148-F280 HydrophobicContact CD1-CB 3.75Å; F148-F280 HydrophobicContact CD1-CD2 4.11Å; F148-F280 HydrophobicContact CD1-CG 4.23Å; F148-F280 HydrophobicContact CE1-CB 3.76Å; A152-F280 HydrophobicContact CB-CD1 4.13Å; A152-F280 HydrophobicContact CB-CD2 4.2Å; A152-F280 HydrophobicContact CB-CE1 4.19Å; A152-F280 HydrophobicContact CB-CE2 4.25Å; A152-F280 HydrophobicContact CB-CG 4.14Å; A152-F280 HydrophobicContact CB-CZ 4.25Å; P153-F280 HydrophobicContact CB-CZ 4.39Å; P153-F280 HydrophobicContact CG-CE2 3.88Å; P153-F280 HydrophobicContact CG-CZ 3.74Å; V156-F280 HydrophobicContact CG2-CE1 4Å; V224-F280 HydrophobicContact CG2-CD1 4.29Å; L227-F280 HydrophobicContact CD1-CD1 4.28Å; L227-F280 HydrophobicContact CD1-CE1 3.93Å; L276-F280 HydrophobicContact CD1-CE2 4.31Å; I277-F280 PolarHBondContact O-N 3.36Å; W278-F280 PolarHBondContact O-N 2.9Å
281S91.9Very high82.2Confident5 Ų534.8 Ų34.84%0.03518%0.178CC..SBendtrans-147.4151.7-170.3-166.40000113.7I277 W278 F283 Y297I277-S281 CarbonylContact C-O 3.58Å; I277-S281 PolarHBondContact O-N 2.9Å; W278-S281 WeakPolarHBondContact CA-O 3.42Å; S281-F283 PolarHBondContact O-N 3.38Å; S281-Y297 WeakPolarHBondContact CA-OH 3.45Å; S281-Y297 PolarHBondContact N-OH 3.47Å; S281-Y297 PolarHBondContact O-OH 2.62Å
282W88.9Confident81.6Confident22 Ų2234.7 Ų34.78%0.08319%0.189CC..  trans-72.3120.8175.1175.3-104.8000111.4W252 R293 Y297 H298W252-W282 AromaticContact CH2-CH2 3.89Å; W252-W282 HydrophobicContact CH2-CH2 3.89Å; W252-W282 AromaticContact CH2-CZ3 3.48Å; W252-W282 HydrophobicContact CH2-CZ3 3.48Å; W252-W282 VanDerWaalsContact CH2-CZ3 3.48Å; W252-W282 AromaticContact CZ3-CZ3 3.8Å; W252-W282 HydrophobicContact CZ3-CZ3 3.8Å; W282-R293 HydrophobicContact CH2-CB 3.87Å; W282-R293 HydrophobicContact CZ2-CB 4.37Å; W282-Y297 HydrophobicContact CB-CD1 3.9Å; W282-Y297 HydrophobicContact CB-CE1 3.65Å; W282-Y297 HydrophobicContact CD2-CD1 4.17Å; W282-Y297 HydrophobicContact CD2-CG 4.26Å; W282-Y297 VanDerWaalsContact CE3-CB 3.5Å; W282-Y297 AromaticContact CE3-CD1 3.6Å; W282-Y297 HydrophobicContact CE3-CD1 3.6Å; W282-Y297 AromaticContact CE3-CD2 3.66Å; W282-Y297 HydrophobicContact CE3-CD2 3.66Å; W282-Y297 HydrophobicContact CE3-CE1 4.22Å; W282-Y297 HydrophobicContact CE3-CE2 4.24Å; W282-Y297 AromaticContact CE3-CG 3.27Å; W282-Y297 HydrophobicContact CE3-CG 3.27Å; W282-Y297 HydrophobicContact CG-CD1 4.35Å; W282-Y297 HydrophobicContact CZ3-CD1 4.5Å; W282-Y297 HydrophobicContact CZ3-CD2 4.02Å; W282-Y297 AromaticContact CZ3-CG 3.78Å; W282-Y297 HydrophobicContact CZ3-CG 3.78Å; W282-Y297 PolarHBondContact N-OH 2.86Å; W282-H298 AromaticContact CG-CE1 3.65Å
283F83.4Confident81.1Confident15 Ų1536.4 Ų36.47%0.06619%0.19CC..  trans-124.5133.6175.8-173.1-111.8000110.3M141 L144 Y190 I277 W278 S281 V285 H394M141-F283 HydrophobicContact CE-CE1 4.38Å; M141-F283 HydrophobicContact CE-CZ 4.04Å; M141-F283 HydrophobicContact SD-CZ 4.35Å; L144-F283 HydrophobicContact CD2-CD2 4.07Å; L144-F283 HydrophobicContact CD2-CE2 3.45Å; L144-F283 VanDerWaalsContact CD2-CE2 3.45Å; L144-F283 HydrophobicContact CD2-CZ 4.05Å; Y190-F283 AromaticContact CD1-CE2 3.96Å; Y190-F283 HydrophobicContact CD1-CE2 3.96Å; Y190-F283 HydrophobicContact CE1-CD2 4.38Å; Y190-F283 AromaticContact CE1-CE2 3.31Å; Y190-F283 HydrophobicContact CE1-CE2 3.31Å; Y190-F283 AromaticContact CE1-CZ 3.86Å; Y190-F283 HydrophobicContact CE1-CZ 3.86Å; Y190-F283 AromaticContact CZ-CE2 3.68Å; Y190-F283 AromaticContact CZ-CZ 3.71Å; Y190-F283 WeakPolarHBondContact OH-CZ 3.4Å; I277-F283 HydrophobicContact CG2-CB 3.64Å; I277-F283 HydrophobicContact CG2-CG 4.18Å; W278-F283 PolarHBondContact NE1-O 2.85Å; S281-F283 PolarHBondContact O-N 3.38Å; F283-V285 HydrophobicContact CD1-CG2 3.44Å; F283-V285 VanDerWaalsContact CD1-CG2 3.44Å; F283-V285 HydrophobicContact CE1-CG2 3.98Å; F283-V285 HydrophobicContact CG-CG2 4.4Å; F283-H394 AromaticContact CE1-CE1 3.6Å; F283-H394 AromaticContact CZ-CE1 3.77Å
284N80.4Confident80.8Confident17 Ų1737 Ų379%0.09119%0.194CC..  trans-93.3123.4-178.2-172.128.6000111.3H394 H397 F398N284-H394 PolarHBondContact O-ND1 3.32Å; N284-H397 PolarHBondContact ND2-O 2.94Å; N284-H397 VanDerWaalsContact ND2-O 3.08Å; N284-F398 HydrophobicContact CB-CD2 4.4Å
285V69.1Low80.6Confident3 Ų343 Ų432%0.01823%0.225CC..  trans-123.1-27.4-163.9-168.60000113.1T258 Y270 V274 W278 F283 H397T258-V285 HydrophobicContact CG2-CB 4.27Å; T258-V285 HydrophobicContact CG2-CG1 3.33Å; Y270-V285 HydrophobicContact CE1-CG1 3.53Å; Y270-V285 VanDerWaalsContact OH-CG1 3.23Å; Y270-V285 WeakPolarHBondContact OH-CG1 3.49Å; V274-V285 HydrophobicContact CB-CG2 4.49Å; V274-V285 HydrophobicContact CG1-CG1 4.31Å; V274-V285 HydrophobicContact CG1-CG2 3.69Å; V274-V285 HydrophobicContact CG2-CG1 3.85Å; V274-V285 HydrophobicContact CG2-CG2 3.93Å; W278-V285 HydrophobicContact CZ2-CB 4.37Å; W278-V285 HydrophobicContact CZ2-CG2 3.85Å; F283-V285 HydrophobicContact CD1-CG2 3.44Å; F283-V285 VanDerWaalsContact CD1-CG2 3.44Å; F283-V285 HydrophobicContact CE1-CG2 3.98Å; F283-V285 HydrophobicContact CG-CG2 4.4Å; V285-H397 PolarHBondContact O-CE1 2.76Å; V285-H397 PolarHBondContact O-ND1 2.88Å
286A60.5Low80.5Confident5 Ų548 Ų484%0.04125%0.251CS..SBendtrans-133.2149.7-172.300000113Q256 R293Q256-A286 HydrophobicContact CB-CB 3.93Å; A286-R293 PolarHBondContact O-NH1 3.23Å
287E53.5Low80.4Confident106 Ų10647 Ų4750%0.49525%0.245SC..SBendtrans-59.5141.2171.8-61.5-166.6162.100111.7R293 H397E287-R293 PolarHBondContact O-NH1 3.39Å; E287-R293 PolarHBondContact O-NH2 2.97Å; E287-R293 VanDerWaalsContact O-NH2 3.07Å; E287-H397 WeakPolarHBondContact CG-CD2 3.37Å; E287-H397 WeakPolarHBondContact CG-NE2 3.11Å; E287-H397 IonicContact OE1-CD2 3.68Å; E287-H397 IonicContact OE1-NE2 3.08Å
288G55.9Low80.4Confident52 Ų5247.4 Ų47.454%0.53625%0.247SC..SBendtrans140-160.3172.800000115.9T290G288-T290 VanDerWaalsContact C-N 3.3Å; G288-T290 PolarHBondContact O-N 2.88Å
289R57.9Low80.3Confident219 Ų21950 Ų5083%0.82627%0.269SS*.  trans-70.681.1-179.7-64.3174.198.3169.43.2110.5L291 G292 R293R289-L291 VanDerWaalsContact C-N 3.25Å; R289-L291 PolarHBondContact O-N 2.93Å; R289-G292 PolarHBondContact O-N 2.96Å; R289-R293 PolarHBondContact O-N 3.16Å
290T70.8Confident80.3Confident50 Ų5053.8 Ų53.831%0.30729%0.286SS..Hα-helixtrans-56.1-36.3-178.9540000113.1G288 S294G288-T290 VanDerWaalsContact C-N 3.3Å; G288-T290 PolarHBondContact O-N 2.88Å; T290-S294 WeakPolarHBondContact O-CB 3.32Å; T290-S294 PolarHBondContact O-N 3.24Å
291L73.9Confident80.3Confident112 Ų11253.5 Ų53.559%0.58629%0.285SS*.Hα-helixtrans-61.8-46.6178.5-70.9171.7000113R289 S294 L295R289-L291 VanDerWaalsContact C-N 3.25Å; R289-L291 PolarHBondContact O-N 2.93Å; L291-S294 PolarHBondContact O-N 3.45Å; L291-L295 WeakPolarHBondContact O-CB 3.37Å; L291-L295 PolarHBondContact O-N 3.01Å
292G79.8Confident80.4Confident34 Ų3456.3 Ų56.335%0.35130%0.302SS..Hα-helixtrans-67.1-43.4-179.200000111.9R289 L295 I296R289-G292 PolarHBondContact O-N 2.96Å; G292-L295 PolarHBondContact O-N 3.42Å; G292-I296 VanDerWaalsContact O-CG1 3.32Å; G292-I296 WeakPolarHBondContact O-CG1 3.48Å; G292-I296 PolarHBondContact O-N 3.41Å
293R85.4Confident80.8Confident61 Ų6158 Ų5823%0.2332%0.32CS..Hα-helixtrans-64.1-43.4176.5-63.5-179.4-179.7153.1-0.1111.6W252 W282 A286 E287 R289 L295 I296 Y297W252-R293 HydrophobicContact CZ2-CB 4.23Å; W282-R293 HydrophobicContact CH2-CB 3.87Å; W282-R293 HydrophobicContact CZ2-CB 4.37Å; A286-R293 PolarHBondContact O-NH1 3.23Å; E287-R293 PolarHBondContact O-NH1 3.39Å; E287-R293 PolarHBondContact O-NH2 2.97Å; E287-R293 VanDerWaalsContact O-NH2 3.07Å; R289-R293 PolarHBondContact O-N 3.16Å; R293-L295 VanDerWaalsContact C-N 3.34Å; R293-L295 PolarHBondContact O-N 2.9Å; R293-I296 PolarHBondContact O-N 3.01Å; R293-Y297 WeakPolarHBondContact O-CB 3.32Å; R293-Y297 PolarHBondContact O-N 3.44Å
294S86.8Confident81.4Confident19 Ų1958.2 Ų58.213%0.13332%0.322CS..Hα-helixtrans-60.8-43.8174176.40000110.8T290 L291 Y297 H298 K343T290-S294 WeakPolarHBondContact O-CB 3.32Å; T290-S294 PolarHBondContact O-N 3.24Å; L291-S294 PolarHBondContact O-N 3.45Å; S294-Y297 PolarHBondContact O-N 3.02Å; S294-H298 PolarHBondContact O-N 3.35Å; S294-H298 PolarHBondContact O-ND1 3.43Å; S294-H298 PolarHBondContact OG-CE1 3.42Å; S294-H298 PolarHBondContact OG-ND1 2.92Å; S294-K343 PolarHBondContact OG-NZ 3.36Å
