A0A5K4F7X4_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F7X4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 355 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M33.6Very low62.8Low238 Ų238103.5 Ų103.5100%1.17253%0.533SS*.  0113.40-94.5171.5-177.800106.4E3M1-E3 PolarHBondContact O-N 3.23Å
2Y32.6Very low64.3Low237 Ų23796.9 Ų96.993%0.92951%0.506SS*.  trans-60.6108163.4-86.8-96.7000105.6A4Y2-A4 PolarHBondContact O-N 3.41Å
3E36.6Very low65.7Low183 Ų18397.2 Ų97.286%0.85551%0.508SS*.  trans-58.597.2160.4-77.8-179.8163.700104.8M1 S5M1-E3 PolarHBondContact O-N 3.23Å; E3-S5 PolarHBondContact O-N 3.35Å
4A46.4Very low66.7Low83 Ų8394.2 Ų94.269%0.68649%0.489SS*.  trans-50.6114.5160.700000104.6Y2 L6Y2-A4 PolarHBondContact O-N 3.41Å; A4-L6 PolarHBondContact O-N 3.16Å
5S61.5Low67.5Low109 Ų10988.3 Ų88.376%0.76246%0.458SS*.  trans-52.9113-177.444.40000107.2E3 N7E3-S5 PolarHBondContact O-N 3.35Å; S5-N7 PolarHBondContact O-N 2.95Å
6L73.4Confident68.6Low100 Ų10085.9 Ų85.952%0.52444%0.443SS..  trans-57.8113.5-174.7-70.1170.5000107.8A4 F8 W192 I199A4-L6 PolarHBondContact O-N 3.16Å; L6-F8 HydrophobicContact CB-CD2 4.08Å; L6-F8 HydrophobicContact CB-CE2 3.4Å; L6-F8 VanDerWaalsContact CB-CE2 3.4Å; L6-F8 HydrophobicContact CB-CZ 3.83Å; L6-F8 HydrophobicContact CD1-CE2 4.24Å; L6-F8 HydrophobicContact CD1-CZ 4.02Å; L6-F8 HydrophobicContact CG-CE2 4.48Å; L6-F8 WeakPolarHBondContact O-CD2 3.28Å; L6-F8 PolarHBondContact O-N 3.1Å; L6-W192 HydrophobicContact CD1-CH2 4.42Å; L6-W192 HydrophobicContact CD1-CZ3 3.98Å; L6-I199 HydrophobicContact CB-CD1 4.03Å; L6-I199 HydrophobicContact CD2-CD1 3.47Å; L6-I199 VanDerWaalsContact CD2-CD1 3.47Å; L6-I199 HydrophobicContact CG-CD1 4.23Å
7N82.8Confident69.6Low65 Ų6587 Ų8735%0.34844%0.44SS..  trans-84.198-174.7-173.311.1000108.5S5 E197 R198 I199S5-N7 PolarHBondContact O-N 2.95Å; N7-E197 PolarHBondContact ND2-O 3.46Å; N7-R198 HydrophobicContact CB-CG 4.48Å; N7-R198 CarbonylContact O-C 3.51Å; N7-R198 WeakPolarHBondContact O-CA 3.17Å; N7-I199 PolarHBondContact O-N 3.45Å
8F84.9Confident70.4Confident26 Ų2684.8 Ų84.811%0.11443%0.428CS..BIsolated β-bridgetrans-85.4154.5-177.6-69.3-85.4000112.8L6 D10 N119 W192 R198 I199L6-F8 HydrophobicContact CB-CD2 4.08Å; L6-F8 HydrophobicContact CB-CE2 3.4Å; L6-F8 VanDerWaalsContact CB-CE2 3.4Å; L6-F8 HydrophobicContact CB-CZ 3.83Å; L6-F8 HydrophobicContact CD1-CE2 4.24Å; L6-F8 HydrophobicContact CD1-CZ 4.02Å; L6-F8 HydrophobicContact CG-CE2 4.48Å; L6-F8 WeakPolarHBondContact O-CD2 3.28Å; L6-F8 PolarHBondContact O-N 3.1Å; F8-D10 VanDerWaalsContact C-N 3.29Å; F8-D10 WeakPolarHBondContact CB-O 3.4Å; F8-N119 VanDerWaalsContact CB-ND2 3.34Å; F8-N119 WeakPolarHBondContact CB-ND2 3.33Å; F8-N119 HydrophobicContact CD1-CB 4.1Å; F8-N119 HydrophobicContact CD2-CB 4.05Å; F8-N119 HydrophobicContact CE1-CB 4.18Å; F8-N119 HydrophobicContact CE2-CB 4.11Å; F8-N119 HydrophobicContact CG-CB 4.04Å; F8-N119 VanDerWaalsContact CG-CG 3.48Å; F8-N119 WeakPolarHBondContact CG-ND2 3.34Å; F8-N119 HydrophobicContact CZ-CB 4.18Å; F8-W192 HydrophobicContact CE1-CD2 4.12Å; F8-W192 AromaticContact CE1-CE2 3.81Å; F8-W192 HydrophobicContact CE1-CE3 4.39Å; F8-W192 HydrophobicContact CE1-CH2 4.14Å; F8-W192 AromaticContact CE1-CZ2 3.83Å; F8-W192 HydrophobicContact CE1-CZ2 3.83Å; F8-W192 HydrophobicContact CE1-CZ3 4.41Å; F8-W192 HydrophobicContact CZ-CE3 4.48Å; F8-W192 AromaticContact CZ-CH2 3.7Å; F8-W192 HydrophobicContact CZ-CH2 3.7Å; F8-W192 AromaticContact CZ-CZ2 3.78Å; F8-W192 HydrophobicContact CZ-CZ2 3.78Å; F8-W192 HydrophobicContact CZ-CZ3 4.07Å; F8-R198 PolarHBondContact O-NH1 3.3Å; F8-I199 WeakPolarHBondContact CA-O 3.25Å; F8-I199 HydrophobicContact CD1-CB 3.7Å; F8-I199 HydrophobicContact CD1-CG2 3.78Å; F8-I199 HydrophobicContact CE1-CB 3.89Å; F8-I199 HydrophobicContact CE1-CD1 4.43Å; F8-I199 HydrophobicContact CE1-CG2 3.61Å; F8-I199 HydrophobicContact CG-CB 4.44Å
9T79.6Confident71.2Confident36 Ų3681.9 Ų81.922%0.22142%0.417CS..SBendtrans-69.7-28.6172.8-57.60000112Y11 K14 I199 L200T9-Y11 WeakPolarHBondContact O-CD1 3.27Å; T9-K14 WeakPolarHBondContact O-CD 3.39Å; T9-K14 PolarHBondContact O-NZ 3.35Å; T9-I199 PolarHBondContact N-O 3.49Å; T9-I199 PolarHBondContact OG1-O 3.2Å; T9-L200 HydrophobicContact CG2-CD1 4.09Å
10D80.3Confident72Confident12 Ų1281.7 Ų81.76%0.06442%0.416CS..SBendtrans-94.7116.9168.5-72.5-17.5000108.8F8 K14 W98 V102 F114 N119F8-D10 VanDerWaalsContact C-N 3.29Å; F8-D10 WeakPolarHBondContact CB-O 3.4Å; D10-K14 IonicContact OD1-NZ 3.41Å; D10-K14 PolarHBondContact OD1-NZ 3.19Å; D10-W98 PolarHBondContact OD2-NE1 3.05Å; D10-V102 HydrophobicContact CB-CG1 3.86Å; D10-V102 HydrophobicContact CB-CG2 4.4Å; D10-F114 HydrophobicContact CB-CZ 4.36Å; D10-F114 WeakPolarHBondContact O-CZ 3.24Å; D10-N119 PolarHBondContact O-ND2 2.91Å
11Y78.8Confident72.7Confident49 Ų4981 Ų8119%0.19241%0.413CS..  trans-150.5156.2-178.665.3-78.1000110.3T9 L13 K14 R17 F114T9-Y11 WeakPolarHBondContact O-CD1 3.27Å; Y11-L13 VanDerWaalsContact C-N 3.31Å; Y11-L13 HydrophobicContact CD2-CB 4.14Å; Y11-L13 VanDerWaalsContact CE2-C 3.47Å; Y11-L13 HydrophobicContact CE2-CB 3.98Å; Y11-L13 PolarHBondContact O-N 3.17Å; Y11-K14 HydrophobicContact CD1-CB 3.89Å; Y11-K14 HydrophobicContact CD1-CG 4.48Å; Y11-K14 HydrophobicContact CD2-CB 4.44Å; Y11-K14 HydrophobicContact CE1-CB 3.66Å; Y11-K14 HydrophobicContact CE1-CG 4.01Å; Y11-K14 HydrophobicContact CE2-CB 4.25Å; Y11-K14 VanDerWaalsContact CE2-N 3.3Å; Y11-K14 HydrophobicContact CG-CB 4.29Å; Y11-K14 VanDerWaalsContact CZ-CA 3.47Å; Y11-K14 WeakPolarHBondContact O-CB 3.45Å; Y11-K14 PolarHBondContact O-N 2.84Å; Y11-R17 WeakPolarHBondContact OH-CB 3.42Å; Y11-R17 WeakPolarHBondContact OH-CD 3.5Å; Y11-R17 WeakPolarHBondContact OH-CG 3.29Å; Y11-R17 PolarHBondContact OH-NH1 3.34Å; Y11-F114 VanDerWaalsContact C-CE2 3.5Å; Y11-F114 VanDerWaalsContact CA-CZ 3.47Å
12A81.4Confident75.2Confident25 Ų2571.9 Ų71.921%0.20737%0.369CS..THydrogen-bonded Turntrans-53-42.6-170.200000114.5K14 P106 F114A12-K14 VanDerWaalsContact C-N 3.32Å; A12-K14 PolarHBondContact O-N 2.96Å; A12-P106 WeakPolarHBondContact O-CB 3.39Å; A12-F114 HydrophobicContact CB-CB 3.56Å; A12-F114 HydrophobicContact CB-CD1 4.38Å; A12-F114 HydrophobicContact CB-CD2 4.18Å; A12-F114 HydrophobicContact CB-CG 3.79Å
13L82.2Confident77.8Confident101 Ų10168.1 Ų68.153%0.52936%0.358SS..THydrogen-bonded Turntrans-88.47.7-176.4-63.8173.6000113.7Y11 V15 F16 R17Y11-L13 VanDerWaalsContact C-N 3.31Å; Y11-L13 HydrophobicContact CD2-CB 4.14Å; Y11-L13 VanDerWaalsContact CE2-C 3.47Å; Y11-L13 HydrophobicContact CE2-CB 3.98Å; Y11-L13 PolarHBondContact O-N 3.17Å; L13-V15 VanDerWaalsContact C-N 3.27Å; L13-V15 PolarHBondContact O-N 2.88Å; L13-F16 HydrophobicContact CD2-CD2 4.18Å; L13-F16 PolarHBondContact O-N 3.34Å; L13-R17 WeakPolarHBondContact O-CB 3.31Å; L13-R17 PolarHBondContact O-N 3.28Å
14K79.8Confident80.2Confident55 Ų5566.5 Ų66.524%0.23936%0.355CS..Hα-helixtrans-55.2-43-178.5-179.2178.1-178.8162.60112.5T9 D10 Y11 A12T9-K14 WeakPolarHBondContact O-CD 3.39Å; T9-K14 PolarHBondContact O-NZ 3.35Å; D10-K14 IonicContact OD1-NZ 3.41Å; D10-K14 PolarHBondContact OD1-NZ 3.19Å; Y11-K14 HydrophobicContact CD1-CB 3.89Å; Y11-K14 HydrophobicContact CD1-CG 4.48Å; Y11-K14 HydrophobicContact CD2-CB 4.44Å; Y11-K14 HydrophobicContact CE1-CB 3.66Å; Y11-K14 HydrophobicContact CE1-CG 4.01Å; Y11-K14 HydrophobicContact CE2-CB 4.25Å; Y11-K14 VanDerWaalsContact CE2-N 3.3Å; Y11-K14 HydrophobicContact CG-CB 4.29Å; Y11-K14 VanDerWaalsContact CZ-CA 3.47Å; Y11-K14 WeakPolarHBondContact O-CB 3.45Å; Y11-K14 PolarHBondContact O-N 2.84Å; A12-K14 VanDerWaalsContact C-N 3.32Å; A12-K14 PolarHBondContact O-N 2.96Å
15V78.5Confident82Confident5 Ų566.3 Ų66.33%0.0334%0.342CS..Hα-helixtrans-62.5-47.4-178.5176.40000111.1L13 S37 S41 R103 Y107L13-V15 VanDerWaalsContact C-N 3.27Å; L13-V15 PolarHBondContact O-N 2.88Å; V15-S37 PolarHBondContact O-OG 3.41Å; V15-S41 WeakPolarHBondContact CG1-OG 3.45Å; V15-S41 VanDerWaalsContact CG2-OG 3.29Å; V15-S41 WeakPolarHBondContact CG2-OG 3.42Å; V15-R103 HydrophobicContact CG2-CB 4.33Å; V15-Y107 HydrophobicContact CG1-CD2 3.9Å
16F85.7Confident83Confident50 Ų5065.6 Ų65.622%0.21934%0.337CS..Hα-helixtrans-77.5-28.2-176.9-58.4-66.5000112.8L13 Q18 C19 D20 Y107L13-F16 HydrophobicContact CD2-CD2 4.18Å; L13-F16 PolarHBondContact O-N 3.34Å; F16-Q18 PolarHBondContact O-N 3.36Å; F16-Q18 VanDerWaalsContact O-N 3.13Å; F16-C19 CarbonylContact O-C 3.36Å; F16-C19 WeakPolarHBondContact O-CA 3.36Å; F16-C19 PolarHBondContact O-N 3.33Å; F16-D20 PolarHBondContact O-N 3.38Å; F16-Y107 HydrophobicContact CE1-CD2 4.2Å; F16-Y107 HydrophobicContact CZ-CD2 4.27Å
17R85.1Confident83.8Confident105 Ų10562.6 Ų62.640%0.39633%0.325SS..Hα-helixtrans-53.5-39.2-178.4-163.2-130.8-166.5130.9-15.6112.8Y11 L13 C19 D20 L21 R198Y11-R17 WeakPolarHBondContact OH-CB 3.42Å; Y11-R17 WeakPolarHBondContact OH-CD 3.5Å; Y11-R17 WeakPolarHBondContact OH-CG 3.29Å; Y11-R17 PolarHBondContact OH-NH1 3.34Å; L13-R17 WeakPolarHBondContact O-CB 3.31Å; L13-R17 PolarHBondContact O-N 3.28Å; R17-C19 VanDerWaalsContact C-N 3.32Å; R17-C19 PolarHBondContact O-N 3.49Å; R17-D20 PolarHBondContact O-N 2.97Å; R17-L21 HydrophobicContact CG-CD1 4.35Å; R17-L21 WeakPolarHBondContact O-CB 3.35Å; R17-L21 VanDerWaalsContact O-CG 3.24Å; R17-L21 WeakPolarHBondContact O-CG 3.49Å; R17-L21 PolarHBondContact O-N 2.71Å; R17-R198 VanDerWaalsContact NH1-NH2 3.17Å
18Q83.4Confident83.9Confident47 Ų4768.1 Ų68.122%0.2234%0.342CS..Hα-helixtrans-66.3-36.1178.3-61-58.8-22.100111.9F16 L22 Q30 R33F16-Q18 PolarHBondContact O-N 3.36Å; F16-Q18 VanDerWaalsContact O-N 3.13Å; Q18-L22 PolarHBondContact O-N 3.34Å; Q18-Q30 PolarHBondContact O-NE2 3.37Å; Q18-R33 HydrophobicContact CB-CB 4.49Å
19C86.7Confident83.9Confident31 Ų3170.1 Ų70.121%0.20935%0.352CS..Hα-helixtrans-80.4-27177.5-610000112.8F16 R17 L22 C34F16-C19 CarbonylContact O-C 3.36Å; F16-C19 WeakPolarHBondContact O-CA 3.36Å; F16-C19 PolarHBondContact O-N 3.33Å; R17-C19 VanDerWaalsContact C-N 3.32Å; R17-C19 PolarHBondContact O-N 3.49Å; C19-L22 WeakPolarHBondContact O-CB 3.35Å; C19-C34 WeakPolarHBondContact CA-SG 3.39Å; C19-C34 HydrophobicContact CB-CB 4.06Å; C19-C34 WeakPolarHBondContact CB-SG 3.38Å; C19-C34 VanDerWaalsContact SG-CA 3.57Å; C19-C34 WeakPolarHBondContact SG-CB 3.41Å; C19-C34 CovalentContact SG-SG 2.05Å; C19-C34 PolarHBondContact SG-SG 3.36Å
20D87.6Confident84.2Confident77 Ų7769 Ų6941%0.41234%0.344SS..Hα-helixtrans-72.5-39.3171.4-72.7-38.1000111.9F16 R17 L22 K23F16-D20 PolarHBondContact O-N 3.38Å; R17-D20 PolarHBondContact O-N 2.97Å; D20-L22 PolarHBondContact O-N 2.84Å; D20-K23 WeakPolarHBondContact O-CB 3.45Å; D20-K23 PolarHBondContact O-N 2.78Å; D20-K23 VanDerWaalsContact O-N 3.11Å; D20-K23 IonicContact OD1-NZ 2.82Å; D20-K23 PolarHBondContact OD1-NZ 3.14Å
21L85.2Confident84.6Confident66 Ų6672.4 Ų72.435%0.34636%0.36SS..Hα-helixtrans-62.6-31.4173.4-73.4173.2000112.3R17 K23 N24 D25 Q30R17-L21 HydrophobicContact CG-CD1 4.35Å; R17-L21 WeakPolarHBondContact O-CB 3.35Å; R17-L21 VanDerWaalsContact O-CG 3.24Å; R17-L21 WeakPolarHBondContact O-CG 3.49Å; R17-L21 PolarHBondContact O-N 2.71Å; L21-K23 PolarHBondContact O-N 3.15Å; L21-N24 PolarHBondContact O-N 2.88Å; L21-D25 PolarHBondContact O-N 2.61Å; L21-Q30 HydrophobicContact CB-CG 4.37Å
22L87.2Confident85Confident48 Ų4872.1 Ų72.125%0.25136%0.363SS..THydrogen-bonded Turntrans-60.3-25.4175179.661000113Q18 C19 D20 N24 D25 Q30 Q31 C34Q18-L22 PolarHBondContact O-N 3.34Å; C19-L22 WeakPolarHBondContact O-CB 3.35Å; D20-L22 PolarHBondContact O-N 2.84Å; L22-N24 VanDerWaalsContact C-N 3.26Å; L22-N24 PolarHBondContact O-N 3.04Å; L22-D25 WeakPolarHBondContact CA-O 3.41Å; L22-D25 CarbonylContact O-C 3.53Å; L22-Q30 HydrophobicContact CB-CG 4.04Å; L22-Q30 HydrophobicContact CD1-CB 4.24Å; L22-Q30 HydrophobicContact CD1-CG 4.27Å; L22-Q31 HydrophobicContact CD1-CB 4.29Å; L22-Q31 HydrophobicContact CD1-CG 3.43Å; L22-Q31 VanDerWaalsContact CD1-CG 3.43Å; L22-Q31 HydrophobicContact CD2-CG 4.3Å; L22-C34 HydrophobicContact CD2-CB 4.11Å
23K86.3Confident85.3Confident158 Ų15873.3 Ų73.369%0.68736%0.362SS*.THydrogen-bonded Turntrans-68.9-27.4175.5-62.4171-179.41570112.2D20 L21D20-K23 WeakPolarHBondContact O-CB 3.45Å; D20-K23 PolarHBondContact O-N 2.78Å; D20-K23 VanDerWaalsContact O-N 3.11Å; D20-K23 IonicContact OD1-NZ 2.82Å; D20-K23 PolarHBondContact OD1-NZ 3.14Å; L21-K23 PolarHBondContact O-N 3.15Å
24N86.9Confident85.6Confident149 Ų14969.3 Ų69.380%0.79734%0.342SS*.THydrogen-bonded Turntrans-100.4-31.5-178.7-66.3-12.5000112.4L21 L22L21-N24 PolarHBondContact O-N 2.88Å; L22-N24 VanDerWaalsContact C-N 3.26Å; L22-N24 PolarHBondContact O-N 3.04Å
25D84.4Confident86.2Confident78 Ų7871.7 Ų71.742%0.41736%0.356SS..  trans-124.1102.6176.1176.918.5000109.8L21 L22 S27L21-D25 PolarHBondContact O-N 2.61Å; L22-D25 WeakPolarHBondContact CA-O 3.41Å; L22-D25 CarbonylContact O-C 3.53Å; D25-S27 VanDerWaalsContact CG-OG 3.27Å; D25-S27 PolarHBondContact O-N 3.26Å; D25-S27 WeakPolarHBondContact OD1-CB 3.34Å; D25-S27 PolarHBondContact OD1-N 3.41Å; D25-S27 PolarHBondContact OD1-OG 3.35Å; D25-S27 PolarHBondContact OD2-OG 3.42Å
26S83.5Confident86.7Confident95 Ų9572.7 Ų72.766%0.66436%0.362SS*.  trans-80.713.2179.759.20000113.9Q31S26-Q31 PolarHBondContact O-NE2 3.23Å; S26-Q31 VanDerWaalsContact O-NE2 3.13Å
27S88.5Confident86.9Confident37 Ų3770.8 Ų70.826%0.25936%0.355SS..  trans-55.5147.4178.5690000112.9D25 E29 Q30 Q31D25-S27 VanDerWaalsContact CG-OG 3.27Å; D25-S27 PolarHBondContact O-N 3.26Å; D25-S27 WeakPolarHBondContact OD1-CB 3.34Å; D25-S27 PolarHBondContact OD1-N 3.41Å; D25-S27 PolarHBondContact OD1-OG 3.35Å; D25-S27 PolarHBondContact OD2-OG 3.42Å; S27-E29 PolarHBondContact O-N 3.02Å; S27-Q30 PolarHBondContact O-N 2.85Å; S27-Q30 VanDerWaalsContact O-N 3.12Å; S27-Q30 WeakPolarHBondContact OG-CB 3.25Å; S27-Q30 PolarHBondContact OG-N 3.29Å; S27-Q31 WeakPolarHBondContact O-CG 3.49Å; S27-Q31 PolarHBondContact O-N 2.88Å
28Y86.3Confident87.2Confident180 Ų18067.8 Ų67.871%0.70635%0.349SS*.Hα-helixtrans-55.7-38.1175.5177.1-100.2000112Q30 Q31 V32Y28-Q30 PolarHBondContact O-N 3.27Å; Y28-Q31 WeakPolarHBondContact O-CB 2.78Å; Y28-Q31 PolarHBondContact O-N 2.96Å; Y28-V32 HydrophobicContact CD1-CG2 4.28Å; Y28-V32 HydrophobicContact CE1-CG2 3.8Å; Y28-V32 HydrophobicContact CE2-CG2 4.22Å; Y28-V32 WeakPolarHBondContact O-CG2 3.35Å; Y28-V32 PolarHBondContact O-N 3.48Å
29E84.4Confident87.6Confident69 Ų6968.8 Ų68.832%0.32236%0.358SS..Hα-helixtrans-60.5-45.6177.2-170.5-174.616000111.7S27 Q31 V32 R33 T298S27-E29 PolarHBondContact O-N 3.02Å; E29-Q31 VanDerWaalsContact C-N 3.35Å; E29-V32 PolarHBondContact O-N 3.49Å; E29-R33 WeakPolarHBondContact O-CG 3.46Å; E29-R33 PolarHBondContact O-N 3.36Å; E29-R33 IonicContact OE1-CZ 3.13Å; E29-R33 VanDerWaalsContact OE1-CZ 3.28Å; E29-R33 IonicContact OE1-NE 3.88Å; E29-R33 PolarHBondContact OE1-NE 3.49Å; E29-R33 IonicContact OE1-NH2 3.89Å; E29-R33 PolarHBondContact OE1-NH2 3.46Å; E29-T298 HydrophobicContact CG-CG2 4.15Å; E29-T298 WeakPolarHBondContact OE1-CG2 3.34Å
30Q86Confident87.9Confident11 Ų1167.4 Ų67.45%0.05135%0.349CS..Hα-helixtrans-69.2-34.2179.3-164.856.835.100112.1Q18 L21 L22 S27 Y28 R33 C34Q18-Q30 PolarHBondContact O-NE2 3.37Å; L21-Q30 HydrophobicContact CB-CG 4.37Å; L22-Q30 HydrophobicContact CB-CG 4.04Å; L22-Q30 HydrophobicContact CD1-CB 4.24Å; L22-Q30 HydrophobicContact CD1-CG 4.27Å; S27-Q30 PolarHBondContact O-N 2.85Å; S27-Q30 VanDerWaalsContact O-N 3.12Å; S27-Q30 WeakPolarHBondContact OG-CB 3.25Å; S27-Q30 PolarHBondContact OG-N 3.29Å; Y28-Q30 PolarHBondContact O-N 3.27Å; Q30-R33 PolarHBondContact O-N 2.94Å; Q30-C34 PolarHBondContact O-N 3.08Å
31Q88.3Confident88.2Confident85 Ų8563.8 Ų63.840%0.39733%0.329SS..Hα-helixtrans-60-49.3172.6-70.3177.919.500111.4L22 S26 S27 Y28 E29 R33 C34 I35L22-Q31 HydrophobicContact CD1-CB 4.29Å; L22-Q31 HydrophobicContact CD1-CG 3.43Å; L22-Q31 VanDerWaalsContact CD1-CG 3.43Å; L22-Q31 HydrophobicContact CD2-CG 4.3Å; S26-Q31 PolarHBondContact O-NE2 3.23Å; S26-Q31 VanDerWaalsContact O-NE2 3.13Å; S27-Q31 WeakPolarHBondContact O-CG 3.49Å; S27-Q31 PolarHBondContact O-N 2.88Å; Y28-Q31 WeakPolarHBondContact O-CB 2.78Å; Y28-Q31 PolarHBondContact O-N 2.96Å; E29-Q31 VanDerWaalsContact C-N 3.35Å; Q31-R33 VanDerWaalsContact C-N 3.34Å; Q31-R33 PolarHBondContact O-N 3.26Å; Q31-C34 PolarHBondContact O-N 3.3Å; Q31-I35 WeakPolarHBondContact O-CG1 3.42Å; Q31-I35 PolarHBondContact O-N 3.22Å
32V88.5Confident88.6Confident42 Ų4264.9 Ų64.926%0.25533%0.331SS..Hα-helixtrans-60-44.7178.3172.70000110.9Y28 E29 C34 I35 V36 V300Y28-V32 HydrophobicContact CD1-CG2 4.28Å; Y28-V32 HydrophobicContact CE1-CG2 3.8Å; Y28-V32 HydrophobicContact CE2-CG2 4.22Å; Y28-V32 WeakPolarHBondContact O-CG2 3.35Å; Y28-V32 PolarHBondContact O-N 3.48Å; E29-V32 PolarHBondContact O-N 3.49Å; V32-C34 PolarHBondContact O-N 2.93Å; V32-I35 PolarHBondContact O-N 2.89Å; V32-V36 HydrophobicContact CG1-CG2 4.17Å; V32-V36 WeakPolarHBondContact O-CB 3.43Å; V32-V36 VanDerWaalsContact O-CG2 3.31Å; V32-V36 WeakPolarHBondContact O-CG2 3.28Å; V32-V36 PolarHBondContact O-N 3.16Å; V32-V300 HydrophobicContact CG1-CG1 4.42Å
33R86.6Confident89Confident50 Ų5065.1 Ų65.119%0.18933%0.329CS..Hα-helixtrans-59.6-44.2177.4-71.3171.4-179.7-154.40.4112.7Q18 E29 Q30 Q31 S37 V300Q18-R33 HydrophobicContact CB-CB 4.49Å; E29-R33 WeakPolarHBondContact O-CG 3.46Å; E29-R33 PolarHBondContact O-N 3.36Å; E29-R33 IonicContact OE1-CZ 3.13Å; E29-R33 VanDerWaalsContact OE1-CZ 3.28Å; E29-R33 IonicContact OE1-NE 3.88Å; E29-R33 PolarHBondContact OE1-NE 3.49Å; E29-R33 IonicContact OE1-NH2 3.89Å; E29-R33 PolarHBondContact OE1-NH2 3.46Å; Q30-R33 PolarHBondContact O-N 2.94Å; Q31-R33 VanDerWaalsContact C-N 3.34Å; Q31-R33 PolarHBondContact O-N 3.26Å; R33-S37 WeakPolarHBondContact O-CB 3.29Å; R33-S37 PolarHBondContact O-N 3.47Å; R33-V300 HydrophobicContact CG-CG2 3.77Å
34C89.8Confident89.4Confident17 Ų1757.7 Ų57.712%0.11530%0.297CS..Hα-helixtrans-64-45.1176.8169.90000111.7C19 L22 Q30 Q31 V32 S37 T38C19-C34 WeakPolarHBondContact CA-SG 3.39Å; C19-C34 HydrophobicContact CB-CB 4.06Å; C19-C34 WeakPolarHBondContact CB-SG 3.38Å; C19-C34 VanDerWaalsContact SG-CA 3.57Å; C19-C34 WeakPolarHBondContact SG-CB 3.41Å; C19-C34 CovalentContact SG-SG 2.05Å; C19-C34 PolarHBondContact SG-SG 3.36Å; L22-C34 HydrophobicContact CD2-CB 4.11Å; Q30-C34 PolarHBondContact O-N 3.08Å; Q31-C34 PolarHBondContact O-N 3.3Å; V32-C34 PolarHBondContact O-N 2.93Å; C34-S37 PolarHBondContact O-N 2.93Å; C34-T38 WeakPolarHBondContact O-CB 3.3Å; C34-T38 PolarHBondContact O-N 3.2Å; C34-T38 PolarHBondContact O-OG1 3.22Å
35I90.9Very high89.7Confident106 Ų10651 Ų5154%0.54426%0.264SS..Hα-helixtrans-61-51.4178.6-68.4167.6000110.5Q31 V32 S37 T38 V39Q31-I35 WeakPolarHBondContact O-CG1 3.42Å; Q31-I35 PolarHBondContact O-N 3.22Å; V32-I35 PolarHBondContact O-N 2.89Å; I35-S37 PolarHBondContact O-N 2.9Å; I35-T38 PolarHBondContact O-N 3.46Å; I35-V39 HydrophobicContact CG2-CG2 4.3Å; I35-V39 WeakPolarHBondContact O-CG2 3.43Å; I35-V39 PolarHBondContact O-N 3.48Å
36V90Very high90.2Very high25 Ų2553 Ų5315%0.15227%0.266CS..Hα-helixtrans-61.4-46.9-179.2171.90000110.9V32 T38 V39 V40 V300 D303V32-V36 HydrophobicContact CG1-CG2 4.17Å; V32-V36 WeakPolarHBondContact O-CB 3.43Å; V32-V36 VanDerWaalsContact O-CG2 3.31Å; V32-V36 WeakPolarHBondContact O-CG2 3.28Å; V32-V36 PolarHBondContact O-N 3.16Å; V36-T38 VanDerWaalsContact C-N 3.3Å; V36-T38 PolarHBondContact O-N 2.85Å; V36-V39 PolarHBondContact O-N 3.5Å; V36-V40 HydrophobicContact CG1-CG2 4.3Å; V36-V40 WeakPolarHBondContact O-CB 3.48Å; V36-V40 WeakPolarHBondContact O-CG2 3.4Å; V36-V40 PolarHBondContact O-N 3.31Å; V36-V300 HydrophobicContact CG1-CG1 4.42Å; V36-V300 HydrophobicContact CG2-CG1 4.09Å; V36-D303 HydrophobicContact CG1-CB 3.62Å
37S88.8Confident90.8Very high10 Ų1049.9 Ų49.97%0.0724%0.243CC..Hα-helixtrans-56.5-44.6176.1-179.80000111.8V15 R33 C34 I35 S41V15-S37 PolarHBondContact O-OG 3.41Å; R33-S37 WeakPolarHBondContact O-CB 3.29Å; R33-S37 PolarHBondContact O-N 3.47Å; C34-S37 PolarHBondContact O-N 2.93Å; I35-S37 PolarHBondContact O-N 2.9Å; S37-S41 VanDerWaalsContact O-CB 3.24Å; S37-S41 WeakPolarHBondContact O-CB 3.37Å; S37-S41 PolarHBondContact O-N 3.5Å; S37-S41 PolarHBondContact O-OG 3.25Å
38T91.4Very high91Very high43 Ų4348.1 Ų48.126%0.26423%0.231SC..Hα-helixtrans-66.3-48.2179.7-57.90000111.5C34 I35 V36 S41 F42 Y107C34-T38 WeakPolarHBondContact O-CB 3.3Å; C34-T38 PolarHBondContact O-N 3.2Å; C34-T38 PolarHBondContact O-OG1 3.22Å; I35-T38 PolarHBondContact O-N 3.46Å; V36-T38 VanDerWaalsContact C-N 3.3Å; V36-T38 PolarHBondContact O-N 2.85Å; T38-S41 PolarHBondContact O-N 2.91Å; T38-F42 WeakPolarHBondContact O-CB 3.28Å; T38-F42 PolarHBondContact O-N 2.94Å; T38-Y107 HydrophobicContact CG2-CE2 4.15Å
39V92.9Very high91.3Very high67 Ų6740.4 Ų40.441%0.40620%0.202SC..Hα-helixtrans-61.7-47.5179.4170.60000110.8I35 V36 S41 F42 W43I35-V39 HydrophobicContact CG2-CG2 4.3Å; I35-V39 WeakPolarHBondContact O-CG2 3.43Å; I35-V39 PolarHBondContact O-N 3.48Å; V36-V39 PolarHBondContact O-N 3.5Å; V39-S41 VanDerWaalsContact C-N 3.33Å; V39-S41 PolarHBondContact O-N 3.41Å; V39-F42 PolarHBondContact O-N 2.92Å; V39-W43 WeakPolarHBondContact O-CB 3.49Å; V39-W43 VanDerWaalsContact O-CD1 3.29Å; V39-W43 PolarHBondContact O-N 2.84Å
40V92.6Very high91.7Very high3 Ų342.2 Ų42.22%0.01821%0.213CC..Hα-helixtrans-61.5-43.4178.3166.40000110.9V36 W43 C44 R103 D303 F307 Y310V36-V40 HydrophobicContact CG1-CG2 4.3Å; V36-V40 WeakPolarHBondContact O-CB 3.48Å; V36-V40 WeakPolarHBondContact O-CG2 3.4Å; V36-V40 PolarHBondContact O-N 3.31Å; V40-W43 WeakPolarHBondContact O-CB 3.44Å; V40-W43 PolarHBondContact O-N 3.21Å; V40-C44 WeakPolarHBondContact O-CB 3.39Å; V40-C44 PolarHBondContact O-N 3.18Å; V40-C44 PolarHBondContact O-SG 3.3Å; V40-R103 VanDerWaalsContact CG1-NH1 3.29Å; V40-D303 HydrophobicContact CG2-CB 4.38Å; V40-F307 HydrophobicContact CG2-CD2 4.48Å; V40-Y310 HydrophobicContact CG1-CE2 3.76Å
41S92.9Very high92.2Very high0 Ų045 Ų450%023%0.225CC..Hα-helixtrans-70.8-37.4-177.7-55.50000112.4V15 S37 T38 V39 W43 C44 G45V15-S41 WeakPolarHBondContact CG1-OG 3.45Å; V15-S41 VanDerWaalsContact CG2-OG 3.29Å; V15-S41 WeakPolarHBondContact CG2-OG 3.42Å; S37-S41 VanDerWaalsContact O-CB 3.24Å; S37-S41 WeakPolarHBondContact O-CB 3.37Å; S37-S41 PolarHBondContact O-N 3.5Å; S37-S41 PolarHBondContact O-OG 3.25Å; T38-S41 PolarHBondContact O-N 2.91Å; V39-S41 VanDerWaalsContact C-N 3.33Å; V39-S41 PolarHBondContact O-N 3.41Å; S41-W43 VanDerWaalsContact C-N 3.35Å; S41-C44 PolarHBondContact O-N 3Å; S41-G45 PolarHBondContact O-N 2.7Å
42F94.4Very high92.5Very high90 Ų9040.9 Ų40.940%0.39521%0.207SC..Hα-helixtrans-57.9-47.8169.7173.7-90.8000111.3T38 V39 C44 G45 Y46 V47 Y107T38-F42 WeakPolarHBondContact O-CB 3.28Å; T38-F42 PolarHBondContact O-N 2.94Å; V39-F42 PolarHBondContact O-N 2.92Å; F42-C44 PolarHBondContact O-N 2.95Å; F42-G45 PolarHBondContact O-N 3.18Å; F42-Y46 AromaticContact CD2-CD2 3.59Å; F42-Y46 HydrophobicContact CD2-CD2 3.59Å; F42-Y46 HydrophobicContact CD2-CE2 4.04Å; F42-Y46 AromaticContact CE2-CD2 3.7Å; F42-Y46 HydrophobicContact CE2-CD2 3.7Å; F42-Y46 HydrophobicContact CE2-CE2 4.26Å; F42-Y46 HydrophobicContact CE2-CG 4.39Å; F42-Y46 HydrophobicContact CG-CD2 4.28Å; F42-Y46 HydrophobicContact CZ-CD2 4.47Å; F42-Y46 PolarHBondContact O-N 3.37Å; F42-V47 HydrophobicContact CD1-CG2 4.4Å; F42-V47 HydrophobicContact CE1-CG2 3.88Å; F42-Y107 HydrophobicContact CB-CE1 3.9Å; F42-Y107 HydrophobicContact CD2-CE1 4.21Å
43W94.5Very high92.8Very high53 Ų5342.7 Ų42.720%0.20121%0.214CC..Iπ-helixtrans-60.2-45.3176.4-94.178.3000112.2V39 V40 S41 G45 V47 L48 F307 L311 I314V39-W43 WeakPolarHBondContact O-CB 3.49Å; V39-W43 VanDerWaalsContact O-CD1 3.29Å; V39-W43 PolarHBondContact O-N 2.84Å; V40-W43 WeakPolarHBondContact O-CB 3.44Å; V40-W43 PolarHBondContact O-N 3.21Å; S41-W43 VanDerWaalsContact C-N 3.35Å; W43-G45 VanDerWaalsContact C-N 3.33Å; W43-G45 PolarHBondContact O-N 3.41Å; W43-V47 HydrophobicContact CD2-CB 4.2Å; W43-V47 HydrophobicContact CD2-CG1 4.21Å; W43-V47 HydrophobicContact CD2-CG2 4.41Å; W43-V47 HydrophobicContact CE3-CB 4.02Å; W43-V47 HydrophobicContact CE3-CG1 3.73Å; W43-V47 HydrophobicContact CH2-CG1 4.15Å; W43-V47 HydrophobicContact CZ3-CG1 3.72Å; W43-V47 PolarHBondContact O-N 3.43Å; W43-V47 VanDerWaalsContact O-N 3.17Å; W43-L48 HydrophobicContact CE3-CG 4.47Å; W43-L48 WeakPolarHBondContact O-CB 3.39Å; W43-L48 PolarHBondContact O-N 2.92Å; W43-F307 AromaticContact CD1-CE2 3.88Å; W43-F307 AromaticContact CD2-CE2 3.79Å; W43-F307 HydrophobicContact CD2-CE2 3.79Å; W43-F307 HydrophobicContact CD2-CZ 4.3Å; W43-F307 AromaticContact CE2-CE2 3.8Å; W43-F307 AromaticContact CE2-CZ 3.91Å; W43-F307 HydrophobicContact CE3-CE2 4.36Å; W43-F307 AromaticContact CG-CE2 3.85Å; W43-F307 HydrophobicContact CG-CE2 3.85Å; W43-F307 HydrophobicContact CZ2-CE2 4.41Å; W43-F307 HydrophobicContact CZ2-CZ 4.09Å; W43-F307 AromaticContact NE1-CE2 3.83Å; W43-L311 HydrophobicContact CH2-CD2 3.79Å; W43-L311 HydrophobicContact CZ3-CD2 4.18Å; W43-I314 HydrophobicContact CH2-CD1 3.69Å; W43-I314 HydrophobicContact CZ3-CD1 3.4Å; W43-I314 VanDerWaalsContact CZ3-CD1 3.4Å; W43-I314 HydrophobicContact CZ3-CG1 4.47Å
