A0A096N7C3_PAPAN Loading...

Lysophosphatidic acid receptor 6

AlphaFold DB (A0A2K6ALR5), UniProt , Accession A0A096N7C3, Species PAPAN (Papio anubis, Olive baboon), Gene LPAR6, Length 344 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
1M28.9Very low50Low249 Ų249115.1 Ų115.1100%1.22764%0.637SS**  01200-78.2170171.700107.5
2V34.8Very low52Low87 Ų87114.8 Ų114.853%0.52763%0.633SS.*  trans-89.8107.1178.5178.40000106.8C263V2-C263 HydrophobicContact CG1-CB 4.37Å
3S34.4Very low53.9Low78 Ų78109.3 Ų109.355%0.54560%0.603SS.*  trans-91.7124.9173.352.80000109.6
4V41.8Very low56Low115 Ų115106.9 Ų106.970%0.69760%0.598SS**EExtended strand (participates in β ladder)trans-91.2117.9175.2179.20000107.6
5N43.6Very low58.2Low121 Ų121104.6 Ų104.665%0.64758%0.579SS**EExtended strand (participates in β ladder)trans-128.8131.9154.5-144.13.8000107.4S7 H8N5-S7 PolarHBondContact O-N 2.85Å; N5-H8 PolarHBondContact O-N 3.41Å
6S48.1Very low60.1Low104 Ų10499.9 Ų99.973%0.72755%0.551SS**THydrogen-bonded Turntrans-29.9121.7-168.3-400000114.7
7S53.2Low61.9Low119 Ų11996.4 Ų96.483%0.83253%0.528SS*.THydrogen-bonded Turntrans80.9-1217372.50000120.2N5N5-S7 PolarHBondContact O-N 2.85Å
8H59.4Low63.6Low137 Ų13796.6 Ų96.663%0.63453%0.532SS*.EExtended strand (participates in β ladder)trans-127.8108.1177.1-83.7-93.3000112.5N5 F10N5-H8 PolarHBondContact O-N 3.41Å; H8-F10 PolarHBondContact O-N 3.39Å
9C69.3Low65.2Low36 Ų3694 Ų9424%0.24352%0.517CS..EExtended strand (participates in β ladder)trans-73.3123.4168.8-53.90000109.1Y11 C263 V266C9-Y11 WeakPolarHBondContact O-CD1 3.26Å; C9-C263 HydrophobicContact CB-CB 3.77Å; C9-C263 WeakPolarHBondContact CB-SG 3.35Å; C9-C263 WeakPolarHBondContact SG-CA 3.37Å; C9-C263 WeakPolarHBondContact SG-CB 3.27Å; C9-C263 CovalentContact SG-SG 2.05Å; C9-C263 PolarHBondContact SG-SG 2.89Å; C9-V266 HydrophobicContact CB-CG1 4.48Å
10F66.7Low66.7Low140 Ų14090 Ų9061%0.61449%0.494SS*.  trans-81.5128.9176-66.6-86.3000110.9H8H8-F10 PolarHBondContact O-N 3.39Å
11Y69.9Low68Low80 Ų8086.2 Ų86.231%0.31448%0.476SS..  trans-145.7143.9175.265.1-74.9000108.7C9 D13 R270C9-Y11 WeakPolarHBondContact O-CD1 3.26Å; Y11-D13 WeakPolarHBondContact CD2-OD1 3.25Å; Y11-D13 WeakPolarHBondContact CE2-OD1 3.36Å; Y11-D13 WeakPolarHBondContact CE2-OD2 3.42Å; Y11-D13 PolarHBondContact OH-OD2 3.15Å; Y11-R270 HydrophobicContact CD2-CB 3.84Å; Y11-R270 HydrophobicContact CD2-CG 4.43Å; Y11-R270 HydrophobicContact CE2-CB 3.95Å; Y11-R270 HydrophobicContact CE2-CG 4.21Å; Y11-R270 PolarHBondContact OH-NH1 3.3Å
12N74.2Confident71.1Confident111 Ų11178 Ų7859%0.59444%0.442SS*.  trans-97109.7-176.6-175.93.7000110.1S14 F15N12-S14 WeakPolarHBondContact OD1-CB 3.42Å; N12-S14 PolarHBondContact OD1-N 3.4Å; N12-S14 PolarHBondContact OD1-OG 3.17Å; N12-F15 WeakPolarHBondContact O-CD1 3.29Å
13D76.6Confident74.1Confident44 Ų4476.6 Ų76.624%0.23543%0.431CS..  trans-89.1-5.6178.1-83.5-15.9000113.7Y11 F15 K16Y11-D13 WeakPolarHBondContact CD2-OD1 3.25Å; Y11-D13 WeakPolarHBondContact CE2-OD1 3.36Å; Y11-D13 WeakPolarHBondContact CE2-OD2 3.42Å; Y11-D13 PolarHBondContact OH-OD2 3.15Å; D13-F15 PolarHBondContact O-N 3.45Å; D13-F15 VanDerWaalsContact O-N 3.17Å; D13-K16 HydrophobicContact CB-CD 4.1Å; D13-K16 WeakPolarHBondContact O-CB 3.29Å; D13-K16 VanDerWaalsContact O-CD 3.3Å; D13-K16 WeakPolarHBondContact O-CD 3.32Å; D13-K16 WeakPolarHBondContact O-CG 3.49Å; D13-K16 PolarHBondContact O-N 3.48Å; D13-K16 VanDerWaalsContact O-N 3.07Å
14S83.2Confident77.1Confident76 Ų7673 Ų7353%0.53141%0.405SS..THydrogen-bonded Turntrans-64.2-28.3-168.9-470000113.2N12 K16 Y17N12-S14 WeakPolarHBondContact OD1-CB 3.42Å; N12-S14 PolarHBondContact OD1-N 3.4Å; N12-S14 PolarHBondContact OD1-OG 3.17Å; S14-K16 PolarHBondContact O-N 3.23Å; S14-Y17 WeakPolarHBondContact O-CD2 3.36Å; S14-Y17 PolarHBondContact O-N 3.14Å
15F89.6Confident79.7Confident72 Ų7269.7 Ų69.732%0.31639%0.387SS..Hα-helixtrans-64.4-23.3178.581.2-86.2000112.9N12 D13 Y17 T18 L19 T271 P274 I275N12-F15 WeakPolarHBondContact O-CD1 3.29Å; D13-F15 PolarHBondContact O-N 3.45Å; D13-F15 VanDerWaalsContact O-N 3.17Å; F15-Y17 PolarHBondContact O-N 3.13Å; F15-T18 PolarHBondContact O-N 3.09Å; F15-L19 HydrophobicContact CD2-CB 4.48Å; F15-L19 HydrophobicContact CD2-CD2 4.35Å; F15-L19 HydrophobicContact CE2-CD2 3.99Å; F15-L19 WeakPolarHBondContact O-CB 3.47Å; F15-L19 PolarHBondContact O-N 3.48Å; F15-T271 HydrophobicContact CE1-CG2 4.11Å; F15-T271 HydrophobicContact CZ-CG2 3.99Å; F15-T271 WeakPolarHBondContact CZ-O 3.04Å; F15-P274 HydrophobicContact CE2-CB 4.3Å; F15-P274 HydrophobicContact CZ-CB 4.36Å; F15-P274 HydrophobicContact CZ-CG 4.13Å; F15-I275 HydrophobicContact CE2-CG1 4.25Å
16K88.8Confident82.2Confident30 Ų3067.5 Ų67.513%0.1338%0.378CS..Hα-helixtrans-61.6-34.1-177.582.2-166.8171.9171.30111.8D13 S14 L19 Y20 E170 P274D13-K16 HydrophobicContact CB-CD 4.1Å; D13-K16 WeakPolarHBondContact O-CB 3.29Å; D13-K16 VanDerWaalsContact O-CD 3.3Å; D13-K16 WeakPolarHBondContact O-CD 3.32Å; D13-K16 WeakPolarHBondContact O-CG 3.49Å; D13-K16 PolarHBondContact O-N 3.48Å; D13-K16 VanDerWaalsContact O-N 3.07Å; S14-K16 PolarHBondContact O-N 3.23Å; K16-L19 PolarHBondContact O-N 3.06Å; K16-Y20 HydrophobicContact CB-CD2 4.32Å; K16-Y20 HydrophobicContact CB-CE2 4.09Å; K16-Y20 HydrophobicContact CG-CD2 4.41Å; K16-Y20 HydrophobicContact CG-CE2 4.25Å; K16-Y20 VanDerWaalsContact O-CB 3.28Å; K16-Y20 WeakPolarHBondContact O-CB 3.45Å; K16-Y20 WeakPolarHBondContact O-CD2 3.44Å; K16-Y20 PolarHBondContact O-N 2.9Å; K16-E170 VanDerWaalsContact CE-OE1 3.32Å; K16-E170 WeakPolarHBondContact CE-OE1 3.29Å; K16-E170 IonicContact NZ-OE1 3.14Å; K16-E170 PolarHBondContact NZ-OE1 3.48Å; K16-P274 HydrophobicContact CB-CB 4.04Å; K16-P274 HydrophobicContact CB-CG 3.86Å
17Y89.7Confident84.5Confident40 Ų4062.7 Ų62.716%0.15734%0.344CS..Hα-helixtrans-64.6-52-178.7-66.8-77.3000111S14 F15 L19 Y20 G21 F77 Q80 E170S14-Y17 WeakPolarHBondContact O-CD2 3.36Å; S14-Y17 PolarHBondContact O-N 3.14Å; F15-Y17 PolarHBondContact O-N 3.13Å; Y17-L19 PolarHBondContact O-N 3Å; Y17-Y20 PolarHBondContact O-N 2.91Å; Y17-G21 PolarHBondContact O-N 3.21Å; Y17-F77 HydrophobicContact CD1-CB 4.48Å; Y17-F77 AromaticContact CD1-CD1 3.82Å; Y17-F77 HydrophobicContact CD1-CD1 3.82Å; Y17-F77 HydrophobicContact CE1-CD1 4.16Å; Y17-Q80 HydrophobicContact CD1-CG 4.23Å; Y17-Q80 HydrophobicContact CE1-CG 4Å; Y17-E170 PolarHBondContact OH-OE1 3.3Å; Y17-E170 PolarHBondContact OH-OE2 2.84Å
18T92.8Very high86.6Confident100 Ų10059.7 Ų59.761%0.61332%0.317SS*.Hα-helixtrans-62-44.8175.7-500000111.4F15 G21 C22F15-T18 PolarHBondContact O-N 3.09Å; T18-G21 PolarHBondContact O-N 3.43Å; T18-C22 PolarHBondContact O-N 3.06Å; T18-C22 PolarHBondContact O-SG 3Å; T18-C22 VanDerWaalsContact O-SG 3.41Å
19L94Very high88.4Confident47 Ų4756.8 Ų56.825%0.24631%0.308CS..Hα-helixtrans-59.5-51.2179.3178.965.9000111.6F15 K16 Y17 C22 M23 P274 I275F15-L19 HydrophobicContact CD2-CB 4.48Å; F15-L19 HydrophobicContact CD2-CD2 4.35Å; F15-L19 HydrophobicContact CE2-CD2 3.99Å; F15-L19 WeakPolarHBondContact O-CB 3.47Å; F15-L19 PolarHBondContact O-N 3.48Å; K16-L19 PolarHBondContact O-N 3.06Å; Y17-L19 PolarHBondContact O-N 3Å; L19-C22 PolarHBondContact O-N 3.39Å; L19-M23 HydrophobicContact CD1-CG 3.78Å; L19-M23 HydrophobicContact CG-CG 4.34Å; L19-M23 VanDerWaalsContact O-CB 3.29Å; L19-M23 WeakPolarHBondContact O-CB 3.45Å; L19-M23 VanDerWaalsContact O-CG 3.26Å; L19-M23 WeakPolarHBondContact O-CG 3.25Å; L19-M23 PolarHBondContact O-N 2.88Å; L19-P274 HydrophobicContact CD2-CB 4.05Å; L19-I275 HydrophobicContact CD2-CG1 4.12Å
20Y94.3Very high89.7Confident14 Ų1459.6 Ų59.66%0.05532%0.32CS..Hα-helixtrans-64.1-41.8178.8-69.6-30.8000112.1K16 Y17 C22 F24 F77 P274 L277 C278K16-Y20 HydrophobicContact CB-CD2 4.32Å; K16-Y20 HydrophobicContact CB-CE2 4.09Å; K16-Y20 HydrophobicContact CG-CD2 4.41Å; K16-Y20 HydrophobicContact CG-CE2 4.25Å; K16-Y20 VanDerWaalsContact O-CB 3.28Å; K16-Y20 WeakPolarHBondContact O-CB 3.45Å; K16-Y20 WeakPolarHBondContact O-CD2 3.44Å; K16-Y20 PolarHBondContact O-N 2.9Å; Y17-Y20 PolarHBondContact O-N 2.91Å; Y20-C22 PolarHBondContact O-N 3.39Å; Y20-F24 HydrophobicContact CD1-CE1 4.19Å; Y20-F24 HydrophobicContact CD1-CE2 4.07Å; Y20-F24 AromaticContact CD1-CZ 3.67Å; Y20-F24 HydrophobicContact CD1-CZ 3.67Å; Y20-F24 HydrophobicContact CE1-CZ 4.21Å; Y20-F24 AromaticContact CG-CE2 3.92Å; Y20-F24 HydrophobicContact CG-CE2 3.92Å; Y20-F24 HydrophobicContact CG-CZ 4.01Å; Y20-F24 WeakPolarHBondContact O-CB 3.35Å; Y20-F24 WeakPolarHBondContact O-CD2 3.3Å; Y20-F24 VanDerWaalsContact O-CG 3.24Å; Y20-F24 WeakPolarHBondContact O-CG 3.35Å; Y20-F24 PolarHBondContact O-N 3.3Å; Y20-F77 AromaticContact CD2-CD1 3.59Å; Y20-F77 HydrophobicContact CD2-CD1 3.59Å; Y20-F77 HydrophobicContact CD2-CD2 4Å; Y20-F77 AromaticContact CD2-CE1 3.39Å; Y20-F77 HydrophobicContact CD2-CE1 3.39Å; Y20-F77 AromaticContact CD2-CE2 3.85Å; Y20-F77 HydrophobicContact CD2-CE2 3.85Å; Y20-F77 AromaticContact CD2-CG 3.91Å; Y20-F77 HydrophobicContact CD2-CG 3.91Å; Y20-F77 AromaticContact CD2-CZ 3.54Å; Y20-F77 HydrophobicContact CD2-CZ 3.54Å; Y20-F77 HydrophobicContact CE2-CD1 4.41Å; Y20-F77 AromaticContact CE2-CE1 3.79Å; Y20-F77 HydrophobicContact CE2-CE1 3.79Å; Y20-F77 HydrophobicContact CE2-CE2 4.45Å; Y20-F77 AromaticContact CE2-CZ 3.82Å; Y20-F77 HydrophobicContact CE2-CZ 3.82Å; Y20-F77 HydrophobicContact CG-CD1 4.45Å; Y20-F77 HydrophobicContact CG-CD2 4.26Å; Y20-F77 HydrophobicContact CG-CE1 4.49Å; Y20-F77 HydrophobicContact CG-CE2 4.33Å; Y20-F77 HydrophobicContact CG-CG 4.35Å; Y20-F77 HydrophobicContact CG-CZ 4.43Å; Y20-P274 HydrophobicContact CE1-CB 3.85Å; Y20-P274 HydrophobicContact CE2-CB 4.5Å; Y20-P274 VanDerWaalsContact OH-CA 3.3Å; Y20-P274 WeakPolarHBondContact OH-CA 3.4Å; Y20-P274 WeakPolarHBondContact OH-CB 3.38Å; Y20-L277 HydrophobicContact CE1-CD2 3.84Å; Y20-C278 VanDerWaalsContact CD1-SG 3.54Å
21G94.1Very high91.1Very high11 Ų1152.9 Ų52.911%0.11329%0.291CS..Hα-helixtrans-55.1-51.8175.200000112.1Y17 T18 S25Y17-G21 PolarHBondContact O-N 3.21Å; T18-G21 PolarHBondContact O-N 3.43Å; G21-S25 VanDerWaalsContact O-CB 3.26Å; G21-S25 WeakPolarHBondContact O-CB 3.47Å; G21-S25 PolarHBondContact O-N 2.92Å; G21-S25 PolarHBondContact O-OG 2.86Å
22C95.8Very high92.3Very high76 Ų7651.1 Ų51.151%0.51429%0.286SS..Hα-helixtrans-67.8-47.9179.9-66.20000112.9T18 L19 Y20 T26T18-C22 PolarHBondContact O-N 3.06Å; T18-C22 PolarHBondContact O-SG 3Å; T18-C22 VanDerWaalsContact O-SG 3.41Å; L19-C22 PolarHBondContact O-N 3.39Å; Y20-C22 PolarHBondContact O-N 3.39Å; C22-T26 PolarHBondContact O-N 2.75Å; C22-T26 PolarHBondContact O-OG1 3.06Å
23M96.6Very high93.3Very high58 Ų5850.8 Ų50.829%0.28628%0.284SS..Hα-helixtrans-69.8-45.2-175.1-69-60.3-65.700111.8L19 S25 T26 V27 C278L19-M23 HydrophobicContact CD1-CG 3.78Å; L19-M23 HydrophobicContact CG-CG 4.34Å; L19-M23 VanDerWaalsContact O-CB 3.29Å; L19-M23 WeakPolarHBondContact O-CB 3.45Å; L19-M23 VanDerWaalsContact O-CG 3.26Å; L19-M23 WeakPolarHBondContact O-CG 3.25Å; L19-M23 PolarHBondContact O-N 2.88Å; M23-S25 VanDerWaalsContact C-N 3.32Å; M23-S25 PolarHBondContact O-N 3.47Å; M23-T26 PolarHBondContact O-N 3.47Å; M23-V27 WeakPolarHBondContact O-CB 3.47Å; M23-V27 WeakPolarHBondContact O-CG2 3.33Å; M23-V27 PolarHBondContact O-N 3.4Å; M23-C278 HydrophobicContact CB-CB 4.11Å; M23-C278 HydrophobicContact CE-CB 4.15Å; M23-C278 HydrophobicContact CG-CB 3.97Å
24F96.7Very high94Very high2 Ų249.9 Ų49.91%0.00928%0.281CS..Hα-helixtrans-66.5-34.9177.7-64.3-17.5000112.1Y20 V27 F28 L70 R73 I74 F77 L277 V281Y20-F24 HydrophobicContact CD1-CE1 4.19Å; Y20-F24 HydrophobicContact CD1-CE2 4.07Å; Y20-F24 AromaticContact CD1-CZ 3.67Å; Y20-F24 HydrophobicContact CD1-CZ 3.67Å; Y20-F24 HydrophobicContact CE1-CZ 4.21Å; Y20-F24 AromaticContact CG-CE2 3.92Å; Y20-F24 HydrophobicContact CG-CE2 3.92Å; Y20-F24 HydrophobicContact CG-CZ 4.01Å; Y20-F24 WeakPolarHBondContact O-CB 3.35Å; Y20-F24 WeakPolarHBondContact O-CD2 3.3Å; Y20-F24 VanDerWaalsContact O-CG 3.24Å; Y20-F24 WeakPolarHBondContact O-CG 3.35Å; Y20-F24 PolarHBondContact O-N 3.3Å; F24-V27 PolarHBondContact O-N 2.93Å; F24-F28 WeakPolarHBondContact O-CB 3.39Å; F24-F28 PolarHBondContact O-N 3.16Å; F24-L70 HydrophobicContact CB-CD2 4.13Å; F24-L70 HydrophobicContact CD1-CD2 4.11Å; F24-L70 HydrophobicContact CG-CD2 4.01Å; F24-R73 HydrophobicContact CD2-CB 3.94Å; F24-R73 HydrophobicContact CE2-CB 4.14Å; F24-I74 HydrophobicContact CB-CD1 4.16Å; F24-I74 HydrophobicContact CB-CG1 3.61Å; F24-F77 HydrophobicContact CD2-CD2 4.16Å; F24-F77 HydrophobicContact CD2-CE2 4.45Å; F24-F77 AromaticContact CE2-CD2 3.82Å; F24-F77 HydrophobicContact CE2-CD2 3.82Å; F24-F77 AromaticContact CE2-CE2 3.7Å; F24-F77 HydrophobicContact CE2-CE2 3.7Å; F24-L277 HydrophobicContact CE1-CD2 3.92Å; F24-L277 HydrophobicContact CZ-CD2 3.78Å; F24-V281 HydrophobicContact CD1-CG1 3.94Å; F24-V281 HydrophobicContact CE1-CB 4.38Å; F24-V281 HydrophobicContact CE1-CG1 3.97Å; F24-V281 HydrophobicContact CE1-CG2 4.18Å
25S97.1Very high94.5Very high46 Ų4646.3 Ų46.332%0.32226%0.256SS..Hα-helixtrans-63.2-43.2173.4-60.60000111.6G21 M23 F28 V29G21-S25 VanDerWaalsContact O-CB 3.26Å; G21-S25 WeakPolarHBondContact O-CB 3.47Å; G21-S25 PolarHBondContact O-N 2.92Å; G21-S25 PolarHBondContact O-OG 2.86Å; M23-S25 VanDerWaalsContact C-N 3.32Å; M23-S25 PolarHBondContact O-N 3.47Å; S25-F28 PolarHBondContact O-N 3.1Å; S25-V29 WeakPolarHBondContact O-CG2 3.28Å; S25-V29 PolarHBondContact O-N 3.03Å; S25-V29 VanDerWaalsContact O-N 3.13Å
26T96.5Very high94.7Very high75 Ų7545.6 Ų45.646%0.4626%0.259SS..Hα-helixtrans-63.8-48.3177.4-57.10000111.2C22 M23 F28 V29 L30C22-T26 PolarHBondContact O-N 2.75Å; C22-T26 PolarHBondContact O-OG1 3.06Å; M23-T26 PolarHBondContact O-N 3.47Å; T26-F28 VanDerWaalsContact C-N 3.3Å; T26-F28 PolarHBondContact O-N 2.99Å; T26-V29 PolarHBondContact O-N 3.3Å; T26-L30 HydrophobicContact CG2-CD1 3.82Å; T26-L30 HydrophobicContact CG2-CG 4.39Å; T26-L30 WeakPolarHBondContact O-CB 3.31Å; T26-L30 WeakPolarHBondContact O-CG 3.34Å; T26-L30 PolarHBondContact O-N 3.23Å
27V96.8Very high94.8Very high2 Ų247.9 Ų47.91%0.01228%0.275CS..Hα-helixtrans-65.7-35.2179174.10000111.5M23 F24 G31 L70 V281 C284M23-V27 WeakPolarHBondContact O-CB 3.47Å; M23-V27 WeakPolarHBondContact O-CG2 3.33Å; M23-V27 PolarHBondContact O-N 3.4Å; F24-V27 PolarHBondContact O-N 2.93Å; V27-G31 VanDerWaalsContact O-CA 3.26Å; V27-G31 WeakPolarHBondContact O-CA 3.47Å; V27-G31 PolarHBondContact O-N 3.32Å; V27-L70 HydrophobicContact CB-CD1 4.15Å; V27-L70 HydrophobicContact CG1-CD1 3.8Å; V27-V281 HydrophobicContact CB-CG1 4.25Å; V27-V281 HydrophobicContact CG1-CG1 3.87Å; V27-V281 WeakPolarHBondContact CG1-O 3.44Å; V27-V281 HydrophobicContact CG2-CG1 4.15Å; V27-C284 HydrophobicContact CG1-CB 4.43Å
28F97.6Very high94.8Very high57 Ų5746.3 Ų46.325%0.2527%0.271CS..Hα-helixtrans-59.8-53.5174.8173.5-108.3000111.2F24 S25 T26 L32 V67 L70 P71 I74F24-F28 WeakPolarHBondContact O-CB 3.39Å; F24-F28 PolarHBondContact O-N 3.16Å; S25-F28 PolarHBondContact O-N 3.1Å; T26-F28 VanDerWaalsContact C-N 3.3Å; T26-F28 PolarHBondContact O-N 2.99Å; F28-L32 HydrophobicContact CE2-CD2 4.1Å; F28-L32 HydrophobicContact CZ-CD2 3.92Å; F28-L32 WeakPolarHBondContact O-CB 3.47Å; F28-L32 PolarHBondContact O-N 3.21Å; F28-V67 HydrophobicContact CD2-CG1 3.72Å; F28-V67 WeakPolarHBondContact CD2-O 3.09Å; F28-V67 HydrophobicContact CE2-CG1 4.26Å; F28-L70 HydrophobicContact CB-CB 4.15Å; F28-L70 HydrophobicContact CB-CD1 4.05Å; F28-L70 HydrophobicContact CD2-CB 4.35Å; F28-P71 HydrophobicContact CD2-CG 3.89Å; F28-P71 HydrophobicContact CE2-CG 3.56Å; F28-P71 HydrophobicContact CG-CG 4.5Å; F28-P71 HydrophobicContact CZ-CG 3.92Å; F28-I74 HydrophobicContact CB-CD1 4.34Å
29V96.9Very high94.6Very high76 Ų7643 Ų4346%0.46125%0.249SC..Hα-helixtrans-64.1-52.7-178.3174.90000111.1S25 T26 I33S25-V29 WeakPolarHBondContact O-CG2 3.28Å; S25-V29 PolarHBondContact O-N 3.03Å; S25-V29 VanDerWaalsContact O-N 3.13Å; T26-V29 PolarHBondContact O-N 3.3Å; V29-I33 HydrophobicContact CG1-CD1 3.94Å; V29-I33 WeakPolarHBondContact O-CD1 3.19Å; V29-I33 VanDerWaalsContact O-CG1 3.26Å; V29-I33 WeakPolarHBondContact O-CG1 3.41Å; V29-I33 PolarHBondContact O-N 3.12Å
30L96Very high94.4Very high94 Ų9447.7 Ų47.749%0.49226%0.264SS..Hα-helixtrans-67-50.1-176.1-66.3-178.8000111.3T26 L32 I33 S34 C285T26-L30 HydrophobicContact CG2-CD1 3.82Å; T26-L30 HydrophobicContact CG2-CG 4.39Å; T26-L30 WeakPolarHBondContact O-CB 3.31Å; T26-L30 WeakPolarHBondContact O-CG 3.34Å; T26-L30 PolarHBondContact O-N 3.23Å; L30-L32 PolarHBondContact O-N 2.99Å; L30-I33 PolarHBondContact O-N 3.13Å; L30-S34 WeakPolarHBondContact O-CB 3.34Å; L30-S34 PolarHBondContact O-N 3.5Å; L30-S34 PolarHBondContact O-OG 2.95Å; L30-C285 HydrophobicContact CB-CB 4.42Å
31G95.7Very high93.9Very high0 Ų048.6 Ų48.60%027%0.27CS..Hα-helixtrans-63.9-39.2-178.100000112.9V27 S34 N35V27-G31 VanDerWaalsContact O-CA 3.26Å; V27-G31 WeakPolarHBondContact O-CA 3.47Å; V27-G31 PolarHBondContact O-N 3.32Å; G31-S34 PolarHBondContact O-OG 3.12Å; G31-N35 VanDerWaalsContact O-CB 3.27Å; G31-N35 WeakPolarHBondContact O-CB 3.22Å; G31-N35 PolarHBondContact O-N 3.03Å; G31-N35 PolarHBondContact O-ND2 2.93Å
32L95.9Very high93.5Very high42 Ų4248 Ų4822%0.2226%0.264CS..Hα-helixtrans-64.9-53177.9-17764.9000110.7F28 L30 S34 C36 L64 V67 F68F28-L32 HydrophobicContact CE2-CD2 4.1Å; F28-L32 HydrophobicContact CZ-CD2 3.92Å; F28-L32 WeakPolarHBondContact O-CB 3.47Å; F28-L32 PolarHBondContact O-N 3.21Å; L30-L32 PolarHBondContact O-N 2.99Å; L32-S34 VanDerWaalsContact C-N 3.34Å; L32-S34 PolarHBondContact O-N 3.42Å; L32-C36 WeakPolarHBondContact O-CB 3.46Å; L32-C36 PolarHBondContact O-N 3.49Å; L32-C36 PolarHBondContact O-SG 2.71Å; L32-L64 HydrophobicContact CD1-CD2 3.96Å; L32-V67 HydrophobicContact CB-CG1 3.78Å; L32-V67 HydrophobicContact CD1-CG1 4.31Å; L32-F68 HydrophobicContact CD1-CE1 3.87Å; L32-F68 HydrophobicContact CD1-CZ 3.91Å
33I94.6Very high92.9Very high104 Ų10448.5 Ų48.553%0.53326%0.261SS..Hα-helixtrans-59.6-49.5-178.8-66.5169.6000109.5V29 L30 V37V29-I33 HydrophobicContact CG1-CD1 3.94Å; V29-I33 WeakPolarHBondContact O-CD1 3.19Å; V29-I33 VanDerWaalsContact O-CG1 3.26Å; V29-I33 WeakPolarHBondContact O-CG1 3.41Å; V29-I33 PolarHBondContact O-N 3.12Å; L30-I33 PolarHBondContact O-N 3.13Å; I33-V37 WeakPolarHBondContact O-CB 3.27Å; I33-V37 VanDerWaalsContact O-CG2 3.24Å; I33-V37 WeakPolarHBondContact O-CG2 3.42Å; I33-V37 PolarHBondContact O-N 3.49Å
34S91.9Very high92.2Very high26 Ų2649.6 Ų49.618%0.18227%0.273CS..Hα-helixtrans-69.9-41.2-171.571.90000113.1L30 G31 L32 A38 P288L30-S34 WeakPolarHBondContact O-CB 3.34Å; L30-S34 PolarHBondContact O-N 3.5Å; L30-S34 PolarHBondContact O-OG 2.95Å; G31-S34 PolarHBondContact O-OG 3.12Å; L32-S34 VanDerWaalsContact C-N 3.34Å; L32-S34 PolarHBondContact O-N 3.42Å; S34-A38 WeakPolarHBondContact O-CB 3.4Å; S34-A38 PolarHBondContact O-N 3.3Å; S34-P288 VanDerWaalsContact OG-CG 3.28Å; S34-P288 WeakPolarHBondContact OG-CG 3.36Å
35N94Very high91.3Very high0 Ų052.2 Ų52.20%029%0.289CS..Hα-helixtrans-76.4-33.8179.7-70.6-67.7000112.4G31 A38 I39 A60 D63 L64 C284G31-N35 VanDerWaalsContact O-CB 3.27Å; G31-N35 WeakPolarHBondContact O-CB 3.22Å; G31-N35 PolarHBondContact O-N 3.03Å; G31-N35 PolarHBondContact O-ND2 2.93Å; N35-A38 PolarHBondContact O-N 3.05Å; N35-I39 WeakPolarHBondContact O-CG1 3.29Å; N35-I39 PolarHBondContact O-N 2.93Å; N35-A60 HydrophobicContact CB-CB 4.48Å; N35-D63 PolarHBondContact OD1-OD2 3.44Å; N35-L64 HydrophobicContact CB-CD2 3.71Å; N35-L64 HydrophobicContact CB-CG 3.79Å; N35-C284 PolarHBondContact ND2-O 3.43Å
36C93.6Very high90.2Very high57 Ų5750.4 Ų50.439%0.38528%0.276SS..Hα-helixtrans-60.7-46.2170.3-77.20000111.6L32 A38 I39 Y40L32-C36 WeakPolarHBondContact O-CB 3.46Å; L32-C36 PolarHBondContact O-N 3.49Å; L32-C36 PolarHBondContact O-SG 2.71Å; C36-A38 VanDerWaalsContact C-N 3.34Å; C36-A38 PolarHBondContact O-N 3.38Å; C36-I39 PolarHBondContact O-N 2.86Å; C36-Y40 WeakPolarHBondContact O-CB 2.86Å; C36-Y40 PolarHBondContact O-N 2.92Å
37V90.1Very high88.4Confident78 Ų7856.9 Ų56.947%0.47330%0.298SS..Hα-helixtrans-61.9-43175.61700000110.9I33 Y40 I41I33-V37 WeakPolarHBondContact O-CB 3.27Å; I33-V37 VanDerWaalsContact O-CG2 3.24Å; I33-V37 WeakPolarHBondContact O-CG2 3.42Å; I33-V37 PolarHBondContact O-N 3.49Å; V37-Y40 PolarHBondContact O-N 2.99Å; V37-I41 HydrophobicContact CG1-CD1 3.78Å; V37-I41 HydrophobicContact CG1-CG1 4.44Å; V37-I41 VanDerWaalsContact O-CG1 3.29Å; V37-I41 WeakPolarHBondContact O-CG1 3.28Å; V37-I41 PolarHBondContact O-N 2.99Å
38A89.1Confident86.7Confident7 Ų762.1 Ų62.16%0.05833%0.329CS..Hα-helixtrans-60.6-49.4177.900000111.9S34 N35 C36 Y40 I41 F42 Y291S34-A38 WeakPolarHBondContact O-CB 3.4Å; S34-A38 PolarHBondContact O-N 3.3Å; N35-A38 PolarHBondContact O-N 3.05Å; C36-A38 VanDerWaalsContact C-N 3.34Å; C36-A38 PolarHBondContact O-N 3.38Å; A38-Y40 PolarHBondContact O-N 2.8Å; A38-I41 PolarHBondContact O-N 3.36Å; A38-F42 HydrophobicContact CB-CD2 4.31Å; A38-F42 HydrophobicContact CB-CE2 3.95Å; A38-F42 WeakPolarHBondContact O-CB 3.28Å; A38-F42 WeakPolarHBondContact O-CD2 3.5Å; A38-F42 WeakPolarHBondContact O-CG 3.42Å; A38-F42 PolarHBondContact O-N 3.32Å; A38-Y291 HydrophobicContact CB-CD2 3.58Å; A38-Y291 HydrophobicContact CB-CE2 3.67Å
39I89.9Confident85.5Confident30 Ų3064.5 Ų64.515%0.15434%0.337CS..Hα-helixtrans-59.2-47.2176.1-71.3-170.1000110.7N35 C36 I41 F42 I43 A60 L64N35-I39 WeakPolarHBondContact O-CG1 3.29Å; N35-I39 PolarHBondContact O-N 2.93Å; C36-I39 PolarHBondContact O-N 2.86Å; I39-I41 VanDerWaalsContact C-N 3.29Å; I39-I41 PolarHBondContact O-N 3.24Å; I39-F42 PolarHBondContact O-N 2.95Å; I39-F42 VanDerWaalsContact O-N 3.13Å; I39-I43 HydrophobicContact CG2-CD1 3.5Å; I39-I43 VanDerWaalsContact CG2-CD1 3.5Å; I39-I43 HydrophobicContact CG2-CG1 3.92Å; I39-I43 WeakPolarHBondContact O-CB 3.35Å; I39-I43 VanDerWaalsContact O-CG1 3.28Å; I39-I43 WeakPolarHBondContact O-CG1 3.33Å; I39-I43 PolarHBondContact O-N 3.5Å; I39-A60 HydrophobicContact CD1-CB 4.15Å; I39-A60 HydrophobicContact CG1-CB 3.7Å; I39-L64 HydrophobicContact CD1-CD1 3.4Å; I39-L64 HydrophobicContact CD1-CG 4.47Å; I39-L64 HydrophobicContact CG1-CD1 4.34Å
40Y88.4Confident84.6Confident146 Ų14663.7 Ų63.757%0.57333%0.33SS*.Hα-helixtrans-55.3-45.6176.9174.7-97000111.7C36 V37 A38 C44 V45C36-Y40 WeakPolarHBondContact O-CB 2.86Å; C36-Y40 PolarHBondContact O-N 2.92Å; V37-Y40 PolarHBondContact O-N 2.99Å; A38-Y40 PolarHBondContact O-N 2.8Å; Y40-C44 HydrophobicContact CD2-CB 4.1Å; Y40-C44 HydrophobicContact CE2-CB 3.91Å; Y40-C44 WeakPolarHBondContact O-CA 3.24Å; Y40-C44 WeakPolarHBondContact O-CB 3.45Å; Y40-C44 PolarHBondContact O-N 2.93Å; Y40-V45 HydrophobicContact CD1-CG2 4.37Å; Y40-V45 HydrophobicContact CE1-CG2 3.96Å
41I85Confident84.1Confident33 Ų3361 Ų6117%0.16932%0.315CS..Iπ-helixtrans-63-47.2176.6-67.7167.8000110.8V37 A38 I39 I43 V45 L46 I298V37-I41 HydrophobicContact CG1-CD1 3.78Å; V37-I41 HydrophobicContact CG1-CG1 4.44Å; V37-I41 VanDerWaalsContact O-CG1 3.29Å; V37-I41 WeakPolarHBondContact O-CG1 3.28Å; V37-I41 PolarHBondContact O-N 2.99Å; A38-I41 PolarHBondContact O-N 3.36Å; I39-I41 VanDerWaalsContact C-N 3.29Å; I39-I41 PolarHBondContact O-N 3.24Å; I41-I43 VanDerWaalsContact C-N 3.35Å; I41-I43 PolarHBondContact O-N 2.89Å; I41-V45 HydrophobicContact CG2-CB 4.27Å; I41-V45 WeakPolarHBondContact O-CA 3.44Å; I41-V45 WeakPolarHBondContact O-CB 3Å; I41-V45 PolarHBondContact O-N 3.27Å; I41-V45 VanDerWaalsContact O-N 3.07Å; I41-L46 HydrophobicContact CG2-CG 4.45Å; I41-L46 WeakPolarHBondContact O-CG 3.44Å; I41-L46 PolarHBondContact O-N 2.91Å; I41-I298 HydrophobicContact CG2-CD1 4.24Å; I41-I298 HydrophobicContact CG2-CG1 3.89Å
42F85.4Confident83.6Confident0 Ų061.1 Ų61.10%032%0.316CS..Iπ-helixtrans-67.6-30.8-177.1-66-40.9000114.4A38 I39 L46 T53 M56 I57 Y291 I298A38-F42 HydrophobicContact CB-CD2 4.31Å; A38-F42 HydrophobicContact CB-CE2 3.95Å; A38-F42 WeakPolarHBondContact O-CB 3.28Å; A38-F42 WeakPolarHBondContact O-CD2 3.5Å; A38-F42 WeakPolarHBondContact O-CG 3.42Å; A38-F42 PolarHBondContact O-N 3.32Å; I39-F42 PolarHBondContact O-N 2.95Å; I39-F42 VanDerWaalsContact O-N 3.13Å; F42-L46 HydrophobicContact CD1-CD1 3.61Å; F42-L46 HydrophobicContact CD1-CG 4.49Å; F42-L46 HydrophobicContact CE1-CD1 4.3Å; F42-T53 HydrophobicContact CB-CG2 4.27Å; F42-T53 HydrophobicContact CD1-CG2 3.91Å; F42-T53 HydrophobicContact CG-CG2 4.27Å; F42-M56 HydrophobicContact CD2-CB 4.46Å; F42-M56 HydrophobicContact CE1-CB 4.31Å; F42-M56 HydrophobicContact CE1-SD 3.72Å; F42-M56 HydrophobicContact CE2-CB 3.72Å; F42-M56 HydrophobicContact CZ-CB 3.62Å; F42-M56 HydrophobicContact CZ-CG 4.17Å; F42-M56 HydrophobicContact CZ-SD 3.56Å; F42-M56 VanDerWaalsContact CZ-SD 3.56Å; F42-I57 HydrophobicContact CB-CD1 3.94Å; F42-I57 HydrophobicContact CB-CG1 3.55Å; F42-I57 HydrophobicContact CD2-CG1 3.97Å; F42-I57 HydrophobicContact CG-CG1 3.99Å; F42-Y291 HydrophobicContact CE2-CD1 4.11Å; F42-Y291 AromaticContact CE2-CD2 3.94Å; F42-Y291 HydrophobicContact CE2-CD2 3.94Å; F42-Y291 HydrophobicContact CE2-CE1 4.28Å; F42-Y291 HydrophobicContact CE2-CE2 4.16Å; F42-Y291 AromaticContact CE2-CG 3.96Å; F42-Y291 HydrophobicContact CE2-CG 3.96Å; F42-Y291 AromaticContact CZ-CD1 3.75Å; F42-Y291 HydrophobicContact CZ-CD1 3.75Å; F42-Y291 AromaticContact CZ-CD2 3.96Å; F42-Y291 HydrophobicContact CZ-CD2 3.96Å; F42-Y291 HydrophobicContact CZ-CE1 4.34Å; F42-Y291 AromaticContact CZ-CG 3.55Å; F42-Y291 HydrophobicContact CZ-CG 3.55Å; F42-I298 HydrophobicContact CD1-CD1 4.2Å; F42-I298 HydrophobicContact CE1-CD1 3.44Å; F42-I298 VanDerWaalsContact CE1-CD1 3.44Å; F42-I298 HydrophobicContact CE1-CG1 4.49Å; F42-I298 HydrophobicContact CZ-CD1 3.99Å
43I84.1Confident83.2Confident85 Ų8559.3 Ų59.344%0.43631%0.306SS..Iπ-helixtrans-91.7-48.2-178.7-58.2-167.2000111.1I39 I41 R49I39-I43 HydrophobicContact CG2-CD1 3.5Å; I39-I43 VanDerWaalsContact CG2-CD1 3.5Å; I39-I43 HydrophobicContact CG2-CG1 3.92Å; I39-I43 WeakPolarHBondContact O-CB 3.35Å; I39-I43 VanDerWaalsContact O-CG1 3.28Å; I39-I43 WeakPolarHBondContact O-CG1 3.33Å; I39-I43 PolarHBondContact O-N 3.5Å; I41-I43 VanDerWaalsContact C-N 3.35Å; I41-I43 PolarHBondContact O-N 2.89Å; I43-R49 VanDerWaalsContact CG1-NH2 3.35Å
44C82Confident83.1Confident81 Ų8155 Ų5555%0.54729%0.285SS..Iπ-helixtrans-98.4-31.6-167.2-55.20000113.2Y40Y40-C44 HydrophobicContact CD2-CB 4.1Å; Y40-C44 HydrophobicContact CE2-CB 3.91Å; Y40-C44 WeakPolarHBondContact O-CA 3.24Å; Y40-C44 WeakPolarHBondContact O-CB 3.45Å; Y40-C44 PolarHBondContact O-N 2.93Å