295L88.8Confident82.1Confident127 Ų12758.1 Ų58.167%0.66532%0.322SS*.Hα-helixtrans-61.6-47179.1-177.364.8000111.7L291 G292 R293 Y297 H298 A299L291-L295 WeakPolarHBondContact O-CB 3.37Å; L291-L295 PolarHBondContact O-N 3.01Å; G292-L295 PolarHBondContact O-N 3.42Å; R293-L295 VanDerWaalsContact C-N 3.34Å; R293-L295 PolarHBondContact O-N 2.9Å; L295-Y297 VanDerWaalsContact C-N 3.32Å; L295-Y297 PolarHBondContact O-N 3.2Å; L295-H298 PolarHBondContact O-N 2.88Å; L295-A299 VanDerWaalsContact O-CB 3.31Å; L295-A299 WeakPolarHBondContact O-CB 3.31Å; L295-A299 PolarHBondContact O-N 3.34Å
296I91.3Very high83.4Confident107 Ų10760.7 Ų60.755%0.54934%0.344SS..Hα-helixtrans-57.4-47.3177-67.3164.8000110.5G292 R293 A299 F300G292-I296 VanDerWaalsContact O-CG1 3.32Å; G292-I296 WeakPolarHBondContact O-CG1 3.48Å; G292-I296 PolarHBondContact O-N 3.41Å; R293-I296 PolarHBondContact O-N 3.01Å; I296-A299 PolarHBondContact O-N 3.27Å; I296-F300 WeakPolarHBondContact O-CB 3.41Å; I296-F300 PolarHBondContact O-N 2.89Å
297Y92.9Very high85.1Confident7 Ų764.8 Ų64.83%0.02737%0.369CS..Hα-helixtrans-60.2-50178.4174.1-89.6000112.6W252 W278 S281 W282 R293 S294 L295 A299 F300 V301W252-Y297 HydrophobicContact CZ3-CD2 4.04Å; W278-Y297 HydrophobicContact CB-CE2 3.87Å; W278-Y297 HydrophobicContact CG-CE2 4.09Å; W278-Y297 WeakPolarHBondContact O-CE2 3.26Å; W278-Y297 PolarHBondContact O-OH 3.25Å; S281-Y297 WeakPolarHBondContact CA-OH 3.45Å; S281-Y297 PolarHBondContact N-OH 3.47Å; S281-Y297 PolarHBondContact O-OH 2.62Å; W282-Y297 HydrophobicContact CB-CD1 3.9Å; W282-Y297 HydrophobicContact CB-CE1 3.65Å; W282-Y297 HydrophobicContact CD2-CD1 4.17Å; W282-Y297 HydrophobicContact CD2-CG 4.26Å; W282-Y297 VanDerWaalsContact CE3-CB 3.5Å; W282-Y297 AromaticContact CE3-CD1 3.6Å; W282-Y297 HydrophobicContact CE3-CD1 3.6Å; W282-Y297 AromaticContact CE3-CD2 3.66Å; W282-Y297 HydrophobicContact CE3-CD2 3.66Å; W282-Y297 HydrophobicContact CE3-CE1 4.22Å; W282-Y297 HydrophobicContact CE3-CE2 4.24Å; W282-Y297 AromaticContact CE3-CG 3.27Å; W282-Y297 HydrophobicContact CE3-CG 3.27Å; W282-Y297 HydrophobicContact CG-CD1 4.35Å; W282-Y297 HydrophobicContact CZ3-CD1 4.5Å; W282-Y297 HydrophobicContact CZ3-CD2 4.02Å; W282-Y297 AromaticContact CZ3-CG 3.78Å; W282-Y297 HydrophobicContact CZ3-CG 3.78Å; W282-Y297 PolarHBondContact N-OH 2.86Å; R293-Y297 WeakPolarHBondContact O-CB 3.32Å; R293-Y297 PolarHBondContact O-N 3.44Å; S294-Y297 PolarHBondContact O-N 3.02Å; L295-Y297 VanDerWaalsContact C-N 3.32Å; L295-Y297 PolarHBondContact O-N 3.2Å; Y297-A299 VanDerWaalsContact C-N 3.31Å; Y297-A299 PolarHBondContact O-N 2.97Å; Y297-F300 WeakPolarHBondContact O-CB 3.41Å; Y297-F300 PolarHBondContact O-N 2.9Å; Y297-V301 HydrophobicContact CD1-CG2 4.14Å; Y297-V301 HydrophobicContact CD2-CG2 4.35Å; Y297-V301 HydrophobicContact CE1-CG2 3.67Å; Y297-V301 HydrophobicContact CE2-CG2 3.92Å; Y297-V301 HydrophobicContact CG-CG2 4.46Å; Y297-V301 WeakPolarHBondContact O-CG2 3.43Å; Y297-V301 PolarHBondContact O-N 3.26Å
298H93Very high87.1Confident11 Ų1159.9 Ų59.95%0.05135%0.345CS..Hα-helixtrans-71.8-30.4-175.9-64.872.7000111.2W282 S294 L295 T302 Y336 L340 K343W282-H298 AromaticContact CG-CE1 3.65Å; S294-H298 PolarHBondContact O-N 3.35Å; S294-H298 PolarHBondContact O-ND1 3.43Å; S294-H298 PolarHBondContact OG-CE1 3.42Å; S294-H298 PolarHBondContact OG-ND1 2.92Å; L295-H298 PolarHBondContact O-N 2.88Å; H298-T302 VanDerWaalsContact O-CB 3.26Å; H298-T302 WeakPolarHBondContact O-CB 3.47Å; H298-T302 PolarHBondContact O-N 3.03Å; H298-T302 PolarHBondContact O-OG1 2.98Å; H298-Y336 PolarHBondContact CD2-OH 2.87Å; H298-L340 HydrophobicContact CB-CD2 4.05Å; H298-L340 WeakPolarHBondContact CD2-CD2 3.45Å; H298-K343 PolarHBondContact CE1-NZ 2.91Å; H298-K343 PolarHBondContact NE2-NZ 3.31Å
299A93.7Very high89Confident57 Ų5757.9 Ų57.947%0.47132%0.323SS..Hα-helixtrans-62.6-46.9170.900000111L295 I296 Y297 T302 A303L295-A299 VanDerWaalsContact O-CB 3.31Å; L295-A299 WeakPolarHBondContact O-CB 3.31Å; L295-A299 PolarHBondContact O-N 3.34Å; I296-A299 PolarHBondContact O-N 3.27Å; Y297-A299 VanDerWaalsContact C-N 3.31Å; Y297-A299 PolarHBondContact O-N 2.97Å; A299-T302 PolarHBondContact O-N 3.32Å; A299-A303 PolarHBondContact O-N 2.69Å
300F95.1Very high90.8Very high90 Ų9050.1 Ų50.140%0.39531%0.305SS..Hα-helixtrans-60.3-50.2176173.3-100.6000112.3L245 L249 I296 Y297 T302 A303 D304L245-F300 HydrophobicContact CD2-CE1 3.56Å; L245-F300 HydrophobicContact CD2-CZ 3.4Å; L245-F300 VanDerWaalsContact CD2-CZ 3.4Å; L245-F300 HydrophobicContact CG-CZ 4.08Å; L249-F300 HydrophobicContact CD2-CE1 4.35Å; I296-F300 WeakPolarHBondContact O-CB 3.41Å; I296-F300 PolarHBondContact O-N 2.89Å; Y297-F300 WeakPolarHBondContact O-CB 3.41Å; Y297-F300 PolarHBondContact O-N 2.9Å; F300-T302 VanDerWaalsContact C-N 3.31Å; F300-T302 PolarHBondContact O-N 3.36Å; F300-A303 PolarHBondContact O-N 3.37Å; F300-D304 WeakPolarHBondContact O-CB 3.36Å; F300-D304 PolarHBondContact O-N 3.42Å
301V93.9Very high92Very high5 Ų549.2 Ų49.23%0.0330%0.299CS..Hα-helixtrans-63.7-36.6178.51740000111.9Y297 D304 V305 Y336Y297-V301 HydrophobicContact CD1-CG2 4.14Å; Y297-V301 HydrophobicContact CD2-CG2 4.35Å; Y297-V301 HydrophobicContact CE1-CG2 3.67Å; Y297-V301 HydrophobicContact CE2-CG2 3.92Å; Y297-V301 HydrophobicContact CG-CG2 4.46Å; Y297-V301 WeakPolarHBondContact O-CG2 3.43Å; Y297-V301 PolarHBondContact O-N 3.26Å; V301-D304 PolarHBondContact O-N 3.28Å; V301-V305 HydrophobicContact CG1-CG2 4.25Å; V301-V305 WeakPolarHBondContact O-CB 3.32Å; V301-V305 VanDerWaalsContact O-CG2 3.31Å; V301-V305 WeakPolarHBondContact O-CG2 3.42Å; V301-V305 PolarHBondContact O-N 3.07Å; V301-Y336 HydrophobicContact CG1-CE2 4.23Å; V301-Y336 WeakPolarHBondContact CG1-OH 3.33Å
302T94.2Very high93Very high63 Ų6344 Ų4439%0.38727%0.272SS..Hα-helixtrans-64.7-43.3176.1-55.70000111H298 A299 F300 D304 A306 Y336H298-T302 VanDerWaalsContact O-CB 3.26Å; H298-T302 WeakPolarHBondContact O-CB 3.47Å; H298-T302 PolarHBondContact O-N 3.03Å; H298-T302 PolarHBondContact O-OG1 2.98Å; A299-T302 PolarHBondContact O-N 3.32Å; F300-T302 VanDerWaalsContact C-N 3.31Å; F300-T302 PolarHBondContact O-N 3.36Å; T302-D304 VanDerWaalsContact C-N 3.35Å; T302-A306 WeakPolarHBondContact O-CB 3.28Å; T302-A306 PolarHBondContact O-N 3.41Å; T302-Y336 WeakPolarHBondContact OG1-CE1 3.37Å
303A95.9Very high93.8Very high57 Ų5747.6 Ų47.647%0.47128%0.275SS..Hα-helixtrans-62.2-43.6174.800000111.4A299 F300 A306 V307A299-A303 PolarHBondContact O-N 2.69Å; F300-A303 PolarHBondContact O-N 3.37Å; A303-A306 WeakPolarHBondContact O-CB 3.5Å; A303-A306 PolarHBondContact O-N 3.34Å; A303-V307 WeakPolarHBondContact O-CG2 3.28Å; A303-V307 PolarHBondContact O-N 3.4Å
304D96.1Very high94.2Very high20 Ų2049.2 Ų49.211%0.10729%0.292CS..Hα-helixtrans-63.2-46.9178.4-169.171.7000112.2R223 H241 F300 V301 T302 A306 V307 L308R223-D304 IonicContact CZ-OD2 3.13Å; R223-D304 IonicContact NH1-OD2 2.62Å; R223-D304 PolarHBondContact NH1-OD2 3.49Å; R223-D304 IonicContact NH2-OD2 3.08Å; R223-D304 PolarHBondContact NH2-OD2 3.07Å; H241-D304 IonicContact CE1-OD1 3.16Å; H241-D304 PolarHBondContact CE1-OD1 2.95Å; H241-D304 IonicContact CE1-OD2 3.2Å; H241-D304 PolarHBondContact CE1-OD2 2.99Å; H241-D304 IonicContact ND1-OD1 3.99Å; H241-D304 IonicContact NE2-OD2 2.75Å; H241-D304 PolarHBondContact NE2-OD2 3.38Å; F300-D304 WeakPolarHBondContact O-CB 3.36Å; F300-D304 PolarHBondContact O-N 3.42Å; V301-D304 PolarHBondContact O-N 3.28Å; T302-D304 VanDerWaalsContact C-N 3.35Å; D304-A306 VanDerWaalsContact C-N 3.29Å; D304-A306 PolarHBondContact O-N 2.89Å; D304-V307 PolarHBondContact O-N 3.49Å; D304-V307 VanDerWaalsContact O-N 3.14Å; D304-L308 WeakPolarHBondContact O-CG 3.08Å; D304-L308 PolarHBondContact O-N 3.35Å
305V95.5Very high94.5Very high15 Ų1555.9 Ų55.99%0.09132%0.315CS..Hα-helixtrans-60.1-39.11741700000111.4A226 V301 V307 L308 L309A226-V305 HydrophobicContact CB-CG1 4Å; A226-V305 HydrophobicContact CB-CG2 4.38Å; V301-V305 HydrophobicContact CG1-CG2 4.25Å; V301-V305 WeakPolarHBondContact O-CB 3.32Å; V301-V305 VanDerWaalsContact O-CG2 3.31Å; V301-V305 WeakPolarHBondContact O-CG2 3.42Å; V301-V305 PolarHBondContact O-N 3.07Å; V305-V307 VanDerWaalsContact C-N 3.35Å; V305-V307 PolarHBondContact O-N 3.29Å; V305-L308 PolarHBondContact O-N 3.34Å; V305-L309 HydrophobicContact CG1-CD1 3.84Å; V305-L309 HydrophobicContact CG1-CG 4.13Å; V305-L309 WeakPolarHBondContact O-CB 3.31Å; V305-L309 VanDerWaalsContact O-CG 3.32Å; V305-L309 WeakPolarHBondContact O-CG 3.48Å; V305-L309 PolarHBondContact O-N 3.2Å