44C94.8Very high93.2Very high1 Ų144.3 Ų44.31%0.00723%0.226CC..Iπ-helixtrans-64.8-36177.5-66.60000112.6V40 S41 F42 P49 F100 R103 Y310V40-C44 WeakPolarHBondContact O-CB 3.39Å; V40-C44 PolarHBondContact O-N 3.18Å; V40-C44 PolarHBondContact O-SG 3.3Å; S41-C44 PolarHBondContact O-N 3Å; F42-C44 PolarHBondContact O-N 2.95Å; C44-P49 VanDerWaalsContact O-CD 3.27Å; C44-P49 WeakPolarHBondContact O-CD 3.17Å; C44-P49 WeakPolarHBondContact O-CG 3.38Å; C44-F100 WeakPolarHBondContact O-CD2 3.23Å; C44-R103 HydrophobicContact CB-CB 4.22Å; C44-Y310 VanDerWaalsContact SG-CZ 3.59Å; C44-Y310 PolarHBondContact SG-OH 2.97Å
45G94.4Very high93.5Very high10 Ų1043.5 Ų43.510%0.10322%0.22CC..Iπ-helixtrans-80.1-40.2-176.100000114.4S41 F42 W43 G104S41-G45 PolarHBondContact O-N 2.7Å; F42-G45 PolarHBondContact O-N 3.18Å; W43-G45 VanDerWaalsContact C-N 3.33Å; W43-G45 PolarHBondContact O-N 3.41Å; G45-G104 VanDerWaalsContact CA-CA 3.46Å
46Y95Very high93.8Very high119 Ų11938.8 Ų38.847%0.46720%0.196SC..Iπ-helixtrans-115.1-43.1-169.2-63.9-71.4000114.1F42 Y107 V108F42-Y46 AromaticContact CD2-CD2 3.59Å; F42-Y46 HydrophobicContact CD2-CD2 3.59Å; F42-Y46 HydrophobicContact CD2-CE2 4.04Å; F42-Y46 AromaticContact CE2-CD2 3.7Å; F42-Y46 HydrophobicContact CE2-CD2 3.7Å; F42-Y46 HydrophobicContact CE2-CE2 4.26Å; F42-Y46 HydrophobicContact CE2-CG 4.39Å; F42-Y46 HydrophobicContact CG-CD2 4.28Å; F42-Y46 HydrophobicContact CZ-CD2 4.47Å; F42-Y46 PolarHBondContact O-N 3.37Å; Y46-Y107 HydrophobicContact CE2-CD1 4.12Å; Y46-Y107 AromaticContact CE2-CE1 3.93Å; Y46-Y107 HydrophobicContact CE2-CE1 3.93Å; Y46-V108 HydrophobicContact CD1-CG2 4.42Å; Y46-V108 HydrophobicContact CD2-CG2 4.42Å; Y46-V108 HydrophobicContact CE1-CG1 4.32Å; Y46-V108 HydrophobicContact CE1-CG2 3.94Å; Y46-V108 HydrophobicContact CE2-CG2 3.94Å
47V94.7Very high94.1Very high29 Ų2943 Ų4318%0.17622%0.216CC..Iπ-helixtrans-87-51.2-168.9-178.20000111.1F42 W43 L50 F51 I314F42-V47 HydrophobicContact CD1-CG2 4.4Å; F42-V47 HydrophobicContact CE1-CG2 3.88Å; W43-V47 HydrophobicContact CD2-CB 4.2Å; W43-V47 HydrophobicContact CD2-CG1 4.21Å; W43-V47 HydrophobicContact CD2-CG2 4.41Å; W43-V47 HydrophobicContact CE3-CB 4.02Å; W43-V47 HydrophobicContact CE3-CG1 3.73Å; W43-V47 HydrophobicContact CH2-CG1 4.15Å; W43-V47 HydrophobicContact CZ3-CG1 3.72Å; W43-V47 PolarHBondContact O-N 3.43Å; W43-V47 VanDerWaalsContact O-N 3.17Å; V47-L50 PolarHBondContact O-N 3.24Å; V47-F51 HydrophobicContact CG1-CD2 3.79Å; V47-F51 HydrophobicContact CG1-CE2 3.77Å; V47-F51 VanDerWaalsContact O-CD2 3.28Å; V47-F51 WeakPolarHBondContact O-CD2 3.24Å; V47-F51 PolarHBondContact O-N 2.98Å; V47-I314 HydrophobicContact CG1-CD1 4.25Å
48L93.1Very high94.3Very high1 Ų143.9 Ų43.91%0.00522%0.221CC..Hα-helixtrans-63.4-44.1-175.3-79-179.6000114.5W43 L50 F51 S52 I95 Y310W43-L48 HydrophobicContact CE3-CG 4.47Å; W43-L48 WeakPolarHBondContact O-CB 3.39Å; W43-L48 PolarHBondContact O-N 2.92Å; L48-L50 VanDerWaalsContact C-N 3.26Å; L48-L50 PolarHBondContact O-N 3.12Å; L48-F51 PolarHBondContact O-N 3.46Å; L48-S52 WeakPolarHBondContact O-CA 3.17Å; L48-S52 WeakPolarHBondContact O-CB 3.4Å; L48-S52 PolarHBondContact O-N 3.32Å; L48-S52 PolarHBondContact O-OG 3.24Å; L48-I95 HydrophobicContact CB-CG2 4.08Å; L48-I95 HydrophobicContact CD1-CG2 4.42Å; L48-I95 HydrophobicContact CD2-CD1 4.47Å; L48-Y310 HydrophobicContact CD1-CD1 3.18Å; L48-Y310 HydrophobicContact CD1-CD2 3.96Å; L48-Y310 HydrophobicContact CD1-CE1 3.62Å; L48-Y310 HydrophobicContact CD1-CE2 4.42Å; L48-Y310 HydrophobicContact CD1-CG 3.39Å; L48-Y310 HydrophobicContact CD2-CD1 4.32Å; L48-Y310 HydrophobicContact CD2-CG 4.21Å; L48-Y310 HydrophobicContact CG-CD1 4.31Å; L48-Y310 HydrophobicContact CG-CG 4.21Å
49P93.7Very high94.6Very high17 Ų1742 Ų4211%0.1121%0.209CC..Hα-helixtrans-59.3-39.7-177.8-26.737.9000111.8C44 S52 L53 W96 F100C44-P49 VanDerWaalsContact O-CD 3.27Å; C44-P49 WeakPolarHBondContact O-CD 3.17Å; C44-P49 WeakPolarHBondContact O-CG 3.38Å; P49-S52 PolarHBondContact O-OG 3.17Å; P49-L53 WeakPolarHBondContact O-CB 3.48Å; P49-L53 PolarHBondContact O-N 2.84Å; P49-W96 HydrophobicContact CB-CH2 3.85Å; P49-W96 HydrophobicContact CB-CZ2 4.2Å; P49-W96 HydrophobicContact CB-CZ3 4.47Å; P49-W96 WeakPolarHBondContact O-CZ2 3.28Å; P49-F100 HydrophobicContact CB-CD2 4.44Å; P49-F100 HydrophobicContact CB-CE2 4.3Å; P49-F100 HydrophobicContact CG-CD2 3.44Å; P49-F100 VanDerWaalsContact CG-CD2 3.44Å; P49-F100 HydrophobicContact CG-CE2 3.52Å; P49-F100 HydrophobicContact CG-CG 4.32Å; P49-F100 HydrophobicContact CG-CZ 4.45Å
50L93.3Very high94.7Very high107 Ų10741.9 Ų41.956%0.5621%0.206SC*.Hα-helixtrans-63.4-53.9179.3-177.665.9000112.2V47 L48V47-L50 PolarHBondContact O-N 3.24Å; L48-L50 VanDerWaalsContact C-N 3.26Å; L48-L50 PolarHBondContact O-N 3.12Å
51F94.7Very high94.8Very high69 Ų6944.6 Ų44.630%0.30322%0.216SC..Hα-helixtrans-74.2-37-177.3-67.5-62.3000112.7V47 L48 L53 I54 T55 I314 L317V47-F51 HydrophobicContact CG1-CD2 3.79Å; V47-F51 HydrophobicContact CG1-CE2 3.77Å; V47-F51 VanDerWaalsContact O-CD2 3.28Å; V47-F51 WeakPolarHBondContact O-CD2 3.24Å; V47-F51 PolarHBondContact O-N 2.98Å; L48-F51 PolarHBondContact O-N 3.46Å; F51-L53 VanDerWaalsContact C-N 3.33Å; F51-L53 PolarHBondContact O-N 3.23Å; F51-I54 PolarHBondContact O-N 3.32Å; F51-T55 WeakPolarHBondContact O-CG2 3.21Å; F51-T55 PolarHBondContact O-N 3.48Å; F51-T55 PolarHBondContact O-OG1 3.45Å; F51-I314 HydrophobicContact CB-CG1 4.19Å; F51-I314 HydrophobicContact CD2-CD1 3.85Å; F51-I314 HydrophobicContact CD2-CG1 4.06Å; F51-I314 HydrophobicContact CE2-CD1 4.17Å; F51-I314 HydrophobicContact CG-CD1 4.47Å; F51-I314 HydrophobicContact CG-CG1 4.22Å; F51-L317 HydrophobicContact CB-CD1 4.35Å; F51-L317 HydrophobicContact CD1-CD1 3.42Å; F51-L317 VanDerWaalsContact CD1-CD1 3.42Å; F51-L317 HydrophobicContact CE1-CD1 3.99Å; F51-L317 HydrophobicContact CG-CD1 4.15Å
52S95.1Very high94.8Very high0 Ų044.7 Ų44.70%022%0.217CC..Hα-helixtrans-66-34.9176.869.10000112L48 P49 T55 V56 W96L48-S52 WeakPolarHBondContact O-CA 3.17Å; L48-S52 WeakPolarHBondContact O-CB 3.4Å; L48-S52 PolarHBondContact O-N 3.32Å; L48-S52 PolarHBondContact O-OG 3.24Å; P49-S52 PolarHBondContact O-OG 3.17Å; S52-T55 WeakPolarHBondContact CA-OG1 3.49Å; S52-T55 PolarHBondContact O-N 3.45Å; S52-T55 PolarHBondContact O-OG1 2.78Å; S52-V56 VanDerWaalsContact O-CB 3.23Å; S52-V56 WeakPolarHBondContact O-CB 3.37Å; S52-V56 WeakPolarHBondContact O-CG2 3.25Å; S52-V56 PolarHBondContact O-N 3.06Å; S52-W96 PolarHBondContact OG-NE1 2.89Å
53L95.7Very high94.8Very high80 Ų8040.4 Ų40.442%0.41920%0.198SC..Hα-helixtrans-61.2-48.5175.3-17562.4000111.3P49 F51 T55 M57 W96P49-L53 WeakPolarHBondContact O-CB 3.48Å; P49-L53 PolarHBondContact O-N 2.84Å; F51-L53 VanDerWaalsContact C-N 3.33Å; F51-L53 PolarHBondContact O-N 3.23Å; L53-T55 PolarHBondContact O-N 2.91Å; L53-M57 HydrophobicContact CD1-CE 3.78Å; L53-M57 HydrophobicContact CD1-CG 4.22Å; L53-M57 WeakPolarHBondContact O-CB 3.36Å; L53-M57 WeakPolarHBondContact O-CG 3.28Å; L53-M57 PolarHBondContact O-N 3.34Å; L53-W96 HydrophobicContact CB-CZ2 4.03Å; L53-W96 HydrophobicContact CD1-CZ2 4.35Å
54I95Very high94.8Very high83 Ų8343.7 Ų43.743%0.42621%0.214SC..Hα-helixtrans-61.7-45.7179.8-63.8169.8000110.7F51 T58 L317F51-I54 PolarHBondContact O-N 3.32Å; I54-T58 VanDerWaalsContact O-CB 3.31Å; I54-T58 WeakPolarHBondContact O-CB 3.28Å; I54-T58 PolarHBondContact O-N 3.48Å; I54-T58 PolarHBondContact O-OG1 3.4Å; I54-L317 HydrophobicContact CB-CD2 4.45Å; I54-L317 HydrophobicContact CG2-CD2 3.96Å
55T95.6Very high94.7Very high0 Ų044.7 Ų44.70%022%0.218CC..Hα-helixtrans-67.8-47.3-178.449.90000111.7F51 S52 L53 M57 T58 N59 E316 L317 I320F51-T55 WeakPolarHBondContact O-CG2 3.21Å; F51-T55 PolarHBondContact O-N 3.48Å; F51-T55 PolarHBondContact O-OG1 3.45Å; S52-T55 WeakPolarHBondContact CA-OG1 3.49Å; S52-T55 PolarHBondContact O-N 3.45Å; S52-T55 PolarHBondContact O-OG1 2.78Å; L53-T55 PolarHBondContact O-N 2.91Å; T55-M57 PolarHBondContact O-N 2.9Å; T55-T58 PolarHBondContact O-N 2.86Å; T55-N59 WeakPolarHBondContact O-CB 3.43Å; T55-N59 PolarHBondContact O-N 3.13Å; T55-N59 PolarHBondContact O-ND2 2.97Å; T55-E316 HydrophobicContact CG2-CB 3.81Å; T55-L317 HydrophobicContact CG2-CD2 3.5Å; T55-L317 HydrophobicContact CG2-CG 3.79Å; T55-I320 HydrophobicContact CG2-CD1 4.03Å
56V96.7Very high94.5Very high7 Ų744.3 Ų44.34%0.04221%0.213CC..Hα-helixtrans-57.3-51.4176.1168.10000110.7S52 T58 N59 L60 N91 I92S52-V56 VanDerWaalsContact O-CB 3.23Å; S52-V56 WeakPolarHBondContact O-CB 3.37Å; S52-V56 WeakPolarHBondContact O-CG2 3.25Å; S52-V56 PolarHBondContact O-N 3.06Å; V56-T58 VanDerWaalsContact C-N 3.35Å; V56-T58 PolarHBondContact O-N 2.96Å; V56-N59 PolarHBondContact O-N 3.39Å; V56-L60 HydrophobicContact CG1-CD1 3.79Å; V56-L60 HydrophobicContact CG1-CG 4.32Å; V56-L60 WeakPolarHBondContact O-CB 3.33Å; V56-L60 VanDerWaalsContact O-CG 3.24Å; V56-L60 WeakPolarHBondContact O-CG 3.39Å; V56-L60 PolarHBondContact O-N 2.93Å; V56-N91 HydrophobicContact CG2-CB 3.81Å; V56-I92 HydrophobicContact CG1-CD1 3.93Å; V56-I92 HydrophobicContact CG1-CG1 3.96Å; V56-I92 HydrophobicContact CG2-CG1 4.29Å
57M95.8Very high94.4Very high115 Ų11542.7 Ų42.757%0.56721%0.212SC*.Hα-helixtrans-61.2-43.9-178.8-69.1-64.6170.200112L53 T55 Y61L53-M57 HydrophobicContact CD1-CE 3.78Å; L53-M57 HydrophobicContact CD1-CG 4.22Å; L53-M57 WeakPolarHBondContact O-CB 3.36Å; L53-M57 WeakPolarHBondContact O-CG 3.28Å; L53-M57 PolarHBondContact O-N 3.34Å; T55-M57 PolarHBondContact O-N 2.9Å; M57-Y61 WeakPolarHBondContact O-CB 3.4Å; M57-Y61 PolarHBondContact O-N 3.32Å
58T94.5Very high94.2Very high28 Ų2845.8 Ų45.817%0.17223%0.23CC..Hα-helixtrans-70.5-41.3-179.2-53.10000111.9I54 T55 V56 Y61 I62 I320I54-T58 VanDerWaalsContact O-CB 3.31Å; I54-T58 WeakPolarHBondContact O-CB 3.28Å; I54-T58 PolarHBondContact O-N 3.48Å; I54-T58 PolarHBondContact O-OG1 3.4Å; T55-T58 PolarHBondContact O-N 2.86Å; V56-T58 VanDerWaalsContact C-N 3.35Å; V56-T58 PolarHBondContact O-N 2.96Å; T58-Y61 WeakPolarHBondContact O-CB 3.42Å; T58-Y61 PolarHBondContact O-N 3.39Å; T58-I62 HydrophobicContact CG2-CD1 3.98Å; T58-I62 HydrophobicContact CG2-CG1 4.49Å; T58-I62 VanDerWaalsContact O-CG1 3.26Å; T58-I62 WeakPolarHBondContact O-CG1 3.42Å; T58-I62 PolarHBondContact O-N 3.35Å; T58-I320 HydrophobicContact CG2-CB 4.45Å; T58-I320 HydrophobicContact CG2-CD1 3.88Å; T58-I320 HydrophobicContact CG2-CG1 3.89Å; T58-I320 HydrophobicContact CG2-CG2 3.72Å
59N96.2Very high94Very high4 Ų450.1 Ų50.12%0.02125%0.247CC..Hα-helixtrans-67-41.5178.4-82.1-23.2000112T55 V56 Y61 I62 G63 S84 S87 A88 E316T55-N59 WeakPolarHBondContact O-CB 3.43Å; T55-N59 PolarHBondContact O-N 3.13Å; T55-N59 PolarHBondContact O-ND2 2.97Å; V56-N59 PolarHBondContact O-N 3.39Å; N59-Y61 VanDerWaalsContact C-N 3.32Å; N59-Y61 PolarHBondContact O-N 3.35Å; N59-I62 PolarHBondContact O-N 3.34Å; N59-G63 PolarHBondContact O-N 2.89Å; N59-S84 WeakPolarHBondContact CB-O 3.47Å; N59-S84 WeakPolarHBondContact O-CB 3.41Å; N59-S84 PolarHBondContact OD1-OG 3.39Å; N59-S84 VanDerWaalsContact OD1-OG 3.08Å; N59-S87 PolarHBondContact ND2-OG 2.77Å; N59-A88 HydrophobicContact CB-CB 4.09Å; N59-E316 PolarHBondContact ND2-OE2 3.45Å
60L96.4Very high93.7Very high64 Ų6450.7 Ų50.734%0.33525%0.253SS..Hα-helixtrans-60-43.8171.9-72.6175.5000111.2V56 G63 F64 L85 A88V56-L60 HydrophobicContact CG1-CD1 3.79Å; V56-L60 HydrophobicContact CG1-CG 4.32Å; V56-L60 WeakPolarHBondContact O-CB 3.33Å; V56-L60 VanDerWaalsContact O-CG 3.24Å; V56-L60 WeakPolarHBondContact O-CG 3.39Å; V56-L60 PolarHBondContact O-N 2.93Å; L60-G63 PolarHBondContact O-N 3.41Å; L60-F64 VanDerWaalsContact O-CB 3.28Å; L60-F64 WeakPolarHBondContact O-CB 3.34Å; L60-F64 PolarHBondContact O-N 2.93Å; L60-L85 HydrophobicContact CD2-CD2 4.34Å; L60-A88 HydrophobicContact CD2-CB 3.76Å; L60-A88 HydrophobicContact CG-CB 3.81Å
61Y94.7Very high93.3Very high59 Ų5952.9 Ų52.923%0.23127%0.265CS..Hα-helixtrans-60.4-47.4175.7176.3-90.9000112.2M57 T58 N59 G63 F64 Y65 L330 S333 L334 T337M57-Y61 WeakPolarHBondContact O-CB 3.4Å; M57-Y61 PolarHBondContact O-N 3.32Å; T58-Y61 WeakPolarHBondContact O-CB 3.42Å; T58-Y61 PolarHBondContact O-N 3.39Å; N59-Y61 VanDerWaalsContact C-N 3.32Å; N59-Y61 PolarHBondContact O-N 3.35Å; Y61-G63 VanDerWaalsContact C-N 3.32Å; Y61-G63 PolarHBondContact O-N 3.33Å; Y61-F64 PolarHBondContact O-N 3.03Å; Y61-Y65 WeakPolarHBondContact O-CB 3.38Å; Y61-Y65 PolarHBondContact O-N 2.91Å; Y61-L330 HydrophobicContact CD1-CD1 4.37Å; Y61-L330 HydrophobicContact CE1-CD1 4.06Å; Y61-S333 VanDerWaalsContact OH-C 3.29Å; Y61-S333 WeakPolarHBondContact OH-CB 3.14Å; Y61-S333 PolarHBondContact OH-O 3.19Å; Y61-S333 PolarHBondContact OH-OG 3.41Å; Y61-L334 HydrophobicContact CD1-CD2 3.57Å; Y61-L334 HydrophobicContact CD1-CG 4.27Å; Y61-L334 HydrophobicContact CE1-CD2 3.42Å; Y61-L334 VanDerWaalsContact CE1-CD2 3.42Å; Y61-L334 HydrophobicContact CE1-CG 3.75Å; Y61-L334 HydrophobicContact CG-CD2 4.35Å; Y61-T337 PolarHBondContact OH-OG1 2.88Å; Y61-T337 VanDerWaalsContact OH-OG1 3.06Å
62I93.1Very high92.8Very high3 Ų356.1 Ų56.12%0.01528%0.279CS..Hα-helixtrans-58.9-46.2177.9-70.4164.5000110.6T58 N59 T66 I80 Y323 L330T58-I62 HydrophobicContact CG2-CD1 3.98Å; T58-I62 HydrophobicContact CG2-CG1 4.49Å; T58-I62 VanDerWaalsContact O-CG1 3.26Å; T58-I62 WeakPolarHBondContact O-CG1 3.42Å; T58-I62 PolarHBondContact O-N 3.35Å; N59-I62 PolarHBondContact O-N 3.34Å; I62-T66 WeakPolarHBondContact O-CB 3.26Å; I62-T66 PolarHBondContact O-N 2.86Å; I62-T66 VanDerWaalsContact O-N 3.08Å; I62-T66 PolarHBondContact O-OG1 3.43Å; I62-I80 HydrophobicContact CG2-CG2 4.37Å; I62-Y323 HydrophobicContact CD1-CD2 4.08Å; I62-L330 HydrophobicContact CD1-CD2 4.1Å; I62-L330 HydrophobicContact CG1-CD1 3.81Å; I62-L330 HydrophobicContact CG1-CD2 3.84Å; I62-L330 HydrophobicContact CG1-CG 4.42Å
63G94.4Very high92.4Very high0 Ų056.2 Ų56.20%028%0.279CS..Hα-helixtrans-57.9-58.5177.200000112.4N59 L60 Y61 Y65 T66 I67N59-G63 PolarHBondContact O-N 2.89Å; L60-G63 PolarHBondContact O-N 3.41Å; Y61-G63 VanDerWaalsContact C-N 3.32Å; Y61-G63 PolarHBondContact O-N 3.33Å; G63-Y65 PolarHBondContact O-N 3.2Å; G63-T66 PolarHBondContact O-N 3.26Å; G63-I67 WeakPolarHBondContact O-CG1 3.43Å; G63-I67 PolarHBondContact O-N 3.11Å; G63-I67 VanDerWaalsContact O-N 3.1Å
64F93.6Very high92.1Very high121 Ų12154.3 Ų54.353%0.53127%0.272SS..Hα-helixtrans-59.4-46.9-179.4-178.9-101.8000112.3L60 Y61 T66 I67 V68L60-F64 VanDerWaalsContact O-CB 3.28Å; L60-F64 WeakPolarHBondContact O-CB 3.34Å; L60-F64 PolarHBondContact O-N 2.93Å; Y61-F64 PolarHBondContact O-N 3.03Å; F64-T66 VanDerWaalsContact C-N 3.27Å; F64-T66 PolarHBondContact O-N 2.93Å; F64-I67 PolarHBondContact O-N 3.09Å; F64-V68 HydrophobicContact CD1-CG2 4.09Å; F64-V68 HydrophobicContact CD2-CG2 4.28Å; F64-V68 HydrophobicContact CE1-CG2 3.66Å; F64-V68 HydrophobicContact CE2-CG2 3.86Å; F64-V68 HydrophobicContact CG-CG2 4.39Å; F64-V68 HydrophobicContact CZ-CG2 3.53Å; F64-V68 WeakPolarHBondContact O-CG2 3.32Å; F64-V68 PolarHBondContact O-N 2.99Å
65Y92.1Very high91.8Very high23 Ų2351.9 Ų51.99%0.0926%0.257CS..Hα-helixtrans-59.6-38.3178.8177.6-103000112.4Y61 G63 R69 M73 L329 L330Y61-Y65 WeakPolarHBondContact O-CB 3.38Å; Y61-Y65 PolarHBondContact O-N 2.91Å; G63-Y65 PolarHBondContact O-N 3.2Å; Y65-R69 PolarHBondContact O-N 3.46Å; Y65-R69 PolarHBondContact OH-NH1 3.39Å; Y65-M73 HydrophobicContact CD1-CE 3.92Å; Y65-M73 HydrophobicContact CE1-CE 3.42Å; Y65-M73 VanDerWaalsContact CE1-CE 3.42Å; Y65-L329 PolarHBondContact OH-O 3.35Å; Y65-L330 HydrophobicContact CD1-CD1 4.18Å
66T91.9Very high91.6Very high1 Ų152.5 Ų52.51%0.00626%0.261CS..Hα-helixtrans-67.3-42.7177.6-590000111.5I62 G63 F64 R69 A70 M73 I77 W169I62-T66 WeakPolarHBondContact O-CB 3.26Å; I62-T66 PolarHBondContact O-N 2.86Å; I62-T66 VanDerWaalsContact O-N 3.08Å; I62-T66 PolarHBondContact O-OG1 3.43Å; G63-T66 PolarHBondContact O-N 3.26Å; F64-T66 VanDerWaalsContact C-N 3.27Å; F64-T66 PolarHBondContact O-N 2.93Å; T66-R69 CarbonylContact O-C 3.6Å; T66-R69 PolarHBondContact O-N 3.48Å; T66-A70 WeakPolarHBondContact O-CA 3.43Å; T66-A70 PolarHBondContact O-N 2.97Å; T66-A70 VanDerWaalsContact O-N 3.09Å; T66-M73 HydrophobicContact CG2-CB 4.28Å; T66-M73 HydrophobicContact CG2-CG 4.02Å; T66-I77 HydrophobicContact CG2-CG2 3.8Å; T66-I77 WeakPolarHBondContact OG1-CG2 3.32Å; T66-W169 HydrophobicContact CG2-CH2 4.25Å; T66-W169 HydrophobicContact CG2-CZ2 4.31Å
67I92.1Very high91.4Very high85 Ų8552.8 Ų52.844%0.43626%0.261SS..Hα-helixtrans-64.6-50.2178.2-68.2169.7000110.7G63 F64 R69 A70 L85 W169G63-I67 WeakPolarHBondContact O-CG1 3.43Å; G63-I67 PolarHBondContact O-N 3.11Å; G63-I67 VanDerWaalsContact O-N 3.1Å; F64-I67 PolarHBondContact O-N 3.09Å; I67-R69 PolarHBondContact O-N 2.89Å; I67-R69 VanDerWaalsContact O-N 3.15Å; I67-A70 WeakPolarHBondContact O-CB 3.21Å; I67-A70 PolarHBondContact O-N 3.44Å; I67-A70 VanDerWaalsContact O-N 3.11Å; I67-L85 HydrophobicContact CD1-CD1 3.68Å; I67-W169 HydrophobicContact CG1-CH2 3.99Å; I67-W169 HydrophobicContact CG1-CZ3 4.35Å
68V90.9Very high91.2Very high94 Ų9447.3 Ų47.357%0.5723%0.234SC*.Hα-helixtrans-60.1-30.1-179.8171.30000112F64F64-V68 HydrophobicContact CD1-CG2 4.09Å; F64-V68 HydrophobicContact CD2-CG2 4.28Å; F64-V68 HydrophobicContact CE1-CG2 3.66Å; F64-V68 HydrophobicContact CE2-CG2 3.86Å; F64-V68 HydrophobicContact CG-CG2 4.39Å; F64-V68 HydrophobicContact CZ-CG2 3.53Å; F64-V68 WeakPolarHBondContact O-CG2 3.32Å; F64-V68 PolarHBondContact O-N 2.99Å
69R89.4Confident91.3Very high93 Ų9346.2 Ų46.235%0.35123%0.227SC..THydrogen-bonded Turntrans-109.331.2179.1-66.3-174170.1-164.7-7113.1Y65 T66 I67 N71 K72 M73Y65-R69 PolarHBondContact O-N 3.46Å; Y65-R69 PolarHBondContact OH-NH1 3.39Å; T66-R69 CarbonylContact O-C 3.6Å; T66-R69 PolarHBondContact O-N 3.48Å; I67-R69 PolarHBondContact O-N 2.89Å; I67-R69 VanDerWaalsContact O-N 3.15Å; R69-N71 PolarHBondContact O-N 3.41Å; R69-K72 PolarHBondContact O-N 2.87Å; R69-M73 HydrophobicContact CB-CE 3.41Å; R69-M73 VanDerWaalsContact CB-CE 3.41Å; R69-M73 HydrophobicContact CB-CG 4.46Å; R69-M73 HydrophobicContact CG-CE 4.27Å; R69-M73 WeakPolarHBondContact O-CG 3.31Å; R69-M73 PolarHBondContact O-N 3.19Å
70A87Confident91.2Very high28 Ų2846.3 Ų46.323%0.23123%0.228CC..G310 helixtrans-46.1-40.4-172.500000114.9T66 I67 K72 W169T66-A70 WeakPolarHBondContact O-CA 3.43Å; T66-A70 PolarHBondContact O-N 2.97Å; T66-A70 VanDerWaalsContact O-N 3.09Å; I67-A70 WeakPolarHBondContact O-CB 3.21Å; I67-A70 PolarHBondContact O-N 3.44Å; I67-A70 VanDerWaalsContact O-N 3.11Å; A70-K72 VanDerWaalsContact C-N 3.35Å; A70-K72 PolarHBondContact O-N 2.85Å; A70-W169 HydrophobicContact CB-CH2 4.43Å; A70-W169 HydrophobicContact CB-CZ2 3.5Å; A70-W169 PolarHBondContact O-NE1 3.44Å
71N84.7Confident91.1Very high153 Ų15343.2 Ų43.282%0.81821%0.212SC*.G310 helixtrans-72.5-23.5-177.6-65.5-23.2000114.2R69R69-N71 PolarHBondContact O-N 3.41Å
72K84.6Confident91.2Very high138 Ų13840.4 Ų40.460%0.620%0.201SC*.G310 helixtrans-95.8-9.7-176.4-65.3-178.6-179.6176.50112.5R69 A70R69-K72 PolarHBondContact O-N 2.87Å; A70-K72 VanDerWaalsContact C-N 3.35Å; A70-K72 PolarHBondContact O-N 2.85Å
73M86.6Confident91.4Very high1 Ų140.6 Ų40.61%0.00520%0.201CC..  trans-86.3137.8-171.6-65.1-60.7159.700112.8Y65 T66 R69 I77Y65-M73 HydrophobicContact CD1-CE 3.92Å; Y65-M73 HydrophobicContact CE1-CE 3.42Å; Y65-M73 VanDerWaalsContact CE1-CE 3.42Å; T66-M73 HydrophobicContact CG2-CB 4.28Å; T66-M73 HydrophobicContact CG2-CG 4.02Å; R69-M73 HydrophobicContact CB-CE 3.41Å; R69-M73 VanDerWaalsContact CB-CE 3.41Å; R69-M73 HydrophobicContact CB-CG 4.46Å; R69-M73 HydrophobicContact CG-CE 4.27Å; R69-M73 WeakPolarHBondContact O-CG 3.31Å; R69-M73 PolarHBondContact O-N 3.19Å; M73-I77 HydrophobicContact CB-CG2 4.47Å; M73-I77 HydrophobicContact CG-CG2 4.45Å; M73-I77 HydrophobicContact SD-CD1 4.23Å; M73-I77 HydrophobicContact SD-CG2 4.07Å
74P88Confident91.5Very high41 Ų4140.6 Ų40.627%0.26620%0.202SC..  trans-70.5152.6169.132-35.1000110.5Q76 I77 I78P74-Q76 VanDerWaalsContact C-N 3.29Å; P74-Q76 PolarHBondContact O-N 3.42Å; P74-I77 HydrophobicContact CG-CB 4.08Å; P74-I77 HydrophobicContact CG-CD1 3.53Å; P74-I77 HydrophobicContact CG-CG1 3.66Å; P74-I77 PolarHBondContact O-N 3.3Å; P74-I78 PolarHBondContact O-N 2.65Å
75R89.9Confident91.7Very high31 Ų3136.6 Ų36.612%0.11719%0.185CC..Hα-helixtrans-52.3-41.5-176.2-166.7171.460.4-124.4-3.6113.9I77 I78 Y79 D149 M160 F163R75-I77 VanDerWaalsContact C-N 3.29Å; R75-I77 PolarHBondContact O-N 3.35Å; R75-I78 VanDerWaalsContact O-CB 3.32Å; R75-I78 WeakPolarHBondContact O-CB 3.26Å; R75-I78 PolarHBondContact O-N 3.39Å; R75-Y79 HydrophobicContact CG-CE2 3.68Å; R75-Y79 WeakPolarHBondContact O-CD2 3.47Å; R75-Y79 PolarHBondContact O-N 3.07Å; R75-D149 IonicContact CZ-OD1 3.12Å; R75-D149 IonicContact CZ-OD2 3.79Å; R75-D149 VanDerWaalsContact NE-CG 3.34Å; R75-D149 IonicContact NE-OD1 2.7Å; R75-D149 PolarHBondContact NE-OD1 2.92Å; R75-D149 IonicContact NE-OD2 3.3Å; R75-D149 PolarHBondContact NE-OD2 3.5Å; R75-D149 IonicContact NH2-OD1 2.78Å; R75-D149 PolarHBondContact NH2-OD1 3.1Å; R75-D149 IonicContact NH2-OD2 3.36Å; R75-D149 PolarHBondContact NH2-OD2 3.06Å; R75-M160 PolarHBondContact NH1-O 3.45Å; R75-M160 VanDerWaalsContact NH2-CE 3.3Å; R75-F163 PolarHBondContact NH1-O 3.14Å
76Q90.8Very high91.9Very high14 Ų1435.5 Ų35.57%0.06518%0.181CC..Hα-helixtrans-58.6-37.5176.2-166.567.624.500113.5P74 I78 Y79 I80 A146 D149 L265 F327P74-Q76 VanDerWaalsContact C-N 3.29Å; P74-Q76 PolarHBondContact O-N 3.42Å; Q76-I78 VanDerWaalsContact C-N 3.29Å; Q76-Y79 PolarHBondContact O-N 3.3Å; Q76-I80 HydrophobicContact CG-CD1 4.05Å; Q76-I80 VanDerWaalsContact O-CG1 3.31Å; Q76-I80 WeakPolarHBondContact O-CG1 3.38Å; Q76-I80 PolarHBondContact O-N 3.09Å; Q76-A146 PolarHBondContact NE2-O 3.41Å; Q76-D149 PolarHBondContact OE1-OD2 2.86Å; Q76-L265 HydrophobicContact CG-CD1 3.86Å; Q76-F327 HydrophobicContact CG-CZ 4.26Å
77I92Very high92.2Very high12 Ų1235.6 Ų35.66%0.06218%0.182CC..Hα-helixtrans-70.4-30.5178.3-67-179.6000110.4T66 M73 P74 R75 I80 S81 F327T66-I77 HydrophobicContact CG2-CG2 3.8Å; T66-I77 WeakPolarHBondContact OG1-CG2 3.32Å; M73-I77 HydrophobicContact CB-CG2 4.47Å; M73-I77 HydrophobicContact CG-CG2 4.45Å; M73-I77 HydrophobicContact SD-CD1 4.23Å; M73-I77 HydrophobicContact SD-CG2 4.07Å; P74-I77 HydrophobicContact CG-CB 4.08Å; P74-I77 HydrophobicContact CG-CD1 3.53Å; P74-I77 HydrophobicContact CG-CG1 3.66Å; P74-I77 PolarHBondContact O-N 3.3Å; R75-I77 VanDerWaalsContact C-N 3.29Å; R75-I77 PolarHBondContact O-N 3.35Å; I77-I80 PolarHBondContact O-N 2.85Å; I77-S81 WeakPolarHBondContact O-CB 3.08Å; I77-S81 PolarHBondContact O-N 3.28Å; I77-F327 HydrophobicContact CD1-CB 4.03Å; I77-F327 HydrophobicContact CD1-CD1 3.34Å; I77-F327 HydrophobicContact CD1-CD2 4.47Å; I77-F327 HydrophobicContact CD1-CE1 3.85Å; I77-F327 HydrophobicContact CD1-CG 3.69Å; I77-F327 HydrophobicContact CG1-CD1 3.51Å; I77-F327 HydrophobicContact CG1-CD2 4.3Å; I77-F327 HydrophobicContact CG1-CE1 3.46Å; I77-F327 VanDerWaalsContact CG1-CE1 3.46Å; I77-F327 HydrophobicContact CG1-CE2 4.29Å; I77-F327 HydrophobicContact CG1-CG 3.93Å; I77-F327 HydrophobicContact CG1-CZ 3.88Å