45V76.3Confident83.1Confident57 Ų5754.9 Ų54.935%0.34528%0.28SS..Iπ-helixtrans-96.8-39.8-174.9-177.20000111.5Y40 I41 K47Y40-V45 HydrophobicContact CD1-CG2 4.37Å; Y40-V45 HydrophobicContact CE1-CG2 3.96Å; I41-V45 HydrophobicContact CG2-CB 4.27Å; I41-V45 WeakPolarHBondContact O-CA 3.44Å; I41-V45 WeakPolarHBondContact O-CB 3Å; I41-V45 PolarHBondContact O-N 3.27Å; I41-V45 VanDerWaalsContact O-N 3.07Å; V45-K47 PolarHBondContact O-N 2.95Å
46L74.1Confident83Confident9 Ų955 Ų555%0.04728%0.281CS..  trans-75.494.7178.2-64.5-167000111.4I41 F42 V48 T53 T297I41-L46 HydrophobicContact CG2-CG 4.45Å; I41-L46 WeakPolarHBondContact O-CG 3.44Å; I41-L46 PolarHBondContact O-N 2.91Å; F42-L46 HydrophobicContact CD1-CD1 3.61Å; F42-L46 HydrophobicContact CD1-CG 4.49Å; F42-L46 HydrophobicContact CE1-CD1 4.3Å; L46-V48 PolarHBondContact O-N 2.82Å; L46-V48 VanDerWaalsContact O-N 3.16Å; L46-T53 HydrophobicContact CD1-CG2 3.87Å; L46-T297 VanDerWaalsContact CD2-CB 3.42Å; L46-T297 HydrophobicContact CD2-CG2 3.24Å
47K60Low83Confident211 Ų21153.7 Ų53.792%0.91727%0.27SS*.SBendtrans-60.9-20.4173.7-68.3-175.4178.8-178.30113.9V45V45-K47 PolarHBondContact O-N 2.95Å
48V60.4Low83.3Confident111 Ų11151.6 Ų51.667%0.67326%0.256SS*.SBendtrans-123.1105.2179.4-174.20000110.1L46L46-V48 PolarHBondContact O-N 2.82Å; L46-V48 VanDerWaalsContact O-N 3.16Å
49R71.3Confident83.5Confident108 Ų10851.2 Ų51.241%0.40825%0.253SS..  trans-77.9123.6169-72.1-178.3164.5163.8-8.3110I43 K130I43-R49 VanDerWaalsContact CG1-NH2 3.35Å; R49-K130 WeakPolarHBondContact O-CD 3.25Å; R49-K130 WeakPolarHBondContact O-CE 3.08Å; R49-K130 PolarHBondContact O-NZ 3.1Å
50N78.1Confident83.8Confident59 Ų5949.8 Ų49.832%0.31625%0.246SC..  trans-108.2-178.5170.963.813.4000111T53 T54N50-T53 PolarHBondContact O-N 3.18Å; N50-T53 WeakPolarHBondContact OD1-CB 3.45Å; N50-T53 PolarHBondContact OD1-N 2.85Å; N50-T53 PolarHBondContact OD1-OG1 2.87Å; N50-T54 PolarHBondContact O-N 3.41Å; N50-T54 PolarHBondContact O-OG1 2.8Å
51E85.4Confident84.1Confident37 Ų3747 Ų4717%0.17324%0.239CC..Hα-helixtrans-59.6-51.1-179-6068-141.600110.5T53 T54 Y55 R128 K130 A133E51-T53 VanDerWaalsContact C-N 3.35Å; E51-T53 PolarHBondContact O-N 3.31Å; E51-T54 VanDerWaalsContact O-CB 3.25Å; E51-T54 WeakPolarHBondContact O-CB 3.18Å; E51-T54 PolarHBondContact O-N 2.91Å; E51-Y55 WeakPolarHBondContact O-CD2 3.3Å; E51-Y55 PolarHBondContact O-N 3.47Å; E51-R128 HydrophobicContact CG-CB 4.43Å; E51-K130 PolarHBondContact OE1-N 3.32Å; E51-A133 HydrophobicContact CB-CB 4.18Å
52T85.4Confident84.7Confident3 Ų345.6 Ų45.62%0.01823%0.232CC..Hα-helixtrans-60.3-41.3-179.7-33.70000112.5T54 Y55 M56 I110 D113 T294T52-T54 PolarHBondContact O-N 2.83Å; T52-Y55 PolarHBondContact O-N 3.02Å; T52-M56 HydrophobicContact CG2-CE 3.85Å; T52-M56 WeakPolarHBondContact O-CG 3.44Å; T52-M56 PolarHBondContact O-N 3.07Å; T52-M56 VanDerWaalsContact O-N 3.09Å; T52-I110 HydrophobicContact CG2-CG1 4.4Å; T52-I110 HydrophobicContact CG2-CG2 4.06Å; T52-D113 PolarHBondContact OG1-OD2 3.47Å; T52-T294 HydrophobicContact CG2-CG2 3.76Å
53T87.6Confident85.2Confident4 Ų445.6 Ų45.63%0.02523%0.232CC..Hα-helixtrans-63.8-30.5177.1-55.90000111.2F42 L46 N50 E51 M56 I57F42-T53 HydrophobicContact CB-CG2 4.27Å; F42-T53 HydrophobicContact CD1-CG2 3.91Å; F42-T53 HydrophobicContact CG-CG2 4.27Å; L46-T53 HydrophobicContact CD1-CG2 3.87Å; N50-T53 PolarHBondContact O-N 3.18Å; N50-T53 WeakPolarHBondContact OD1-CB 3.45Å; N50-T53 PolarHBondContact OD1-N 2.85Å; N50-T53 PolarHBondContact OD1-OG1 2.87Å; E51-T53 VanDerWaalsContact C-N 3.35Å; E51-T53 PolarHBondContact O-N 3.31Å; T53-M56 PolarHBondContact O-N 3.22Å; T53-I57 HydrophobicContact CG2-CD1 3.98Å; T53-I57 HydrophobicContact CG2-CG1 4.3Å; T53-I57 VanDerWaalsContact O-CG1 3.3Å; T53-I57 WeakPolarHBondContact O-CG1 3.37Å; T53-I57 PolarHBondContact O-N 2.92Å
54T92.1Very high85.8Confident14 Ų1442.2 Ų42.29%0.08622%0.215CC..Hα-helixtrans-64.5-43.7176.3-54.50000110.8N50 E51 T52 N58 A133 K134N50-T54 PolarHBondContact O-N 3.41Å; N50-T54 PolarHBondContact O-OG1 2.8Å; E51-T54 VanDerWaalsContact O-CB 3.25Å; E51-T54 WeakPolarHBondContact O-CB 3.18Å; E51-T54 PolarHBondContact O-N 2.91Å; T52-T54 PolarHBondContact O-N 2.83Å; T54-N58 PolarHBondContact O-N 3.49Å; T54-N58 PolarHBondContact O-ND2 3.43Å; T54-A133 HydrophobicContact CG2-CB 4.37Å; T54-K134 HydrophobicContact CG2-CG 4.03Å
55Y93.3Very high86.5Confident22 Ų2241.1 Ų41.19%0.08620%0.203CC..Hα-helixtrans-64.3-42.6174.5-58.9-54.1000112.1E51 T52 I57 N58 L59 F106 C109 I110 D113 A133 V136 C137E51-Y55 WeakPolarHBondContact O-CD2 3.3Å; E51-Y55 PolarHBondContact O-N 3.47Å; T52-Y55 PolarHBondContact O-N 3.02Å; Y55-I57 PolarHBondContact O-N 3.16Å; Y55-N58 PolarHBondContact O-N 3.32Å; Y55-L59 PolarHBondContact O-N 3.26Å; Y55-F106 HydrophobicContact CD1-CD1 4.41Å; Y55-C109 HydrophobicContact CD1-CB 3.76Å; Y55-C109 HydrophobicContact CD2-CB 4.15Å; Y55-C109 HydrophobicContact CE1-CB 3.81Å; Y55-C109 HydrophobicContact CE2-CB 4.19Å; Y55-C109 HydrophobicContact CG-CB 3.96Å; Y55-I110 HydrophobicContact CD2-CG1 4.45Å; Y55-I110 HydrophobicContact CG-CG1 4.46Å; Y55-D113 HydrophobicContact CE2-CB 4.15Å; Y55-A133 HydrophobicContact CE1-CB 4.19Å; Y55-A133 HydrophobicContact CE2-CB 4.3Å; Y55-A133 WeakPolarHBondContact OH-CA 3.22Å; Y55-V136 HydrophobicContact CE1-CB 4.09Å; Y55-V136 HydrophobicContact CE1-CG1 3.82Å; Y55-C137 WeakPolarHBondContact CD1-SG 3.46Å
56M91.9Very high87.5Confident2 Ų238.4 Ų38.41%0.0119%0.187CC..Hα-helixtrans-63.1-39.6178.2-66.5172.9179.400113.8F42 T52 T53 N58 L59 A60 I110 Y291 T294F42-M56 HydrophobicContact CD2-CB 4.46Å; F42-M56 HydrophobicContact CE1-CB 4.31Å; F42-M56 HydrophobicContact CE1-SD 3.72Å; F42-M56 HydrophobicContact CE2-CB 3.72Å; F42-M56 HydrophobicContact CZ-CB 3.62Å; F42-M56 HydrophobicContact CZ-CG 4.17Å; F42-M56 HydrophobicContact CZ-SD 3.56Å; F42-M56 VanDerWaalsContact CZ-SD 3.56Å; T52-M56 HydrophobicContact CG2-CE 3.85Å; T52-M56 WeakPolarHBondContact O-CG 3.44Å; T52-M56 PolarHBondContact O-N 3.07Å; T52-M56 VanDerWaalsContact O-N 3.09Å; T53-M56 PolarHBondContact O-N 3.22Å; M56-N58 VanDerWaalsContact C-N 3.29Å; M56-N58 PolarHBondContact O-N 3.48Å; M56-L59 PolarHBondContact O-N 2.84Å; M56-A60 WeakPolarHBondContact O-CB 3.43Å; M56-A60 PolarHBondContact O-N 3.35Å; M56-I110 HydrophobicContact CG-CD1 4.07Å; M56-Y291 HydrophobicContact CB-CD1 3.93Å; M56-Y291 HydrophobicContact CB-CE1 3.79Å; M56-Y291 HydrophobicContact CG-CD1 3.73Å; M56-Y291 HydrophobicContact CG-CE1 3.92Å; M56-Y291 HydrophobicContact SD-CD1 3.99Å; M56-T294 HydrophobicContact CE-CG2 3Å
57I92.7Very high88.6Confident31 Ų3138 Ų3816%0.15918%0.184CC..Hα-helixtrans-62.8-41.3176.3-70.7166.3000110.1F42 T53 Y55 M61F42-I57 HydrophobicContact CB-CD1 3.94Å; F42-I57 HydrophobicContact CB-CG1 3.55Å; F42-I57 HydrophobicContact CD2-CG1 3.97Å; F42-I57 HydrophobicContact CG-CG1 3.99Å; T53-I57 HydrophobicContact CG2-CD1 3.98Å; T53-I57 HydrophobicContact CG2-CG1 4.3Å; T53-I57 VanDerWaalsContact O-CG1 3.3Å; T53-I57 WeakPolarHBondContact O-CG1 3.37Å; T53-I57 PolarHBondContact O-N 2.92Å; Y55-I57 PolarHBondContact O-N 3.16Å; I57-M61 VanDerWaalsContact O-CB 3.32Å; I57-M61 WeakPolarHBondContact O-CB 3.26Å; I57-M61 PolarHBondContact O-N 2.93Å
58N95.6Very high90.3Very high33 Ų3333.5 Ų33.518%0.17617%0.165CC..Hα-helixtrans-69.8-36.7178.5-77.2-90.2000112.3T54 Y55 M56 M61 S62 F106 C137 W141T54-N58 PolarHBondContact O-N 3.49Å; T54-N58 PolarHBondContact O-ND2 3.43Å; Y55-N58 PolarHBondContact O-N 3.32Å; M56-N58 VanDerWaalsContact C-N 3.29Å; M56-N58 PolarHBondContact O-N 3.48Å; N58-M61 PolarHBondContact O-N 2.69Å; N58-S62 WeakPolarHBondContact O-CB 3.49Å; N58-S62 PolarHBondContact O-N 2.94Å; N58-F106 HydrophobicContact CB-CD1 4.15Å; N58-F106 HydrophobicContact CB-CD2 4.43Å; N58-F106 HydrophobicContact CB-CE1 3.56Å; N58-F106 HydrophobicContact CB-CE2 3.89Å; N58-F106 HydrophobicContact CB-CZ 3.45Å; N58-F106 VanDerWaalsContact CB-CZ 3.45Å; N58-C137 PolarHBondContact ND2-SG 3.4Å; N58-C137 VanDerWaalsContact ND2-SG 3.42Å; N58-W141 PolarHBondContact OD1-NE1 2.98Å
59L94.8Very high92Very high0 Ų028.6 Ų28.60%014%0.135CC..Hα-helixtrans-58.5-56.4171.6-177.356.5000110.6Y55 M56 M61 S62 D63 F106 L107 I110 Y291Y55-L59 PolarHBondContact O-N 3.26Å; M56-L59 PolarHBondContact O-N 2.84Å; L59-M61 VanDerWaalsContact C-N 3.26Å; L59-M61 PolarHBondContact O-N 3.29Å; L59-S62 WeakPolarHBondContact O-CA 3.41Å; L59-S62 VanDerWaalsContact O-CB 3.29Å; L59-S62 WeakPolarHBondContact O-CB 3.01Å; L59-S62 PolarHBondContact O-N 2.85Å; L59-D63 PolarHBondContact O-N 3.21Å; L59-D63 VanDerWaalsContact O-OD2 3.13Å; L59-F106 HydrophobicContact CB-CB 4.12Å; L59-F106 HydrophobicContact CB-CD2 4.41Å; L59-F106 HydrophobicContact CB-CG 4.46Å; L59-F106 HydrophobicContact CD1-CB 4.18Å; L59-F106 HydrophobicContact CD1-CD2 4.49Å; L59-L107 HydrophobicContact CD2-CD2 3.9Å; L59-L107 HydrophobicContact CD2-CG 4.18Å; L59-I110 HydrophobicContact CD2-CD1 4.45Å; L59-Y291 HydrophobicContact CD2-CE1 4.04Å; L59-Y291 WeakPolarHBondContact CG-OH 3.23Å
60A95.1Very high93.2Very high0 Ų023.4 Ų23.40%012%0.116CC..Hα-helixtrans-59.2-35.3178.600000113N35 I39 M56 D63 L64 Y291N35-A60 HydrophobicContact CB-CB 4.48Å; I39-A60 HydrophobicContact CD1-CB 4.15Å; I39-A60 HydrophobicContact CG1-CB 3.7Å; M56-A60 WeakPolarHBondContact O-CB 3.43Å; M56-A60 PolarHBondContact O-N 3.35Å; A60-D63 PolarHBondContact O-N 3.46Å; A60-L64 WeakPolarHBondContact O-CG 3.19Å; A60-L64 PolarHBondContact O-N 2.86Å; A60-Y291 WeakPolarHBondContact CA-OH 3.41Å; A60-Y291 HydrophobicContact CB-CE2 4.28Å; A60-Y291 WeakPolarHBondContact CB-OH 3.33Å; A60-Y291 PolarHBondContact N-OH 3.05Å; A60-Y291 VanDerWaalsContact N-OH 3.15Å
61M95.9Very high94.1Very high88 Ų8823 Ų2343%0.43312%0.116SC..Hα-helixtrans-65.6-42.7174.5-173.767.7-17400111.4I57 N58 L59 D63 L64 L65I57-M61 VanDerWaalsContact O-CB 3.32Å; I57-M61 WeakPolarHBondContact O-CB 3.26Å; I57-M61 PolarHBondContact O-N 2.93Å; N58-M61 PolarHBondContact O-N 2.69Å; L59-M61 VanDerWaalsContact C-N 3.26Å; L59-M61 PolarHBondContact O-N 3.29Å; M61-D63 VanDerWaalsContact C-N 3.34Å; M61-L64 PolarHBondContact O-N 3.42Å; M61-L65 HydrophobicContact CE-CD1 4.39Å; M61-L65 HydrophobicContact CE-CD2 4.24Å; M61-L65 HydrophobicContact CE-CG 4.27Å; M61-L65 HydrophobicContact CG-CD1 4.45Å; M61-L65 VanDerWaalsContact O-CG 3.31Å; M61-L65 WeakPolarHBondContact O-CG 3.47Å; M61-L65 PolarHBondContact O-N 3.38Å
62S96.7Very high94.6Very high2 Ų224.3 Ų24.31%0.01412%0.122CC..Hα-helixtrans-62-42.6175.8-163.20000111.7N58 L59 L65 F66 N99N58-S62 WeakPolarHBondContact O-CB 3.49Å; N58-S62 PolarHBondContact O-N 2.94Å; L59-S62 WeakPolarHBondContact O-CA 3.41Å; L59-S62 VanDerWaalsContact O-CB 3.29Å; L59-S62 WeakPolarHBondContact O-CB 3.01Å; L59-S62 PolarHBondContact O-N 2.85Å; S62-L65 PolarHBondContact O-N 3.14Å; S62-F66 PolarHBondContact O-N 3.41Å; S62-N99 PolarHBondContact O-ND2 3.31Å; S62-N99 WeakPolarHBondContact OG-CA 3.28Å
63D96.6Very high95Very high0 Ų024.8 Ų24.80%012%0.123CC..Hα-helixtrans-61.9-46.8175.8-62.5-41000112N35 L59 A60 M61 L65 F66 V67 N99 C284 D287N35-D63 PolarHBondContact OD1-OD2 3.44Å; L59-D63 PolarHBondContact O-N 3.21Å; L59-D63 VanDerWaalsContact O-OD2 3.13Å; A60-D63 PolarHBondContact O-N 3.46Å; M61-D63 VanDerWaalsContact C-N 3.34Å; D63-L65 PolarHBondContact O-N 2.93Å; D63-F66 PolarHBondContact O-N 2.84Å; D63-V67 VanDerWaalsContact O-CB 3.32Å; D63-V67 WeakPolarHBondContact O-CB 3.2Å; D63-V67 WeakPolarHBondContact O-CG2 3.36Å; D63-V67 PolarHBondContact O-N 3.49Å; D63-N99 VanDerWaalsContact CA-ND2 3.34Å; D63-N99 WeakPolarHBondContact CA-ND2 3.2Å; D63-N99 PolarHBondContact N-ND2 3.46Å; D63-N99 PolarHBondContact OD1-ND2 3.13Å; D63-C284 HydrophobicContact CB-CB 4.09Å; D63-C284 PolarHBondContact OD1-SG 2.9Å; D63-D287 VanDerWaalsContact OD2-OD2 3.06Å
64L96.8Very high95.4Very high15 Ų1526 Ų268%0.07913%0.129CC..Hα-helixtrans-61.5-45.3178.1-74.7179.4000112.2L32 N35 I39 A60 M61 F66 V67 F68L32-L64 HydrophobicContact CD1-CD2 3.96Å; N35-L64 HydrophobicContact CB-CD2 3.71Å; N35-L64 HydrophobicContact CB-CG 3.79Å; I39-L64 HydrophobicContact CD1-CD1 3.4Å; I39-L64 HydrophobicContact CD1-CG 4.47Å; I39-L64 HydrophobicContact CG1-CD1 4.34Å; A60-L64 WeakPolarHBondContact O-CG 3.19Å; A60-L64 PolarHBondContact O-N 2.86Å; M61-L64 PolarHBondContact O-N 3.42Å; L64-F66 VanDerWaalsContact C-N 3.26Å; L64-F66 PolarHBondContact O-N 2.7Å; L64-V67 PolarHBondContact O-N 3.29Å; L64-F68 HydrophobicContact CB-CD2 4.45Å; L64-F68 HydrophobicContact CB-CE2 4.18Å; L64-F68 WeakPolarHBondContact O-CD2 3.45Å; L64-F68 WeakPolarHBondContact O-CG 3.49Å; L64-F68 PolarHBondContact O-N 3.36Å
65L96.7Very high95.6Very high57 Ų5729.4 Ų29.430%0.29814%0.143SC..Hα-helixtrans-56.7-42.8178.4-73.9173.1000111.4M61 S62 D63 L95 W141M61-L65 HydrophobicContact CE-CD1 4.39Å; M61-L65 HydrophobicContact CE-CD2 4.24Å; M61-L65 HydrophobicContact CE-CG 4.27Å; M61-L65 HydrophobicContact CG-CD1 4.45Å; M61-L65 VanDerWaalsContact O-CG 3.31Å; M61-L65 WeakPolarHBondContact O-CG 3.47Å; M61-L65 PolarHBondContact O-N 3.38Å; S62-L65 PolarHBondContact O-N 3.14Å; D63-L65 PolarHBondContact O-N 2.93Å; L65-L95 HydrophobicContact CB-CD2 4.21Å; L65-W141 HydrophobicContact CD1-CH2 3.89Å; L65-W141 HydrophobicContact CD1-CZ3 4.37Å
66F96.8Very high95.5Very high0 Ų028.4 Ų28.40%014%0.139CC..Hα-helixtrans-72-43.6176.1165.3-116000112.9S62 D63 L64 F68 T69 L70 F96 N99 V281S62-F66 PolarHBondContact O-N 3.41Å; D63-F66 PolarHBondContact O-N 2.84Å; L64-F66 VanDerWaalsContact C-N 3.26Å; L64-F66 PolarHBondContact O-N 2.7Å; F66-F68 PolarHBondContact O-N 3.17Å; F66-T69 WeakPolarHBondContact O-CA 3.27Å; F66-T69 WeakPolarHBondContact O-CB 3.39Å; F66-T69 PolarHBondContact O-N 3.05Å; F66-T69 PolarHBondContact O-OG1 2.95Å; F66-L70 HydrophobicContact CE1-CD2 4.15Å; F66-L70 HydrophobicContact CE2-CD2 3.83Å; F66-L70 HydrophobicContact CZ-CD2 3.53Å; F66-L70 HydrophobicContact CZ-CG 4.33Å; F66-L70 PolarHBondContact O-N 3.33Å; F66-F96 HydrophobicContact CD2-CB 4.13Å; F66-F96 HydrophobicContact CD2-CD2 4.45Å; F66-F96 HydrophobicContact CE2-CB 4Å; F66-F96 AromaticContact CE2-CD2 3.69Å; F66-F96 HydrophobicContact CE2-CD2 3.69Å; F66-F96 HydrophobicContact CE2-CG 4.35Å; F66-F96 AromaticContact CZ-CD2 3.98Å; F66-F96 HydrophobicContact CZ-CD2 3.98Å; F66-N99 HydrophobicContact CB-CB 3.47Å; F66-N99 VanDerWaalsContact CB-CB 3.47Å; F66-N99 HydrophobicContact CD1-CB 4.28Å; F66-N99 WeakPolarHBondContact CD1-OD1 3.33Å; F66-N99 HydrophobicContact CG-CB 3.92Å; F66-V281 HydrophobicContact CE1-CB 4.36Å; F66-V281 HydrophobicContact CE1-CG1 3.73Å; F66-V281 HydrophobicContact CE1-CG2 4.19Å; F66-V281 HydrophobicContact CZ-CB 4.31Å; F66-V281 HydrophobicContact CZ-CG1 3.74Å; F66-V281 HydrophobicContact CZ-CG2 3.75Å
67V97.1Very high95.5Very high0 Ų029 Ų290%014%0.141CC..Hα-helixtrans-57.4-37.8177.8165.20000111.3F28 L32 D63 L64 T69 L70 P71 C284F28-V67 HydrophobicContact CD2-CG1 3.72Å; F28-V67 WeakPolarHBondContact CD2-O 3.09Å; F28-V67 HydrophobicContact CE2-CG1 4.26Å; L32-V67 HydrophobicContact CB-CG1 3.78Å; L32-V67 HydrophobicContact CD1-CG1 4.31Å; D63-V67 VanDerWaalsContact O-CB 3.32Å; D63-V67 WeakPolarHBondContact O-CB 3.2Å; D63-V67 WeakPolarHBondContact O-CG2 3.36Å; D63-V67 PolarHBondContact O-N 3.49Å; L64-V67 PolarHBondContact O-N 3.29Å; V67-T69 PolarHBondContact O-N 2.94Å; V67-L70 HydrophobicContact CB-CD1 4.48Å; V67-L70 HydrophobicContact CG2-CD1 4.25Å; V67-L70 WeakPolarHBondContact O-CB 3.26Å; V67-L70 PolarHBondContact O-N 2.86Å; V67-P71 WeakPolarHBondContact O-CD 3.41Å; V67-C284 HydrophobicContact CG2-CB 4.32Å
68F96.6Very high95.4Very high117 Ų11732.4 Ų32.451%0.51316%0.164SC..THydrogen-bonded Turntrans-63.1-20173.8-76.2-57.5000114.1L32 L64 F66 P71L32-F68 HydrophobicContact CD1-CE1 3.87Å; L32-F68 HydrophobicContact CD1-CZ 3.91Å; L64-F68 HydrophobicContact CB-CD2 4.45Å; L64-F68 HydrophobicContact CB-CE2 4.18Å; L64-F68 WeakPolarHBondContact O-CD2 3.45Å; L64-F68 WeakPolarHBondContact O-CG 3.49Å; L64-F68 PolarHBondContact O-N 3.36Å; F66-F68 PolarHBondContact O-N 3.17Å; F68-P71 WeakPolarHBondContact O-CD 3.45Å
69T96.2Very high95.2Very high8 Ų834 Ų345%0.04918%0.175CC..THydrogen-bonded Turntrans-85.3-17.1174.673.80000113.7F66 V67 F72 R73 L95F66-T69 WeakPolarHBondContact O-CA 3.27Å; F66-T69 WeakPolarHBondContact O-CB 3.39Å; F66-T69 PolarHBondContact O-N 3.05Å; F66-T69 PolarHBondContact O-OG1 2.95Å; V67-T69 PolarHBondContact O-N 2.94Å; T69-F72 PolarHBondContact O-N 2.67Å; T69-R73 PolarHBondContact O-N 3.44Å; T69-L95 HydrophobicContact CG2-CB 3.99Å; T69-L95 HydrophobicContact CG2-CD1 3.48Å; T69-L95 VanDerWaalsContact CG2-CD1 3.48Å; T69-L95 HydrophobicContact CG2-CG 4.36Å
70L96.3Very high94.8Very high0 Ų038.5 Ų38.50%020%0.196CC..Hα-helixtrans-61-38.8-176-66.7178.7000113.9F24 V27 F28 F66 V67 F72 R73 I74F24-L70 HydrophobicContact CB-CD2 4.13Å; F24-L70 HydrophobicContact CD1-CD2 4.11Å; F24-L70 HydrophobicContact CG-CD2 4.01Å; V27-L70 HydrophobicContact CB-CD1 4.15Å; V27-L70 HydrophobicContact CG1-CD1 3.8Å; F28-L70 HydrophobicContact CB-CB 4.15Å; F28-L70 HydrophobicContact CB-CD1 4.05Å; F28-L70 HydrophobicContact CD2-CB 4.35Å; F66-L70 HydrophobicContact CE1-CD2 4.15Å; F66-L70 HydrophobicContact CE2-CD2 3.83Å; F66-L70 HydrophobicContact CZ-CD2 3.53Å; F66-L70 HydrophobicContact CZ-CG 4.33Å; F66-L70 PolarHBondContact O-N 3.33Å; V67-L70 HydrophobicContact CB-CD1 4.48Å; V67-L70 HydrophobicContact CG2-CD1 4.25Å; V67-L70 WeakPolarHBondContact O-CB 3.26Å; V67-L70 PolarHBondContact O-N 2.86Å; L70-F72 VanDerWaalsContact C-N 3.27Å; L70-F72 PolarHBondContact O-N 2.81Å; L70-R73 CarbonylContact O-C 3.59Å; L70-R73 WeakPolarHBondContact O-CB 3.08Å; L70-R73 PolarHBondContact O-N 2.9Å; L70-I74 HydrophobicContact CB-CD1 4.38Å; L70-I74 WeakPolarHBondContact O-CD1 3.31Å; L70-I74 VanDerWaalsContact O-CG1 3.24Å; L70-I74 WeakPolarHBondContact O-CG1 3.49Å; L70-I74 PolarHBondContact O-N 2.96Å
71P96.8Very high94.6Very high49 Ų4940.9 Ų40.932%0.31821%0.209SC..Hα-helixtrans-54.7-40.7176.4-2937.3000113.7F28 V67 F68 I74 F75F28-P71 HydrophobicContact CD2-CG 3.89Å; F28-P71 HydrophobicContact CE2-CG 3.56Å; F28-P71 HydrophobicContact CG-CG 4.5Å; F28-P71 HydrophobicContact CZ-CG 3.92Å; V67-P71 WeakPolarHBondContact O-CD 3.41Å; F68-P71 WeakPolarHBondContact O-CD 3.45Å; P71-I74 PolarHBondContact O-N 3.37Å; P71-F75 WeakPolarHBondContact O-CB 3.32Å; P71-F75 PolarHBondContact O-N 3.03Å
72F95.4Very high94.4Very high66 Ų6636.7 Ų36.729%0.28919%0.188SC..Hα-helixtrans-67.2-38.5177.6-53.5-73.9000111.9T69 L70 Y76 W82 F84 L88T69-F72 PolarHBondContact O-N 2.67Å; L70-F72 VanDerWaalsContact C-N 3.27Å; L70-F72 PolarHBondContact O-N 2.81Å; F72-Y76 WeakPolarHBondContact O-CB 3.42Å; F72-Y76 PolarHBondContact O-N 3Å; F72-W82 HydrophobicContact CB-CH2 3.62Å; F72-W82 HydrophobicContact CB-CZ3 3.86Å; F72-F84 HydrophobicContact CB-CD2 4.27Å; F72-F84 HydrophobicContact CB-CE2 4.17Å; F72-F84 AromaticContact CD1-CD1 3.84Å; F72-F84 HydrophobicContact CD1-CD1 3.84Å; F72-F84 AromaticContact CD1-CD2 3.96Å; F72-F84 HydrophobicContact CD1-CD2 3.96Å; F72-F84 AromaticContact CD1-CE1 3.81Å; F72-F84 HydrophobicContact CD1-CE1 3.81Å; F72-F84 AromaticContact CD1-CE2 3.92Å; F72-F84 HydrophobicContact CD1-CE2 3.92Å; F72-F84 AromaticContact CD1-CG 3.93Å; F72-F84 HydrophobicContact CD1-CG 3.93Å; F72-F84 AromaticContact CD1-CZ 3.85Å; F72-F84 HydrophobicContact CD1-CZ 3.85Å; F72-F84 HydrophobicContact CE1-CD1 4.12Å; F72-F84 HydrophobicContact CE1-CE1 4.17Å; F72-L88 HydrophobicContact CD1-CD2 3.5Å; F72-L88 VanDerWaalsContact CD1-CD2 3.5Å; F72-L88 HydrophobicContact CD2-CD2 4.07Å; F72-L88 HydrophobicContact CE1-CD2 3.52Å; F72-L88 HydrophobicContact CE2-CD2 4.1Å; F72-L88 HydrophobicContact CG-CD2 3.78Å; F72-L88 HydrophobicContact CZ-CD2 3.83Å
73R94.1Very high94.1Very high13 Ų1340.2 Ų40.25%0.04921%0.211CC..Hα-helixtrans-67.4-43174.8-69.4174.5173.4-108.92.1111.4F24 T69 L70 F75 Y76 F77 S92 F169F24-R73 HydrophobicContact CD2-CB 3.94Å; F24-R73 HydrophobicContact CE2-CB 4.14Å; T69-R73 PolarHBondContact O-N 3.44Å; L70-R73 CarbonylContact O-C 3.59Å; L70-R73 WeakPolarHBondContact O-CB 3.08Å; L70-R73 PolarHBondContact O-N 2.9Å; R73-F75 VanDerWaalsContact C-N 3.32Å; R73-F75 PolarHBondContact O-N 2.62Å; R73-Y76 PolarHBondContact O-N 3.41Å; R73-F77 HydrophobicContact CB-CD2 4.35Å; R73-F77 HydrophobicContact CB-CE2 4.35Å; R73-F77 WeakPolarHBondContact O-CD2 3.23Å; R73-F77 PolarHBondContact O-N 3.02Å; R73-S92 PolarHBondContact NE-OG 3.08Å; R73-S92 PolarHBondContact NH2-O 2.84Å; R73-F169 HydrophobicContact CG-CE2 3.98Å; R73-F169 HydrophobicContact CG-CZ 3.83Å
74I95.8Very high93.9Very high30 Ų3043.7 Ų43.715%0.15423%0.226CC..Hα-helixtrans-59.2-46.5176.4-66.8159.2000109.8F24 F28 L70 P71 F77 T78F24-I74 HydrophobicContact CB-CD1 4.16Å; F24-I74 HydrophobicContact CB-CG1 3.61Å; F28-I74 HydrophobicContact CB-CD1 4.34Å; L70-I74 HydrophobicContact CB-CD1 4.38Å; L70-I74 WeakPolarHBondContact O-CD1 3.31Å; L70-I74 VanDerWaalsContact O-CG1 3.24Å; L70-I74 WeakPolarHBondContact O-CG1 3.49Å; L70-I74 PolarHBondContact O-N 2.96Å; P71-I74 PolarHBondContact O-N 3.37Å; I74-F77 PolarHBondContact O-N 3.21Å; I74-T78 WeakPolarHBondContact O-CB 2.99Å; I74-T78 PolarHBondContact O-N 3.33Å; I74-T78 VanDerWaalsContact O-N 3.08Å; I74-T78 PolarHBondContact O-OG1 3.39Å
75F95.5Very high93.6Very high84 Ų8444.3 Ų44.337%0.36824%0.236SC..Hα-helixtrans-55.8-54.2175-175.1-86.8000110.6P71 R73 F77 T78 T79 N81 P83 F84P71-F75 WeakPolarHBondContact O-CB 3.32Å; P71-F75 PolarHBondContact O-N 3.03Å; R73-F75 VanDerWaalsContact C-N 3.32Å; R73-F75 PolarHBondContact O-N 2.62Å; F75-F77 PolarHBondContact O-N 2.84Å; F75-T78 PolarHBondContact O-N 3.45Å; F75-T78 VanDerWaalsContact O-N 3.12Å; F75-T79 HydrophobicContact CD1-CG2 4.3Å; F75-T79 WeakPolarHBondContact CD1-OG1 3.46Å; F75-T79 HydrophobicContact CD2-CG2 4.2Å; F75-T79 HydrophobicContact CE1-CG2 4.02Å; F75-T79 VanDerWaalsContact CE1-OG1 3.23Å; F75-T79 WeakPolarHBondContact CE1-OG1 3.5Å; F75-T79 HydrophobicContact CE2-CG2 3.92Å; F75-T79 HydrophobicContact CG-CG2 4.39Å; F75-T79 HydrophobicContact CZ-CG2 3.83Å; F75-T79 PolarHBondContact O-N 3.46Å; F75-T79 PolarHBondContact O-OG1 3.37Å; F75-N81 WeakPolarHBondContact CE1-O 3.25Å; F75-P83 HydrophobicContact CD1-CG 4.36Å; F75-P83 HydrophobicContact CE1-CG 3.66Å; F75-P83 HydrophobicContact CZ-CG 4.2Å; F75-F84 HydrophobicContact CB-CE2 4.19Å; F75-F84 HydrophobicContact CB-CZ 4.16Å; F75-F84 AromaticContact CD1-CE2 3.7Å; F75-F84 HydrophobicContact CD1-CE2 3.7Å; F75-F84 AromaticContact CD1-CZ 3.76Å; F75-F84 HydrophobicContact CD1-CZ 3.76Å; F75-F84 HydrophobicContact CD2-CZ 4.47Å; F75-F84 HydrophobicContact CE1-CE2 4.4Å; F75-F84 HydrophobicContact CE1-CZ 4.29Å; F75-F84 HydrophobicContact CG-CE2 4.1Å; F75-F84 AromaticContact CG-CZ 3.87Å; F75-F84 HydrophobicContact CG-CZ 3.87Å
76Y92.6Very high93.2Very high2 Ų244 Ų441%0.00824%0.235CC..Hα-helixtrans-55.6-48.7179.5177.5-106000113.5F72 R73 T78 Q80 W82 C168 F169 E170F72-Y76 WeakPolarHBondContact O-CB 3.42Å; F72-Y76 PolarHBondContact O-N 3Å; R73-Y76 PolarHBondContact O-N 3.41Å; Y76-T78 PolarHBondContact O-N 3.49Å; Y76-Q80 WeakPolarHBondContact O-CA 3.42Å; Y76-Q80 PolarHBondContact O-N 3.24Å; Y76-W82 HydrophobicContact CD2-CB 3.89Å; Y76-W82 HydrophobicContact CD2-CE3 4.23Å; Y76-W82 HydrophobicContact CE2-CB 4.27Å; Y76-W82 HydrophobicContact CG-CE3 4.17Å; Y76-C168 WeakPolarHBondContact CE1-O 3.36Å; Y76-C168 PolarHBondContact OH-O 3.21Å; Y76-F169 AromaticContact CD1-CD2 3.83Å; Y76-F169 HydrophobicContact CD1-CD2 3.83Å; Y76-F169 HydrophobicContact CD1-CE2 4.31Å; Y76-F169 HydrophobicContact CE1-CD2 4.03Å; Y76-F169 HydrophobicContact CG-CD2 4.44Å; Y76-E170 WeakPolarHBondContact OH-CG 3.48Å
77F90.9Very high92.9Very high14 Ų1450 Ų506%0.06127%0.266CS..Hα-helixtrans-73.3-13-177.9-71.9-64000113.6Y17 Y20 F24 R73 I74 F75 F169Y17-F77 HydrophobicContact CD1-CB 4.48Å; Y17-F77 AromaticContact CD1-CD1 3.82Å; Y17-F77 HydrophobicContact CD1-CD1 3.82Å; Y17-F77 HydrophobicContact CE1-CD1 4.16Å; Y20-F77 AromaticContact CD2-CD1 3.59Å; Y20-F77 HydrophobicContact CD2-CD1 3.59Å; Y20-F77 HydrophobicContact CD2-CD2 4Å; Y20-F77 AromaticContact CD2-CE1 3.39Å; Y20-F77 HydrophobicContact CD2-CE1 3.39Å; Y20-F77 AromaticContact CD2-CE2 3.85Å; Y20-F77 HydrophobicContact CD2-CE2 3.85Å; Y20-F77 AromaticContact CD2-CG 3.91Å; Y20-F77 HydrophobicContact CD2-CG 3.91Å; Y20-F77 AromaticContact CD2-CZ 3.54Å; Y20-F77 HydrophobicContact CD2-CZ 3.54Å; Y20-F77 HydrophobicContact CE2-CD1 4.41Å; Y20-F77 AromaticContact CE2-CE1 3.79Å; Y20-F77 HydrophobicContact CE2-CE1 3.79Å; Y20-F77 HydrophobicContact CE2-CE2 4.45Å; Y20-F77 AromaticContact CE2-CZ 3.82Å; Y20-F77 HydrophobicContact CE2-CZ 3.82Å; Y20-F77 HydrophobicContact CG-CD1 4.45Å; Y20-F77 HydrophobicContact CG-CD2 4.26Å; Y20-F77 HydrophobicContact CG-CE1 4.49Å; Y20-F77 HydrophobicContact CG-CE2 4.33Å; Y20-F77 HydrophobicContact CG-CG 4.35Å; Y20-F77 HydrophobicContact CG-CZ 4.43Å; F24-F77 HydrophobicContact CD2-CD2 4.16Å; F24-F77 HydrophobicContact CD2-CE2 4.45Å; F24-F77 AromaticContact CE2-CD2 3.82Å; F24-F77 HydrophobicContact CE2-CD2 3.82Å; F24-F77 AromaticContact CE2-CE2 3.7Å; F24-F77 HydrophobicContact CE2-CE2 3.7Å; R73-F77 HydrophobicContact CB-CD2 4.35Å; R73-F77 HydrophobicContact CB-CE2 4.35Å; R73-F77 WeakPolarHBondContact O-CD2 3.23Å; R73-F77 PolarHBondContact O-N 3.02Å; I74-F77 PolarHBondContact O-N 3.21Å; F75-F77 PolarHBondContact O-N 2.84Å; F77-F169 HydrophobicContact CZ-CD2 4.46Å
78T91.3Very high92.6Very high102 Ų10252.2 Ų52.263%0.62628%0.278SS*.Hα-helixtrans-95.6-40.3176.1-51.50000112.1I74 F75 Y76I74-T78 WeakPolarHBondContact O-CB 2.99Å; I74-T78 PolarHBondContact O-N 3.33Å; I74-T78 VanDerWaalsContact O-N 3.08Å; I74-T78 PolarHBondContact O-OG1 3.39Å; F75-T78 PolarHBondContact O-N 3.45Å; F75-T78 VanDerWaalsContact O-N 3.12Å; Y76-T78 PolarHBondContact O-N 3.49Å
79T90.6Very high92.4Very high66 Ų6646.6 Ų46.641%0.40525%0.253SS..Hα-helixtrans-98.6-12.2-175.466.10000113.7F75 N81F75-T79 HydrophobicContact CD1-CG2 4.3Å; F75-T79 WeakPolarHBondContact CD1-OG1 3.46Å; F75-T79 HydrophobicContact CD2-CG2 4.2Å; F75-T79 HydrophobicContact CE1-CG2 4.02Å; F75-T79 VanDerWaalsContact CE1-OG1 3.23Å; F75-T79 WeakPolarHBondContact CE1-OG1 3.5Å; F75-T79 HydrophobicContact CE2-CG2 3.92Å; F75-T79 HydrophobicContact CG-CG2 4.39Å; F75-T79 HydrophobicContact CZ-CG2 3.83Å; F75-T79 PolarHBondContact O-N 3.46Å; F75-T79 PolarHBondContact O-OG1 3.37Å; T79-N81 PolarHBondContact O-N 3.25Å; T79-N81 PolarHBondContact OG1-N 2.84Å; T79-N81 PolarHBondContact OG1-O 3.17Å
80Q87.9Confident92.1Very high95 Ų9548.7 Ų48.744%0.44426%0.262SS..SBendtrans55.528.8-172-58.9-178.9-11.700112.8Y17 Y76Y17-Q80 HydrophobicContact CD1-CG 4.23Å; Y17-Q80 HydrophobicContact CE1-CG 4Å; Y76-Q80 WeakPolarHBondContact O-CA 3.42Å; Y76-Q80 PolarHBondContact O-N 3.24Å