306A95.8Very high94.6Very high58 Ų5852 Ų5248%0.47929%0.292SS..Hα-helixtrans-62-42.1175.700000111.9T302 A303 D304 A310T302-A306 WeakPolarHBondContact O-CB 3.28Å; T302-A306 PolarHBondContact O-N 3.41Å; A303-A306 WeakPolarHBondContact O-CB 3.5Å; A303-A306 PolarHBondContact O-N 3.34Å; D304-A306 VanDerWaalsContact C-N 3.29Å; D304-A306 PolarHBondContact O-N 2.89Å; A306-A310 WeakPolarHBondContact O-CB 3.41Å; A306-A310 PolarHBondContact O-N 2.88Å
307V96Very high94.6Very high91 Ų9150.1 Ų50.155%0.55228%0.283SS*.Hα-helixtrans-63.2-44.6174.9172.80000111.3A303 D304 V305 A310 T311A303-V307 WeakPolarHBondContact O-CG2 3.28Å; A303-V307 PolarHBondContact O-N 3.4Å; D304-V307 PolarHBondContact O-N 3.49Å; D304-V307 VanDerWaalsContact O-N 3.14Å; V305-V307 VanDerWaalsContact C-N 3.35Å; V305-V307 PolarHBondContact O-N 3.29Å; V307-A310 PolarHBondContact O-N 3.01Å; V307-T311 WeakPolarHBondContact O-CB 3.27Å; V307-T311 PolarHBondContact O-N 3.09Å; V307-T311 PolarHBondContact O-OG1 3.49Å
308L96.4Very high94.4Very high2 Ų253.8 Ų53.81%0.0131%0.307CS..Hα-helixtrans-61.1-47.6178.2-67.1172.8000111.8A226 L227 F230 D304 V305 T311 W312A226-L308 HydrophobicContact CB-CD1 4.4Å; L227-L308 HydrophobicContact CD2-CD1 3.65Å; L227-L308 HydrophobicContact CG-CD1 4.29Å; F230-L308 HydrophobicContact CB-CB 4.26Å; F230-L308 HydrophobicContact CB-CD2 3.73Å; F230-L308 HydrophobicContact CD1-CD2 3.83Å; F230-L308 HydrophobicContact CD2-CD2 3.72Å; F230-L308 HydrophobicContact CE1-CD2 4.36Å; F230-L308 HydrophobicContact CE2-CD2 4.26Å; F230-L308 HydrophobicContact CG-CD2 3.47Å; F230-L308 VanDerWaalsContact CG-CD2 3.47Å; D304-L308 WeakPolarHBondContact O-CG 3.08Å; D304-L308 PolarHBondContact O-N 3.35Å; V305-L308 PolarHBondContact O-N 3.34Å; L308-T311 PolarHBondContact O-N 3.48Å; L308-W312 WeakPolarHBondContact O-CB 3.43Å; L308-W312 PolarHBondContact O-N 2.91Å
309L96.2Very high94.1Very high11 Ų1159.1 Ų59.16%0.05834%0.34CS..Hα-helixtrans-69.7-38.3179.7-67.7-178.9000112.5A226 L229 V305 W312 W313 L329 L332 P333A226-L309 HydrophobicContact CB-CD2 4.13Å; A226-L309 HydrophobicContact CB-CG 4.42Å; L229-L309 HydrophobicContact CD1-CD2 3.93Å; V305-L309 HydrophobicContact CG1-CD1 3.84Å; V305-L309 HydrophobicContact CG1-CG 4.13Å; V305-L309 WeakPolarHBondContact O-CB 3.31Å; V305-L309 VanDerWaalsContact O-CG 3.32Å; V305-L309 WeakPolarHBondContact O-CG 3.48Å; V305-L309 PolarHBondContact O-N 3.2Å; L309-W312 PolarHBondContact O-N 3.48Å; L309-W313 WeakPolarHBondContact O-CB 3.49Å; L309-W313 PolarHBondContact O-N 2.91Å; L309-L329 HydrophobicContact CB-CD2 3.93Å; L309-L329 HydrophobicContact CD1-CD2 4.49Å; L309-L329 HydrophobicContact CD2-CD2 4.41Å; L309-L332 HydrophobicContact CD1-CB 4.45Å; L309-L332 HydrophobicContact CD2-CD1 3.89Å; L309-P333 HydrophobicContact CD1-CG 4.17Å
310A95.8Very high93.7Very high55 Ų5561.8 Ų61.846%0.45534%0.343SS..Hα-helixtrans-61.9-46.9174.500000110.8A306 V307 W312 W313 T314A306-A310 WeakPolarHBondContact O-CB 3.41Å; A306-A310 PolarHBondContact O-N 2.88Å; V307-A310 PolarHBondContact O-N 3.01Å; A310-W312 VanDerWaalsContact C-N 3.33Å; A310-W312 PolarHBondContact O-N 2.92Å; A310-W313 PolarHBondContact O-N 3.35Å; A310-W313 VanDerWaalsContact O-N 3.16Å; A310-T314 WeakPolarHBondContact O-CG2 3.18Å; A310-T314 PolarHBondContact O-N 3.23Å; A310-T314 PolarHBondContact O-OG1 2.94Å
311T95.6Very high93.3Very high31 Ų3157.9 Ų57.919%0.1933%0.327CS..Hα-helixtrans-62-42.5177.2-52.20000111.3F230 L234 V307 L308 W313 T314 Y315F230-T311 HydrophobicContact CD2-CG2 4.08Å; F230-T311 HydrophobicContact CE2-CG2 3.84Å; L234-T311 HydrophobicContact CD1-CG2 3.78Å; V307-T311 WeakPolarHBondContact O-CB 3.27Å; V307-T311 PolarHBondContact O-N 3.09Å; V307-T311 PolarHBondContact O-OG1 3.49Å; L308-T311 PolarHBondContact O-N 3.48Å; T311-W313 VanDerWaalsContact C-N 3.34Å; T311-W313 PolarHBondContact O-N 3.35Å; T311-T314 PolarHBondContact O-N 2.91Å; T311-T314 PolarHBondContact O-OG1 3.24Å; T311-Y315 HydrophobicContact CG2-CD2 3.75Å; T311-Y315 HydrophobicContact CG2-CE2 4.02Å; T311-Y315 VanDerWaalsContact O-CD2 3.31Å; T311-Y315 WeakPolarHBondContact O-CD2 3.3Å; T311-Y315 PolarHBondContact O-N 3.45Å; T311-Y315 VanDerWaalsContact O-N 3.16Å
312W95.8Very high93Very high3 Ų361 Ų611%0.01135%0.353CS..Hα-helixtrans-60.3-45174.2179.173.7000111.8L229 S232 L308 L309 A310 T314 Y315 R316 T321 Y324 L329L229-W312 HydrophobicContact CB-CB 4.39Å; L229-W312 HydrophobicContact CB-CD2 4.23Å; L229-W312 HydrophobicContact CB-CG 3.86Å; L229-W312 HydrophobicContact CD2-CD2 4.12Å; L229-W312 HydrophobicContact CD2-CH2 4.49Å; L229-W312 HydrophobicContact CD2-CZ2 3.82Å; S232-W312 PolarHBondContact OG-NE1 3.3Å; L308-W312 WeakPolarHBondContact O-CB 3.43Å; L308-W312 PolarHBondContact O-N 2.91Å; L309-W312 PolarHBondContact O-N 3.48Å; A310-W312 VanDerWaalsContact C-N 3.33Å; A310-W312 PolarHBondContact O-N 2.92Å; W312-T314 VanDerWaalsContact C-N 3.32Å; W312-T314 PolarHBondContact O-N 2.87Å; W312-Y315 PolarHBondContact O-N 3.49Å; W312-R316 HydrophobicContact CZ2-CB 4.3Å; W312-R316 WeakPolarHBondContact O-CB 3.43Å; W312-R316 PolarHBondContact O-N 3.32Å; W312-T321 HydrophobicContact CZ2-CG2 3.9Å; W312-Y324 HydrophobicContact CH2-CE2 4.49Å; W312-Y324 HydrophobicContact CZ2-CE2 4.22Å; W312-L329 HydrophobicContact CE3-CD2 4.28Å; W312-L329 HydrophobicContact CZ3-CD2 4.38Å; W312-L329 HydrophobicContact CZ3-CG 4.21Å
313W94.7Very high92.6Very high110 Ų11062.9 Ų62.942%0.41738%0.375SS..Hα-helixtrans-62.8-35.8179.7-177.2-103.7000113.5L309 A310 T311 L329L309-W313 WeakPolarHBondContact O-CB 3.49Å; L309-W313 PolarHBondContact O-N 2.91Å; A310-W313 PolarHBondContact O-N 3.35Å; A310-W313 VanDerWaalsContact O-N 3.16Å; T311-W313 VanDerWaalsContact C-N 3.34Å; T311-W313 PolarHBondContact O-N 3.35Å; W313-L329 HydrophobicContact CB-CD1 4.24Å; W313-L329 HydrophobicContact CD2-CD1 3.5Å; W313-L329 HydrophobicContact CE3-CD1 3.14Å; W313-L329 HydrophobicContact CE3-CG 3.97Å; W313-L329 HydrophobicContact CG-CD1 3.99Å; W313-L329 HydrophobicContact CH2-CD1 4.31Å; W313-L329 HydrophobicContact CZ3-CD1 3.58Å; W313-L329 HydrophobicContact CZ3-CG 4.37Å
314T94.1Very high92.2Very high95 Ų9563.1 Ų63.158%0.58336%0.364SS*.Hα-helixtrans-75.9-34.3179.857.50000113.4A310 T311 W312A310-T314 WeakPolarHBondContact O-CG2 3.18Å; A310-T314 PolarHBondContact O-N 3.23Å; A310-T314 PolarHBondContact O-OG1 2.94Å; T311-T314 PolarHBondContact O-N 2.91Å; T311-T314 PolarHBondContact O-OG1 3.24Å; W312-T314 VanDerWaalsContact C-N 3.32Å; W312-T314 PolarHBondContact O-N 2.87Å
315Y93.4Very high91.8Very high159 Ų15962.1 Ų62.162%0.62436%0.359SS*.Hα-helixtrans-104.5-1.9-174.6-67.3-75.8000114.5L234 T311 W312L234-Y315 HydrophobicContact CD1-CD2 4.47Å; T311-Y315 HydrophobicContact CG2-CD2 3.75Å; T311-Y315 HydrophobicContact CG2-CE2 4.02Å; T311-Y315 VanDerWaalsContact O-CD2 3.31Å; T311-Y315 WeakPolarHBondContact O-CD2 3.3Å; T311-Y315 PolarHBondContact O-N 3.45Å; T311-Y315 VanDerWaalsContact O-N 3.16Å; W312-Y315 PolarHBondContact O-N 3.49Å
316R91.8Very high91.6Very high46 Ų4664.6 Ų64.617%0.17438%0.381CS..SBendtrans-64.5149.8177.368.4-176.9-176.1914.5111.9W312 P318 T321W312-R316 HydrophobicContact CZ2-CB 4.3Å; W312-R316 WeakPolarHBondContact O-CB 3.43Å; W312-R316 PolarHBondContact O-N 3.32Å; R316-P318 VanDerWaalsContact O-CD 3.31Å; R316-P318 WeakPolarHBondContact O-CD 3.29Å; R316-T321 HydrophobicContact CB-CG2 4.25Å; R316-T321 WeakPolarHBondContact CD-OG1 3.41Å; R316-T321 PolarHBondContact NH1-OG1 3.36Å
317D90.3Very high91.4Very high67 Ų6764.8 Ų64.836%0.35838%0.382SS..  trans-70.6115.1163.2-178.7-33.4000108.9V319 Q320 T321D317-V319 VanDerWaalsContact C-N 3.29Å; D317-V319 PolarHBondContact O-N 2.91Å; D317-V319 WeakPolarHBondContact OD1-CB 3.38Å; D317-V319 PolarHBondContact OD1-N 3.16Å; D317-Q320 HydrophobicContact CB-CB 4.22Å; D317-Q320 HydrophobicContact CB-CG 4.33Å; D317-Q320 PolarHBondContact OD1-N 3.42Å; D317-Q320 WeakPolarHBondContact OD2-CG 3.38Å; D317-Q320 PolarHBondContact OD2-NE2 3.43Å; D317-T321 WeakPolarHBondContact O-CB 3.38Å; D317-T321 WeakPolarHBondContact O-CG2 3.5Å; D317-T321 PolarHBondContact O-N 3Å; D317-T321 PolarHBondContact O-OG1 3.39Å