78I93.3Very high92.4Very high0 Ų031.5 Ų31.50%016%0.161CC..Hα-helixtrans-62.1-45.1174.6-57.2172.4000110.3P74 R75 Q76 S81 G82 W169 H172P74-I78 PolarHBondContact O-N 2.65Å; R75-I78 VanDerWaalsContact O-CB 3.32Å; R75-I78 WeakPolarHBondContact O-CB 3.26Å; R75-I78 PolarHBondContact O-N 3.39Å; Q76-I78 VanDerWaalsContact C-N 3.29Å; I78-S81 PolarHBondContact O-N 3.49Å; I78-S81 PolarHBondContact O-OG 3.28Å; I78-G82 PolarHBondContact O-N 3.04Å; I78-W169 HydrophobicContact CD1-CD2 4.27Å; I78-W169 HydrophobicContact CD1-CG 4.19Å; I78-W169 HydrophobicContact CD1-CZ2 4.43Å; I78-W169 HydrophobicContact CG1-CZ2 4.08Å; I78-W169 HydrophobicContact CG2-CD2 3.9Å; I78-W169 HydrophobicContact CG2-CE3 3.9Å; I78-W169 HydrophobicContact CG2-CG 4.44Å; I78-W169 HydrophobicContact CG2-CH2 4.29Å; I78-W169 HydrophobicContact CG2-CZ2 4.28Å; I78-W169 HydrophobicContact CG2-CZ3 4.11Å; I78-H172 HydrophobicContact CG2-CB 4Å; I78-H172 PolarHBondContact O-CE1 3.39Å; I78-H172 PolarHBondContact O-ND1 2.87Å; I78-H172 VanDerWaalsContact O-ND1 3.09Å
79Y95Very high92.8Very high6 Ų629.9 Ų29.92%0.02415%0.149CC..Hα-helixtrans-66.2-43.2175.6-55.1-53.5000112.3R75 Q76 S81 G82 I83 C145 D149 I171R75-Y79 HydrophobicContact CG-CE2 3.68Å; R75-Y79 WeakPolarHBondContact O-CD2 3.47Å; R75-Y79 PolarHBondContact O-N 3.07Å; Q76-Y79 PolarHBondContact O-N 3.3Å; Y79-S81 VanDerWaalsContact C-N 3.26Å; Y79-S81 PolarHBondContact O-N 2.98Å; Y79-G82 WeakPolarHBondContact O-CA 3.49Å; Y79-G82 PolarHBondContact O-N 2.85Å; Y79-I83 PolarHBondContact O-N 2.93Å; Y79-C145 HydrophobicContact CD1-CB 4.09Å; Y79-C145 HydrophobicContact CE1-CB 4.25Å; Y79-D149 HydrophobicContact CD2-CB 4.12Å; Y79-D149 HydrophobicContact CE2-CB 3.52Å; Y79-I171 HydrophobicContact CE1-CB 4.11Å; Y79-I171 HydrophobicContact CE1-CG2 3.7Å; Y79-I171 VanDerWaalsContact OH-CD1 3.3Å; Y79-I171 WeakPolarHBondContact OH-CD1 3.06Å
80I94.6Very high93.1Very high5 Ų525.5 Ų25.53%0.02613%0.132CC..Hα-helixtrans-60.1-37.9176.7-70.4168.9000111.3I62 Q76 I77 G82 I83 S84 L265 Y323 F327I62-I80 HydrophobicContact CG2-CG2 4.37Å; Q76-I80 HydrophobicContact CG-CD1 4.05Å; Q76-I80 VanDerWaalsContact O-CG1 3.31Å; Q76-I80 WeakPolarHBondContact O-CG1 3.38Å; Q76-I80 PolarHBondContact O-N 3.09Å; I77-I80 PolarHBondContact O-N 2.85Å; I80-G82 PolarHBondContact O-N 3.25Å; I80-I83 WeakPolarHBondContact O-CB 3.18Å; I80-I83 PolarHBondContact O-N 2.88Å; I80-S84 WeakPolarHBondContact O-CB 3.34Å; I80-S84 PolarHBondContact O-N 2.92Å; I80-S84 PolarHBondContact O-OG 3.42Å; I80-L265 HydrophobicContact CD1-CD2 3.96Å; I80-Y323 HydrophobicContact CD1-CD1 4.04Å; I80-Y323 HydrophobicContact CD1-CE1 3.82Å; I80-Y323 HydrophobicContact CG1-CE1 4.1Å; I80-Y323 HydrophobicContact CG2-CD1 4.21Å; I80-Y323 HydrophobicContact CG2-CD2 3.84Å; I80-Y323 HydrophobicContact CG2-CE1 3.96Å; I80-Y323 HydrophobicContact CG2-CE2 3.57Å; I80-Y323 HydrophobicContact CG2-CG 4.18Å; I80-F327 HydrophobicContact CD1-CE2 3.4Å; I80-F327 HydrophobicContact CD1-CZ 3.53Å
81S95.3Very high93.6Very high0 Ų024.1 Ų24.10%012%0.121CC..Hα-helixtrans-62.5-34.4174.774.80000112.4I77 I78 Y79 L85I77-S81 WeakPolarHBondContact O-CB 3.08Å; I77-S81 PolarHBondContact O-N 3.28Å; I78-S81 PolarHBondContact O-N 3.49Å; I78-S81 PolarHBondContact O-OG 3.28Å; Y79-S81 VanDerWaalsContact C-N 3.26Å; Y79-S81 PolarHBondContact O-N 2.98Å; S81-L85 WeakPolarHBondContact O-CB 3.36Å; S81-L85 VanDerWaalsContact O-CG 3.28Å; S81-L85 WeakPolarHBondContact O-CG 3.47Å; S81-L85 PolarHBondContact O-N 3.29Å
82G96.6Very high94.2Very high0 Ų019.5 Ų19.50%010%0.095CC..Hα-helixtrans-66.5-47174.300000111.4I78 Y79 I80 S86 H172I78-G82 PolarHBondContact O-N 3.04Å; Y79-G82 WeakPolarHBondContact O-CA 3.49Å; Y79-G82 PolarHBondContact O-N 2.85Å; I80-G82 PolarHBondContact O-N 3.25Å; G82-S86 VanDerWaalsContact O-CB 3.28Å; G82-S86 WeakPolarHBondContact O-CB 3.39Å; G82-S86 PolarHBondContact O-N 3.43Å; G82-S86 PolarHBondContact O-OG 2.97Å; G82-H172 WeakPolarHBondContact CA-CE1 3.36Å; G82-H172 PolarHBondContact N-CE1 3.48Å
83I96.9Very high94.7Very high6 Ų614.1 Ų14.13%0.0317%0.073CC..Hα-helixtrans-55.5-52.8173.5-62170.4000110.1Y79 I80 S86 S87 M139 M142 H143 A146Y79-I83 PolarHBondContact O-N 2.93Å; I80-I83 WeakPolarHBondContact O-CB 3.18Å; I80-I83 PolarHBondContact O-N 2.88Å; I83-S86 PolarHBondContact O-OG 3.42Å; I83-S87 WeakPolarHBondContact O-CB 3.39Å; I83-S87 PolarHBondContact O-N 2.94Å; I83-M139 HydrophobicContact CG2-CG 4.23Å; I83-M142 HydrophobicContact CG1-CB 3.57Å; I83-H143 HydrophobicContact CD1-CB 4.49Å; I83-H143 VanDerWaalsContact CG2-NE2 3.28Å; I83-H143 WeakPolarHBondContact CG2-NE2 3.24Å; I83-A146 HydrophobicContact CD1-CB 4.11Å
84S96.6Very high95.2Very high1 Ų114.1 Ų14.11%0.0077%0.073CC..Hα-helixtrans-62.4-47.5-178.4-710000112.9N59 I80 A88N59-S84 WeakPolarHBondContact CB-O 3.47Å; N59-S84 WeakPolarHBondContact O-CB 3.41Å; N59-S84 PolarHBondContact OD1-OG 3.39Å; N59-S84 VanDerWaalsContact OD1-OG 3.08Å; I80-S84 WeakPolarHBondContact O-CB 3.34Å; I80-S84 PolarHBondContact O-N 2.92Å; I80-S84 PolarHBondContact O-OG 3.42Å; S84-A88 WeakPolarHBondContact O-CB 3.49Å; S84-A88 PolarHBondContact O-N 3.21Å
85L97Very high95.5Very high36 Ų3612.1 Ų12.119%0.1886%0.06CC..Hα-helixtrans-63.2-46-179.8-74.6169.9000111.8L60 I67 S81 A88 I89L60-L85 HydrophobicContact CD2-CD2 4.34Å; I67-L85 HydrophobicContact CD1-CD1 3.68Å; S81-L85 WeakPolarHBondContact O-CB 3.36Å; S81-L85 VanDerWaalsContact O-CG 3.28Å; S81-L85 WeakPolarHBondContact O-CG 3.47Å; S81-L85 PolarHBondContact O-N 3.29Å; L85-A88 PolarHBondContact O-N 3.22Å; L85-I89 VanDerWaalsContact O-CG1 3.31Å; L85-I89 WeakPolarHBondContact O-CG1 3.12Å; L85-I89 PolarHBondContact O-N 3.2Å
86S97.5Very high95.8Very high1 Ų114.1 Ų14.11%0.0077%0.068CC..Hα-helixtrans-68-41.4-18058.70000112.3G82 I83 A88 I89 A90 S135 M139G82-S86 VanDerWaalsContact O-CB 3.28Å; G82-S86 WeakPolarHBondContact O-CB 3.39Å; G82-S86 PolarHBondContact O-N 3.43Å; G82-S86 PolarHBondContact O-OG 2.97Å; I83-S86 PolarHBondContact O-OG 3.42Å; S86-A88 PolarHBondContact O-N 3.47Å; S86-I89 PolarHBondContact O-N 3.38Å; S86-A90 WeakPolarHBondContact O-CB 3.35Å; S86-A90 PolarHBondContact O-N 3.06Å; S86-S135 WeakPolarHBondContact CB-O 3.44Å; S86-S135 WeakPolarHBondContact O-CB 3.25Å; S86-M139 WeakPolarHBondContact OG-CA 3.26Å; S86-M139 VanDerWaalsContact OG-CB 3.27Å; S86-M139 WeakPolarHBondContact OG-CB 3.3Å; S86-M139 PolarHBondContact OG-N 3Å
87S97.1Very high96Very high2 Ų216.1 Ų16.11%0.0148%0.078CC..Hα-helixtrans-57.3-46.3170.5153.90000112N59 I83 I89 A90 N91 E316N59-S87 PolarHBondContact ND2-OG 2.77Å; I83-S87 WeakPolarHBondContact O-CB 3.39Å; I83-S87 PolarHBondContact O-N 2.94Å; S87-I89 PolarHBondContact O-N 3.01Å; S87-A90 PolarHBondContact O-N 2.78Å; S87-N91 WeakPolarHBondContact O-CB 3.38Å; S87-N91 PolarHBondContact O-N 3.49Å; S87-N91 PolarHBondContact O-ND2 3.07Å; S87-E316 PolarHBondContact OG-OE1 2.91Å; S87-E316 PolarHBondContact OG-OE2 3.23Å
88A97.6Very high96.1Very high0 Ų017 Ų170%08%0.081CC..Hα-helixtrans-61.3-45.2178.800000111.8N59 L60 S84 L85 S86 N91 I92N59-A88 HydrophobicContact CB-CB 4.09Å; L60-A88 HydrophobicContact CD2-CB 3.76Å; L60-A88 HydrophobicContact CG-CB 3.81Å; S84-A88 WeakPolarHBondContact O-CB 3.49Å; S84-A88 PolarHBondContact O-N 3.21Å; L85-A88 PolarHBondContact O-N 3.22Å; S86-A88 PolarHBondContact O-N 3.47Å; A88-N91 PolarHBondContact O-N 3.49Å; A88-I92 WeakPolarHBondContact O-CD1 3.46Å; A88-I92 VanDerWaalsContact O-CG1 3.25Å; A88-I92 WeakPolarHBondContact O-CG1 3.48Å; A88-I92 PolarHBondContact O-N 3.42Å
89I97.6Very high96.1Very high60 Ų6017 Ų1731%0.3088%0.081SC..Hα-helixtrans-62.6-46176.1-65164.7000110.3L85 S86 S87 N91 I92 M93L85-I89 VanDerWaalsContact O-CG1 3.31Å; L85-I89 WeakPolarHBondContact O-CG1 3.12Å; L85-I89 PolarHBondContact O-N 3.2Å; S86-I89 PolarHBondContact O-N 3.38Å; S87-I89 PolarHBondContact O-N 3.01Å; I89-N91 VanDerWaalsContact C-N 3.34Å; I89-N91 PolarHBondContact O-N 3.06Å; I89-I92 PolarHBondContact O-N 3.14Å; I89-M93 HydrophobicContact CG2-CG 4.29Å; I89-M93 VanDerWaalsContact O-CG 3.28Å; I89-M93 WeakPolarHBondContact O-CG 3.47Å; I89-M93 PolarHBondContact O-N 2.98Å
90A97.1Very high96.1Very high0 Ų018.4 Ų18.40%09%0.087CC..Hα-helixtrans-61.3-42.7179.700000111.7S86 S87 M93 F94 S135 W309S86-A90 WeakPolarHBondContact O-CB 3.35Å; S86-A90 PolarHBondContact O-N 3.06Å; S87-A90 PolarHBondContact O-N 2.78Å; A90-M93 PolarHBondContact O-N 3.5Å; A90-F94 WeakPolarHBondContact O-CB 3.39Å; A90-F94 PolarHBondContact O-N 3.34Å; A90-S135 VanDerWaalsContact CA-OG 3.27Å; A90-S135 WeakPolarHBondContact CA-OG 3.18Å; A90-S135 WeakPolarHBondContact CB-OG 3.37Å; A90-S135 PolarHBondContact N-OG 3.44Å; A90-W309 HydrophobicContact CB-CH2 4.22Å; A90-W309 HydrophobicContact CB-CZ2 3.8Å
91N96.9Very high96.1Very high0 Ų018.9 Ų18.90%09%0.09CC..Hα-helixtrans-67.5-37.5176.5-75.2-26.6000112.4V56 S87 A88 I89 I95 W96 W309 S313 E316V56-N91 HydrophobicContact CG2-CB 3.81Å; S87-N91 WeakPolarHBondContact O-CB 3.38Å; S87-N91 PolarHBondContact O-N 3.49Å; S87-N91 PolarHBondContact O-ND2 3.07Å; A88-N91 PolarHBondContact O-N 3.49Å; I89-N91 VanDerWaalsContact C-N 3.34Å; I89-N91 PolarHBondContact O-N 3.06Å; N91-I95 HydrophobicContact CB-CD1 4.12Å; N91-I95 WeakPolarHBondContact O-CA 3.5Å; N91-I95 WeakPolarHBondContact O-CB 3.36Å; N91-I95 PolarHBondContact O-N 3.23Å; N91-W96 PolarHBondContact O-N 3.04Å; N91-W309 PolarHBondContact OD1-NE1 3.09Å; N91-S313 PolarHBondContact OD1-OG 3.4Å; N91-E316 PolarHBondContact ND2-OE1 3.48Å; N91-E316 PolarHBondContact ND2-OE2 3.34Å
92I97.1Very high96Very high55 Ų5518.9 Ų18.928%0.2829%0.091SC..Iπ-helixtrans-61.6-49.7172.2-70.1163.8000109.9V56 A88 I89 W96 L97V56-I92 HydrophobicContact CG1-CD1 3.93Å; V56-I92 HydrophobicContact CG1-CG1 3.96Å; V56-I92 HydrophobicContact CG2-CG1 4.29Å; A88-I92 WeakPolarHBondContact O-CD1 3.46Å; A88-I92 VanDerWaalsContact O-CG1 3.25Å; A88-I92 WeakPolarHBondContact O-CG1 3.48Å; A88-I92 PolarHBondContact O-N 3.42Å; I89-I92 PolarHBondContact O-N 3.14Å; I92-W96 WeakPolarHBondContact O-CB 3.48Å; I92-W96 PolarHBondContact O-N 2.81Å; I92-L97 HydrophobicContact CG2-CD1 4.1Å; I92-L97 HydrophobicContact CG2-CG 4.26Å; I92-L97 WeakPolarHBondContact O-CG 3.42Å; I92-L97 PolarHBondContact O-N 3.21Å
93M96.3Very high95.7Very high26 Ų2620.1 Ų20.113%0.12810%0.095CC..Iπ-helixtrans-66.6-41.7-176.8-66.1-65.6169.400112.6I89 A90 L97 F127 Q128 M131I89-M93 HydrophobicContact CG2-CG 4.29Å; I89-M93 VanDerWaalsContact O-CG 3.28Å; I89-M93 WeakPolarHBondContact O-CG 3.47Å; I89-M93 PolarHBondContact O-N 2.98Å; A90-M93 PolarHBondContact O-N 3.5Å; M93-L97 HydrophobicContact SD-CD1 3.84Å; M93-F127 HydrophobicContact CE-CE1 4.29Å; M93-Q128 PolarHBondContact O-NE2 2.91Å; M93-Q128 HydrophobicContact SD-CG 4.37Å; M93-M131 HydrophobicContact CE-CB 3.87Å; M93-M131 HydrophobicContact CE-CG 4.31Å; M93-M131 HydrophobicContact CG-CB 4.15Å; M93-M131 HydrophobicContact SD-CB 4.07Å
94F95.4Very high95.6Very high0 Ų019.8 Ų19.80%09%0.094CC..Iπ-helixtrans-87-52.1-175.4-176.8-104.1000113A90 W98 Q99 Y132 D306 W309 Y310A90-F94 WeakPolarHBondContact O-CB 3.39Å; A90-F94 PolarHBondContact O-N 3.34Å; F94-W98 AromaticContact CD2-CE3 3.59Å; F94-W98 HydrophobicContact CD2-CE3 3.59Å; F94-W98 AromaticContact CD2-CZ3 3.66Å; F94-W98 HydrophobicContact CD2-CZ3 3.66Å; F94-W98 AromaticContact CE2-CE3 3.85Å; F94-W98 HydrophobicContact CE2-CE3 3.85Å; F94-W98 HydrophobicContact CE2-CH2 4.48Å; F94-W98 AromaticContact CE2-CZ3 3.53Å; F94-W98 HydrophobicContact CE2-CZ3 3.53Å; F94-W98 WeakPolarHBondContact O-CB 3.37Å; F94-Q99 HydrophobicContact CD1-CG 4.14Å; F94-Q99 HydrophobicContact CD2-CG 4.33Å; F94-Q99 HydrophobicContact CE1-CG 3.88Å; F94-Q99 HydrophobicContact CE2-CG 4.04Å; F94-Q99 HydrophobicContact CG-CG 4.38Å; F94-Q99 HydrophobicContact CZ-CG 3.81Å; F94-Q99 WeakPolarHBondContact O-CB 2.71Å; F94-Q99 VanDerWaalsContact O-CG 3.28Å; F94-Q99 WeakPolarHBondContact O-CG 3.39Å; F94-Q99 PolarHBondContact O-N 2.81Å; F94-Y132 HydrophobicContact CB-CD2 3.71Å; F94-Y132 HydrophobicContact CB-CE2 3.54Å; F94-Y132 HydrophobicContact CD2-CD2 4.4Å; F94-Y132 HydrophobicContact CD2-CE1 4.23Å; F94-Y132 AromaticContact CD2-CE2 3.79Å; F94-Y132 HydrophobicContact CD2-CE2 3.79Å; F94-Y132 AromaticContact CD2-CZ 3.7Å; F94-Y132 HydrophobicContact CG-CD2 4.43Å; F94-Y132 AromaticContact CG-CE2 3.85Å; F94-Y132 HydrophobicContact CG-CE2 3.85Å; F94-D306 HydrophobicContact CZ-CB 4.12Å; F94-W309 HydrophobicContact CD1-CB 4.44Å; F94-W309 AromaticContact CD1-CD1 3.11Å; F94-W309 HydrophobicContact CD1-CD2 4.32Å; F94-W309 AromaticContact CD1-CG 3.72Å; F94-W309 HydrophobicContact CD1-CG 3.72Å; F94-W309 AromaticContact CD1-NE1 3.37Å; F94-W309 HydrophobicContact CE1-CB 3.69Å; F94-W309 AromaticContact CE1-CD1 3.19Å; F94-W309 HydrophobicContact CE1-CD2 4.35Å; F94-W309 AromaticContact CE1-CG 3.44Å; F94-W309 HydrophobicContact CE1-CG 3.44Å; F94-W309 VanDerWaalsContact CE1-CG 3.44Å; F94-W309 AromaticContact CE1-NE1 3.93Å; F94-W309 AromaticContact CG-NE1 3.99Å; F94-W309 HydrophobicContact CZ-CB 4.08Å; F94-W309 HydrophobicContact CZ-CG 4.09Å; F94-Y310 HydrophobicContact CD1-CE1 4.39Å; F94-Y310 AromaticContact CE1-CD1 3.86Å; F94-Y310 HydrophobicContact CE1-CD1 3.86Å; F94-Y310 AromaticContact CE1-CE1 3.42Å; F94-Y310 HydrophobicContact CE1-CE1 3.42Å; F94-Y310 VanDerWaalsContact CE1-CE1 3.42Å; F94-Y310 AromaticContact CZ-CE1 3.95Å; F94-Y310 HydrophobicContact CZ-CE1 3.95Å
95I95.5Very high95.5Very high0 Ų021.8 Ų21.80%010%0.104CC..Iπ-helixtrans-79.2-59-175.1-55.7175.6000109.4L48 N91 Q99 F100 S313L48-I95 HydrophobicContact CB-CG2 4.08Å; L48-I95 HydrophobicContact CD1-CG2 4.42Å; L48-I95 HydrophobicContact CD2-CD1 4.47Å; N91-I95 HydrophobicContact CB-CD1 4.12Å; N91-I95 WeakPolarHBondContact O-CA 3.5Å; N91-I95 WeakPolarHBondContact O-CB 3.36Å; N91-I95 PolarHBondContact O-N 3.23Å; I95-Q99 PolarHBondContact O-N 3.28Å; I95-F100 WeakPolarHBondContact O-CA 3.45Å; I95-F100 WeakPolarHBondContact O-CB 3.28Å; I95-F100 PolarHBondContact O-N 3.28Å; I95-S313 WeakPolarHBondContact CD1-OG 3.29Å
96W95.7Very high95.3Very high73 Ų7320.1 Ų20.128%0.27710%0.095SC..Iπ-helixtrans-75.3-45.2-168.9-74.393.9000113.5P49 S52 L53 N91 I92 F100 T101P49-W96 HydrophobicContact CB-CH2 3.85Å; P49-W96 HydrophobicContact CB-CZ2 4.2Å; P49-W96 HydrophobicContact CB-CZ3 4.47Å; P49-W96 WeakPolarHBondContact O-CZ2 3.28Å; S52-W96 PolarHBondContact OG-NE1 2.89Å; L53-W96 HydrophobicContact CB-CZ2 4.03Å; L53-W96 HydrophobicContact CD1-CZ2 4.35Å; N91-W96 PolarHBondContact O-N 3.04Å; I92-W96 WeakPolarHBondContact O-CB 3.48Å; I92-W96 PolarHBondContact O-N 2.81Å; W96-F100 HydrophobicContact CE3-CD1 4.03Å; W96-F100 HydrophobicContact CE3-CE1 4.39Å; W96-F100 HydrophobicContact CZ3-CD1 4.19Å; W96-F100 HydrophobicContact CZ3-CE1 4.13Å; W96-T101 VanDerWaalsContact O-CG2 3.32Å; W96-T101 WeakPolarHBondContact O-CG2 3.27Å
97L95.1Very high95.1Very high56 Ų5622.6 Ų22.629%0.29311%0.105SC..Iπ-helixtrans-87.5-12-175.1-63.4-180000113.9I92 M93 T101 I117I92-L97 HydrophobicContact CG2-CD1 4.1Å; I92-L97 HydrophobicContact CG2-CG 4.26Å; I92-L97 WeakPolarHBondContact O-CG 3.42Å; I92-L97 PolarHBondContact O-N 3.21Å; M93-L97 HydrophobicContact SD-CD1 3.84Å; L97-T101 PolarHBondContact O-OG1 3.44Å; L97-I117 HydrophobicContact CB-CD1 4.22Å; L97-I117 HydrophobicContact CB-CG2 4.28Å; L97-I117 HydrophobicContact CD1-CD1 3.97Å; L97-I117 HydrophobicContact CD2-CD1 4.35Å; L97-I117 HydrophobicContact CG-CD1 4.42Å; L97-I117 WeakPolarHBondContact O-CG2 3.45Å
98W94.3Very high95Very high29 Ų2925.1 Ų25.111%0.1112%0.12CC..Iπ-helixtrans-126.8-72-178.3-175.528.3000112.9D10 F94 F100 T101 V102 L118D10-W98 PolarHBondContact OD2-NE1 3.05Å; F94-W98 AromaticContact CD2-CE3 3.59Å; F94-W98 HydrophobicContact CD2-CE3 3.59Å; F94-W98 AromaticContact CD2-CZ3 3.66Å; F94-W98 HydrophobicContact CD2-CZ3 3.66Å; F94-W98 AromaticContact CE2-CE3 3.85Å; F94-W98 HydrophobicContact CE2-CE3 3.85Å; F94-W98 HydrophobicContact CE2-CH2 4.48Å; F94-W98 AromaticContact CE2-CZ3 3.53Å; F94-W98 HydrophobicContact CE2-CZ3 3.53Å; F94-W98 WeakPolarHBondContact O-CB 3.37Å; W98-F100 PolarHBondContact O-N 3.41Å; W98-T101 PolarHBondContact O-N 2.79Å; W98-T101 PolarHBondContact O-OG1 3.26Å; W98-V102 WeakPolarHBondContact O-CB 3.42Å; W98-V102 VanDerWaalsContact O-CG2 3.31Å; W98-V102 WeakPolarHBondContact O-CG2 3.49Å; W98-V102 PolarHBondContact O-N 2.52Å; W98-L118 HydrophobicContact CD2-CD1 4.25Å; W98-L118 HydrophobicContact CG-CD1 4.21Å; W98-L118 HydrophobicContact CZ2-CD1 4.46Å
99Q94.1Very high94.8Very high0 Ų026 Ų260%013%0.126CC..Iπ-helixtrans-68.1-40.9-168.8-63.3-71.7-0.100113.1F94 I95 R103 G104 D306 Y310F94-Q99 HydrophobicContact CD1-CG 4.14Å; F94-Q99 HydrophobicContact CD2-CG 4.33Å; F94-Q99 HydrophobicContact CE1-CG 3.88Å; F94-Q99 HydrophobicContact CE2-CG 4.04Å; F94-Q99 HydrophobicContact CG-CG 4.38Å; F94-Q99 HydrophobicContact CZ-CG 3.81Å; F94-Q99 WeakPolarHBondContact O-CB 2.71Å; F94-Q99 VanDerWaalsContact O-CG 3.28Å; F94-Q99 WeakPolarHBondContact O-CG 3.39Å; F94-Q99 PolarHBondContact O-N 2.81Å; I95-Q99 PolarHBondContact O-N 3.28Å; Q99-R103 WeakPolarHBondContact O-CA 3.48Å; Q99-R103 WeakPolarHBondContact O-CB 3.34Å; Q99-R103 PolarHBondContact O-N 3.44Å; Q99-R103 VanDerWaalsContact OE1-CD 3.27Å; Q99-G104 PolarHBondContact O-N 2.91Å; Q99-G104 VanDerWaalsContact O-N 3.16Å; Q99-D306 PolarHBondContact NE2-OD2 2.9Å; Q99-Y310 HydrophobicContact CB-CE1 4.26Å; Q99-Y310 HydrophobicContact CG-CE1 4Å; Q99-Y310 PolarHBondContact OE1-OH 2.76Å; Q99-Y310 VanDerWaalsContact OE1-OH 3.08Å
100F95.1Very high94.5Very high36 Ų3630.5 Ų30.516%0.15815%0.146CC..Iπ-helixtrans-63.1-48.6175.3177.7-117.8000110.9C44 P49 I95 W96 W98 G104 L105C44-F100 WeakPolarHBondContact O-CD2 3.23Å; P49-F100 HydrophobicContact CB-CD2 4.44Å; P49-F100 HydrophobicContact CB-CE2 4.3Å; P49-F100 HydrophobicContact CG-CD2 3.44Å; P49-F100 VanDerWaalsContact CG-CD2 3.44Å; P49-F100 HydrophobicContact CG-CE2 3.52Å; P49-F100 HydrophobicContact CG-CG 4.32Å; P49-F100 HydrophobicContact CG-CZ 4.45Å; I95-F100 WeakPolarHBondContact O-CA 3.45Å; I95-F100 WeakPolarHBondContact O-CB 3.28Å; I95-F100 PolarHBondContact O-N 3.28Å; W96-F100 HydrophobicContact CE3-CD1 4.03Å; W96-F100 HydrophobicContact CE3-CE1 4.39Å; W96-F100 HydrophobicContact CZ3-CD1 4.19Å; W96-F100 HydrophobicContact CZ3-CE1 4.13Å; W98-F100 PolarHBondContact O-N 3.41Å; F100-G104 CarbonylContact O-C 3.56Å; F100-G104 VanDerWaalsContact O-CA 3.24Å; F100-G104 WeakPolarHBondContact O-CA 3.37Å; F100-G104 PolarHBondContact O-N 3.1Å; F100-L105 HydrophobicContact CD1-CD1 4.3Å; F100-L105 HydrophobicContact CD1-CG 4.12Å; F100-L105 HydrophobicContact CE1-CD1 3.93Å; F100-L105 HydrophobicContact CE1-CD2 3.78Å; F100-L105 HydrophobicContact CE1-CG 3.67Å; F100-L105 HydrophobicContact CE2-CD2 4.1Å; F100-L105 HydrophobicContact CE2-CG 4.15Å; F100-L105 HydrophobicContact CZ-CD1 4.43Å; F100-L105 HydrophobicContact CZ-CD2 3.44Å; F100-L105 VanDerWaalsContact CZ-CD2 3.44Å; F100-L105 HydrophobicContact CZ-CG 3.7Å; F100-L105 PolarHBondContact O-N 3.41Å
101T93.9Very high94Very high15 Ų1531.4 Ų31.49%0.09215%0.154CC..Iπ-helixtrans-77.3-27.4-174.161.20000113.8W96 L97 W98 L105 P106 F115W96-T101 VanDerWaalsContact O-CG2 3.32Å; W96-T101 WeakPolarHBondContact O-CG2 3.27Å; L97-T101 PolarHBondContact O-OG1 3.44Å; W98-T101 PolarHBondContact O-N 2.79Å; W98-T101 PolarHBondContact O-OG1 3.26Å; T101-L105 HydrophobicContact CG2-CD1 4.08Å; T101-P106 WeakPolarHBondContact O-CD 3.45Å; T101-F115 CarbonylContact C-O 3.54Å; T101-F115 WeakPolarHBondContact CB-O 3.49Å; T101-F115 HydrophobicContact CG2-CD1 4.29Å; T101-F115 PolarHBondContact O-N 3.46Å; T101-F115 VanDerWaalsContact O-O 3.12Å; T101-F115 PolarHBondContact OG1-O 3.39Å
102V92.1Very high93.6Very high1 Ų137 Ų371%0.00619%0.189CC..Iπ-helixtrans-91.2-33.1-179.3173.40000113.1D10 W98 P106 F114D10-V102 HydrophobicContact CB-CG1 3.86Å; D10-V102 HydrophobicContact CB-CG2 4.4Å; W98-V102 WeakPolarHBondContact O-CB 3.42Å; W98-V102 VanDerWaalsContact O-CG2 3.31Å; W98-V102 WeakPolarHBondContact O-CG2 3.49Å; W98-V102 PolarHBondContact O-N 2.52Å; V102-P106 WeakPolarHBondContact O-CG 3.09Å; V102-F114 HydrophobicContact CB-CE2 4.4Å; V102-F114 HydrophobicContact CG1-CE2 4.21Å; V102-F114 HydrophobicContact CG2-CE2 4.3Å
103R91.9Very high93.4Very high25 Ų2539 Ų399%0.09420%0.199CC..Iπ-helixtrans-116.4-47.5-177.5-56.4-174.1-174.3-148.82.6112.7V15 V40 C44 Q99 Y107 D303 D306V15-R103 HydrophobicContact CG2-CB 4.33Å; V40-R103 VanDerWaalsContact CG1-NH1 3.29Å; C44-R103 HydrophobicContact CB-CB 4.22Å; Q99-R103 WeakPolarHBondContact O-CA 3.48Å; Q99-R103 WeakPolarHBondContact O-CB 3.34Å; Q99-R103 PolarHBondContact O-N 3.44Å; Q99-R103 VanDerWaalsContact OE1-CD 3.27Å; R103-Y107 WeakPolarHBondContact O-CB 3.19Å; R103-Y107 PolarHBondContact O-N 2.93Å; R103-D303 IonicContact CZ-OD1 3.66Å; R103-D303 IonicContact NH1-OD1 3.19Å; R103-D303 PolarHBondContact NH1-OD1 3.15Å; R103-D303 IonicContact NH1-OD2 2.69Å; R103-D303 IonicContact NH2-OD1 3.57Å; R103-D303 PolarHBondContact NH2-OD1 3.19Å; R103-D306 IonicContact NH2-OD2 3.28Å
104G94.5Very high93.1Very high0 Ų040.8 Ų40.80%021%0.206CC..Iπ-helixtrans-65.3-58.6-176.600000113.7G45 Q99 F100 Y107 V108G45-G104 VanDerWaalsContact CA-CA 3.46Å; Q99-G104 PolarHBondContact O-N 2.91Å; Q99-G104 VanDerWaalsContact O-N 3.16Å; F100-G104 CarbonylContact O-C 3.56Å; F100-G104 VanDerWaalsContact O-CA 3.24Å; F100-G104 WeakPolarHBondContact O-CA 3.37Å; F100-G104 PolarHBondContact O-N 3.1Å; G104-Y107 WeakPolarHBondContact O-CB 3.34Å; G104-Y107 PolarHBondContact O-N 2.76Å; G104-V108 VanDerWaalsContact O-CG2 3.32Å; G104-V108 WeakPolarHBondContact O-CG2 3.28Å; G104-V108 PolarHBondContact O-N 3.36Å
105L93.9Very high92.9Very high43 Ų4345.5 Ų45.523%0.22523%0.227CC..Hα-helixtrans-59.2-47.8-179.2-77.5179.5000112.4F100 T101 Y107 V108 S109 I113F100-L105 HydrophobicContact CD1-CD1 4.3Å; F100-L105 HydrophobicContact CD1-CG 4.12Å; F100-L105 HydrophobicContact CE1-CD1 3.93Å; F100-L105 HydrophobicContact CE1-CD2 3.78Å; F100-L105 HydrophobicContact CE1-CG 3.67Å; F100-L105 HydrophobicContact CE2-CD2 4.1Å; F100-L105 HydrophobicContact CE2-CG 4.15Å; F100-L105 HydrophobicContact CZ-CD1 4.43Å; F100-L105 HydrophobicContact CZ-CD2 3.44Å; F100-L105 VanDerWaalsContact CZ-CD2 3.44Å; F100-L105 HydrophobicContact CZ-CG 3.7Å; F100-L105 PolarHBondContact O-N 3.41Å; T101-L105 HydrophobicContact CG2-CD1 4.08Å; L105-Y107 VanDerWaalsContact C-N 3.27Å; L105-Y107 PolarHBondContact O-N 3.04Å; L105-V108 PolarHBondContact O-N 2.99Å; L105-S109 WeakPolarHBondContact O-CB 3.25Å; L105-S109 PolarHBondContact O-N 3.2Å; L105-S109 PolarHBondContact O-OG 2.82Å; L105-I113 CarbonylContact C-O 3.57Å; L105-I113 HydrophobicContact CB-CG2 4.42Å; L105-I113 HydrophobicContact CD1-CG2 4.2Å
106P93.4Very high92.7Very high0 Ų045.8 Ų45.80%023%0.229CC..Hα-helixtrans-63.3-34.1176.6-25.136.4000112.5A12 T101 V102 H110 G111 I113 F114A12-P106 WeakPolarHBondContact O-CB 3.39Å; T101-P106 WeakPolarHBondContact O-CD 3.45Å; V102-P106 WeakPolarHBondContact O-CG 3.09Å; P106-H110 CarbonylContact O-C 3.47Å; P106-H110 WeakPolarHBondContact O-CA 3.39Å; P106-H110 PolarHBondContact O-N 3.22Å; P106-H110 VanDerWaalsContact O-N 3.08Å; P106-G111 PolarHBondContact O-N 3.08Å; P106-I113 WeakPolarHBondContact CA-O 3.26Å; P106-I113 WeakPolarHBondContact CG-O 3.3Å; P106-F114 HydrophobicContact CG-CB 4.13Å; P106-F114 HydrophobicContact CG-CD2 3.69Å; P106-F114 HydrophobicContact CG-CG 4.41Å
107Y93.7Very high92.6Very high53 Ų5343.6 Ų43.621%0.20822%0.222CC..Hα-helixtrans-67.1-50.4176.2-177.1-102.4000112.1V15 F16 T38 F42 Y46 R103 G104 L105 S109 H110V15-Y107 HydrophobicContact CG1-CD2 3.9Å; F16-Y107 HydrophobicContact CE1-CD2 4.2Å; F16-Y107 HydrophobicContact CZ-CD2 4.27Å; T38-Y107 HydrophobicContact CG2-CE2 4.15Å; F42-Y107 HydrophobicContact CB-CE1 3.9Å; F42-Y107 HydrophobicContact CD2-CE1 4.21Å; Y46-Y107 HydrophobicContact CE2-CD1 4.12Å; Y46-Y107 AromaticContact CE2-CE1 3.93Å; Y46-Y107 HydrophobicContact CE2-CE1 3.93Å; R103-Y107 WeakPolarHBondContact O-CB 3.19Å; R103-Y107 PolarHBondContact O-N 2.93Å; G104-Y107 WeakPolarHBondContact O-CB 3.34Å; G104-Y107 PolarHBondContact O-N 2.76Å; L105-Y107 VanDerWaalsContact C-N 3.27Å; L105-Y107 PolarHBondContact O-N 3.04Å; Y107-S109 VanDerWaalsContact C-N 3.28Å; Y107-S109 PolarHBondContact O-N 3.47Å; Y107-H110 PolarHBondContact O-N 3.26Å
108V93.9Very high92.5Very high56 Ų5641 Ų4134%0.33921%0.208SC..Hα-helixtrans-63.6-35.3179.7175.70000111.9Y46 G104 L105Y46-V108 HydrophobicContact CD1-CG2 4.42Å; Y46-V108 HydrophobicContact CD2-CG2 4.42Å; Y46-V108 HydrophobicContact CE1-CG1 4.32Å; Y46-V108 HydrophobicContact CE1-CG2 3.94Å; Y46-V108 HydrophobicContact CE2-CG2 3.94Å; G104-V108 VanDerWaalsContact O-CG2 3.32Å; G104-V108 WeakPolarHBondContact O-CG2 3.28Å; G104-V108 PolarHBondContact O-N 3.36Å; L105-V108 PolarHBondContact O-N 2.99Å