81N90.1Very high91.9Very high51 Ų5151.7 Ų51.727%0.27328%0.277SS..  trans-138.9135.7179.8-173.433000111.5F75 T79 P83 S165 E166F75-N81 WeakPolarHBondContact CE1-O 3.25Å; T79-N81 PolarHBondContact O-N 3.25Å; T79-N81 PolarHBondContact OG1-N 2.84Å; T79-N81 PolarHBondContact OG1-O 3.17Å; N81-P83 WeakPolarHBondContact O-CD 3.47Å; N81-S165 WeakPolarHBondContact OD1-CA 3.45Å; N81-E166 PolarHBondContact OD1-N 2.96Å
82W91.1Very high91.7Very high0 Ų049.4 Ų49.40%026%0.262CS..  trans-109.985.9177.2-174.6-90.4000111.5F72 Y76 F84 G85 L88 C89 T157 E166 C168 F169F72-W82 HydrophobicContact CB-CH2 3.62Å; F72-W82 HydrophobicContact CB-CZ3 3.86Å; Y76-W82 HydrophobicContact CD2-CB 3.89Å; Y76-W82 HydrophobicContact CD2-CE3 4.23Å; Y76-W82 HydrophobicContact CE2-CB 4.27Å; Y76-W82 HydrophobicContact CG-CE3 4.17Å; W82-F84 VanDerWaalsContact C-N 3.25Å; W82-F84 AromaticContact CD2-CD2 3.9Å; W82-F84 HydrophobicContact CD2-CD2 3.9Å; W82-F84 AromaticContact CE2-CD2 3.88Å; W82-F84 HydrophobicContact CE3-CD2 4.01Å; W82-F84 HydrophobicContact CG-CD2 4.48Å; W82-F84 HydrophobicContact CH2-CD2 4.08Å; W82-F84 HydrophobicContact CZ2-CB 3.96Å; W82-F84 AromaticContact CZ2-CD2 3.97Å; W82-F84 HydrophobicContact CZ2-CD2 3.97Å; W82-F84 HydrophobicContact CZ2-CG 4.42Å; W82-F84 HydrophobicContact CZ3-CD2 4.09Å; W82-F84 PolarHBondContact O-N 3.18Å; W82-G85 PolarHBondContact NE1-O 3.25Å; W82-L88 HydrophobicContact CZ2-CB 3.98Å; W82-L88 HydrophobicContact CZ2-CD2 4.23Å; W82-L88 HydrophobicContact CZ2-CG 4.03Å; W82-C89 HydrophobicContact CZ2-CB 4.05Å; W82-C89 VanDerWaalsContact CZ2-N 3.34Å; W82-T157 HydrophobicContact CG-CG2 4.49Å; W82-E166 HydrophobicContact CB-CB 4.39Å; W82-E166 WeakPolarHBondContact CB-O 3.49Å; W82-E166 PolarHBondContact N-O 3.42Å; W82-E166 WeakPolarHBondContact O-CB 3.24Å; W82-C168 HydrophobicContact CB-CB 3.88Å; W82-C168 HydrophobicContact CD2-CB 3.58Å; W82-C168 HydrophobicContact CE3-CB 3.85Å; W82-C168 HydrophobicContact CG-CB 3.56Å; W82-F169 AromaticContact CE3-CE2 3.99Å; W82-F169 HydrophobicContact CE3-CE2 3.99Å; W82-F169 HydrophobicContact CH2-CE2 4.34Å; W82-F169 HydrophobicContact CH2-CZ 4.22Å; W82-F169 AromaticContact CZ3-CE2 3.63Å; W82-F169 HydrophobicContact CZ3-CE2 3.63Å; W82-F169 AromaticContact CZ3-CZ 3.97Å; W82-F169 HydrophobicContact CZ3-CZ 3.97Å
83P92.1Very high91.4Very high75 Ų7546.6 Ų46.649%0.48725%0.25SS..THydrogen-bonded Turntrans-82.12.8-178.234.2-38.3000114.1F75 N81F75-P83 HydrophobicContact CD1-CG 4.36Å; F75-P83 HydrophobicContact CE1-CG 3.66Å; F75-P83 HydrophobicContact CZ-CG 4.2Å; N81-P83 WeakPolarHBondContact O-CD 3.47Å
84F91.8Very high91.2Very high73 Ų7348.6 Ų48.632%0.3226%0.261SS..THydrogen-bonded Turntrans-92.93.4-167.5-47.6-72.8000114.4F72 F75 W82 L88F72-F84 HydrophobicContact CB-CD2 4.27Å; F72-F84 HydrophobicContact CB-CE2 4.17Å; F72-F84 AromaticContact CD1-CD1 3.84Å; F72-F84 HydrophobicContact CD1-CD1 3.84Å; F72-F84 AromaticContact CD1-CD2 3.96Å; F72-F84 HydrophobicContact CD1-CD2 3.96Å; F72-F84 AromaticContact CD1-CE1 3.81Å; F72-F84 HydrophobicContact CD1-CE1 3.81Å; F72-F84 AromaticContact CD1-CE2 3.92Å; F72-F84 HydrophobicContact CD1-CE2 3.92Å; F72-F84 AromaticContact CD1-CG 3.93Å; F72-F84 HydrophobicContact CD1-CG 3.93Å; F72-F84 AromaticContact CD1-CZ 3.85Å; F72-F84 HydrophobicContact CD1-CZ 3.85Å; F72-F84 HydrophobicContact CE1-CD1 4.12Å; F72-F84 HydrophobicContact CE1-CE1 4.17Å; F75-F84 HydrophobicContact CB-CE2 4.19Å; F75-F84 HydrophobicContact CB-CZ 4.16Å; F75-F84 AromaticContact CD1-CE2 3.7Å; F75-F84 HydrophobicContact CD1-CE2 3.7Å; F75-F84 AromaticContact CD1-CZ 3.76Å; F75-F84 HydrophobicContact CD1-CZ 3.76Å; F75-F84 HydrophobicContact CD2-CZ 4.47Å; F75-F84 HydrophobicContact CE1-CE2 4.4Å; F75-F84 HydrophobicContact CE1-CZ 4.29Å; F75-F84 HydrophobicContact CG-CE2 4.1Å; F75-F84 AromaticContact CG-CZ 3.87Å; F75-F84 HydrophobicContact CG-CZ 3.87Å; W82-F84 VanDerWaalsContact C-N 3.25Å; W82-F84 AromaticContact CD2-CD2 3.9Å; W82-F84 HydrophobicContact CD2-CD2 3.9Å; W82-F84 AromaticContact CE2-CD2 3.88Å; W82-F84 HydrophobicContact CE3-CD2 4.01Å; W82-F84 HydrophobicContact CG-CD2 4.48Å; W82-F84 HydrophobicContact CH2-CD2 4.08Å; W82-F84 HydrophobicContact CZ2-CB 3.96Å; W82-F84 AromaticContact CZ2-CD2 3.97Å; W82-F84 HydrophobicContact CZ2-CD2 3.97Å; W82-F84 HydrophobicContact CZ2-CG 4.42Å; W82-F84 HydrophobicContact CZ3-CD2 4.09Å; W82-F84 PolarHBondContact O-N 3.18Å; F84-L88 HydrophobicContact CB-CB 4.15Å; F84-L88 HydrophobicContact CB-CD2 3.47Å; F84-L88 VanDerWaalsContact CB-CD2 3.47Å; F84-L88 HydrophobicContact CB-CG 4.37Å; F84-L88 HydrophobicContact CD1-CD2 4.42Å; F84-L88 HydrophobicContact CG-CD2 3.95Å
85G90.4Very high91.2Very high29 Ų2948.6 Ų48.630%0.29926%0.261SS..Hα-helixtrans76.2166.9179.700000114.9W82 L87 L88 C89W82-G85 PolarHBondContact NE1-O 3.25Å; G85-L87 PolarHBondContact O-N 3.41Å; G85-L88 PolarHBondContact O-N 3.48Å; G85-C89 PolarHBondContact O-N 3.44Å
86D88.4Confident91Very high50 Ų5045 Ų4527%0.26725%0.245SC..Hα-helixtrans-63-39.3-172.8-178.766.3000113.7L88 C89 K90 S156 T157D86-L88 PolarHBondContact O-N 3.02Å; D86-C89 WeakPolarHBondContact O-CB 3.38Å; D86-C89 PolarHBondContact O-N 2.93Å; D86-K90 PolarHBondContact O-N 3.01Å; D86-K90 IonicContact OD1-NZ 2.67Å; D86-K90 WeakPolarHBondContact OD2-CD 3.32Å; D86-K90 WeakPolarHBondContact OD2-CE 3.37Å; D86-K90 IonicContact OD2-NZ 2.86Å; D86-K90 PolarHBondContact OD2-NZ 2.86Å; D86-S156 VanDerWaalsContact OD1-CA 3.27Å; D86-S156 WeakPolarHBondContact OD1-CA 3.43Å; D86-T157 HydrophobicContact CB-CG2 4.38Å; D86-T157 PolarHBondContact OD1-N 3.15Å; D86-T157 VanDerWaalsContact OD1-N 3.07Å
87L90.1Very high90.9Very high127 Ų12746.6 Ų46.667%0.66525%0.252SS*.Hα-helixtrans-59.2-46-179.4178.762000111.7G85 C89 K90 I91G85-L87 PolarHBondContact O-N 3.41Å; L87-C89 VanDerWaalsContact C-N 3.33Å; L87-K90 PolarHBondContact O-N 3.48Å; L87-I91 HydrophobicContact CD1-CD1 3.97Å; L87-I91 HydrophobicContact CD1-CG1 4.32Å; L87-I91 HydrophobicContact CG-CD1 3.88Å; L87-I91 VanDerWaalsContact O-CG1 3.31Å; L87-I91 WeakPolarHBondContact O-CG1 3.41Å; L87-I91 PolarHBondContact O-N 2.97Å
88L91.6Very high91Very high45 Ų4546.1 Ų46.124%0.23625%0.25CC..Hα-helixtrans-71.5-31.9-179.4-165.967.3000111.6F72 W82 F84 G85 D86 I91 S92F72-L88 HydrophobicContact CD1-CD2 3.5Å; F72-L88 VanDerWaalsContact CD1-CD2 3.5Å; F72-L88 HydrophobicContact CD2-CD2 4.07Å; F72-L88 HydrophobicContact CE1-CD2 3.52Å; F72-L88 HydrophobicContact CE2-CD2 4.1Å; F72-L88 HydrophobicContact CG-CD2 3.78Å; F72-L88 HydrophobicContact CZ-CD2 3.83Å; W82-L88 HydrophobicContact CZ2-CB 3.98Å; W82-L88 HydrophobicContact CZ2-CD2 4.23Å; W82-L88 HydrophobicContact CZ2-CG 4.03Å; F84-L88 HydrophobicContact CB-CB 4.15Å; F84-L88 HydrophobicContact CB-CD2 3.47Å; F84-L88 VanDerWaalsContact CB-CD2 3.47Å; F84-L88 HydrophobicContact CB-CG 4.37Å; F84-L88 HydrophobicContact CD1-CD2 4.42Å; F84-L88 HydrophobicContact CG-CD2 3.95Å; G85-L88 PolarHBondContact O-N 3.48Å; D86-L88 PolarHBondContact O-N 3.02Å; L88-I91 PolarHBondContact O-N 3.41Å; L88-S92 VanDerWaalsContact O-CB 3.23Å; L88-S92 WeakPolarHBondContact O-CB 3.42Å; L88-S92 PolarHBondContact O-N 2.94Å
89C90.8Very high91.2Very high0 Ų041.5 Ų41.50%022%0.221CC..Hα-helixtrans-59.1-51173179.70000110W82 G85 D86 L87 S92 V93 T157 C168W82-C89 HydrophobicContact CZ2-CB 4.05Å; W82-C89 VanDerWaalsContact CZ2-N 3.34Å; G85-C89 PolarHBondContact O-N 3.44Å; D86-C89 WeakPolarHBondContact O-CB 3.38Å; D86-C89 PolarHBondContact O-N 2.93Å; L87-C89 VanDerWaalsContact C-N 3.33Å; C89-S92 PolarHBondContact O-N 3.48Å; C89-V93 WeakPolarHBondContact O-CG2 3.46Å; C89-V93 PolarHBondContact O-N 2.97Å; C89-T157 HydrophobicContact CB-CG2 3.81Å; C89-C168 VanDerWaalsContact CA-SG 3.55Å; C89-C168 HydrophobicContact CB-CB 4Å; C89-C168 WeakPolarHBondContact CB-SG 3.46Å; C89-C168 WeakPolarHBondContact SG-CB 3.25Å; C89-C168 CovalentContact SG-SG 2.03Å; C89-C168 PolarHBondContact SG-SG 3.46Å
90K90.3Very high91.4Very high52 Ų5238.7 Ų38.723%0.22620%0.203CC..Hα-helixtrans-59.6-47.6176.6-79.2174.3178.7163.60113D86 L87 S92 V93 M94 V152 Q155D86-K90 PolarHBondContact O-N 3.01Å; D86-K90 IonicContact OD1-NZ 2.67Å; D86-K90 WeakPolarHBondContact OD2-CD 3.32Å; D86-K90 WeakPolarHBondContact OD2-CE 3.37Å; D86-K90 IonicContact OD2-NZ 2.86Å; D86-K90 PolarHBondContact OD2-NZ 2.86Å; L87-K90 PolarHBondContact O-N 3.48Å; K90-S92 VanDerWaalsContact C-N 3.33Å; K90-S92 PolarHBondContact O-N 3.37Å; K90-V93 PolarHBondContact O-N 3.03Å; K90-M94 WeakPolarHBondContact O-CB 3.37Å; K90-M94 PolarHBondContact O-N 3.24Å; K90-V152 HydrophobicContact CB-CG1 3.97Å; K90-V152 HydrophobicContact CD-CG1 4.36Å; K90-V152 HydrophobicContact CG-CG1 4.14Å; K90-Q155 WeakPolarHBondContact CE-O 3.34Å; K90-Q155 HydrophobicContact CG-CB 4.48Å
91I91.4Very high91.7Very high62 Ų6235 Ų3532%0.31819%0.186SC..Hα-helixtrans-61-43176.7-70.4169.5000110.8L87 L88 V93 M94 L95L87-I91 HydrophobicContact CD1-CD1 3.97Å; L87-I91 HydrophobicContact CD1-CG1 4.32Å; L87-I91 HydrophobicContact CG-CD1 3.88Å; L87-I91 VanDerWaalsContact O-CG1 3.31Å; L87-I91 WeakPolarHBondContact O-CG1 3.41Å; L87-I91 PolarHBondContact O-N 2.97Å; L88-I91 PolarHBondContact O-N 3.41Å; I91-V93 VanDerWaalsContact C-N 3.34Å; I91-V93 PolarHBondContact O-N 3.32Å; I91-M94 PolarHBondContact O-N 2.97Å; I91-L95 HydrophobicContact CG2-CD1 3.76Å; I91-L95 HydrophobicContact CG2-CG 4.21Å; I91-L95 WeakPolarHBondContact O-CB 3.47Å; I91-L95 WeakPolarHBondContact O-CG 3.21Å; I91-L95 PolarHBondContact O-N 3.42Å
92S92.7Very high91.9Very high1 Ų132.6 Ų32.61%0.00717%0.173CC..Hα-helixtrans-64-37.8179.1-173.70000112.4R73 L88 C89 K90 F96R73-S92 PolarHBondContact NE-OG 3.08Å; R73-S92 PolarHBondContact NH2-O 2.84Å; L88-S92 VanDerWaalsContact O-CB 3.23Å; L88-S92 WeakPolarHBondContact O-CB 3.42Å; L88-S92 PolarHBondContact O-N 2.94Å; C89-S92 PolarHBondContact O-N 3.48Å; K90-S92 VanDerWaalsContact C-N 3.33Å; K90-S92 PolarHBondContact O-N 3.37Å; S92-F96 WeakPolarHBondContact O-CB 3.44Å; S92-F96 PolarHBondContact O-N 3.33Å
93V89.9Confident92.1Very high7 Ų732.6 Ų32.64%0.04217%0.173CC..Hα-helixtrans-67-46.9172.1173.70000111.3C89 K90 I91 L95 F96 Y97 A151 Q155 F169C89-V93 WeakPolarHBondContact O-CG2 3.46Å; C89-V93 PolarHBondContact O-N 2.97Å; K90-V93 PolarHBondContact O-N 3.03Å; I91-V93 VanDerWaalsContact C-N 3.34Å; I91-V93 PolarHBondContact O-N 3.32Å; V93-L95 PolarHBondContact O-N 2.91Å; V93-F96 WeakPolarHBondContact O-CB 3.21Å; V93-F96 PolarHBondContact O-N 3.09Å; V93-Y97 HydrophobicContact CG1-CD2 3.76Å; V93-Y97 HydrophobicContact CG1-CE2 3.65Å; V93-Y97 WeakPolarHBondContact O-CD2 3.31Å; V93-Y97 PolarHBondContact O-N 3.17Å; V93-A151 HydrophobicContact CG1-CB 4.3Å; V93-Q155 HydrophobicContact CG2-CG 3.84Å; V93-F169 HydrophobicContact CG2-CD1 3.5Å; V93-F169 HydrophobicContact CG2-CE1 3.41Å; V93-F169 VanDerWaalsContact CG2-CE1 3.41Å
94M90.8Very high92.3Very high56 Ų5629 Ų2928%0.27615%0.15SC..Hα-helixtrans-57.6-48.6179.8-169.6-17769.300111.8K90 I91 F96 Y97 T98 V152K90-M94 WeakPolarHBondContact O-CB 3.37Å; K90-M94 PolarHBondContact O-N 3.24Å; I91-M94 PolarHBondContact O-N 2.97Å; M94-F96 VanDerWaalsContact C-N 3.32Å; M94-F96 PolarHBondContact O-N 3.4Å; M94-Y97 PolarHBondContact O-N 3.39Å; M94-T98 WeakPolarHBondContact O-CB 3.21Å; M94-T98 PolarHBondContact O-N 2.67Å; M94-T98 PolarHBondContact O-OG1 3.17Å; M94-V152 HydrophobicContact CB-CG2 3.53Å; M94-V152 HydrophobicContact CG-CG2 3.86Å; M94-V152 HydrophobicContact SD-CG2 4.5Å
95L94.1Very high92.5Very high29 Ų2927.4 Ų27.415%0.15214%0.144CC..Hα-helixtrans-68.2-31-177.9-72.1178.7000112.4L65 T69 I91 V93 N99L65-L95 HydrophobicContact CB-CD2 4.21Å; T69-L95 HydrophobicContact CG2-CB 3.99Å; T69-L95 HydrophobicContact CG2-CD1 3.48Å; T69-L95 VanDerWaalsContact CG2-CD1 3.48Å; T69-L95 HydrophobicContact CG2-CG 4.36Å; I91-L95 HydrophobicContact CG2-CD1 3.76Å; I91-L95 HydrophobicContact CG2-CG 4.21Å; I91-L95 WeakPolarHBondContact O-CB 3.47Å; I91-L95 WeakPolarHBondContact O-CG 3.21Å; I91-L95 PolarHBondContact O-N 3.42Å; V93-L95 PolarHBondContact O-N 2.91Å; L95-N99 WeakPolarHBondContact O-CB 3.48Å; L95-N99 PolarHBondContact O-N 3.41Å
96F92.6Very high92.7Very high9 Ų926.1 Ų26.14%0.03913%0.13CC..Hα-helixtrans-62.9-52.6171.5166.8-98.5000112.2F66 S92 V93 M94 N99 M100 L277 V281F66-F96 HydrophobicContact CD2-CB 4.13Å; F66-F96 HydrophobicContact CD2-CD2 4.45Å; F66-F96 HydrophobicContact CE2-CB 4Å; F66-F96 AromaticContact CE2-CD2 3.69Å; F66-F96 HydrophobicContact CE2-CD2 3.69Å; F66-F96 HydrophobicContact CE2-CG 4.35Å; F66-F96 AromaticContact CZ-CD2 3.98Å; F66-F96 HydrophobicContact CZ-CD2 3.98Å; S92-F96 WeakPolarHBondContact O-CB 3.44Å; S92-F96 PolarHBondContact O-N 3.33Å; V93-F96 WeakPolarHBondContact O-CB 3.21Å; V93-F96 PolarHBondContact O-N 3.09Å; M94-F96 VanDerWaalsContact C-N 3.32Å; M94-F96 PolarHBondContact O-N 3.4Å; F96-N99 PolarHBondContact O-N 3.15Å; F96-M100 PolarHBondContact O-N 3.32Å; F96-L277 HydrophobicContact CE2-CD1 4.49Å; F96-L277 HydrophobicContact CE2-CD2 4.37Å; F96-L277 HydrophobicContact CE2-CG 4.29Å; F96-L277 HydrophobicContact CZ-CD1 3.99Å; F96-L277 HydrophobicContact CZ-CG 4.09Å; F96-V281 HydrophobicContact CD2-CG2 4.24Å; F96-V281 HydrophobicContact CE2-CG2 3.66Å
97Y90.5Very high92.9Very high36 Ų3623.9 Ų23.914%0.14112%0.118CC..Hα-helixtrans-67.6-38.4179-74.5-66.5000112.3V93 M94 N99 M100 Y101 S148 A151V93-Y97 HydrophobicContact CG1-CD2 3.76Å; V93-Y97 HydrophobicContact CG1-CE2 3.65Å; V93-Y97 WeakPolarHBondContact O-CD2 3.31Å; V93-Y97 PolarHBondContact O-N 3.17Å; M94-Y97 PolarHBondContact O-N 3.39Å; Y97-N99 VanDerWaalsContact C-N 3.32Å; Y97-N99 PolarHBondContact O-N 3.49Å; Y97-M100 PolarHBondContact O-N 3.03Å; Y97-Y101 AromaticContact CD1-CE2 3.92Å; Y97-Y101 HydrophobicContact CD1-CE2 3.92Å; Y97-Y101 VanDerWaalsContact O-CD2 3.26Å; Y97-Y101 WeakPolarHBondContact O-CD2 3.34Å; Y97-Y101 PolarHBondContact O-N 3.48Å; Y97-S148 WeakPolarHBondContact CB-OG 3.24Å; Y97-A151 HydrophobicContact CD2-CB 3.91Å; Y97-A151 HydrophobicContact CE2-CB 3.76Å
98T93.6Very high93.1Very high3 Ų318.2 Ų18.22%0.0189%0.089CC..Hα-helixtrans-59.1-43.8174-66.40000111.2M94 G102 W141 V144 I145 S148M94-T98 WeakPolarHBondContact O-CB 3.21Å; M94-T98 PolarHBondContact O-N 2.67Å; M94-T98 PolarHBondContact O-OG1 3.17Å; T98-G102 VanDerWaalsContact O-CA 3.23Å; T98-G102 WeakPolarHBondContact O-CA 3.44Å; T98-G102 PolarHBondContact O-N 3.42Å; T98-W141 HydrophobicContact CG2-CE3 4.1Å; T98-W141 HydrophobicContact CG2-CZ3 3.56Å; T98-V144 HydrophobicContact CG2-CG2 3.83Å; T98-I145 HydrophobicContact CG2-CG1 4.37Å; T98-S148 PolarHBondContact N-OG 3.3Å; T98-S148 PolarHBondContact OG1-OG 3Å
99N95.4Very high93.2Very high6 Ų617.1 Ų17.13%0.0329%0.085CC..Hα-helixtrans-66.7-45.4175.5171.5-101.9000112.5S62 D63 F66 L95 F96 Y97 G102 S103S62-N99 PolarHBondContact O-ND2 3.31Å; S62-N99 WeakPolarHBondContact OG-CA 3.28Å; D63-N99 VanDerWaalsContact CA-ND2 3.34Å; D63-N99 WeakPolarHBondContact CA-ND2 3.2Å; D63-N99 PolarHBondContact N-ND2 3.46Å; D63-N99 PolarHBondContact OD1-ND2 3.13Å; F66-N99 HydrophobicContact CB-CB 3.47Å; F66-N99 VanDerWaalsContact CB-CB 3.47Å; F66-N99 HydrophobicContact CD1-CB 4.28Å; F66-N99 WeakPolarHBondContact CD1-OD1 3.33Å; F66-N99 HydrophobicContact CG-CB 3.92Å; L95-N99 WeakPolarHBondContact O-CB 3.48Å; L95-N99 PolarHBondContact O-N 3.41Å; F96-N99 PolarHBondContact O-N 3.15Å; Y97-N99 VanDerWaalsContact C-N 3.32Å; Y97-N99 PolarHBondContact O-N 3.49Å; N99-G102 PolarHBondContact O-N 2.81Å; N99-S103 VanDerWaalsContact O-CB 3.22Å; N99-S103 WeakPolarHBondContact O-CB 3.36Å; N99-S103 PolarHBondContact O-N 3.21Å; N99-S103 PolarHBondContact O-OG 3.37Å
100M93.2Very high93.2Very high6 Ų617.1 Ų17.13%0.039%0.085CC..Hα-helixtrans-61.4-55.5-177.6-170.4-178.4107.400112F96 Y97 S103 I104 F242 Y245 N246F96-M100 PolarHBondContact O-N 3.32Å; Y97-M100 PolarHBondContact O-N 3.03Å; M100-S103 PolarHBondContact O-N 2.93Å; M100-I104 HydrophobicContact CG-CD1 4.43Å; M100-I104 WeakPolarHBondContact O-CG1 3.29Å; M100-I104 PolarHBondContact O-N 2.91Å; M100-I104 VanDerWaalsContact O-N 3.14Å; M100-F242 HydrophobicContact CG-CD1 4.27Å; M100-F242 HydrophobicContact CG-CE1 4.27Å; M100-Y245 HydrophobicContact CE-CD1 3.76Å; M100-Y245 HydrophobicContact CE-CE1 3.6Å; M100-Y245 HydrophobicContact SD-CD1 3.38Å; M100-Y245 WeakPolarHBondContact SD-CD1 3.38Å; M100-Y245 HydrophobicContact SD-CE1 3.19Å; M100-Y245 WeakPolarHBondContact SD-CE1 3.4Å; M100-N246 WeakPolarHBondContact CE-OD1 3.13Å
101Y94Very high93.2Very high19 Ų1915.2 Ų15.28%0.0758%0.078CC..Hα-helixtrans-74.6-29.9179.8-61.4-65.9000112.3Y97 S103 I104 L105 I188 E189Y97-Y101 AromaticContact CD1-CE2 3.92Å; Y97-Y101 HydrophobicContact CD1-CE2 3.92Å; Y97-Y101 VanDerWaalsContact O-CD2 3.26Å; Y97-Y101 WeakPolarHBondContact O-CD2 3.34Å; Y97-Y101 PolarHBondContact O-N 3.48Å; Y101-S103 VanDerWaalsContact C-N 3.33Å; Y101-I104 HydrophobicContact CD1-CD1 4.15Å; Y101-I104 PolarHBondContact O-N 2.95Å; Y101-L105 WeakPolarHBondContact O-CB 3.19Å; Y101-L105 WeakPolarHBondContact O-CG 3.26Å; Y101-L105 PolarHBondContact O-N 3.22Å; Y101-I188 HydrophobicContact CE1-CG2 4.2Å; Y101-I188 HydrophobicContact CE2-CG2 4.03Å; Y101-E189 PolarHBondContact OH-OE1 3.25Å
102G96Very high93.3Very high0 Ų014.3 Ų14.30%08%0.075CC..Hα-helixtrans-58.6-47.8171.500000110.8T98 N99 L105 F106T98-G102 VanDerWaalsContact O-CA 3.23Å; T98-G102 WeakPolarHBondContact O-CA 3.44Å; T98-G102 PolarHBondContact O-N 3.42Å; N99-G102 PolarHBondContact O-N 2.81Å; G102-L105 PolarHBondContact O-N 3.42Å; G102-F106 WeakPolarHBondContact O-CB 3.22Å; G102-F106 WeakPolarHBondContact O-CD2 3.37Å; G102-F106 WeakPolarHBondContact O-CG 3.42Å; G102-F106 PolarHBondContact O-N 2.93Å
103S95.3Very high93.2Very high0 Ų014.5 Ų14.50%08%0.076CC..Hα-helixtrans-61.5-46.8177.9-59.50000112.1N99 M100 Y101 L105 F106 L107N99-S103 VanDerWaalsContact O-CB 3.22Å; N99-S103 WeakPolarHBondContact O-CB 3.36Å; N99-S103 PolarHBondContact O-N 3.21Å; N99-S103 PolarHBondContact O-OG 3.37Å; M100-S103 PolarHBondContact O-N 2.93Å; Y101-S103 VanDerWaalsContact C-N 3.33Å; S103-L105 PolarHBondContact O-N 3.46Å; S103-F106 PolarHBondContact O-N 3.05Å; S103-L107 VanDerWaalsContact O-CB 3.29Å; S103-L107 WeakPolarHBondContact O-CB 3.46Å; S103-L107 VanDerWaalsContact O-CG 3.22Å; S103-L107 WeakPolarHBondContact O-CG 3.39Å; S103-L107 PolarHBondContact O-N 3.21Å
104I95.1Very high93Very high0 Ų016.5 Ų16.50%08%0.083CC..Hα-helixtrans-55.1-50.2175.1-71.6165.1000111M100 Y101 T108 G192 F193 P196 F238 F242M100-I104 HydrophobicContact CG-CD1 4.43Å; M100-I104 WeakPolarHBondContact O-CG1 3.29Å; M100-I104 PolarHBondContact O-N 2.91Å; M100-I104 VanDerWaalsContact O-N 3.14Å; Y101-I104 HydrophobicContact CD1-CD1 4.15Å; Y101-I104 PolarHBondContact O-N 2.95Å; I104-T108 WeakPolarHBondContact O-CB 3.39Å; I104-T108 PolarHBondContact O-N 3.48Å; I104-T108 PolarHBondContact O-OG1 3.3Å; I104-G192 WeakPolarHBondContact CG2-O 3.48Å; I104-F193 HydrophobicContact CD1-CD2 4.1Å; I104-P196 HydrophobicContact CG2-CB 3.42Å; I104-P196 VanDerWaalsContact CG2-CB 3.42Å; I104-P196 HydrophobicContact CG2-CG 3.74Å; I104-F238 HydrophobicContact CB-CE2 4.2Å; I104-F238 HydrophobicContact CG1-CE2 4.2Å; I104-F238 HydrophobicContact CG2-CE2 3.84Å; I104-F238 HydrophobicContact CG2-CZ 3.99Å; I104-F242 HydrophobicContact CD1-CB 4.26Å; I104-F242 HydrophobicContact CD1-CD1 3.86Å; I104-F242 HydrophobicContact CD1-CE1 4.4Å; I104-F242 HydrophobicContact CD1-CG 4.01Å; I104-F242 HydrophobicContact CG1-CB 4.26Å; I104-F242 HydrophobicContact CG1-CD1 3.69Å; I104-F242 HydrophobicContact CG1-CD2 3.82Å; I104-F242 HydrophobicContact CG1-CE1 3.93Å; I104-F242 HydrophobicContact CG1-CE2 4.08Å; I104-F242 HydrophobicContact CG1-CG 3.63Å; I104-F242 HydrophobicContact CG1-CZ 4.12Å
105L96Very high93Very high39 Ų3915 Ų1520%0.2048%0.075CC..Hα-helixtrans-71.1-41.9-177-68.9178.3000112.4Y101 G102 S103 T108 C109 V140 T143 V144 P196Y101-L105 WeakPolarHBondContact O-CB 3.19Å; Y101-L105 WeakPolarHBondContact O-CG 3.26Å; Y101-L105 PolarHBondContact O-N 3.22Å; G102-L105 PolarHBondContact O-N 3.42Å; S103-L105 PolarHBondContact O-N 3.46Å; L105-T108 CarbonylContact O-C 3.15Å; L105-T108 WeakPolarHBondContact O-CB 3.48Å; L105-T108 PolarHBondContact O-N 3.09Å; L105-C109 PolarHBondContact O-N 3.22Å; L105-C109 PolarHBondContact O-SG 3.39Å; L105-V140 HydrophobicContact CB-CG1 3.79Å; L105-V140 HydrophobicContact CB-CG2 4.13Å; L105-V140 HydrophobicContact CD1-CG1 4.05Å; L105-T143 HydrophobicContact CD1-CG2 4.43Å; L105-V144 HydrophobicContact CD1-CG1 3.76Å; L105-P196 HydrophobicContact CD2-CG 3.88Å
106F95.3Very high92.8Very high1 Ų115.1 Ų15.10%0.0048%0.076CC..Hα-helixtrans-65.9-41.3177.5-73.1-52.5000112.3Y55 N58 L59 G102 S103 T108 C109 I110 C137 V140 W141Y55-F106 HydrophobicContact CD1-CD1 4.41Å; N58-F106 HydrophobicContact CB-CD1 4.15Å; N58-F106 HydrophobicContact CB-CD2 4.43Å; N58-F106 HydrophobicContact CB-CE1 3.56Å; N58-F106 HydrophobicContact CB-CE2 3.89Å; N58-F106 HydrophobicContact CB-CZ 3.45Å; N58-F106 VanDerWaalsContact CB-CZ 3.45Å; L59-F106 HydrophobicContact CB-CB 4.12Å; L59-F106 HydrophobicContact CB-CD2 4.41Å; L59-F106 HydrophobicContact CB-CG 4.46Å; L59-F106 HydrophobicContact CD1-CB 4.18Å; L59-F106 HydrophobicContact CD1-CD2 4.49Å; G102-F106 WeakPolarHBondContact O-CB 3.22Å; G102-F106 WeakPolarHBondContact O-CD2 3.37Å; G102-F106 WeakPolarHBondContact O-CG 3.42Å; G102-F106 PolarHBondContact O-N 2.93Å; S103-F106 PolarHBondContact O-N 3.05Å; F106-T108 VanDerWaalsContact C-N 3.28Å; F106-T108 PolarHBondContact O-N 3.02Å; F106-C109 WeakPolarHBondContact O-CB 3.41Å; F106-C109 PolarHBondContact O-N 2.67Å; F106-I110 VanDerWaalsContact O-CG1 3.31Å; F106-I110 WeakPolarHBondContact O-CG1 3.28Å; F106-I110 PolarHBondContact O-N 2.75Å; F106-C137 HydrophobicContact CE1-CB 4.11Å; F106-V140 HydrophobicContact CD1-CG1 4.23Å; F106-V140 HydrophobicContact CD2-CG1 4.37Å; F106-V140 HydrophobicContact CE1-CB 3.96Å; F106-V140 HydrophobicContact CE1-CG1 3.77Å; F106-V140 HydrophobicContact CE1-CG2 4.37Å; F106-V140 HydrophobicContact CE2-CG1 3.92Å; F106-V140 HydrophobicContact CG-CG1 4.49Å; F106-V140 HydrophobicContact CZ-CB 4.05Å; F106-V140 HydrophobicContact CZ-CG1 3.56Å; F106-W141 HydrophobicContact CE2-CZ2 4.47Å; F106-W141 AromaticContact CZ-NE1 3.78Å
107L92Very high92.5Very high3 Ų315.7 Ų15.72%0.0168%0.082CC..Hα-helixtrans-61.2-39.8172.4-71.7171.1000111.2L59 S103 I110 S111 F238 F242 V290L59-L107 HydrophobicContact CD2-CD2 3.9Å; L59-L107 HydrophobicContact CD2-CG 4.18Å; S103-L107 VanDerWaalsContact O-CB 3.29Å; S103-L107 WeakPolarHBondContact O-CB 3.46Å; S103-L107 VanDerWaalsContact O-CG 3.22Å; S103-L107 WeakPolarHBondContact O-CG 3.39Å; S103-L107 PolarHBondContact O-N 3.21Å; L107-I110 PolarHBondContact O-N 2.81Å; L107-S111 PolarHBondContact O-N 2.81Å; L107-S111 PolarHBondContact O-OG 3.26Å; L107-F238 HydrophobicContact CB-CD2 4.3Å; L107-F238 HydrophobicContact CD1-CD2 4.19Å; L107-F242 HydrophobicContact CD1-CE2 3.74Å; L107-F242 HydrophobicContact CD1-CZ 4.41Å; L107-V290 HydrophobicContact CD2-CG1 4.11Å; L107-V290 HydrophobicContact CD2-CG2 4.41Å
108T94.4Very high92.2Very high9 Ų915.3 Ų15.36%0.0558%0.082CC..Hα-helixtrans-62.4-44.9173.6-54.40000111.8I104 L105 F106 I110 S111 V112 P196 L199 N200I104-T108 WeakPolarHBondContact O-CB 3.39Å; I104-T108 PolarHBondContact O-N 3.48Å; I104-T108 PolarHBondContact O-OG1 3.3Å; L105-T108 CarbonylContact O-C 3.15Å; L105-T108 WeakPolarHBondContact O-CB 3.48Å; L105-T108 PolarHBondContact O-N 3.09Å; F106-T108 VanDerWaalsContact C-N 3.28Å; F106-T108 PolarHBondContact O-N 3.02Å; T108-I110 VanDerWaalsContact C-N 3.29Å; T108-I110 PolarHBondContact O-N 3.5Å; T108-S111 PolarHBondContact O-N 3.06Å; T108-V112 HydrophobicContact CG2-CG2 4.32Å; T108-V112 WeakPolarHBondContact O-CB 3.36Å; T108-V112 VanDerWaalsContact O-CG2 3.31Å; T108-V112 WeakPolarHBondContact O-CG2 3.36Å; T108-V112 PolarHBondContact O-N 2.89Å; T108-P196 WeakPolarHBondContact OG1-CB 3.48Å; T108-L199 HydrophobicContact CG2-CB 3.95Å; T108-L199 HydrophobicContact CG2-CD1 4.14Å; T108-N200 PolarHBondContact OG1-ND2 3.42Å
109C94.5Very high91.8Very high21 Ų2116.5 Ų16.514%0.1429%0.09CC..Hα-helixtrans-59.6-40.1175.4-68.10000111.8Y55 L105 F106 D113Y55-C109 HydrophobicContact CD1-CB 3.76Å; Y55-C109 HydrophobicContact CD2-CB 4.15Å; Y55-C109 HydrophobicContact CE1-CB 3.81Å; Y55-C109 HydrophobicContact CE2-CB 4.19Å; Y55-C109 HydrophobicContact CG-CB 3.96Å; L105-C109 PolarHBondContact O-N 3.22Å; L105-C109 PolarHBondContact O-SG 3.39Å; F106-C109 WeakPolarHBondContact O-CB 3.41Å; F106-C109 PolarHBondContact O-N 2.67Å; C109-D113 VanDerWaalsContact O-CB 3.25Å; C109-D113 WeakPolarHBondContact O-CB 3.46Å; C109-D113 PolarHBondContact O-N 3.11Å
110I90.9Very high91.4Very high0 Ų021.1 Ų21.10%011%0.107CC..Hα-helixtrans-63-47.8174.6-67.4165000110.2T52 Y55 M56 L59 F106 L107 T108 V112 D113 R114 T294T52-I110 HydrophobicContact CG2-CG1 4.4Å; T52-I110 HydrophobicContact CG2-CG2 4.06Å; Y55-I110 HydrophobicContact CD2-CG1 4.45Å; Y55-I110 HydrophobicContact CG-CG1 4.46Å; M56-I110 HydrophobicContact CG-CD1 4.07Å; L59-I110 HydrophobicContact CD2-CD1 4.45Å; F106-I110 VanDerWaalsContact O-CG1 3.31Å; F106-I110 WeakPolarHBondContact O-CG1 3.28Å; F106-I110 PolarHBondContact O-N 2.75Å; L107-I110 PolarHBondContact O-N 2.81Å; T108-I110 VanDerWaalsContact C-N 3.29Å; T108-I110 PolarHBondContact O-N 3.5Å; I110-V112 PolarHBondContact O-N 2.73Å; I110-D113 PolarHBondContact O-N 3.46Å; I110-R114 WeakPolarHBondContact O-CG 3.44Å; I110-R114 PolarHBondContact O-N 3.17Å; I110-T294 HydrophobicContact CG2-CG2 4.27Å
111S90.2Very high90.8Very high13 Ų1323.7 Ų23.79%0.09113%0.125CC..Hα-helixtrans-60.2-44.1177.4-68.80000112.8L107 T108 R114 F115 N200L107-S111 PolarHBondContact O-N 2.81Å; L107-S111 PolarHBondContact O-OG 3.26Å; T108-S111 PolarHBondContact O-N 3.06Å; S111-R114 PolarHBondContact O-N 3.03Å; S111-F115 WeakPolarHBondContact O-CB 3.22Å; S111-F115 PolarHBondContact O-N 3.27Å; S111-N200 WeakPolarHBondContact CB-OD1 3.46Å; S111-N200 PolarHBondContact OG-OD1 2.99Å
112V92.3Very high90.2Very high43 Ų4330.1 Ų30.126%0.26115%0.153SC..Hα-helixtrans-66.6-43.7177.4172.30000111.2T108 I110 R114 F115 L116T108-V112 HydrophobicContact CG2-CG2 4.32Å; T108-V112 WeakPolarHBondContact O-CB 3.36Å; T108-V112 VanDerWaalsContact O-CG2 3.31Å; T108-V112 WeakPolarHBondContact O-CG2 3.36Å; T108-V112 PolarHBondContact O-N 2.89Å; I110-V112 PolarHBondContact O-N 2.73Å; V112-R114 VanDerWaalsContact C-N 3.27Å; V112-R114 PolarHBondContact O-N 3.37Å; V112-F115 WeakPolarHBondContact O-CB 3.34Å; V112-F115 PolarHBondContact O-N 3.44Å; V112-L116 HydrophobicContact CG1-CD1 3.96Å; V112-L116 HydrophobicContact CG1-CG 4.3Å; V112-L116 WeakPolarHBondContact O-CB 3.32Å; V112-L116 VanDerWaalsContact O-CG 3.31Å; V112-L116 WeakPolarHBondContact O-CG 3.39Å; V112-L116 PolarHBondContact O-N 2.99Å