318P88.9Confident91.2Very high83 Ų8362.2 Ų62.254%0.53937%0.366SS..THydrogen-bonded Turntrans-67.8-27.6-174.627-33.8000113.5R316 A322R316-P318 VanDerWaalsContact O-CD 3.31Å; R316-P318 WeakPolarHBondContact O-CD 3.29Å; P318-A322 WeakPolarHBondContact O-CB 3.47Å; P318-A322 PolarHBondContact O-N 2.88Å
319V88.2Confident91.1Very high123 Ų12364.4 Ų64.475%0.74538%0.378SS*.THydrogen-bonded Turntrans-76.9-48.8-178.3-179.40000110.1D317 T321D317-V319 VanDerWaalsContact C-N 3.29Å; D317-V319 PolarHBondContact O-N 2.91Å; D317-V319 WeakPolarHBondContact OD1-CB 3.38Å; D317-V319 PolarHBondContact OD1-N 3.16Å; V319-T321 VanDerWaalsContact C-N 3.3Å; V319-T321 PolarHBondContact O-N 3.5Å
320Q84.4Confident90.9Very high113 Ų11369.3 Ų69.353%0.52840%0.404SS..THydrogen-bonded Turntrans-67.1-33.5-178.2-66.7-177.242.200112.5D317D317-Q320 HydrophobicContact CB-CB 4.22Å; D317-Q320 HydrophobicContact CB-CG 4.33Å; D317-Q320 PolarHBondContact OD1-N 3.42Å; D317-Q320 WeakPolarHBondContact OD2-CG 3.38Å; D317-Q320 PolarHBondContact OD2-NE2 3.43Å
321T86.8Confident90.9Very high9 Ų968.7 Ų68.76%0.05540%0.399CS..THydrogen-bonded Turntrans-98.50.5-17462.10000113.6W312 R316 D317 V319 A323 Y324 G325W312-T321 HydrophobicContact CZ2-CG2 3.9Å; R316-T321 HydrophobicContact CB-CG2 4.25Å; R316-T321 WeakPolarHBondContact CD-OG1 3.41Å; R316-T321 PolarHBondContact NH1-OG1 3.36Å; D317-T321 WeakPolarHBondContact O-CB 3.38Å; D317-T321 WeakPolarHBondContact O-CG2 3.5Å; D317-T321 PolarHBondContact O-N 3Å; D317-T321 PolarHBondContact O-OG1 3.39Å; V319-T321 VanDerWaalsContact C-N 3.3Å; V319-T321 PolarHBondContact O-N 3.5Å; T321-A323 VanDerWaalsContact C-N 3.27Å; T321-A323 PolarHBondContact O-N 2.95Å; T321-Y324 HydrophobicContact CG2-CE2 4.32Å; T321-Y324 PolarHBondContact O-N 3.48Å; T321-G325 WeakPolarHBondContact O-CA 3.47Å; T321-G325 PolarHBondContact O-N 2.87Å
322A86.6Confident90.9Very high70 Ų7068.3 Ų68.358%0.57940%0.396SS*.THydrogen-bonded Turntrans-55.7-40.2-176.700000113.3P318 Y324P318-A322 WeakPolarHBondContact O-CB 3.47Å; P318-A322 PolarHBondContact O-N 2.88Å; A322-Y324 VanDerWaalsContact C-N 3.33Å; A322-Y324 PolarHBondContact O-N 3.37Å
323A86.1Confident90.8Very high102 Ų10270.7 Ų70.784%0.84341%0.411SS*.THydrogen-bonded Turntrans-67.4-29.4-174.100000114T321T321-A323 VanDerWaalsContact C-N 3.27Å; T321-A323 PolarHBondContact O-N 2.95Å
324Y87.2Confident90.9Very high62 Ų6270.1 Ų70.124%0.24342%0.416CS..THydrogen-bonded Turntrans-127.7-13-173.362.7-97000114.2L163 W312 T321 A322 A326 A327 V328L163-Y324 HydrophobicContact CD2-CE2 4.36Å; W312-Y324 HydrophobicContact CH2-CE2 4.49Å; W312-Y324 HydrophobicContact CZ2-CE2 4.22Å; T321-Y324 HydrophobicContact CG2-CE2 4.32Å; T321-Y324 PolarHBondContact O-N 3.48Å; A322-Y324 VanDerWaalsContact C-N 3.33Å; A322-Y324 PolarHBondContact O-N 3.37Å; Y324-A326 PolarHBondContact O-N 2.84Å; Y324-A327 PolarHBondContact O-N 3.06Å; Y324-V328 HydrophobicContact CD2-CG2 3.99Å; Y324-V328 WeakPolarHBondContact O-CB 3.38Å; Y324-V328 WeakPolarHBondContact O-CG2 3.47Å; Y324-V328 PolarHBondContact O-N 3.29Å
325G88.9Confident90.9Very high0 Ų067.7 Ų67.70%040%0.402CS..Hα-helixtrans-66-42.8-166.300000114.5T321 L329T321-G325 WeakPolarHBondContact O-CA 3.47Å; T321-G325 PolarHBondContact O-N 2.87Å; G325-L329 PolarHBondContact O-N 3.24Å
326A90.4Very high91Very high67 Ų6760.8 Ų60.855%0.55438%0.375SS*.Hα-helixtrans-66.8-41174.900000111.7Y324 V328 L329 L330Y324-A326 PolarHBondContact O-N 2.84Å; A326-V328 VanDerWaalsContact C-N 3.35Å; A326-V328 PolarHBondContact O-N 2.97Å; A326-L329 PolarHBondContact O-N 2.93Å; A326-L330 PolarHBondContact O-N 3.32Å; A326-L330 VanDerWaalsContact O-N 3.12Å
327A92.1Very high91.1Very high62 Ų6263.5 Ų63.551%0.51239%0.393SS..Hα-helixtrans-61.7-43.2177.900000111.4Y324 L330 A331Y324-A327 PolarHBondContact O-N 3.06Å; A327-L330 PolarHBondContact O-N 2.82Å; A327-A331 WeakPolarHBondContact O-CB 3.3Å; A327-A331 PolarHBondContact O-N 3.27Å
328V91.9Very high91.4Very high36 Ų3664.2 Ų64.222%0.21840%0.396CS..Hα-helixtrans-67.2-42.9177.8168.90000111.8L229 Y324 A326 L330 A331 L332L229-V328 HydrophobicContact CD1-CG1 3.45Å; L229-V328 VanDerWaalsContact CD1-CG1 3.45Å; L229-V328 HydrophobicContact CD2-CG1 4.4Å; Y324-V328 HydrophobicContact CD2-CG2 3.99Å; Y324-V328 WeakPolarHBondContact O-CB 3.38Å; Y324-V328 WeakPolarHBondContact O-CG2 3.47Å; Y324-V328 PolarHBondContact O-N 3.29Å; A326-V328 VanDerWaalsContact C-N 3.35Å; A326-V328 PolarHBondContact O-N 2.97Å; V328-L330 PolarHBondContact O-N 3.49Å; V328-A331 PolarHBondContact O-N 2.95Å; V328-L332 HydrophobicContact CG1-CD1 3.68Å; V328-L332 HydrophobicContact CG1-CG 4Å; V328-L332 WeakPolarHBondContact O-CG 3.25Å; V328-L332 PolarHBondContact O-N 3.12Å
329L93.3Very high91.6Very high49 Ų4960.3 Ų60.326%0.25737%0.37SS..Hα-helixtrans-60.6-32.6176.5-84.9-168.1000113.4L309 W312 W313 G325 A326 P333L309-L329 HydrophobicContact CB-CD2 3.93Å; L309-L329 HydrophobicContact CD1-CD2 4.49Å; L309-L329 HydrophobicContact CD2-CD2 4.41Å; W312-L329 HydrophobicContact CE3-CD2 4.28Å; W312-L329 HydrophobicContact CZ3-CD2 4.38Å; W312-L329 HydrophobicContact CZ3-CG 4.21Å; W313-L329 HydrophobicContact CB-CD1 4.24Å; W313-L329 HydrophobicContact CD2-CD1 3.5Å; W313-L329 HydrophobicContact CE3-CD1 3.14Å; W313-L329 HydrophobicContact CE3-CG 3.97Å; W313-L329 HydrophobicContact CG-CD1 3.99Å; W313-L329 HydrophobicContact CH2-CD1 4.31Å; W313-L329 HydrophobicContact CZ3-CD1 3.58Å; W313-L329 HydrophobicContact CZ3-CG 4.37Å; G325-L329 PolarHBondContact O-N 3.24Å; A326-L329 PolarHBondContact O-N 2.93Å; L329-P333 WeakPolarHBondContact O-CD 3.34Å; L329-P333 VanDerWaalsContact O-CG 3.28Å; L329-P333 WeakPolarHBondContact O-CG 3.49Å
330L93.8Very high91.8Very high113 Ų11356.4 Ų56.459%0.59235%0.345SS*.Hα-helixtrans-83.4-44.1176.3-175.862.8000111.7A326 A327 V328 P333 L334A326-L330 PolarHBondContact O-N 3.32Å; A326-L330 VanDerWaalsContact O-N 3.12Å; A327-L330 PolarHBondContact O-N 2.82Å; V328-L330 PolarHBondContact O-N 3.49Å; L330-P333 WeakPolarHBondContact O-CD 3.3Å; L330-L334 HydrophobicContact CD1-CD1 3.87Å; L330-L334 HydrophobicContact CD1-CG 4.28Å; L330-L334 HydrophobicContact CD2-CD1 4.45Å; L330-L334 HydrophobicContact CG-CD1 3.74Å; L330-L334 HydrophobicContact CG-CG 4.48Å; L330-L334 WeakPolarHBondContact O-CB 3.44Å; L330-L334 WeakPolarHBondContact O-CG 3.36Å; L330-L334 PolarHBondContact O-N 2.83Å
331A94.8Very high92.1Very high43 Ų4355.4 Ų55.436%0.35534%0.343SS..Hα-helixtrans-66.4-43.1-173.700000112.6A327 V328 L334 C335A327-A331 WeakPolarHBondContact O-CB 3.3Å; A327-A331 PolarHBondContact O-N 3.27Å; V328-A331 PolarHBondContact O-N 2.95Å; A331-L334 PolarHBondContact O-N 3.32Å; A331-C335 WeakPolarHBondContact O-CB 3.31Å; A331-C335 PolarHBondContact O-N 3.38Å; A331-C335 PolarHBondContact O-SG 3.39Å
332L95.3Very high92.4Very high23 Ų2356.4 Ų56.412%0.1235%0.348CS..Hα-helixtrans-63.6-49.2-174.9-62.4-178.7000113P222 A225 L229 L309 V328 L334 C335 Y336P222-L332 HydrophobicContact CB-CB 4.35Å; P222-L332 HydrophobicContact CB-CD2 4.27Å; A225-L332 HydrophobicContact CB-CD1 4.03Å; A225-L332 HydrophobicContact CB-CD2 3.71Å; L229-L332 HydrophobicContact CD1-CD1 3.52Å; L309-L332 HydrophobicContact CD1-CB 4.45Å; L309-L332 HydrophobicContact CD2-CD1 3.89Å; V328-L332 HydrophobicContact CG1-CD1 3.68Å; V328-L332 HydrophobicContact CG1-CG 4Å; V328-L332 WeakPolarHBondContact O-CG 3.25Å; V328-L332 PolarHBondContact O-N 3.12Å; L332-L334 PolarHBondContact O-N 3.31Å; L332-C335 PolarHBondContact O-N 2.88Å; L332-Y336 PolarHBondContact O-N 2.83Å
333P94.6Very high92.5Very high53 Ų5353.6 Ų53.634%0.34432%0.322SS..Hα-helixtrans-62.4-40.9174.3-23.435.4000112.8L309 L329 L330 Y336 L337L309-P333 HydrophobicContact CD1-CG 4.17Å; L329-P333 WeakPolarHBondContact O-CD 3.34Å; L329-P333 VanDerWaalsContact O-CG 3.28Å; L329-P333 WeakPolarHBondContact O-CG 3.49Å; L330-P333 WeakPolarHBondContact O-CD 3.3Å; P333-Y336 PolarHBondContact O-N 3.24Å; P333-L337 WeakPolarHBondContact O-CB 3.31Å; P333-L337 VanDerWaalsContact O-CG 3.29Å; P333-L337 WeakPolarHBondContact O-CG 3.16Å; P333-L337 PolarHBondContact O-N 2.84Å