109S93.8Very high92.4Very high18 Ų1841.1 Ų41.113%0.12621%0.211CC..THydrogen-bonded Turntrans-95.68.7-176.472.10000113.8L105 Y107 G111 T112 I113L105-S109 WeakPolarHBondContact O-CB 3.25Å; L105-S109 PolarHBondContact O-N 3.2Å; L105-S109 PolarHBondContact O-OG 2.82Å; Y107-S109 VanDerWaalsContact C-N 3.28Å; Y107-S109 PolarHBondContact O-N 3.47Å; S109-G111 PolarHBondContact O-N 3.22Å; S109-T112 VanDerWaalsContact CB-OG1 3.3Å; S109-T112 WeakPolarHBondContact CB-OG1 3.34Å; S109-T112 WeakPolarHBondContact O-CB 3.49Å; S109-T112 WeakPolarHBondContact O-CG2 3.41Å; S109-T112 PolarHBondContact O-N 3.26Å; S109-T112 VanDerWaalsContact O-N 3.13Å; S109-T112 PolarHBondContact O-OG1 3.45Å; S109-T112 PolarHBondContact OG-N 3.19Å; S109-I113 PolarHBondContact OG-N 3.3Å; S109-I113 PolarHBondContact OG-O 3.01Å
110H90.2Very high92.3Very high155 Ų15545 Ų4572%0.71824%0.235SC*.THydrogen-bonded Turntrans52.136-175.7-62.6-94.7000113.9P106 Y107P106-H110 CarbonylContact O-C 3.47Å; P106-H110 WeakPolarHBondContact O-CA 3.39Å; P106-H110 PolarHBondContact O-N 3.22Å; P106-H110 VanDerWaalsContact O-N 3.08Å; Y107-H110 PolarHBondContact O-N 3.26Å
111G87.2Confident92.2Very high18 Ų1845 Ų4519%0.18624%0.239CC..THydrogen-bonded Turntrans88.40.6176.900000114.9P106 S109P106-G111 PolarHBondContact O-N 3.08Å; S109-G111 PolarHBondContact O-N 3.22Å
112T89.6Confident92.2Very high117 Ų11746.5 Ų46.572%0.71825%0.249SC*.SBendtrans-77.7-32-17859.80000113.5S109S109-T112 VanDerWaalsContact CB-OG1 3.3Å; S109-T112 WeakPolarHBondContact CB-OG1 3.34Å; S109-T112 WeakPolarHBondContact O-CB 3.49Å; S109-T112 WeakPolarHBondContact O-CG2 3.41Å; S109-T112 PolarHBondContact O-N 3.26Å; S109-T112 VanDerWaalsContact O-N 3.13Å; S109-T112 PolarHBondContact O-OG1 3.45Å; S109-T112 PolarHBondContact OG-N 3.19Å
113I91Very high92.3Very high97 Ų9752.8 Ų52.850%0.49728%0.28SS..  trans-113.4118178.6-55.5174.6000109L105 P106 S109L105-I113 CarbonylContact C-O 3.57Å; L105-I113 HydrophobicContact CB-CG2 4.42Å; L105-I113 HydrophobicContact CD1-CG2 4.2Å; P106-I113 WeakPolarHBondContact CA-O 3.26Å; P106-I113 WeakPolarHBondContact CG-O 3.3Å; S109-I113 PolarHBondContact OG-N 3.3Å; S109-I113 PolarHBondContact OG-O 3.01Å
114F90.3Very high92.5Very high64 Ų6453.4 Ų53.428%0.28129%0.287SS..  trans-141.6135.2177.3170.9-99.5000110.9D10 Y11 A12 V102 P106D10-F114 HydrophobicContact CB-CZ 4.36Å; D10-F114 WeakPolarHBondContact O-CZ 3.24Å; Y11-F114 VanDerWaalsContact C-CE2 3.5Å; Y11-F114 VanDerWaalsContact CA-CZ 3.47Å; A12-F114 HydrophobicContact CB-CB 3.56Å; A12-F114 HydrophobicContact CB-CD1 4.38Å; A12-F114 HydrophobicContact CB-CD2 4.18Å; A12-F114 HydrophobicContact CB-CG 3.79Å; V102-F114 HydrophobicContact CB-CE2 4.4Å; V102-F114 HydrophobicContact CG1-CE2 4.21Å; V102-F114 HydrophobicContact CG2-CE2 4.3Å; P106-F114 HydrophobicContact CG-CB 4.13Å; P106-F114 HydrophobicContact CG-CD2 3.69Å; P106-F114 HydrophobicContact CG-CG 4.41Å
115F91.8Very high92.5Very high100 Ų10053.4 Ų53.444%0.43929%0.287SS..  trans-145.9135.7170.3178.8-104.1000110.2T101 I117 V120T101-F115 CarbonylContact C-O 3.54Å; T101-F115 WeakPolarHBondContact CB-O 3.49Å; T101-F115 HydrophobicContact CG2-CD1 4.29Å; T101-F115 PolarHBondContact O-N 3.46Å; T101-F115 VanDerWaalsContact O-O 3.12Å; T101-F115 PolarHBondContact OG1-O 3.39Å; F115-I117 HydrophobicContact CE1-CB 4.05Å; F115-I117 HydrophobicContact CZ-CB 4.49Å; F115-V120 HydrophobicContact CE2-CG2 4.06Å; F115-V120 HydrophobicContact CZ-CG2 3.97Å
116S92.1Very high92.6Very high5 Ų555.3 Ų55.34%0.03529%0.291CS..  trans-128.8112.3172.4178.30000108.9L118 N119S116-L118 PolarHBondContact O-N 2.61Å; S116-L118 VanDerWaalsContact O-N 3.16Å; S116-L118 PolarHBondContact OG-N 3.35Å; S116-N119 PolarHBondContact O-N 2.98Å; S116-N119 VanDerWaalsContact O-N 3.07Å; S116-N119 PolarHBondContact OG-OD1 3.34Å
117I92.6Very high92.7Very high27 Ų2760.4 Ų60.414%0.13831%0.314CS..G310 helixtrans-58.6-26.9173.7-165.6166.1000111.8L97 F115 N119 V120 T124 Q128L97-I117 HydrophobicContact CB-CD1 4.22Å; L97-I117 HydrophobicContact CB-CG2 4.28Å; L97-I117 HydrophobicContact CD1-CD1 3.97Å; L97-I117 HydrophobicContact CD2-CD1 4.35Å; L97-I117 HydrophobicContact CG-CD1 4.42Å; L97-I117 WeakPolarHBondContact O-CG2 3.45Å; F115-I117 HydrophobicContact CE1-CB 4.05Å; F115-I117 HydrophobicContact CZ-CB 4.49Å; I117-N119 VanDerWaalsContact C-N 3.27Å; I117-N119 PolarHBondContact O-N 3.02Å; I117-V120 PolarHBondContact O-N 2.81Å; I117-T124 HydrophobicContact CD1-CG2 4.27Å; I117-T124 HydrophobicContact CG1-CG2 3.53Å; I117-T124 VanDerWaalsContact O-CG2 3.28Å; I117-T124 WeakPolarHBondContact O-CG2 3.49Å; I117-Q128 HydrophobicContact CG2-CB 4.45Å; I117-Q128 HydrophobicContact CG2-CG 3.89Å
118L92.4Very high92.8Very high1 Ų158 Ų581%0.00530%0.304CS..G310 helixtrans-72-22.2-179.8-52.7-175.9000112.9W98 S116 Q128 W192 C201W98-L118 HydrophobicContact CD2-CD1 4.25Å; W98-L118 HydrophobicContact CG-CD1 4.21Å; W98-L118 HydrophobicContact CZ2-CD1 4.46Å; S116-L118 PolarHBondContact O-N 2.61Å; S116-L118 VanDerWaalsContact O-N 3.16Å; S116-L118 PolarHBondContact OG-N 3.35Å; L118-Q128 HydrophobicContact CD2-CB 4.07Å; L118-Q128 HydrophobicContact CD2-CG 4.01Å; L118-Q128 VanDerWaalsContact CD2-OE1 3.26Å; L118-W192 PolarHBondContact O-NE1 2.99Å; L118-C201 HydrophobicContact CB-CB 3.84Å; L118-C201 HydrophobicContact CD1-CB 4.35Å
119N92.3Very high92.9Very high32 Ų3255.6 Ų55.617%0.17129%0.289CS..G310 helixtrans-93.3-3.9-178.2-60.55.9000112.3F8 D10 S116 I117 W192F8-N119 VanDerWaalsContact CB-ND2 3.34Å; F8-N119 WeakPolarHBondContact CB-ND2 3.33Å; F8-N119 HydrophobicContact CD1-CB 4.1Å; F8-N119 HydrophobicContact CD2-CB 4.05Å; F8-N119 HydrophobicContact CE1-CB 4.18Å; F8-N119 HydrophobicContact CE2-CB 4.11Å; F8-N119 HydrophobicContact CG-CB 4.04Å; F8-N119 VanDerWaalsContact CG-CG 3.48Å; F8-N119 WeakPolarHBondContact CG-ND2 3.34Å; F8-N119 HydrophobicContact CZ-CB 4.18Å; D10-N119 PolarHBondContact O-ND2 2.91Å; S116-N119 PolarHBondContact O-N 2.98Å; S116-N119 VanDerWaalsContact O-N 3.07Å; S116-N119 PolarHBondContact OG-OD1 3.34Å; I117-N119 VanDerWaalsContact C-N 3.27Å; I117-N119 PolarHBondContact O-N 3.02Å; N119-W192 WeakPolarHBondContact O-CZ2 3.38Å
120V92.6Very high93Very high83 Ų8356.9 Ų56.950%0.50329%0.291SS..THydrogen-bonded Turntrans-70.9-51.8-176.8175.80000111.5F115 I117 T124F115-V120 HydrophobicContact CE2-CG2 4.06Å; F115-V120 HydrophobicContact CZ-CG2 3.97Å; I117-V120 PolarHBondContact O-N 2.81Å; V120-T124 HydrophobicContact CB-CG2 4.32Å
121S94Very high93.4Very high34 Ų3451.7 Ų51.724%0.23827%0.268CS..  trans-159.3160.6175.877.80000110.9M123 T124 C125 W192S121-M123 VanDerWaalsContact C-N 3.25Å; S121-M123 PolarHBondContact O-N 3.23Å; S121-M123 PolarHBondContact OG-N 3.33Å; S121-T124 PolarHBondContact O-N 3.35Å; S121-T124 WeakPolarHBondContact OG-CB 3.28Å; S121-T124 PolarHBondContact OG-N 2.84Å; S121-T124 PolarHBondContact OG-OG1 3Å; S121-C125 WeakPolarHBondContact O-CB 3.48Å; S121-C125 PolarHBondContact O-N 3.03Å; S121-W192 VanDerWaalsContact CA-CZ2 3.42Å
122P93Very high93.8Very high48 Ų4851.1 Ų51.131%0.31226%0.26SS..Hα-helixtrans-56.6-39.5172.2-24.233.1000112.5C125 R126 D191 W192P122-C125 WeakPolarHBondContact O-CB 3.48Å; P122-C125 PolarHBondContact O-N 3.28Å; P122-R126 VanDerWaalsContact O-CG 3.32Å; P122-R126 WeakPolarHBondContact O-CG 3.28Å; P122-R126 PolarHBondContact O-N 3.28Å; P122-D191 WeakPolarHBondContact CB-OD1 3.44Å; P122-W192 HydrophobicContact CB-CD2 4.39Å; P122-W192 HydrophobicContact CB-CG 4.4Å; P122-W192 HydrophobicContact CG-CD2 3.73Å; P122-W192 HydrophobicContact CG-CE3 3.71Å; P122-W192 HydrophobicContact CG-CG 4.19Å; P122-W192 HydrophobicContact CG-CH2 4.46Å; P122-W192 HydrophobicContact CG-CZ2 4.49Å; P122-W192 HydrophobicContact CG-CZ3 4.08Å
123M95Very high94.2Very high132 Ų13245.5 Ų45.565%0.6523%0.226SC*.Hα-helixtrans-67.6-42.2179.8-171.161.4-170.100111.9S121 C125 R126 F127S121-M123 VanDerWaalsContact C-N 3.25Å; S121-M123 PolarHBondContact O-N 3.23Å; S121-M123 PolarHBondContact OG-N 3.33Å; M123-C125 VanDerWaalsContact C-N 3.35Å; M123-R126 PolarHBondContact O-N 3.05Å; M123-F127 WeakPolarHBondContact O-CB 3.29Å; M123-F127 PolarHBondContact O-N 3.5Å
124T95.2Very high94.5Very high39 Ų3942.1 Ų42.124%0.23921%0.207CC..Hα-helixtrans-63.1-43.1175.7-53.20000111I117 V120 S121 F127 Q128I117-T124 HydrophobicContact CD1-CG2 4.27Å; I117-T124 HydrophobicContact CG1-CG2 3.53Å; I117-T124 VanDerWaalsContact O-CG2 3.28Å; I117-T124 WeakPolarHBondContact O-CG2 3.49Å; V120-T124 HydrophobicContact CB-CG2 4.32Å; S121-T124 PolarHBondContact O-N 3.35Å; S121-T124 WeakPolarHBondContact OG-CB 3.28Å; S121-T124 PolarHBondContact OG-N 2.84Å; S121-T124 PolarHBondContact OG-OG1 3Å; T124-F127 PolarHBondContact O-N 2.93Å; T124-Q128 WeakPolarHBondContact O-CB 3.41Å; T124-Q128 PolarHBondContact O-N 3.49Å
125C94.6Very high94.8Very high0 Ų039 Ų390%019%0.194CC..Hα-helixtrans-54.4-54.3172.6156.90000111.4S121 P122 M123 F127 Q128 R129 C201S121-C125 WeakPolarHBondContact O-CB 3.48Å; S121-C125 PolarHBondContact O-N 3.03Å; P122-C125 WeakPolarHBondContact O-CB 3.48Å; P122-C125 PolarHBondContact O-N 3.28Å; M123-C125 VanDerWaalsContact C-N 3.35Å; C125-F127 PolarHBondContact O-N 3.33Å; C125-Q128 PolarHBondContact O-N 3.38Å; C125-R129 WeakPolarHBondContact O-CB 3.28Å; C125-R129 VanDerWaalsContact O-CG 3.22Å; C125-R129 WeakPolarHBondContact O-CG 3.1Å; C125-R129 PolarHBondContact O-N 3.35Å; C125-C201 VanDerWaalsContact CA-SG 3.55Å; C125-C201 HydrophobicContact CB-CB 3.89Å; C125-C201 WeakPolarHBondContact CB-SG 3.31Å; C125-C201 VanDerWaalsContact SG-CA 3.58Å; C125-C201 WeakPolarHBondContact SG-CB 3.16Å; C125-C201 CovalentContact SG-SG 2Å; C125-C201 PolarHBondContact SG-SG 3.5Å
126R95.7Very high95.1Very high83 Ų8334.3 Ų34.331%0.31317%0.173SC..Hα-helixtrans-58.1-47.3178.4-71.7179.5-163.3-175.42.7112.2P122 M123 R129 Y130 V190 D191P122-R126 VanDerWaalsContact O-CG 3.32Å; P122-R126 WeakPolarHBondContact O-CG 3.28Å; P122-R126 PolarHBondContact O-N 3.28Å; M123-R126 PolarHBondContact O-N 3.05Å; R126-R129 PolarHBondContact O-N 3.22Å; R126-Y130 VanDerWaalsContact O-CB 3.25Å; R126-Y130 WeakPolarHBondContact O-CB 3.16Å; R126-Y130 PolarHBondContact O-N 3.28Å; R126-V190 HydrophobicContact CG-CG1 4.32Å; R126-V190 WeakPolarHBondContact CG-O 3.5Å; R126-V190 PolarHBondContact NE-O 3.3Å; R126-D191 IonicContact CZ-OD1 3.65Å; R126-D191 IonicContact CZ-OD2 3.64Å; R126-D191 IonicContact NE-OD1 3.16Å; R126-D191 PolarHBondContact NE-OD1 3.27Å; R126-D191 VanDerWaalsContact NE-OD1 3.13Å; R126-D191 IonicContact NE-OD2 2.7Å; R126-D191 IonicContact NH2-OD1 3.98Å; R126-D191 PolarHBondContact NH2-OD1 2.93Å; R126-D191 IonicContact NH2-OD2 2.64Å; R126-D191 PolarHBondContact NH2-OD2 3.41Å
127F96.1Very high95.3Very high107 Ų10734 Ų3447%0.46917%0.172SC..Hα-helixtrans-61.8-49.5-179.7176.3-96.7000112.1M93 M123 T124 C125 R129 Y130 M131M93-F127 HydrophobicContact CE-CE1 4.29Å; M123-F127 WeakPolarHBondContact O-CB 3.29Å; M123-F127 PolarHBondContact O-N 3.5Å; T124-F127 PolarHBondContact O-N 2.93Å; C125-F127 PolarHBondContact O-N 3.33Å; F127-R129 PolarHBondContact O-N 3.24Å; F127-Y130 PolarHBondContact O-N 3.44Å; F127-M131 HydrophobicContact CD1-CG 4.3Å; F127-M131 HydrophobicContact CD2-CE 4.2Å; F127-M131 HydrophobicContact CD2-CG 4.1Å; F127-M131 HydrophobicContact CE1-CG 3.91Å; F127-M131 HydrophobicContact CE2-CE 3.56Å; F127-M131 HydrophobicContact CE2-CG 3.7Å; F127-M131 HydrophobicContact CE2-SD 4.35Å; F127-M131 HydrophobicContact CG-CG 4.4Å; F127-M131 HydrophobicContact CZ-CE 4.16Å; F127-M131 HydrophobicContact CZ-CG 3.59Å; F127-M131 HydrophobicContact CZ-SD 4.43Å; F127-M131 WeakPolarHBondContact O-CB 3.39Å; F127-M131 WeakPolarHBondContact O-CG 3.37Å; F127-M131 PolarHBondContact O-N 2.83Å
128Q96Very high95.6Very high1 Ų133.3 Ų33.31%0.00517%0.168CC..Hα-helixtrans-60.2-47.8179.8-174.8-76.4-21.900110.6M93 I117 L118 T124 C125 Y130 M131 Y132M93-Q128 PolarHBondContact O-NE2 2.91Å; M93-Q128 HydrophobicContact SD-CG 4.37Å; I117-Q128 HydrophobicContact CG2-CB 4.45Å; I117-Q128 HydrophobicContact CG2-CG 3.89Å; L118-Q128 HydrophobicContact CD2-CB 4.07Å; L118-Q128 HydrophobicContact CD2-CG 4.01Å; L118-Q128 VanDerWaalsContact CD2-OE1 3.26Å; T124-Q128 WeakPolarHBondContact O-CB 3.41Å; T124-Q128 PolarHBondContact O-N 3.49Å; C125-Q128 PolarHBondContact O-N 3.38Å; Q128-Y130 PolarHBondContact O-N 3.28Å; Q128-M131 PolarHBondContact O-N 3.4Å; Q128-Y132 WeakPolarHBondContact O-CB 3.28Å; Q128-Y132 PolarHBondContact O-N 2.85Å
129R95.4Very high95.8Very high7 Ų733.2 Ų33.23%0.02617%0.167CC..Hα-helixtrans-62.8-45.5-178.2-72.5-66.1-165.8-161.21.5111.3C125 R126 F127 A133 F186 V190 C201C125-R129 WeakPolarHBondContact O-CB 3.28Å; C125-R129 VanDerWaalsContact O-CG 3.22Å; C125-R129 WeakPolarHBondContact O-CG 3.1Å; C125-R129 PolarHBondContact O-N 3.35Å; R126-R129 PolarHBondContact O-N 3.22Å; F127-R129 PolarHBondContact O-N 3.24Å; R129-A133 WeakPolarHBondContact O-CB 3.44Å; R129-A133 PolarHBondContact O-N 2.92Å; R129-F186 HydrophobicContact CB-CE1 3.83Å; R129-F186 HydrophobicContact CB-CZ 4.4Å; R129-F186 WeakPolarHBondContact O-CE1 3.4Å; R129-V190 HydrophobicContact CB-CG1 3.87Å; R129-V190 HydrophobicContact CB-CG2 4.24Å; R129-V190 HydrophobicContact CG-CG1 3.84Å; R129-C201 PolarHBondContact NE-O 2.89Å; R129-C201 PolarHBondContact NH2-O 3.43Å
130Y96.6Very high96.1Very high45 Ų4531.8 Ų31.818%0.17616%0.16CC..Hα-helixtrans-61.9-49.8175.3171.4-103.4000111.8R126 F127 Q128 Y132 A133 F134 M183 A187R126-Y130 VanDerWaalsContact O-CB 3.25Å; R126-Y130 WeakPolarHBondContact O-CB 3.16Å; R126-Y130 PolarHBondContact O-N 3.28Å; F127-Y130 PolarHBondContact O-N 3.44Å; Q128-Y130 PolarHBondContact O-N 3.28Å; Y130-Y132 VanDerWaalsContact C-N 3.31Å; Y130-Y132 PolarHBondContact O-N 3.12Å; Y130-A133 PolarHBondContact O-N 2.94Å; Y130-F134 HydrophobicContact CE1-CB 4.35Å; Y130-F134 HydrophobicContact CE2-CB 4.36Å; Y130-F134 WeakPolarHBondContact O-CB 3.32Å; Y130-F134 PolarHBondContact O-N 3.21Å; Y130-M183 HydrophobicContact CD2-CB 4.11Å; Y130-M183 HydrophobicContact CE2-CB 3.82Å; Y130-A187 HydrophobicContact CD2-CB 3.52Å; Y130-A187 HydrophobicContact CE2-CB 4.11Å; Y130-A187 HydrophobicContact CG-CB 4Å
131M97.2Very high96.3Very high46 Ų4628.6 Ų28.623%0.22714%0.14CC..Hα-helixtrans-62.9-38.5-177.9-75.8-61.1157.400112.3M93 F127 Q128 F134 S135M93-M131 HydrophobicContact CE-CB 3.87Å; M93-M131 HydrophobicContact CE-CG 4.31Å; M93-M131 HydrophobicContact CG-CB 4.15Å; M93-M131 HydrophobicContact SD-CB 4.07Å; F127-M131 HydrophobicContact CD1-CG 4.3Å; F127-M131 HydrophobicContact CD2-CE 4.2Å; F127-M131 HydrophobicContact CD2-CG 4.1Å; F127-M131 HydrophobicContact CE1-CG 3.91Å; F127-M131 HydrophobicContact CE2-CE 3.56Å; F127-M131 HydrophobicContact CE2-CG 3.7Å; F127-M131 HydrophobicContact CE2-SD 4.35Å; F127-M131 HydrophobicContact CG-CG 4.4Å; F127-M131 HydrophobicContact CZ-CE 4.16Å; F127-M131 HydrophobicContact CZ-CG 3.59Å; F127-M131 HydrophobicContact CZ-SD 4.43Å; F127-M131 WeakPolarHBondContact O-CB 3.39Å; F127-M131 WeakPolarHBondContact O-CG 3.37Å; F127-M131 PolarHBondContact O-N 2.83Å; Q128-M131 PolarHBondContact O-N 3.4Å; M131-F134 HydrophobicContact SD-CD1 4.16Å; M131-S135 VanDerWaalsContact O-CB 3.23Å; M131-S135 WeakPolarHBondContact O-CB 3.38Å; M131-S135 PolarHBondContact O-N 3.2Å; M131-S135 PolarHBondContact O-OG 3.49Å
132Y96.8Very high96.5Very high5 Ų527 Ų272%0.0213%0.129CC..Hα-helixtrans-61.4-52.1171.4170.4-116.3000111.7F94 Q128 Y130 S135 S136 N219 W309F94-Y132 HydrophobicContact CB-CD2 3.71Å; F94-Y132 HydrophobicContact CB-CE2 3.54Å; F94-Y132 HydrophobicContact CD2-CD2 4.4Å; F94-Y132 HydrophobicContact CD2-CE1 4.23Å; F94-Y132 AromaticContact CD2-CE2 3.79Å; F94-Y132 HydrophobicContact CD2-CE2 3.79Å; F94-Y132 AromaticContact CD2-CZ 3.7Å; F94-Y132 HydrophobicContact CG-CD2 4.43Å; F94-Y132 AromaticContact CG-CE2 3.85Å; F94-Y132 HydrophobicContact CG-CE2 3.85Å; Q128-Y132 WeakPolarHBondContact O-CB 3.28Å; Q128-Y132 PolarHBondContact O-N 2.85Å; Y130-Y132 VanDerWaalsContact C-N 3.31Å; Y130-Y132 PolarHBondContact O-N 3.12Å; Y132-S135 PolarHBondContact O-N 3.47Å; Y132-S135 PolarHBondContact O-OG 3.13Å; Y132-S135 VanDerWaalsContact O-OG 3.05Å; Y132-S136 WeakPolarHBondContact O-CB 3.45Å; Y132-S136 PolarHBondContact O-N 3.45Å; Y132-S136 PolarHBondContact O-OG 3.45Å; Y132-N219 WeakPolarHBondContact CE1-OD1 3.25Å; Y132-N219 VanDerWaalsContact CZ-OD1 3.31Å; Y132-N219 PolarHBondContact OH-OD1 3.46Å; Y132-W309 AromaticContact CE2-CH2 3.87Å; Y132-W309 HydrophobicContact CE2-CH2 3.87Å; Y132-W309 AromaticContact CE2-CZ2 3.76Å; Y132-W309 HydrophobicContact CE2-CZ2 3.76Å; Y132-W309 HydrophobicContact CE2-CZ3 4.33Å
133A96.7Very high96.7Very high0 Ų025 Ų250%012%0.115CC..Hα-helixtrans-61.1-50.6-179.600000111.6R129 Y130 S135 S136 T137 M183 F186 S218R129-A133 WeakPolarHBondContact O-CB 3.44Å; R129-A133 PolarHBondContact O-N 2.92Å; Y130-A133 PolarHBondContact O-N 2.94Å; A133-S135 PolarHBondContact O-N 3.09Å; A133-S136 PolarHBondContact O-N 2.97Å; A133-S136 PolarHBondContact O-OG 2.91Å; A133-T137 WeakPolarHBondContact O-CB 3.31Å; A133-T137 PolarHBondContact O-N 2.59Å; A133-T137 PolarHBondContact O-OG1 3.13Å; A133-T137 VanDerWaalsContact O-OG1 3.12Å; A133-M183 HydrophobicContact CB-CG 4.22Å; A133-M183 HydrophobicContact CB-SD 3.87Å; A133-F186 HydrophobicContact CB-CD1 3.69Å; A133-F186 HydrophobicContact CB-CE1 3.86Å; A133-S218 WeakPolarHBondContact CA-OG 3.37Å
134F97.4Very high96.8Very high25 Ų2519.8 Ų19.811%0.119%0.09CC..Hα-helixtrans-52.1-53.2175.8161.4-109.9000112.4Y130 M131 T137 M138 L176 A180 M183Y130-F134 HydrophobicContact CE1-CB 4.35Å; Y130-F134 HydrophobicContact CE2-CB 4.36Å; Y130-F134 WeakPolarHBondContact O-CB 3.32Å; Y130-F134 PolarHBondContact O-N 3.21Å; M131-F134 HydrophobicContact SD-CD1 4.16Å; F134-T137 PolarHBondContact O-N 3.48Å; F134-M138 HydrophobicContact CE2-SD 4.45Å; F134-M138 HydrophobicContact CZ-SD 3.93Å; F134-M138 WeakPolarHBondContact O-CB 3.35Å; F134-M138 PolarHBondContact O-N 3.46Å; F134-L176 HydrophobicContact CZ-CG 4.3Å; F134-A180 HydrophobicContact CD2-CB 4.09Å; F134-A180 HydrophobicContact CE2-CB 3.92Å; F134-M183 HydrophobicContact CB-CB 4.49Å
135S97.7Very high96.8Very high0 Ų018.8 Ų18.80%09%0.085CC..Hα-helixtrans-66.7-39.7-177.857.30000111.7S86 A90 M131 Y132 A133 M138 M139S86-S135 WeakPolarHBondContact CB-O 3.44Å; S86-S135 WeakPolarHBondContact O-CB 3.25Å; A90-S135 VanDerWaalsContact CA-OG 3.27Å; A90-S135 WeakPolarHBondContact CA-OG 3.18Å; A90-S135 WeakPolarHBondContact CB-OG 3.37Å; A90-S135 PolarHBondContact N-OG 3.44Å; M131-S135 VanDerWaalsContact O-CB 3.23Å; M131-S135 WeakPolarHBondContact O-CB 3.38Å; M131-S135 PolarHBondContact O-N 3.2Å; M131-S135 PolarHBondContact O-OG 3.49Å; Y132-S135 PolarHBondContact O-N 3.47Å; Y132-S135 PolarHBondContact O-OG 3.13Å; Y132-S135 VanDerWaalsContact O-OG 3.05Å; A133-S135 PolarHBondContact O-N 3.09Å; S135-M138 PolarHBondContact O-N 3.38Å; S135-M139 WeakPolarHBondContact O-CB 3.16Å; S135-M139 PolarHBondContact O-N 3.36Å
136S97.1Very high96.9Very high0 Ų019.1 Ų19.10%09%0.087CC..Hα-helixtrans-62.9-43.2174.381.40000112.5Y132 A133 M139 C140 S218 N219Y132-S136 WeakPolarHBondContact O-CB 3.45Å; Y132-S136 PolarHBondContact O-N 3.45Å; Y132-S136 PolarHBondContact O-OG 3.45Å; A133-S136 PolarHBondContact O-N 2.97Å; A133-S136 PolarHBondContact O-OG 2.91Å; S136-M139 WeakPolarHBondContact O-CB 3.22Å; S136-M139 PolarHBondContact O-N 3.09Å; S136-C140 PolarHBondContact O-N 2.93Å; S136-C140 VanDerWaalsContact O-N 3.09Å; S136-C140 PolarHBondContact O-SG 3.36Å; S136-S218 PolarHBondContact OG-OG 2.85Å; S136-N219 PolarHBondContact OG-N 3.34Å
137T97.6Very high96.9Very high0 Ų015.2 Ų15.20%07%0.073CC..Hα-helixtrans-66.4-41.2177.1-63.90000111.3A133 F134 M139 C140 N141 M182 M183 F217A133-T137 WeakPolarHBondContact O-CB 3.31Å; A133-T137 PolarHBondContact O-N 2.59Å; A133-T137 PolarHBondContact O-OG1 3.13Å; A133-T137 VanDerWaalsContact O-OG1 3.12Å; F134-T137 PolarHBondContact O-N 3.48Å; T137-M139 VanDerWaalsContact C-N 3.35Å; T137-M139 PolarHBondContact O-N 3.07Å; T137-C140 PolarHBondContact O-N 2.99Å; T137-N141 WeakPolarHBondContact O-CB 3.49Å; T137-N141 VanDerWaalsContact O-CG 3.24Å; T137-N141 PolarHBondContact O-N 2.82Å; T137-M182 HydrophobicContact CG2-CE 4.18Å; T137-M182 HydrophobicContact CG2-SD 4.16Å; T137-M183 HydrophobicContact CG2-CE 4.16Å; T137-M183 WeakPolarHBondContact OG1-CE 3.5Å; T137-F217 PolarHBondContact OG1-O 3.41Å
138M97.6Very high96.8Very high11 Ų1113.6 Ų13.65%0.0547%0.069CC..Hα-helixtrans-59.9-43.6173.7-175.9179.4173.100111.9F134 S135 C140 N141 M142 L176 S179F134-M138 HydrophobicContact CE2-SD 4.45Å; F134-M138 HydrophobicContact CZ-SD 3.93Å; F134-M138 WeakPolarHBondContact O-CB 3.35Å; F134-M138 PolarHBondContact O-N 3.46Å; S135-M138 PolarHBondContact O-N 3.38Å; M138-C140 PolarHBondContact O-N 3.47Å; M138-N141 PolarHBondContact O-N 3.15Å; M138-M142 HydrophobicContact CE-CE 3.68Å; M138-M142 HydrophobicContact CG-CG 4.39Å; M138-M142 WeakPolarHBondContact O-CB 3.41Å; M138-M142 WeakPolarHBondContact O-CG 3.44Å; M138-M142 PolarHBondContact O-N 3.24Å; M138-L176 HydrophobicContact CE-CB 4.17Å; M138-L176 HydrophobicContact CE-CD1 4.23Å; M138-L176 HydrophobicContact CE-CG 4.38Å; M138-L176 HydrophobicContact SD-CB 4.5Å; M138-L176 HydrophobicContact SD-CG 4.4Å; M138-S179 VanDerWaalsContact CA-OG 3.23Å; M138-S179 WeakPolarHBondContact CA-OG 3.26Å; M138-S179 PolarHBondContact N-OG 2.97Å
139M97.4Very high96.7Very high0 Ų014.1 Ų14.10%07%0.072CC..Hα-helixtrans-57.6-50.6175.4-178-173.662.500111.1I83 S86 S135 S136 T137 M142 H143 L220 F272 W309I83-M139 HydrophobicContact CG2-CG 4.23Å; S86-M139 WeakPolarHBondContact OG-CA 3.26Å; S86-M139 VanDerWaalsContact OG-CB 3.27Å; S86-M139 WeakPolarHBondContact OG-CB 3.3Å; S86-M139 PolarHBondContact OG-N 3Å; S135-M139 WeakPolarHBondContact O-CB 3.16Å; S135-M139 PolarHBondContact O-N 3.36Å; S136-M139 WeakPolarHBondContact O-CB 3.22Å; S136-M139 PolarHBondContact O-N 3.09Å; T137-M139 VanDerWaalsContact C-N 3.35Å; T137-M139 PolarHBondContact O-N 3.07Å; M139-M142 PolarHBondContact O-N 2.87Å; M139-H143 PolarHBondContact O-CD2 3.4Å; M139-H143 VanDerWaalsContact O-CD2 3.28Å; M139-H143 PolarHBondContact O-N 2.97Å; M139-L220 HydrophobicContact CE-CD2 3.67Å; M139-F272 HydrophobicContact CE-CE2 3.94Å; M139-F272 HydrophobicContact CE-CZ 4.5Å; M139-W309 HydrophobicContact CE-CH2 4.09Å
140C97.6Very high96.5Very high2 Ų214.3 Ų14.31%0.0147%0.073CC..Hα-helixtrans-63.4-44.7-179.5-58.90000112.2S136 T137 M138 M142 H143 V144 L220 Q224S136-C140 PolarHBondContact O-N 2.93Å; S136-C140 VanDerWaalsContact O-N 3.09Å; S136-C140 PolarHBondContact O-SG 3.36Å; T137-C140 PolarHBondContact O-N 2.99Å; M138-C140 PolarHBondContact O-N 3.47Å; C140-M142 VanDerWaalsContact C-N 3.31Å; C140-M142 PolarHBondContact O-N 3.49Å; C140-H143 WeakPolarHBondContact O-CB 3.46Å; C140-H143 PolarHBondContact O-N 3.39Å; C140-V144 PolarHBondContact O-N 3.5Å; C140-L220 VanDerWaalsContact SG-CA 3.56Å; C140-L220 PolarHBondContact SG-O 3.03Å; C140-Q224 HydrophobicContact CB-CB 3.78Å; C140-Q224 HydrophobicContact CB-CG 3.85Å
141N97.9Very high96.4Very high16 Ų1612.9 Ų12.99%0.0867%0.069CC..Hα-helixtrans-62.5-39.3177.4-72-11.4000111.4T137 M138 V144 C145 I175 S179 Q224T137-N141 WeakPolarHBondContact O-CB 3.49Å; T137-N141 VanDerWaalsContact O-CG 3.24Å; T137-N141 PolarHBondContact O-N 2.82Å; M138-N141 PolarHBondContact O-N 3.15Å; N141-V144 PolarHBondContact O-N 2.92Å; N141-C145 PolarHBondContact O-N 3.01Å; N141-C145 PolarHBondContact O-SG 3.22Å; N141-C145 VanDerWaalsContact O-SG 3.41Å; N141-I175 HydrophobicContact CB-CG2 3.59Å; N141-S179 PolarHBondContact ND2-OG 3.12Å; N141-Q224 WeakPolarHBondContact OD1-CG 3.12Å; N141-Q224 PolarHBondContact OD1-NE2 2.98Å
142M97.3Very high96.2Very high0 Ų014.3 Ų14.30%08%0.077CC..Hα-helixtrans-67.4-35.5175.5-71.3-71.2-173.200112.7I83 M138 M139 C140 C145 A146 H172 I175I83-M142 HydrophobicContact CG1-CB 3.57Å; M138-M142 HydrophobicContact CE-CE 3.68Å; M138-M142 HydrophobicContact CG-CG 4.39Å; M138-M142 WeakPolarHBondContact O-CB 3.41Å; M138-M142 WeakPolarHBondContact O-CG 3.44Å; M138-M142 PolarHBondContact O-N 3.24Å; M139-M142 PolarHBondContact O-N 2.87Å; C140-M142 VanDerWaalsContact C-N 3.31Å; C140-M142 PolarHBondContact O-N 3.49Å; M142-C145 PolarHBondContact O-N 3.49Å; M142-A146 VanDerWaalsContact O-CB 3.26Å; M142-A146 WeakPolarHBondContact O-CB 3.32Å; M142-A146 PolarHBondContact O-N 3.31Å; M142-H172 HydrophobicContact CE-CB 4.24Å; M142-H172 WeakPolarHBondContact CE-O 2.92Å; M142-I175 HydrophobicContact CE-CB 3.88Å; M142-I175 HydrophobicContact CE-CG2 3.81Å; M142-I175 HydrophobicContact CG-CG2 4.02Å; M142-I175 HydrophobicContact SD-CB 4.26Å; M142-I175 HydrophobicContact SD-CG2 4Å