113D90.4Very high89.5Confident5 Ų538.5 Ų38.53%0.02719%0.19CC..Hα-helixtrans-56.9-43.6175.7177.464.1000111.1T52 Y55 C109 I110 L116 A117 R128T52-D113 PolarHBondContact OG1-OD2 3.47Å; Y55-D113 HydrophobicContact CE2-CB 4.15Å; C109-D113 VanDerWaalsContact O-CB 3.25Å; C109-D113 WeakPolarHBondContact O-CB 3.46Å; C109-D113 PolarHBondContact O-N 3.11Å; I110-D113 PolarHBondContact O-N 3.46Å; D113-L116 PolarHBondContact O-N 3.15Å; D113-A117 WeakPolarHBondContact O-CB 3.21Å; D113-A117 PolarHBondContact O-N 2.93Å; D113-R128 PolarHBondContact O-NE 2.99Å; D113-R128 IonicContact OD1-CZ 3.77Å; D113-R128 VanDerWaalsContact OD1-CZ 3.32Å; D113-R128 IonicContact OD1-NE 2.69Å; D113-R128 PolarHBondContact OD1-NE 3.19Å; D113-R128 IonicContact OD1-NH2 3.23Å; D113-R128 PolarHBondContact OD1-NH2 3.4Å; D113-R128 IonicContact OD2-NH2 3.82Å; D113-R128 PolarHBondContact OD2-NH2 2.93Å
114R86.9Confident89.1Confident49 Ų4938.7 Ų38.719%0.18519%0.191CC..Hα-helixtrans-68.7-41.3178-66.2-64.6-178.6179.50.8112.6I110 S111 V112 A117 I118 M230 T294I110-R114 WeakPolarHBondContact O-CG 3.44Å; I110-R114 PolarHBondContact O-N 3.17Å; S111-R114 PolarHBondContact O-N 3.03Å; V112-R114 VanDerWaalsContact C-N 3.27Å; V112-R114 PolarHBondContact O-N 3.37Å; R114-A117 WeakPolarHBondContact O-CB 3.39Å; R114-A117 PolarHBondContact O-N 2.91Å; R114-I118 WeakPolarHBondContact O-CD1 3.4Å; R114-I118 WeakPolarHBondContact O-CG1 3.37Å; R114-I118 PolarHBondContact O-N 3.1Å; R114-I118 VanDerWaalsContact O-N 3.15Å; R114-M230 HydrophobicContact CB-CE 3.94Å; R114-M230 HydrophobicContact CG-CE 3.49Å; R114-M230 VanDerWaalsContact CG-CE 3.49Å; R114-M230 HydrophobicContact CG-SD 4.27Å; R114-T294 PolarHBondContact NH2-O 3.49Å
115F89.7Confident88.5Confident24 Ų2445.5 Ų45.511%0.10522%0.221CC..Hα-helixtrans-56.5-51.8172.4160.7-106.6000111.9S111 V112 A117 I118 V119 Y120 C203 M206 V207S111-F115 WeakPolarHBondContact O-CB 3.22Å; S111-F115 PolarHBondContact O-N 3.27Å; V112-F115 WeakPolarHBondContact O-CB 3.34Å; V112-F115 PolarHBondContact O-N 3.44Å; F115-A117 VanDerWaalsContact C-N 3.31Å; F115-A117 PolarHBondContact O-N 2.86Å; F115-I118 PolarHBondContact O-N 2.9Å; F115-V119 HydrophobicContact CD2-CB 4Å; F115-V119 HydrophobicContact CD2-CG2 3.5Å; F115-V119 HydrophobicContact CE2-CB 3.79Å; F115-V119 HydrophobicContact CE2-CG1 3.97Å; F115-V119 HydrophobicContact CE2-CG2 3.62Å; F115-V119 WeakPolarHBondContact O-CB 3.34Å; F115-V119 WeakPolarHBondContact O-CG2 3.15Å; F115-V119 PolarHBondContact O-N 3.42Å; F115-Y120 HydrophobicContact CE1-CD2 4.34Å; F115-Y120 HydrophobicContact CE1-CE2 4.14Å; F115-Y120 HydrophobicContact CE2-CE2 4.26Å; F115-Y120 HydrophobicContact CZ-CD2 4.12Å; F115-Y120 AromaticContact CZ-CE2 3.59Å; F115-Y120 HydrophobicContact CZ-CE2 3.59Å; F115-C203 HydrophobicContact CB-CB 3.85Å; F115-C203 HydrophobicContact CG-CB 4.2Å; F115-M206 HydrophobicContact CD2-CB 3.98Å; F115-M206 HydrophobicContact CD2-SD 4.48Å; F115-M206 HydrophobicContact CE2-CB 3.66Å; F115-M206 HydrophobicContact CE2-CE 3.63Å; F115-M206 HydrophobicContact CE2-CG 4.23Å; F115-M206 HydrophobicContact CE2-SD 3.52Å; F115-M206 VanDerWaalsContact CE2-SD 3.52Å; F115-M206 HydrophobicContact CZ-CE 3.79Å; F115-M206 HydrophobicContact CZ-SD 3.77Å; F115-V207 HydrophobicContact CB-CG2 3.98Å; F115-V207 HydrophobicContact CD2-CG2 4.14Å
116L89.9Confident88Confident31 Ų3149.3 Ų49.316%0.16225%0.246CC..Hα-helixtrans-61.7-39.6179.1-70173.5000112V112 D113 I118 Y120 S124 L127 R128V112-L116 HydrophobicContact CG1-CD1 3.96Å; V112-L116 HydrophobicContact CG1-CG 4.3Å; V112-L116 WeakPolarHBondContact O-CB 3.32Å; V112-L116 VanDerWaalsContact O-CG 3.31Å; V112-L116 WeakPolarHBondContact O-CG 3.39Å; V112-L116 PolarHBondContact O-N 2.99Å; D113-L116 PolarHBondContact O-N 3.15Å; L116-I118 VanDerWaalsContact C-N 3.31Å; L116-I118 PolarHBondContact O-N 3.3Å; L116-Y120 HydrophobicContact CD2-CD2 4.41Å; L116-Y120 CarbonylContact O-C 3.56Å; L116-Y120 WeakPolarHBondContact O-CA 3.38Å; L116-Y120 PolarHBondContact O-N 2.92Å; L116-Y120 VanDerWaalsContact O-N 3.15Å; L116-S124 PolarHBondContact O-OG 3.49Å; L116-S124 VanDerWaalsContact O-OG 3.06Å; L116-L127 HydrophobicContact CD1-CD2 3.81Å; L116-R128 HydrophobicContact CB-CG 4.29Å; L116-R128 HydrophobicContact CD1-CG 4.41Å
117A85.9Confident87.6Confident22 Ų2254 Ų5418%0.18227%0.27CS..Hα-helixtrans-58.8-39.8177.200000113.5D113 R114 F115 P121D113-A117 WeakPolarHBondContact O-CB 3.21Å; D113-A117 PolarHBondContact O-N 2.93Å; R114-A117 WeakPolarHBondContact O-CB 3.39Å; R114-A117 PolarHBondContact O-N 2.91Å; F115-A117 VanDerWaalsContact C-N 3.31Å; F115-A117 PolarHBondContact O-N 2.86Å; A117-P121 WeakPolarHBondContact O-CB 3.44Å
118I84.3Confident87.5Confident27 Ų2756.6 Ų56.614%0.13828%0.28CS..Hα-helixtrans-96.7-43.9-168.9-64.5160.8000111.3R114 F115 L116 V207 T210 L211 V227R114-I118 WeakPolarHBondContact O-CD1 3.4Å; R114-I118 WeakPolarHBondContact O-CG1 3.37Å; R114-I118 PolarHBondContact O-N 3.1Å; R114-I118 VanDerWaalsContact O-N 3.15Å; F115-I118 PolarHBondContact O-N 2.9Å; L116-I118 VanDerWaalsContact C-N 3.31Å; L116-I118 PolarHBondContact O-N 3.3Å; I118-V207 HydrophobicContact CB-CG1 4.41Å; I118-V207 HydrophobicContact CD1-CG1 3.63Å; I118-V207 HydrophobicContact CD1-CG2 4.43Å; I118-V207 HydrophobicContact CG2-CG1 4.11Å; I118-T210 HydrophobicContact CG2-CG2 4.43Å; I118-L211 HydrophobicContact CG2-CD2 4.16Å; I118-L211 HydrophobicContact CG2-CG 4.43Å; I118-V227 HydrophobicContact CD1-CG1 3.42Å; I118-V227 VanDerWaalsContact CD1-CG1 3.42Å
119V86.3Confident87.3Confident29 Ų2958.3 Ų58.318%0.17629%0.29CS..Hα-helixtrans-83.1-34.6-174.9-174.70000111.1F115 P121 V207 T210F115-V119 HydrophobicContact CD2-CB 4Å; F115-V119 HydrophobicContact CD2-CG2 3.5Å; F115-V119 HydrophobicContact CE2-CB 3.79Å; F115-V119 HydrophobicContact CE2-CG1 3.97Å; F115-V119 HydrophobicContact CE2-CG2 3.62Å; F115-V119 WeakPolarHBondContact O-CB 3.34Å; F115-V119 WeakPolarHBondContact O-CG2 3.15Å; F115-V119 PolarHBondContact O-N 3.42Å; V119-P121 VanDerWaalsContact C-CD 3.47Å; V119-V207 HydrophobicContact CG2-CG2 4.15Å; V119-T210 HydrophobicContact CG2-CG2 4.44Å
120Y85.9Confident87.1Confident102 Ų10262.1 Ų62.140%0.430%0.304SS..  trans-129.956.9-177.1-58.6-67.2000113.2F115 L116 F122 K123 S124F115-Y120 HydrophobicContact CE1-CD2 4.34Å; F115-Y120 HydrophobicContact CE1-CE2 4.14Å; F115-Y120 HydrophobicContact CE2-CE2 4.26Å; F115-Y120 HydrophobicContact CZ-CD2 4.12Å; F115-Y120 AromaticContact CZ-CE2 3.59Å; F115-Y120 HydrophobicContact CZ-CE2 3.59Å; L116-Y120 HydrophobicContact CD2-CD2 4.41Å; L116-Y120 CarbonylContact O-C 3.56Å; L116-Y120 WeakPolarHBondContact O-CA 3.38Å; L116-Y120 PolarHBondContact O-N 2.92Å; L116-Y120 VanDerWaalsContact O-N 3.15Å; Y120-F122 VanDerWaalsContact C-N 3.29Å; Y120-F122 PolarHBondContact O-N 3.02Å; Y120-F122 VanDerWaalsContact O-N 3.15Å; Y120-K123 PolarHBondContact O-N 3.13Å; Y120-S124 WeakPolarHBondContact O-CB 3.03Å; Y120-S124 PolarHBondContact O-N 3.41Å; Y120-S124 PolarHBondContact O-OG 2.94Å
121P80.7Confident87.1Confident61 Ų6171.3 Ų71.340%0.39634%0.339SS..THydrogen-bonded Turntrans-61.4-28.4-17023-34.5000115.1A117 V119 K125A117-P121 WeakPolarHBondContact O-CB 3.44Å; V119-P121 VanDerWaalsContact C-CD 3.47Å; P121-K125 WeakPolarHBondContact O-CG 3.29Å
122F81.2Confident87.3Confident153 Ų15373 Ų7367%0.67135%0.348SS*.THydrogen-bonded Turntrans-92.3-45.1179.8-59.6-71.4000112.6Y120 S124 K125Y120-F122 VanDerWaalsContact C-N 3.29Å; Y120-F122 PolarHBondContact O-N 3.02Å; Y120-F122 VanDerWaalsContact O-N 3.15Å; F122-S124 VanDerWaalsContact C-N 3.31Å; F122-S124 PolarHBondContact O-N 2.98Å; F122-K125 PolarHBondContact O-N 3.32Å
123K83Confident87.4Confident176 Ų17671.1 Ų71.177%0.76534%0.336SS*.THydrogen-bonded Turntrans-69.1-29-179-65.2-173.1177.5-175.40112.5Y120Y120-K123 PolarHBondContact O-N 3.13Å
124S86.4Confident87.6Confident5 Ų577 Ų774%0.03536%0.362CS..THydrogen-bonded Turntrans-84-6.4-177.567.90000114.7L116 Y120 F122 T126 L127 R128L116-S124 PolarHBondContact O-OG 3.49Å; L116-S124 VanDerWaalsContact O-OG 3.06Å; Y120-S124 WeakPolarHBondContact O-CB 3.03Å; Y120-S124 PolarHBondContact O-N 3.41Å; Y120-S124 PolarHBondContact O-OG 2.94Å; F122-S124 VanDerWaalsContact C-N 3.31Å; F122-S124 PolarHBondContact O-N 2.98Å; S124-T126 VanDerWaalsContact C-N 3.28Å; S124-T126 PolarHBondContact O-N 3.37Å; S124-L127 PolarHBondContact O-N 3.44Å; S124-R128 WeakPolarHBondContact O-CB 3.41Å; S124-R128 WeakPolarHBondContact O-CG 3.47Å; S124-R128 PolarHBondContact O-N 3.44Å; S124-R128 WeakPolarHBondContact OG-CD 3.31Å
125K81.9Confident88.1Confident143 Ų14379.3 Ų79.362%0.62238%0.376SS*.THydrogen-bonded Turntrans-58.4-37.2-177.1-74.6-171.7176.9-176.10113.5P121 F122P121-K125 WeakPolarHBondContact O-CG 3.29Å; F122-K125 PolarHBondContact O-N 3.32Å
126T86.2Confident88.4Confident118 Ų11880.9 Ų80.972%0.72439%0.388SS*.THydrogen-bonded Turntrans-74.6-28.2178.751.80000112.4S124 T129 N132S124-T126 VanDerWaalsContact C-N 3.28Å; S124-T126 PolarHBondContact O-N 3.37Å; T126-T129 WeakPolarHBondContact O-CG2 3.39Å; T126-N132 PolarHBondContact O-ND2 3.27Å
127L87.6Confident88.8Confident100 Ų10079.5 Ų79.552%0.52438%0.381SS..THydrogen-bonded Turntrans-83.5-41.7178.9-173.761000111.8L116 S124 T129 N132L116-L127 HydrophobicContact CD1-CD2 3.81Å; S124-L127 PolarHBondContact O-N 3.44Å; L127-T129 VanDerWaalsContact C-N 3.29Å; L127-T129 PolarHBondContact O-N 3.17Å; L127-N132 WeakPolarHBondContact O-CB 3.31Å; L127-N132 PolarHBondContact O-ND2 2.94Å
128R89.8Confident89.4Confident57 Ų5783.3 Ų83.322%0.21540%0.397CS..SBendtrans-84.769-177.6-63.2-179.370.6-131.8-4.2111E51 D113 L116 S124E51-R128 HydrophobicContact CG-CB 4.43Å; D113-R128 PolarHBondContact O-NE 2.99Å; D113-R128 IonicContact OD1-CZ 3.77Å; D113-R128 VanDerWaalsContact OD1-CZ 3.32Å; D113-R128 IonicContact OD1-NE 2.69Å; D113-R128 PolarHBondContact OD1-NE 3.19Å; D113-R128 IonicContact OD1-NH2 3.23Å; D113-R128 PolarHBondContact OD1-NH2 3.4Å; D113-R128 IonicContact OD2-NH2 3.82Å; D113-R128 PolarHBondContact OD2-NH2 2.93Å; L116-R128 HydrophobicContact CB-CG 4.29Å; L116-R128 HydrophobicContact CD1-CG 4.41Å; S124-R128 WeakPolarHBondContact O-CB 3.41Å; S124-R128 WeakPolarHBondContact O-CG 3.47Å; S124-R128 PolarHBondContact O-N 3.44Å; S124-R128 WeakPolarHBondContact OG-CD 3.31Å
129T89.8Confident90Very high45 Ų4583.5 Ų83.528%0.27641%0.405SS..  trans-117151.8173.871.30000110.4T126 L127 R131 N132 A133T126-T129 WeakPolarHBondContact O-CG2 3.39Å; L127-T129 VanDerWaalsContact C-N 3.29Å; L127-T129 PolarHBondContact O-N 3.17Å; T129-R131 PolarHBondContact O-N 2.81Å; T129-N132 PolarHBondContact O-N 3.08Å; T129-N132 VanDerWaalsContact O-N 3.1Å; T129-N132 PolarHBondContact OG1-N 2.8Å; T129-N132 PolarHBondContact OG1-ND2 2.79Å; T129-N132 PolarHBondContact OG1-OD1 2.97Å; T129-A133 PolarHBondContact O-N 2.76Å
130K89Confident90.6Very high101 Ų10182.7 Ų82.744%0.43940%0.4SS..Hα-helixtrans-55.9-35.4175.9-54.1-175.5-157.6-172.70112.9R49 E51 A133 K134R49-K130 WeakPolarHBondContact O-CD 3.25Å; R49-K130 WeakPolarHBondContact O-CE 3.08Å; R49-K130 PolarHBondContact O-NZ 3.1Å; E51-K130 PolarHBondContact OE1-N 3.32Å; K130-A133 PolarHBondContact O-N 2.98Å; K130-K134 WeakPolarHBondContact O-CG 3.46Å; K130-K134 PolarHBondContact O-N 2.92Å
131R92.2Very high91.1Very high193 Ų19380 Ų8073%0.72839%0.389SS*.Hα-helixtrans-62.2-49.9176.7-177.9-179.7178-178.3-0.5110.3T129 A133 K134 I135T129-R131 PolarHBondContact O-N 2.81Å; R131-A133 VanDerWaalsContact C-N 3.35Å; R131-A133 PolarHBondContact O-N 3.05Å; R131-K134 PolarHBondContact O-N 3.36Å; R131-I135 HydrophobicContact CG-CD1 4.09Å; R131-I135 WeakPolarHBondContact O-CG1 3.47Å; R131-I135 PolarHBondContact O-N 2.94Å
132N93.9Very high91.9Very high50 Ų5082.8 Ų82.827%0.26740%0.401SS..Hα-helixtrans-65-40.7179.3-64.8-4.1000111.2T126 L127 T129 K134 I135 V136T126-N132 PolarHBondContact O-ND2 3.27Å; L127-N132 WeakPolarHBondContact O-CB 3.31Å; L127-N132 PolarHBondContact O-ND2 2.94Å; T129-N132 PolarHBondContact O-N 3.08Å; T129-N132 VanDerWaalsContact O-N 3.1Å; T129-N132 PolarHBondContact OG1-N 2.8Å; T129-N132 PolarHBondContact OG1-ND2 2.79Å; T129-N132 PolarHBondContact OG1-OD1 2.97Å; N132-K134 VanDerWaalsContact C-N 3.31Å; N132-K134 PolarHBondContact O-N 2.92Å; N132-I135 PolarHBondContact O-N 3.23Å; N132-I135 VanDerWaalsContact O-N 3.17Å; N132-V136 WeakPolarHBondContact O-CG2 3.48Å; N132-V136 PolarHBondContact O-N 3.34Å
133A94.4Very high92.5Very high2 Ų279.8 Ų79.82%0.01740%0.395CS..Hα-helixtrans-59.1-41.4175.600000112.3E51 T54 Y55 T129 K130 R131 V136 C137E51-A133 HydrophobicContact CB-CB 4.18Å; T54-A133 HydrophobicContact CG2-CB 4.37Å; Y55-A133 HydrophobicContact CE1-CB 4.19Å; Y55-A133 HydrophobicContact CE2-CB 4.3Å; Y55-A133 WeakPolarHBondContact OH-CA 3.22Å; T129-A133 PolarHBondContact O-N 2.76Å; K130-A133 PolarHBondContact O-N 2.98Å; R131-A133 VanDerWaalsContact C-N 3.35Å; R131-A133 PolarHBondContact O-N 3.05Å; A133-V136 PolarHBondContact O-N 3.5Å; A133-C137 PolarHBondContact O-N 2.97Å; A133-C137 PolarHBondContact O-SG 3.07Å
134K94.9Very high93.1Very high130 Ų13071.6 Ų71.657%0.56536%0.36SS*.Hα-helixtrans-63.8-44.3173.8-74179.6178.7-1730112.4T54 K130 R131 N132 V136 C137 I138T54-K134 HydrophobicContact CG2-CG 4.03Å; K130-K134 WeakPolarHBondContact O-CG 3.46Å; K130-K134 PolarHBondContact O-N 2.92Å; R131-K134 PolarHBondContact O-N 3.36Å; N132-K134 VanDerWaalsContact C-N 3.31Å; N132-K134 PolarHBondContact O-N 2.92Å; K134-V136 VanDerWaalsContact C-N 3.31Å; K134-V136 PolarHBondContact O-N 3.46Å; K134-C137 PolarHBondContact O-N 3.47Å; K134-I138 WeakPolarHBondContact O-CG1 3.4Å; K134-I138 PolarHBondContact O-N 2.77Å
135I96.8Very high93.4Very high96 Ų9675.1 Ų75.149%0.49238%0.377SS..Hα-helixtrans-59.9-45177-67.5166.4000110.1R131 N132 C137 I138 G139R131-I135 HydrophobicContact CG-CD1 4.09Å; R131-I135 WeakPolarHBondContact O-CG1 3.47Å; R131-I135 PolarHBondContact O-N 2.94Å; N132-I135 PolarHBondContact O-N 3.23Å; N132-I135 VanDerWaalsContact O-N 3.17Å; I135-C137 PolarHBondContact O-N 3.47Å; I135-I138 PolarHBondContact O-N 3.47Å; I135-G139 PolarHBondContact O-N 3.19Å
136V97.3Very high93.8Very high57 Ų5770.5 Ų70.535%0.34537%0.37SS..Hα-helixtrans-60.6-44.4175.3172.30000110.8Y55 N132 A133 K134 I138 G139 V140Y55-V136 HydrophobicContact CE1-CB 4.09Å; Y55-V136 HydrophobicContact CE1-CG1 3.82Å; N132-V136 WeakPolarHBondContact O-CG2 3.48Å; N132-V136 PolarHBondContact O-N 3.34Å; A133-V136 PolarHBondContact O-N 3.5Å; K134-V136 VanDerWaalsContact C-N 3.31Å; K134-V136 PolarHBondContact O-N 3.46Å; V136-I138 PolarHBondContact O-N 3.27Å; V136-G139 PolarHBondContact O-N 3.23Å; V136-V140 HydrophobicContact CG1-CG2 4.4Å; V136-V140 WeakPolarHBondContact O-CG2 3.49Å; V136-V140 PolarHBondContact O-N 2.65Å
137C97.8Very high93.8Very high3 Ų366.3 Ų66.32%0.0235%0.35CS..Hα-helixtrans-60.7-43.6177-65.70000112.3Y55 N58 F106 A133 K134 I135 G139 V140 W141Y55-C137 WeakPolarHBondContact CD1-SG 3.46Å; N58-C137 PolarHBondContact ND2-SG 3.4Å; N58-C137 VanDerWaalsContact ND2-SG 3.42Å; F106-C137 HydrophobicContact CE1-CB 4.11Å; A133-C137 PolarHBondContact O-N 2.97Å; A133-C137 PolarHBondContact O-SG 3.07Å; K134-C137 PolarHBondContact O-N 3.47Å; I135-C137 PolarHBondContact O-N 3.47Å; C137-G139 VanDerWaalsContact C-N 3.32Å; C137-G139 PolarHBondContact O-N 2.81Å; C137-V140 PolarHBondContact O-N 2.85Å; C137-W141 PolarHBondContact O-N 3.29Å
138I97.9Very high93.7Very high102 Ų10261.6 Ų61.652%0.52333%0.326SS..Hα-helixtrans-60.3-45.2175.1-67.2164.3000109.9K134 I135 V136 V140 W141 L142K134-I138 WeakPolarHBondContact O-CG1 3.4Å; K134-I138 PolarHBondContact O-N 2.77Å; I135-I138 PolarHBondContact O-N 3.47Å; V136-I138 PolarHBondContact O-N 3.27Å; I138-V140 PolarHBondContact O-N 2.92Å; I138-W141 PolarHBondContact O-N 3.47Å; I138-L142 HydrophobicContact CG2-CD1 3.98Å; I138-L142 HydrophobicContact CG2-CG 4.37Å; I138-L142 VanDerWaalsContact O-CG 3.32Å; I138-L142 WeakPolarHBondContact O-CG 3.38Å; I138-L142 PolarHBondContact O-N 3.27Å
139G97.9Very high93.3Very high30 Ų3060.9 Ų60.931%0.30933%0.332SS..Hα-helixtrans-57-48.2175.200000112.3I135 V136 C137 W141 L142 T143I135-G139 PolarHBondContact O-N 3.19Å; V136-G139 PolarHBondContact O-N 3.23Å; C137-G139 VanDerWaalsContact C-N 3.32Å; C137-G139 PolarHBondContact O-N 2.81Å; G139-W141 PolarHBondContact O-N 2.88Å; G139-L142 PolarHBondContact O-N 3.17Å; G139-T143 WeakPolarHBondContact O-CB 3.21Å; G139-T143 PolarHBondContact O-N 3.18Å; G139-T143 PolarHBondContact O-OG1 2.94Å
140V97.8Very high92.7Very high12 Ų1260.5 Ų60.57%0.07333%0.331CS..Hα-helixtrans-56.7-50.5176.1170.20000110.7L105 F106 V136 C137 I138 L142 T143 V144L105-V140 HydrophobicContact CB-CG1 3.79Å; L105-V140 HydrophobicContact CB-CG2 4.13Å; L105-V140 HydrophobicContact CD1-CG1 4.05Å; F106-V140 HydrophobicContact CD1-CG1 4.23Å; F106-V140 HydrophobicContact CD2-CG1 4.37Å; F106-V140 HydrophobicContact CE1-CB 3.96Å; F106-V140 HydrophobicContact CE1-CG1 3.77Å; F106-V140 HydrophobicContact CE1-CG2 4.37Å; F106-V140 HydrophobicContact CE2-CG1 3.92Å; F106-V140 HydrophobicContact CG-CG1 4.49Å; F106-V140 HydrophobicContact CZ-CB 4.05Å; F106-V140 HydrophobicContact CZ-CG1 3.56Å; V136-V140 HydrophobicContact CG1-CG2 4.4Å; V136-V140 WeakPolarHBondContact O-CG2 3.49Å; V136-V140 PolarHBondContact O-N 2.65Å; C137-V140 PolarHBondContact O-N 2.85Å; I138-V140 PolarHBondContact O-N 2.92Å; V140-L142 PolarHBondContact O-N 2.84Å; V140-T143 PolarHBondContact O-N 3.45Å; V140-V144 HydrophobicContact CG1-CG1 4.35Å; V140-V144 WeakPolarHBondContact O-CG1 3.32Å; V140-V144 WeakPolarHBondContact O-CG2 3.26Å; V140-V144 PolarHBondContact O-N 3.33Å
141W97.6Very high91.8Very high45 Ų4557 Ų5717%0.1732%0.321CS..Hα-helixtrans-56.3-48.2177.9-82113.7000112.6N58 L65 T98 F106 C137 I138 G139 T143 V144 I145N58-W141 PolarHBondContact OD1-NE1 2.98Å; L65-W141 HydrophobicContact CD1-CH2 3.89Å; L65-W141 HydrophobicContact CD1-CZ3 4.37Å; T98-W141 HydrophobicContact CG2-CE3 4.1Å; T98-W141 HydrophobicContact CG2-CZ3 3.56Å; F106-W141 HydrophobicContact CE2-CZ2 4.47Å; F106-W141 AromaticContact CZ-NE1 3.78Å; C137-W141 PolarHBondContact O-N 3.29Å; I138-W141 PolarHBondContact O-N 3.47Å; G139-W141 PolarHBondContact O-N 2.88Å; W141-T143 VanDerWaalsContact C-N 3.33Å; W141-T143 PolarHBondContact O-N 3.36Å; W141-V144 HydrophobicContact CE3-CG2 4.34Å; W141-V144 WeakPolarHBondContact O-CG2 3.32Å; W141-V144 PolarHBondContact O-N 2.96Å; W141-I145 HydrophobicContact CE3-CD1 4.09Å; W141-I145 HydrophobicContact CE3-CG1 4.44Å; W141-I145 VanDerWaalsContact O-CB 3.32Å; W141-I145 WeakPolarHBondContact O-CB 3.5Å; W141-I145 WeakPolarHBondContact O-CD1 3.36Å; W141-I145 VanDerWaalsContact O-CG1 3.22Å; W141-I145 WeakPolarHBondContact O-CG1 3.34Å; W141-I145 PolarHBondContact O-N 3.44Å
142L96.8Very high91Very high121 Ų12149.2 Ų49.263%0.63429%0.294SS*.Hα-helixtrans-61.4-42.4177.8-68.2173.9000111.5I138 G139 V140 G146I138-L142 HydrophobicContact CG2-CD1 3.98Å; I138-L142 HydrophobicContact CG2-CG 4.37Å; I138-L142 VanDerWaalsContact O-CG 3.32Å; I138-L142 WeakPolarHBondContact O-CG 3.38Å; I138-L142 PolarHBondContact O-N 3.27Å; G139-L142 PolarHBondContact O-N 3.17Å; V140-L142 PolarHBondContact O-N 2.84Å; L142-G146 PolarHBondContact O-N 3.39Å
143T94.5Very high90Very high90 Ų9053.7 Ų53.755%0.55232%0.318SS*.Hα-helixtrans-63.1-47.4177.5-61.70000111.9L105 G139 V140 W141 G147L105-T143 HydrophobicContact CD1-CG2 4.43Å; G139-T143 WeakPolarHBondContact O-CB 3.21Å; G139-T143 PolarHBondContact O-N 3.18Å; G139-T143 PolarHBondContact O-OG1 2.94Å; V140-T143 PolarHBondContact O-N 3.45Å; W141-T143 VanDerWaalsContact C-N 3.33Å; W141-T143 PolarHBondContact O-N 3.36Å; T143-G147 PolarHBondContact O-N 3.27Å
144V94.5Very high88.9Confident4 Ų455.3 Ų55.32%0.02433%0.327CS..Hα-helixtrans-75.2-34.8-175.2-59.40000112.6T98 L105 V140 W141 S148T98-V144 HydrophobicContact CG2-CG2 3.83Å; L105-V144 HydrophobicContact CD1-CG1 3.76Å; V140-V144 HydrophobicContact CG1-CG1 4.35Å; V140-V144 WeakPolarHBondContact O-CG1 3.32Å; V140-V144 WeakPolarHBondContact O-CG2 3.26Å; V140-V144 PolarHBondContact O-N 3.33Å; W141-V144 HydrophobicContact CE3-CG2 4.34Å; W141-V144 WeakPolarHBondContact O-CG2 3.32Å; W141-V144 PolarHBondContact O-N 2.96Å; V144-S148 WeakPolarHBondContact O-CB 3.49Å; V144-S148 PolarHBondContact O-N 3.22Å; V144-S148 PolarHBondContact O-OG 3.01Å
145I92.8Very high87.9Confident78 Ų7849.3 Ų49.340%0.430%0.301SS..Hα-helixtrans-67.9-47.4174-67.4168.6000109.4T98 W141 G147 S148 A149T98-I145 HydrophobicContact CG2-CG1 4.37Å; W141-I145 HydrophobicContact CE3-CD1 4.09Å; W141-I145 HydrophobicContact CE3-CG1 4.44Å; W141-I145 VanDerWaalsContact O-CB 3.32Å; W141-I145 WeakPolarHBondContact O-CB 3.5Å; W141-I145 WeakPolarHBondContact O-CD1 3.36Å; W141-I145 VanDerWaalsContact O-CG1 3.22Å; W141-I145 WeakPolarHBondContact O-CG1 3.34Å; W141-I145 PolarHBondContact O-N 3.44Å; I145-G147 PolarHBondContact O-N 2.93Å; I145-S148 PolarHBondContact O-N 3.19Å; I145-A149 PolarHBondContact O-N 2.93Å
146G90.8Very high86.6Confident46 Ų4646.5 Ų46.547%0.47429%0.29SS..Hα-helixtrans-61.3-42.7176.700000112.6L142 S148 A149L142-G146 PolarHBondContact O-N 3.39Å; G146-S148 VanDerWaalsContact C-N 3.29Å; G146-S148 PolarHBondContact O-N 2.86Å; G146-A149 VanDerWaalsContact O-CB 3.32Å; G146-A149 WeakPolarHBondContact O-CB 3.48Å; G146-A149 PolarHBondContact O-N 3.39Å
147G86.4Confident85.5Confident30 Ų3045.3 Ų45.331%0.30928%0.283SS..Hα-helixtrans-67.4-26.1176.600000114T143 I145 P150T143-G147 PolarHBondContact O-N 3.27Å; I145-G147 PolarHBondContact O-N 2.93Å; G147-P150 WeakPolarHBondContact O-CD 3.24Å
148S85.2Confident84.4Confident1 Ų148.6 Ų48.61%0.00730%0.298CS..Hα-helixtrans-79.7-16.9176-58.80000113Y97 T98 V144 I145 G146 A151 V152Y97-S148 WeakPolarHBondContact CB-OG 3.24Å; T98-S148 PolarHBondContact N-OG 3.3Å; T98-S148 PolarHBondContact OG1-OG 3Å; V144-S148 WeakPolarHBondContact O-CB 3.49Å; V144-S148 PolarHBondContact O-N 3.22Å; V144-S148 PolarHBondContact O-OG 3.01Å; I145-S148 PolarHBondContact O-N 3.19Å; G146-S148 VanDerWaalsContact C-N 3.29Å; G146-S148 PolarHBondContact O-N 2.86Å; S148-A151 WeakPolarHBondContact O-CB 3.18Å; S148-A151 PolarHBondContact O-N 3.35Å; S148-V152 PolarHBondContact O-N 3.36Å
149A80.8Confident83.1Confident42 Ų4248 Ų4835%0.34730%0.303SS..Hα-helixtrans-58.6-42.9-174.400000114.5I145 G146 A151 V152 L153I145-A149 PolarHBondContact O-N 2.93Å; G146-A149 VanDerWaalsContact O-CB 3.32Å; G146-A149 WeakPolarHBondContact O-CB 3.48Å; G146-A149 PolarHBondContact O-N 3.39Å; A149-A151 VanDerWaalsContact C-N 3.27Å; A149-A151 PolarHBondContact O-N 2.96Å; A149-V152 WeakPolarHBondContact O-CB 3.39Å; A149-V152 PolarHBondContact O-N 2.88Å; A149-V152 VanDerWaalsContact O-N 3.09Å; A149-L153 WeakPolarHBondContact O-CG 3.17Å; A149-L153 PolarHBondContact O-N 3.47Å
150P76.6Confident81.5Confident38 Ų3850.4 Ų50.425%0.24731%0.306CS..Hα-helixtrans-59.5-36.3177.7-24.335.1000113.3G147 V152 V154 I184G147-P150 WeakPolarHBondContact O-CD 3.24Å; P150-V152 VanDerWaalsContact C-N 3.34Å; P150-V154 WeakPolarHBondContact O-CG2 3.49Å; P150-V154 PolarHBondContact O-N 3.47Å; P150-I184 HydrophobicContact CB-CG2 4.37Å; P150-I184 HydrophobicContact CG-CG2 4.37Å
151A71.4Confident79.8Confident28 Ų2852.7 Ų52.723%0.23133%0.332CS..Hα-helixtrans-67.1-37.8176.900000111.6V93 Y97 S148 A149 Q155V93-A151 HydrophobicContact CG1-CB 4.3Å; Y97-A151 HydrophobicContact CD2-CB 3.91Å; Y97-A151 HydrophobicContact CE2-CB 3.76Å; S148-A151 WeakPolarHBondContact O-CB 3.18Å; S148-A151 PolarHBondContact O-N 3.35Å; A149-A151 VanDerWaalsContact C-N 3.27Å; A149-A151 PolarHBondContact O-N 2.96Å; A151-Q155 WeakPolarHBondContact O-CB 3.35Å; A151-Q155 PolarHBondContact O-N 3.39Å
152V75.5Confident77.8Confident28 Ų2859 Ų5917%0.1737%0.369CS..Hα-helixtrans-69.4-39.3178.2176.20000112.4K90 M94 S148 A149 P150 V154K90-V152 HydrophobicContact CB-CG1 3.97Å; K90-V152 HydrophobicContact CD-CG1 4.36Å; K90-V152 HydrophobicContact CG-CG1 4.14Å; M94-V152 HydrophobicContact CB-CG2 3.53Å; M94-V152 HydrophobicContact CG-CG2 3.86Å; M94-V152 HydrophobicContact SD-CG2 4.5Å; S148-V152 PolarHBondContact O-N 3.36Å; A149-V152 WeakPolarHBondContact O-CB 3.39Å; A149-V152 PolarHBondContact O-N 2.88Å; A149-V152 VanDerWaalsContact O-N 3.09Å; P150-V152 VanDerWaalsContact C-N 3.34Å; V152-V154 PolarHBondContact O-N 3.24Å
153L73.5Confident75.9Confident145 Ų14559.4 Ų59.476%0.75937%0.372SS*.Hα-helixtrans-66.5-26.4-179.5-70.1173.1000112.8A149A149-L153 WeakPolarHBondContact O-CG 3.17Å; A149-L153 PolarHBondContact O-N 3.47Å
154V69.3Low74.6Confident35 Ų3559.8 Ų59.821%0.21238%0.384CS..Hα-helixtrans-96.7-27.2-178.8178.30000112.2P150 V152 S156 F172 T176 L181P150-V154 WeakPolarHBondContact O-CG2 3.49Å; P150-V154 PolarHBondContact O-N 3.47Å; V152-V154 PolarHBondContact O-N 3.24Å; V154-S156 PolarHBondContact O-N 3.24Å; V154-F172 HydrophobicContact CG1-CD1 4.17Å; V154-T176 HydrophobicContact CG1-CG2 4.44Å; V154-L181 HydrophobicContact CB-CD1 4.1Å; V154-L181 HydrophobicContact CG1-CD1 3.59Å; V154-L181 HydrophobicContact CG2-CD1 3.72Å; V154-L181 HydrophobicContact CG2-CD2 3.8Å; V154-L181 HydrophobicContact CG2-CG 4.29Å
155Q74.1Confident73.6Confident4 Ų461 Ų612%0.01939%0.393CS..  trans-66.4130.7175.5-172.266.45500109.8K90 V93 A151 F172K90-Q155 WeakPolarHBondContact CE-O 3.34Å; K90-Q155 HydrophobicContact CG-CB 4.48Å; V93-Q155 HydrophobicContact CG2-CG 3.84Å; A151-Q155 WeakPolarHBondContact O-CB 3.35Å; A151-Q155 PolarHBondContact O-N 3.39Å; Q155-F172 VanDerWaalsContact OE1-CE1 3.26Å
156S70.2Confident73.1Confident38 Ų3860.9 Ų60.927%0.26639%0.391SS..  trans-143.5159.5166.9-64.80000109.7D86 V154 H158D86-S156 VanDerWaalsContact OD1-CA 3.27Å; D86-S156 WeakPolarHBondContact OD1-CA 3.43Å; V154-S156 PolarHBondContact O-N 3.24Å; S156-H158 PolarHBondContact O-CD2 3.38Å
157T74.1Confident72.7Confident31 Ų3158.8 Ų58.819%0.1937%0.369CS..  trans-75.9144.5167.1520000110.4W82 D86 C89 A167 C168W82-T157 HydrophobicContact CG-CG2 4.49Å; D86-T157 HydrophobicContact CB-CG2 4.38Å; D86-T157 PolarHBondContact OD1-N 3.15Å; D86-T157 VanDerWaalsContact OD1-N 3.07Å; C89-T157 HydrophobicContact CB-CG2 3.81Å; T157-A167 WeakPolarHBondContact CA-O 3.41Å; T157-C168 HydrophobicContact CG2-CB 4.38Å
158H74.8Confident72.5Confident73 Ų7357.3 Ų57.334%0.33835%0.354SS..EExtended strand (participates in β ladder)trans-132.7136.8-179.2-63.3-72.8000110.5S156 Q160 A167S156-H158 PolarHBondContact O-CD2 3.38Å; H158-Q160 PolarHBondContact O-N 3.33Å; H158-A167 PolarHBondContact N-O 3.29Å; H158-A167 PolarHBondContact O-N 3.3Å