334L95.5Very high92.5Very high97 Ų9752.3 Ų52.351%0.50830%0.304SS..Hα-helixtrans-63.2-43.4178.3-72179.1000112.1L330 A331 L332 Y336 L337 L338L330-L334 HydrophobicContact CD1-CD1 3.87Å; L330-L334 HydrophobicContact CD1-CG 4.28Å; L330-L334 HydrophobicContact CD2-CD1 4.45Å; L330-L334 HydrophobicContact CG-CD1 3.74Å; L330-L334 HydrophobicContact CG-CG 4.48Å; L330-L334 WeakPolarHBondContact O-CB 3.44Å; L330-L334 WeakPolarHBondContact O-CG 3.36Å; L330-L334 PolarHBondContact O-N 2.83Å; A331-L334 PolarHBondContact O-N 3.32Å; L332-L334 PolarHBondContact O-N 3.31Å; L334-Y336 VanDerWaalsContact C-N 3.33Å; L334-Y336 PolarHBondContact O-N 2.9Å; L334-L337 PolarHBondContact O-N 3.42Å; L334-L338 WeakPolarHBondContact O-CB 3.44Å; L334-L338 PolarHBondContact O-N 2.98Å
335C95.6Very high92.4Very high44 Ų4453.6 Ų53.630%0.29732%0.315SS..Hα-helixtrans-60.2-43.6174.2-73.80000111.4L218 P222 A331 L332 L338 G339L218-C335 HydrophobicContact CD2-CB 4.13Å; P222-C335 HydrophobicContact CG-CB 3.6Å; A331-C335 WeakPolarHBondContact O-CB 3.31Å; A331-C335 PolarHBondContact O-N 3.38Å; A331-C335 PolarHBondContact O-SG 3.39Å; L332-C335 PolarHBondContact O-N 2.88Å; C335-L338 PolarHBondContact O-N 3.5Å; C335-G339 PolarHBondContact O-N 2.98Å
336Y93.9Very high92.2Very high15 Ų1553.6 Ų53.66%0.05932%0.315CS..Hα-helixtrans-65.3-43.3178.7-169.7-94000112.2L219 H298 V301 T302 L332 P333 L334 L338 G339 L340L219-Y336 HydrophobicContact CB-CE2 4.38Å; L219-Y336 HydrophobicContact CD2-CD1 4.44Å; L219-Y336 HydrophobicContact CD2-CD2 3.74Å; L219-Y336 HydrophobicContact CD2-CE1 4.32Å; L219-Y336 HydrophobicContact CD2-CE2 3.58Å; L219-Y336 HydrophobicContact CD2-CG 4.18Å; H298-Y336 PolarHBondContact CD2-OH 2.87Å; V301-Y336 HydrophobicContact CG1-CE2 4.23Å; V301-Y336 WeakPolarHBondContact CG1-OH 3.33Å; T302-Y336 WeakPolarHBondContact OG1-CE1 3.37Å; L332-Y336 PolarHBondContact O-N 2.83Å; P333-Y336 PolarHBondContact O-N 3.24Å; L334-Y336 VanDerWaalsContact C-N 3.33Å; L334-Y336 PolarHBondContact O-N 2.9Å; Y336-L338 VanDerWaalsContact C-N 3.35Å; Y336-L338 PolarHBondContact O-N 3.42Å; Y336-G339 PolarHBondContact O-N 2.73Å; Y336-L340 HydrophobicContact CD1-CD1 4.03Å; Y336-L340 HydrophobicContact CD1-CG 4.34Å; Y336-L340 HydrophobicContact CE1-CD1 3.8Å; Y336-L340 HydrophobicContact CE1-CG 4.14Å; Y336-L340 PolarHBondContact O-N 3.45Å
337L94.6Very high91.6Very high103 Ų10353.9 Ų53.954%0.53930%0.302SS..Hα-helixtrans-62.7-40.3174.6-71.3173.8000111.9P333 L334 G339 L340 L341P333-L337 WeakPolarHBondContact O-CB 3.31Å; P333-L337 VanDerWaalsContact O-CG 3.29Å; P333-L337 WeakPolarHBondContact O-CG 3.16Å; P333-L337 PolarHBondContact O-N 2.84Å; L334-L337 PolarHBondContact O-N 3.42Å; L337-G339 VanDerWaalsContact C-N 3.34Å; L337-L340 HydrophobicContact CD2-CD1 4.43Å; L337-L340 WeakPolarHBondContact O-CB 3.47Å; L337-L340 PolarHBondContact O-N 3.01Å; L337-L341 PolarHBondContact O-N 3.16Å
338L95.6Very high90.9Very high82 Ų8256.5 Ų56.543%0.42932%0.315SS..Hα-helixtrans-63.2-40.8173.4-178.862.8000111.2L218 L334 C335 Y336 L340 L341 L342L218-L338 HydrophobicContact CD1-CB 4.4Å; L218-L338 HydrophobicContact CD1-CD2 3.83Å; L218-L338 HydrophobicContact CD1-CG 3.87Å; L334-L338 WeakPolarHBondContact O-CB 3.44Å; L334-L338 PolarHBondContact O-N 2.98Å; C335-L338 PolarHBondContact O-N 3.5Å; Y336-L338 VanDerWaalsContact C-N 3.35Å; Y336-L338 PolarHBondContact O-N 3.42Å; L338-L340 VanDerWaalsContact C-N 3.34Å; L338-L340 PolarHBondContact O-N 3.24Å; L338-L341 HydrophobicContact CD1-CD2 4.4Å; L338-L341 PolarHBondContact O-N 2.97Å; L338-L342 WeakPolarHBondContact O-CG 3.38Å; L338-L342 PolarHBondContact O-N 3.38Å
339G93.8Very high89.8Confident0 Ų057.7 Ų57.70%034%0.335CS..Hα-helixtrans-58.8-43.6172.500000112.4C335 Y336 L337 L342 K343C335-G339 PolarHBondContact O-N 2.98Å; Y336-G339 PolarHBondContact O-N 2.73Å; L337-G339 VanDerWaalsContact C-N 3.34Å; G339-L342 PolarHBondContact O-N 3.47Å; G339-K343 WeakPolarHBondContact O-CB 3.4Å; G339-K343 PolarHBondContact O-N 3.44Å
340L92.4Very high88.6Confident41 Ų4159.9 Ų59.922%0.21534%0.342CS..Hα-helixtrans-62.8-40.2173.5-74176.7000112.6L219 H298 Y336 L337 L338 K343 T344L219-L340 HydrophobicContact CD2-CD2 4.17Å; L219-L340 HydrophobicContact CD2-CG 4.07Å; H298-L340 HydrophobicContact CB-CD2 4.05Å; H298-L340 WeakPolarHBondContact CD2-CD2 3.45Å; Y336-L340 HydrophobicContact CD1-CD1 4.03Å; Y336-L340 HydrophobicContact CD1-CG 4.34Å; Y336-L340 HydrophobicContact CE1-CD1 3.8Å; Y336-L340 HydrophobicContact CE1-CG 4.14Å; Y336-L340 PolarHBondContact O-N 3.45Å; L337-L340 HydrophobicContact CD2-CD1 4.43Å; L337-L340 WeakPolarHBondContact O-CB 3.47Å; L337-L340 PolarHBondContact O-N 3.01Å; L338-L340 VanDerWaalsContact C-N 3.34Å; L338-L340 PolarHBondContact O-N 3.24Å; L340-K343 VanDerWaalsContact O-CB 3.3Å; L340-K343 WeakPolarHBondContact O-CB 3.26Å; L340-K343 PolarHBondContact O-N 3.39Å; L340-T344 WeakPolarHBondContact O-CG2 3.45Å; L340-T344 PolarHBondContact O-N 2.99Å; L340-T344 PolarHBondContact O-OG1 3.37Å
341L92.1Very high87.3Confident93 Ų9356.1 Ų56.149%0.48732%0.322SS..Hα-helixtrans-64.9-45.8176.2179.264.7000111.4L337 L338 K343 T344 L345L337-L341 PolarHBondContact O-N 3.16Å; L338-L341 HydrophobicContact CD1-CD2 4.4Å; L338-L341 PolarHBondContact O-N 2.97Å; L341-K343 VanDerWaalsContact C-N 3.26Å; L341-K343 PolarHBondContact O-N 3.47Å; L341-T344 PolarHBondContact O-N 2.94Å; L341-T344 PolarHBondContact O-OG1 3.48Å; L341-L345 HydrophobicContact CD1-CG 4.48Å; L341-L345 HydrophobicContact CG-CD1 4.18Å; L341-L345 WeakPolarHBondContact O-CB 3.44Å; L341-L345 VanDerWaalsContact O-CG 3.28Å; L341-L345 WeakPolarHBondContact O-CG 3.32Å; L341-L345 PolarHBondContact O-N 3.14Å
342L91Very high85.9Confident29 Ų2956 Ų5615%0.15232%0.318CS..Hα-helixtrans-63.5-35.8176-69.2179.8000111.7L214 W215 L218 L338 G339 L345 Y346L214-L342 HydrophobicContact CB-CD1 4.18Å; L214-L342 HydrophobicContact CD2-CD1 3.57Å; L214-L342 HydrophobicContact CG-CD1 3.6Å; W215-L342 HydrophobicContact CB-CB 3.74Å; L218-L342 HydrophobicContact CD1-CD1 3.74Å; L338-L342 WeakPolarHBondContact O-CG 3.38Å; L338-L342 PolarHBondContact O-N 3.38Å; G339-L342 PolarHBondContact O-N 3.47Å; L342-L345 HydrophobicContact CD2-CD1 4.39Å; L342-L345 PolarHBondContact O-N 2.94Å; L342-Y346 WeakPolarHBondContact O-CB 3.41Å; L342-Y346 PolarHBondContact O-N 3.36Å
343K89.1Confident84.2Confident11 Ų1158.1 Ų58.15%0.04833%0.332CS..Hα-helixtrans-57.7-53.8170.9-172.9-177.9-166.3171.10111W215 S294 H298 G339 L340 L341 L345 Y346 Y347W215-K343 HydrophobicContact CD2-CB 3.96Å; W215-K343 HydrophobicContact CD2-CG 4.1Å; W215-K343 HydrophobicContact CE3-CB 3.32Å; W215-K343 HydrophobicContact CE3-CD 3.62Å; W215-K343 HydrophobicContact CE3-CG 3.33Å; W215-K343 HydrophobicContact CH2-CD 3.99Å; W215-K343 HydrophobicContact CH2-CG 3.92Å; W215-K343 HydrophobicContact CZ3-CB 3.84Å; W215-K343 HydrophobicContact CZ3-CD 3.17Å; W215-K343 HydrophobicContact CZ3-CG 3.27Å; S294-K343 PolarHBondContact OG-NZ 3.36Å; H298-K343 PolarHBondContact CE1-NZ 2.91Å; H298-K343 PolarHBondContact NE2-NZ 3.31Å; G339-K343 WeakPolarHBondContact O-CB 3.4Å; G339-K343 PolarHBondContact O-N 3.44Å; L340-K343 VanDerWaalsContact O-CB 3.3Å; L340-K343 WeakPolarHBondContact O-CB 3.26Å; L340-K343 PolarHBondContact O-N 3.39Å; L341-K343 VanDerWaalsContact C-N 3.26Å; L341-K343 PolarHBondContact O-N 3.47Å; K343-L345 VanDerWaalsContact C-N 3.32Å; K343-L345 PolarHBondContact O-N 2.94Å; K343-Y346 WeakPolarHBondContact O-CB 3.33Å; K343-Y346 PolarHBondContact O-N 2.96Å; K343-Y346 VanDerWaalsContact O-N 3.16Å; K343-Y347 HydrophobicContact CG-CD2 3.86Å; K343-Y347 HydrophobicContact CG-CE2 3.84Å; K343-Y347 VanDerWaalsContact O-CD2 3.29Å; K343-Y347 WeakPolarHBondContact O-CD2 3.4Å; K343-Y347 PolarHBondContact O-N 3.48Å
344T86.4Confident82.2Confident75 Ų7558.3 Ų58.346%0.4633%0.33SS..Hα-helixtrans-62.7-41.6-177.555.40000111L340 L341 Y346 Y347 C348L340-T344 WeakPolarHBondContact O-CG2 3.45Å; L340-T344 PolarHBondContact O-N 2.99Å; L340-T344 PolarHBondContact O-OG1 3.37Å; L341-T344 PolarHBondContact O-N 2.94Å; L341-T344 PolarHBondContact O-OG1 3.48Å; T344-Y346 VanDerWaalsContact C-N 3.33Å; T344-Y346 PolarHBondContact O-N 2.9Å; T344-Y347 PolarHBondContact O-N 3.43Å; T344-C348 WeakPolarHBondContact O-CB 3.36Å; T344-C348 PolarHBondContact O-N 3.49Å; T344-C348 PolarHBondContact O-SG 2.89Å