143H97Very high95.8Very high7 Ų715.6 Ų15.63%0.0329%0.085CC..Hα-helixtrans-59.3-46.6170.4-88.3-78.5000111.5I83 M139 C140 C145 A146 S147 L228I83-H143 HydrophobicContact CD1-CB 4.49Å; I83-H143 VanDerWaalsContact CG2-NE2 3.28Å; I83-H143 WeakPolarHBondContact CG2-NE2 3.24Å; M139-H143 PolarHBondContact O-CD2 3.4Å; M139-H143 VanDerWaalsContact O-CD2 3.28Å; M139-H143 PolarHBondContact O-N 2.97Å; C140-H143 WeakPolarHBondContact O-CB 3.46Å; C140-H143 PolarHBondContact O-N 3.39Å; H143-C145 PolarHBondContact O-N 3.09Å; H143-A146 PolarHBondContact O-N 3.45Å; H143-S147 PolarHBondContact O-N 2.82Å; H143-S147 PolarHBondContact O-OG 3.25Å; H143-L228 HydrophobicContact CB-CD1 4.37Å; H143-L228 HydrophobicContact CB-CD2 4.16Å
144V97.5Very high95.4Very high21 Ų2116.4 Ų16.413%0.1279%0.09CC..Hα-helixtrans-58.7-48.5176.2174.20000110.7C140 N141 A146 S147 L148 Q224 F227 L228 I231C140-V144 PolarHBondContact O-N 3.5Å; N141-V144 PolarHBondContact O-N 2.92Å; V144-A146 PolarHBondContact O-N 2.87Å; V144-S147 PolarHBondContact O-N 3.2Å; V144-L148 HydrophobicContact CG1-CD1 3.93Å; V144-L148 HydrophobicContact CG1-CG 4.33Å; V144-L148 WeakPolarHBondContact O-CB 3.46Å; V144-L148 WeakPolarHBondContact O-CG 3.42Å; V144-L148 PolarHBondContact O-N 2.81Å; V144-Q224 HydrophobicContact CG2-CB 3.96Å; V144-Q224 WeakPolarHBondContact CG2-O 3.39Å; V144-F227 HydrophobicContact CG1-CB 4.46Å; V144-F227 HydrophobicContact CG2-CB 4.44Å; V144-L228 HydrophobicContact CG2-CB 4.28Å; V144-I231 HydrophobicContact CG1-CD1 3.83Å
145C96.3Very high94.9Very high19 Ų1919.9 Ų19.913%0.12810%0.103CC..Hα-helixtrans-60.6-42.6176.7-69.40000112.8Y79 N141 M142 H143 S147 L148 D149 I175Y79-C145 HydrophobicContact CD1-CB 4.09Å; Y79-C145 HydrophobicContact CE1-CB 4.25Å; N141-C145 PolarHBondContact O-N 3.01Å; N141-C145 PolarHBondContact O-SG 3.22Å; N141-C145 VanDerWaalsContact O-SG 3.41Å; M142-C145 PolarHBondContact O-N 3.49Å; H143-C145 PolarHBondContact O-N 3.09Å; C145-S147 VanDerWaalsContact C-N 3.3Å; C145-S147 PolarHBondContact O-N 2.87Å; C145-L148 PolarHBondContact O-N 3.09Å; C145-D149 WeakPolarHBondContact O-CB 3.41Å; C145-D149 PolarHBondContact O-N 3.46Å; C145-I175 VanDerWaalsContact SG-CD1 3.52Å
146A95.4Very high94.5Very high6 Ų623 Ų235%0.0512%0.119CC..Hα-helixtrans-64-34.617800000112.4Q76 I83 M142 H143 V144 R150Q76-A146 PolarHBondContact NE2-O 3.41Å; I83-A146 HydrophobicContact CD1-CB 4.11Å; M142-A146 VanDerWaalsContact O-CB 3.26Å; M142-A146 WeakPolarHBondContact O-CB 3.32Å; M142-A146 PolarHBondContact O-N 3.31Å; H143-A146 PolarHBondContact O-N 3.45Å; V144-A146 PolarHBondContact O-N 2.87Å; A146-R150 VanDerWaalsContact O-CG 3.28Å; A146-R150 WeakPolarHBondContact O-CG 3.36Å; A146-R150 PolarHBondContact O-N 3.48Å; A146-R150 PolarHBondContact O-NE 2.91Å
147S96Very high93.9Very high2 Ų226.6 Ų26.61%0.01414%0.142CC..Hα-helixtrans-77.1-40.3174.8-70.30000112.3H143 V144 C145 D149 R150 C151 L228 D232H143-S147 PolarHBondContact O-N 2.82Å; H143-S147 PolarHBondContact O-OG 3.25Å; V144-S147 PolarHBondContact O-N 3.2Å; C145-S147 VanDerWaalsContact C-N 3.3Å; C145-S147 PolarHBondContact O-N 2.87Å; S147-D149 VanDerWaalsContact C-N 3.34Å; S147-D149 PolarHBondContact O-N 3.34Å; S147-R150 PolarHBondContact O-N 3.36Å; S147-R150 PolarHBondContact OG-NH2 2.89Å; S147-C151 WeakPolarHBondContact O-CB 3.27Å; S147-C151 PolarHBondContact O-N 2.9Å; S147-L228 WeakPolarHBondContact OG-CD1 3.4Å; S147-D232 PolarHBondContact OG-OD1 3.03Å
148L95.2Very high93.2Very high73 Ų7331.6 Ų31.638%0.38217%0.172SC..Hα-helixtrans-58.6-45.8174-77.4173.5000111.5V144 C145 R150 C151 L152 I231V144-L148 HydrophobicContact CG1-CD1 3.93Å; V144-L148 HydrophobicContact CG1-CG 4.33Å; V144-L148 WeakPolarHBondContact O-CB 3.46Å; V144-L148 WeakPolarHBondContact O-CG 3.42Å; V144-L148 PolarHBondContact O-N 2.81Å; C145-L148 PolarHBondContact O-N 3.09Å; L148-R150 VanDerWaalsContact C-N 3.34Å; L148-R150 PolarHBondContact O-N 3.15Å; L148-C151 PolarHBondContact O-N 3.31Å; L148-L152 WeakPolarHBondContact O-CB 3.34Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.11Å; L148-L152 PolarHBondContact O-N 2.94Å; L148-I231 HydrophobicContact CD1-CD1 4.25Å; L148-I231 HydrophobicContact CD2-CD1 3.41Å; L148-I231 VanDerWaalsContact CD2-CD1 3.41Å; L148-I231 HydrophobicContact CD2-CG1 3.62Å; L148-I231 HydrophobicContact CD2-CG2 4.09Å; L148-I231 HydrophobicContact CG-CD1 3.51Å; L148-I231 HydrophobicContact CG-CG1 4.24Å; L148-I231 HydrophobicContact CG-CG2 4.44Å
149D93.3Very high92.6Very high11 Ų1138.1 Ų38.16%0.05920%0.2CC..Hα-helixtrans-60.6-43.3179.7-170.857.9000112.4R75 Q76 Y79 C145 S147 T153 M160R75-D149 IonicContact CZ-OD1 3.12Å; R75-D149 IonicContact CZ-OD2 3.79Å; R75-D149 VanDerWaalsContact NE-CG 3.34Å; R75-D149 IonicContact NE-OD1 2.7Å; R75-D149 PolarHBondContact NE-OD1 2.92Å; R75-D149 IonicContact NE-OD2 3.3Å; R75-D149 PolarHBondContact NE-OD2 3.5Å; R75-D149 IonicContact NH2-OD1 2.78Å; R75-D149 PolarHBondContact NH2-OD1 3.1Å; R75-D149 IonicContact NH2-OD2 3.36Å; R75-D149 PolarHBondContact NH2-OD2 3.06Å; Q76-D149 PolarHBondContact OE1-OD2 2.86Å; Y79-D149 HydrophobicContact CD2-CB 4.12Å; Y79-D149 HydrophobicContact CE2-CB 3.52Å; C145-D149 WeakPolarHBondContact O-CB 3.41Å; C145-D149 PolarHBondContact O-N 3.46Å; S147-D149 VanDerWaalsContact C-N 3.34Å; S147-D149 PolarHBondContact O-N 3.34Å; D149-T153 VanDerWaalsContact O-CB 3.29Å; D149-T153 WeakPolarHBondContact O-CB 3.27Å; D149-T153 PolarHBondContact O-N 3.45Å; D149-T153 PolarHBondContact O-OG1 2.84Å; D149-M160 VanDerWaalsContact OD1-CE 3.27Å; D149-M160 WeakPolarHBondContact OD1-CE 3.15Å
150R92Very high92Very high12 Ų1239.4 Ų39.45%0.04521%0.207CC..Hα-helixtrans-63.6-45175.9-69.3-178.7-59.2131.93.7111.4A146 S147 L148 T153 I154 D232 F235 S262 L265 T266A146-R150 VanDerWaalsContact O-CG 3.28Å; A146-R150 WeakPolarHBondContact O-CG 3.36Å; A146-R150 PolarHBondContact O-N 3.48Å; A146-R150 PolarHBondContact O-NE 2.91Å; S147-R150 PolarHBondContact O-N 3.36Å; S147-R150 PolarHBondContact OG-NH2 2.89Å; L148-R150 VanDerWaalsContact C-N 3.34Å; L148-R150 PolarHBondContact O-N 3.15Å; R150-T153 PolarHBondContact O-N 3.49Å; R150-I154 PolarHBondContact O-N 3.5Å; R150-D232 IonicContact CZ-OD1 3.86Å; R150-D232 IonicContact NH2-OD1 2.91Å; R150-D232 PolarHBondContact NH2-OD1 3.32Å; R150-F235 HydrophobicContact CB-CE2 4.42Å; R150-S262 PolarHBondContact NH1-O 3.35Å; R150-L265 VanDerWaalsContact NH1-C 3.27Å; R150-T266 PolarHBondContact NH1-OG1 3.44Å
151C93.5Very high91.2Very high14 Ų1448.5 Ų48.510%0.09525%0.246CC..Hα-helixtrans-60-54.6177.7-169.50000111S147 L148 T153 I154 Y155 I231 F235S147-C151 WeakPolarHBondContact O-CB 3.27Å; S147-C151 PolarHBondContact O-N 2.9Å; L148-C151 PolarHBondContact O-N 3.31Å; C151-T153 VanDerWaalsContact C-N 3.27Å; C151-T153 PolarHBondContact O-N 3.46Å; C151-I154 PolarHBondContact O-N 2.94Å; C151-Y155 WeakPolarHBondContact O-CD2 3.47Å; C151-Y155 PolarHBondContact O-N 3.06Å; C151-Y155 VanDerWaalsContact SG-CD2 3.58Å; C151-Y155 VanDerWaalsContact SG-CE2 3.52Å; C151-I231 HydrophobicContact CB-CG2 3.85Å; C151-F235 HydrophobicContact CB-CB 4.26Å
152L92.3Very high90.5Very high77 Ų7758.3 Ų58.340%0.40328%0.282SS..Hα-helixtrans-60.5-35.3179.6-68.7174.5000112.8L148 I154 Y155 I156 M160L148-L152 WeakPolarHBondContact O-CB 3.34Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.11Å; L148-L152 PolarHBondContact O-N 2.94Å; L152-I154 VanDerWaalsContact C-N 3.25Å; L152-I154 PolarHBondContact O-N 3.3Å; L152-Y155 PolarHBondContact O-N 3.43Å; L152-I156 PolarHBondContact O-N 2.88Å; L152-M160 HydrophobicContact CB-CE 4.04Å; L152-M160 HydrophobicContact CB-CG 4.1Å; L152-M160 HydrophobicContact CB-SD 3.9Å; L152-M160 WeakPolarHBondContact O-CG 3.38Å
153T89.6Confident89.8Confident32 Ų3261.6 Ų61.620%0.19630%0.297CS..Hα-helixtrans-62.7-32.1177-62.20000112.3D149 R150 C151 P157D149-T153 VanDerWaalsContact O-CB 3.29Å; D149-T153 WeakPolarHBondContact O-CB 3.27Å; D149-T153 PolarHBondContact O-N 3.45Å; D149-T153 PolarHBondContact O-OG1 2.84Å; R150-T153 PolarHBondContact O-N 3.49Å; C151-T153 VanDerWaalsContact C-N 3.27Å; C151-T153 PolarHBondContact O-N 3.46Å; T153-P157 WeakPolarHBondContact O-CA 3.5Å
154I87.3Confident89.2Confident17 Ų1764.5 Ų64.59%0.08732%0.316CS..Hα-helixtrans-83.8-39.8174.7-64.3-161.6000111.9R150 C151 L152 F235 K238 L239R150-I154 PolarHBondContact O-N 3.5Å; C151-I154 PolarHBondContact O-N 2.94Å; L152-I154 VanDerWaalsContact C-N 3.25Å; L152-I154 PolarHBondContact O-N 3.3Å; I154-F235 HydrophobicContact CD1-CD2 3.81Å; I154-F235 HydrophobicContact CD1-CE2 3.16Å; I154-F235 HydrophobicContact CD1-CZ 3.86Å; I154-F235 HydrophobicContact CG1-CD2 4.34Å; I154-F235 HydrophobicContact CG1-CE2 3.93Å; I154-K238 HydrophobicContact CG2-CB 4.41Å; I154-K238 HydrophobicContact CG2-CG 3.63Å; I154-L239 HydrophobicContact CD1-CD1 4.12Å
155Y88Confident88.5Confident98 Ų9868.9 Ų68.938%0.38433%0.333SS..Hα-helixtrans-70.5-39.7-178.4-87.9-97.4000112.7C151 L152 A234 K238C151-Y155 WeakPolarHBondContact O-CD2 3.47Å; C151-Y155 PolarHBondContact O-N 3.06Å; C151-Y155 VanDerWaalsContact SG-CD2 3.58Å; C151-Y155 VanDerWaalsContact SG-CE2 3.52Å; L152-Y155 PolarHBondContact O-N 3.43Å; Y155-A234 WeakPolarHBondContact CE2-O 3.33Å; Y155-A234 PolarHBondContact OH-O 3.43Å; Y155-K238 HydrophobicContact CD1-CD 4.15Å; Y155-K238 HydrophobicContact CD1-CG 4.41Å; Y155-K238 HydrophobicContact CD2-CB 4.13Å; Y155-K238 HydrophobicContact CD2-CG 3.89Å; Y155-K238 HydrophobicContact CE1-CB 4.38Å; Y155-K238 HydrophobicContact CE1-CD 3.88Å; Y155-K238 HydrophobicContact CE1-CG 4.2Å; Y155-K238 HydrophobicContact CE2-CB 3.42Å; Y155-K238 VanDerWaalsContact CE2-CB 3.42Å; Y155-K238 HydrophobicContact CE2-CD 4.27Å; Y155-K238 HydrophobicContact CE2-CG 3.66Å; Y155-K238 HydrophobicContact CG-CD 4.46Å; Y155-K238 HydrophobicContact CG-CG 4.27Å
156I89.1Confident88.2Confident66 Ų6672.6 Ų72.634%0.33835%0.351SS..  trans-136.864.8-173.3-39.4177.8000110.8L152 T158 K159 M160L152-I156 PolarHBondContact O-N 2.88Å; I156-T158 VanDerWaalsContact C-N 3.26Å; I156-T158 PolarHBondContact O-N 2.86Å; I156-K159 HydrophobicContact CG2-CB 3.71Å; I156-K159 HydrophobicContact CG2-CD 3.82Å; I156-K159 HydrophobicContact CG2-CG 3.59Å; I156-K159 PolarHBondContact O-N 3.37Å; I156-M160 WeakPolarHBondContact O-CG 3.45Å; I156-M160 PolarHBondContact O-N 3.08Å; I156-M160 VanDerWaalsContact O-N 3.1Å
157P84.3Confident87.8Confident75 Ų7577.8 Ų77.849%0.48737%0.37SS..Hα-helixtrans-60.4-33.4-173.223.6-34.4000113.2T153 K161T153-P157 WeakPolarHBondContact O-CA 3.5Å; P157-K161 VanDerWaalsContact O-CB 3.28Å; P157-K161 WeakPolarHBondContact O-CB 3.45Å; P157-K161 PolarHBondContact O-N 3.34Å
158T82.3Confident87.6Confident104 Ų10477.7 Ų77.764%0.63837%0.37SS*.Hα-helixtrans-66.5-44.2-178.851.70000112.6I156I156-T158 VanDerWaalsContact C-N 3.26Å; I156-T158 PolarHBondContact O-N 2.86Å
159K84.6Confident87.5Confident148 Ų14876.3 Ų76.364%0.64336%0.359SS*.Hα-helixtrans-69.9-43.9176-65.3-167.9-172.6-179.90110.9I156 K161 R162 F163I156-K159 HydrophobicContact CG2-CB 3.71Å; I156-K159 HydrophobicContact CG2-CD 3.82Å; I156-K159 HydrophobicContact CG2-CG 3.59Å; I156-K159 PolarHBondContact O-N 3.37Å; K159-K161 VanDerWaalsContact C-N 3.31Å; K159-K161 PolarHBondContact O-N 3.04Å; K159-R162 PolarHBondContact O-N 2.91Å; K159-R162 VanDerWaalsContact O-N 3.16Å; K159-F163 PolarHBondContact O-N 3.21Å
160M85.6Confident87.6Confident27 Ų2782.4 Ų82.413%0.13338%0.382CS..Hα-helixtrans-69.3-25.6-177.5-63.1-54.1-69.600113.9R75 D149 L152 I156 F163R75-M160 PolarHBondContact NH1-O 3.45Å; R75-M160 VanDerWaalsContact NH2-CE 3.3Å; D149-M160 VanDerWaalsContact OD1-CE 3.27Å; D149-M160 WeakPolarHBondContact OD1-CE 3.15Å; L152-M160 HydrophobicContact CB-CE 4.04Å; L152-M160 HydrophobicContact CB-CG 4.1Å; L152-M160 HydrophobicContact CB-SD 3.9Å; L152-M160 WeakPolarHBondContact O-CG 3.38Å; I156-M160 WeakPolarHBondContact O-CG 3.45Å; I156-M160 PolarHBondContact O-N 3.08Å; I156-M160 VanDerWaalsContact O-N 3.1Å; M160-F163 WeakPolarHBondContact O-CB 3.39Å; M160-F163 PolarHBondContact O-N 3.33Å
161K80.7Confident87.7Confident193 Ų19384.5 Ų84.584%0.83939%0.394SS*.Hα-helixtrans-68-34.2172.6-174.6178.1179.7-177.30112.5P157 K159 F163P157-K161 VanDerWaalsContact O-CB 3.28Å; P157-K161 WeakPolarHBondContact O-CB 3.45Å; P157-K161 PolarHBondContact O-N 3.34Å; K159-K161 VanDerWaalsContact C-N 3.31Å; K159-K161 PolarHBondContact O-N 3.04Å; K161-F163 VanDerWaalsContact C-N 3.33Å
162R83.9Confident87.8Confident223 Ų22384.5 Ų84.584%0.84239%0.393SS*.Hα-helixtrans-80.3-17.1176.7-66.6-177.1-178.1173.20.5112.7K159 P164K159-R162 PolarHBondContact O-N 2.91Å; K159-R162 VanDerWaalsContact O-N 3.16Å; R162-P164 WeakPolarHBondContact O-CD 3.21Å
163F81Confident88Confident69 Ų6985.3 Ų85.330%0.30340%0.396SS..SBendtrans-67.8113-176.8-161.2-100.1000111.2R75 K159 M160 K161 Y167 I171R75-F163 PolarHBondContact NH1-O 3.14Å; K159-F163 PolarHBondContact O-N 3.21Å; M160-F163 WeakPolarHBondContact O-CB 3.39Å; M160-F163 PolarHBondContact O-N 3.33Å; K161-F163 VanDerWaalsContact C-N 3.33Å; F163-Y167 AromaticContact CE1-CG 3.94Å; F163-Y167 HydrophobicContact CE1-CG 3.94Å; F163-Y167 HydrophobicContact CE2-CD1 4.28Å; F163-Y167 HydrophobicContact CE2-CG 4.17Å; F163-Y167 AromaticContact CZ-CD1 3.91Å; F163-Y167 HydrophobicContact CZ-CD1 3.91Å; F163-Y167 HydrophobicContact CZ-CD2 4.47Å; F163-Y167 AromaticContact CZ-CG 3.68Å; F163-Y167 HydrophobicContact CZ-CG 3.68Å; F163-I171 HydrophobicContact CE1-CD1 4.34Å; F163-I171 HydrophobicContact CZ-CD1 4.41Å
164P84.5Confident88.4Confident67 Ų6785.5 Ų85.544%0.43541%0.405SS..  trans-64.8153-174.2-20.932.2000112.9R162 L166 Y167R162-P164 WeakPolarHBondContact O-CD 3.21Å; P164-L166 PolarHBondContact O-N 3.11Å; P164-Y167 HydrophobicContact CB-CD2 3.91Å; P164-Y167 HydrophobicContact CB-CE2 4.29Å; P164-Y167 HydrophobicContact CG-CD2 3.84Å; P164-Y167 HydrophobicContact CG-CE2 3.8Å; P164-Y167 PolarHBondContact O-N 3.24Å
165K84.2Confident88.9Confident114 Ų11485.7 Ų85.750%0.49641%0.406SS..THydrogen-bonded Turntrans-63.1-31.4177.8-62.1175.4-177.21770112.7Y167 G168K165-Y167 PolarHBondContact O-N 3.37Å; K165-G168 PolarHBondContact O-N 3.17Å
166L88.6Confident89.3Confident97 Ų9784.2 Ų84.251%0.50840%0.404SS..Hα-helixtrans-57.5-35.9179.8-174.764000112.5P164 G168 W169 Y170P164-L166 PolarHBondContact O-N 3.11Å; L166-G168 PolarHBondContact O-N 3.35Å; L166-W169 WeakPolarHBondContact O-CB 3.35Å; L166-W169 PolarHBondContact O-N 3.42Å; L166-Y170 HydrophobicContact CD2-CE2 3.94Å; L166-Y170 HydrophobicContact CG-CD2 4.44Å; L166-Y170 HydrophobicContact CG-CE2 3.78Å; L166-Y170 PolarHBondContact O-N 2.98Å
167Y88.4Confident89.8Confident115 Ų11586.2 Ų86.245%0.45142%0.415SS..Hα-helixtrans-64.2-25.9175.7-76-91.9000113.2F163 P164 K165 W169 Y170 I171F163-Y167 AromaticContact CE1-CG 3.94Å; F163-Y167 HydrophobicContact CE1-CG 3.94Å; F163-Y167 HydrophobicContact CE2-CD1 4.28Å; F163-Y167 HydrophobicContact CE2-CG 4.17Å; F163-Y167 AromaticContact CZ-CD1 3.91Å; F163-Y167 HydrophobicContact CZ-CD1 3.91Å; F163-Y167 HydrophobicContact CZ-CD2 4.47Å; F163-Y167 AromaticContact CZ-CG 3.68Å; F163-Y167 HydrophobicContact CZ-CG 3.68Å; P164-Y167 HydrophobicContact CB-CD2 3.91Å; P164-Y167 HydrophobicContact CB-CE2 4.29Å; P164-Y167 HydrophobicContact CG-CD2 3.84Å; P164-Y167 HydrophobicContact CG-CE2 3.8Å; P164-Y167 PolarHBondContact O-N 3.24Å; K165-Y167 PolarHBondContact O-N 3.37Å; Y167-W169 PolarHBondContact O-N 3.42Å; Y167-Y170 HydrophobicContact CD1-CD2 4.23Å; Y167-Y170 HydrophobicContact CG-CD2 4.44Å; Y167-Y170 PolarHBondContact O-N 3.46Å; Y167-I171 VanDerWaalsContact O-CG1 3.28Å; Y167-I171 WeakPolarHBondContact O-CG1 3.35Å; Y167-I171 PolarHBondContact O-N 2.77Å
168G90.9Very high90.4Very high0 Ų086.5 Ų86.50%041%0.412CS..Hα-helixtrans-59.7-38.2171.300000112.1K165 L166 H172K165-G168 PolarHBondContact O-N 3.17Å; L166-G168 PolarHBondContact O-N 3.35Å; G168-H172 WeakPolarHBondContact O-CB 3.42Å; G168-H172 PolarHBondContact O-N 2.89Å
169W93.9Very high91.1Very high44 Ų4481.5 Ų81.517%0.16738%0.381CS..Hα-helixtrans-73-38.7175.8-72.6111.8000112.5T66 I67 A70 I78 L166 Y167 I171 H172 I173T66-W169 HydrophobicContact CG2-CH2 4.25Å; T66-W169 HydrophobicContact CG2-CZ2 4.31Å; I67-W169 HydrophobicContact CG1-CH2 3.99Å; I67-W169 HydrophobicContact CG1-CZ3 4.35Å; A70-W169 HydrophobicContact CB-CH2 4.43Å; A70-W169 HydrophobicContact CB-CZ2 3.5Å; A70-W169 PolarHBondContact O-NE1 3.44Å; I78-W169 HydrophobicContact CD1-CD2 4.27Å; I78-W169 HydrophobicContact CD1-CG 4.19Å; I78-W169 HydrophobicContact CD1-CZ2 4.43Å; I78-W169 HydrophobicContact CG1-CZ2 4.08Å; I78-W169 HydrophobicContact CG2-CD2 3.9Å; I78-W169 HydrophobicContact CG2-CE3 3.9Å; I78-W169 HydrophobicContact CG2-CG 4.44Å; I78-W169 HydrophobicContact CG2-CH2 4.29Å; I78-W169 HydrophobicContact CG2-CZ2 4.28Å; I78-W169 HydrophobicContact CG2-CZ3 4.11Å; L166-W169 WeakPolarHBondContact O-CB 3.35Å; L166-W169 PolarHBondContact O-N 3.42Å; Y167-W169 PolarHBondContact O-N 3.42Å; W169-I171 VanDerWaalsContact C-N 3.35Å; W169-I171 PolarHBondContact O-N 2.87Å; W169-H172 HydrophobicContact CE3-CB 4.4Å; W169-H172 WeakPolarHBondContact O-CB 3.48Å; W169-H172 PolarHBondContact O-N 3.12Å; W169-I173 WeakPolarHBondContact O-CG1 3.29Å; W169-I173 PolarHBondContact O-N 3.28Å
170Y94.8Very high91.7Very high138 Ų13875.5 Ų75.554%0.54136%0.359SS..Hα-helixtrans-61.8-42.9173.2-65.1-40.5000112.2L166 Y167 H172 I173 G174L166-Y170 HydrophobicContact CD2-CE2 3.94Å; L166-Y170 HydrophobicContact CG-CD2 4.44Å; L166-Y170 HydrophobicContact CG-CE2 3.78Å; L166-Y170 PolarHBondContact O-N 2.98Å; Y167-Y170 HydrophobicContact CD1-CD2 4.23Å; Y167-Y170 HydrophobicContact CG-CD2 4.44Å; Y167-Y170 PolarHBondContact O-N 3.46Å; Y170-H172 VanDerWaalsContact C-N 3.32Å; Y170-H172 PolarHBondContact O-N 2.94Å; Y170-I173 PolarHBondContact O-N 3.05Å; Y170-G174 PolarHBondContact O-N 3.1Å
171I95.2Very high92.3Very high57 Ų5779.6 Ų79.629%0.29238%0.381SS..Hα-helixtrans-62.7-43.4173.5-65.6165.5000109.6Y79 F163 Y167 W169 I173 G174 I175Y79-I171 HydrophobicContact CE1-CB 4.11Å; Y79-I171 HydrophobicContact CE1-CG2 3.7Å; Y79-I171 VanDerWaalsContact OH-CD1 3.3Å; Y79-I171 WeakPolarHBondContact OH-CD1 3.06Å; F163-I171 HydrophobicContact CE1-CD1 4.34Å; F163-I171 HydrophobicContact CZ-CD1 4.41Å; Y167-I171 VanDerWaalsContact O-CG1 3.28Å; Y167-I171 WeakPolarHBondContact O-CG1 3.35Å; Y167-I171 PolarHBondContact O-N 2.77Å; W169-I171 VanDerWaalsContact C-N 3.35Å; W169-I171 PolarHBondContact O-N 2.87Å; I171-I173 PolarHBondContact O-N 2.85Å; I171-G174 PolarHBondContact O-N 2.77Å; I171-I175 HydrophobicContact CG2-CG1 4.16Å; I171-I175 VanDerWaalsContact O-CG1 3.29Å; I171-I175 WeakPolarHBondContact O-CG1 3.42Å; I171-I175 PolarHBondContact O-N 3.35Å
172H94.9Very high93Very high13 Ų1371.8 Ų71.86%0.0635%0.348CS..Hα-helixtrans-58.8-48.1179.7-168.5114.2000112.4I78 G82 M142 G168 W169 Y170 I175 L176I78-H172 HydrophobicContact CG2-CB 4Å; I78-H172 PolarHBondContact O-CE1 3.39Å; I78-H172 PolarHBondContact O-ND1 2.87Å; I78-H172 VanDerWaalsContact O-ND1 3.09Å; G82-H172 WeakPolarHBondContact CA-CE1 3.36Å; G82-H172 PolarHBondContact N-CE1 3.48Å; M142-H172 HydrophobicContact CE-CB 4.24Å; M142-H172 WeakPolarHBondContact CE-O 2.92Å; G168-H172 WeakPolarHBondContact O-CB 3.42Å; G168-H172 PolarHBondContact O-N 2.89Å; W169-H172 HydrophobicContact CE3-CB 4.4Å; W169-H172 WeakPolarHBondContact O-CB 3.48Å; W169-H172 PolarHBondContact O-N 3.12Å; Y170-H172 VanDerWaalsContact C-N 3.32Å; Y170-H172 PolarHBondContact O-N 2.94Å; H172-I175 PolarHBondContact O-N 3.35Å; H172-L176 PolarHBondContact O-N 3.44Å
173I96.6Very high93.6Very high94 Ų9461.2 Ų61.248%0.48231%0.308SS..Hα-helixtrans-65.7-42176.2-65.6168.9000110.6W169 Y170 I171 I175 L176 L177W169-I173 WeakPolarHBondContact O-CG1 3.29Å; W169-I173 PolarHBondContact O-N 3.28Å; Y170-I173 PolarHBondContact O-N 3.05Å; I171-I173 PolarHBondContact O-N 2.85Å; I173-I175 VanDerWaalsContact C-N 3.31Å; I173-I175 PolarHBondContact O-N 3.03Å; I173-L176 WeakPolarHBondContact O-CB 3.34Å; I173-L176 PolarHBondContact O-N 3.46Å; I173-L177 HydrophobicContact CG2-CD1 4.16Å; I173-L177 HydrophobicContact CG2-CG 4.43Å; I173-L177 WeakPolarHBondContact O-CG 3.5Å; I173-L177 PolarHBondContact O-N 2.93Å
174G97.7Very high94.2Very high36 Ų3661.1 Ų61.137%0.37131%0.31SS..Hα-helixtrans-58.7-41.3176.600000112.7Y170 I171 L177 L178Y170-G174 PolarHBondContact O-N 3.1Å; I171-G174 PolarHBondContact O-N 2.77Å; G174-L177 PolarHBondContact O-N 2.9Å; G174-L178 VanDerWaalsContact O-CB 3.26Å; G174-L178 WeakPolarHBondContact O-CB 3.2Å; G174-L178 PolarHBondContact O-N 3.47Å
175I97.7Very high94.6Very high22 Ų2260.5 Ų60.511%0.11331%0.306CS..Hα-helixtrans-69.2-38.6175.8-66.1-60.6000111.8N141 M142 C145 I171 H172 I173 L177 L178 S179N141-I175 HydrophobicContact CB-CG2 3.59Å; M142-I175 HydrophobicContact CE-CB 3.88Å; M142-I175 HydrophobicContact CE-CG2 3.81Å; M142-I175 HydrophobicContact CG-CG2 4.02Å; M142-I175 HydrophobicContact SD-CB 4.26Å; M142-I175 HydrophobicContact SD-CG2 4Å; C145-I175 VanDerWaalsContact SG-CD1 3.52Å; I171-I175 HydrophobicContact CG2-CG1 4.16Å; I171-I175 VanDerWaalsContact O-CG1 3.29Å; I171-I175 WeakPolarHBondContact O-CG1 3.42Å; I171-I175 PolarHBondContact O-N 3.35Å; H172-I175 PolarHBondContact O-N 3.35Å; I173-I175 VanDerWaalsContact C-N 3.31Å; I173-I175 PolarHBondContact O-N 3.03Å; I175-L177 PolarHBondContact O-N 3.31Å; I175-L178 HydrophobicContact CD1-CD2 4.23Å; I175-L178 PolarHBondContact O-N 2.64Å; I175-S179 WeakPolarHBondContact O-CB 3.36Å; I175-S179 PolarHBondContact O-N 3.02Å; I175-S179 PolarHBondContact O-OG 3.05Å; I175-S179 VanDerWaalsContact O-OG 3.1Å
176L97.4Very high95Very high67 Ų6755.1 Ų55.135%0.35128%0.283SS..Hα-helixtrans-57.8-49.7173.4-177.5157.2000110.8F134 M138 H172 I173 S179 A180F134-L176 HydrophobicContact CZ-CG 4.3Å; M138-L176 HydrophobicContact CE-CB 4.17Å; M138-L176 HydrophobicContact CE-CD1 4.23Å; M138-L176 HydrophobicContact CE-CG 4.38Å; M138-L176 HydrophobicContact SD-CB 4.5Å; M138-L176 HydrophobicContact SD-CG 4.4Å; H172-L176 PolarHBondContact O-N 3.44Å; I173-L176 WeakPolarHBondContact O-CB 3.34Å; I173-L176 PolarHBondContact O-N 3.46Å; L176-S179 PolarHBondContact O-N 3.31Å; L176-A180 WeakPolarHBondContact O-CB 3.36Å; L176-A180 PolarHBondContact O-N 3.35Å
177L98Very high95.2Very high108 Ų10851.8 Ų51.857%0.56527%0.269SS*.Hα-helixtrans-65.5-42.7179.1-65.7176.4000112I173 G174 I175 A180 L181I173-L177 HydrophobicContact CG2-CD1 4.16Å; I173-L177 HydrophobicContact CG2-CG 4.43Å; I173-L177 WeakPolarHBondContact O-CG 3.5Å; I173-L177 PolarHBondContact O-N 2.93Å; G174-L177 PolarHBondContact O-N 2.9Å; I175-L177 PolarHBondContact O-N 3.31Å; L177-A180 PolarHBondContact O-N 2.98Å; L177-L181 WeakPolarHBondContact O-CB 3.48Å; L177-L181 PolarHBondContact O-N 3.32Å
178L97.6Very high95.4Very high80 Ų8053.9 Ų53.942%0.41928%0.281SS..Hα-helixtrans-59.8-47.8176.1178.864.8000111.2G174 I175 A180 L181 M182G174-L178 VanDerWaalsContact O-CB 3.26Å; G174-L178 WeakPolarHBondContact O-CB 3.2Å; G174-L178 PolarHBondContact O-N 3.47Å; I175-L178 HydrophobicContact CD1-CD2 4.23Å; I175-L178 PolarHBondContact O-N 2.64Å; L178-A180 VanDerWaalsContact C-N 3.33Å; L178-A180 PolarHBondContact O-N 2.77Å; L178-L181 PolarHBondContact O-N 3.16Å; L178-M182 HydrophobicContact CD1-CG 4.29Å; L178-M182 HydrophobicContact CD1-SD 4.33Å; L178-M182 HydrophobicContact CD2-SD 4.48Å; L178-M182 HydrophobicContact CG-CG 4.38Å; L178-M182 HydrophobicContact CG-SD 3.95Å; L178-M182 WeakPolarHBondContact O-CB 3.34Å; L178-M182 WeakPolarHBondContact O-CG 3.36Å; L178-M182 PolarHBondContact O-N 3.42Å
179S97.8Very high95.6Very high0 Ų060 Ų600%030%0.304CS..Hα-helixtrans-64.3-38179-69.20000112.5M138 N141 I175 L176 M183M138-S179 VanDerWaalsContact CA-OG 3.23Å; M138-S179 WeakPolarHBondContact CA-OG 3.26Å; M138-S179 PolarHBondContact N-OG 2.97Å; N141-S179 PolarHBondContact ND2-OG 3.12Å; I175-S179 WeakPolarHBondContact O-CB 3.36Å; I175-S179 PolarHBondContact O-N 3.02Å; I175-S179 PolarHBondContact O-OG 3.05Å; I175-S179 VanDerWaalsContact O-OG 3.1Å; L176-S179 PolarHBondContact O-N 3.31Å; S179-M183 PolarHBondContact O-N 2.72Å