159S71.2Confident72.1Confident89 Ų8958.9 Ų58.962%0.62236%0.361SS*.EExtended strand (participates in β ladder)trans-71.6128.2173.6-168.90000110.3G161S159-G161 PolarHBondContact O-N 3.06Å
160Q63.9Low71.3Confident80 Ų8058.1 Ų58.137%0.37435%0.35SS..  trans-95.892.6-179.2-164.3175.539.700110.9H158 S165H158-Q160 PolarHBondContact O-N 3.33Å; Q160-S165 PolarHBondContact N-O 2.87Å
161G61.6Low70.5Confident61 Ų6161.8 Ų61.863%0.62937%0.368SS*.THydrogen-bonded Turntrans71.6-157.1174.600000114.6S159 N163S159-G161 PolarHBondContact O-N 3.06Å; G161-N163 VanDerWaalsContact C-N 3.34Å
162N57Low69.9Low177 Ų17763.2 Ų63.295%0.94737%0.369SS*.THydrogen-bonded Turntrans-78.8-12.3-176.7-75.5-1000114.1
163N56.8Low69Low129 Ų12964.8 Ų64.869%0.6938%0.38SS*.SBendtrans-92.7131.7173-68-11.7000107.2G161 S165G161-N163 VanDerWaalsContact C-N 3.34Å; N163-S165 PolarHBondContact O-N 3.15Å; N163-S165 PolarHBondContact O-OG 2.9Å
164A66.1Low68.2Low98 Ų9862.8 Ų62.881%0.8137%0.366SS*.  trans-68.134.9-17300000115.3
165S73.1Confident67.5Low31 Ų3164.7 Ų64.722%0.21739%0.385CS..PPolyproline II helixtrans-82126.9173.545.70000110.6N81 Q160 N163N81-S165 WeakPolarHBondContact OD1-CA 3.45Å; Q160-S165 PolarHBondContact N-O 2.87Å; N163-S165 PolarHBondContact O-N 3.15Å; N163-S165 PolarHBondContact O-OG 2.9Å
166E83Confident66.8Low74 Ų7467.7 Ų67.735%0.34640%0.404SS..EExtended strand (participates in β ladder)trans-91.6130175.5-68.7-167.6174.300110.5N81 W82N81-E166 PolarHBondContact OD1-N 2.96Å; W82-E166 HydrophobicContact CB-CB 4.39Å; W82-E166 WeakPolarHBondContact CB-O 3.49Å; W82-E166 PolarHBondContact N-O 3.42Å; W82-E166 WeakPolarHBondContact O-CB 3.24Å
167A82.6Confident66.4Low2 Ų267 Ų672%0.01740%0.396CS..EExtended strand (participates in β ladder)trans-94.7138.4172.600000110.9T157 H158T157-A167 WeakPolarHBondContact CA-O 3.41Å; H158-A167 PolarHBondContact N-O 3.29Å; H158-A167 PolarHBondContact O-N 3.3Å
168C81.7Confident65.8Low0 Ų068.4 Ų68.40%040%0.399CS..SBendtrans-129.1150.9169.8173.40000108.1Y76 W82 C89 T157 E170Y76-C168 WeakPolarHBondContact CE1-O 3.36Å; Y76-C168 PolarHBondContact OH-O 3.21Å; W82-C168 HydrophobicContact CB-CB 3.88Å; W82-C168 HydrophobicContact CD2-CB 3.58Å; W82-C168 HydrophobicContact CE3-CB 3.85Å; W82-C168 HydrophobicContact CG-CB 3.56Å; C89-C168 VanDerWaalsContact CA-SG 3.55Å; C89-C168 HydrophobicContact CB-CB 4Å; C89-C168 WeakPolarHBondContact CB-SG 3.46Å; C89-C168 WeakPolarHBondContact SG-CB 3.25Å; C89-C168 CovalentContact SG-SG 2.03Å; C89-C168 PolarHBondContact SG-SG 3.46Å; T157-C168 HydrophobicContact CG2-CB 4.38Å; C168-E170 PolarHBondContact O-N 2.95Å
169F76.8Confident65.2Low33 Ų3368.4 Ų68.415%0.14541%0.405CS..SBendtrans67.6-7.2-175.8-40.4-71.9000116.3R73 Y76 F77 W82 V93R73-F169 HydrophobicContact CG-CE2 3.98Å; R73-F169 HydrophobicContact CG-CZ 3.83Å; Y76-F169 AromaticContact CD1-CD2 3.83Å; Y76-F169 HydrophobicContact CD1-CD2 3.83Å; Y76-F169 HydrophobicContact CD1-CE2 4.31Å; Y76-F169 HydrophobicContact CE1-CD2 4.03Å; Y76-F169 HydrophobicContact CG-CD2 4.44Å; F77-F169 HydrophobicContact CZ-CD2 4.46Å; W82-F169 AromaticContact CE3-CE2 3.99Å; W82-F169 HydrophobicContact CE3-CE2 3.99Å; W82-F169 HydrophobicContact CH2-CE2 4.34Å; W82-F169 HydrophobicContact CH2-CZ 4.22Å; W82-F169 AromaticContact CZ3-CE2 3.63Å; W82-F169 HydrophobicContact CZ3-CE2 3.63Å; W82-F169 AromaticContact CZ3-CZ 3.97Å; W82-F169 HydrophobicContact CZ3-CZ 3.97Å; V93-F169 HydrophobicContact CG2-CD1 3.5Å; V93-F169 HydrophobicContact CG2-CE1 3.41Å; V93-F169 VanDerWaalsContact CG2-CE1 3.41Å
170E64.6Low65Low26 Ų2672.2 Ų72.212%0.12141%0.407CS..  trans-110.8154.2178.1-61.2-159.3159.900111.9K16 Y17 Y76 C168K16-E170 VanDerWaalsContact CE-OE1 3.32Å; K16-E170 WeakPolarHBondContact CE-OE1 3.29Å; K16-E170 IonicContact NZ-OE1 3.14Å; K16-E170 PolarHBondContact NZ-OE1 3.48Å; Y17-E170 PolarHBondContact OH-OE1 3.3Å; Y17-E170 PolarHBondContact OH-OE2 2.84Å; Y76-E170 WeakPolarHBondContact OH-CG 3.48Å; C168-E170 PolarHBondContact O-N 2.95Å
171N58.6Low65.4Low116 Ų11669.3 Ų69.362%0.6239%0.393SS*.  trans6165.6174.5-64.7-27.9000116.2
172F59.5Low66Low58 Ų5866.6 Ų66.625%0.25437%0.365SS..  trans-67.2127.6160.3-62.6-79000110.2V154 Q155 E174 W177 R256V154-F172 HydrophobicContact CG1-CD1 4.17Å; Q155-F172 VanDerWaalsContact OE1-CE1 3.26Å; F172-E174 PolarHBondContact O-N 3.44Å; F172-W177 HydrophobicContact CB-CE3 4.2Å; F172-W177 HydrophobicContact CG-CE3 4.23Å; F172-W177 HydrophobicContact CG-CZ3 4.43Å; F172-R256 PolarHBondContact O-NH2 3.49Å
173P57.1Low67Low61 Ų6166.9 Ų66.940%0.39635%0.353SS..  trans-52.8123.1176.1-24.732.1000110.9A175 T176 W177P173-A175 PolarHBondContact O-N 3.48Å; P173-T176 PolarHBondContact O-N 3.18Å; P173-W177 PolarHBondContact O-N 2.91Å; P173-W177 VanDerWaalsContact O-N 3.12Å
174E57.1Low68.1Low103 Ų10364 Ų6448%0.48134%0.337SS..Hα-helixtrans-58.4-35.1-174.1-73.1-157.2163.300112.8F172 W177 K178F172-E174 PolarHBondContact O-N 3.44Å; E174-W177 PolarHBondContact O-N 3.29Å; E174-K178 WeakPolarHBondContact O-CB 3.23Å; E174-K178 VanDerWaalsContact O-CG 3.26Å; E174-K178 WeakPolarHBondContact O-CG 3.43Å; E174-K178 PolarHBondContact O-N 3.48Å; E174-K178 IonicContact OE2-NZ 3.05Å; E174-K178 PolarHBondContact OE2-NZ 3.21Å; E174-K178 VanDerWaalsContact OE2-NZ 3.14Å
175A53.8Low68.8Low74 Ų7460.7 Ų60.761%0.61231%0.306SS*.Hα-helixtrans-66.1-42.3-178.800000112.9P173 T179P173-A175 PolarHBondContact O-N 3.48Å; A175-T179 PolarHBondContact O-N 2.67Å; A175-T179 PolarHBondContact O-OG1 2.86Å
176T58.9Low69.3Low68 Ų6861.2 Ų61.242%0.41731%0.306SS..Hα-helixtrans-71.3-37.3178-43.10000110.9V154 P173 L181V154-T176 HydrophobicContact CG1-CG2 4.44Å; P173-T176 PolarHBondContact O-N 3.18Å; T176-L181 HydrophobicContact CG2-CD1 3.85Å; T176-L181 HydrophobicContact CG2-CG 4.48Å
177W63.3Low69.4Low22 Ų2264.1 Ų64.18%0.08332%0.318CS..Iπ-helixtrans-66.3-45.7176.9-168.4-91.5000112.9F172 P173 E174 T179 L181 S182 V185 Y252F172-W177 HydrophobicContact CB-CE3 4.2Å; F172-W177 HydrophobicContact CG-CE3 4.23Å; F172-W177 HydrophobicContact CG-CZ3 4.43Å; P173-W177 PolarHBondContact O-N 2.91Å; P173-W177 VanDerWaalsContact O-N 3.12Å; E174-W177 PolarHBondContact O-N 3.29Å; W177-T179 PolarHBondContact O-N 2.88Å; W177-L181 HydrophobicContact CE3-CB 4.29Å; W177-L181 HydrophobicContact CE3-CD1 4.17Å; W177-S182 WeakPolarHBondContact O-CB 3.49Å; W177-S182 PolarHBondContact O-N 3.05Å; W177-S182 VanDerWaalsContact O-N 3.1Å; W177-V185 HydrophobicContact CH2-CG2 4.39Å; W177-Y252 HydrophobicContact CZ2-CE1 4.45Å
178K60.3Low69.6Low62 Ų6265.7 Ų65.727%0.2733%0.326SS..Iπ-helixtrans-67.7-34.2-174.5-77.3177.8-177.41720113.3E174 S182 R256E174-K178 WeakPolarHBondContact O-CB 3.23Å; E174-K178 VanDerWaalsContact O-CG 3.26Å; E174-K178 WeakPolarHBondContact O-CG 3.43Å; E174-K178 PolarHBondContact O-N 3.48Å; E174-K178 IonicContact OE2-NZ 3.05Å; E174-K178 PolarHBondContact OE2-NZ 3.21Å; E174-K178 VanDerWaalsContact OE2-NZ 3.14Å; K178-S182 PolarHBondContact O-OG 3.24Å; K178-R256 VanDerWaalsContact CE-O 3.27Å; K178-R256 WeakPolarHBondContact CE-O 3.5Å
179T62.8Low69.8Low73 Ų7365.7 Ų65.745%0.44833%0.326SS..Iπ-helixtrans-89.7-52.6-166.5-43.30000114A175 W177A175-T179 PolarHBondContact O-N 2.67Å; A175-T179 PolarHBondContact O-OG1 2.86Å; W177-T179 PolarHBondContact O-N 2.88Å
180Y67.4Low70.2Confident169 Ų16968.2 Ų68.266%0.66334%0.34SS*.Iπ-helixtrans-119.7-38.6-171.7-70.7-81.4000113.5R183 I184Y180-R183 PolarHBondContact O-N 3.44Å; Y180-I184 WeakPolarHBondContact O-CG1 3.23Å; Y180-I184 PolarHBondContact O-N 3.48Å; Y180-I184 VanDerWaalsContact O-N 3.14Å
181L71.6Confident71.4Confident18 Ų1870 Ų709%0.09435%0.352CS..Iπ-helixtrans-70.3-37.9-174.7-66168.7000113.1V154 T176 W177 R183 I184 V185V154-L181 HydrophobicContact CB-CD1 4.1Å; V154-L181 HydrophobicContact CG1-CD1 3.59Å; V154-L181 HydrophobicContact CG2-CD1 3.72Å; V154-L181 HydrophobicContact CG2-CD2 3.8Å; V154-L181 HydrophobicContact CG2-CG 4.29Å; T176-L181 HydrophobicContact CG2-CD1 3.85Å; T176-L181 HydrophobicContact CG2-CG 4.48Å; W177-L181 HydrophobicContact CE3-CB 4.29Å; W177-L181 HydrophobicContact CE3-CD1 4.17Å; L181-R183 VanDerWaalsContact C-N 3.28Å; L181-R183 PolarHBondContact O-N 3.48Å; L181-I184 PolarHBondContact O-N 3.5Å; L181-V185 WeakPolarHBondContact O-CB 3.22Å; L181-V185 WeakPolarHBondContact O-CG2 3.29Å; L181-V185 PolarHBondContact O-N 2.94Å
182S73.3Confident72.8Confident5 Ų565.3 Ų65.34%0.03533%0.331CS..Hα-helixtrans-55.2-44.3175.961.20000112W177 K178 I186 S253W177-S182 WeakPolarHBondContact O-CB 3.49Å; W177-S182 PolarHBondContact O-N 3.05Å; W177-S182 VanDerWaalsContact O-N 3.1Å; K178-S182 PolarHBondContact O-OG 3.24Å; S182-I186 WeakPolarHBondContact O-CB 3.49Å; S182-I186 WeakPolarHBondContact O-CD1 3.42Å; S182-I186 WeakPolarHBondContact O-CG1 3.48Å; S182-I186 PolarHBondContact O-N 2.73Å; S182-S253 WeakPolarHBondContact CA-OG 3.5Å; S182-S253 WeakPolarHBondContact CB-OG 3.2Å; S182-S253 PolarHBondContact O-OG 3.32Å
183R79Confident74.3Confident183 Ų18362.5 Ų62.569%0.69132%0.319SS*.Hα-helixtrans-68.8-43.1178.4-63.5-177.4-171.2174.53.6112.3Y180 L181 I186 F187Y180-R183 PolarHBondContact O-N 3.44Å; L181-R183 VanDerWaalsContact C-N 3.28Å; L181-R183 PolarHBondContact O-N 3.48Å; R183-I186 PolarHBondContact O-N 3.47Å; R183-F187 WeakPolarHBondContact O-CB 3.39Å; R183-F187 PolarHBondContact O-N 3.08Å
184I80.4Confident76Confident68 Ų6863 Ų6335%0.34932%0.315SS..Hα-helixtrans-63.7-46.7177.2-69.1169.4000110.5P150 Y180 L181 F187 I188P150-I184 HydrophobicContact CB-CG2 4.37Å; P150-I184 HydrophobicContact CG-CG2 4.37Å; Y180-I184 WeakPolarHBondContact O-CG1 3.23Å; Y180-I184 PolarHBondContact O-N 3.48Å; Y180-I184 VanDerWaalsContact O-N 3.14Å; L181-I184 PolarHBondContact O-N 3.5Å; I184-F187 PolarHBondContact O-N 3.43Å; I184-I188 HydrophobicContact CG2-CD1 3.66Å; I184-I188 HydrophobicContact CG2-CG1 4.34Å; I184-I188 WeakPolarHBondContact O-CB 3.23Å; I184-I188 VanDerWaalsContact O-CG1 3.3Å; I184-I188 WeakPolarHBondContact O-CG1 3.49Å; I184-I188 PolarHBondContact O-N 2.87Å
185V80.1Confident77.7Confident28 Ų2862.2 Ų62.217%0.1731%0.313CS..Hα-helixtrans-59.5-49.4176.4170.50000109.8W177 L181 F187 I188 E189 L249W177-V185 HydrophobicContact CH2-CG2 4.39Å; L181-V185 WeakPolarHBondContact O-CB 3.22Å; L181-V185 WeakPolarHBondContact O-CG2 3.29Å; L181-V185 PolarHBondContact O-N 2.94Å; V185-F187 VanDerWaalsContact C-N 3.3Å; V185-F187 PolarHBondContact O-N 3.29Å; V185-I188 PolarHBondContact O-N 3.41Å; V185-E189 HydrophobicContact CG1-CG 4.13Å; V185-E189 WeakPolarHBondContact O-CB 3.22Å; V185-E189 WeakPolarHBondContact O-CG 3.36Å; V185-E189 PolarHBondContact O-N 2.75Å; V185-L249 HydrophobicContact CG1-CD1 4.47Å; V185-L249 HydrophobicContact CG1-CD2 4.46Å; V185-L249 HydrophobicContact CG1-CG 4.25Å
186I82.5Confident79.6Confident43 Ų4358.9 Ų58.922%0.22129%0.286CS..Hα-helixtrans-58.3-42.8177.5-70.8164.3000111.4S182 R183 E189 I190 L254S182-I186 WeakPolarHBondContact O-CB 3.49Å; S182-I186 WeakPolarHBondContact O-CD1 3.42Å; S182-I186 WeakPolarHBondContact O-CG1 3.48Å; S182-I186 PolarHBondContact O-N 2.73Å; R183-I186 PolarHBondContact O-N 3.47Å; I186-E189 PolarHBondContact O-N 3.25Å; I186-I190 HydrophobicContact CG2-CD1 3.67Å; I186-I190 HydrophobicContact CG2-CG1 4.37Å; I186-I190 WeakPolarHBondContact O-CB 3.13Å; I186-I190 VanDerWaalsContact O-CG1 3.23Å; I186-I190 WeakPolarHBondContact O-CG1 3.33Å; I186-I190 PolarHBondContact O-N 2.94Å; I186-L254 HydrophobicContact CD1-CD2 4.25Å
187F86.6Confident81.3Confident135 Ų13557.1 Ų57.159%0.59227%0.273SS*.Hα-helixtrans-62.8-46.8176.8175.3-97.9000112.3R183 I184 V185 E189 I190 V191R183-F187 WeakPolarHBondContact O-CB 3.39Å; R183-F187 PolarHBondContact O-N 3.08Å; I184-F187 PolarHBondContact O-N 3.43Å; V185-F187 VanDerWaalsContact C-N 3.3Å; V185-F187 PolarHBondContact O-N 3.29Å; F187-E189 VanDerWaalsContact C-N 3.31Å; F187-E189 PolarHBondContact O-N 3.08Å; F187-I190 PolarHBondContact O-N 3.2Å; F187-V191 HydrophobicContact CD2-CG2 4.15Å; F187-V191 HydrophobicContact CE1-CG2 4.26Å; F187-V191 HydrophobicContact CE2-CG2 3.74Å; F187-V191 HydrophobicContact CZ-CG2 3.81Å; F187-V191 WeakPolarHBondContact O-CB 3.41Å; F187-V191 WeakPolarHBondContact O-CG2 3.31Å; F187-V191 PolarHBondContact O-N 3.05Å
188I85.9Confident82.8Confident35 Ų3561 Ų6118%0.17930%0.295CS..Hα-helixtrans-62.5-39.6177.1-68.5170.1000110.6Y101 I184 V185 G192Y101-I188 HydrophobicContact CE1-CG2 4.2Å; Y101-I188 HydrophobicContact CE2-CG2 4.03Å; I184-I188 HydrophobicContact CG2-CD1 3.66Å; I184-I188 HydrophobicContact CG2-CG1 4.34Å; I184-I188 WeakPolarHBondContact O-CB 3.23Å; I184-I188 VanDerWaalsContact O-CG1 3.3Å; I184-I188 WeakPolarHBondContact O-CG1 3.49Å; I184-I188 PolarHBondContact O-N 2.87Å; V185-I188 PolarHBondContact O-N 3.41Å; I188-G192 WeakPolarHBondContact O-CA 3.22Å; I188-G192 PolarHBondContact O-N 3.22Å
189E86.5Confident84.4Confident0 Ų061.5 Ų61.50%030%0.3CS..Hα-helixtrans-65.6-44.8176.1-70.5-66.9123.900111.4Y101 V185 I186 F187 F193 F194 N246 L249 I250Y101-E189 PolarHBondContact OH-OE1 3.25Å; V185-E189 HydrophobicContact CG1-CG 4.13Å; V185-E189 WeakPolarHBondContact O-CB 3.22Å; V185-E189 WeakPolarHBondContact O-CG 3.36Å; V185-E189 PolarHBondContact O-N 2.75Å; I186-E189 PolarHBondContact O-N 3.25Å; F187-E189 VanDerWaalsContact C-N 3.31Å; F187-E189 PolarHBondContact O-N 3.08Å; E189-F193 WeakPolarHBondContact O-CA 3.49Å; E189-F193 VanDerWaalsContact O-CB 3.26Å; E189-F193 WeakPolarHBondContact O-CB 3.15Å; E189-F193 PolarHBondContact O-N 3.42Å; E189-F194 PolarHBondContact O-N 3Å; E189-N246 PolarHBondContact OE1-OD1 3.41Å; E189-N246 WeakPolarHBondContact OE2-CA 3.4Å; E189-N246 WeakPolarHBondContact OE2-CB 3.38Å; E189-N246 VanDerWaalsContact OE2-CG 3.32Å; E189-N246 PolarHBondContact OE2-OD1 3.5Å; E189-L249 HydrophobicContact CG-CD2 4.29Å; E189-L249 HydrophobicContact CG-CG 4.48Å; E189-L249 VanDerWaalsContact OE1-CD2 3.29Å; E189-L249 WeakPolarHBondContact OE1-CD2 3.38Å; E189-I250 HydrophobicContact CB-CD1 3.9Å; E189-I250 HydrophobicContact CB-CG1 3.78Å; E189-I250 HydrophobicContact CG-CG1 4.04Å
190I86.1Confident85.8Confident86 Ų8658.2 Ų58.244%0.44128%0.28SS..Iπ-helixtrans-61.6-51.7178.2-69.8168000110.7I186 F187 F194I186-I190 HydrophobicContact CG2-CD1 3.67Å; I186-I190 HydrophobicContact CG2-CG1 4.37Å; I186-I190 WeakPolarHBondContact O-CB 3.13Å; I186-I190 VanDerWaalsContact O-CG1 3.23Å; I186-I190 WeakPolarHBondContact O-CG1 3.33Å; I186-I190 PolarHBondContact O-N 2.94Å; F187-I190 PolarHBondContact O-N 3.2Å; I190-F194 WeakPolarHBondContact O-CB 3.43Å; I190-F194 PolarHBondContact O-N 3.46Å
191V88.6Confident87Confident62 Ų6253 Ų5338%0.37627%0.265SS..Iπ-helixtrans-76.7-43.5-175.2176.20000111.5F187 I195 P196F187-V191 HydrophobicContact CD2-CG2 4.15Å; F187-V191 HydrophobicContact CE1-CG2 4.26Å; F187-V191 HydrophobicContact CE2-CG2 3.74Å; F187-V191 HydrophobicContact CZ-CG2 3.81Å; F187-V191 WeakPolarHBondContact O-CB 3.41Å; F187-V191 WeakPolarHBondContact O-CG2 3.31Å; F187-V191 PolarHBondContact O-N 3.05Å; V191-I195 HydrophobicContact CB-CD1 4.36Å; V191-I195 HydrophobicContact CG1-CD1 4.04Å; V191-I195 WeakPolarHBondContact O-CB 3.46Å; V191-P196 WeakPolarHBondContact O-CD 3.23Å
192G87.6Confident88Confident18 Ų1855.1 Ų55.119%0.18628%0.279CS..Iπ-helixtrans-81.4-17.4-173.600000114.7I104 I188 P196I104-G192 WeakPolarHBondContact CG2-O 3.48Å; I188-G192 WeakPolarHBondContact O-CA 3.22Å; I188-G192 PolarHBondContact O-N 3.22Å; G192-P196 WeakPolarHBondContact O-CG 3.17Å
193F91.8Very high88.9Confident0 Ų055.2 Ų55.20%028%0.28CS..Iπ-helixtrans-120.1-50.2177.5170.7-104.2000114I104 E189 P196 L197 F238 F242 V243 N246I104-F193 HydrophobicContact CD1-CD2 4.1Å; E189-F193 WeakPolarHBondContact O-CA 3.49Å; E189-F193 VanDerWaalsContact O-CB 3.26Å; E189-F193 WeakPolarHBondContact O-CB 3.15Å; E189-F193 PolarHBondContact O-N 3.42Å; F193-P196 WeakPolarHBondContact O-CD 3.4Å; F193-L197 HydrophobicContact CE1-CD2 4.17Å; F193-L197 HydrophobicContact CZ-CD2 4.04Å; F193-L197 WeakPolarHBondContact O-CB 3.31Å; F193-L197 PolarHBondContact O-N 3.49Å; F193-F238 HydrophobicContact CE2-CE1 4.05Å; F193-F238 HydrophobicContact CE2-CZ 4.33Å; F193-F242 HydrophobicContact CD2-CB 4.15Å; F193-F242 HydrophobicContact CE2-CB 3.7Å; F193-V243 HydrophobicContact CE2-CG2 4.31Å; F193-V243 HydrophobicContact CZ-CB 4.07Å; F193-V243 HydrophobicContact CZ-CG2 3.67Å; F193-N246 HydrophobicContact CB-CB 4.13Å; F193-N246 WeakPolarHBondContact CB-OD1 2.84Å; F193-N246 HydrophobicContact CD1-CB 3.5Å; F193-N246 VanDerWaalsContact CD1-CB 3.5Å; F193-N246 HydrophobicContact CD2-CB 3.97Å; F193-N246 HydrophobicContact CE1-CB 3.87Å; F193-N246 HydrophobicContact CE2-CB 4.3Å; F193-N246 HydrophobicContact CG-CB 3.57Å; F193-N246 HydrophobicContact CZ-CB 4.26Å
194F92.3Very high89.4Confident72 Ų7246.8 Ų46.832%0.31625%0.249SC..Iπ-helixtrans-70.1-37.7-174.8-73.4-92.6000113.3E189 I190 L197 I198 I250E189-F194 PolarHBondContact O-N 3Å; I190-F194 WeakPolarHBondContact O-CB 3.43Å; I190-F194 PolarHBondContact O-N 3.46Å; F194-L197 PolarHBondContact O-N 2.9Å; F194-I198 VanDerWaalsContact O-CG1 3.27Å; F194-I198 WeakPolarHBondContact O-CG1 3.43Å; F194-I198 PolarHBondContact O-N 3.43Å; F194-I250 HydrophobicContact CE2-CD1 3.58Å; F194-I250 HydrophobicContact CZ-CD1 4.23Å
195I93.4Very high89.9Confident86 Ų8645.9 Ų45.944%0.44125%0.248SC..Hα-helixtrans-62.2-51.5175.3-62.5174.6000110.3V191 L197 I198 L199V191-I195 HydrophobicContact CB-CD1 4.36Å; V191-I195 HydrophobicContact CG1-CD1 4.04Å; V191-I195 WeakPolarHBondContact O-CB 3.46Å; I195-L197 VanDerWaalsContact C-N 3.33Å; I195-L197 PolarHBondContact O-N 3.38Å; I195-I198 PolarHBondContact O-N 2.99Å; I195-L199 HydrophobicContact CG2-CD1 4.07Å; I195-L199 HydrophobicContact CG2-CG 4.49Å; I195-L199 WeakPolarHBondContact O-CG 3.37Å; I195-L199 PolarHBondContact O-N 2.95Å
196P94.2Very high90.3Very high4 Ų448.1 Ų48.13%0.02626%0.258CS..Hα-helixtrans-53.4-43.7170.4-34.841.7000114.5I104 L105 T108 V191 G192 F193 L199 N200 F238I104-P196 HydrophobicContact CG2-CB 3.42Å; I104-P196 VanDerWaalsContact CG2-CB 3.42Å; I104-P196 HydrophobicContact CG2-CG 3.74Å; L105-P196 HydrophobicContact CD2-CG 3.88Å; T108-P196 WeakPolarHBondContact OG1-CB 3.48Å; V191-P196 WeakPolarHBondContact O-CD 3.23Å; G192-P196 WeakPolarHBondContact O-CG 3.17Å; F193-P196 WeakPolarHBondContact O-CD 3.4Å; P196-L199 PolarHBondContact O-N 3.4Å; P196-N200 PolarHBondContact O-N 2.96Å; P196-N200 PolarHBondContact O-ND2 2.9Å; P196-F238 HydrophobicContact CB-CZ 4.26Å
197L94.4Very high90.5Very high31 Ų3146.1 Ų46.116%0.16225%0.248CC..Hα-helixtrans-59.4-49.7178176.665.8000111.4F193 F194 I195 L199 N200 V201 F238 V243F193-L197 HydrophobicContact CE1-CD2 4.17Å; F193-L197 HydrophobicContact CZ-CD2 4.04Å; F193-L197 WeakPolarHBondContact O-CB 3.31Å; F193-L197 PolarHBondContact O-N 3.49Å; F194-L197 PolarHBondContact O-N 2.9Å; I195-L197 VanDerWaalsContact C-N 3.33Å; I195-L197 PolarHBondContact O-N 3.38Å; L197-L199 VanDerWaalsContact C-N 3.32Å; L197-L199 PolarHBondContact O-N 3.44Å; L197-N200 PolarHBondContact O-N 3.26Å; L197-V201 HydrophobicContact CD1-CG2 4.23Å; L197-V201 WeakPolarHBondContact O-CG2 3.44Å; L197-V201 PolarHBondContact O-N 3.45Å; L197-F238 HydrophobicContact CB-CE1 4.01Å; L197-F238 HydrophobicContact CB-CZ 4.5Å; L197-F238 HydrophobicContact CD1-CD1 4.05Å; L197-F238 HydrophobicContact CD1-CE1 3.66Å; L197-F238 HydrophobicContact CG-CE1 4.45Å; L197-V243 HydrophobicContact CD1-CG2 4.32Å
198I94.5Very high90.4Very high103 Ų10343 Ų4353%0.52824%0.237SC..Hα-helixtrans-60.6-43.5178.1-67.8165.1000110.3F194 I195 V201 T202F194-I198 VanDerWaalsContact O-CG1 3.27Å; F194-I198 WeakPolarHBondContact O-CG1 3.43Å; F194-I198 PolarHBondContact O-N 3.43Å; I195-I198 PolarHBondContact O-N 2.99Å; I198-V201 PolarHBondContact O-N 3.5Å; I198-T202 HydrophobicContact CG2-CG2 4.13Å; I198-T202 WeakPolarHBondContact O-CB 3.38Å; I198-T202 VanDerWaalsContact O-CG2 3.23Å; I198-T202 WeakPolarHBondContact O-CG2 3.44Å; I198-T202 PolarHBondContact O-N 3.02Å; I198-T202 PolarHBondContact O-OG1 3.26Å
199L93.9Very high90.5Very high73 Ų7348.7 Ų48.738%0.38226%0.26SS..Hα-helixtrans-61.1-45.9176.9-74.6173.8000112T108 I195 P196 L197 T202 C203T108-L199 HydrophobicContact CG2-CB 3.95Å; T108-L199 HydrophobicContact CG2-CD1 4.14Å; I195-L199 HydrophobicContact CG2-CD1 4.07Å; I195-L199 HydrophobicContact CG2-CG 4.49Å; I195-L199 WeakPolarHBondContact O-CG 3.37Å; I195-L199 PolarHBondContact O-N 2.95Å; P196-L199 PolarHBondContact O-N 3.4Å; L197-L199 VanDerWaalsContact C-N 3.32Å; L197-L199 PolarHBondContact O-N 3.44Å; L199-T202 WeakPolarHBondContact CA-OG1 3.32Å; L199-T202 PolarHBondContact O-OG1 3.38Å; L199-T202 VanDerWaalsContact O-OG1 3.05Å; L199-C203 WeakPolarHBondContact O-CB 3.34Å; L199-C203 PolarHBondContact O-N 3.1Å; L199-C203 PolarHBondContact O-SG 3.43Å
200N92.3Very high90.3Very high4 Ų450 Ų502%0.02127%0.268CS..Hα-helixtrans-62.6-46178.2-81-78.4000111.8T108 S111 P196 L197 S204 L235T108-N200 PolarHBondContact OG1-ND2 3.42Å; S111-N200 WeakPolarHBondContact CB-OD1 3.46Å; S111-N200 PolarHBondContact OG-OD1 2.99Å; P196-N200 PolarHBondContact O-N 2.96Å; P196-N200 PolarHBondContact O-ND2 2.9Å; L197-N200 PolarHBondContact O-N 3.26Å; N200-S204 WeakPolarHBondContact O-CB 3.47Å; N200-S204 PolarHBondContact O-N 3.26Å; N200-S204 PolarHBondContact O-OG 3.28Å; N200-L235 HydrophobicContact CB-CD1 4.44Å
201V92.6Very high90Very high60 Ų6046.4 Ų46.436%0.36425%0.25SC..Hα-helixtrans-64.3-45.9179.8172.40000111.1L197 I198 S205 L235L197-V201 HydrophobicContact CD1-CG2 4.23Å; L197-V201 WeakPolarHBondContact O-CG2 3.44Å; L197-V201 PolarHBondContact O-N 3.45Å; I198-V201 PolarHBondContact O-N 3.5Å; V201-S205 VanDerWaalsContact O-CB 3.26Å; V201-S205 WeakPolarHBondContact O-CB 3.34Å; V201-S205 PolarHBondContact O-N 3.28Å; V201-S205 PolarHBondContact O-OG 3.37Å; V201-L235 HydrophobicContact CG2-CD1 4.09Å
202T93.1Very high89.6Confident61 Ų6149.4 Ų49.437%0.37426%0.264SS..Hα-helixtrans-67-47.3180530000111.8I198 L199 S204 S205 M206I198-T202 HydrophobicContact CG2-CG2 4.13Å; I198-T202 WeakPolarHBondContact O-CB 3.38Å; I198-T202 VanDerWaalsContact O-CG2 3.23Å; I198-T202 WeakPolarHBondContact O-CG2 3.44Å; I198-T202 PolarHBondContact O-N 3.02Å; I198-T202 PolarHBondContact O-OG1 3.26Å; L199-T202 WeakPolarHBondContact CA-OG1 3.32Å; L199-T202 PolarHBondContact O-OG1 3.38Å; L199-T202 VanDerWaalsContact O-OG1 3.05Å; T202-S204 PolarHBondContact O-N 3.29Å; T202-S205 PolarHBondContact O-N 2.69Å; T202-M206 VanDerWaalsContact O-CG 3.32Å; T202-M206 WeakPolarHBondContact O-CG 3.22Å; T202-M206 PolarHBondContact O-N 2.94Å
203C91.6Very high89.2Confident8 Ų854.7 Ų54.75%0.05428%0.282CS..Hα-helixtrans-57.2-49.3175.7-72.50000111F115 L199 S205 M206 V207F115-C203 HydrophobicContact CB-CB 3.85Å; F115-C203 HydrophobicContact CG-CB 4.2Å; L199-C203 WeakPolarHBondContact O-CB 3.34Å; L199-C203 PolarHBondContact O-N 3.1Å; L199-C203 PolarHBondContact O-SG 3.43Å; C203-S205 PolarHBondContact O-N 2.8Å; C203-M206 PolarHBondContact O-N 3.06Å; C203-V207 WeakPolarHBondContact O-CG2 3.26Å; C203-V207 PolarHBondContact O-N 3.45Å
204S89.6Confident87.9Confident6 Ų659.8 Ų59.84%0.04232%0.315CS..Hα-helixtrans-59.6-46178.5-61.50000111.6N200 T202 M206 V207 L208 I231N200-S204 WeakPolarHBondContact O-CB 3.47Å; N200-S204 PolarHBondContact O-N 3.26Å; N200-S204 PolarHBondContact O-OG 3.28Å; T202-S204 PolarHBondContact O-N 3.29Å; S204-M206 PolarHBondContact O-N 2.68Å; S204-V207 PolarHBondContact O-N 3.34Å; S204-L208 WeakPolarHBondContact O-CB 3.29Å; S204-L208 WeakPolarHBondContact O-CD1 3.5Å; S204-L208 VanDerWaalsContact O-CG 3.25Å; S204-L208 WeakPolarHBondContact O-CG 3.42Å; S204-L208 PolarHBondContact O-N 2.99Å; S204-I231 WeakPolarHBondContact OG-CG2 3.09Å
205S90.3Very high86.5Confident49 Ų4962.1 Ų62.134%0.34334%0.335SS..Hα-helixtrans-62.3-41.9178.7-620000112.6V201 T202 C203 L208 K209V201-S205 VanDerWaalsContact O-CB 3.26Å; V201-S205 WeakPolarHBondContact O-CB 3.34Å; V201-S205 PolarHBondContact O-N 3.28Å; V201-S205 PolarHBondContact O-OG 3.37Å; T202-S205 PolarHBondContact O-N 2.69Å; C203-S205 PolarHBondContact O-N 2.8Å; S205-L208 PolarHBondContact O-N 3.46Å; S205-K209 WeakPolarHBondContact O-CG 3.46Å; S205-K209 PolarHBondContact O-N 3.44Å
206M89.4Confident84.8Confident74 Ų7460.3 Ų60.337%0.36533%0.328SS..Hα-helixtrans-68.6-38.5178.2-70-178.977.800112.3F115 T202 C203 S204 K209 T210F115-M206 HydrophobicContact CD2-CB 3.98Å; F115-M206 HydrophobicContact CD2-SD 4.48Å; F115-M206 HydrophobicContact CE2-CB 3.66Å; F115-M206 HydrophobicContact CE2-CE 3.63Å; F115-M206 HydrophobicContact CE2-CG 4.23Å; F115-M206 HydrophobicContact CE2-SD 3.52Å; F115-M206 VanDerWaalsContact CE2-SD 3.52Å; F115-M206 HydrophobicContact CZ-CE 3.79Å; F115-M206 HydrophobicContact CZ-SD 3.77Å; T202-M206 VanDerWaalsContact O-CG 3.32Å; T202-M206 WeakPolarHBondContact O-CG 3.22Å; T202-M206 PolarHBondContact O-N 2.94Å; C203-M206 PolarHBondContact O-N 3.06Å; S204-M206 PolarHBondContact O-N 2.68Å; M206-K209 PolarHBondContact O-N 2.79Å; M206-T210 WeakPolarHBondContact O-CB 3.28Å; M206-T210 PolarHBondContact O-N 3.01Å; M206-T210 PolarHBondContact O-OG1 2.85Å
207V85.8Confident82.7Confident2 Ų265.7 Ų65.71%0.01236%0.356CS..Hα-helixtrans-64-45.8174.3176.10000110.5F115 I118 V119 C203 S204 K209 T210 L211 V227 I231F115-V207 HydrophobicContact CB-CG2 3.98Å; F115-V207 HydrophobicContact CD2-CG2 4.14Å; I118-V207 HydrophobicContact CB-CG1 4.41Å; I118-V207 HydrophobicContact CD1-CG1 3.63Å; I118-V207 HydrophobicContact CD1-CG2 4.43Å; I118-V207 HydrophobicContact CG2-CG1 4.11Å; V119-V207 HydrophobicContact CG2-CG2 4.15Å; C203-V207 WeakPolarHBondContact O-CG2 3.26Å; C203-V207 PolarHBondContact O-N 3.45Å; S204-V207 PolarHBondContact O-N 3.34Å; V207-K209 PolarHBondContact O-N 3.1Å; V207-T210 PolarHBondContact O-N 3.31Å; V207-T210 VanDerWaalsContact O-N 3.1Å; V207-L211 HydrophobicContact CG1-CD1 3.7Å; V207-L211 HydrophobicContact CG1-CG 4.12Å; V207-L211 WeakPolarHBondContact O-CG 3.46Å; V207-L211 PolarHBondContact O-N 3.03Å; V207-V227 HydrophobicContact CG1-CG1 4.29Å; V207-I231 HydrophobicContact CB-CD1 3.71Å; V207-I231 HydrophobicContact CG1-CD1 3.24Å; V207-I231 HydrophobicContact CG2-CD1 4.36Å
208L85.4Confident80.6Confident70 Ų7070 Ų7037%0.36639%0.389SS..Hα-helixtrans-55.3-51.1176-74.9164.3000111.6S204 S205 T210 L211 N212 L228S204-L208 WeakPolarHBondContact O-CB 3.29Å; S204-L208 WeakPolarHBondContact O-CD1 3.5Å; S204-L208 VanDerWaalsContact O-CG 3.25Å; S204-L208 WeakPolarHBondContact O-CG 3.42Å; S204-L208 PolarHBondContact O-N 2.99Å; S205-L208 PolarHBondContact O-N 3.46Å; L208-T210 VanDerWaalsContact C-N 3.25Å; L208-T210 PolarHBondContact O-N 3.32Å; L208-L211 PolarHBondContact O-N 3.26Å; L208-N212 PolarHBondContact O-N 2.88Å; L208-N212 VanDerWaalsContact O-N 3.1Å; L208-L228 HydrophobicContact CD2-CD2 3.21Å; L208-L228 HydrophobicContact CG-CD2 4.4Å