345L85.9Confident79.7Confident90 Ų9058.3 Ų58.347%0.47134%0.335SS..Hα-helixtrans-59.1-42.2173.4-69.3173.5000112.4L341 L342 K343 C348 G349L341-L345 HydrophobicContact CD1-CG 4.48Å; L341-L345 HydrophobicContact CG-CD1 4.18Å; L341-L345 WeakPolarHBondContact O-CB 3.44Å; L341-L345 VanDerWaalsContact O-CG 3.28Å; L341-L345 WeakPolarHBondContact O-CG 3.32Å; L341-L345 PolarHBondContact O-N 3.14Å; L342-L345 HydrophobicContact CD2-CD1 4.39Å; L342-L345 PolarHBondContact O-N 2.94Å; K343-L345 VanDerWaalsContact C-N 3.32Å; K343-L345 PolarHBondContact O-N 2.94Å; L345-C348 PolarHBondContact O-N 3.04Å; L345-G349 PolarHBondContact O-N 3.4Å
346Y83.9Confident77.1Confident0 Ų062.8 Ų62.80%035%0.346CS..Hα-helixtrans-59.8-48.4174.9178.4-86.8000111.8H191 R195 S208 V211 Y212 L342 K343 T344 C348 F350 H351H191-Y346 PolarHBondContact CE1-OH 3.25Å; H191-Y346 PolarHBondContact NE2-OH 3.44Å; R195-Y346 PolarHBondContact NH2-OH 2.59Å; S208-Y346 WeakPolarHBondContact OG-CE2 3.35Å; V211-Y346 HydrophobicContact CB-CD2 4.5Å; V211-Y346 HydrophobicContact CG1-CD2 4.13Å; Y212-Y346 HydrophobicContact CD2-CD1 4.49Å; Y212-Y346 HydrophobicContact CD2-CD2 4.37Å; Y212-Y346 HydrophobicContact CD2-CE1 4.01Å; Y212-Y346 AromaticContact CD2-CE2 3.85Å; Y212-Y346 HydrophobicContact CD2-CE2 3.85Å; Y212-Y346 AromaticContact CD2-CZ 3.68Å; Y212-Y346 HydrophobicContact CE2-CE1 4.39Å; Y212-Y346 HydrophobicContact CG-CE2 4.44Å; L342-Y346 WeakPolarHBondContact O-CB 3.41Å; L342-Y346 PolarHBondContact O-N 3.36Å; K343-Y346 WeakPolarHBondContact O-CB 3.33Å; K343-Y346 PolarHBondContact O-N 2.96Å; K343-Y346 VanDerWaalsContact O-N 3.16Å; T344-Y346 VanDerWaalsContact C-N 3.33Å; T344-Y346 PolarHBondContact O-N 2.9Å; Y346-C348 VanDerWaalsContact C-N 3.34Å; Y346-C348 PolarHBondContact O-N 3.19Å; Y346-F350 HydrophobicContact CD2-CB 3.89Å; Y346-F350 HydrophobicContact CE2-CB 4.09Å; Y346-F350 HydrophobicContact CG-CB 4.38Å; Y346-F350 CarbonylContact O-C 3.5Å; Y346-F350 WeakPolarHBondContact O-CA 3.44Å; Y346-F350 WeakPolarHBondContact O-CB 3.36Å; Y346-F350 PolarHBondContact O-N 2.61Å; Y346-H351 HydrophobicContact CE1-CB 4.2Å; Y346-H351 PolarHBondContact O-N 3.45Å
347Y77.4Confident74.5Confident73 Ų7367.2 Ų67.229%0.28638%0.376SS..Hα-helixtrans-70.2-29179.7-79.5-84.3000113.4W215 K343 T344 H351 F398W215-Y347 HydrophobicContact CH2-CE2 4.44Å; K343-Y347 HydrophobicContact CG-CD2 3.86Å; K343-Y347 HydrophobicContact CG-CE2 3.84Å; K343-Y347 VanDerWaalsContact O-CD2 3.29Å; K343-Y347 WeakPolarHBondContact O-CD2 3.4Å; K343-Y347 PolarHBondContact O-N 3.48Å; T344-Y347 PolarHBondContact O-N 3.43Å; Y347-H351 HydrophobicContact CD1-CB 4.09Å; Y347-H351 AromaticContact CD1-CD2 3.51Å; Y347-H351 AromaticContact CD1-CG 3.81Å; Y347-H351 AromaticContact CE1-CD2 3.34Å; Y347-H351 WeakPolarHBondContact CE1-CD2 3.28Å; Y347-H351 AromaticContact CE1-NE2 3.71Å; Y347-F398 HydrophobicContact CE1-CZ 4.48Å; Y347-F398 WeakPolarHBondContact OH-CZ 3.48Å
348C77.9Confident71.7Confident116 Ų11670.1 Ų70.178%0.78439%0.391SS*.Hα-helixtrans-76-37.1176.6-70.90000113.1T344 L345 Y346T344-C348 WeakPolarHBondContact O-CB 3.36Å; T344-C348 PolarHBondContact O-N 3.49Å; T344-C348 PolarHBondContact O-SG 2.89Å; L345-C348 PolarHBondContact O-N 3.04Å; Y346-C348 VanDerWaalsContact C-N 3.34Å; Y346-C348 PolarHBondContact O-N 3.19Å
349G69.6Low69Low61 Ų6172.7 Ų72.763%0.62941%0.406SS*.Hα-helixtrans-118.1-23.7-16900000116.6L345L345-G349 PolarHBondContact O-N 3.4Å
350F66.6Low66Low95 Ų9584.3 Ų84.342%0.41745%0.45SS..THydrogen-bonded Turntrans-124-5.7-168.4-65.8-79.3000114.7R195 Y346 P352R195-F350 PolarHBondContact NH2-O 2.87Å; Y346-F350 HydrophobicContact CD2-CB 3.89Å; Y346-F350 HydrophobicContact CE2-CB 4.09Å; Y346-F350 HydrophobicContact CG-CB 4.38Å; Y346-F350 CarbonylContact O-C 3.5Å; Y346-F350 WeakPolarHBondContact O-CA 3.44Å; Y346-F350 WeakPolarHBondContact O-CB 3.36Å; Y346-F350 PolarHBondContact O-N 2.61Å; F350-P352 VanDerWaalsContact O-CD 3.28Å; F350-P352 WeakPolarHBondContact O-CD 3.47Å
351H68Low62.9Low34 Ų3489.3 Ų89.316%0.15748%0.476CS..  trans-84.7112.6-179-173.2-79.7000111.4Y346 Y347 F398 Y399Y346-H351 HydrophobicContact CE1-CB 4.2Å; Y346-H351 PolarHBondContact O-N 3.45Å; Y347-H351 HydrophobicContact CD1-CB 4.09Å; Y347-H351 AromaticContact CD1-CD2 3.51Å; Y347-H351 AromaticContact CD1-CG 3.81Å; Y347-H351 AromaticContact CE1-CD2 3.34Å; Y347-H351 WeakPolarHBondContact CE1-CD2 3.28Å; Y347-H351 AromaticContact CE1-NE2 3.71Å; H351-F398 AromaticContact CD2-CE1 3.58Å; H351-F398 PolarHBondContact CE1-O 3.22Å; H351-F398 AromaticContact NE2-CD1 3.49Å; H351-F398 WeakPolarHBondContact NE2-CD1 3.44Å; H351-F398 AromaticContact NE2-CE1 3.24Å; H351-F398 WeakPolarHBondContact NE2-CE1 3.45Å; H351-F398 PolarHBondContact NE2-O 3.32Å; H351-Y399 AromaticContact CE1-CD1 3.88Å; H351-Y399 AromaticContact NE2-CD1 3.94Å
352P64.5Low60.1Low41 Ų4190.4 Ų90.427%0.26649%0.489SS..  trans-70.3136.8176.629.2-33.4000109L198 F350 Y399L198-P352 HydrophobicContact CD2-CB 4.02Å; L198-P352 HydrophobicContact CD2-CG 4.08Å; F350-P352 VanDerWaalsContact O-CD 3.28Å; F350-P352 WeakPolarHBondContact O-CD 3.47Å; P352-Y399 HydrophobicContact CG-CD1 3.84Å; P352-Y399 HydrophobicContact CG-CE1 3.64Å; P352-Y399 WeakPolarHBondContact O-CD1 3.35Å
353T59.4Low57.4Low68 Ų6896.7 Ų96.742%0.41752%0.517SS..  trans-111.3125.3178.547.20000109.2D401T353-D401 HydrophobicContact CG2-CB 3.99Å
354L53.7Low54.8Low57 Ų57103.4 Ų103.430%0.29855%0.554SS.*BIsolated β-bridgetrans-83.6130.2168.5-92.499000110L198 Y399L198-L354 HydrophobicContact CD2-CD1 3.24Å; L198-L354 HydrophobicContact CD2-CG 4.38Å; L198-L354 HydrophobicContact CG-CD1 3.62Å; L354-Y399 HydrophobicContact CD1-CG 4.47Å; L354-Y399 PolarHBondContact N-O 3.24Å
355P42.7Very low52.2Low96 Ų96106.4 Ų106.462%0.62357%0.566SS**PPolyproline II helixtrans-63.8134.1161-13.627.9000109.7
356R41.6Very low49.5Very low138 Ų138107.3 Ų107.352%0.52158%0.578SS.*PPolyproline II helixtrans-63.7139.3169.5-139.9-177.5-161.1-166.63.1109L358R356-L358 PolarHBondContact O-N 2.93Å
357P38.8Very low47.2Very low108 Ų108115.5 Ų115.570%0.70162%0.621SS**PPolyproline II helixtrans-58134.1159.7-16.129.3000108.1D359P357-D359 PolarHBondContact O-N 3.49Å
358L36Very low45.1Very low164 Ų164116.7 Ų116.786%0.85964%0.64SS**PPolyproline II helixtrans-63.3122.4173.4-92124.3000108.7R356 R360R356-L358 PolarHBondContact O-N 2.93Å; L358-R360 PolarHBondContact O-N 3.48Å
359D39.3Very low42.7Very low136 Ų136118.4 Ų118.473%0.72764%0.642SS**PPolyproline II helixtrans-56.7118.7165.4-67.7-42.9000107.7P357P357-D359 PolarHBondContact O-N 3.49Å
360R29.7Very low40.9Very low245 Ų245123 Ų12393%0.92566%0.657SS**PPolyproline II helixtrans-77.9137.1164.4-111.8-179.7175.6159.5-2.7107.3L358L358-R360 PolarHBondContact O-N 3.48Å
361D28.3Very low39Very low145 Ų145121.9 Ų121.978%0.77567%0.666SS**PPolyproline II helixtrans-49.6143.1-176.1-111.8-42.2000113.1H363D361-H363 VanDerWaalsContact C-N 3.27Å; D361-H363 PolarHBondContact O-N 3.33Å
362P33Very low37Very low116 Ų116126.1 Ų126.175%0.75370%0.699SS**SBendtrans-77.9-2.2-175.1-8.826.3000114.9D364P362-D364 PolarHBondContact O-N 3.25Å
363H33.4Very low35.2Very low161 Ų161134.4 Ų134.475%0.74573%0.725SS**  trans-10181.9-178.6-72.9-57.7000110.1D361D361-H363 VanDerWaalsContact C-N 3.27Å; D361-H363 PolarHBondContact O-N 3.33Å
364D34Very low33.7Very low153 Ų153134.5 Ų134.582%0.81873%0.733SS**SBendtrans173.187.3149.4-87.3-22.2000108.6P362P362-D364 PolarHBondContact O-N 3.25Å
365L32.5Very low32.3Very low137 Ų137139.1 Ų139.172%0.71776%0.757SS**  trans179.9142.2145.3-94.1144.5000110.4
366P29.9Very low31.5Very low109 Ų109140.1 Ų140.171%0.70876%0.764SS**  trans-77152.1-1763.513.4000112.5S368P366-S368 PolarHBondContact O-N 3.42Å
367D35.4Very low30.9Very low172 Ų172138.9 Ų138.992%0.9277%0.766SS**SBendtrans-61.694.6176.8-70-45.7000112.6
368S33Very low30.3Very low98 Ų98142.8 Ų142.869%0.68578%0.775SS**SBendtrans-163.8125.4153.853.50000109.1P366P366-S368 PolarHBondContact O-N 3.42Å
369D27Very low29.9Very low153 Ų153142.4 Ų142.482%0.81877%0.774SS**  trans72.489176.1-56-30.4000117.2A371D369-A371 PolarHBondContact O-N 2.87Å
370V31.3Very low29.1Very low156 Ų156146.8 Ų146.895%0.94578%0.78SS**  trans-73.973.8161.9-175.30000108.8