180A97.4Very high95.6Very high22 Ų2257.9 Ų57.918%0.18230%0.296CS..Hα-helixtrans-62-48.9173.400000110.6F134 L176 L177 L178 M182 M183 I184F134-A180 HydrophobicContact CD2-CB 4.09Å; F134-A180 HydrophobicContact CE2-CB 3.92Å; L176-A180 WeakPolarHBondContact O-CB 3.36Å; L176-A180 PolarHBondContact O-N 3.35Å; L177-A180 PolarHBondContact O-N 2.98Å; L178-A180 VanDerWaalsContact C-N 3.33Å; L178-A180 PolarHBondContact O-N 2.77Å; A180-M182 PolarHBondContact O-N 3.22Å; A180-M183 PolarHBondContact O-N 2.7Å; A180-I184 WeakPolarHBondContact O-CG1 3.11Å; A180-I184 PolarHBondContact O-N 3.16Å
181L97.1Very high95.5Very high113 Ų11352.8 Ų52.859%0.59228%0.278SS*.Hα-helixtrans-59.5-44.7178.2-177.962.7000112.3L177 L178 M183 I184L177-L181 WeakPolarHBondContact O-CB 3.48Å; L177-L181 PolarHBondContact O-N 3.32Å; L178-L181 PolarHBondContact O-N 3.16Å; L181-M183 PolarHBondContact O-N 2.98Å; L181-I184 HydrophobicContact CD1-CD1 3.8Å; L181-I184 WeakPolarHBondContact O-CB 3.4Å; L181-I184 WeakPolarHBondContact O-CG1 3.24Å; L181-I184 PolarHBondContact O-N 3.25Å
182M96.1Very high95.4Very high29 Ų2952.8 Ų52.814%0.14327%0.274CS..Hα-helixtrans-58.8-36.4178.2-73.2173.973.900111.9T137 L178 A180 P185 Y213 F217T137-M182 HydrophobicContact CG2-CE 4.18Å; T137-M182 HydrophobicContact CG2-SD 4.16Å; L178-M182 HydrophobicContact CD1-CG 4.29Å; L178-M182 HydrophobicContact CD1-SD 4.33Å; L178-M182 HydrophobicContact CD2-SD 4.48Å; L178-M182 HydrophobicContact CG-CG 4.38Å; L178-M182 HydrophobicContact CG-SD 3.95Å; L178-M182 WeakPolarHBondContact O-CB 3.34Å; L178-M182 WeakPolarHBondContact O-CG 3.36Å; L178-M182 PolarHBondContact O-N 3.42Å; A180-M182 PolarHBondContact O-N 3.22Å; M182-P185 WeakPolarHBondContact O-CD 3.47Å; M182-Y213 VanDerWaalsContact O-CE1 3.28Å; M182-Y213 WeakPolarHBondContact O-CE1 3.16Å; M182-Y213 PolarHBondContact O-OH 2.87Å; M182-F217 HydrophobicContact CE-CB 4.02Å; M182-F217 HydrophobicContact CE-CD1 3.21Å; M182-F217 HydrophobicContact CE-CE1 3.77Å; M182-F217 HydrophobicContact CE-CG 3.82Å
183M95.8Very high95.2Very high0 Ų056.2 Ų56.20%029%0.287CS..THydrogen-bonded Turntrans-92.73.1-175.9-65.2-60.4113.900114.3Y130 A133 F134 T137 S179 A180 L181 F186 A187 Y213 F217Y130-M183 HydrophobicContact CD2-CB 4.11Å; Y130-M183 HydrophobicContact CE2-CB 3.82Å; A133-M183 HydrophobicContact CB-CG 4.22Å; A133-M183 HydrophobicContact CB-SD 3.87Å; F134-M183 HydrophobicContact CB-CB 4.49Å; T137-M183 HydrophobicContact CG2-CE 4.16Å; T137-M183 WeakPolarHBondContact OG1-CE 3.5Å; S179-M183 PolarHBondContact O-N 2.72Å; A180-M183 PolarHBondContact O-N 2.7Å; L181-M183 PolarHBondContact O-N 2.98Å; M183-F186 WeakPolarHBondContact O-CB 3.42Å; M183-F186 PolarHBondContact O-N 3.06Å; M183-A187 PolarHBondContact O-N 2.91Å; M183-A187 VanDerWaalsContact O-N 3.14Å; M183-Y213 HydrophobicContact CE-CE1 3.67Å; M183-F217 HydrophobicContact CE-CB 3.87Å
184I94.3Very high94.6Very high68 Ų6857.9 Ų57.935%0.34930%0.296SS..Hα-helixtrans-56.4-46.4174.8-67.6-172.9000113A180 L181 F186 A187 F188A180-I184 WeakPolarHBondContact O-CG1 3.11Å; A180-I184 PolarHBondContact O-N 3.16Å; L181-I184 HydrophobicContact CD1-CD1 3.8Å; L181-I184 WeakPolarHBondContact O-CB 3.4Å; L181-I184 WeakPolarHBondContact O-CG1 3.24Å; L181-I184 PolarHBondContact O-N 3.25Å; I184-F186 PolarHBondContact O-N 3.18Å; I184-A187 WeakPolarHBondContact O-CB 3.32Å; I184-A187 PolarHBondContact O-N 3.23Å; I184-F188 HydrophobicContact CG2-CD2 3.59Å; I184-F188 HydrophobicContact CG2-CE2 3.37Å; I184-F188 WeakPolarHBondContact O-CD2 3.18Å; I184-F188 PolarHBondContact O-N 3.37Å
185P92.8Very high93.7Very high53 Ų5358.8 Ų58.834%0.34429%0.294SS..Hα-helixtrans-57.7-37.2179.5-2535.2000112.5M182 R189M182-P185 WeakPolarHBondContact O-CD 3.47Å; P185-R189 WeakPolarHBondContact O-CB 3.35Å; P185-R189 WeakPolarHBondContact O-CG 3.34Å; P185-R189 PolarHBondContact O-N 2.78Å
186F92Very high92.8Very high2 Ų261 Ų611%0.00932%0.322CS..Hα-helixtrans-68.2-39.4177.2-167.4-112.9000111.7R129 A133 M183 I184 F188 R189 V190 W202 V203 V210 H214R129-F186 HydrophobicContact CB-CE1 3.83Å; R129-F186 HydrophobicContact CB-CZ 4.4Å; R129-F186 WeakPolarHBondContact O-CE1 3.4Å; A133-F186 HydrophobicContact CB-CD1 3.69Å; A133-F186 HydrophobicContact CB-CE1 3.86Å; M183-F186 WeakPolarHBondContact O-CB 3.42Å; M183-F186 PolarHBondContact O-N 3.06Å; I184-F186 PolarHBondContact O-N 3.18Å; F186-F188 VanDerWaalsContact C-N 3.3Å; F186-F188 PolarHBondContact O-N 2.67Å; F186-R189 PolarHBondContact O-N 3.36Å; F186-V190 HydrophobicContact CD1-CG2 3.93Å; F186-V190 HydrophobicContact CD2-CG2 3.81Å; F186-V190 HydrophobicContact CE1-CG2 3.71Å; F186-V190 HydrophobicContact CE2-CG2 3.57Å; F186-V190 HydrophobicContact CG-CG2 3.99Å; F186-V190 HydrophobicContact CZ-CG2 3.51Å; F186-V190 WeakPolarHBondContact O-CB 3.38Å; F186-V190 VanDerWaalsContact O-CG2 3.22Å; F186-V190 WeakPolarHBondContact O-CG2 3.45Å; F186-V190 PolarHBondContact O-N 2.84Å; F186-V190 VanDerWaalsContact O-N 3.11Å; F186-W202 HydrophobicContact CE2-CH2 4.49Å; F186-W202 HydrophobicContact CZ-CH2 4.18Å; F186-W202 HydrophobicContact CZ-CZ3 4.1Å; F186-V203 HydrophobicContact CD2-CG2 3.76Å; F186-V203 HydrophobicContact CE2-CG2 3.52Å; F186-V210 HydrophobicContact CD2-CG1 4.21Å; F186-H214 HydrophobicContact CD2-CB 4.19Å; F186-H214 AromaticContact CD2-CD2 3.76Å; F186-H214 AromaticContact CE1-CD2 3.86Å; F186-H214 AromaticContact CE1-NE2 3.94Å; F186-H214 HydrophobicContact CE2-CB 4.19Å; F186-H214 AromaticContact CE2-CD2 3.55Å; F186-H214 AromaticContact CE2-CG 3.82Å; F186-H214 AromaticContact CZ-CD2 3.61Å; F186-H214 AromaticContact CZ-NE2 3.76Å
187A92.7Very high92Very high27 Ų2765.9 Ų65.922%0.22334%0.343CS..Hα-helixtrans-57.9-39.8177.800000113.3Y130 M183 I184Y130-A187 HydrophobicContact CD2-CB 3.52Å; Y130-A187 HydrophobicContact CE2-CB 4.11Å; Y130-A187 HydrophobicContact CG-CB 4Å; M183-A187 PolarHBondContact O-N 2.91Å; M183-A187 VanDerWaalsContact O-N 3.14Å; I184-A187 WeakPolarHBondContact O-CB 3.32Å; I184-A187 PolarHBondContact O-N 3.23Å
188F93.3Very high91.3Very high158 Ų15863.2 Ų63.269%0.69333%0.326SS*.Hα-helixtrans-84.5-25-177.9-71.9-63.9000114I184 F186I184-F188 HydrophobicContact CG2-CD2 3.59Å; I184-F188 HydrophobicContact CG2-CE2 3.37Å; I184-F188 WeakPolarHBondContact O-CD2 3.18Å; I184-F188 PolarHBondContact O-N 3.37Å; F186-F188 VanDerWaalsContact C-N 3.3Å; F186-F188 PolarHBondContact O-N 2.67Å
189R94.1Very high90.9Very high129 Ų12960.6 Ų60.649%0.48731%0.312SS..Hα-helixtrans-94.5-28-172.7-68.7-74.3-172.4121.6-4.8113.7P185 F186 R193 V203 D207 V210P185-R189 WeakPolarHBondContact O-CB 3.35Å; P185-R189 WeakPolarHBondContact O-CG 3.34Å; P185-R189 PolarHBondContact O-N 2.78Å; F186-R189 PolarHBondContact O-N 3.36Å; R189-R193 PolarHBondContact O-NH2 2.89Å; R189-V203 HydrophobicContact CB-CG1 4.46Å; R189-D207 IonicContact CZ-OD2 3.19Å; R189-D207 IonicContact NH1-OD2 2.74Å; R189-D207 PolarHBondContact NH1-OD2 3.38Å; R189-V210 HydrophobicContact CB-CG1 4.2Å; R189-V210 HydrophobicContact CG-CG2 4.1Å
190V94Very high90.4Very high0 Ų062.4 Ų62.40%032%0.321CS..  trans-63.6133.9172.9169.10000109.6R126 R129 F186 V203R126-V190 HydrophobicContact CG-CG1 4.32Å; R126-V190 WeakPolarHBondContact CG-O 3.5Å; R126-V190 PolarHBondContact NE-O 3.3Å; R129-V190 HydrophobicContact CB-CG1 3.87Å; R129-V190 HydrophobicContact CB-CG2 4.24Å; R129-V190 HydrophobicContact CG-CG1 3.84Å; F186-V190 HydrophobicContact CD1-CG2 3.93Å; F186-V190 HydrophobicContact CD2-CG2 3.81Å; F186-V190 HydrophobicContact CE1-CG2 3.71Å; F186-V190 HydrophobicContact CE2-CG2 3.57Å; F186-V190 HydrophobicContact CG-CG2 3.99Å; F186-V190 HydrophobicContact CZ-CG2 3.51Å; F186-V190 WeakPolarHBondContact O-CB 3.38Å; F186-V190 VanDerWaalsContact O-CG2 3.22Å; F186-V190 WeakPolarHBondContact O-CG2 3.45Å; F186-V190 PolarHBondContact O-N 2.84Å; F186-V190 VanDerWaalsContact O-N 3.11Å; V190-V203 HydrophobicContact CG2-CG2 3.7Å
191D93.8Very high90.1Very high31 Ų3161.6 Ų61.617%0.16631%0.314CS..EExtended strand (participates in β ladder)trans-157.6-179.5169.5-148.30.4000111.7P122 R126 R193 C201 W202P122-D191 WeakPolarHBondContact CB-OD1 3.44Å; R126-D191 IonicContact CZ-OD1 3.65Å; R126-D191 IonicContact CZ-OD2 3.64Å; R126-D191 IonicContact NE-OD1 3.16Å; R126-D191 PolarHBondContact NE-OD1 3.27Å; R126-D191 VanDerWaalsContact NE-OD1 3.13Å; R126-D191 IonicContact NE-OD2 2.7Å; R126-D191 IonicContact NH2-OD1 3.98Å; R126-D191 PolarHBondContact NH2-OD1 2.93Å; R126-D191 IonicContact NH2-OD2 2.64Å; R126-D191 PolarHBondContact NH2-OD2 3.41Å; D191-R193 PolarHBondContact O-N 3.43Å; D191-C201 WeakPolarHBondContact O-CA 3.36Å; D191-W202 PolarHBondContact N-O 3.07Å; D191-W202 VanDerWaalsContact N-O 3.08Å; D191-W202 PolarHBondContact O-N 3.02Å
192W93Very high89.8Confident57 Ų5757.8 Ų57.822%0.21629%0.292CS..EExtended strand (participates in β ladder)trans-67.8120.6158.8-75.12.5000110.1L6 F8 L118 N119 S121 P122 I199L6-W192 HydrophobicContact CD1-CH2 4.42Å; L6-W192 HydrophobicContact CD1-CZ3 3.98Å; F8-W192 HydrophobicContact CE1-CD2 4.12Å; F8-W192 AromaticContact CE1-CE2 3.81Å; F8-W192 HydrophobicContact CE1-CE3 4.39Å; F8-W192 HydrophobicContact CE1-CH2 4.14Å; F8-W192 AromaticContact CE1-CZ2 3.83Å; F8-W192 HydrophobicContact CE1-CZ2 3.83Å; F8-W192 HydrophobicContact CE1-CZ3 4.41Å; F8-W192 HydrophobicContact CZ-CE3 4.48Å; F8-W192 AromaticContact CZ-CH2 3.7Å; F8-W192 HydrophobicContact CZ-CH2 3.7Å; F8-W192 AromaticContact CZ-CZ2 3.78Å; F8-W192 HydrophobicContact CZ-CZ2 3.78Å; F8-W192 HydrophobicContact CZ-CZ3 4.07Å; L118-W192 PolarHBondContact O-NE1 2.99Å; N119-W192 WeakPolarHBondContact O-CZ2 3.38Å; S121-W192 VanDerWaalsContact CA-CZ2 3.42Å; P122-W192 HydrophobicContact CB-CD2 4.39Å; P122-W192 HydrophobicContact CB-CG 4.4Å; P122-W192 HydrophobicContact CG-CD2 3.73Å; P122-W192 HydrophobicContact CG-CE3 3.71Å; P122-W192 HydrophobicContact CG-CG 4.19Å; P122-W192 HydrophobicContact CG-CH2 4.46Å; P122-W192 HydrophobicContact CG-CZ2 4.49Å; P122-W192 HydrophobicContact CG-CZ3 4.08Å; W192-I199 HydrophobicContact CB-CG2 3.76Å; W192-I199 HydrophobicContact CD2-CG2 4.16Å; W192-I199 HydrophobicContact CE3-CG2 4.49Å; W192-I199 HydrophobicContact CG-CG2 3.85Å
193R89.1Confident89.6Confident85 Ų8556.5 Ų56.532%0.32129%0.286SS..EExtended strand (participates in β ladder)trans-124.7139.8179.6-57.7-62-179.4-179.4-1.8109.9R189 D191 I199 L200 W202R189-R193 PolarHBondContact O-NH2 2.89Å; D191-R193 PolarHBondContact O-N 3.43Å; R193-I199 CarbonylContact O-C 3.5Å; R193-I199 WeakPolarHBondContact O-CA 3.5Å; R193-L200 PolarHBondContact N-O 2.66Å; R193-L200 PolarHBondContact O-N 2.9Å; R193-W202 WeakPolarHBondContact CG-O 3.46Å
194L84.1Confident89Confident128 Ų12859.8 Ų59.867%0.6730%0.304SS*.EExtended strand (participates in β ladder)trans-84.7121175.2-169.572.4000109.3G196 R198 I199L194-G196 WeakPolarHBondContact CG-O 3.28Å; L194-R198 CarbonylContact C-O 3.35Å; L194-R198 WeakPolarHBondContact CA-O 3.23Å; L194-I199 HydrophobicContact CD1-CG1 4.18Å
195V79.3Confident88.4Confident56 Ų5660.4 Ų60.434%0.33931%0.307SS..EExtended strand (participates in β ladder)trans-120103.8174-177.30000107.5E197 R198 L200 L205V195-E197 PolarHBondContact O-N 3.19Å; V195-R198 PolarHBondContact N-O 3.33Å; V195-R198 PolarHBondContact O-N 3.35Å; V195-R198 VanDerWaalsContact O-N 3.15Å; V195-L200 HydrophobicContact CG2-CB 4.17Å; V195-L200 HydrophobicContact CG2-CD2 4.21Å; V195-L205 HydrophobicContact CB-CD1 4.43Å; V195-L205 HydrophobicContact CG1-CD1 3.8Å; V195-L205 HydrophobicContact CG2-CD1 3.73Å; V195-L205 HydrophobicContact CG2-CG 4.38Å
196G78.5Confident87.9Confident68 Ų6862.3 Ų62.370%0.70132%0.321SS*.THydrogen-bonded Turntrans62.6-123.2-168.100000110.6L194L194-G196 WeakPolarHBondContact CG-O 3.28Å
197E81.7Confident87.6Confident169 Ų16963.2 Ų63.279%0.7933%0.327SS*.THydrogen-bonded Turntrans-94.38.9177.6-61.2-179.3168.700113.4N7 V195N7-E197 PolarHBondContact ND2-O 3.46Å; V195-E197 PolarHBondContact O-N 3.19Å
198R84Confident87.2Confident53 Ų5367.2 Ų67.220%0.234%0.341CS..EExtended strand (participates in β ladder)trans-124.3145.1-171-70.5175.7179.5-108.73.8114.2N7 F8 R17 L194 V195N7-R198 HydrophobicContact CB-CG 4.48Å; N7-R198 CarbonylContact O-C 3.51Å; N7-R198 WeakPolarHBondContact O-CA 3.17Å; F8-R198 PolarHBondContact O-NH1 3.3Å; R17-R198 VanDerWaalsContact NH1-NH2 3.17Å; L194-R198 CarbonylContact C-O 3.35Å; L194-R198 WeakPolarHBondContact CA-O 3.23Å; V195-R198 PolarHBondContact N-O 3.33Å; V195-R198 PolarHBondContact O-N 3.35Å; V195-R198 VanDerWaalsContact O-N 3.15Å
199I87.3Confident87Confident24 Ų2468 Ų6812%0.12334%0.34CS..EExtended strand (participates in β ladder)trans-91.5124177.2-58.2176.7000109.6L6 N7 F8 T9 W192 R193 L194L6-I199 HydrophobicContact CB-CD1 4.03Å; L6-I199 HydrophobicContact CD2-CD1 3.47Å; L6-I199 VanDerWaalsContact CD2-CD1 3.47Å; L6-I199 HydrophobicContact CG-CD1 4.23Å; N7-I199 PolarHBondContact O-N 3.45Å; F8-I199 WeakPolarHBondContact CA-O 3.25Å; F8-I199 HydrophobicContact CD1-CB 3.7Å; F8-I199 HydrophobicContact CD1-CG2 3.78Å; F8-I199 HydrophobicContact CE1-CB 3.89Å; F8-I199 HydrophobicContact CE1-CD1 4.43Å; F8-I199 HydrophobicContact CE1-CG2 3.61Å; F8-I199 HydrophobicContact CG-CB 4.44Å; T9-I199 PolarHBondContact N-O 3.49Å; T9-I199 PolarHBondContact OG1-O 3.2Å; W192-I199 HydrophobicContact CB-CG2 3.76Å; W192-I199 HydrophobicContact CD2-CG2 4.16Å; W192-I199 HydrophobicContact CE3-CG2 4.49Å; W192-I199 HydrophobicContact CG-CG2 3.85Å; R193-I199 CarbonylContact O-C 3.5Å; R193-I199 WeakPolarHBondContact O-CA 3.5Å; L194-I199 HydrophobicContact CD1-CG1 4.18Å
200L88.6Confident86.8Confident39 Ų3962 Ų6220%0.20432%0.318CS..EExtended strand (participates in β ladder)trans-115.2130.2176.4178.765.2000109.7T9 R193 V195 W202T9-L200 HydrophobicContact CG2-CD1 4.09Å; R193-L200 PolarHBondContact N-O 2.66Å; R193-L200 PolarHBondContact O-N 2.9Å; V195-L200 HydrophobicContact CG2-CB 4.17Å; V195-L200 HydrophobicContact CG2-CD2 4.21Å; L200-W202 HydrophobicContact CD2-CB 3.72Å; L200-W202 HydrophobicContact CD2-CG 4.38Å; L200-W202 HydrophobicContact CG-CB 3.73Å; L200-W202 PolarHBondContact O-N 3.29Å
201C91.1Very high86.5Confident5 Ų562.5 Ų62.53%0.03432%0.321CS..EExtended strand (participates in β ladder)trans-80.990.7167.9169.20000109.9L118 C125 R129 D191L118-C201 HydrophobicContact CB-CB 3.84Å; L118-C201 HydrophobicContact CD1-CB 4.35Å; C125-C201 VanDerWaalsContact CA-SG 3.55Å; C125-C201 HydrophobicContact CB-CB 3.89Å; C125-C201 WeakPolarHBondContact CB-SG 3.31Å; C125-C201 VanDerWaalsContact SG-CA 3.58Å; C125-C201 WeakPolarHBondContact SG-CB 3.16Å; C125-C201 CovalentContact SG-SG 2Å; C125-C201 PolarHBondContact SG-SG 3.5Å; R129-C201 PolarHBondContact NE-O 2.89Å; R129-C201 PolarHBondContact NH2-O 3.43Å; D191-C201 WeakPolarHBondContact O-CA 3.36Å
202W91.3Very high86.2Confident32 Ų3261.6 Ų61.612%0.12132%0.318CS..EExtended strand (participates in β ladder)trans-159.6177.7-178.9-159.9-116000112.7F186 D191 R193 L200F186-W202 HydrophobicContact CE2-CH2 4.49Å; F186-W202 HydrophobicContact CZ-CH2 4.18Å; F186-W202 HydrophobicContact CZ-CZ3 4.1Å; D191-W202 PolarHBondContact N-O 3.07Å; D191-W202 VanDerWaalsContact N-O 3.08Å; D191-W202 PolarHBondContact O-N 3.02Å; R193-W202 WeakPolarHBondContact CG-O 3.46Å; L200-W202 HydrophobicContact CD2-CB 3.72Å; L200-W202 HydrophobicContact CD2-CG 4.38Å; L200-W202 HydrophobicContact CG-CB 3.73Å; L200-W202 PolarHBondContact O-N 3.29Å
203V90Very high86.1Confident3 Ų360.8 Ų60.82%0.01832%0.315CS..SBendtrans-70.6154.2167.8179.10000109.1F186 R189 V190 L205 D207 V210 Q211F186-V203 HydrophobicContact CD2-CG2 3.76Å; F186-V203 HydrophobicContact CE2-CG2 3.52Å; R189-V203 HydrophobicContact CB-CG1 4.46Å; V190-V203 HydrophobicContact CG2-CG2 3.7Å; V203-L205 PolarHBondContact O-N 3.43Å; V203-D207 HydrophobicContact CG1-CB 4Å; V203-V210 HydrophobicContact CG1-CB 3.91Å; V203-V210 HydrophobicContact CG1-CG1 3.84Å; V203-V210 HydrophobicContact CG2-CG1 3.86Å; V203-Q211 HydrophobicContact CB-CG 4.41Å; V203-Q211 HydrophobicContact CG1-CG 4.33Å
204D85Confident86.2Confident69 Ų6956.8 Ų56.837%0.36930%0.3SS..  trans-53.2134.4172.9-160.1-28.2000111.1S206 D207 Q211D204-S206 VanDerWaalsContact CG-OG 3.27Å; D204-S206 PolarHBondContact O-N 3.49Å; D204-S206 PolarHBondContact OD1-N 3Å; D204-S206 VanDerWaalsContact OD1-N 3.13Å; D204-S206 PolarHBondContact OD1-OG 3.02Å; D204-D207 HydrophobicContact CB-CB 4.1Å; D204-D207 PolarHBondContact O-N 3.49Å; D204-Q211 PolarHBondContact O-NE2 2.89Å
205L80.8Confident86.4Confident81 Ų8151 Ų5142%0.42427%0.27SS..THydrogen-bonded Turntrans-64.1-27.4179.4-67.1178.1000111.6V195 V203 D207 Q211V195-L205 HydrophobicContact CB-CD1 4.43Å; V195-L205 HydrophobicContact CG1-CD1 3.8Å; V195-L205 HydrophobicContact CG2-CD1 3.73Å; V195-L205 HydrophobicContact CG2-CG 4.38Å; V203-L205 PolarHBondContact O-N 3.43Å; L205-D207 VanDerWaalsContact C-N 3.34Å; L205-Q211 PolarHBondContact O-NE2 2.98Å; L205-Q211 VanDerWaalsContact O-NE2 3.07Å
206S82.6Confident87Confident92 Ų9251.2 Ų51.264%0.64327%0.269SS*.THydrogen-bonded Turntrans-76.3-19.8174.767.10000113.5D204 Q208D204-S206 VanDerWaalsContact CG-OG 3.27Å; D204-S206 PolarHBondContact O-N 3.49Å; D204-S206 PolarHBondContact OD1-N 3Å; D204-S206 VanDerWaalsContact OD1-N 3.13Å; D204-S206 PolarHBondContact OD1-OG 3.02Å; S206-Q208 VanDerWaalsContact C-N 3.27Å; S206-Q208 PolarHBondContact O-N 3.12Å
207D86.3Confident87.7Confident22 Ų2250.3 Ų50.312%0.11825%0.246CC..  trans-85.169.9-178.6-170.1-4.5000111.1R189 V203 D204 L205 Y209 V210 Q211R189-D207 IonicContact CZ-OD2 3.19Å; R189-D207 IonicContact NH1-OD2 2.74Å; R189-D207 PolarHBondContact NH1-OD2 3.38Å; V203-D207 HydrophobicContact CG1-CB 4Å; D204-D207 HydrophobicContact CB-CB 4.1Å; D204-D207 PolarHBondContact O-N 3.49Å; L205-D207 VanDerWaalsContact C-N 3.34Å; D207-Y209 PolarHBondContact O-N 2.85Å; D207-V210 PolarHBondContact O-N 3.31Å; D207-V210 WeakPolarHBondContact OD1-CG2 3.36Å; D207-V210 PolarHBondContact OD1-N 3.41Å; D207-V210 WeakPolarHBondContact OD2-CG2 3.21Å; D207-Q211 WeakPolarHBondContact O-CG 3.35Å; D207-Q211 PolarHBondContact O-N 2.74Å
208Q84.3Confident88.1Confident110 Ų11042.2 Ų42.251%0.51421%0.208SC..Hα-helixtrans-61.4-27.6179.3-65.9-174.5-14.100112.6S206 G212S206-Q208 VanDerWaalsContact C-N 3.27Å; S206-Q208 PolarHBondContact O-N 3.12Å; Q208-G212 PolarHBondContact O-N 2.84Å
209Y89.1Confident88.4Confident174 Ų17440.1 Ų40.168%0.68220%0.201SC*.Hα-helixtrans-63-52.9178.2176.2-97.2000111.1D207 Q211 G212 Y213D207-Y209 PolarHBondContact O-N 2.85Å; Y209-Q211 VanDerWaalsContact C-N 3.34Å; Y209-Q211 PolarHBondContact O-N 3.37Å; Y209-G212 PolarHBondContact O-N 2.91Å; Y209-Y213 VanDerWaalsContact O-CB 3.26Å; Y209-Y213 WeakPolarHBondContact O-CB 3.39Å; Y209-Y213 PolarHBondContact O-N 3.08Å
210V89.9Confident88.6Confident5 Ų539 Ų393%0.0320%0.195CC..Hα-helixtrans-69-35.5-178.4176.40000111.1F186 R189 V203 D207 Y213 H214F186-V210 HydrophobicContact CD2-CG1 4.21Å; R189-V210 HydrophobicContact CB-CG1 4.2Å; R189-V210 HydrophobicContact CG-CG2 4.1Å; V203-V210 HydrophobicContact CG1-CB 3.91Å; V203-V210 HydrophobicContact CG1-CG1 3.84Å; V203-V210 HydrophobicContact CG2-CG1 3.86Å; D207-V210 PolarHBondContact O-N 3.31Å; D207-V210 WeakPolarHBondContact OD1-CG2 3.36Å; D207-V210 PolarHBondContact OD1-N 3.41Å; D207-V210 WeakPolarHBondContact OD2-CG2 3.21Å; V210-Y213 PolarHBondContact O-N 3.03Å; V210-H214 WeakPolarHBondContact O-CB 3.49Å; V210-H214 PolarHBondContact O-N 3.42Å
211Q86.8Confident88.7Confident10 Ų1037.1 Ų37.15%0.04719%0.185CC..Hα-helixtrans-63.8-46.8174.3-68.5-175.358.200112.1V203 D204 L205 D207 Y209 H214 T215V203-Q211 HydrophobicContact CB-CG 4.41Å; V203-Q211 HydrophobicContact CG1-CG 4.33Å; D204-Q211 PolarHBondContact O-NE2 2.89Å; L205-Q211 PolarHBondContact O-NE2 2.98Å; L205-Q211 VanDerWaalsContact O-NE2 3.07Å; D207-Q211 WeakPolarHBondContact O-CG 3.35Å; D207-Q211 PolarHBondContact O-N 2.74Å; Y209-Q211 VanDerWaalsContact C-N 3.34Å; Y209-Q211 PolarHBondContact O-N 3.37Å; Q211-H214 PolarHBondContact O-N 2.57Å; Q211-T215 PolarHBondContact O-N 2.69Å; Q211-T215 VanDerWaalsContact O-N 3.07Å; Q211-T215 PolarHBondContact O-OG1 3.19Å
212G87.5Confident88.9Confident11 Ų1138.7 Ų38.711%0.11319%0.193CC..Hα-helixtrans-60.6-47174.200000111.5Q208 Y209 H214 T215 L216Q208-G212 PolarHBondContact O-N 2.84Å; Y209-G212 PolarHBondContact O-N 2.91Å; G212-H214 PolarHBondContact O-N 3.36Å; G212-T215 WeakPolarHBondContact O-CA 3.38Å; G212-T215 VanDerWaalsContact O-CB 3.24Å; G212-T215 WeakPolarHBondContact O-CB 3.35Å; G212-T215 PolarHBondContact O-N 2.85Å; G212-L216 VanDerWaalsContact O-CG 3.3Å; G212-L216 WeakPolarHBondContact O-CG 3.39Å; G212-L216 PolarHBondContact O-N 3.33Å
213Y91.6Very high89Confident41 Ų4139.4 Ų39.416%0.16120%0.199CC..Hα-helixtrans-56.1-48.5176.6-178.6-90.6000112.3M182 M183 Y209 V210 T215 L216 F217M182-Y213 VanDerWaalsContact O-CE1 3.28Å; M182-Y213 WeakPolarHBondContact O-CE1 3.16Å; M182-Y213 PolarHBondContact O-OH 2.87Å; M183-Y213 HydrophobicContact CE-CE1 3.67Å; Y209-Y213 VanDerWaalsContact O-CB 3.26Å; Y209-Y213 WeakPolarHBondContact O-CB 3.39Å; Y209-Y213 PolarHBondContact O-N 3.08Å; V210-Y213 PolarHBondContact O-N 3.03Å; Y213-T215 VanDerWaalsContact C-N 3.28Å; Y213-T215 PolarHBondContact O-N 3.47Å; Y213-L216 PolarHBondContact O-N 2.91Å; Y213-L216 VanDerWaalsContact O-N 3.15Å; Y213-F217 HydrophobicContact CD1-CD2 4.45Å; Y213-F217 AromaticContact CD2-CD2 3.58Å; Y213-F217 HydrophobicContact CD2-CD2 3.58Å; Y213-F217 AromaticContact CD2-CE2 3.68Å; Y213-F217 HydrophobicContact CD2-CE2 3.68Å; Y213-F217 HydrophobicContact CE1-CD2 4.25Å; Y213-F217 AromaticContact CE2-CD2 3.34Å; Y213-F217 HydrophobicContact CE2-CD2 3.34Å; Y213-F217 AromaticContact CE2-CE2 3.39Å; Y213-F217 HydrophobicContact CE2-CE2 3.39Å; Y213-F217 HydrophobicContact CE2-CG 4.3Å; Y213-F217 HydrophobicContact CE2-CZ 4.36Å; Y213-F217 HydrophobicContact CG-CD2 4.13Å; Y213-F217 AromaticContact CZ-CD2 3.69Å; Y213-F217 PolarHBondContact O-N 3.29Å; Y213-F217 VanDerWaalsContact O-N 3.09Å
214H90.6Very high89.4Confident1 Ų139.7 Ų39.71%0.00520%0.2CC..Hα-helixtrans-61-37176.8-179.4-92.8000111.7F186 V210 Q211 G212 S218 N219F186-H214 HydrophobicContact CD2-CB 4.19Å; F186-H214 AromaticContact CD2-CD2 3.76Å; F186-H214 AromaticContact CE1-CD2 3.86Å; F186-H214 AromaticContact CE1-NE2 3.94Å; F186-H214 HydrophobicContact CE2-CB 4.19Å; F186-H214 AromaticContact CE2-CD2 3.55Å; F186-H214 AromaticContact CE2-CG 3.82Å; F186-H214 AromaticContact CZ-CD2 3.61Å; F186-H214 AromaticContact CZ-NE2 3.76Å; V210-H214 WeakPolarHBondContact O-CB 3.49Å; V210-H214 PolarHBondContact O-N 3.42Å; Q211-H214 PolarHBondContact O-N 2.57Å; G212-H214 PolarHBondContact O-N 3.36Å; H214-S218 PolarHBondContact NE2-OG 2.98Å; H214-S218 CarbonylContact O-C 3.19Å; H214-S218 WeakPolarHBondContact O-CA 3.24Å; H214-S218 WeakPolarHBondContact O-CB 3.4Å; H214-S218 PolarHBondContact O-N 3.44Å; H214-N219 PolarHBondContact CE1-ND2 3.3Å; H214-N219 PolarHBondContact CE1-OD1 3.43Å
215T88.4Confident89.9Confident5 Ų536.4 Ų36.43%0.03118%0.182CC..Hα-helixtrans-62.3-42174-44.20000112.9Q211 G212 Y213 R287Q211-T215 PolarHBondContact O-N 2.69Å; Q211-T215 VanDerWaalsContact O-N 3.07Å; Q211-T215 PolarHBondContact O-OG1 3.19Å; G212-T215 WeakPolarHBondContact O-CA 3.38Å; G212-T215 VanDerWaalsContact O-CB 3.24Å; G212-T215 WeakPolarHBondContact O-CB 3.35Å; G212-T215 PolarHBondContact O-N 2.85Å; Y213-T215 VanDerWaalsContact C-N 3.28Å; Y213-T215 PolarHBondContact O-N 3.47Å; T215-R287 VanDerWaalsContact CG2-NH1 3.28Å; T215-R287 WeakPolarHBondContact OG1-CD 3.13Å; T215-R287 VanDerWaalsContact OG1-CZ 3.3Å; T215-R287 PolarHBondContact OG1-NE 3.13Å; T215-R287 PolarHBondContact OG1-NH1 2.8Å
216L92.2Very high90.6Very high62 Ų6236.5 Ų36.533%0.32518%0.182SC..Hα-helixtrans-76.7-34.3-171-70.7168.4000112.4G212 Y213 G221 L222 I223 Q224G212-L216 VanDerWaalsContact O-CG 3.3Å; G212-L216 WeakPolarHBondContact O-CG 3.39Å; G212-L216 PolarHBondContact O-N 3.33Å; Y213-L216 PolarHBondContact O-N 2.91Å; Y213-L216 VanDerWaalsContact O-N 3.15Å; L216-G221 CarbonylContact O-C 3.41Å; L216-L222 HydrophobicContact CD2-CD2 4.02Å; L216-L222 PolarHBondContact O-N 2.97Å; L216-I223 HydrophobicContact CB-CD1 3.84Å; L216-I223 HydrophobicContact CB-CG1 4.17Å; L216-I223 HydrophobicContact CD2-CD1 4.5Å; L216-I223 HydrophobicContact CD2-CG1 4.4Å; L216-I223 PolarHBondContact O-N 2.66Å; L216-Q224 PolarHBondContact O-OE1 2.95Å