209K86.6Confident78.6Confident153 Ų15375.8 Ų75.867%0.66540%0.404SS*.Hα-helixtrans-57.8-37176.4-74.4177.6-179.2-177.80112.7S205 M206 V207S205-K209 WeakPolarHBondContact O-CG 3.46Å; S205-K209 PolarHBondContact O-N 3.44Å; M206-K209 PolarHBondContact O-N 2.79Å; V207-K209 PolarHBondContact O-N 3.1Å
210T82.9Confident76.7Confident27 Ų2775.1 Ų75.117%0.16641%0.405CS..Hα-helixtrans-75.1-37.1-178.9-58.30000112.2I118 V119 M206 V207 L208 N212 K213 T216I118-T210 HydrophobicContact CG2-CG2 4.43Å; V119-T210 HydrophobicContact CG2-CG2 4.44Å; M206-T210 WeakPolarHBondContact O-CB 3.28Å; M206-T210 PolarHBondContact O-N 3.01Å; M206-T210 PolarHBondContact O-OG1 2.85Å; V207-T210 PolarHBondContact O-N 3.31Å; V207-T210 VanDerWaalsContact O-N 3.1Å; L208-T210 VanDerWaalsContact C-N 3.25Å; L208-T210 PolarHBondContact O-N 3.32Å; T210-N212 VanDerWaalsContact C-N 3.31Å; T210-K213 PolarHBondContact O-N 2.85Å; T210-T216 HydrophobicContact CG2-CG2 4.31Å; T210-T216 PolarHBondContact O-OG1 3.31Å
211L79.7Confident75.2Confident11 Ų1185.7 Ų85.76%0.05845%0.451CS..Hα-helixtrans-70.7-27177.1-70173.2000112.8I118 V207 L208 K213 K224 V227 L228I118-L211 HydrophobicContact CG2-CD2 4.16Å; I118-L211 HydrophobicContact CG2-CG 4.43Å; V207-L211 HydrophobicContact CG1-CD1 3.7Å; V207-L211 HydrophobicContact CG1-CG 4.12Å; V207-L211 WeakPolarHBondContact O-CG 3.46Å; V207-L211 PolarHBondContact O-N 3.03Å; L208-L211 PolarHBondContact O-N 3.26Å; L211-K213 VanDerWaalsContact C-N 3.29Å; L211-K213 PolarHBondContact O-N 3.28Å; L211-K224 HydrophobicContact CD2-CG 4.33Å; L211-K224 PolarHBondContact O-NZ 3.46Å; L211-V227 HydrophobicContact CD1-CB 4.24Å; L211-V227 HydrophobicContact CD1-CG1 3.76Å; L211-L228 HydrophobicContact CD1-CD2 3.78Å; L211-L228 HydrophobicContact CD1-CG 4.06Å
212N80.3Confident73.9Confident126 Ų12686.1 Ų86.167%0.67445%0.451SS*.THydrogen-bonded Turntrans-76.8-10.3176.5-70.8-12.4000113.9L208 T210L208-N212 PolarHBondContact O-N 2.88Å; L208-N212 VanDerWaalsContact O-N 3.1Å; T210-N212 VanDerWaalsContact C-N 3.31Å
213K78.8Confident73Confident128 Ų12888 Ų8856%0.55746%0.458SS*.  trans-75.1135.7176.7-68.4-177.7179-1750111.3T210 L211 V215 T216T210-K213 PolarHBondContact O-N 2.85Å; L211-K213 VanDerWaalsContact C-N 3.29Å; L211-K213 PolarHBondContact O-N 3.28Å; K213-V215 VanDerWaalsContact C-N 3.35Å; K213-V215 PolarHBondContact O-N 2.94Å; K213-T216 HydrophobicContact CB-CG2 4.41Å; K213-T216 PolarHBondContact O-OG1 3.45Å
214P65.4Low72.2Confident108 Ų10890 Ų9070%0.70147%0.466SS*.THydrogen-bonded Turntrans-69.4-27.7-176.324.3-32.2000113.6T216 L217P214-T216 PolarHBondContact O-N 3.31Å; P214-L217 VanDerWaalsContact O-CB 3.26Å; P214-L217 WeakPolarHBondContact O-CB 3.35Å; P214-L217 PolarHBondContact O-N 2.73Å
215V62.1Low71.4Confident121 Ų12193.7 Ų93.773%0.73349%0.488SS*.THydrogen-bonded Turntrans-74.8-24.6-176.7-179.30000113.1K213 L217K213-V215 VanDerWaalsContact C-N 3.35Å; K213-V215 PolarHBondContact O-N 2.94Å; V215-L217 PolarHBondContact O-N 2.82Å
216T58Low70.8Confident48 Ų4892.6 Ų92.629%0.29448%0.478SS..Hα-helixtrans-73.7-11.9177.860.40000112.9T210 K213 P214T210-T216 HydrophobicContact CG2-CG2 4.31Å; T210-T216 PolarHBondContact O-OG1 3.31Å; K213-T216 HydrophobicContact CB-CG2 4.41Å; K213-T216 PolarHBondContact O-OG1 3.45Å; P214-T216 PolarHBondContact O-N 3.31Å
217L51.1Low70.2Confident117 Ų11790 Ų9061%0.61347%0.466SS*.Hα-helixtrans-73.8-34.2-177.5-129.1126.7000113P214 V215 K224P214-L217 VanDerWaalsContact O-CB 3.26Å; P214-L217 WeakPolarHBondContact O-CB 3.35Å; P214-L217 PolarHBondContact O-N 2.73Å; V215-L217 PolarHBondContact O-N 2.82Å; L217-K224 HydrophobicContact CD1-CD 4.26Å
218S49.1Very low69.9Low122 Ų12292.5 Ų92.585%0.85348%0.479SS*.Hα-helixtrans-84.8-26.3-176.9-178.10000112.8
219R52.7Low69.7Low224 Ų22494.8 Ų94.885%0.84549%0.486SS*.Hα-helixtrans-99.1-7.5-166.9-141.5175.1-174.1167.52.2115.3
220S53.8Low69.5Low58 Ų5887.8 Ų87.841%0.40646%0.456SS..  trans-139.5122.6-177.4-146.70000111.6I222S220-I222 PolarHBondContact O-N 3.42Å; S220-I222 WeakPolarHBondContact OG-CD1 3.33Å; S220-I222 VanDerWaalsContact OG-CG1 3.23Å; S220-I222 WeakPolarHBondContact OG-CG1 3.09Å
221K61.1Low69.5Low227 Ų22787.1 Ų87.199%0.98745%0.451SS*.  trans-65.927.4170.5-78.3-176.8174.9178.70113
222I66.1Low69.8Low69 Ų6993 Ų9335%0.35448%0.476SS..  trans-82.6125.6-177.2-67.5171.9000108.9S220 K224 V227S220-I222 PolarHBondContact O-N 3.42Å; S220-I222 WeakPolarHBondContact OG-CD1 3.33Å; S220-I222 VanDerWaalsContact OG-CG1 3.23Å; S220-I222 WeakPolarHBondContact OG-CG1 3.09Å; I222-K224 PolarHBondContact O-N 3.48Å; I222-V227 HydrophobicContact CG2-CG2 3.61Å
223N72.5Confident70Confident101 Ų10188.3 Ų88.354%0.5445%0.452SS..  trans-70.997.9173.8-174.1-30000110T225 K226 V227N223-T225 PolarHBondContact O-N 3.22Å; N223-T225 PolarHBondContact OD1-N 3.29Å; N223-K226 HydrophobicContact CB-CB 3.93Å; N223-K226 WeakPolarHBondContact O-CB 3.15Å; N223-K226 PolarHBondContact O-N 2.82Å; N223-K226 PolarHBondContact OD1-N 3.21Å; N223-V227 PolarHBondContact O-N 2.82Å; N223-V227 VanDerWaalsContact O-N 3.17Å
224K75Confident70.2Confident48 Ų4882.6 Ų82.621%0.20943%0.427CS..Hα-helixtrans-54.2-49.9-177.2-64.9-166.9172.2-162.90112.5L211 L217 I222 K226 V227 L228L211-K224 HydrophobicContact CD2-CG 4.33Å; L211-K224 PolarHBondContact O-NZ 3.46Å; L217-K224 HydrophobicContact CD1-CD 4.26Å; I222-K224 PolarHBondContact O-N 3.48Å; K224-K226 PolarHBondContact O-N 3.4Å; K224-V227 PolarHBondContact O-N 2.92Å; K224-V227 VanDerWaalsContact O-N 3.17Å; K224-L228 VanDerWaalsContact O-CG 3.29Å; K224-L228 WeakPolarHBondContact O-CG 3.22Å; K224-L228 PolarHBondContact O-N 3.45Å
225T74Confident71.3Confident84 Ų8479.7 Ų79.752%0.51541%0.406SS..Hα-helixtrans-57.8-38.8-178.8-50.70000111.7N223 K229N223-T225 PolarHBondContact O-N 3.22Å; N223-T225 PolarHBondContact OD1-N 3.29Å; T225-K229 HydrophobicContact CG2-CD 4.45Å; T225-K229 WeakPolarHBondContact O-CB 3.36Å; T225-K229 VanDerWaalsContact O-CG 3.31Å; T225-K229 WeakPolarHBondContact O-CG 3.12Å; T225-K229 PolarHBondContact O-N 3.42Å
226K76.9Confident72.7Confident27 Ų2777.9 Ų77.912%0.11739%0.391CS..Hα-helixtrans-65.8-48.3177.3177.9175.2177.6159.20112.5N223 K224 L228 K229 M230 D296 Q299N223-K226 HydrophobicContact CB-CB 3.93Å; N223-K226 WeakPolarHBondContact O-CB 3.15Å; N223-K226 PolarHBondContact O-N 2.82Å; N223-K226 PolarHBondContact OD1-N 3.21Å; K224-K226 PolarHBondContact O-N 3.4Å; K226-L228 VanDerWaalsContact C-N 3.31Å; K226-L228 PolarHBondContact O-N 2.94Å; K226-K229 PolarHBondContact O-N 2.8Å; K226-M230 WeakPolarHBondContact O-CB 3.28Å; K226-M230 PolarHBondContact O-N 3.33Å; K226-D296 WeakPolarHBondContact CE-OD1 3.22Å; K226-D296 IonicContact NZ-OD1 2.67Å; K226-D296 PolarHBondContact NZ-OD1 3.39Å; K226-D296 IonicContact NZ-OD2 2.75Å; K226-D296 PolarHBondContact NZ-OD2 2.82Å; K226-Q299 VanDerWaalsContact NZ-CD 3.33Å
227V77.6Confident74.2Confident19 Ų1976.4 Ų76.412%0.11538%0.381CS..Hα-helixtrans-62.9-40.7179.4174.70000111I118 V207 L211 I222 N223 K224 M230 I231I118-V227 HydrophobicContact CD1-CG1 3.42Å; I118-V227 VanDerWaalsContact CD1-CG1 3.42Å; V207-V227 HydrophobicContact CG1-CG1 4.29Å; L211-V227 HydrophobicContact CD1-CB 4.24Å; L211-V227 HydrophobicContact CD1-CG1 3.76Å; I222-V227 HydrophobicContact CG2-CG2 3.61Å; N223-V227 PolarHBondContact O-N 2.82Å; N223-V227 VanDerWaalsContact O-N 3.17Å; K224-V227 PolarHBondContact O-N 2.92Å; K224-V227 VanDerWaalsContact O-N 3.17Å; V227-M230 WeakPolarHBondContact O-CB 3.48Å; V227-M230 PolarHBondContact O-N 3.19Å; V227-I231 HydrophobicContact CG1-CD1 3.91Å; V227-I231 WeakPolarHBondContact O-CG1 3.3Å; V227-I231 PolarHBondContact O-N 3.43Å
228L79.4Confident76.1Confident54 Ų5470.9 Ų70.928%0.28335%0.352SS..Hα-helixtrans-61.9-47.8175.4-69.9173.7000111.9L208 L211 K224 K226 M230 I231 F232L208-L228 HydrophobicContact CD2-CD2 3.21Å; L208-L228 HydrophobicContact CG-CD2 4.4Å; L211-L228 HydrophobicContact CD1-CD2 3.78Å; L211-L228 HydrophobicContact CD1-CG 4.06Å; K224-L228 VanDerWaalsContact O-CG 3.29Å; K224-L228 WeakPolarHBondContact O-CG 3.22Å; K224-L228 PolarHBondContact O-N 3.45Å; K226-L228 VanDerWaalsContact C-N 3.31Å; K226-L228 PolarHBondContact O-N 2.94Å; L228-M230 VanDerWaalsContact C-N 3.31Å; L228-M230 PolarHBondContact O-N 2.66Å; L228-I231 PolarHBondContact O-N 3.03Å; L228-F232 WeakPolarHBondContact O-CB 3.42Å; L228-F232 PolarHBondContact O-N 3.14Å
229K81.3Confident78.2Confident119 Ų11967.1 Ų67.152%0.51733%0.325SS..Hα-helixtrans-57.9-45175.4-77.8-179.3178-172.60111.5T225 K226 F232 V233 F293T225-K229 HydrophobicContact CG2-CD 4.45Å; T225-K229 WeakPolarHBondContact O-CB 3.36Å; T225-K229 VanDerWaalsContact O-CG 3.31Å; T225-K229 WeakPolarHBondContact O-CG 3.12Å; T225-K229 PolarHBondContact O-N 3.42Å; K226-K229 PolarHBondContact O-N 2.8Å; K229-F232 PolarHBondContact O-N 2.85Å; K229-V233 WeakPolarHBondContact O-CB 3.3Å; K229-V233 WeakPolarHBondContact O-CG2 3.16Å; K229-V233 PolarHBondContact O-N 3.11Å; K229-F293 HydrophobicContact CB-CD1 4.22Å; K229-F293 HydrophobicContact CB-CE1 4.42Å; K229-F293 HydrophobicContact CD-CE1 4.46Å
230M82.4Confident80.2Confident6 Ų661.5 Ų61.53%0.0331%0.307CS..Hα-helixtrans-58.3-50.6177.1-178-16078.500111.5R114 K226 V227 L228 F232 V233 H234 F293 T294R114-M230 HydrophobicContact CB-CE 3.94Å; R114-M230 HydrophobicContact CG-CE 3.49Å; R114-M230 VanDerWaalsContact CG-CE 3.49Å; R114-M230 HydrophobicContact CG-SD 4.27Å; K226-M230 WeakPolarHBondContact O-CB 3.28Å; K226-M230 PolarHBondContact O-N 3.33Å; V227-M230 WeakPolarHBondContact O-CB 3.48Å; V227-M230 PolarHBondContact O-N 3.19Å; L228-M230 VanDerWaalsContact C-N 3.31Å; L228-M230 PolarHBondContact O-N 2.66Å; M230-F232 PolarHBondContact O-N 2.88Å; M230-V233 PolarHBondContact O-N 3.39Å; M230-H234 WeakPolarHBondContact CG-CE1 3.22Å; M230-H234 PolarHBondContact O-N 3.48Å; M230-H234 PolarHBondContact O-ND1 3.26Å; M230-F293 HydrophobicContact CB-CB 4.2Å; M230-F293 HydrophobicContact CG-CB 4.44Å; M230-T294 HydrophobicContact CG-CG2 4.36Å; M230-T294 WeakPolarHBondContact CG-OG1 3.19Å; M230-T294 HydrophobicContact SD-CG2 3.69Å
231I82.6Confident82.1Confident13 Ų1358.7 Ų58.77%0.06729%0.288CS..Hα-helixtrans-62.3-45.6179.8-70166.8000111.5S204 V207 V227 L228 V233 H234 L235S204-I231 WeakPolarHBondContact OG-CG2 3.09Å; V207-I231 HydrophobicContact CB-CD1 3.71Å; V207-I231 HydrophobicContact CG1-CD1 3.24Å; V207-I231 HydrophobicContact CG2-CD1 4.36Å; V227-I231 HydrophobicContact CG1-CD1 3.91Å; V227-I231 WeakPolarHBondContact O-CG1 3.3Å; V227-I231 PolarHBondContact O-N 3.43Å; L228-I231 PolarHBondContact O-N 3.03Å; I231-V233 PolarHBondContact O-N 2.93Å; I231-H234 PolarHBondContact O-N 3.46Å; I231-L235 WeakPolarHBondContact O-CB 3.2Å; I231-L235 PolarHBondContact O-N 2.88Å
232F84.8Confident83.7Confident135 Ų13548 Ų4859%0.59224%0.241SC*.Hα-helixtrans-61.6-45.7-179.4-175.9-104.9000112L228 K229 M230 L235 I236L228-F232 WeakPolarHBondContact O-CB 3.42Å; L228-F232 PolarHBondContact O-N 3.14Å; K229-F232 PolarHBondContact O-N 2.85Å; M230-F232 PolarHBondContact O-N 2.88Å; F232-L235 PolarHBondContact O-N 3.31Å; F232-I236 HydrophobicContact CD1-CD1 3.76Å; F232-I236 HydrophobicContact CD2-CD1 4.24Å; F232-I236 HydrophobicContact CE1-CD1 3.23Å; F232-I236 HydrophobicContact CE1-CG1 4.46Å; F232-I236 HydrophobicContact CE2-CD1 3.77Å; F232-I236 HydrophobicContact CE2-CG1 4.5Å; F232-I236 HydrophobicContact CG-CD1 4.25Å; F232-I236 HydrophobicContact CZ-CD1 3.26Å; F232-I236 HydrophobicContact CZ-CG1 4.4Å; F232-I236 WeakPolarHBondContact O-CB 3.32Å; F232-I236 WeakPolarHBondContact O-CG1 3.34Å; F232-I236 PolarHBondContact O-N 3.39Å
233V86.3Confident85Confident26 Ų2646.4 Ų46.416%0.15824%0.235CC..Hα-helixtrans-61.4-47.9177166.70000111.2K229 M230 I231 L235 I236 I237 V289 F293K229-V233 WeakPolarHBondContact O-CB 3.3Å; K229-V233 WeakPolarHBondContact O-CG2 3.16Å; K229-V233 PolarHBondContact O-N 3.11Å; M230-V233 PolarHBondContact O-N 3.39Å; I231-V233 PolarHBondContact O-N 2.93Å; V233-L235 PolarHBondContact O-N 2.9Å; V233-I236 PolarHBondContact O-N 3.43Å; V233-I237 HydrophobicContact CG1-CD1 3.6Å; V233-I237 WeakPolarHBondContact O-CG1 3.4Å; V233-I237 PolarHBondContact O-N 2.8Å; V233-V289 HydrophobicContact CG1-CG1 3.91Å; V233-F293 HydrophobicContact CB-CD2 4.29Å; V233-F293 HydrophobicContact CG1-CD2 3.99Å; V233-F293 HydrophobicContact CG2-CD2 3.88Å; V233-F293 HydrophobicContact CG2-CE2 4Å; V233-F293 HydrophobicContact CG2-CG 4.37Å
234H83Confident86.1Confident8 Ų843.7 Ų43.74%0.03722%0.222CC..Hα-helixtrans-59.1-47.1177.4-72.3119.6000112.2M230 I231 I236 I237 F238 V290 T294M230-H234 WeakPolarHBondContact CG-CE1 3.22Å; M230-H234 PolarHBondContact O-N 3.48Å; M230-H234 PolarHBondContact O-ND1 3.26Å; I231-H234 PolarHBondContact O-N 3.46Å; H234-I236 PolarHBondContact O-N 3.27Å; H234-I237 PolarHBondContact O-N 2.85Å; H234-F238 VanDerWaalsContact O-CB 3.24Å; H234-F238 WeakPolarHBondContact O-CB 3.26Å; H234-F238 PolarHBondContact O-N 3.45Å; H234-V290 WeakPolarHBondContact CD2-CG1 3.35Å; H234-V290 VanDerWaalsContact CD2-CG2 3.48Å; H234-V290 WeakPolarHBondContact CD2-CG2 3.19Å; H234-V290 WeakPolarHBondContact NE2-CG1 3.38Å; H234-T294 PolarHBondContact CE1-OG1 2.92Å; H234-T294 PolarHBondContact NE2-OG1 3.3Å
235L88.4Confident87Confident48 Ų4841.4 Ų41.425%0.25121%0.212SC..Hα-helixtrans-65.7-40.5-176.4-170.866.7000111.3N200 V201 I231 F232 V233 C239N200-L235 HydrophobicContact CB-CD1 4.44Å; V201-L235 HydrophobicContact CG2-CD1 4.09Å; I231-L235 WeakPolarHBondContact O-CB 3.2Å; I231-L235 PolarHBondContact O-N 2.88Å; F232-L235 PolarHBondContact O-N 3.31Å; V233-L235 PolarHBondContact O-N 2.9Å; L235-C239 VanDerWaalsContact O-CB 3.28Å; L235-C239 WeakPolarHBondContact O-CB 3.33Å; L235-C239 PolarHBondContact O-N 2.86Å; L235-C239 PolarHBondContact O-SG 3.43Å
236I90.5Very high87.9Confident83 Ų8337.4 Ų37.443%0.42619%0.188SC..Hα-helixtrans-64.9-48.6176.4-74.3179.2000111.1F232 V233 H234 F238 C239 F240F232-I236 HydrophobicContact CD1-CD1 3.76Å; F232-I236 HydrophobicContact CD2-CD1 4.24Å; F232-I236 HydrophobicContact CE1-CD1 3.23Å; F232-I236 HydrophobicContact CE1-CG1 4.46Å; F232-I236 HydrophobicContact CE2-CD1 3.77Å; F232-I236 HydrophobicContact CE2-CG1 4.5Å; F232-I236 HydrophobicContact CG-CD1 4.25Å; F232-I236 HydrophobicContact CZ-CD1 3.26Å; F232-I236 HydrophobicContact CZ-CG1 4.4Å; F232-I236 WeakPolarHBondContact O-CB 3.32Å; F232-I236 WeakPolarHBondContact O-CG1 3.34Å; F232-I236 PolarHBondContact O-N 3.39Å; V233-I236 PolarHBondContact O-N 3.43Å; H234-I236 PolarHBondContact O-N 3.27Å; I236-F238 VanDerWaalsContact C-N 3.33Å; I236-F238 PolarHBondContact O-N 3.39Å; I236-C239 PolarHBondContact O-N 3.39Å; I236-F240 WeakPolarHBondContact O-CB 3.11Å; I236-F240 PolarHBondContact O-N 3.21Å
237I90.6Very high88.6Confident16 Ų1639.8 Ų39.88%0.08220%0.201CC..Hα-helixtrans-62.2-45.2-179.2-69.8165.7000110V233 H234 C239 F240 C241 F286 V289 V290V233-I237 HydrophobicContact CG1-CD1 3.6Å; V233-I237 WeakPolarHBondContact O-CG1 3.4Å; V233-I237 PolarHBondContact O-N 2.8Å; H234-I237 PolarHBondContact O-N 2.85Å; I237-C239 PolarHBondContact O-N 2.93Å; I237-F240 PolarHBondContact O-N 3.47Å; I237-C241 VanDerWaalsContact O-CB 3.3Å; I237-C241 WeakPolarHBondContact O-CB 3.37Å; I237-C241 PolarHBondContact O-N 2.96Å; I237-C241 PolarHBondContact O-SG 3.01Å; I237-F286 HydrophobicContact CD1-CB 3.97Å; I237-F286 HydrophobicContact CG1-CB 4.14Å; I237-F286 HydrophobicContact CG2-CB 3.75Å; I237-F286 HydrophobicContact CG2-CG 4.5Å; I237-V289 HydrophobicContact CD1-CB 4.37Å; I237-V290 HydrophobicContact CD1-CG2 3.73Å
238F90.6Very high89.3Confident2 Ų239.5 Ų39.51%0.00920%0.199CC..Hα-helixtrans-58.1-51.2176.6-176.2-83.3000111.6I104 L107 F193 P196 L197 H234 I236 F242I104-F238 HydrophobicContact CB-CE2 4.2Å; I104-F238 HydrophobicContact CG1-CE2 4.2Å; I104-F238 HydrophobicContact CG2-CE2 3.84Å; I104-F238 HydrophobicContact CG2-CZ 3.99Å; L107-F238 HydrophobicContact CB-CD2 4.3Å; L107-F238 HydrophobicContact CD1-CD2 4.19Å; F193-F238 HydrophobicContact CE2-CE1 4.05Å; F193-F238 HydrophobicContact CE2-CZ 4.33Å; P196-F238 HydrophobicContact CB-CZ 4.26Å; L197-F238 HydrophobicContact CB-CE1 4.01Å; L197-F238 HydrophobicContact CB-CZ 4.5Å; L197-F238 HydrophobicContact CD1-CD1 4.05Å; L197-F238 HydrophobicContact CD1-CE1 3.66Å; L197-F238 HydrophobicContact CG-CE1 4.45Å; H234-F238 VanDerWaalsContact O-CB 3.24Å; H234-F238 WeakPolarHBondContact O-CB 3.26Å; H234-F238 PolarHBondContact O-N 3.45Å; I236-F238 VanDerWaalsContact C-N 3.33Å; I236-F238 PolarHBondContact O-N 3.39Å; F238-F242 HydrophobicContact CB-CD2 4.48Å; F238-F242 AromaticContact CD2-CD2 3.8Å; F238-F242 HydrophobicContact CD2-CD2 3.8Å; F238-F242 HydrophobicContact CD2-CE2 4.16Å; F238-F242 HydrophobicContact CE2-CD2 4.13Å; F238-F242 HydrophobicContact CG-CD2 4.07Å; F238-F242 WeakPolarHBondContact O-CB 3.33Å; F238-F242 VanDerWaalsContact O-CD2 3.3Å; F238-F242 WeakPolarHBondContact O-CD2 3.36Å; F238-F242 PolarHBondContact O-N 3.39Å
239C92.7Very high89.7Confident43 Ų4337 Ų3729%0.29119%0.186SC..Hα-helixtrans-65.5-44.3-178.9-72.80000111.7L235 I236 I237 V243 P244L235-C239 VanDerWaalsContact O-CB 3.28Å; L235-C239 WeakPolarHBondContact O-CB 3.33Å; L235-C239 PolarHBondContact O-N 2.86Å; L235-C239 PolarHBondContact O-SG 3.43Å; I236-C239 PolarHBondContact O-N 3.39Å; I237-C239 PolarHBondContact O-N 2.93Å; C239-V243 HydrophobicContact CB-CG2 4.07Å; C239-V243 WeakPolarHBondContact O-CB 3.47Å; C239-V243 VanDerWaalsContact O-CG2 3.27Å; C239-V243 WeakPolarHBondContact O-CG2 3.02Å; C239-V243 PolarHBondContact O-N 3.3Å; C239-V243 VanDerWaalsContact O-N 3.16Å; C239-P244 WeakPolarHBondContact O-CD 3.38Å
240F93.9Very high90Very high105 Ų10532.8 Ų32.846%0.46117%0.169SC..Hα-helixtrans-65-46.6-178.9178-103.6000112I236 I237 P244 I279 F286I236-F240 WeakPolarHBondContact O-CB 3.11Å; I236-F240 PolarHBondContact O-N 3.21Å; I237-F240 PolarHBondContact O-N 3.47Å; F240-P244 WeakPolarHBondContact O-CD 3.19Å; F240-P244 WeakPolarHBondContact O-CG 3.5Å; F240-I279 HydrophobicContact CD1-CG2 4.14Å; F240-I279 HydrophobicContact CE1-CG2 3.89Å; F240-I279 HydrophobicContact CZ-CG2 4.1Å; F240-I279 WeakPolarHBondContact O-CG2 3.12Å; F240-F286 HydrophobicContact CD1-CE2 4.31Å; F240-F286 HydrophobicContact CE1-CE2 4.1Å; F240-F286 HydrophobicContact CE1-CZ 4.35Å
241C94.3Very high90.3Very high0 Ų035.6 Ų35.60%018%0.184CC..Hα-helixtrans-75.6-44.7-175.9-59.10000111.9I237 A280 N283I237-C241 VanDerWaalsContact O-CB 3.3Å; I237-C241 WeakPolarHBondContact O-CB 3.37Å; I237-C241 PolarHBondContact O-N 2.96Å; I237-C241 PolarHBondContact O-SG 3.01Å; C241-A280 WeakPolarHBondContact O-CA 3.5Å; C241-A280 WeakPolarHBondContact O-CB 3.44Å; C241-A280 PolarHBondContact O-N 3.43Å; C241-N283 HydrophobicContact CB-CB 4.04Å
242F94.3Very high90.4Very high2 Ų237.1 Ų37.11%0.00919%0.189CC..Hα-helixtrans-99.2-36.2-167-56.6-62.6000114.1M100 I104 L107 F193 F238 Y245 N246 N283M100-F242 HydrophobicContact CG-CD1 4.27Å; M100-F242 HydrophobicContact CG-CE1 4.27Å; I104-F242 HydrophobicContact CD1-CB 4.26Å; I104-F242 HydrophobicContact CD1-CD1 3.86Å; I104-F242 HydrophobicContact CD1-CE1 4.4Å; I104-F242 HydrophobicContact CD1-CG 4.01Å; I104-F242 HydrophobicContact CG1-CB 4.26Å; I104-F242 HydrophobicContact CG1-CD1 3.69Å; I104-F242 HydrophobicContact CG1-CD2 3.82Å; I104-F242 HydrophobicContact CG1-CE1 3.93Å; I104-F242 HydrophobicContact CG1-CE2 4.08Å; I104-F242 HydrophobicContact CG1-CG 3.63Å; I104-F242 HydrophobicContact CG1-CZ 4.12Å; L107-F242 HydrophobicContact CD1-CE2 3.74Å; L107-F242 HydrophobicContact CD1-CZ 4.41Å; F193-F242 HydrophobicContact CD2-CB 4.15Å; F193-F242 HydrophobicContact CE2-CB 3.7Å; F238-F242 HydrophobicContact CB-CD2 4.48Å; F238-F242 AromaticContact CD2-CD2 3.8Å; F238-F242 HydrophobicContact CD2-CD2 3.8Å; F238-F242 HydrophobicContact CD2-CE2 4.16Å; F238-F242 HydrophobicContact CE2-CD2 4.13Å; F238-F242 HydrophobicContact CG-CD2 4.07Å; F238-F242 WeakPolarHBondContact O-CB 3.33Å; F238-F242 VanDerWaalsContact O-CD2 3.3Å; F238-F242 WeakPolarHBondContact O-CD2 3.36Å; F238-F242 PolarHBondContact O-N 3.39Å; F242-Y245 PolarHBondContact O-N 3.45Å; F242-N246 PolarHBondContact O-N 2.9Å; F242-N246 VanDerWaalsContact O-N 3.07Å; F242-N246 PolarHBondContact O-ND2 3.01Å; F242-N283 HydrophobicContact CE1-CB 4.25Å; F242-N283 HydrophobicContact CZ-CB 3.84Å; F242-N283 WeakPolarHBondContact CZ-OD1 3.44Å
243V94.4Very high90.2Very high36 Ų3630.7 Ų30.722%0.21816%0.16CC..Hα-helixtrans-60.1-48.1-175.4179.10000112.5F193 L197 C239 Y245 I247F193-V243 HydrophobicContact CE2-CG2 4.31Å; F193-V243 HydrophobicContact CZ-CB 4.07Å; F193-V243 HydrophobicContact CZ-CG2 3.67Å; L197-V243 HydrophobicContact CD1-CG2 4.32Å; C239-V243 HydrophobicContact CB-CG2 4.07Å; C239-V243 WeakPolarHBondContact O-CB 3.47Å; C239-V243 VanDerWaalsContact O-CG2 3.27Å; C239-V243 WeakPolarHBondContact O-CG2 3.02Å; C239-V243 PolarHBondContact O-N 3.3Å; C239-V243 VanDerWaalsContact O-N 3.16Å; V243-Y245 VanDerWaalsContact C-N 3.32Å; V243-Y245 PolarHBondContact O-N 3.18Å; V243-I247 HydrophobicContact CG1-CD1 3.43Å; V243-I247 VanDerWaalsContact CG1-CD1 3.43Å; V243-I247 HydrophobicContact CG1-CG1 4.16Å; V243-I247 WeakPolarHBondContact O-CB 3.49Å; V243-I247 VanDerWaalsContact O-CG1 3.29Å; V243-I247 WeakPolarHBondContact O-CG1 3.37Å; V243-I247 PolarHBondContact O-N 2.9Å; V243-I247 VanDerWaalsContact O-N 3.13Å
244P95.4Very high90.1Very high44 Ų4431.9 Ų31.929%0.28617%0.166SC..Hα-helixtrans-62-40.3-177.2-23.235000112.6C239 F240 N248 T276C239-P244 WeakPolarHBondContact O-CD 3.38Å; F240-P244 WeakPolarHBondContact O-CD 3.19Å; F240-P244 WeakPolarHBondContact O-CG 3.5Å; P244-N248 VanDerWaalsContact O-CB 3.23Å; P244-N248 WeakPolarHBondContact O-CB 3.27Å; P244-N248 PolarHBondContact O-N 3.43Å; P244-N248 VanDerWaalsContact O-N 3.13Å; P244-T276 HydrophobicContact CB-CG2 3.62Å
245Y94.1Very high90Very high0 Ų031.9 Ų31.90%017%0.166CC..Hα-helixtrans-71.5-51.7-177.6178.1-101.3000112.3M100 F242 V243 I247 N248 L249 Y273 L277 A280M100-Y245 HydrophobicContact CE-CD1 3.76Å; M100-Y245 HydrophobicContact CE-CE1 3.6Å; M100-Y245 HydrophobicContact SD-CD1 3.38Å; M100-Y245 WeakPolarHBondContact SD-CD1 3.38Å; M100-Y245 HydrophobicContact SD-CE1 3.19Å; M100-Y245 WeakPolarHBondContact SD-CE1 3.4Å; F242-Y245 PolarHBondContact O-N 3.45Å; V243-Y245 VanDerWaalsContact C-N 3.32Å; V243-Y245 PolarHBondContact O-N 3.18Å; Y245-I247 PolarHBondContact O-N 2.94Å; Y245-N248 CarbonylContact O-C 3.59Å; Y245-N248 PolarHBondContact O-N 3.03Å; Y245-N248 VanDerWaalsContact O-N 3.16Å; Y245-L249 HydrophobicContact CE1-CD2 3.77Å; Y245-L249 WeakPolarHBondContact O-CB 3.26Å; Y245-L249 PolarHBondContact O-N 2.82Å; Y245-Y273 HydrophobicContact CE2-CD2 4.41Å; Y245-Y273 AromaticContact CE2-CE2 3.79Å; Y245-Y273 HydrophobicContact CE2-CE2 3.79Å; Y245-Y273 PolarHBondContact OH-OH 2.97Å; Y245-L277 HydrophobicContact CD2-CB 3.87Å; Y245-L277 HydrophobicContact CD2-CG 4.44Å; Y245-L277 HydrophobicContact CE2-CB 3.76Å; Y245-L277 HydrophobicContact CE2-CD1 3.96Å; Y245-L277 HydrophobicContact CE2-CG 3.96Å; Y245-A280 HydrophobicContact CD1-CB 4.44Å; Y245-A280 HydrophobicContact CG-CB 4.05Å
246N92.3Very high89.4Confident0 Ų031.2 Ų31.20%016%0.161CC..Hα-helixtrans-64.8-39.7-176-70.6-95.8000111.1M100 E189 F193 F242 L249 I250M100-N246 WeakPolarHBondContact CE-OD1 3.13Å; E189-N246 PolarHBondContact OE1-OD1 3.41Å; E189-N246 WeakPolarHBondContact OE2-CA 3.4Å; E189-N246 WeakPolarHBondContact OE2-CB 3.38Å; E189-N246 VanDerWaalsContact OE2-CG 3.32Å; E189-N246 PolarHBondContact OE2-OD1 3.5Å; F193-N246 HydrophobicContact CB-CB 4.13Å; F193-N246 WeakPolarHBondContact CB-OD1 2.84Å; F193-N246 HydrophobicContact CD1-CB 3.5Å; F193-N246 VanDerWaalsContact CD1-CB 3.5Å; F193-N246 HydrophobicContact CD2-CB 3.97Å; F193-N246 HydrophobicContact CE1-CB 3.87Å; F193-N246 HydrophobicContact CE2-CB 4.3Å; F193-N246 HydrophobicContact CG-CB 3.57Å; F193-N246 HydrophobicContact CZ-CB 4.26Å; F242-N246 PolarHBondContact O-N 2.9Å; F242-N246 VanDerWaalsContact O-N 3.07Å; F242-N246 PolarHBondContact O-ND2 3.01Å; N246-L249 PolarHBondContact O-N 3.23Å; N246-I250 WeakPolarHBondContact O-CG1 3.38Å; N246-I250 PolarHBondContact O-N 3.12Å; N246-I250 VanDerWaalsContact O-N 3.14Å
247I92.2Very high88.5Confident76 Ų7629.2 Ų29.239%0.3915%0.152SC..Hα-helixtrans-61.6-48.8172.6-67.4179.5000110.7V243 Y245 L249 I250 L251V243-I247 HydrophobicContact CG1-CD1 3.43Å; V243-I247 VanDerWaalsContact CG1-CD1 3.43Å; V243-I247 HydrophobicContact CG1-CG1 4.16Å; V243-I247 WeakPolarHBondContact O-CB 3.49Å; V243-I247 VanDerWaalsContact O-CG1 3.29Å; V243-I247 WeakPolarHBondContact O-CG1 3.37Å; V243-I247 PolarHBondContact O-N 2.9Å; V243-I247 VanDerWaalsContact O-N 3.13Å; Y245-I247 PolarHBondContact O-N 2.94Å; I247-L249 VanDerWaalsContact C-N 3.28Å; I247-L249 PolarHBondContact O-N 2.87Å; I247-I250 PolarHBondContact O-N 3.49Å; I247-L251 HydrophobicContact CG2-CD1 4.16Å; I247-L251 WeakPolarHBondContact O-CG 3.41Å; I247-L251 PolarHBondContact O-N 2.9Å; I247-L251 VanDerWaalsContact O-N 3.08Å
248N91.3Very high87.5Confident13 Ų1335.3 Ų35.37%0.0718%0.18CC..Hα-helixtrans-67.4-30.1-178.6-165.170000112.4P244 Y245 L251 Y252 V269 Y273 T276P244-N248 VanDerWaalsContact O-CB 3.23Å; P244-N248 WeakPolarHBondContact O-CB 3.27Å; P244-N248 PolarHBondContact O-N 3.43Å; P244-N248 VanDerWaalsContact O-N 3.13Å; Y245-N248 CarbonylContact O-C 3.59Å; Y245-N248 PolarHBondContact O-N 3.03Å; Y245-N248 VanDerWaalsContact O-N 3.16Å; N248-L251 PolarHBondContact O-N 3.46Å; N248-Y252 WeakPolarHBondContact O-CB 3.49Å; N248-Y252 PolarHBondContact O-N 3.4Å; N248-V269 PolarHBondContact ND2-O 3.38Å; N248-V269 VanDerWaalsContact ND2-O 3.08Å; N248-Y273 WeakPolarHBondContact ND2-CA 3.19Å; N248-Y273 WeakPolarHBondContact ND2-CB 3.47Å; N248-Y273 PolarHBondContact ND2-N 3.05Å; N248-T276 HydrophobicContact CB-CG2 4.45Å
249L88.2Confident86.1Confident3 Ų339.1 Ų39.12%0.01620%0.204CC..Hα-helixtrans-68.1-39.2176.3179.756.5000111.7V185 E189 Y245 N246 I247 Y252 S253 Y273V185-L249 HydrophobicContact CG1-CD1 4.47Å; V185-L249 HydrophobicContact CG1-CD2 4.46Å; V185-L249 HydrophobicContact CG1-CG 4.25Å; E189-L249 HydrophobicContact CG-CD2 4.29Å; E189-L249 HydrophobicContact CG-CG 4.48Å; E189-L249 VanDerWaalsContact OE1-CD2 3.29Å; E189-L249 WeakPolarHBondContact OE1-CD2 3.38Å; Y245-L249 HydrophobicContact CE1-CD2 3.77Å; Y245-L249 WeakPolarHBondContact O-CB 3.26Å; Y245-L249 PolarHBondContact O-N 2.82Å; N246-L249 PolarHBondContact O-N 3.23Å; I247-L249 VanDerWaalsContact C-N 3.28Å; I247-L249 PolarHBondContact O-N 2.87Å; L249-Y252 PolarHBondContact O-N 3.28Å; L249-S253 WeakPolarHBondContact O-CB 3.38Å; L249-S253 PolarHBondContact O-N 2.96Å; L249-Y273 HydrophobicContact CD1-CE2 4Å