371A27Very low29.3Very low73 Ų73140.3 Ų140.360%0.60378%0.78SS**  trans-93.6115.1160.400000108.2D369 R373D369-A371 PolarHBondContact O-N 2.87Å; A371-R373 PolarHBondContact O-N 3.21Å
372S27.1Very low29.5Very low123 Ų123138.1 Ų138.186%0.8677%0.773SS**  trans-44.8104.6173.2-46.80000110.9A374S372-A374 PolarHBondContact O-N 2.89Å
373R26.9Very low29.3Very low214 Ų214136.6 Ų136.681%0.80877%0.77SS**PPolyproline II helixtrans-76.4124.8-174.2-88.9-178-179.5165.12.2112A371A371-R373 PolarHBondContact O-N 3.21Å
374A27Very low29.4Very low71 Ų71133.6 Ų133.659%0.58777%0.773SS**PPolyproline II helixtrans-57.3149173.300000113.7S372 I377S372-A374 PolarHBondContact O-N 2.89Å; A374-I377 HydrophobicContact CB-CD1 3.86Å; A374-I377 HydrophobicContact CB-CG1 4.35Å
375L25.4Very low30.1Very low154 Ų154131.7 Ų131.781%0.80676%0.763SS**SBendtrans-50.1147.4152.6-77.6154.6000109.5I377L375-I377 PolarHBondContact O-N 3.41Å
376P25.1Very low31.4Very low116 Ų116127.1 Ų127.175%0.75374%0.739SS**  trans-59.7113.5-167.424.7-33.6000111.2
377I29.8Very low32.8Very low112 Ų112126.2 Ų126.257%0.57473%0.727SS**  trans-89.3116.7174.9-67.5168.6000106.8A374 L375A374-I377 HydrophobicContact CB-CD1 3.86Å; A374-I377 HydrophobicContact CB-CG1 4.35Å; L375-I377 PolarHBondContact O-N 3.41Å
378Q24.8Very low34.3Very low190 Ų190118.1 Ų118.189%0.88868%0.684SS**  trans-80.8130.5157-165.1162.222.200107.1R380Q378-R380 PolarHBondContact O-N 2.97Å
379D27.8Very low36Very low157 Ų157120.8 Ų120.884%0.8469%0.686SS**SBendtrans-45.2101.8-169.3-70.8-51.5000115.5
380R22.7Very low38.2Very low227 Ų227114.6 Ų114.686%0.85765%0.651SS**SBendtrans-174.2111.1144.1-117.6-180-177.3174.51.9106.8Q378 P382Q378-R380 PolarHBondContact O-N 2.97Å; R380-P382 WeakPolarHBondContact O-CD 3.42Å; R380-P382 WeakPolarHBondContact O-CG 3.41Å
381A34.8Very low40Very low110 Ų110107.3 Ų107.391%0.90961%0.607SS**  trans-47.8109179.400000111.6
382P30.6Very low41.5Very low99 Ų99105 Ų10564%0.64359%0.587SS**  trans-92.1143.7164.29.912.6000107.3R380 A384R380-P382 WeakPolarHBondContact O-CD 3.42Å; R380-P382 WeakPolarHBondContact O-CG 3.41Å; P382-A384 PolarHBondContact O-N 3.48Å
383A30.1Very low43.5Very low84 Ų84101.2 Ų101.269%0.69456%0.56SS**  trans-43.7130.7169.600000109.9L385A383-L385 PolarHBondContact O-N 2.93Å
384A36Very low45.5Very low97 Ų9791.2 Ų91.280%0.80252%0.523SS*.  trans-53112178.400000108.7P382 L386P382-A384 PolarHBondContact O-N 3.48Å; A384-L386 PolarHBondContact O-N 3.26Å; A384-L386 VanDerWaalsContact O-N 3.11Å
385L48.5Very low47.3Very low114 Ų11488.1 Ų88.160%0.59750%0.497SS*.  trans-54118.5-178.1-157.899000108.1E130 A383 L387E130-L385 WeakPolarHBondContact OE1-CD1 3.17Å; A383-L385 PolarHBondContact O-N 2.93Å; L385-L387 HydrophobicContact CD2-CB 4.47Å; L385-L387 HydrophobicContact CD2-CD1 4.19Å; L385-L387 PolarHBondContact O-N 2.84Å
386L58.2Low49.3Very low41 Ų4182.6 Ų82.622%0.21547%0.474CS..  trans-74.172-177.1-151.5149.8000109.1Y131 Y134 A384Y131-L386 HydrophobicContact CD2-CD1 4.41Å; Y131-L386 HydrophobicContact CD2-CD2 4.48Å; Y134-L386 HydrophobicContact CD1-CD2 4.34Å; Y134-L386 HydrophobicContact CD2-CD2 3.49Å; Y134-L386 VanDerWaalsContact CD2-CD2 3.49Å; Y134-L386 HydrophobicContact CE2-CD2 3.96Å; Y134-L386 HydrophobicContact CG-CD2 3.72Å; A384-L386 PolarHBondContact O-N 3.26Å; A384-L386 VanDerWaalsContact O-N 3.11Å
387L60.9Low51.4Low90 Ų9078.1 Ų78.147%0.47144%0.443SS..  trans-83.7125.9-174.1-170.672.3000109.6F197 L385 Q389 A392F197-L387 HydrophobicContact CD1-CD1 3.8Å; F197-L387 HydrophobicContact CE1-CD1 3.61Å; F197-L387 HydrophobicContact CE1-CG 4.15Å; L385-L387 HydrophobicContact CD2-CB 4.47Å; L385-L387 HydrophobicContact CD2-CD1 4.19Å; L385-L387 PolarHBondContact O-N 2.84Å; L387-Q389 PolarHBondContact O-N 2.9Å; L387-A392 HydrophobicContact CD2-CB 4.34Å
388N66.9Low53.1Low2 Ų273.9 Ų73.91%0.01142%0.42CS..  trans-69.495.8173.8-169.8-40.1000109.9Y134 D138 F197 R390 M391 A392Y134-N388 HydrophobicContact CD2-CB 3.5Å; Y134-N388 HydrophobicContact CE2-CB 3.61Å; Y134-N388 HydrophobicContact CG-CB 4.38Å; D138-N388 PolarHBondContact OD1-ND2 2.79Å; F197-N388 HydrophobicContact CZ-CB 4.26Å; N388-R390 PolarHBondContact O-N 3.38Å; N388-R390 WeakPolarHBondContact OD1-CB 3.22Å; N388-R390 PolarHBondContact OD1-N 3.01Å; N388-M391 HydrophobicContact CB-CB 4.27Å; N388-M391 PolarHBondContact O-N 3.21Å; N388-M391 PolarHBondContact OD1-N 3.34Å; N388-M391 VanDerWaalsContact OD1-N 3.08Å; N388-A392 WeakPolarHBondContact O-CB 3.31Å; N388-A392 PolarHBondContact O-N 3.19Å
389Q67.6Low55.1Low153 Ų15365 Ų6572%0.71538%0.379SS*.Hα-helixtrans-58.7-35.4-176.8-68.4-175.4-5.200112.4L387 A392 C393L387-Q389 PolarHBondContact O-N 2.9Å; Q389-A392 PolarHBondContact O-N 3.42Å; Q389-C393 WeakPolarHBondContact O-CB 3.38Å; Q389-C393 PolarHBondContact O-N 3.43Å
390R74.8Confident56.8Low24 Ų2460.7 Ų60.79%0.09136%0.358CS..Hα-helixtrans-66.1-47.6-179.4-53.4-179.3-172.7120.221.8111.4W68 Y71 D72 F260 D262 N388 C393 H394W68-R390 VanDerWaalsContact CD1-NH1 3.3Å; W68-R390 VanDerWaalsContact CG-NH1 3.29Å; Y71-R390 VanDerWaalsContact CD2-NH2 3.3Å; D72-R390 IonicContact OD1-CZ 3.62Å; D72-R390 IonicContact OD1-NH1 3.16Å; D72-R390 PolarHBondContact OD1-NH1 2.88Å; D72-R390 IonicContact OD1-NH2 3.65Å; D72-R390 PolarHBondContact OD1-NH2 2.87Å; D72-R390 VanDerWaalsContact OD1-NH2 3.16Å; F260-R390 HydrophobicContact CD2-CB 4.09Å; F260-R390 HydrophobicContact CE2-CB 3.59Å; F260-R390 HydrophobicContact CZ-CB 4.16Å; D262-R390 IonicContact OD2-NH2 2.67Å; N388-R390 PolarHBondContact O-N 3.38Å; N388-R390 WeakPolarHBondContact OD1-CB 3.22Å; N388-R390 PolarHBondContact OD1-N 3.01Å; R390-C393 WeakPolarHBondContact O-CB 3.29Å; R390-C393 PolarHBondContact O-N 3.16Å; R390-H394 PolarHBondContact O-N 2.88Å
391M67.2Low58.3Low3 Ų353.6 Ų53.62%0.01534%0.337CS..Hα-helixtrans-72.1-32.7176.2-76.9-139.753.600112.8H137 Y190 L194 F197 N388 C393 H394 A395H137-M391 VanDerWaalsContact CA-SD 3.51Å; H137-M391 HydrophobicContact CB-CG 4.15Å; H137-M391 HydrophobicContact CB-SD 3.36Å; H137-M391 WeakPolarHBondContact CB-SD 3.28Å; Y190-M391 HydrophobicContact CD2-CE 4.24Å; Y190-M391 HydrophobicContact CE2-CE 3.83Å; L194-M391 HydrophobicContact CD2-CE 3.41Å; L194-M391 VanDerWaalsContact CD2-CE 3.41Å; L194-M391 HydrophobicContact CG-CE 3.83Å; F197-M391 HydrophobicContact CE2-CB 3.59Å; F197-M391 HydrophobicContact CE2-CE 4.38Å; F197-M391 HydrophobicContact CZ-CB 3.49Å; F197-M391 VanDerWaalsContact CZ-CB 3.49Å; N388-M391 HydrophobicContact CB-CB 4.27Å; N388-M391 PolarHBondContact O-N 3.21Å; N388-M391 PolarHBondContact OD1-N 3.34Å; N388-M391 VanDerWaalsContact OD1-N 3.08Å; M391-C393 VanDerWaalsContact C-N 3.29Å; M391-C393 PolarHBondContact O-N 3.23Å; M391-H394 PolarHBondContact O-N 3.36Å; M391-A395 WeakPolarHBondContact O-CB 3.03Å; M391-A395 PolarHBondContact O-N 3.05Å
392A60.2Low58.8Low24 Ų2457.8 Ų57.820%0.19833%0.329CS..Hα-helixtrans-61.3-39.1171.800000111.7F197 L387 N388 Q389 A395 A396F197-A392 HydrophobicContact CD1-CB 3.74Å; F197-A392 HydrophobicContact CE1-CB 3.72Å; L387-A392 HydrophobicContact CD2-CB 4.34Å; N388-A392 WeakPolarHBondContact O-CB 3.31Å; N388-A392 PolarHBondContact O-N 3.19Å; Q389-A392 PolarHBondContact O-N 3.42Å; A392-A395 PolarHBondContact O-N 2.91Å; A392-A396 WeakPolarHBondContact O-CB 3.47Å; A392-A396 PolarHBondContact O-N 2.8Å
393C68.5Low59.3Low44 Ų4461.8 Ų61.830%0.29733%0.332SS..Hα-helixtrans-60.6-49.2174.7177.60000111.5Q389 R390 M391 A395 A396 H397Q389-C393 WeakPolarHBondContact O-CB 3.38Å; Q389-C393 PolarHBondContact O-N 3.43Å; R390-C393 WeakPolarHBondContact O-CB 3.29Å; R390-C393 PolarHBondContact O-N 3.16Å; M391-C393 VanDerWaalsContact C-N 3.29Å; M391-C393 PolarHBondContact O-N 3.23Å; C393-A395 VanDerWaalsContact C-N 3.33Å; C393-A395 PolarHBondContact O-N 3.36Å; C393-A396 WeakPolarHBondContact O-CB 3.45Å; C393-A396 PolarHBondContact O-N 3.29Å; C393-H397 PolarHBondContact O-CD2 3.26Å; C393-H397 VanDerWaalsContact O-CG 3.24Å; C393-H397 PolarHBondContact O-N 3.33Å; C393-H397 PolarHBondContact SG-CE1 3.39Å; C393-H397 PolarHBondContact SG-NE2 3.2Å