217F93Very high91.3Very high48 Ų4837.7 Ų37.721%0.21118%0.176CC..Hα-helixtrans-115.3-18.3-171.2-69.5-75.5000115.5T137 M182 M183 Y213 I223 Q224T137-F217 PolarHBondContact OG1-O 3.41Å; M182-F217 HydrophobicContact CE-CB 4.02Å; M182-F217 HydrophobicContact CE-CD1 3.21Å; M182-F217 HydrophobicContact CE-CE1 3.77Å; M182-F217 HydrophobicContact CE-CG 3.82Å; M183-F217 HydrophobicContact CE-CB 3.87Å; Y213-F217 HydrophobicContact CD1-CD2 4.45Å; Y213-F217 AromaticContact CD2-CD2 3.58Å; Y213-F217 HydrophobicContact CD2-CD2 3.58Å; Y213-F217 AromaticContact CD2-CE2 3.68Å; Y213-F217 HydrophobicContact CD2-CE2 3.68Å; Y213-F217 HydrophobicContact CE1-CD2 4.25Å; Y213-F217 AromaticContact CE2-CD2 3.34Å; Y213-F217 HydrophobicContact CE2-CD2 3.34Å; Y213-F217 AromaticContact CE2-CE2 3.39Å; Y213-F217 HydrophobicContact CE2-CE2 3.39Å; Y213-F217 HydrophobicContact CE2-CG 4.3Å; Y213-F217 HydrophobicContact CE2-CZ 4.36Å; Y213-F217 HydrophobicContact CG-CD2 4.13Å; Y213-F217 AromaticContact CZ-CD2 3.69Å; Y213-F217 PolarHBondContact O-N 3.29Å; Y213-F217 VanDerWaalsContact O-N 3.09Å; F217-I223 HydrophobicContact CD1-CB 4.31Å; F217-I223 HydrophobicContact CD1-CD1 4.12Å; F217-I223 HydrophobicContact CD2-CD1 4.24Å; F217-I223 HydrophobicContact CE1-CB 4.18Å; F217-I223 HydrophobicContact CE1-CD1 3.57Å; F217-I223 HydrophobicContact CE1-CG1 4.45Å; F217-I223 HydrophobicContact CE1-CG2 4.02Å; F217-I223 HydrophobicContact CE2-CD1 3.67Å; F217-I223 HydrophobicContact CG-CD1 4.46Å; F217-I223 HydrophobicContact CZ-CD1 3.33Å; F217-Q224 PolarHBondContact O-NE2 3.45Å
218S90.4Very high91.8Very high0 Ų036.7 Ų36.70%017%0.171CC..SBendtrans-116.6-177.8177.81770000109.1A133 S136 H214 G221A133-S218 WeakPolarHBondContact CA-OG 3.37Å; S136-S218 PolarHBondContact OG-OG 2.85Å; H214-S218 PolarHBondContact NE2-OG 2.98Å; H214-S218 CarbonylContact O-C 3.19Å; H214-S218 WeakPolarHBondContact O-CA 3.24Å; H214-S218 WeakPolarHBondContact O-CB 3.4Å; H214-S218 PolarHBondContact O-N 3.44Å; S218-G221 WeakPolarHBondContact O-CA 3.34Å; S218-G221 PolarHBondContact O-N 2.89Å
219N89.4Confident92.4Very high8 Ų833.4 Ų33.44%0.04316%0.159CC..THydrogen-bonded Turntrans52.664.3179.6-74.1-3.4000112.9Y132 S136 H214 G221 Q279 Y283Y132-N219 WeakPolarHBondContact CE1-OD1 3.25Å; Y132-N219 VanDerWaalsContact CZ-OD1 3.31Å; Y132-N219 PolarHBondContact OH-OD1 3.46Å; S136-N219 PolarHBondContact OG-N 3.34Å; H214-N219 PolarHBondContact CE1-ND2 3.3Å; H214-N219 PolarHBondContact CE1-OD1 3.43Å; N219-G221 PolarHBondContact O-N 3.47Å; N219-G221 VanDerWaalsContact O-N 3.12Å; N219-Q279 PolarHBondContact O-OE1 3.44Å; N219-Y283 HydrophobicContact CB-CD2 4.07Å; N219-Y283 HydrophobicContact CB-CE2 3.73Å; N219-Y283 WeakPolarHBondContact ND2-CE2 3.42Å
220L92.3Very high92.8Very high1 Ų129.9 Ų29.91%0.00515%0.15CC..THydrogen-bonded Turntrans65.70.8-172-53.3178.5000115.4M139 C140 T225 F272 M275 A276 Q279 W309 N312M139-L220 HydrophobicContact CE-CD2 3.67Å; C140-L220 VanDerWaalsContact SG-CA 3.56Å; C140-L220 PolarHBondContact SG-O 3.03Å; L220-T225 PolarHBondContact O-OG1 3.34Å; L220-F272 HydrophobicContact CB-CZ 4.37Å; L220-F272 HydrophobicContact CD2-CD2 4.49Å; L220-F272 HydrophobicContact CD2-CE2 3.59Å; L220-F272 HydrophobicContact CD2-CZ 4.05Å; L220-M275 HydrophobicContact CD1-CB 4.44Å; L220-A276 HydrophobicContact CB-CB 3.65Å; L220-A276 HydrophobicContact CD1-CB 4.25Å; L220-Q279 HydrophobicContact CD1-CB 4.16Å; L220-W309 HydrophobicContact CD1-CE3 4.44Å; L220-W309 HydrophobicContact CD2-CE3 3.93Å; L220-W309 HydrophobicContact CD2-CH2 4.29Å; L220-W309 HydrophobicContact CD2-CZ3 3.63Å; L220-W309 HydrophobicContact CG-CE3 3.81Å; L220-W309 HydrophobicContact CG-CZ3 3.77Å; L220-N312 HydrophobicContact CD1-CB 4.21Å
221G90.8Very high93.2Very high0 Ų030.5 Ų30.50%015%0.153CC..  trans57.786.7160.800000114.2L216 S218 N219 I223 Q224 T225L216-G221 CarbonylContact O-C 3.41Å; S218-G221 WeakPolarHBondContact O-CA 3.34Å; S218-G221 PolarHBondContact O-N 2.89Å; N219-G221 PolarHBondContact O-N 3.47Å; N219-G221 VanDerWaalsContact O-N 3.12Å; G221-I223 VanDerWaalsContact C-N 3.34Å; G221-I223 PolarHBondContact O-N 2.92Å; G221-Q224 PolarHBondContact O-N 3.43Å; G221-Q224 PolarHBondContact O-OE1 3.44Å; G221-T225 WeakPolarHBondContact O-CB 3.22Å; G221-T225 PolarHBondContact O-N 2.89Å; G221-T225 PolarHBondContact O-OG1 3.02Å
222L93.8Very high93.6Very high38 Ų3830.2 Ų30.220%0.19915%0.152CC..Hα-helixtrans-56.1-46.2-179.3178.757.5000112.4L216 T225 I226 L277 A280L216-L222 HydrophobicContact CD2-CD2 4.02Å; L216-L222 PolarHBondContact O-N 2.97Å; L222-T225 WeakPolarHBondContact O-CB 3.43Å; L222-T225 PolarHBondContact O-N 3.39Å; L222-I226 HydrophobicContact CD1-CD1 4.25Å; L222-I226 HydrophobicContact CD1-CG1 4.35Å; L222-I226 HydrophobicContact CG-CD1 4.17Å; L222-I226 WeakPolarHBondContact O-CG1 3.29Å; L222-I226 PolarHBondContact O-N 2.76Å; L222-L277 HydrophobicContact CD1-CD2 4.17Å; L222-A280 HydrophobicContact CB-CB 4.09Å; L222-A280 HydrophobicContact CD1-CB 3.83Å; L222-A280 HydrophobicContact CD2-CB 4.37Å; L222-A280 HydrophobicContact CG-CB 4.31Å
223I95.2Very high94Very high47 Ų4734.3 Ų34.324%0.24117%0.171CC..Hα-helixtrans-63.6-45.6-179.9-70.4176.3000110.4L216 F217 G221 T225 I226 F227L216-I223 HydrophobicContact CB-CD1 3.84Å; L216-I223 HydrophobicContact CB-CG1 4.17Å; L216-I223 HydrophobicContact CD2-CD1 4.5Å; L216-I223 HydrophobicContact CD2-CG1 4.4Å; L216-I223 PolarHBondContact O-N 2.66Å; F217-I223 HydrophobicContact CD1-CB 4.31Å; F217-I223 HydrophobicContact CD1-CD1 4.12Å; F217-I223 HydrophobicContact CD2-CD1 4.24Å; F217-I223 HydrophobicContact CE1-CB 4.18Å; F217-I223 HydrophobicContact CE1-CD1 3.57Å; F217-I223 HydrophobicContact CE1-CG1 4.45Å; F217-I223 HydrophobicContact CE1-CG2 4.02Å; F217-I223 HydrophobicContact CE2-CD1 3.67Å; F217-I223 HydrophobicContact CG-CD1 4.46Å; F217-I223 HydrophobicContact CZ-CD1 3.33Å; G221-I223 VanDerWaalsContact C-N 3.34Å; G221-I223 PolarHBondContact O-N 2.92Å; I223-T225 VanDerWaalsContact C-N 3.28Å; I223-T225 PolarHBondContact O-N 2.81Å; I223-I226 PolarHBondContact O-N 3.25Å; I223-F227 HydrophobicContact CG2-CD2 3.86Å; I223-F227 HydrophobicContact CG2-CE2 3.56Å; I223-F227 WeakPolarHBondContact O-CD2 3.48Å; I223-F227 PolarHBondContact O-N 3.32Å; I223-F227 VanDerWaalsContact O-N 3.09Å
224Q96.6Very high94.2Very high8 Ų833.7 Ų33.74%0.03717%0.174CC..Hα-helixtrans-61-39.5175.6-65.989.4-22.300111.5C140 N141 V144 L216 F217 G221 F227 L228C140-Q224 HydrophobicContact CB-CB 3.78Å; C140-Q224 HydrophobicContact CB-CG 3.85Å; N141-Q224 WeakPolarHBondContact OD1-CG 3.12Å; N141-Q224 PolarHBondContact OD1-NE2 2.98Å; V144-Q224 HydrophobicContact CG2-CB 3.96Å; V144-Q224 WeakPolarHBondContact CG2-O 3.39Å; L216-Q224 PolarHBondContact O-OE1 2.95Å; F217-Q224 PolarHBondContact O-NE2 3.45Å; G221-Q224 PolarHBondContact O-N 3.43Å; G221-Q224 PolarHBondContact O-OE1 3.44Å; Q224-F227 PolarHBondContact O-N 3.08Å; Q224-L228 VanDerWaalsContact O-CB 3.24Å; Q224-L228 WeakPolarHBondContact O-CB 3.43Å; Q224-L228 PolarHBondContact O-N 3.35Å
225T95.9Very high94.4Very high0 Ų033.7 Ų33.70%017%0.174CC..Hα-helixtrans-66.2-38.4178.3-64.90000111.9L220 G221 L222 I223 L228 T229 I273 A276 L277L220-T225 PolarHBondContact O-OG1 3.34Å; G221-T225 WeakPolarHBondContact O-CB 3.22Å; G221-T225 PolarHBondContact O-N 2.89Å; G221-T225 PolarHBondContact O-OG1 3.02Å; L222-T225 WeakPolarHBondContact O-CB 3.43Å; L222-T225 PolarHBondContact O-N 3.39Å; I223-T225 VanDerWaalsContact C-N 3.28Å; I223-T225 PolarHBondContact O-N 2.81Å; T225-L228 PolarHBondContact O-N 2.92Å; T225-T229 WeakPolarHBondContact O-CB 3.41Å; T225-T229 PolarHBondContact O-N 2.83Å; T225-T229 PolarHBondContact O-OG1 3.4Å; T225-I273 HydrophobicContact CG2-CB 4.39Å; T225-I273 HydrophobicContact CG2-CG1 4.31Å; T225-I273 HydrophobicContact CG2-CG2 4.03Å; T225-A276 HydrophobicContact CG2-CB 3.9Å; T225-A276 WeakPolarHBondContact OG1-CB 3.32Å; T225-L277 HydrophobicContact CG2-CD2 3.86Å; T225-L277 HydrophobicContact CG2-CG 3.91Å
226I96.6Very high94.8Very high83 Ų8336.6 Ų36.643%0.42619%0.189SC..Hα-helixtrans-61.7-49.9172.8-69.2165.4000110.1L222 I223 L228 T229 I230L222-I226 HydrophobicContact CD1-CD1 4.25Å; L222-I226 HydrophobicContact CD1-CG1 4.35Å; L222-I226 HydrophobicContact CG-CD1 4.17Å; L222-I226 WeakPolarHBondContact O-CG1 3.29Å; L222-I226 PolarHBondContact O-N 2.76Å; I223-I226 PolarHBondContact O-N 3.25Å; I226-L228 VanDerWaalsContact C-N 3.35Å; I226-L228 PolarHBondContact O-N 2.85Å; I226-T229 PolarHBondContact O-N 3.35Å; I226-I230 HydrophobicContact CG2-CD1 3.98Å; I226-I230 WeakPolarHBondContact O-CG1 3.3Å; I226-I230 PolarHBondContact O-N 3.02Å
227F97Very high94.9Very high118 Ų11839.2 Ų39.252%0.51820%0.203SC..Hα-helixtrans-58.5-47.7175.9-77-63.5000111.6V144 I223 Q224 T229 I230 I231V144-F227 HydrophobicContact CG1-CB 4.46Å; V144-F227 HydrophobicContact CG2-CB 4.44Å; I223-F227 HydrophobicContact CG2-CD2 3.86Å; I223-F227 HydrophobicContact CG2-CE2 3.56Å; I223-F227 WeakPolarHBondContact O-CD2 3.48Å; I223-F227 PolarHBondContact O-N 3.32Å; I223-F227 VanDerWaalsContact O-N 3.09Å; Q224-F227 PolarHBondContact O-N 3.08Å; F227-T229 VanDerWaalsContact C-N 3.29Å; F227-T229 PolarHBondContact O-N 3.5Å; F227-I230 PolarHBondContact O-N 3.03Å; F227-I231 HydrophobicContact CB-CD1 4.39Å; F227-I231 VanDerWaalsContact O-CD1 3.24Å; F227-I231 WeakPolarHBondContact O-CD1 2.95Å; F227-I231 WeakPolarHBondContact O-CG1 3.26Å; F227-I231 PolarHBondContact O-N 3.43Å
228L96.7Very high94.8Very high1 Ų140 Ų401%0.00521%0.206CC..Hα-helixtrans-55.4-45.7178.7-173.362.1000111.4H143 V144 S147 Q224 T225 I226 I231 D232 S269 F272 I273H143-L228 HydrophobicContact CB-CD1 4.37Å; H143-L228 HydrophobicContact CB-CD2 4.16Å; V144-L228 HydrophobicContact CG2-CB 4.28Å; S147-L228 WeakPolarHBondContact OG-CD1 3.4Å; Q224-L228 VanDerWaalsContact O-CB 3.24Å; Q224-L228 WeakPolarHBondContact O-CB 3.43Å; Q224-L228 PolarHBondContact O-N 3.35Å; T225-L228 PolarHBondContact O-N 2.92Å; I226-L228 VanDerWaalsContact C-N 3.35Å; I226-L228 PolarHBondContact O-N 2.85Å; L228-I231 PolarHBondContact O-N 3.18Å; L228-D232 WeakPolarHBondContact O-CB 3.48Å; L228-D232 PolarHBondContact O-N 2.94Å; L228-S269 WeakPolarHBondContact CD1-OG 3.18Å; L228-S269 WeakPolarHBondContact CG-OG 3.46Å; L228-F272 HydrophobicContact CD2-CD1 3.67Å; L228-F272 HydrophobicContact CD2-CE1 3.98Å; L228-I273 HydrophobicContact CD2-CD1 4.24Å; L228-I273 HydrophobicContact CD2-CG1 3.78Å; L228-I273 HydrophobicContact CG-CD1 4.04Å; L228-I273 HydrophobicContact CG-CG1 4.09Å
229T97Very high94.9Very high41 Ų4140.4 Ų40.425%0.25221%0.208SC..Hα-helixtrans-60.5-48.9177-57.30000111.5T225 I226 F227 I231 D232 L233 I273T225-T229 WeakPolarHBondContact O-CB 3.41Å; T225-T229 PolarHBondContact O-N 2.83Å; T225-T229 PolarHBondContact O-OG1 3.4Å; I226-T229 PolarHBondContact O-N 3.35Å; F227-T229 VanDerWaalsContact C-N 3.29Å; F227-T229 PolarHBondContact O-N 3.5Å; T229-I231 VanDerWaalsContact C-N 3.31Å; T229-I231 PolarHBondContact O-N 2.91Å; T229-D232 PolarHBondContact O-N 3.19Å; T229-L233 HydrophobicContact CG2-CD1 4Å; T229-L233 HydrophobicContact CG2-CG 4.42Å; T229-L233 WeakPolarHBondContact O-CB 3.33Å; T229-L233 VanDerWaalsContact O-CG 3.25Å; T229-L233 WeakPolarHBondContact O-CG 3.36Å; T229-L233 PolarHBondContact O-N 3.26Å; T229-I273 WeakPolarHBondContact OG1-CG2 3.29Å
230I97.6Very high95.1Very high100 Ų10049.3 Ų49.351%0.51324%0.241SC..Hα-helixtrans-59.2-44.3178.1-67.3167.2000110.6I226 F227 A234I226-I230 HydrophobicContact CG2-CD1 3.98Å; I226-I230 WeakPolarHBondContact O-CG1 3.3Å; I226-I230 PolarHBondContact O-N 3.02Å; F227-I230 PolarHBondContact O-N 3.03Å; I230-A234 WeakPolarHBondContact O-CB 3.43Å; I230-A234 PolarHBondContact O-N 3.4Å
231I97Very high95Very high18 Ų1856.7 Ų56.79%0.09227%0.273CS..Hα-helixtrans-66.7-46.1-178.4-65156.5000111.4V144 L148 C151 F227 L228 T229 A234 F235V144-I231 HydrophobicContact CG1-CD1 3.83Å; L148-I231 HydrophobicContact CD1-CD1 4.25Å; L148-I231 HydrophobicContact CD2-CD1 3.41Å; L148-I231 VanDerWaalsContact CD2-CD1 3.41Å; L148-I231 HydrophobicContact CD2-CG1 3.62Å; L148-I231 HydrophobicContact CD2-CG2 4.09Å; L148-I231 HydrophobicContact CG-CD1 3.51Å; L148-I231 HydrophobicContact CG-CG1 4.24Å; L148-I231 HydrophobicContact CG-CG2 4.44Å; C151-I231 HydrophobicContact CB-CG2 3.85Å; F227-I231 HydrophobicContact CB-CD1 4.39Å; F227-I231 VanDerWaalsContact O-CD1 3.24Å; F227-I231 WeakPolarHBondContact O-CD1 2.95Å; F227-I231 WeakPolarHBondContact O-CG1 3.26Å; F227-I231 PolarHBondContact O-N 3.43Å; L228-I231 PolarHBondContact O-N 3.18Å; T229-I231 VanDerWaalsContact C-N 3.31Å; T229-I231 PolarHBondContact O-N 2.91Å; I231-A234 PolarHBondContact O-N 2.63Å; I231-F235 WeakPolarHBondContact O-CB 3.31Å; I231-F235 PolarHBondContact O-N 2.81Å
232D96Very high94.9Very high4 Ų460.2 Ų60.22%0.02129%0.29CS..Hα-helixtrans-67.4-37.5179.2-82.6-42.6000111.7S147 R150 L228 T229 F235 L236 T266 S269S147-D232 PolarHBondContact OG-OD1 3.03Å; R150-D232 IonicContact CZ-OD1 3.86Å; R150-D232 IonicContact NH2-OD1 2.91Å; R150-D232 PolarHBondContact NH2-OD1 3.32Å; L228-D232 WeakPolarHBondContact O-CB 3.48Å; L228-D232 PolarHBondContact O-N 2.94Å; T229-D232 PolarHBondContact O-N 3.19Å; D232-F235 WeakPolarHBondContact O-CB 3.5Å; D232-F235 PolarHBondContact O-N 3.22Å; D232-L236 WeakPolarHBondContact O-CB 3.49Å; D232-L236 VanDerWaalsContact O-CG 3.28Å; D232-L236 WeakPolarHBondContact O-CG 2.98Å; D232-L236 PolarHBondContact O-N 3.21Å; D232-T266 HydrophobicContact CB-CG2 4.47Å; D232-S269 WeakPolarHBondContact OD2-CB 3.05Å; D232-S269 PolarHBondContact OD2-OG 3.06Å
233L96.2Very high94.6Very high97 Ų9760.8 Ų60.851%0.50829%0.293SS..Hα-helixtrans-61.4-47.9171.5-73.4175.2000111.2T229 F235 L236 L237T229-L233 HydrophobicContact CG2-CD1 4Å; T229-L233 HydrophobicContact CG2-CG 4.42Å; T229-L233 WeakPolarHBondContact O-CB 3.33Å; T229-L233 VanDerWaalsContact O-CG 3.25Å; T229-L233 WeakPolarHBondContact O-CG 3.36Å; T229-L233 PolarHBondContact O-N 3.26Å; L233-F235 VanDerWaalsContact C-N 3.28Å; L233-F235 PolarHBondContact O-N 2.98Å; L233-L236 PolarHBondContact O-N 3.47Å; L233-L237 WeakPolarHBondContact O-CB 3.23Å; L233-L237 VanDerWaalsContact O-CG 3.28Å; L233-L237 WeakPolarHBondContact O-CG 3.4Å; L233-L237 PolarHBondContact O-N 3.4Å
234A96Very high94.3Very high28 Ų2868.7 Ų68.723%0.23132%0.321CS..Hα-helixtrans-60-38.717700000112.3Y155 I230 I231 K238Y155-A234 WeakPolarHBondContact CE2-O 3.33Å; Y155-A234 PolarHBondContact OH-O 3.43Å; I230-A234 WeakPolarHBondContact O-CB 3.43Å; I230-A234 PolarHBondContact O-N 3.4Å; I231-A234 PolarHBondContact O-N 2.63Å; A234-K238 WeakPolarHBondContact O-CB 3.18Å; A234-K238 PolarHBondContact O-N 3.42Å; A234-K238 VanDerWaalsContact O-N 3.16Å
235F95.2Very high93.9Very high1 Ų176.7 Ų76.70%0.00436%0.356CS..Hα-helixtrans-63.2-49.5173.4166.2-92.2000111.6R150 C151 I154 I231 D232 L233 L237 K238 L239 T266R150-F235 HydrophobicContact CB-CE2 4.42Å; C151-F235 HydrophobicContact CB-CB 4.26Å; I154-F235 HydrophobicContact CD1-CD2 3.81Å; I154-F235 HydrophobicContact CD1-CE2 3.16Å; I154-F235 HydrophobicContact CD1-CZ 3.86Å; I154-F235 HydrophobicContact CG1-CD2 4.34Å; I154-F235 HydrophobicContact CG1-CE2 3.93Å; I231-F235 WeakPolarHBondContact O-CB 3.31Å; I231-F235 PolarHBondContact O-N 2.81Å; D232-F235 WeakPolarHBondContact O-CB 3.5Å; D232-F235 PolarHBondContact O-N 3.22Å; L233-F235 VanDerWaalsContact C-N 3.28Å; L233-F235 PolarHBondContact O-N 2.98Å; F235-L237 PolarHBondContact O-N 3.43Å; F235-K238 PolarHBondContact O-N 3.17Å; F235-L239 HydrophobicContact CE1-CD2 4Å; F235-L239 HydrophobicContact CZ-CD2 4.05Å; F235-L239 WeakPolarHBondContact O-CB 3.36Å; F235-L239 PolarHBondContact O-N 3.35Å; F235-T266 WeakPolarHBondContact CD1-OG1 3.41Å; F235-T266 WeakPolarHBondContact CE1-OG1 3.17Å
236L95.2Very high93.3Very high65 Ų6580.3 Ų80.334%0.3438%0.375SS..Hα-helixtrans-62.8-43.4-179.2-74.4174000112D232 L233 K238 L239 R240 T266 I270D232-L236 WeakPolarHBondContact O-CB 3.49Å; D232-L236 VanDerWaalsContact O-CG 3.28Å; D232-L236 WeakPolarHBondContact O-CG 2.98Å; D232-L236 PolarHBondContact O-N 3.21Å; L233-L236 PolarHBondContact O-N 3.47Å; L236-K238 VanDerWaalsContact C-N 3.34Å; L236-K238 PolarHBondContact O-N 3.01Å; L236-L239 PolarHBondContact O-N 3.18Å; L236-R240 WeakPolarHBondContact O-CB 3.49Å; L236-R240 PolarHBondContact O-N 3.28Å; L236-T266 HydrophobicContact CD1-CG2 4.18Å; L236-T266 HydrophobicContact CD2-CG2 4.02Å; L236-T266 HydrophobicContact CG-CG2 4.14Å; L236-I270 HydrophobicContact CD1-CD1 4.45Å
237L94.6Very high92.6Very high117 Ų11779.2 Ų79.261%0.61338%0.375SS*.Hα-helixtrans-60.1-44.2176.3-70.8173.7000111.4L233 F235 K241L233-L237 WeakPolarHBondContact O-CB 3.23Å; L233-L237 VanDerWaalsContact O-CG 3.28Å; L233-L237 WeakPolarHBondContact O-CG 3.4Å; L233-L237 PolarHBondContact O-N 3.4Å; F235-L237 PolarHBondContact O-N 3.43Å; L237-K241 PolarHBondContact O-N 3.12Å; L237-K241 VanDerWaalsContact O-N 3.08Å
238K92.5Very high91.8Very high66 Ų6677.6 Ų77.629%0.28737%0.371SS..Hα-helixtrans-67.6-43.5177.8-173.967.3174.4-1650112.3I154 Y155 A234 F235 L236 R240 K241 Q242I154-K238 HydrophobicContact CG2-CB 4.41Å; I154-K238 HydrophobicContact CG2-CG 3.63Å; Y155-K238 HydrophobicContact CD1-CD 4.15Å; Y155-K238 HydrophobicContact CD1-CG 4.41Å; Y155-K238 HydrophobicContact CD2-CB 4.13Å; Y155-K238 HydrophobicContact CD2-CG 3.89Å; Y155-K238 HydrophobicContact CE1-CB 4.38Å; Y155-K238 HydrophobicContact CE1-CD 3.88Å; Y155-K238 HydrophobicContact CE1-CG 4.2Å; Y155-K238 HydrophobicContact CE2-CB 3.42Å; Y155-K238 VanDerWaalsContact CE2-CB 3.42Å; Y155-K238 HydrophobicContact CE2-CD 4.27Å; Y155-K238 HydrophobicContact CE2-CG 3.66Å; Y155-K238 HydrophobicContact CG-CD 4.46Å; Y155-K238 HydrophobicContact CG-CG 4.27Å; A234-K238 WeakPolarHBondContact O-CB 3.18Å; A234-K238 PolarHBondContact O-N 3.42Å; A234-K238 VanDerWaalsContact O-N 3.16Å; F235-K238 PolarHBondContact O-N 3.17Å; L236-K238 VanDerWaalsContact C-N 3.34Å; L236-K238 PolarHBondContact O-N 3.01Å; K238-R240 VanDerWaalsContact C-N 3.33Å; K238-R240 PolarHBondContact O-N 3.22Å; K238-K241 PolarHBondContact O-N 2.94Å; K238-Q242 PolarHBondContact O-N 3.5Å
239L91.7Very high90.9Very high8 Ų883.8 Ų83.84%0.04240%0.404CS..Hα-helixtrans-60.2-45177.6179.762.6000110.6I154 F235 L236 K241 Q242 L243 I259 I263I154-L239 HydrophobicContact CD1-CD1 4.12Å; F235-L239 HydrophobicContact CE1-CD2 4Å; F235-L239 HydrophobicContact CZ-CD2 4.05Å; F235-L239 WeakPolarHBondContact O-CB 3.36Å; F235-L239 PolarHBondContact O-N 3.35Å; L236-L239 PolarHBondContact O-N 3.18Å; L239-K241 PolarHBondContact O-N 3.19Å; L239-Q242 PolarHBondContact O-N 2.97Å; L239-L243 HydrophobicContact CD1-CD1 4.26Å; L239-L243 HydrophobicContact CD1-CG 4.25Å; L239-L243 HydrophobicContact CG-CD1 4.18Å; L239-L243 WeakPolarHBondContact O-CG 3.36Å; L239-L243 PolarHBondContact O-N 3.3Å; L239-I259 HydrophobicContact CD1-CG1 4.29Å; L239-I259 HydrophobicContact CD1-CG2 4.09Å; L239-I263 HydrophobicContact CD2-CD1 4.24Å; L239-I263 HydrophobicContact CD2-CG1 3.84Å
240R92.4Very high90.3Very high195 Ų19590.5 Ų90.574%0.73643%0.43SS*.Hα-helixtrans-57.4-49174.7-177.6179.8177.6177.6-0.2111.5L236 K238 Q242 L243 Y244L236-R240 WeakPolarHBondContact O-CB 3.49Å; L236-R240 PolarHBondContact O-N 3.28Å; K238-R240 VanDerWaalsContact C-N 3.33Å; K238-R240 PolarHBondContact O-N 3.22Å; R240-Q242 VanDerWaalsContact C-N 3.28Å; R240-Q242 PolarHBondContact O-N 3.07Å; R240-L243 PolarHBondContact O-N 2.52Å; R240-Y244 WeakPolarHBondContact O-CB 2.99Å; R240-Y244 PolarHBondContact O-N 3.41Å
241K91.4Very high89.7Confident156 Ų15686.8 Ų86.868%0.67841%0.411SS*.Hα-helixtrans-59.5-39.2177.9-173.6172.2-177.8170.40112.2L237 K238 L239 K245L237-K241 PolarHBondContact O-N 3.12Å; L237-K241 VanDerWaalsContact O-N 3.08Å; K238-K241 PolarHBondContact O-N 2.94Å; L239-K241 PolarHBondContact O-N 3.19Å; K241-K245 PolarHBondContact O-N 3.13Å
242Q87.8Confident89.2Confident73 Ų7388.2 Ų88.234%0.34142%0.423SS..Hα-helixtrans-68.4-43.8177.9-176.9175.5-5.300112.4K238 L239 R240 Y244 K245 N246K238-Q242 PolarHBondContact O-N 3.5Å; L239-Q242 PolarHBondContact O-N 2.97Å; R240-Q242 VanDerWaalsContact C-N 3.28Å; R240-Q242 PolarHBondContact O-N 3.07Å; Q242-Y244 VanDerWaalsContact C-N 3.32Å; Q242-K245 PolarHBondContact O-N 3.45Å; Q242-N246 PolarHBondContact O-N 2.97Å
243L88.3Confident88.8Confident50 Ų5092.8 Ų92.826%0.26245%0.451SS..Hα-helixtrans-69.3-30.2178.5-70-178.7000112.9L239 R240 N246 L248 I259L239-L243 HydrophobicContact CD1-CD1 4.26Å; L239-L243 HydrophobicContact CD1-CG 4.25Å; L239-L243 HydrophobicContact CG-CD1 4.18Å; L239-L243 WeakPolarHBondContact O-CG 3.36Å; L239-L243 PolarHBondContact O-N 3.3Å; R240-L243 PolarHBondContact O-N 2.52Å; L243-N246 CarbonylContact O-C 3.58Å; L243-N246 VanDerWaalsContact O-O 3.07Å; L243-L248 HydrophobicContact CD1-CD1 4.44Å; L243-L248 HydrophobicContact CD2-CD1 3.81Å; L243-I259 HydrophobicContact CD2-CD1 4.1Å
244Y89.3Confident88.3Confident213 Ų21393 Ų9384%0.83546%0.456SS*.Hα-helixtrans-67.1-43.7172.2-175.8-99000111.7R240 Q242R240-Y244 WeakPolarHBondContact O-CB 2.99Å; R240-Y244 PolarHBondContact O-N 3.41Å; Q242-Y244 VanDerWaalsContact C-N 3.32Å
245K86.8Confident87.8Confident176 Ų17695.5 Ų95.577%0.76547%0.465SS*.Hα-helixtrans-70.7-43178.3-173.3176.2179.5177.10112.5K241 Q242K241-K245 PolarHBondContact O-N 3.13Å; Q242-K245 PolarHBondContact O-N 3.45Å
246N84Confident87.4Confident77 Ų7798.9 Ų98.941%0.41248%0.48SS..SBendtrans-118.1100-178.9-67.1-11000108.6Q242 L243 L248 L251Q242-N246 PolarHBondContact O-N 2.97Å; L243-N246 CarbonylContact O-C 3.58Å; L243-N246 VanDerWaalsContact O-O 3.07Å; N246-L248 PolarHBondContact O-N 3.4Å; N246-L251 HydrophobicContact CB-CD1 3.91Å; N246-L251 WeakPolarHBondContact O-CD1 3.22Å
247S82.5Confident87Confident60 Ų60102.9 Ų102.942%0.4250%0.495SS..  trans-49.7138.8174.1171.30000110.6N249 K250 L251S247-N249 PolarHBondContact O-N 3.31Å; S247-K250 PolarHBondContact O-N 3.45Å; S247-L251 VanDerWaalsContact O-CD1 3.25Å; S247-L251 WeakPolarHBondContact O-CD1 3.41Å
248L79.6Confident86.6Confident83 Ų83100 Ų10044%0.43548%0.478SS..G310 helixtrans-50.8-31.4-177.8-151116.3000111.9L243 N246 K250 L251 K256L243-L248 HydrophobicContact CD1-CD1 4.44Å; L243-L248 HydrophobicContact CD2-CD1 3.81Å; N246-L248 PolarHBondContact O-N 3.4Å; L248-K250 VanDerWaalsContact C-N 3.3Å; L248-K250 PolarHBondContact O-N 3.11Å; L248-L251 PolarHBondContact O-N 2.9Å; L248-K256 WeakPolarHBondContact O-CE 3Å; L248-K256 PolarHBondContact O-NZ 2.88Å
249N78.9Confident86.4Confident131 Ų13197.5 Ų97.570%0.70147%0.468SS*.G310 helixtrans-66.5-28-179.8-68.2-13000113.7S247 L251S247-N249 PolarHBondContact O-N 3.31Å; N249-L251 VanDerWaalsContact C-N 3.33Å
250K84.1Confident86.4Confident182 Ų182103.8 Ų103.879%0.79150%0.495SS*.G310 helixtrans-82.5-9.3178.8-62.7-175.3177.7-177.70113.4S247 L248S247-K250 PolarHBondContact O-N 3.45Å; L248-K250 VanDerWaalsContact C-N 3.3Å; L248-K250 PolarHBondContact O-N 3.11Å
251L83.7Confident86.3Confident22 Ų2297.6 Ų97.612%0.11547%0.471CS..SBendtrans-81.4145.3-178.4-83.574.3000111.6N246 S247 L248 N249 D255 K256 I259N246-L251 HydrophobicContact CB-CD1 3.91Å; N246-L251 WeakPolarHBondContact O-CD1 3.22Å; S247-L251 VanDerWaalsContact O-CD1 3.25Å; S247-L251 WeakPolarHBondContact O-CD1 3.41Å; L248-L251 PolarHBondContact O-N 2.9Å; N249-L251 VanDerWaalsContact C-N 3.33Å; L251-D255 HydrophobicContact CB-CB 4.23Å; L251-D255 HydrophobicContact CD2-CB 4.02Å; L251-D255 HydrophobicContact CG-CB 4.4Å; L251-K256 HydrophobicContact CB-CG 4.14Å; L251-K256 WeakPolarHBondContact O-CE 3.22Å; L251-I259 HydrophobicContact CD2-CD1 3.28Å
252S87Confident86.3Confident49 Ų4990.3 Ų90.334%0.34344%0.44SS..  trans-60.2155.9172.975.20000111.5T254 D255 K256S252-T254 PolarHBondContact O-N 2.78Å; S252-T254 PolarHBondContact OG-OG1 3.24Å; S252-D255 PolarHBondContact O-N 3.29Å; S252-D255 VanDerWaalsContact O-N 3.14Å; S252-D255 WeakPolarHBondContact OG-CB 3.22Å; S252-D255 PolarHBondContact OG-N 3.46Å; S252-D255 VanDerWaalsContact OG-N 3.15Å; S252-D255 PolarHBondContact OG-OD2 3.46Å; S252-K256 WeakPolarHBondContact O-CG 3.08Å; S252-K256 PolarHBondContact O-N 3.47Å
253V87.5Confident86.6Confident100 Ų10090 Ų9061%0.60644%0.44SS*.Hα-helixtrans-58.5-34.6177.3177.70000111.4K257V253-K257 WeakPolarHBondContact O-CG 3.47Å; V253-K257 PolarHBondContact O-N 2.9Å; V253-K257 VanDerWaalsContact O-N 3.17Å
254T85.1Confident86.9Confident101 Ų10189.4 Ų89.462%0.6244%0.437SS*.Hα-helixtrans-67.6-42.3176.941.70000112.2S252 K257 H258S252-T254 PolarHBondContact O-N 2.78Å; S252-T254 PolarHBondContact OG-OG1 3.24Å; T254-K257 PolarHBondContact O-N 3.22Å; T254-H258 PolarHBondContact O-N 3.09Å