250I88.1Confident84.7Confident30 Ų3041 Ų4115%0.15421%0.207CC..Hα-helixtrans-62.5-48.7170.8-67.1169.9000110.5E189 F194 N246 I247 Y252 S253 L254E189-I250 HydrophobicContact CB-CD1 3.9Å; E189-I250 HydrophobicContact CB-CG1 3.78Å; E189-I250 HydrophobicContact CG-CG1 4.04Å; F194-I250 HydrophobicContact CE2-CD1 3.58Å; F194-I250 HydrophobicContact CZ-CD1 4.23Å; N246-I250 WeakPolarHBondContact O-CG1 3.38Å; N246-I250 PolarHBondContact O-N 3.12Å; N246-I250 VanDerWaalsContact O-N 3.14Å; I247-I250 PolarHBondContact O-N 3.49Å; I250-Y252 VanDerWaalsContact C-N 3.28Å; I250-Y252 PolarHBondContact O-N 2.89Å; I250-S253 WeakPolarHBondContact O-CB 3.44Å; I250-S253 PolarHBondContact O-N 3.2Å; I250-L254 HydrophobicContact CG2-CD1 4.24Å; I250-L254 WeakPolarHBondContact O-CG 3.32Å; I250-L254 PolarHBondContact O-N 3.1Å
251L88Confident83.3Confident65 Ų6542.3 Ų42.334%0.3422%0.224SC..Hα-helixtrans-60.2-40177.6-66.9175.2000111.6I247 N248 L254 V255 V269I247-L251 HydrophobicContact CG2-CD1 4.16Å; I247-L251 WeakPolarHBondContact O-CG 3.41Å; I247-L251 PolarHBondContact O-N 2.9Å; I247-L251 VanDerWaalsContact O-N 3.08Å; N248-L251 PolarHBondContact O-N 3.46Å; L251-L254 PolarHBondContact O-N 3.22Å; L251-V255 WeakPolarHBondContact O-CB 3.05Å; L251-V255 WeakPolarHBondContact O-CG2 3.34Å; L251-V255 PolarHBondContact O-N 3.39Å; L251-V269 HydrophobicContact CB-CG1 4.08Å; L251-V269 HydrophobicContact CB-CG2 3.96Å; L251-V269 HydrophobicContact CD1-CG2 4.46Å
252Y84.4Confident82.7Confident44 Ų4447.5 Ų47.517%0.17325%0.251CS..Hα-helixtrans-63.5-42.3176.4-176.1-93.1000111.4W177 N248 L249 I250 L254 V255 R256 V269 R270 Y273W177-Y252 HydrophobicContact CZ2-CE1 4.45Å; N248-Y252 WeakPolarHBondContact O-CB 3.49Å; N248-Y252 PolarHBondContact O-N 3.4Å; L249-Y252 PolarHBondContact O-N 3.28Å; I250-Y252 VanDerWaalsContact C-N 3.28Å; I250-Y252 PolarHBondContact O-N 2.89Å; Y252-L254 PolarHBondContact O-N 3.07Å; Y252-V255 PolarHBondContact O-N 2.85Å; Y252-R256 HydrophobicContact CD1-CG 4.03Å; Y252-R256 HydrophobicContact CE1-CG 3.71Å; Y252-R256 HydrophobicContact CE2-CG 4.49Å; Y252-R256 WeakPolarHBondContact O-CB 3.48Å; Y252-R256 WeakPolarHBondContact O-CG 3.3Å; Y252-R256 PolarHBondContact O-N 3.17Å; Y252-V269 VanDerWaalsContact CA-CG1 3.48Å; Y252-V269 HydrophobicContact CD2-CG1 4.2Å; Y252-R270 HydrophobicContact CD2-CG 4.4Å; Y252-R270 HydrophobicContact CE2-CG 4.06Å; Y252-Y273 HydrophobicContact CD2-CD2 4.5Å; Y252-Y273 HydrophobicContact CG-CD2 4.38Å
253S81.9Confident82.2Confident0 Ų048.6 Ų48.60%026%0.259CS..Hα-helixtrans-59-45.5174-170.40000111.6S182 L249 I250 R256 T257S182-S253 WeakPolarHBondContact CA-OG 3.5Å; S182-S253 WeakPolarHBondContact CB-OG 3.2Å; S182-S253 PolarHBondContact O-OG 3.32Å; L249-S253 WeakPolarHBondContact O-CB 3.38Å; L249-S253 PolarHBondContact O-N 2.96Å; I250-S253 WeakPolarHBondContact O-CB 3.44Å; I250-S253 PolarHBondContact O-N 3.2Å; S253-R256 PolarHBondContact O-N 2.95Å; S253-T257 PolarHBondContact O-N 3.48Å; S253-T257 VanDerWaalsContact O-N 3.16Å; S253-T257 PolarHBondContact O-OG1 3.4Å
254L82.6Confident81.7Confident52 Ų5251 Ų5127%0.27228%0.277SS..Hα-helixtrans-66.8-41.7178-66.1172.5000113I186 I250 L251 Y252 R256 T257 T259 F260I186-L254 HydrophobicContact CD1-CD2 4.25Å; I250-L254 HydrophobicContact CG2-CD1 4.24Å; I250-L254 WeakPolarHBondContact O-CG 3.32Å; I250-L254 PolarHBondContact O-N 3.1Å; L251-L254 PolarHBondContact O-N 3.22Å; Y252-L254 PolarHBondContact O-N 3.07Å; L254-R256 VanDerWaalsContact C-N 3.28Å; L254-R256 PolarHBondContact O-N 2.78Å; L254-T257 PolarHBondContact O-N 2.92Å; L254-T257 PolarHBondContact O-OG1 3.19Å; L254-T259 PolarHBondContact O-N 2.88Å; L254-T259 PolarHBondContact O-OG1 3.34Å; L254-F260 HydrophobicContact CB-CD2 4.17Å; L254-F260 HydrophobicContact CB-CE2 3.6Å; L254-F260 HydrophobicContact CD1-CE2 4.18Å
255V81.3Confident81.3Confident8 Ų851.7 Ų51.75%0.04828%0.281CS..Hα-helixtrans-61.4-39.6174.8162.20000110.8L251 Y252 T257 Q258 F260 V266 V269L251-V255 WeakPolarHBondContact O-CB 3.05Å; L251-V255 WeakPolarHBondContact O-CG2 3.34Å; L251-V255 PolarHBondContact O-N 3.39Å; Y252-V255 PolarHBondContact O-N 2.85Å; V255-T257 VanDerWaalsContact C-N 3.34Å; V255-T257 PolarHBondContact O-N 3.43Å; V255-Q258 PolarHBondContact O-N 3.34Å; V255-F260 HydrophobicContact CG2-CD2 3.85Å; V255-V266 HydrophobicContact CG1-CB 4.16Å; V255-V266 HydrophobicContact CG1-CG1 3.84Å; V255-V266 HydrophobicContact CG1-CG2 3.88Å; V255-V269 HydrophobicContact CG2-CB 4.33Å; V255-V269 HydrophobicContact CG2-CG1 4.35Å; V255-V269 HydrophobicContact CG2-CG2 4.28Å
256R75.4Confident80.8Confident34 Ų3452.4 Ų52.413%0.12829%0.285CS..Hα-helixtrans-70.5-25.9179.4-72.4-80.3-68.3-170.82.8113.4F172 K178 Y252 S253 L254 Q258F172-R256 PolarHBondContact O-NH2 3.49Å; K178-R256 VanDerWaalsContact CE-O 3.27Å; K178-R256 WeakPolarHBondContact CE-O 3.5Å; Y252-R256 HydrophobicContact CD1-CG 4.03Å; Y252-R256 HydrophobicContact CE1-CG 3.71Å; Y252-R256 HydrophobicContact CE2-CG 4.49Å; Y252-R256 WeakPolarHBondContact O-CB 3.48Å; Y252-R256 WeakPolarHBondContact O-CG 3.3Å; Y252-R256 PolarHBondContact O-N 3.17Å; S253-R256 PolarHBondContact O-N 2.95Å; L254-R256 VanDerWaalsContact C-N 3.28Å; L254-R256 PolarHBondContact O-N 2.78Å; R256-Q258 PolarHBondContact O-N 2.92Å
257T73.1Confident80.5Confident40 Ų4053.3 Ų53.325%0.24529%0.292CS..THydrogen-bonded Turntrans-819.6173.154.70000113.5S253 L254 V255 T259S253-T257 PolarHBondContact O-N 3.48Å; S253-T257 VanDerWaalsContact O-N 3.16Å; S253-T257 PolarHBondContact O-OG1 3.4Å; L254-T257 PolarHBondContact O-N 2.92Å; L254-T257 PolarHBondContact O-OG1 3.19Å; V255-T257 VanDerWaalsContact C-N 3.34Å; V255-T257 PolarHBondContact O-N 3.43Å; T257-T259 PolarHBondContact O-N 3.27Å; T257-T259 WeakPolarHBondContact OG1-CG2 3.27Å
258Q68.4Low80.3Confident145 Ų14552.2 Ų52.268%0.67830%0.295SS*.THydrogen-bonded Turntrans58.124.3-179.5-67.4-178.9-37.900114.1V255 R256 F260V255-Q258 PolarHBondContact O-N 3.34Å; R256-Q258 PolarHBondContact O-N 2.92Å; Q258-F260 PolarHBondContact O-N 3.46Å
259T62.6Low80.2Confident82 Ų8252 Ų5250%0.50329%0.294SS..  trans-71.3-20175.1570000113L254 T257L254-T259 PolarHBondContact O-N 2.88Å; L254-T259 PolarHBondContact O-OG1 3.34Å; T257-T259 PolarHBondContact O-N 3.27Å; T257-T259 WeakPolarHBondContact OG1-CG2 3.27Å
260F61.6Low80.1Confident81 Ų8154 Ų5436%0.35530%0.301SS..  trans-113.2130178.9-65-69.8000111.9L254 V255 Q258L254-F260 HydrophobicContact CB-CD2 4.17Å; L254-F260 HydrophobicContact CB-CE2 3.6Å; L254-F260 HydrophobicContact CD1-CE2 4.18Å; V255-F260 HydrophobicContact CG2-CD2 3.85Å; Q258-F260 PolarHBondContact O-N 3.46Å
261V65.8Low80.1Confident134 Ų13455.1 Ų55.181%0.81231%0.309SS*.  trans-95.5-14.4179.9-166.70000112.3C263V261-C263 PolarHBondContact O-N 3.33Å
262N82.2Confident80.3Confident108 Ų10856 Ų5658%0.57831%0.313SS*.  trans-80.6107.5-173.3-69.3-41.1000112.7S264 V265 V266N262-S264 PolarHBondContact O-N 2.73Å; N262-S264 VanDerWaalsContact O-N 3.15Å; N262-V265 HydrophobicContact CB-CB 4.33Å; N262-V265 HydrophobicContact CB-CG2 3.98Å; N262-V265 PolarHBondContact O-N 2.91Å; N262-V266 PolarHBondContact O-N 3.43Å
263C83.1Confident80.6Confident25 Ų2556.1 Ų56.117%0.16931%0.313CS..Hα-helixtrans-56.8-31.6180-77.50000114.5V2 C9 V261 V265 V266 A267V2-C263 HydrophobicContact CG1-CB 4.37Å; C9-C263 HydrophobicContact CB-CB 3.77Å; C9-C263 WeakPolarHBondContact CB-SG 3.35Å; C9-C263 WeakPolarHBondContact SG-CA 3.37Å; C9-C263 WeakPolarHBondContact SG-CB 3.27Å; C9-C263 CovalentContact SG-SG 2.05Å; C9-C263 PolarHBondContact SG-SG 2.89Å; V261-C263 PolarHBondContact O-N 3.33Å; C263-V265 VanDerWaalsContact C-N 3.34Å; C263-V265 PolarHBondContact O-N 3.01Å; C263-V266 PolarHBondContact O-N 2.96Å; C263-A267 WeakPolarHBondContact O-CB 3.38Å; C263-A267 PolarHBondContact O-N 2.92Å
264S84.4Confident81Confident87 Ų8756.3 Ų56.361%0.60832%0.315SS*.Hα-helixtrans-63.4-39.8176.2-530000112.4N262 A268N262-S264 PolarHBondContact O-N 2.73Å; N262-S264 VanDerWaalsContact O-N 3.15Å; S264-A268 VanDerWaalsContact O-CB 3.31Å; S264-A268 WeakPolarHBondContact O-CB 3.19Å; S264-A268 PolarHBondContact O-N 3.04Å
265V85.4Confident81.6Confident58 Ų5856.8 Ų56.835%0.35232%0.317SS..Hα-helixtrans-69.4-43.4177178.40000110.1N262 C263 A267 A268 V269N262-V265 HydrophobicContact CB-CB 4.33Å; N262-V265 HydrophobicContact CB-CG2 3.98Å; N262-V265 PolarHBondContact O-N 2.91Å; C263-V265 VanDerWaalsContact C-N 3.34Å; C263-V265 PolarHBondContact O-N 3.01Å; V265-A267 PolarHBondContact O-N 3.27Å; V265-A268 PolarHBondContact O-N 2.81Å; V265-V269 HydrophobicContact CG1-CG2 4.27Å; V265-V269 WeakPolarHBondContact O-CB 3.14Å; V265-V269 VanDerWaalsContact O-CG2 3.31Å; V265-V269 WeakPolarHBondContact O-CG2 3.37Å; V265-V269 PolarHBondContact O-N 2.03Å
266V84.3Confident82.3Confident15 Ų1556.6 Ų56.69%0.09132%0.315CS..Hα-helixtrans-58.1-49.8176.3178.40000110.8C9 V255 N262 C263 V269 R270C9-V266 HydrophobicContact CB-CG1 4.48Å; V255-V266 HydrophobicContact CG1-CB 4.16Å; V255-V266 HydrophobicContact CG1-CG1 3.84Å; V255-V266 HydrophobicContact CG1-CG2 3.88Å; N262-V266 PolarHBondContact O-N 3.43Å; C263-V266 PolarHBondContact O-N 2.96Å; V266-V269 PolarHBondContact O-N 3.18Å; V266-R270 WeakPolarHBondContact O-CB 3.29Å; V266-R270 WeakPolarHBondContact O-CG 3.1Å; V266-R270 PolarHBondContact O-N 3.02Å
267A85.7Confident83.2Confident19 Ų1955.4 Ų55.416%0.15731%0.312CS..Hα-helixtrans-62.2-43.9179.100000111.7C263 V265 T271C263-A267 WeakPolarHBondContact O-CB 3.38Å; C263-A267 PolarHBondContact O-N 2.92Å; V265-A267 PolarHBondContact O-N 3.27Å; A267-T271 VanDerWaalsContact O-CB 3.25Å; A267-T271 WeakPolarHBondContact O-CB 3.33Å; A267-T271 PolarHBondContact O-N 3.38Å; A267-T271 PolarHBondContact O-OG1 2.87Å
268A88.9Confident84.3Confident53 Ų5353.7 Ų53.744%0.43830%0.301SS..Hα-helixtrans-61.5-49.8178.300000112.1S264 V265 R270 T271 M272S264-A268 VanDerWaalsContact O-CB 3.31Å; S264-A268 WeakPolarHBondContact O-CB 3.19Å; S264-A268 PolarHBondContact O-N 3.04Å; V265-A268 PolarHBondContact O-N 2.81Å; A268-R270 PolarHBondContact O-N 2.77Å; A268-T271 PolarHBondContact O-N 2.9Å; A268-M272 WeakPolarHBondContact O-CB 3.38Å; A268-M272 VanDerWaalsContact O-CG 3.27Å; A268-M272 WeakPolarHBondContact O-CG 3.29Å; A268-M272 PolarHBondContact O-N 3.3Å
269V88.5Confident85.6Confident8 Ų848.8 Ų48.85%0.04828%0.279CS..Hα-helixtrans-64.1-41.9-178.4171.50000111.7N248 L251 Y252 V255 V265 V266 Y273N248-V269 PolarHBondContact ND2-O 3.38Å; N248-V269 VanDerWaalsContact ND2-O 3.08Å; L251-V269 HydrophobicContact CB-CG1 4.08Å; L251-V269 HydrophobicContact CB-CG2 3.96Å; L251-V269 HydrophobicContact CD1-CG2 4.46Å; Y252-V269 VanDerWaalsContact CA-CG1 3.48Å; Y252-V269 HydrophobicContact CD2-CG1 4.2Å; V255-V269 HydrophobicContact CG2-CB 4.33Å; V255-V269 HydrophobicContact CG2-CG1 4.35Å; V255-V269 HydrophobicContact CG2-CG2 4.28Å; V265-V269 HydrophobicContact CG1-CG2 4.27Å; V265-V269 WeakPolarHBondContact O-CB 3.14Å; V265-V269 VanDerWaalsContact O-CG2 3.31Å; V265-V269 WeakPolarHBondContact O-CG2 3.37Å; V265-V269 PolarHBondContact O-N 2.03Å; V266-V269 PolarHBondContact O-N 3.18Å; V269-Y273 WeakPolarHBondContact O-CB 3.39Å; V269-Y273 PolarHBondContact O-N 2.73Å; V269-Y273 VanDerWaalsContact O-N 3.14Å
270R86.1Confident87.2Confident47 Ų4745.1 Ų45.118%0.17726%0.257CS..Hα-helixtrans-66.9-39.4176.4-68.1-165.8-175.6-152.73.6112Y11 Y252 V266 A268 Y273 P274Y11-R270 HydrophobicContact CD2-CB 3.84Å; Y11-R270 HydrophobicContact CD2-CG 4.43Å; Y11-R270 HydrophobicContact CE2-CB 3.95Å; Y11-R270 HydrophobicContact CE2-CG 4.21Å; Y11-R270 PolarHBondContact OH-NH1 3.3Å; Y252-R270 HydrophobicContact CD2-CG 4.4Å; Y252-R270 HydrophobicContact CE2-CG 4.06Å; V266-R270 WeakPolarHBondContact O-CB 3.29Å; V266-R270 WeakPolarHBondContact O-CG 3.1Å; V266-R270 PolarHBondContact O-N 3.02Å; A268-R270 PolarHBondContact O-N 2.77Å; R270-Y273 PolarHBondContact O-N 3.26Å; R270-P274 WeakPolarHBondContact O-CD 3.26Å
271T89.1Confident88.7Confident53 Ų5341.5 Ų41.533%0.32524%0.242SC..Hα-helixtrans-69.5-39.3177.1-55.20000112.1F15 A267 A268 Y273 P274F15-T271 HydrophobicContact CE1-CG2 4.11Å; F15-T271 HydrophobicContact CZ-CG2 3.99Å; F15-T271 WeakPolarHBondContact CZ-O 3.04Å; A267-T271 VanDerWaalsContact O-CB 3.25Å; A267-T271 WeakPolarHBondContact O-CB 3.33Å; A267-T271 PolarHBondContact O-N 3.38Å; A267-T271 PolarHBondContact O-OG1 2.87Å; A268-T271 PolarHBondContact O-N 2.9Å; T271-Y273 VanDerWaalsContact C-N 3.29Å; T271-Y273 PolarHBondContact O-N 2.88Å; T271-P274 WeakPolarHBondContact O-CD 3.5Å
272M91.4Very high90.1Very high84 Ų8435.8 Ų35.841%0.41421%0.208SC..Hα-helixtrans-71.4-25.3179.6-73.8-60.7-67.500112.5A268 I275 T276A268-M272 WeakPolarHBondContact O-CB 3.38Å; A268-M272 VanDerWaalsContact O-CG 3.27Å; A268-M272 WeakPolarHBondContact O-CG 3.29Å; A268-M272 PolarHBondContact O-N 3.3Å; M272-I275 WeakPolarHBondContact O-CB 3.27Å; M272-I275 PolarHBondContact O-N 3.01Å; M272-I275 VanDerWaalsContact O-N 3.15Å; M272-I275 HydrophobicContact SD-CD1 4.27Å; M272-T276 HydrophobicContact CE-CG2 4.02Å; M272-T276 WeakPolarHBondContact O-CG2 3.23Å; M272-T276 PolarHBondContact O-N 2.67Å; M272-T276 PolarHBondContact O-OG1 3.34Å; M272-T276 VanDerWaalsContact O-OG1 3.13Å
273Y90.4Very high90.7Very high46 Ų4630.7 Ų30.718%0.1818%0.181CC..Hα-helixtrans-58.6-51.6-174.5179.3-91.6000113.9Y245 N248 L249 Y252 V269 R270 T271 I275 T276 L277Y245-Y273 HydrophobicContact CE2-CD2 4.41Å; Y245-Y273 AromaticContact CE2-CE2 3.79Å; Y245-Y273 HydrophobicContact CE2-CE2 3.79Å; Y245-Y273 PolarHBondContact OH-OH 2.97Å; N248-Y273 WeakPolarHBondContact ND2-CA 3.19Å; N248-Y273 WeakPolarHBondContact ND2-CB 3.47Å; N248-Y273 PolarHBondContact ND2-N 3.05Å; L249-Y273 HydrophobicContact CD1-CE2 4Å; Y252-Y273 HydrophobicContact CD2-CD2 4.5Å; Y252-Y273 HydrophobicContact CG-CD2 4.38Å; V269-Y273 WeakPolarHBondContact O-CB 3.39Å; V269-Y273 PolarHBondContact O-N 2.73Å; V269-Y273 VanDerWaalsContact O-N 3.14Å; R270-Y273 PolarHBondContact O-N 3.26Å; T271-Y273 VanDerWaalsContact C-N 3.29Å; T271-Y273 PolarHBondContact O-N 2.88Å; Y273-I275 VanDerWaalsContact C-N 3.27Å; Y273-I275 PolarHBondContact O-N 2.69Å; Y273-T276 PolarHBondContact O-OG1 3.42Å; Y273-L277 HydrophobicContact CE1-CD1 4.08Å; Y273-L277 VanDerWaalsContact O-CB 3.27Å; Y273-L277 WeakPolarHBondContact O-CB 3.11Å; Y273-L277 PolarHBondContact O-N 2.95Å
274P91.6Very high91.1Very high4 Ų429.5 Ų29.53%0.02617%0.173CC..Hα-helixtrans-60.2-36.1174.5-25.234.5000114F15 K16 L19 Y20 R270 T271 C278F15-P274 HydrophobicContact CE2-CB 4.3Å; F15-P274 HydrophobicContact CZ-CB 4.36Å; F15-P274 HydrophobicContact CZ-CG 4.13Å; K16-P274 HydrophobicContact CB-CB 4.04Å; K16-P274 HydrophobicContact CB-CG 3.86Å; L19-P274 HydrophobicContact CD2-CB 4.05Å; Y20-P274 HydrophobicContact CE1-CB 3.85Å; Y20-P274 HydrophobicContact CE2-CB 4.5Å; Y20-P274 VanDerWaalsContact OH-CA 3.3Å; Y20-P274 WeakPolarHBondContact OH-CA 3.4Å; Y20-P274 WeakPolarHBondContact OH-CB 3.38Å; R270-P274 WeakPolarHBondContact O-CD 3.26Å; T271-P274 WeakPolarHBondContact O-CD 3.5Å; P274-C278 PolarHBondContact O-N 3.28Å; P274-C278 VanDerWaalsContact O-N 3.07Å; P274-C278 PolarHBondContact O-SG 3.2Å
275I94.5Very high91.5Very high62 Ų6226.7 Ų26.732%0.31815%0.152SC..Hα-helixtrans-67.9-52-178-59.5172.7000109.9F15 L19 M272 Y273 L277 C278 I279F15-I275 HydrophobicContact CE2-CG1 4.25Å; L19-I275 HydrophobicContact CD2-CG1 4.12Å; M272-I275 WeakPolarHBondContact O-CB 3.27Å; M272-I275 PolarHBondContact O-N 3.01Å; M272-I275 VanDerWaalsContact O-N 3.15Å; M272-I275 HydrophobicContact SD-CD1 4.27Å; Y273-I275 VanDerWaalsContact C-N 3.27Å; Y273-I275 PolarHBondContact O-N 2.69Å; I275-L277 VanDerWaalsContact C-N 3.29Å; I275-L277 PolarHBondContact O-N 3.09Å; I275-C278 PolarHBondContact O-N 2.98Å; I275-I279 HydrophobicContact CG2-CD1 4.28Å; I275-I279 WeakPolarHBondContact O-CG1 3.49Å; I275-I279 PolarHBondContact O-N 3.25Å; I275-I279 VanDerWaalsContact O-N 3.1Å
276T95.9Very high91.7Very high3 Ų327.3 Ų27.32%0.01815%0.151CC..Hα-helixtrans-68-31.5-179.660.20000111.9P244 N248 M272 Y273 I279 A280P244-T276 HydrophobicContact CB-CG2 3.62Å; N248-T276 HydrophobicContact CB-CG2 4.45Å; M272-T276 HydrophobicContact CE-CG2 4.02Å; M272-T276 WeakPolarHBondContact O-CG2 3.23Å; M272-T276 PolarHBondContact O-N 2.67Å; M272-T276 PolarHBondContact O-OG1 3.34Å; M272-T276 VanDerWaalsContact O-OG1 3.13Å; Y273-T276 PolarHBondContact O-OG1 3.42Å; T276-I279 PolarHBondContact O-N 3.41Å; T276-A280 PolarHBondContact O-N 3.01Å
277L94.2Very high91.8Very high10 Ų1026.6 Ų26.65%0.05215%0.146CC..Hα-helixtrans-61.9-45.7171.6-172152.4000111.5Y20 F24 F96 Y245 Y273 I275 I279 A280 V281Y20-L277 HydrophobicContact CE1-CD2 3.84Å; F24-L277 HydrophobicContact CE1-CD2 3.92Å; F24-L277 HydrophobicContact CZ-CD2 3.78Å; F96-L277 HydrophobicContact CE2-CD1 4.49Å; F96-L277 HydrophobicContact CE2-CD2 4.37Å; F96-L277 HydrophobicContact CE2-CG 4.29Å; F96-L277 HydrophobicContact CZ-CD1 3.99Å; F96-L277 HydrophobicContact CZ-CG 4.09Å; Y245-L277 HydrophobicContact CD2-CB 3.87Å; Y245-L277 HydrophobicContact CD2-CG 4.44Å; Y245-L277 HydrophobicContact CE2-CB 3.76Å; Y245-L277 HydrophobicContact CE2-CD1 3.96Å; Y245-L277 HydrophobicContact CE2-CG 3.96Å; Y273-L277 HydrophobicContact CE1-CD1 4.08Å; Y273-L277 VanDerWaalsContact O-CB 3.27Å; Y273-L277 WeakPolarHBondContact O-CB 3.11Å; Y273-L277 PolarHBondContact O-N 2.95Å; I275-L277 VanDerWaalsContact C-N 3.29Å; I275-L277 PolarHBondContact O-N 3.09Å; L277-I279 VanDerWaalsContact C-N 3.28Å; L277-I279 PolarHBondContact O-N 2.82Å; L277-A280 PolarHBondContact O-N 3.47Å; L277-V281 HydrophobicContact CD2-CG2 3.87Å; L277-V281 WeakPolarHBondContact O-CB 3.5Å; L277-V281 WeakPolarHBondContact O-CG2 3.4Å; L277-V281 PolarHBondContact O-N 3.29Å
278C95.8Very high91.5Very high4 Ų427.5 Ų27.53%0.02715%0.151CC..Hα-helixtrans-61.9-38176.6-68.60000112.2Y20 M23 P274 I275 S282Y20-C278 VanDerWaalsContact CD1-SG 3.54Å; M23-C278 HydrophobicContact CB-CB 4.11Å; M23-C278 HydrophobicContact CE-CB 4.15Å; M23-C278 HydrophobicContact CG-CB 3.97Å; P274-C278 PolarHBondContact O-N 3.28Å; P274-C278 VanDerWaalsContact O-N 3.07Å; P274-C278 PolarHBondContact O-SG 3.2Å; I275-C278 PolarHBondContact O-N 2.98Å; C278-S282 PolarHBondContact O-N 3.22Å; C278-S282 VanDerWaalsContact O-N 3.08Å; C278-S282 PolarHBondContact O-OG 3.15Å
279I96.3Very high91.2Very high42 Ų4227.9 Ų27.922%0.21515%0.147CC..Hα-helixtrans-62.5-45.4174.6-68.6168.8000110.6F240 I275 T276 L277 S282F240-I279 HydrophobicContact CD1-CG2 4.14Å; F240-I279 HydrophobicContact CE1-CG2 3.89Å; F240-I279 HydrophobicContact CZ-CG2 4.1Å; F240-I279 WeakPolarHBondContact O-CG2 3.12Å; I275-I279 HydrophobicContact CG2-CD1 4.28Å; I275-I279 WeakPolarHBondContact O-CG1 3.49Å; I275-I279 PolarHBondContact O-N 3.25Å; I275-I279 VanDerWaalsContact O-N 3.1Å; T276-I279 PolarHBondContact O-N 3.41Å; L277-I279 VanDerWaalsContact C-N 3.28Å; L277-I279 PolarHBondContact O-N 2.82Å; I279-S282 WeakPolarHBondContact O-CB 3.47Å; I279-S282 PolarHBondContact O-N 3.31Å
280A95.5Very high90.7Very high5 Ų527.5 Ų27.54%0.04115%0.145CC..Hα-helixtrans-63.3-45.4177.700000112.7C241 Y245 T276 L277 S282 N283C241-A280 WeakPolarHBondContact O-CA 3.5Å; C241-A280 WeakPolarHBondContact O-CB 3.44Å; C241-A280 PolarHBondContact O-N 3.43Å; Y245-A280 HydrophobicContact CD1-CB 4.44Å; Y245-A280 HydrophobicContact CG-CB 4.05Å; T276-A280 PolarHBondContact O-N 3.01Å; L277-A280 PolarHBondContact O-N 3.47Å; A280-S282 PolarHBondContact O-N 3.33Å; A280-N283 VanDerWaalsContact O-CB 3.23Å; A280-N283 WeakPolarHBondContact O-CB 3.3Å; A280-N283 PolarHBondContact O-N 3.32Å
281V94.2Very high90.4Very high4 Ų425.5 Ų25.52%0.02414%0.137CC..Hα-helixtrans-62.6-26.4177.4164.70000112.2F24 V27 F66 F96 L277 N283F24-V281 HydrophobicContact CD1-CG1 3.94Å; F24-V281 HydrophobicContact CE1-CB 4.38Å; F24-V281 HydrophobicContact CE1-CG1 3.97Å; F24-V281 HydrophobicContact CE1-CG2 4.18Å; V27-V281 HydrophobicContact CB-CG1 4.25Å; V27-V281 HydrophobicContact CG1-CG1 3.87Å; V27-V281 WeakPolarHBondContact CG1-O 3.44Å; V27-V281 HydrophobicContact CG2-CG1 4.15Å; F66-V281 HydrophobicContact CE1-CB 4.36Å; F66-V281 HydrophobicContact CE1-CG1 3.73Å; F66-V281 HydrophobicContact CE1-CG2 4.19Å; F66-V281 HydrophobicContact CZ-CB 4.31Å; F66-V281 HydrophobicContact CZ-CG1 3.74Å; F66-V281 HydrophobicContact CZ-CG2 3.75Å; F96-V281 HydrophobicContact CD2-CG2 4.24Å; F96-V281 HydrophobicContact CE2-CG2 3.66Å; L277-V281 HydrophobicContact CD2-CG2 3.87Å; L277-V281 WeakPolarHBondContact O-CB 3.5Å; L277-V281 WeakPolarHBondContact O-CG2 3.4Å; L277-V281 PolarHBondContact O-N 3.29Å; V281-N283 PolarHBondContact O-N 3.07Å
282S94.9Very high90Very high15 Ų1527 Ų2711%0.10514%0.138CC..THydrogen-bonded Turntrans-69.1-9.3175.8-58.20000113.4C278 I279 A280 C284 C285 F286C278-S282 PolarHBondContact O-N 3.22Å; C278-S282 VanDerWaalsContact O-N 3.08Å; C278-S282 PolarHBondContact O-OG 3.15Å; I279-S282 WeakPolarHBondContact O-CB 3.47Å; I279-S282 PolarHBondContact O-N 3.31Å; A280-S282 PolarHBondContact O-N 3.33Å; S282-C284 PolarHBondContact O-N 2.98Å; S282-C285 WeakPolarHBondContact O-CB 3.44Å; S282-C285 PolarHBondContact O-N 2.86Å; S282-F286 WeakPolarHBondContact O-CD2 3.43Å
283N93.8Very high89.2Confident1 Ų125.4 Ų25.41%0.00513%0.128CC..Hα-helixtrans-50.4-43.9175.2-175.975.4000112.1C241 F242 A280 V281 C285 F286 D287C241-N283 HydrophobicContact CB-CB 4.04Å; F242-N283 HydrophobicContact CE1-CB 4.25Å; F242-N283 HydrophobicContact CZ-CB 3.84Å; F242-N283 WeakPolarHBondContact CZ-OD1 3.44Å; A280-N283 VanDerWaalsContact O-CB 3.23Å; A280-N283 WeakPolarHBondContact O-CB 3.3Å; A280-N283 PolarHBondContact O-N 3.32Å; V281-N283 PolarHBondContact O-N 3.07Å; N283-C285 PolarHBondContact O-N 3.16Å; N283-F286 WeakPolarHBondContact O-CA 3.38Å; N283-F286 PolarHBondContact O-N 3.41Å; N283-D287 PolarHBondContact ND2-OD1 2.69Å; N283-D287 PolarHBondContact ND2-OD2 2.97Å; N283-D287 PolarHBondContact O-N 3Å; N283-D287 VanDerWaalsContact O-N 3.1Å
284C92.6Very high88.3Confident0 Ų023.2 Ų23.20%012%0.12CC..Hα-helixtrans-56.6-23.9-179.9-54.70000113.5V27 N35 D63 V67 S282 D287V27-C284 HydrophobicContact CG1-CB 4.43Å; N35-C284 PolarHBondContact ND2-O 3.43Å; D63-C284 HydrophobicContact CB-CB 4.09Å; D63-C284 PolarHBondContact OD1-SG 2.9Å; V67-C284 HydrophobicContact CG2-CB 4.32Å; S282-C284 PolarHBondContact O-N 2.98Å; C284-D287 WeakPolarHBondContact CA-OD2 3.48Å
285C92.6Very high87.3Confident27 Ų2723.6 Ų23.618%0.18212%0.123CC..Hα-helixtrans-85.8-22.6177.2-58.70000112.7L30 S282 N283 P288L30-C285 HydrophobicContact CB-CB 4.42Å; S282-C285 WeakPolarHBondContact O-CB 3.44Å; S282-C285 PolarHBondContact O-N 2.86Å; N283-C285 PolarHBondContact O-N 3.16Å; C285-P288 WeakPolarHBondContact O-CD 3.21Å
286F89.9Confident85.8Confident72 Ų7224.5 Ų24.532%0.31613%0.128SC..Hα-helixtrans-94.4-21.2-177.9-62.2-57.3000113.3I237 F240 S282 N283 P288 V289 V290I237-F286 HydrophobicContact CD1-CB 3.97Å; I237-F286 HydrophobicContact CG1-CB 4.14Å; I237-F286 HydrophobicContact CG2-CB 3.75Å; I237-F286 HydrophobicContact CG2-CG 4.5Å; F240-F286 HydrophobicContact CD1-CE2 4.31Å; F240-F286 HydrophobicContact CE1-CE2 4.1Å; F240-F286 HydrophobicContact CE1-CZ 4.35Å; S282-F286 WeakPolarHBondContact O-CD2 3.43Å; N283-F286 WeakPolarHBondContact O-CA 3.38Å; N283-F286 PolarHBondContact O-N 3.41Å; F286-P288 VanDerWaalsContact C-N 3.33Å; F286-V289 WeakPolarHBondContact O-CA 3.3Å; F286-V289 WeakPolarHBondContact O-CB 3.46Å; F286-V289 PolarHBondContact O-N 2.75Å; F286-V290 PolarHBondContact O-N 3.39Å
287D85.8Confident83.9Confident0 Ų027.9 Ų27.90%015%0.149CC..Hα-helixtrans-54.7-34.5176.6-64.6-49000115.3D63 N283 C284 V289 V290 Y291D63-D287 VanDerWaalsContact OD2-OD2 3.06Å; N283-D287 PolarHBondContact ND2-OD1 2.69Å; N283-D287 PolarHBondContact ND2-OD2 2.97Å; N283-D287 PolarHBondContact O-N 3Å; N283-D287 VanDerWaalsContact O-N 3.1Å; C284-D287 WeakPolarHBondContact CA-OD2 3.48Å; D287-V289 PolarHBondContact O-N 3.07Å; D287-V290 CarbonylContact O-C 3.59Å; D287-V290 WeakPolarHBondContact O-CA 3.17Å; D287-V290 VanDerWaalsContact O-CB 3.22Å; D287-V290 WeakPolarHBondContact O-CB 3.18Å; D287-V290 PolarHBondContact O-N 3.13Å; D287-V290 VanDerWaalsContact O-N 3.08Å; D287-Y291 HydrophobicContact CB-CE1 4.35Å; D287-Y291 HydrophobicContact CB-CE2 3.97Å; D287-Y291 WeakPolarHBondContact O-CD1 3.48Å; D287-Y291 VanDerWaalsContact O-CD2 3.28Å; D287-Y291 WeakPolarHBondContact O-CD2 3.32Å; D287-Y291 PolarHBondContact O-N 2.72Å
288P80.7Confident82.2Confident38 Ų3827.9 Ų27.925%0.24715%0.149CC..Hα-helixtrans-58.3-34.3171.2-2331.6000114.1S34 C285 F286 Y291 Y292S34-P288 VanDerWaalsContact OG-CG 3.28Å; S34-P288 WeakPolarHBondContact OG-CG 3.36Å; C285-P288 WeakPolarHBondContact O-CD 3.21Å; F286-P288 VanDerWaalsContact C-N 3.33Å; P288-Y291 PolarHBondContact O-N 2.89Å; P288-Y292 WeakPolarHBondContact O-CB 3.48Å; P288-Y292 PolarHBondContact O-N 2.8Å
289V80.8Confident80.6Confident60 Ų6028.7 Ų28.736%0.36415%0.152SC..Hα-helixtrans-66.6-44.2175.6-172.60000109.1V233 I237 F286 D287 Y291 Y292 F293V233-V289 HydrophobicContact CG1-CG1 3.91Å; I237-V289 HydrophobicContact CD1-CB 4.37Å; F286-V289 WeakPolarHBondContact O-CA 3.3Å; F286-V289 WeakPolarHBondContact O-CB 3.46Å; F286-V289 PolarHBondContact O-N 2.75Å; D287-V289 PolarHBondContact O-N 3.07Å; V289-Y291 PolarHBondContact O-N 3.5Å; V289-Y292 PolarHBondContact O-N 3.05Å; V289-F293 HydrophobicContact CG1-CD2 3.8Å; V289-F293 HydrophobicContact CG1-CE2 3.66Å; V289-F293 WeakPolarHBondContact O-CD2 3.47Å; V289-F293 PolarHBondContact O-N 3.35Å; V289-F293 VanDerWaalsContact O-N 3.08Å
290V78.3Confident79Confident1 Ų131 Ų311%0.00617%0.165CC..Hα-helixtrans-56.4-48.2172154.70000111.2L107 H234 I237 F286 D287 Y292 F293 T294L107-V290 HydrophobicContact CD2-CG1 4.11Å; L107-V290 HydrophobicContact CD2-CG2 4.41Å; H234-V290 WeakPolarHBondContact CD2-CG1 3.35Å; H234-V290 VanDerWaalsContact CD2-CG2 3.48Å; H234-V290 WeakPolarHBondContact CD2-CG2 3.19Å; H234-V290 WeakPolarHBondContact NE2-CG1 3.38Å; I237-V290 HydrophobicContact CD1-CG2 3.73Å; F286-V290 PolarHBondContact O-N 3.39Å; D287-V290 CarbonylContact O-C 3.59Å; D287-V290 WeakPolarHBondContact O-CA 3.17Å; D287-V290 VanDerWaalsContact O-CB 3.22Å; D287-V290 WeakPolarHBondContact O-CB 3.18Å; D287-V290 PolarHBondContact O-N 3.13Å; D287-V290 VanDerWaalsContact O-N 3.08Å; V290-Y292 PolarHBondContact O-N 3.49Å; V290-F293 PolarHBondContact O-N 2.9Å; V290-T294 WeakPolarHBondContact O-CB 3.45Å; V290-T294 PolarHBondContact O-N 3.49Å; V290-T294 VanDerWaalsContact O-N 3.09Å; V290-T294 PolarHBondContact O-OG1 3.32Å