394H68.8Low59.6Low4 Ų466.2 Ų66.22%0.01933%0.33CS..Hα-helixtrans-60.5-39.5173.5-92.2-68.9000113.6Y190 L194 F260 Y270 F283 N284 R390 M391 A396 H397 F398Y190-H394 VanDerWaalsContact OH-CG 3.3Å; L194-H394 HydrophobicContact CD2-CB 3.47Å; L194-H394 VanDerWaalsContact CD2-CB 3.47Å; F260-H394 AromaticContact CD2-CD2 3.61Å; F260-H394 AromaticContact CD2-NE2 3.68Å; F260-H394 AromaticContact CE2-CD2 3.51Å; F260-H394 AromaticContact CE2-NE2 3.81Å; Y270-H394 AromaticContact CZ-NE2 3.76Å; Y270-H394 PolarHBondContact OH-CE1 3.02Å; Y270-H394 PolarHBondContact OH-NE2 2.97Å; F283-H394 AromaticContact CE1-CE1 3.6Å; F283-H394 AromaticContact CZ-CE1 3.77Å; N284-H394 PolarHBondContact O-ND1 3.32Å; R390-H394 PolarHBondContact O-N 2.88Å; M391-H394 PolarHBondContact O-N 3.36Å; H394-A396 VanDerWaalsContact C-N 3.33Å; H394-H397 PolarHBondContact O-N 2.6Å; H394-F398 WeakPolarHBondContact O-CB 3.47Å; H394-F398 PolarHBondContact O-N 3.04Å
395A64.2Low59.7Low6 Ų665 Ų655%0.0532%0.32CS..Hα-helixtrans-64.3-41.817800000110.5L194 F197 M391 A392 C393 H397 F398 Y399L194-A395 HydrophobicContact CB-CB 4.46Å; L194-A395 HydrophobicContact CD2-CB 4.16Å; L194-A395 WeakPolarHBondContact O-CB 3.47Å; F197-A395 HydrophobicContact CB-CB 3.76Å; F197-A395 HydrophobicContact CD2-CB 3.95Å; F197-A395 HydrophobicContact CG-CB 3.99Å; M391-A395 WeakPolarHBondContact O-CB 3.03Å; M391-A395 PolarHBondContact O-N 3.05Å; A392-A395 PolarHBondContact O-N 2.91Å; C393-A395 VanDerWaalsContact C-N 3.33Å; C393-A395 PolarHBondContact O-N 3.36Å; A395-H397 PolarHBondContact O-N 3.31Å; A395-F398 PolarHBondContact O-N 2.81Å; A395-Y399 HydrophobicContact CB-CD2 4.43Å; A395-Y399 WeakPolarHBondContact O-CD2 3.44Å; A395-Y399 PolarHBondContact O-N 3.38Å
396A67.3Low59.1Low38 Ų3869.8 Ų69.831%0.31433%0.33SS..Hα-helixtrans-60-44.7173.200000111.6A392 C393 H394 F398 Y399 T400A392-A396 WeakPolarHBondContact O-CB 3.47Å; A392-A396 PolarHBondContact O-N 2.8Å; C393-A396 WeakPolarHBondContact O-CB 3.45Å; C393-A396 PolarHBondContact O-N 3.29Å; H394-A396 VanDerWaalsContact C-N 3.33Å; A396-F398 PolarHBondContact O-N 3.46Å; A396-Y399 PolarHBondContact O-N 2.88Å; A396-T400 WeakPolarHBondContact O-CB 3.35Å; A396-T400 VanDerWaalsContact O-CG2 3.3Å; A396-T400 WeakPolarHBondContact O-CG2 3.48Å; A396-T400 PolarHBondContact O-N 3.4Å; A396-T400 PolarHBondContact O-OG1 2.84Å
397H69.6Low58.1Low22 Ų2271.7 Ų71.710%0.10235%0.352CS..Hα-helixtrans-62-32.2177.6-63.8-179.7000112.8N284 V285 E287 C393 H394 A395N284-H397 PolarHBondContact ND2-O 2.94Å; N284-H397 VanDerWaalsContact ND2-O 3.08Å; V285-H397 PolarHBondContact O-CE1 2.76Å; V285-H397 PolarHBondContact O-ND1 2.88Å; E287-H397 WeakPolarHBondContact CG-CD2 3.37Å; E287-H397 WeakPolarHBondContact CG-NE2 3.11Å; E287-H397 IonicContact OE1-CD2 3.68Å; E287-H397 IonicContact OE1-NE2 3.08Å; C393-H397 PolarHBondContact O-CD2 3.26Å; C393-H397 VanDerWaalsContact O-CG 3.24Å; C393-H397 PolarHBondContact O-N 3.33Å; C393-H397 PolarHBondContact SG-CE1 3.39Å; C393-H397 PolarHBondContact SG-NE2 3.2Å; H394-H397 PolarHBondContact O-N 2.6Å; A395-H397 PolarHBondContact O-N 3.31Å
398F66.4Low57Low23 Ų2377.5 Ų77.510%0.10137%0.368CS..Hα-helixtrans-82.2-40.9-177.6-163.5-86.6000112.4H191 Y212 N284 Y347 H351 H394 A395 A396H191-F398 AromaticContact CE1-CE1 3.44Å; H191-F398 VanDerWaalsContact CE1-CE1 3.44Å; H191-F398 WeakPolarHBondContact CE1-CE1 3.21Å; H191-F398 AromaticContact CE1-CZ 3.74Å; H191-F398 AromaticContact ND1-CE1 3.9Å; H191-F398 AromaticContact ND1-CZ 3.86Å; Y212-F398 HydrophobicContact CE2-CZ 4.28Å; N284-F398 HydrophobicContact CB-CD2 4.4Å; Y347-F398 HydrophobicContact CE1-CZ 4.48Å; Y347-F398 WeakPolarHBondContact OH-CZ 3.48Å; H351-F398 AromaticContact CD2-CE1 3.58Å; H351-F398 PolarHBondContact CE1-O 3.22Å; H351-F398 AromaticContact NE2-CD1 3.49Å; H351-F398 WeakPolarHBondContact NE2-CD1 3.44Å; H351-F398 AromaticContact NE2-CE1 3.24Å; H351-F398 WeakPolarHBondContact NE2-CE1 3.45Å; H351-F398 PolarHBondContact NE2-O 3.32Å; H394-F398 WeakPolarHBondContact O-CB 3.47Å; H394-F398 PolarHBondContact O-N 3.04Å; A395-F398 PolarHBondContact O-N 2.81Å; A396-F398 PolarHBondContact O-N 3.46Å
399Y67.3Low55.6Low3 Ų380.5 Ų80.51%0.01240%0.399CS..Hα-helixtrans-102.6-7.6-168.4-64.6-65.5000116.4H191 L194 R195 L198 H351 P352 L354 A395 A396H191-Y399 PolarHBondContact CE1-OH 2.87Å; L194-Y399 HydrophobicContact CB-CE2 4.49Å; R195-Y399 WeakPolarHBondContact CB-OH 3.5Å; R195-Y399 WeakPolarHBondContact CG-OH 3.36Å; L198-Y399 HydrophobicContact CD1-CD1 4.05Å; L198-Y399 HydrophobicContact CD1-CD2 3.49Å; L198-Y399 VanDerWaalsContact CD1-CD2 3.49Å; L198-Y399 HydrophobicContact CD1-CE1 3.9Å; L198-Y399 HydrophobicContact CD1-CE2 3.31Å; L198-Y399 HydrophobicContact CD1-CG 3.86Å; L198-Y399 HydrophobicContact CD2-CG 4.49Å; L198-Y399 HydrophobicContact CG-CD2 4.3Å; L198-Y399 HydrophobicContact CG-CG 4.47Å; H351-Y399 AromaticContact CE1-CD1 3.88Å; H351-Y399 AromaticContact NE2-CD1 3.94Å; P352-Y399 HydrophobicContact CG-CD1 3.84Å; P352-Y399 HydrophobicContact CG-CE1 3.64Å; P352-Y399 WeakPolarHBondContact O-CD1 3.35Å; L354-Y399 HydrophobicContact CD1-CG 4.47Å; L354-Y399 PolarHBondContact N-O 3.24Å; A395-Y399 HydrophobicContact CB-CD2 4.43Å; A395-Y399 WeakPolarHBondContact O-CD2 3.44Å; A395-Y399 PolarHBondContact O-N 3.38Å; A396-Y399 PolarHBondContact O-N 2.88Å
400T62.5Low54.3Low67 Ų6779.5 Ų79.541%0.41140%0.403SS..BIsolated β-bridgetrans-83.3123.1179.351.70000112.1A396A396-T400 WeakPolarHBondContact O-CB 3.35Å; A396-T400 VanDerWaalsContact O-CG2 3.3Å; A396-T400 WeakPolarHBondContact O-CG2 3.48Å; A396-T400 PolarHBondContact O-N 3.4Å; A396-T400 PolarHBondContact O-OG1 2.84Å
401D53.2Low52.4Low77 Ų7781.9 Ų81.941%0.41244%0.435SS..  trans-119.1133.3175.2-168.45.5000112.4T353 R403T353-D401 HydrophobicContact CG2-CB 3.99Å; D401-R403 PolarHBondContact OD1-N 2.79Å
402R45.6Very low50.9Low198 Ų19885.5 Ų85.575%0.74747%0.473SS*.  trans-82.7-12-178.9-112.3-178.5175.6177.5-1113.7R404 A405R402-R404 PolarHBondContact O-N 3.22Å; R402-R404 VanDerWaalsContact O-N 3.14Å; R402-A405 PolarHBondContact O-N 3.43Å; R402-A405 VanDerWaalsContact O-N 3.11Å
403R41.5Very low49.6Very low183 Ų18389 Ų8969%0.69150%0.502SS*.Hα-helixtrans-58.1-29.8-172.4-77.9-174-180-154.92.4114.3D401D401-R403 PolarHBondContact OD1-N 2.79Å
404R37.6Very low48Very low178 Ų17895.4 Ų95.467%0.67253%0.53SS*.Hα-helixtrans-83.9-18.2178.4-78.7-177.5176.4174.7-0.5115.3R402R402-R404 PolarHBondContact O-N 3.22Å; R402-R404 VanDerWaalsContact O-N 3.14Å
405A36.5Very low46.5Very low71 Ų71101 Ų10159%0.58757%0.567SS**Hα-helixtrans-70.7-35.6178.100000111.9R402 G409R402-A405 PolarHBondContact O-N 3.43Å; R402-A405 VanDerWaalsContact O-N 3.11Å; A405-G409 PolarHBondContact O-N 3.38Å
406R35.9Very low44.9Very low215 Ų215105.6 Ų105.681%0.81160%0.598SS**Hα-helixtrans-74.3-30.2177.5-98.7-177.4176.3-172.5-3114.1R408R406-R408 VanDerWaalsContact C-N 3.29Å; R406-R408 PolarHBondContact O-N 3.12Å
407A36.9Very low43.3Very low81 Ų81112.5 Ų112.567%0.66962%0.624SS**Hα-helixtrans-72.3-22.1179.500000113.2
408R38.2Very low41.5Very low212 Ų212120.8 Ų120.880%0.868%0.684SS**Hα-helixtrans-97.3-17.1177.1-72.1-176.7-179169.5-1.2114.3R406 V410R406-R408 VanDerWaalsContact C-N 3.29Å; R406-R408 PolarHBondContact O-N 3.12Å; R408-V410 VanDerWaalsContact C-N 3.35Å
409G38.7Very low40.3Very low65 Ų65125.7 Ų125.767%0.6771%0.713SS**THydrogen-bonded Turntrans-82.3-2.9178.500000115.8A405A405-G409 PolarHBondContact O-N 3.38Å
410V38.8Very low38.9Very low132 Ų132132.2 Ų132.280%0.875%0.75SS**THydrogen-bonded Turntrans-112.2-1.1-177.3-175.30000112.3R408R408-V410 VanDerWaalsContact C-N 3.35Å
411G34.5Very low37.6Very low74 Ų74135.8 Ų135.876%0.76377%0.769SS**SBendtrans-95.74.5-17700000116.4
412G35.7Very low36.6Very low78 Ų78139.2 Ų139.280%0.80479%0.79SS**  trans-123.658.9-169.700000113.7
413A34.1Very low36.1Very low98 Ų98135.6 Ų135.681%0.8179%0.793SS**  trans-147.683.3163.800000109.7
414M34.5Very low35.7Very low179 Ų179132.4 Ų132.488%0.88280%0.799SS**  trans-103.8122.3157.5-109.3-84.9-166.800106.2
415P36.6Very low35.6Very low122 Ų122129.1 Ų129.179%0.79281%0.809SS**  trans-97.7107.8155.518.4-2.3000108.7
416S31.5Very low35.5Very low102 Ų102133.6 Ų133.671%0.71383%0.826SS**  trans-77.9122.2158.852.90000109.2
417H33.8Very low35.5Very low183 Ų183126.8 Ų126.885%0.84783%0.827SS**  trans18.8120.6152.2-66.3-77.8000119.8
418S32.2Very low35.3Very low196 Ų196131 Ų131100%1.37184%0.841SS**  -161.60112.7-67.20000109

Retrieved 418 of 418 residues in 663.5 ms (Link to these results)

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