291Y81.1Confident77.3Confident4 Ų432.8 Ų32.82%0.01618%0.177CC..Hα-helixtrans-60.4-44.5178.9-57.2-28.7000112.2A38 F42 M56 L59 A60 D287 P288 V289 T294 S295A38-Y291 HydrophobicContact CB-CD2 3.58Å; A38-Y291 HydrophobicContact CB-CE2 3.67Å; F42-Y291 HydrophobicContact CE2-CD1 4.11Å; F42-Y291 AromaticContact CE2-CD2 3.94Å; F42-Y291 HydrophobicContact CE2-CD2 3.94Å; F42-Y291 HydrophobicContact CE2-CE1 4.28Å; F42-Y291 HydrophobicContact CE2-CE2 4.16Å; F42-Y291 AromaticContact CE2-CG 3.96Å; F42-Y291 HydrophobicContact CE2-CG 3.96Å; F42-Y291 AromaticContact CZ-CD1 3.75Å; F42-Y291 HydrophobicContact CZ-CD1 3.75Å; F42-Y291 AromaticContact CZ-CD2 3.96Å; F42-Y291 HydrophobicContact CZ-CD2 3.96Å; F42-Y291 HydrophobicContact CZ-CE1 4.34Å; F42-Y291 AromaticContact CZ-CG 3.55Å; F42-Y291 HydrophobicContact CZ-CG 3.55Å; M56-Y291 HydrophobicContact CB-CD1 3.93Å; M56-Y291 HydrophobicContact CB-CE1 3.79Å; M56-Y291 HydrophobicContact CG-CD1 3.73Å; M56-Y291 HydrophobicContact CG-CE1 3.92Å; M56-Y291 HydrophobicContact SD-CD1 3.99Å; L59-Y291 HydrophobicContact CD2-CE1 4.04Å; L59-Y291 WeakPolarHBondContact CG-OH 3.23Å; A60-Y291 WeakPolarHBondContact CA-OH 3.41Å; A60-Y291 HydrophobicContact CB-CE2 4.28Å; A60-Y291 WeakPolarHBondContact CB-OH 3.33Å; A60-Y291 PolarHBondContact N-OH 3.05Å; A60-Y291 VanDerWaalsContact N-OH 3.15Å; D287-Y291 HydrophobicContact CB-CE1 4.35Å; D287-Y291 HydrophobicContact CB-CE2 3.97Å; D287-Y291 WeakPolarHBondContact O-CD1 3.48Å; D287-Y291 VanDerWaalsContact O-CD2 3.28Å; D287-Y291 WeakPolarHBondContact O-CD2 3.32Å; D287-Y291 PolarHBondContact O-N 2.72Å; P288-Y291 PolarHBondContact O-N 2.89Å; V289-Y291 PolarHBondContact O-N 3.5Å; Y291-T294 PolarHBondContact O-N 2.5Å; Y291-S295 WeakPolarHBondContact O-CB 3.38Å; Y291-S295 PolarHBondContact O-N 3.07Å
292Y78.9Confident75.8Confident85 Ų8535.9 Ų35.933%0.33319%0.193SC..Hα-helixtrans-61.4-46.6179.1176-98.5000112.6P288 V289 V290 T294 I298 Q299 I302P288-Y292 WeakPolarHBondContact O-CB 3.48Å; P288-Y292 PolarHBondContact O-N 2.8Å; V289-Y292 PolarHBondContact O-N 3.05Å; V290-Y292 PolarHBondContact O-N 3.49Å; Y292-T294 VanDerWaalsContact C-N 3.26Å; Y292-T294 PolarHBondContact O-N 3.21Å; Y292-I298 HydrophobicContact CD2-CG2 4.2Å; Y292-Q299 HydrophobicContact CD2-CG 4.1Å; Y292-Q299 HydrophobicContact CE1-CG 4.39Å; Y292-Q299 HydrophobicContact CE2-CB 4.38Å; Y292-Q299 HydrophobicContact CE2-CG 3.76Å; Y292-Q299 VanDerWaalsContact O-CG 3.28Å; Y292-Q299 WeakPolarHBondContact O-CG 3.4Å; Y292-Q299 PolarHBondContact O-NE2 3.43Å; Y292-I302 HydrophobicContact CD2-CD1 3.84Å; Y292-I302 HydrophobicContact CE2-CD1 4.05Å
293F76.6Confident74.1Confident50 Ų5040.9 Ų40.922%0.21921%0.213CC..Hα-helixtrans-73.7-21.6-178.9-76.2-70.5000113.3K229 M230 V233 V289 V290K229-F293 HydrophobicContact CB-CD1 4.22Å; K229-F293 HydrophobicContact CB-CE1 4.42Å; K229-F293 HydrophobicContact CD-CE1 4.46Å; M230-F293 HydrophobicContact CB-CB 4.2Å; M230-F293 HydrophobicContact CG-CB 4.44Å; V233-F293 HydrophobicContact CB-CD2 4.29Å; V233-F293 HydrophobicContact CG1-CD2 3.99Å; V233-F293 HydrophobicContact CG2-CD2 3.88Å; V233-F293 HydrophobicContact CG2-CE2 4Å; V233-F293 HydrophobicContact CG2-CG 4.37Å; V289-F293 HydrophobicContact CG1-CD2 3.8Å; V289-F293 HydrophobicContact CG1-CE2 3.66Å; V289-F293 WeakPolarHBondContact O-CD2 3.47Å; V289-F293 PolarHBondContact O-N 3.35Å; V289-F293 VanDerWaalsContact O-N 3.08Å; V290-F293 PolarHBondContact O-N 2.9Å
294T71.5Confident72.4Confident1 Ų147.7 Ų47.71%0.00625%0.246CC..Hα-helixtrans-94-26.5-175.4-52.60000113.6T52 M56 I110 R114 M230 H234 V290 Y291 Y292T52-T294 HydrophobicContact CG2-CG2 3.76Å; M56-T294 HydrophobicContact CE-CG2 3Å; I110-T294 HydrophobicContact CG2-CG2 4.27Å; R114-T294 PolarHBondContact NH2-O 3.49Å; M230-T294 HydrophobicContact CG-CG2 4.36Å; M230-T294 WeakPolarHBondContact CG-OG1 3.19Å; M230-T294 HydrophobicContact SD-CG2 3.69Å; H234-T294 PolarHBondContact CE1-OG1 2.92Å; H234-T294 PolarHBondContact NE2-OG1 3.3Å; V290-T294 WeakPolarHBondContact O-CB 3.45Å; V290-T294 PolarHBondContact O-N 3.49Å; V290-T294 VanDerWaalsContact O-N 3.09Å; V290-T294 PolarHBondContact O-OG1 3.32Å; Y291-T294 PolarHBondContact O-N 2.5Å; Y292-T294 VanDerWaalsContact C-N 3.26Å; Y292-T294 PolarHBondContact O-N 3.21Å
295S68.8Low70.7Confident11 Ų1154.5 Ų54.58%0.07728%0.276CS..  trans-108109.2-178-175.20000113.2Y291 T297 I298 Q299Y291-S295 WeakPolarHBondContact O-CB 3.38Å; Y291-S295 PolarHBondContact O-N 3.07Å; S295-T297 PolarHBondContact O-N 3.46Å; S295-I298 PolarHBondContact O-N 2.68Å; S295-I298 PolarHBondContact OG-N 2.98Å; S295-Q299 PolarHBondContact O-N 2.93Å; S295-Q299 VanDerWaalsContact O-N 3.14Å
296D63.9Low68.9Low82 Ų8258 Ų5844%0.43929%0.293SS..Hα-helixtrans-53.9-37.5169.7-67.843.5000112.6K226 Q299 N300K226-D296 WeakPolarHBondContact CE-OD1 3.22Å; K226-D296 IonicContact NZ-OD1 2.67Å; K226-D296 PolarHBondContact NZ-OD1 3.39Å; K226-D296 IonicContact NZ-OD2 2.75Å; K226-D296 PolarHBondContact NZ-OD2 2.82Å; D296-Q299 PolarHBondContact O-N 3.04Å; D296-N300 WeakPolarHBondContact O-CB 3.23Å; D296-N300 PolarHBondContact O-N 3.17Å; D296-N300 PolarHBondContact O-ND2 3.4Å
297T56Low66.7Low73 Ų7363.3 Ų63.345%0.44831%0.311SS..Hα-helixtrans-72.7-33.6-179.1-43.40000111.8L46 S295 N300 S301L46-T297 VanDerWaalsContact CD2-CB 3.42Å; L46-T297 HydrophobicContact CD2-CG2 3.24Å; S295-T297 PolarHBondContact O-N 3.46Å; T297-N300 PolarHBondContact O-N 2.79Å; T297-S301 VanDerWaalsContact O-CB 3.27Å; T297-S301 WeakPolarHBondContact O-CB 3.47Å; T297-S301 PolarHBondContact O-N 2.97Å; T297-S301 PolarHBondContact O-OG 3.5Å
298I58.6Low65Low11 Ų1166.5 Ų66.56%0.05633%0.333CS..Hα-helixtrans-65.9-46.5172.4-68.4-177000110.1I41 F42 Y292 S295 N300 S301 I302I41-I298 HydrophobicContact CG2-CD1 4.24Å; I41-I298 HydrophobicContact CG2-CG1 3.89Å; F42-I298 HydrophobicContact CD1-CD1 4.2Å; F42-I298 HydrophobicContact CE1-CD1 3.44Å; F42-I298 VanDerWaalsContact CE1-CD1 3.44Å; F42-I298 HydrophobicContact CE1-CG1 4.49Å; F42-I298 HydrophobicContact CZ-CD1 3.99Å; Y292-I298 HydrophobicContact CD2-CG2 4.2Å; S295-I298 PolarHBondContact O-N 2.68Å; S295-I298 PolarHBondContact OG-N 2.98Å; I298-N300 VanDerWaalsContact C-N 3.29Å; I298-N300 PolarHBondContact O-N 3.42Å; I298-S301 PolarHBondContact O-N 3.45Å; I298-I302 HydrophobicContact CG2-CD1 3.68Å; I298-I302 HydrophobicContact CG2-CG1 4.38Å; I298-I302 WeakPolarHBondContact O-CG1 3.33Å; I298-I302 PolarHBondContact O-N 3.14Å
299Q63Low63.7Low21 Ų2167.6 Ų67.610%0.09834%0.339CS..Hα-helixtrans-58.1-43.5176.6-65.6179.84.300111.6K226 Y292 S295 D296 K303K226-Q299 VanDerWaalsContact NZ-CD 3.33Å; Y292-Q299 HydrophobicContact CD2-CG 4.1Å; Y292-Q299 HydrophobicContact CE1-CG 4.39Å; Y292-Q299 HydrophobicContact CE2-CB 4.38Å; Y292-Q299 HydrophobicContact CE2-CG 3.76Å; Y292-Q299 VanDerWaalsContact O-CG 3.28Å; Y292-Q299 WeakPolarHBondContact O-CG 3.4Å; Y292-Q299 PolarHBondContact O-NE2 3.43Å; S295-Q299 PolarHBondContact O-N 2.93Å; S295-Q299 VanDerWaalsContact O-N 3.14Å; D296-Q299 PolarHBondContact O-N 3.04Å; Q299-K303 WeakPolarHBondContact O-CB 3.4Å; Q299-K303 WeakPolarHBondContact O-CG 3.42Å; Q299-K303 PolarHBondContact O-N 3.13Å
300N62.2Low62.2Low90 Ų9073.8 Ų73.848%0.48136%0.356SS..Hα-helixtrans-72.1-36.3179.7-68.7-14.7000112.4D296 T297 I298 K303 M304D296-N300 WeakPolarHBondContact O-CB 3.23Å; D296-N300 PolarHBondContact O-N 3.17Å; D296-N300 PolarHBondContact O-ND2 3.4Å; T297-N300 PolarHBondContact O-N 2.79Å; I298-N300 VanDerWaalsContact C-N 3.29Å; I298-N300 PolarHBondContact O-N 3.42Å; N300-K303 PolarHBondContact O-N 3.49Å; N300-M304 VanDerWaalsContact O-CB 3.28Å; N300-M304 WeakPolarHBondContact O-CB 3.25Å; N300-M304 WeakPolarHBondContact O-CG 3.19Å; N300-M304 PolarHBondContact O-N 3.38Å
301S59.2Low60.7Low42 Ų4281.1 Ų81.129%0.29438%0.384SS..Hα-helixtrans-67-41.4176.8-57.90000111.7T297 I298 M304 K305T297-S301 VanDerWaalsContact O-CB 3.27Å; T297-S301 WeakPolarHBondContact O-CB 3.47Å; T297-S301 PolarHBondContact O-N 2.97Å; T297-S301 PolarHBondContact O-OG 3.5Å; I298-S301 PolarHBondContact O-N 3.45Å; S301-M304 PolarHBondContact O-N 3.39Å; S301-K305 WeakPolarHBondContact O-CB 2.99Å; S301-K305 PolarHBondContact O-N 2.78Å
302I61.9Low59.3Low69 Ų6984 Ų8435%0.35440%0.404SS..Hα-helixtrans-67.1-43.3174.8-66.4169.6000110.5Y292 I298 M304 K305 N306Y292-I302 HydrophobicContact CD2-CD1 3.84Å; Y292-I302 HydrophobicContact CE2-CD1 4.05Å; I298-I302 HydrophobicContact CG2-CD1 3.68Å; I298-I302 HydrophobicContact CG2-CG1 4.38Å; I298-I302 WeakPolarHBondContact O-CG1 3.33Å; I298-I302 PolarHBondContact O-N 3.14Å; I302-M304 PolarHBondContact O-N 3.22Å; I302-K305 PolarHBondContact O-N 2.83Å; I302-N306 WeakPolarHBondContact O-CB 3.46Å; I302-N306 VanDerWaalsContact O-CG 3.28Å; I302-N306 PolarHBondContact O-N 2.76Å; I302-N306 PolarHBondContact O-OD1 3.16Å
303K59.8Low58.1Low121 Ų12184.5 Ų84.553%0.52641%0.413SS..Hα-helixtrans-60.7-44.3175-76.8174.3-177.9-177.20112.2Q299 N300 N306 W307Q299-K303 WeakPolarHBondContact O-CB 3.4Å; Q299-K303 WeakPolarHBondContact O-CG 3.42Å; Q299-K303 PolarHBondContact O-N 3.13Å; N300-K303 PolarHBondContact O-N 3.49Å; K303-N306 PolarHBondContact O-N 3.39Å; K303-W307 WeakPolarHBondContact O-CB 3.5Å; K303-W307 PolarHBondContact O-N 3.13Å
304M58Low56.8Low143 Ų14388.9 Ų88.970%0.70443%0.432SS*.Hα-helixtrans-63.8-41.7176.9-73.4-98.6-76.200111.6N300 S301 I302 W307 S308N300-M304 VanDerWaalsContact O-CB 3.28Å; N300-M304 WeakPolarHBondContact O-CB 3.25Å; N300-M304 WeakPolarHBondContact O-CG 3.19Å; N300-M304 PolarHBondContact O-N 3.38Å; S301-M304 PolarHBondContact O-N 3.39Å; I302-M304 PolarHBondContact O-N 3.22Å; M304-W307 WeakPolarHBondContact O-CB 3.02Å; M304-W307 PolarHBondContact O-N 3.08Å; M304-S308 PolarHBondContact O-N 3.42Å; M304-S308 PolarHBondContact O-OG 2.91Å
305K56.7Low55.8Low144 Ų14496.7 Ų96.763%0.62646%0.461SS*.Hα-helixtrans-64.5-44.5175.7-163176.5-178.2-176.90111.4S301 I302 W307 S308 T309S301-K305 WeakPolarHBondContact O-CB 2.99Å; S301-K305 PolarHBondContact O-N 2.78Å; I302-K305 PolarHBondContact O-N 2.83Å; K305-W307 PolarHBondContact O-N 3.32Å; K305-S308 WeakPolarHBondContact CA-OG 3.27Å; K305-S308 PolarHBondContact O-N 3.48Å; K305-S308 PolarHBondContact O-OG 3.14Å; K305-T309 WeakPolarHBondContact O-CB 3.17Å; K305-T309 PolarHBondContact O-N 2.91Å; K305-T309 PolarHBondContact O-OG1 3.44Å
306N55Low54.8Low100 Ų100103.1 Ų103.154%0.53549%0.488SS..Hα-helixtrans-62.4-31.9174.2-71.7-2.7000112.3I302 K303 R310I302-N306 WeakPolarHBondContact O-CB 3.46Å; I302-N306 VanDerWaalsContact O-CG 3.28Å; I302-N306 PolarHBondContact O-N 2.76Å; I302-N306 PolarHBondContact O-OD1 3.16Å; K303-N306 PolarHBondContact O-N 3.39Å; N306-R310 VanDerWaalsContact O-CB 3.31Å; N306-R310 WeakPolarHBondContact O-CB 3.38Å; N306-R310 PolarHBondContact O-N 2.95Å
307W43.9Very low54.2Low183 Ų183103.1 Ų103.169%0.69349%0.494SS*.Hα-helixtrans-72.6-40.9173.7-130.563.2000112.2K303 M304 K305 R311K303-W307 WeakPolarHBondContact O-CB 3.5Å; K303-W307 PolarHBondContact O-N 3.13Å; M304-W307 WeakPolarHBondContact O-CB 3.02Å; M304-W307 PolarHBondContact O-N 3.08Å; K305-W307 PolarHBondContact O-N 3.32Å; W307-R311 VanDerWaalsContact O-CB 3.3Å; W307-R311 WeakPolarHBondContact O-CB 3.39Å; W307-R311 PolarHBondContact O-N 3.2Å
308S50.3Low54.1Low67 Ų67105.1 Ų105.147%0.46950%0.499SS..Hα-helixtrans-67.6-38.3174.656.90000112.5M304 K305 R311 S312M304-S308 PolarHBondContact O-N 3.42Å; M304-S308 PolarHBondContact O-OG 2.91Å; K305-S308 WeakPolarHBondContact CA-OG 3.27Å; K305-S308 PolarHBondContact O-N 3.48Å; K305-S308 PolarHBondContact O-OG 3.14Å; S308-R311 PolarHBondContact O-N 3.32Å; S308-S312 PolarHBondContact O-N 2.8Å; S308-S312 PolarHBondContact O-OG 3.14Å
309T53.9Low53.9Low62 Ų62108.7 Ų108.738%0.3852%0.521SS..Hα-helixtrans-69.1-42.5175.7-50.60000110.9K305 R311 S312 D313K305-T309 WeakPolarHBondContact O-CB 3.17Å; K305-T309 PolarHBondContact O-N 2.91Å; K305-T309 PolarHBondContact O-OG1 3.44Å; T309-R311 VanDerWaalsContact C-N 3.26Å; T309-R311 PolarHBondContact O-N 3.31Å; T309-S312 WeakPolarHBondContact CA-OG 3.41Å; T309-S312 PolarHBondContact O-N 3.25Å; T309-S312 PolarHBondContact O-OG 3.33Å; T309-D313 VanDerWaalsContact O-CG 3.28Å; T309-D313 PolarHBondContact O-N 2.87Å
310R49Very low53.3Low190 Ų190112.3 Ų112.372%0.71754%0.538SS*.Hα-helixtrans-59.6-36.9170.4-90.8-175.5170.2-171.9-3.5112.4N306 F314N306-R310 VanDerWaalsContact O-CB 3.31Å; N306-R310 WeakPolarHBondContact O-CB 3.38Å; N306-R310 PolarHBondContact O-N 2.95Å; R310-F314 WeakPolarHBondContact O-CB 3.26Å; R310-F314 PolarHBondContact O-N 3.24Å
311R46.6Very low52.9Low155 Ų155110 Ų11059%0.58554%0.535SS*.Hα-helixtrans-73.8-31.6179.1-159.9174.8-170.6175.22112.5W307 S308 T309 R315W307-R311 VanDerWaalsContact O-CB 3.3Å; W307-R311 WeakPolarHBondContact O-CB 3.39Å; W307-R311 PolarHBondContact O-N 3.2Å; S308-R311 PolarHBondContact O-N 3.32Å; T309-R311 VanDerWaalsContact C-N 3.26Å; T309-R311 PolarHBondContact O-N 3.31Å; R311-R315 WeakPolarHBondContact O-CB 3.34Å; R311-R315 PolarHBondContact O-N 2.67Å
312S51.3Low52.7Low64 Ų64111.7 Ų111.745%0.44854%0.543SS..Hα-helixtrans-70.7-40.6170.856.50000111.8S308 T309 F314 R315 F316S308-S312 PolarHBondContact O-N 2.8Å; S308-S312 PolarHBondContact O-OG 3.14Å; T309-S312 WeakPolarHBondContact CA-OG 3.41Å; T309-S312 PolarHBondContact O-N 3.25Å; T309-S312 PolarHBondContact O-OG 3.33Å; S312-F314 VanDerWaalsContact C-N 3.35Å; S312-F314 PolarHBondContact O-N 2.93Å; S312-R315 PolarHBondContact O-N 2.93Å; S312-F316 WeakPolarHBondContact O-CB 3.38Å; S312-F316 PolarHBondContact O-N 3.29Å
313D53.1Low52.4Low96 Ų96113.3 Ų113.351%0.51355%0.549SS..Hα-helixtrans-66.6-36.7176.5-66.7-17.3000111.9T309 S317T309-D313 VanDerWaalsContact O-CG 3.28Å; T309-D313 PolarHBondContact O-N 2.87Å; D313-S317 WeakPolarHBondContact O-CB 3.38Å; D313-S317 PolarHBondContact O-N 3.47Å; D313-S317 PolarHBondContact O-OG 2.95Å
314F49.8Very low52.2Low142 Ų142112.2 Ų112.262%0.62355%0.549SS*.Hα-helixtrans-68.3-43.8174.8-138.1-93.3000111.9R310 S312 F316 S317 E318R310-F314 WeakPolarHBondContact O-CB 3.26Å; R310-F314 PolarHBondContact O-N 3.24Å; S312-F314 VanDerWaalsContact C-N 3.35Å; S312-F314 PolarHBondContact O-N 2.93Å; F314-F316 VanDerWaalsContact C-N 3.34Å; F314-F316 PolarHBondContact O-N 3.05Å; F314-S317 PolarHBondContact O-N 3.08Å; F314-E318 PolarHBondContact O-N 3.49Å
315R50.9Low52Low164 Ų164111.7 Ų111.762%0.61954%0.544SS*.Hα-helixtrans-64-38.1174.2-85.3-173-179.6-174.2-0.4112.3R311 S312 S317 E318 V319R311-R315 WeakPolarHBondContact O-CB 3.34Å; R311-R315 PolarHBondContact O-N 2.67Å; S312-R315 PolarHBondContact O-N 2.93Å; R315-S317 VanDerWaalsContact C-N 3.34Å; R315-E318 PolarHBondContact O-N 2.71Å; R315-V319 VanDerWaalsContact O-CG2 3.25Å; R315-V319 WeakPolarHBondContact O-CG2 3.35Å; R315-V319 PolarHBondContact O-N 3.3Å
316F47.8Very low52.2Low146 Ų146109.2 Ų109.264%0.6454%0.536SS*.Hα-helixtrans-66.1-38.9176.7-164.3-94.4000111.2S312 F314 H320S312-F316 WeakPolarHBondContact O-CB 3.38Å; S312-F316 PolarHBondContact O-N 3.29Å; F314-F316 VanDerWaalsContact C-N 3.34Å; F314-F316 PolarHBondContact O-N 3.05Å; F316-H320 PolarHBondContact O-N 3.39Å; F316-H320 VanDerWaalsContact O-N 3.12Å
317S52Low52.6Low82 Ų82109.9 Ų109.957%0.57354%0.536SS*.Hα-helixtrans-68.2-38.6174.3-620000113.3D313 F314 R315 G321D313-S317 WeakPolarHBondContact O-CB 3.38Å; D313-S317 PolarHBondContact O-N 3.47Å; D313-S317 PolarHBondContact O-OG 2.95Å; F314-S317 PolarHBondContact O-N 3.08Å; R315-S317 VanDerWaalsContact C-N 3.34Å; S317-G321 PolarHBondContact O-N 3.49Å
318E52.3Low53.6Low116 Ų116106.5 Ų106.554%0.54253%0.528SS..Hα-helixtrans-65.4-40.4174.7-83.8178152.700112.4F314 R315 G321 T322F314-E318 PolarHBondContact O-N 3.49Å; R315-E318 PolarHBondContact O-N 2.71Å; E318-G321 PolarHBondContact O-N 3.3Å; E318-T322 WeakPolarHBondContact O-CB 3.15Å; E318-T322 PolarHBondContact O-N 3.01Å; E318-T322 PolarHBondContact O-OG1 3.32Å
319V54.7Low54.2Low85 Ų85106.4 Ų106.452%0.51552%0.522SS..Hα-helixtrans-65.9-44.7177.9172.20000110.9R315 G321 T322 E323R315-V319 VanDerWaalsContact O-CG2 3.25Å; R315-V319 WeakPolarHBondContact O-CG2 3.35Å; R315-V319 PolarHBondContact O-N 3.3Å; V319-G321 PolarHBondContact O-N 3.37Å; V319-T322 PolarHBondContact O-N 3.44Å; V319-E323 PolarHBondContact O-N 3.16Å
320H51.3Low54.6Low98 Ų98108.8 Ų108.845%0.45453%0.532SS..Hα-helixtrans-67.4-34.7176.1-11736.3000113.2F316 T322 E323 N324F316-H320 PolarHBondContact O-N 3.39Å; F316-H320 VanDerWaalsContact O-N 3.12Å; H320-T322 VanDerWaalsContact C-N 3.31Å; H320-T322 PolarHBondContact O-N 3.48Å; H320-E323 IonicContact CE1-OE2 3.02Å; H320-E323 IonicContact ND1-OE2 3.32Å; H320-E323 PolarHBondContact ND1-OE2 2.97Å; H320-N324 WeakPolarHBondContact O-CB 3.4Å; H320-N324 VanDerWaalsContact O-CG 3.3Å; H320-N324 PolarHBondContact O-N 2.87Å; H320-N324 VanDerWaalsContact O-N 3.12Å; H320-N324 PolarHBondContact O-ND2 3.45Å; H320-N324 VanDerWaalsContact O-ND2 3.13Å
321G53.4Low55.5Low41 Ų41105.3 Ų105.342%0.42352%0.524SS..Hα-helixtrans-63.7-36.9172.100000112.7S317 E318 V319 F325S317-G321 PolarHBondContact O-N 3.49Å; E318-G321 PolarHBondContact O-N 3.3Å; V319-G321 PolarHBondContact O-N 3.37Å; G321-F325 WeakPolarHBondContact O-CB 3.42Å; G321-F325 PolarHBondContact O-N 2.94Å; G321-F325 VanDerWaalsContact O-N 3.16Å
322T55.1Low56.4Low77 Ų77100.6 Ų100.647%0.47251%0.512SS..Hα-helixtrans-75.2-40179.4-49.90000111.9E318 V319 H320 F325 I326E318-T322 WeakPolarHBondContact O-CB 3.15Å; E318-T322 PolarHBondContact O-N 3.01Å; E318-T322 PolarHBondContact O-OG1 3.32Å; V319-T322 PolarHBondContact O-N 3.44Å; H320-T322 VanDerWaalsContact C-N 3.31Å; H320-T322 PolarHBondContact O-N 3.48Å; T322-F325 PolarHBondContact O-N 3.18Å; T322-I326 HydrophobicContact CG2-CD1 3.97Å; T322-I326 WeakPolarHBondContact O-CB 3.42Å; T322-I326 VanDerWaalsContact O-CG1 3.29Å; T322-I326 WeakPolarHBondContact O-CG1 3.35Å; T322-I326 PolarHBondContact O-N 3.12Å
323E54.8Low57.1Low103 Ų103102.6 Ų102.648%0.48152%0.517SS..Hα-helixtrans-60.8-45.6173.4-79.9-179.6145.700111.8V319 H320 F325 I326 Q327V319-E323 PolarHBondContact O-N 3.16Å; H320-E323 IonicContact CE1-OE2 3.02Å; H320-E323 IonicContact ND1-OE2 3.32Å; H320-E323 PolarHBondContact ND1-OE2 2.97Å; E323-F325 VanDerWaalsContact C-N 3.32Å; E323-F325 PolarHBondContact O-N 3.17Å; E323-I326 PolarHBondContact O-N 3.41Å; E323-Q327 VanDerWaalsContact O-CB 3.29Å; E323-Q327 WeakPolarHBondContact O-CB 3.33Å; E323-Q327 PolarHBondContact O-N 3.4Å
324N55.2Low57.7Low98 Ų98104.7 Ų104.752%0.52452%0.522SS..Hα-helixtrans-63.4-37.4177.4-73.6-30.1000112.3H320 H328H320-N324 WeakPolarHBondContact O-CB 3.4Å; H320-N324 VanDerWaalsContact O-CG 3.3Å; H320-N324 PolarHBondContact O-N 2.87Å; H320-N324 VanDerWaalsContact O-N 3.12Å; H320-N324 PolarHBondContact O-ND2 3.45Å; H320-N324 VanDerWaalsContact O-ND2 3.13Å; N324-H328 WeakPolarHBondContact O-CB 3.31Å; N324-H328 PolarHBondContact O-N 2.88Å
325F54.9Low58.4Low133 Ų133106.8 Ų106.858%0.58353%0.526SS*.Hα-helixtrans-68.7-41.9175.9-174.7-103.1000112.5G321 T322 E323 H328 N329G321-F325 WeakPolarHBondContact O-CB 3.42Å; G321-F325 PolarHBondContact O-N 2.94Å; G321-F325 VanDerWaalsContact O-N 3.16Å; T322-F325 PolarHBondContact O-N 3.18Å; E323-F325 VanDerWaalsContact C-N 3.32Å; E323-F325 PolarHBondContact O-N 3.17Å; F325-H328 PolarHBondContact O-N 3.47Å; F325-N329 WeakPolarHBondContact CD1-ND2 3.31Å; F325-N329 WeakPolarHBondContact CE1-ND2 3.48Å; F325-N329 VanDerWaalsContact CZ-ND2 3.29Å; F325-N329 WeakPolarHBondContact CZ-ND2 3.36Å; F325-N329 PolarHBondContact O-N 3.4Å; F325-N329 PolarHBondContact O-ND2 3.24Å; F325-N329 VanDerWaalsContact O-ND2 3.1Å
326I61Low59.1Low91 Ų91106.5 Ų106.547%0.46753%0.529SS..Hα-helixtrans-65.7-43.5176.5-70.3169.6000110.4T322 E323 H328 N329 L330T322-I326 HydrophobicContact CG2-CD1 3.97Å; T322-I326 WeakPolarHBondContact O-CB 3.42Å; T322-I326 VanDerWaalsContact O-CG1 3.29Å; T322-I326 WeakPolarHBondContact O-CG1 3.35Å; T322-I326 PolarHBondContact O-N 3.12Å; E323-I326 PolarHBondContact O-N 3.41Å; I326-H328 VanDerWaalsContact C-N 3.34Å; I326-H328 PolarHBondContact O-N 3.25Å; I326-N329 PolarHBondContact O-N 3.19Å; I326-L330 HydrophobicContact CG2-CD1 3.84Å; I326-L330 WeakPolarHBondContact O-CB 3.46Å; I326-L330 PolarHBondContact O-N 3.33Å
327Q62.7Low59.8Low114 Ų114104 Ų10453%0.53352%0.521SS..Hα-helixtrans-66-36.9179.2-166.1164.7-8.900111.9E323 Q331E323-Q327 VanDerWaalsContact O-CB 3.29Å; E323-Q327 WeakPolarHBondContact O-CB 3.33Å; E323-Q327 PolarHBondContact O-N 3.4Å; Q327-Q331 WeakPolarHBondContact O-CG 3.27Å; Q327-Q331 PolarHBondContact O-N 2.99Å
328H65.3Low60.1Low112 Ų112106.3 Ų106.352%0.51952%0.521SS..Hα-helixtrans-66.3-42173.9-169.250.8000112.6N324 F325 I326 Q331 T332N324-H328 WeakPolarHBondContact O-CB 3.31Å; N324-H328 PolarHBondContact O-N 2.88Å; F325-H328 PolarHBondContact O-N 3.47Å; I326-H328 VanDerWaalsContact C-N 3.34Å; I326-H328 PolarHBondContact O-N 3.25Å; H328-Q331 PolarHBondContact O-N 3.47Å; H328-T332 PolarHBondContact O-N 2.88Å; H328-T332 PolarHBondContact O-OG1 3.1Å
329N62.1Low60.4Low66 Ų66105.9 Ų105.935%0.35352%0.523SS..Hα-helixtrans-67.3-37.6176-77.4-41.6000112.7F325 I326 T332 L333F325-N329 WeakPolarHBondContact CD1-ND2 3.31Å; F325-N329 WeakPolarHBondContact CE1-ND2 3.48Å; F325-N329 VanDerWaalsContact CZ-ND2 3.29Å; F325-N329 WeakPolarHBondContact CZ-ND2 3.36Å; F325-N329 PolarHBondContact O-N 3.4Å; F325-N329 PolarHBondContact O-ND2 3.24Å; F325-N329 VanDerWaalsContact O-ND2 3.1Å; I326-N329 PolarHBondContact O-N 3.19Å; N329-T332 VanDerWaalsContact CA-OG1 3.25Å; N329-T332 WeakPolarHBondContact CA-OG1 3.45Å; N329-T332 PolarHBondContact O-N 3.48Å; N329-T332 PolarHBondContact O-OG1 3.37Å; N329-T332 VanDerWaalsContact O-OG1 3.06Å; N329-L333 WeakPolarHBondContact O-CB 3.13Å; N329-L333 PolarHBondContact O-N 3.17Å
330L63.8Low60.3Low112 Ų112108 Ų10859%0.58653%0.531SS*.Hα-helixtrans-65.7-39.6174-101.9147000112I326 K334I326-L330 HydrophobicContact CG2-CD1 3.84Å; I326-L330 WeakPolarHBondContact O-CB 3.46Å; I326-L330 PolarHBondContact O-N 3.33Å; L330-K334 VanDerWaalsContact O-CB 3.26Å; L330-K334 WeakPolarHBondContact O-CB 3.07Å; L330-K334 PolarHBondContact O-N 3.48Å
331Q67Low60.5Low116 Ų116109.9 Ų109.954%0.54254%0.54SS..Hα-helixtrans-65.5-38.6174.8-77.8178-10.400112.5Q327 H328 R335Q327-Q331 WeakPolarHBondContact O-CG 3.27Å; Q327-Q331 PolarHBondContact O-N 2.99Å; H328-Q331 PolarHBondContact O-N 3.47Å; Q331-R335 PolarHBondContact O-N 3.03Å
332T66.3Low60.5Low57 Ų57112.4 Ų112.435%0.3555%0.551SS.*Hα-helixtrans-71.2-38.6176.726.50000112.4H328 N329 R335 K336H328-T332 PolarHBondContact O-N 2.88Å; H328-T332 PolarHBondContact O-OG1 3.1Å; N329-T332 VanDerWaalsContact CA-OG1 3.25Å; N329-T332 WeakPolarHBondContact CA-OG1 3.45Å; N329-T332 PolarHBondContact O-N 3.48Å; N329-T332 PolarHBondContact O-OG1 3.37Å; N329-T332 VanDerWaalsContact O-OG1 3.06Å; T332-R335 PolarHBondContact O-N 3.21Å; T332-K336 PolarHBondContact O-N 3.42Å; T332-K336 VanDerWaalsContact O-N 3.09Å
333L65.1Low60.4Low105 Ų105112.9 Ų112.955%0.5556%0.563SS.*Hα-helixtrans-63.9-43.3171.8-99.8148.9000112N329 R335 K336 I337N329-L333 WeakPolarHBondContact O-CB 3.13Å; N329-L333 PolarHBondContact O-N 3.17Å; L333-R335 VanDerWaalsContact C-N 3.33Å; L333-R335 PolarHBondContact O-N 3.35Å; L333-K336 PolarHBondContact O-N 3.47Å; L333-I337 WeakPolarHBondContact O-CG1 3.36Å; L333-I337 PolarHBondContact O-N 2.69Å
334K65.7Low60Low140 Ų140114.9 Ų114.961%0.60960%0.597SS**Hα-helixtrans-64.3-36.6178.6-159.4175.7-175.8-177.50112.1L330 F338L330-K334 VanDerWaalsContact O-CB 3.26Å; L330-K334 WeakPolarHBondContact O-CB 3.07Å; L330-K334 PolarHBondContact O-N 3.48Å; K334-F338 HydrophobicContact CG-CD2 4.39Å; K334-F338 PolarHBondContact O-N 3.14Å; K334-F338 VanDerWaalsContact O-N 3.14Å
335R65.1Low60.2Low187 Ų187115.8 Ų115.871%0.70660%0.601SS**Hα-helixtrans-62.1-49.7170-88-174.5-170.3159.44.4112.1Q331 T332 L333 I337 F338 D339Q331-R335 PolarHBondContact O-N 3.03Å; T332-R335 PolarHBondContact O-N 3.21Å; L333-R335 VanDerWaalsContact C-N 3.33Å; L333-R335 PolarHBondContact O-N 3.35Å; R335-I337 PolarHBondContact O-N 3.47Å; R335-F338 PolarHBondContact O-N 3.47Å; R335-F338 VanDerWaalsContact O-N 3.17Å; R335-D339 VanDerWaalsContact O-CG 3.24Å; R335-D339 PolarHBondContact O-N 2.05Å
336K65.1Low60.5Low157 Ų157114.8 Ų114.868%0.68360%0.602SS**Hα-helixtrans-60.4-31.5179.7-78.1-176.1176.6-177.10113.7T332 L333 N340T332-K336 PolarHBondContact O-N 3.42Å; T332-K336 VanDerWaalsContact O-N 3.09Å; L333-K336 PolarHBondContact O-N 3.47Å; K336-N340 PolarHBondContact O-N 3.3Å
337I64Low60.5Low95 Ų95116.2 Ų116.249%0.48761%0.609SS.*Hα-helixtrans-74.4-44.4176.4-66.4165.9000110.7L333 R335 D339 N340 E341L333-I337 WeakPolarHBondContact O-CG1 3.36Å; L333-I337 PolarHBondContact O-N 2.69Å; R335-I337 PolarHBondContact O-N 3.47Å; I337-D339 VanDerWaalsContact C-N 3.35Å; I337-D339 PolarHBondContact O-N 2.88Å; I337-N340 PolarHBondContact O-N 3.29Å; I337-N340 VanDerWaalsContact O-N 3.13Å; I337-E341 PolarHBondContact O-N 3.4Å; I337-E341 VanDerWaalsContact O-N 3.15Å
338F57.8Low60.3Low129 Ų129116.3 Ų116.357%0.56661%0.614SS**Hα-helixtrans-65.3-34.5177.3-101-88000113.5K334 R335 N340 S342K334-F338 HydrophobicContact CG-CD2 4.39Å; K334-F338 PolarHBondContact O-N 3.14Å; K334-F338 VanDerWaalsContact O-N 3.14Å; R335-F338 PolarHBondContact O-N 3.47Å; R335-F338 VanDerWaalsContact O-N 3.17Å; F338-N340 PolarHBondContact O-N 3.15Å; F338-S342 PolarHBondContact O-N 3.21Å; F338-S342 PolarHBondContact O-OG 3.43Å
339D57.1Low60Low108 Ų108116.6 Ų116.658%0.57862%0.62SS**Hα-helixtrans-70.5-20.8175.6-64.5-25.5000112R335 I337 S342R335-D339 VanDerWaalsContact O-CG 3.24Å; R335-D339 PolarHBondContact O-N 2.05Å; I337-D339 VanDerWaalsContact C-N 3.35Å; I337-D339 PolarHBondContact O-N 2.88Å; D339-S342 PolarHBondContact O-OG 3.49Å
340N53.8Low59.9Low129 Ų129119.9 Ų119.969%0.6964%0.638SS**Hα-helixtrans-89.5-28.2178.1-123.620.3000113K336 I337 F338 S342K336-N340 PolarHBondContact O-N 3.3Å; I337-N340 PolarHBondContact O-N 3.29Å; I337-N340 VanDerWaalsContact O-N 3.13Å; F338-N340 PolarHBondContact O-N 3.15Å; N340-S342 VanDerWaalsContact C-N 3.33Å
341E54.4Low59.6Low138 Ų138120.5 Ų120.565%0.64564%0.641SS**Hα-helixtrans-80.6-11.4174.5-84.1-178.2148.800113.6I337I337-E341 PolarHBondContact O-N 3.4Å; I337-E341 VanDerWaalsContact O-N 3.15Å
342S53.8Low59Low94 Ų94120.8 Ų120.866%0.65765%0.649SS**THydrogen-bonded Turntrans-95.40.4175.1420000113.6F338 D339 N340F338-S342 PolarHBondContact O-N 3.21Å; F338-S342 PolarHBondContact O-OG 3.43Å; D339-S342 PolarHBondContact O-OG 3.49Å; N340-S342 VanDerWaalsContact C-N 3.33Å
343A52.9Low58.4Low87 Ų87126.2 Ų126.272%0.71967%0.674SS**  trans-112.98.7179.500000114
344A46.2Very low57.8Low145 Ų145128.1 Ų128.1100%1.19869%0.685SS**  trans-121.20170.800000109

Retrieved 344 of 344 residues in 1096 ms (Link to these results)

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