255D85.6Confident87.1Confident80 Ų8079.7 Ų79.743%0.42840%0.399SS..Hα-helixtrans-68.6-40.4179.1-59.8-33.2000111.1L251 S252 K257 H258 I259L251-D255 HydrophobicContact CB-CB 4.23Å; L251-D255 HydrophobicContact CD2-CB 4.02Å; L251-D255 HydrophobicContact CG-CB 4.4Å; S252-D255 PolarHBondContact O-N 3.29Å; S252-D255 VanDerWaalsContact O-N 3.14Å; S252-D255 WeakPolarHBondContact OG-CB 3.22Å; S252-D255 PolarHBondContact OG-N 3.46Å; S252-D255 VanDerWaalsContact OG-N 3.15Å; S252-D255 PolarHBondContact OG-OD2 3.46Å; D255-K257 VanDerWaalsContact C-N 3.32Å; D255-K257 PolarHBondContact O-N 3.46Å; D255-H258 WeakPolarHBondContact O-CB 3.48Å; D255-H258 PolarHBondContact O-N 3.29Å; D255-H258 VanDerWaalsContact O-N 3.13Å; D255-I259 WeakPolarHBondContact O-CG1 3.5Å; D255-I259 PolarHBondContact O-N 3.35Å
256K86.9Confident87.5Confident73 Ų7371.4 Ų71.432%0.31736%0.364SS..Hα-helixtrans-56.8-45173.5-73176.9178.4173.10111.6L248 L251 S252 I259 K260L248-K256 WeakPolarHBondContact O-CE 3Å; L248-K256 PolarHBondContact O-NZ 2.88Å; L251-K256 HydrophobicContact CB-CG 4.14Å; L251-K256 WeakPolarHBondContact O-CE 3.22Å; S252-K256 WeakPolarHBondContact O-CG 3.08Å; S252-K256 PolarHBondContact O-N 3.47Å; K256-I259 PolarHBondContact O-N 3.12Å; K256-K260 WeakPolarHBondContact O-CB 3.28Å; K256-K260 PolarHBondContact O-N 2.95Å
257K87.6Confident88Confident149 Ų14971.6 Ų71.665%0.64836%0.364SS*.Hα-helixtrans-63.9-40.6175.8-74176.1-178.3175.10111.8V253 T254 D255 R261V253-K257 WeakPolarHBondContact O-CG 3.47Å; V253-K257 PolarHBondContact O-N 2.9Å; V253-K257 VanDerWaalsContact O-N 3.17Å; T254-K257 PolarHBondContact O-N 3.22Å; D255-K257 VanDerWaalsContact C-N 3.32Å; D255-K257 PolarHBondContact O-N 3.46Å; K257-R261 WeakPolarHBondContact O-CB 3.43Å; K257-R261 PolarHBondContact O-N 3.16Å
258H86.7Confident88.6Confident57 Ų5769 Ų6926%0.26435%0.345SS..Hα-helixtrans-63.2-46.3177-173.3-83.5000112.4T254 D255 R261 S262T254-H258 PolarHBondContact O-N 3.09Å; D255-H258 WeakPolarHBondContact O-CB 3.48Å; D255-H258 PolarHBondContact O-N 3.29Å; D255-H258 VanDerWaalsContact O-N 3.13Å; H258-R261 PolarHBondContact CD2-NH2 2.91Å; H258-R261 PolarHBondContact NE2-NH2 3.39Å; H258-R261 PolarHBondContact O-N 3.39Å; H258-S262 PolarHBondContact CE1-OG 3.27Å; H258-S262 WeakPolarHBondContact O-CB 3.3Å; H258-S262 PolarHBondContact O-N 3.29Å; H258-S262 PolarHBondContact O-OG 2.95Å
259I88.4Confident89.4Confident12 Ų1265.1 Ų65.16%0.06233%0.325CS..Hα-helixtrans-62.7-48177.6-70.4171.1000110.2L239 L243 L251 D255 K256 R261 S262 I263L239-I259 HydrophobicContact CD1-CG1 4.29Å; L239-I259 HydrophobicContact CD1-CG2 4.09Å; L243-I259 HydrophobicContact CD2-CD1 4.1Å; L251-I259 HydrophobicContact CD2-CD1 3.28Å; D255-I259 WeakPolarHBondContact O-CG1 3.5Å; D255-I259 PolarHBondContact O-N 3.35Å; K256-I259 PolarHBondContact O-N 3.12Å; I259-R261 VanDerWaalsContact C-N 3.32Å; I259-R261 PolarHBondContact O-N 2.88Å; I259-S262 PolarHBondContact O-N 2.85Å; I259-I263 HydrophobicContact CG2-CD1 3.71Å; I259-I263 HydrophobicContact CG2-CG1 4.31Å; I259-I263 WeakPolarHBondContact O-CG1 3.37Å; I259-I263 PolarHBondContact O-N 3.44Å
260K90.7Very high90.2Very high140 Ų14062.1 Ų62.161%0.60931%0.309SS*.Hα-helixtrans-55.7-46177.2-177.8175.1-179.1172.70112.1K256 S262 I263 L264K256-K260 WeakPolarHBondContact O-CB 3.28Å; K256-K260 PolarHBondContact O-N 2.95Å; K260-S262 VanDerWaalsContact C-N 3.34Å; K260-S262 PolarHBondContact O-N 3.41Å; K260-I263 PolarHBondContact O-N 2.96Å; K260-L264 HydrophobicContact CG-CD1 4.37Å; K260-L264 WeakPolarHBondContact O-CG 3.43Å; K260-L264 PolarHBondContact O-N 2.93Å
261R90.7Very high90.8Very high66 Ų6654.5 Ų54.525%0.24928%0.278CS..Hα-helixtrans-60.1-45.2175.3177.6178.270.6-1754.1111.6K257 H258 I259 I263 L264 L265 C326K257-R261 WeakPolarHBondContact O-CB 3.43Å; K257-R261 PolarHBondContact O-N 3.16Å; H258-R261 PolarHBondContact CD2-NH2 2.91Å; H258-R261 PolarHBondContact NE2-NH2 3.39Å; H258-R261 PolarHBondContact O-N 3.39Å; I259-R261 VanDerWaalsContact C-N 3.32Å; I259-R261 PolarHBondContact O-N 2.88Å; R261-I263 PolarHBondContact O-N 3.06Å; R261-L264 PolarHBondContact O-N 3.18Å; R261-L265 HydrophobicContact CG-CD1 4.03Å; R261-L265 WeakPolarHBondContact O-CG 3.44Å; R261-L265 PolarHBondContact O-N 2.91Å; R261-C326 HydrophobicContact CG-CB 3.9Å
262S91.8Very high91.4Very high3 Ų353.6 Ų53.62%0.02127%0.273CS..Hα-helixtrans-66.1-39.2-176.9-52.40000111.7R150 H258 I259 K260 L265 T266R150-S262 PolarHBondContact NH1-O 3.35Å; H258-S262 PolarHBondContact CE1-OG 3.27Å; H258-S262 WeakPolarHBondContact O-CB 3.3Å; H258-S262 PolarHBondContact O-N 3.29Å; H258-S262 PolarHBondContact O-OG 2.95Å; I259-S262 PolarHBondContact O-N 2.85Å; K260-S262 VanDerWaalsContact C-N 3.34Å; K260-S262 PolarHBondContact O-N 3.41Å; S262-L265 PolarHBondContact O-N 3.43Å; S262-T266 PolarHBondContact O-N 2.95Å; S262-T266 PolarHBondContact O-OG1 3.39Å
263I92.8Very high91.9Very high67 Ų6752 Ų5234%0.34426%0.261SS..Hα-helixtrans-62.5-47.8173.6-68169.3000111L239 I259 K260 R261 L265 T266 I267L239-I263 HydrophobicContact CD2-CD1 4.24Å; L239-I263 HydrophobicContact CD2-CG1 3.84Å; I259-I263 HydrophobicContact CG2-CD1 3.71Å; I259-I263 HydrophobicContact CG2-CG1 4.31Å; I259-I263 WeakPolarHBondContact O-CG1 3.37Å; I259-I263 PolarHBondContact O-N 3.44Å; K260-I263 PolarHBondContact O-N 2.96Å; R261-I263 PolarHBondContact O-N 3.06Å; I263-L265 VanDerWaalsContact C-N 3.3Å; I263-L265 PolarHBondContact O-N 3Å; I263-T266 WeakPolarHBondContact O-CB 3.48Å; I263-T266 PolarHBondContact O-N 3.4Å; I263-I267 HydrophobicContact CG2-CD1 4.11Å; I263-I267 WeakPolarHBondContact O-CG1 3.27Å; I263-I267 PolarHBondContact O-N 3.33Å
264L94.6Very high92.3Very high36 Ų3651.8 Ų51.819%0.18826%0.255CS..Hα-helixtrans-59.8-41.7178.3-72.2171.1000111.7K260 R261 T266 I267 S268 I322 K325K260-L264 HydrophobicContact CG-CD1 4.37Å; K260-L264 WeakPolarHBondContact O-CG 3.43Å; K260-L264 PolarHBondContact O-N 2.93Å; R261-L264 PolarHBondContact O-N 3.18Å; L264-T266 VanDerWaalsContact C-N 3.3Å; L264-T266 PolarHBondContact O-N 3.05Å; L264-I267 HydrophobicContact CD2-CD1 4.5Å; L264-I267 WeakPolarHBondContact O-CB 3.42Å; L264-I267 PolarHBondContact O-N 2Å; L264-S268 PolarHBondContact O-N 2.85Å; L264-S268 VanDerWaalsContact O-N 3.09Å; L264-I322 HydrophobicContact CB-CG2 3.87Å; L264-K325 HydrophobicContact CD1-CB 4.5Å
265L94Very high92.8Very high9 Ų948.1 Ų48.15%0.04723%0.232CC..Hα-helixtrans-65.9-32174.8-67.9172.2000112.4Q76 I80 R150 R261 S262 I263 S268 S269 I322 Y323Q76-L265 HydrophobicContact CG-CD1 3.86Å; I80-L265 HydrophobicContact CD1-CD2 3.96Å; R150-L265 VanDerWaalsContact NH1-C 3.27Å; R261-L265 HydrophobicContact CG-CD1 4.03Å; R261-L265 WeakPolarHBondContact O-CG 3.44Å; R261-L265 PolarHBondContact O-N 2.91Å; S262-L265 PolarHBondContact O-N 3.43Å; I263-L265 VanDerWaalsContact C-N 3.3Å; I263-L265 PolarHBondContact O-N 3Å; L265-S268 PolarHBondContact O-N 3.47Å; L265-S269 PolarHBondContact O-N 3.48Å; L265-I322 HydrophobicContact CD2-CG2 4.18Å; L265-Y323 HydrophobicContact CD2-CD1 4.13Å; L265-Y323 HydrophobicContact CD2-CE1 3.8Å
266T94.7Very high93.3Very high3 Ų344.4 Ų44.42%0.01821%0.212CC..Hα-helixtrans-70.2-36.1173.5-63.30000111.2R150 D232 F235 L236 S262 I263 L264 S268 S269 I270R150-T266 PolarHBondContact NH1-OG1 3.44Å; D232-T266 HydrophobicContact CB-CG2 4.47Å; F235-T266 WeakPolarHBondContact CD1-OG1 3.41Å; F235-T266 WeakPolarHBondContact CE1-OG1 3.17Å; L236-T266 HydrophobicContact CD1-CG2 4.18Å; L236-T266 HydrophobicContact CD2-CG2 4.02Å; L236-T266 HydrophobicContact CG-CG2 4.14Å; S262-T266 PolarHBondContact O-N 2.95Å; S262-T266 PolarHBondContact O-OG1 3.39Å; I263-T266 WeakPolarHBondContact O-CB 3.48Å; I263-T266 PolarHBondContact O-N 3.4Å; L264-T266 VanDerWaalsContact C-N 3.3Å; L264-T266 PolarHBondContact O-N 3.05Å; T266-S268 VanDerWaalsContact C-N 3.35Å; T266-S269 WeakPolarHBondContact O-CB 3.42Å; T266-S269 PolarHBondContact O-N 2.97Å; T266-I270 HydrophobicContact CG2-CD1 3.79Å; T266-I270 HydrophobicContact CG2-CG1 4.2Å; T266-I270 WeakPolarHBondContact O-CB 3.34Å; T266-I270 VanDerWaalsContact O-CG1 3.28Å; T266-I270 WeakPolarHBondContact O-CG1 3.28Å; T266-I270 PolarHBondContact O-N 3.4Å
267I95.6Very high93.6Very high81 Ų8144.3 Ų44.342%0.41521%0.214SC..Hα-helixtrans-61.9-44.1174.2-67.6167.1000110.8I263 L264 S269 I270 S271I263-I267 HydrophobicContact CG2-CD1 4.11Å; I263-I267 WeakPolarHBondContact O-CG1 3.27Å; I263-I267 PolarHBondContact O-N 3.33Å; L264-I267 HydrophobicContact CD2-CD1 4.5Å; L264-I267 WeakPolarHBondContact O-CB 3.42Å; L264-I267 PolarHBondContact O-N 2Å; I267-S269 VanDerWaalsContact C-N 3.33Å; I267-S269 PolarHBondContact O-N 2.96Å; I267-I270 PolarHBondContact O-N 3.49Å; I267-S271 PolarHBondContact O-N 2.79Å; I267-S271 PolarHBondContact O-OG 2.83Å
268S94.4Very high94Very high4 Ų439.3 Ų39.33%0.02820%0.197CC..Hα-helixtrans-59.4-42.2172.7160.50000112.1L264 L265 T266 S271 F272 D319L264-S268 PolarHBondContact O-N 2.85Å; L264-S268 VanDerWaalsContact O-N 3.09Å; L265-S268 PolarHBondContact O-N 3.47Å; T266-S268 VanDerWaalsContact C-N 3.35Å; S268-S271 PolarHBondContact O-N 2.85Å; S268-S271 PolarHBondContact O-OG 2.93Å; S268-F272 PolarHBondContact O-N 3.29Å; S268-F272 VanDerWaalsContact O-N 3.09Å; S268-D319 WeakPolarHBondContact CB-OD1 3.45Å; S268-D319 PolarHBondContact OG-OD1 3.31Å; S268-D319 PolarHBondContact OG-OD2 2.86Å
269S95.6Very high94.4Very high3 Ų336.6 Ų36.62%0.02119%0.185CC..Hα-helixtrans-66-43.4176.7-164.10000112.7L228 D232 L265 T266 I267 S271 F272 I273L228-S269 WeakPolarHBondContact CD1-OG 3.18Å; L228-S269 WeakPolarHBondContact CG-OG 3.46Å; D232-S269 WeakPolarHBondContact OD2-CB 3.05Å; D232-S269 PolarHBondContact OD2-OG 3.06Å; L265-S269 PolarHBondContact O-N 3.48Å; T266-S269 WeakPolarHBondContact O-CB 3.42Å; T266-S269 PolarHBondContact O-N 2.97Å; I267-S269 VanDerWaalsContact C-N 3.33Å; I267-S269 PolarHBondContact O-N 2.96Å; S269-S271 PolarHBondContact O-N 3.21Å; S269-F272 WeakPolarHBondContact O-CB 3.08Å; S269-F272 PolarHBondContact O-N 3.45Å; S269-I273 VanDerWaalsContact O-CG1 3.28Å; S269-I273 WeakPolarHBondContact O-CG1 3.44Å; S269-I273 PolarHBondContact O-N 3.26Å
270I96.4Very high94.6Very high68 Ų6836.3 Ų36.335%0.34918%0.184SC..Hα-helixtrans-63.1-42.9177.4-70.1167.2000110.9L236 T266 I267 F272 I273 I274L236-I270 HydrophobicContact CD1-CD1 4.45Å; T266-I270 HydrophobicContact CG2-CD1 3.79Å; T266-I270 HydrophobicContact CG2-CG1 4.2Å; T266-I270 WeakPolarHBondContact O-CB 3.34Å; T266-I270 VanDerWaalsContact O-CG1 3.28Å; T266-I270 WeakPolarHBondContact O-CG1 3.28Å; T266-I270 PolarHBondContact O-N 3.4Å; I267-I270 PolarHBondContact O-N 3.49Å; I270-F272 VanDerWaalsContact C-N 3.31Å; I270-F272 PolarHBondContact O-N 2.91Å; I270-I273 PolarHBondContact O-N 2.82Å; I270-I274 HydrophobicContact CG2-CD1 4.08Å; I270-I274 WeakPolarHBondContact O-CG1 3.28Å; I270-I274 PolarHBondContact O-N 3.01Å
271S96.7Very high94.6Very high22 Ų2233.6 Ų33.615%0.15418%0.179CC..Hα-helixtrans-62.7-41177680000111.1I267 S268 S269 I274 M275 R315I267-S271 PolarHBondContact O-N 2.79Å; I267-S271 PolarHBondContact O-OG 2.83Å; S268-S271 PolarHBondContact O-N 2.85Å; S268-S271 PolarHBondContact O-OG 2.93Å; S269-S271 PolarHBondContact O-N 3.21Å; S271-I274 PolarHBondContact O-N 3.19Å; S271-M275 WeakPolarHBondContact O-CG 3.44Å; S271-M275 PolarHBondContact O-N 3.22Å; S271-R315 WeakPolarHBondContact OG-CD 3.35Å; S271-R315 WeakPolarHBondContact OG-CG 3.35Å
272F96.6Very high94.6Very high2 Ų233 Ų331%0.00918%0.179CC..Hα-helixtrans-59.8-46.9171.7174.5-91.2000112.6M139 L220 L228 S268 S269 I270 I274 M275 A276M139-F272 HydrophobicContact CE-CE2 3.94Å; M139-F272 HydrophobicContact CE-CZ 4.5Å; L220-F272 HydrophobicContact CB-CZ 4.37Å; L220-F272 HydrophobicContact CD2-CD2 4.49Å; L220-F272 HydrophobicContact CD2-CE2 3.59Å; L220-F272 HydrophobicContact CD2-CZ 4.05Å; L228-F272 HydrophobicContact CD2-CD1 3.67Å; L228-F272 HydrophobicContact CD2-CE1 3.98Å; S268-F272 PolarHBondContact O-N 3.29Å; S268-F272 VanDerWaalsContact O-N 3.09Å; S269-F272 WeakPolarHBondContact O-CB 3.08Å; S269-F272 PolarHBondContact O-N 3.45Å; I270-F272 VanDerWaalsContact C-N 3.31Å; I270-F272 PolarHBondContact O-N 2.91Å; F272-I274 VanDerWaalsContact C-N 3.31Å; F272-I274 PolarHBondContact O-N 2.87Å; F272-M275 PolarHBondContact O-N 3.2Å; F272-A276 HydrophobicContact CE1-CB 4.15Å; F272-A276 HydrophobicContact CZ-CB 4.4Å; F272-A276 WeakPolarHBondContact O-CB 3.1Å; F272-A276 PolarHBondContact O-N 3.2Å
273I96.9Very high94.5Very high15 Ų1533.2 Ų33.28%0.07718%0.179CC..Hα-helixtrans-56.8-44.5179-70.8162.7000111.1T225 L228 T229 S269 I270 M275 A276 L277T225-I273 HydrophobicContact CG2-CB 4.39Å; T225-I273 HydrophobicContact CG2-CG1 4.31Å; T225-I273 HydrophobicContact CG2-CG2 4.03Å; L228-I273 HydrophobicContact CD2-CD1 4.24Å; L228-I273 HydrophobicContact CD2-CG1 3.78Å; L228-I273 HydrophobicContact CG-CD1 4.04Å; L228-I273 HydrophobicContact CG-CG1 4.09Å; T229-I273 WeakPolarHBondContact OG1-CG2 3.29Å; S269-I273 VanDerWaalsContact O-CG1 3.28Å; S269-I273 WeakPolarHBondContact O-CG1 3.44Å; S269-I273 PolarHBondContact O-N 3.26Å; I270-I273 PolarHBondContact O-N 2.82Å; I273-M275 VanDerWaalsContact C-N 3.34Å; I273-M275 PolarHBondContact O-N 3.47Å; I273-A276 PolarHBondContact O-N 3.34Å; I273-L277 HydrophobicContact CG2-CD1 3.63Å; I273-L277 HydrophobicContact CG2-CG 4.04Å; I273-L277 WeakPolarHBondContact O-CB 3.32Å; I273-L277 VanDerWaalsContact O-CG 3.29Å; I273-L277 WeakPolarHBondContact O-CG 3.42Å; I273-L277 PolarHBondContact O-N 3.14Å
274I96.5Very high94.2Very high96 Ų9631.3 Ų31.349%0.49217%0.172SC..Hα-helixtrans-58.9-48.4179.3-67.6165.4000110.2I270 S271 F272 A276 C278I270-I274 HydrophobicContact CG2-CD1 4.08Å; I270-I274 WeakPolarHBondContact O-CG1 3.28Å; I270-I274 PolarHBondContact O-N 3.01Å; S271-I274 PolarHBondContact O-N 3.19Å; F272-I274 VanDerWaalsContact C-N 3.31Å; F272-I274 PolarHBondContact O-N 2.87Å; I274-A276 PolarHBondContact O-N 3.11Å; I274-C278 PolarHBondContact O-N 2.9Å; I274-C278 VanDerWaalsContact O-N 3.12Å; I274-C278 PolarHBondContact O-SG 3.04Å
275M95.3Very high93.8Very high25 Ų2533.9 Ų33.912%0.12319%0.185CC..Hα-helixtrans-62.3-44.7178.6-58.1-44.9-64.100112.1L220 S271 F272 I273 C278 Q279 F308 L311 N312 R315L220-M275 HydrophobicContact CD1-CB 4.44Å; S271-M275 WeakPolarHBondContact O-CG 3.44Å; S271-M275 PolarHBondContact O-N 3.22Å; F272-M275 PolarHBondContact O-N 3.2Å; I273-M275 VanDerWaalsContact C-N 3.34Å; I273-M275 PolarHBondContact O-N 3.47Å; M275-C278 PolarHBondContact O-N 2.86Å; M275-Q279 WeakPolarHBondContact O-CB 3.45Å; M275-Q279 PolarHBondContact O-N 3.38Å; M275-F308 HydrophobicContact CE-CB 4.48Å; M275-F308 HydrophobicContact CE-CD1 3.65Å; M275-F308 HydrophobicContact CE-CE1 4.43Å; M275-F308 WeakPolarHBondContact CE-O 3.05Å; M275-L311 HydrophobicContact CE-CB 3.06Å; M275-L311 HydrophobicContact CE-CD1 3.81Å; M275-L311 HydrophobicContact CE-CG 4.09Å; M275-L311 HydrophobicContact SD-CB 4.49Å; M275-N312 HydrophobicContact CB-CB 4.22Å; M275-N312 HydrophobicContact CG-CB 4.47Å; M275-R315 HydrophobicContact CG-CG 4.44Å
276A95.4Very high93.3Very high1 Ų133.6 Ų33.61%0.00818%0.184CC..Hα-helixtrans-65.1-44.4-178.500000112.5L220 T225 F272 I273 I274 Q279 A280L220-A276 HydrophobicContact CB-CB 3.65Å; L220-A276 HydrophobicContact CD1-CB 4.25Å; T225-A276 HydrophobicContact CG2-CB 3.9Å; T225-A276 WeakPolarHBondContact OG1-CB 3.32Å; F272-A276 HydrophobicContact CE1-CB 4.15Å; F272-A276 HydrophobicContact CZ-CB 4.4Å; F272-A276 WeakPolarHBondContact O-CB 3.1Å; F272-A276 PolarHBondContact O-N 3.2Å; I273-A276 PolarHBondContact O-N 3.34Å; I274-A276 PolarHBondContact O-N 3.11Å; A276-Q279 PolarHBondContact O-N 3.22Å; A276-A280 VanDerWaalsContact O-CB 3.26Å; A276-A280 WeakPolarHBondContact O-CB 3.35Å; A276-A280 PolarHBondContact O-N 2.94Å
277L95Very high92.8Very high72 Ų7234 Ų3438%0.37719%0.186SC..Hα-helixtrans-64-45.2177.4-71.9176.5000111.4L222 T225 I273 Q279 A280 V281L222-L277 HydrophobicContact CD1-CD2 4.17Å; T225-L277 HydrophobicContact CG2-CD2 3.86Å; T225-L277 HydrophobicContact CG2-CG 3.91Å; I273-L277 HydrophobicContact CG2-CD1 3.63Å; I273-L277 HydrophobicContact CG2-CG 4.04Å; I273-L277 WeakPolarHBondContact O-CB 3.32Å; I273-L277 VanDerWaalsContact O-CG 3.29Å; I273-L277 WeakPolarHBondContact O-CG 3.42Å; I273-L277 PolarHBondContact O-N 3.14Å; L277-Q279 PolarHBondContact O-N 3.18Å; L277-A280 PolarHBondContact O-N 3.37Å; L277-V281 WeakPolarHBondContact O-CG2 3.5Å; L277-V281 PolarHBondContact O-N 3.29Å
278C95.1Very high91.9Very high43 Ų4335.7 Ų35.729%0.29119%0.19SC..Hα-helixtrans-60.2-47.6176.7-70.40000111.5I274 M275 A280 V281 F282 F308I274-C278 PolarHBondContact O-N 2.9Å; I274-C278 VanDerWaalsContact O-N 3.12Å; I274-C278 PolarHBondContact O-SG 3.04Å; M275-C278 PolarHBondContact O-N 2.86Å; C278-A280 VanDerWaalsContact C-N 3.34Å; C278-A280 PolarHBondContact O-N 2.8Å; C278-V281 PolarHBondContact O-N 3.12Å; C278-F282 VanDerWaalsContact O-CD2 3.26Å; C278-F282 WeakPolarHBondContact O-CD2 3.21Å; C278-F282 PolarHBondContact O-N 3.13Å; C278-F308 HydrophobicContact CB-CD1 3.44Å; C278-F308 VanDerWaalsContact CB-CD1 3.44Å; C278-F308 HydrophobicContact CB-CD2 4.03Å; C278-F308 HydrophobicContact CB-CE1 3.27Å; C278-F308 HydrophobicContact CB-CE2 3.88Å; C278-F308 HydrophobicContact CB-CG 3.84Å; C278-F308 HydrophobicContact CB-CZ 3.52Å
279Q94.6Very high90.8Very high0 Ų036.7 Ų36.70%020%0.197CC..Hα-helixtrans-59.6-45176.2-178.2171.558.500112.2N219 L220 M275 A276 L277 V281 F282 Y283 G305 F308N219-Q279 PolarHBondContact O-OE1 3.44Å; L220-Q279 HydrophobicContact CD1-CB 4.16Å; M275-Q279 WeakPolarHBondContact O-CB 3.45Å; M275-Q279 PolarHBondContact O-N 3.38Å; A276-Q279 PolarHBondContact O-N 3.22Å; L277-Q279 PolarHBondContact O-N 3.18Å; Q279-V281 VanDerWaalsContact C-N 3.3Å; Q279-V281 PolarHBondContact O-N 3.1Å; Q279-F282 PolarHBondContact O-N 2.93Å; Q279-Y283 VanDerWaalsContact CD-CE2 3.42Å; Q279-Y283 HydrophobicContact CG-CD2 3.54Å; Q279-Y283 HydrophobicContact CG-CE2 3.43Å; Q279-Y283 VanDerWaalsContact CG-CE2 3.43Å; Q279-Y283 HydrophobicContact CG-CG 4.47Å; Q279-Y283 VanDerWaalsContact NE2-CE2 3.26Å; Q279-Y283 PolarHBondContact NE2-OH 3.42Å; Q279-Y283 PolarHBondContact O-N 2.99Å; Q279-G305 WeakPolarHBondContact CG-O 3.21Å; Q279-G305 PolarHBondContact NE2-O 2.63Å; Q279-F308 HydrophobicContact CB-CB 3.77Å; Q279-F308 HydrophobicContact CG-CB 4.48Å
280A92.4Very high89.1Confident6 Ų638.9 Ų38.95%0.0521%0.212CC..Hα-helixtrans-62.1-37.8-178.300000112.1L222 A276 L277 C278 S284L222-A280 HydrophobicContact CB-CB 4.09Å; L222-A280 HydrophobicContact CD1-CB 3.83Å; L222-A280 HydrophobicContact CD2-CB 4.37Å; L222-A280 HydrophobicContact CG-CB 4.31Å; A276-A280 VanDerWaalsContact O-CB 3.26Å; A276-A280 WeakPolarHBondContact O-CB 3.35Å; A276-A280 PolarHBondContact O-N 2.94Å; L277-A280 PolarHBondContact O-N 3.37Å; C278-A280 VanDerWaalsContact C-N 3.34Å; C278-A280 PolarHBondContact O-N 2.8Å; A280-S284 WeakPolarHBondContact O-CB 3.5Å; A280-S284 PolarHBondContact O-N 3.19Å; A280-S284 PolarHBondContact O-OG 3.35Å
281V91.4Very high87.1Confident83 Ų8339.2 Ų39.250%0.50322%0.218SC..Hα-helixtrans-60.6-53.2174.6170.40000110.4L277 C278 Q279 Y283 S284 L285L277-V281 WeakPolarHBondContact O-CG2 3.5Å; L277-V281 PolarHBondContact O-N 3.29Å; C278-V281 PolarHBondContact O-N 3.12Å; Q279-V281 VanDerWaalsContact C-N 3.3Å; Q279-V281 PolarHBondContact O-N 3.1Å; V281-Y283 PolarHBondContact O-N 3.42Å; V281-S284 PolarHBondContact O-N 3.07Å; V281-L285 HydrophobicContact CG1-CD1 4.06Å; V281-L285 WeakPolarHBondContact O-CG 3.4Å; V281-L285 PolarHBondContact O-N 2.75Å
282F91.4Very high85Confident55 Ų5543.2 Ų43.224%0.24124%0.237CC..Hα-helixtrans-64.3-41.2-178.1-77.3-73.4000112.9C278 Q279 S284 L285 A286 I304 F308C278-F282 VanDerWaalsContact O-CD2 3.26Å; C278-F282 WeakPolarHBondContact O-CD2 3.21Å; C278-F282 PolarHBondContact O-N 3.13Å; Q279-F282 PolarHBondContact O-N 2.93Å; F282-S284 VanDerWaalsContact C-N 3.34Å; F282-S284 PolarHBondContact O-N 3.39Å; F282-L285 PolarHBondContact O-N 3.36Å; F282-A286 VanDerWaalsContact O-CB 3.29Å; F282-A286 WeakPolarHBondContact O-CB 3.31Å; F282-A286 PolarHBondContact O-N 3.05Å; F282-I304 HydrophobicContact CD1-CB 3.99Å; F282-I304 HydrophobicContact CD1-CD1 4.35Å; F282-I304 HydrophobicContact CD1-CG2 3.68Å; F282-I304 HydrophobicContact CD2-CG2 3.6Å; F282-I304 HydrophobicContact CE1-CB 4.25Å; F282-I304 HydrophobicContact CE1-CD1 4Å; F282-I304 HydrophobicContact CE1-CG2 3.66Å; F282-I304 HydrophobicContact CE2-CG2 3.6Å; F282-I304 HydrophobicContact CG-CB 4.17Å; F282-I304 HydrophobicContact CG-CG2 3.66Å; F282-I304 HydrophobicContact CZ-CG2 3.62Å; F282-F308 AromaticContact CD2-CD2 3.97Å; F282-F308 HydrophobicContact CD2-CD2 3.97Å; F282-F308 AromaticContact CD2-CE2 3.6Å; F282-F308 HydrophobicContact CD2-CE2 3.6Å; F282-F308 HydrophobicContact CE2-CD2 4.32Å; F282-F308 AromaticContact CE2-CE2 3.49Å; F282-F308 HydrophobicContact CE2-CE2 3.49Å; F282-F308 VanDerWaalsContact CE2-CE2 3.49Å; F282-F308 HydrophobicContact CE2-CZ 4.24Å
283Y89.4Confident82.8Confident6 Ų648.3 Ų48.32%0.02428%0.28CS..Hα-helixtrans-69.3-31.5175-78.2-30.7000113.8N219 Q279 V281 A286 R287 Y302 D306N219-Y283 HydrophobicContact CB-CD2 4.07Å; N219-Y283 HydrophobicContact CB-CE2 3.73Å; N219-Y283 WeakPolarHBondContact ND2-CE2 3.42Å; Q279-Y283 VanDerWaalsContact CD-CE2 3.42Å; Q279-Y283 HydrophobicContact CG-CD2 3.54Å; Q279-Y283 HydrophobicContact CG-CE2 3.43Å; Q279-Y283 VanDerWaalsContact CG-CE2 3.43Å; Q279-Y283 HydrophobicContact CG-CG 4.47Å; Q279-Y283 VanDerWaalsContact NE2-CE2 3.26Å; Q279-Y283 PolarHBondContact NE2-OH 3.42Å; Q279-Y283 PolarHBondContact O-N 2.99Å; V281-Y283 PolarHBondContact O-N 3.42Å; Y283-A286 PolarHBondContact O-N 3.44Å; Y283-R287 WeakPolarHBondContact O-CB 3.21Å; Y283-R287 WeakPolarHBondContact O-CG 3.47Å; Y283-R287 PolarHBondContact O-N 2.69Å; Y283-R287 VanDerWaalsContact O-N 3.09Å; Y283-Y302 AromaticContact CD1-CD1 3.94Å; Y283-Y302 HydrophobicContact CD1-CD1 3.94Å; Y283-Y302 HydrophobicContact CD1-CE1 4.38Å; Y283-Y302 AromaticContact CE1-CD1 3.97Å; Y283-Y302 HydrophobicContact CE1-CD1 3.97Å; Y283-D306 PolarHBondContact OH-OD1 2.94Å
284S86.4Confident80.3Confident28 Ų2855.3 Ų55.320%0.19632%0.317CS..Hα-helixtrans-66.5-46.2173.3-60.70000109.9A280 V281 F282 A286 R287 F288A280-S284 WeakPolarHBondContact O-CB 3.5Å; A280-S284 PolarHBondContact O-N 3.19Å; A280-S284 PolarHBondContact O-OG 3.35Å; V281-S284 PolarHBondContact O-N 3.07Å; F282-S284 VanDerWaalsContact C-N 3.34Å; F282-S284 PolarHBondContact O-N 3.39Å; S284-A286 VanDerWaalsContact C-N 3.33Å; S284-A286 PolarHBondContact O-N 3.16Å; S284-R287 PolarHBondContact O-N 3.31Å; S284-F288 WeakPolarHBondContact O-CB 3.36Å; S284-F288 WeakPolarHBondContact O-CD2 3.45Å; S284-F288 PolarHBondContact O-N 2.77Å
285L86.4Confident77.7Confident89 Ų8956.1 Ų56.147%0.46632%0.317SS..Hα-helixtrans-57.5-46.4173-67.8172.5000111.2V281 F282 R287 S289V281-L285 HydrophobicContact CG1-CD1 4.06Å; V281-L285 WeakPolarHBondContact O-CG 3.4Å; V281-L285 PolarHBondContact O-N 2.75Å; F282-L285 PolarHBondContact O-N 3.36Å; L285-R287 VanDerWaalsContact C-N 3.27Å; L285-R287 PolarHBondContact O-N 3.48Å; L285-S289 WeakPolarHBondContact O-CA 3.27Å; L285-S289 WeakPolarHBondContact O-CB 3.41Å; L285-S289 PolarHBondContact O-N 3.3Å
286A83.9Confident75.4Confident3 Ų362.5 Ų62.53%0.02534%0.344CS..Hα-helixtrans-63.6-28.1-178.300000114.6F282 Y283 S284 D301 Y302F282-A286 VanDerWaalsContact O-CB 3.29Å; F282-A286 WeakPolarHBondContact O-CB 3.31Å; F282-A286 PolarHBondContact O-N 3.05Å; Y283-A286 PolarHBondContact O-N 3.44Å; S284-A286 VanDerWaalsContact C-N 3.33Å; S284-A286 PolarHBondContact O-N 3.16Å; A286-D301 HydrophobicContact CB-CB 3.55Å; A286-Y302 HydrophobicContact CB-CD1 4.1Å; A286-Y302 HydrophobicContact CB-CD2 3.73Å; A286-Y302 HydrophobicContact CB-CE1 3.92Å; A286-Y302 HydrophobicContact CB-CE2 3.5Å; A286-Y302 VanDerWaalsContact CB-CE2 3.5Å; A286-Y302 HydrophobicContact CB-CG 4.01Å; A286-Y302 PolarHBondContact O-OH 2.7Å
287R83Confident73.3Confident13 Ų1367.3 Ų67.35%0.04937%0.367CS..Hα-helixtrans-102.5-29.9-175.3-71.1172.3178.2134.26.6113.7T215 Y283 S284 L285 S290 Y302T215-R287 VanDerWaalsContact CG2-NH1 3.28Å; T215-R287 WeakPolarHBondContact OG1-CD 3.13Å; T215-R287 VanDerWaalsContact OG1-CZ 3.3Å; T215-R287 PolarHBondContact OG1-NE 3.13Å; T215-R287 PolarHBondContact OG1-NH1 2.8Å; Y283-R287 WeakPolarHBondContact O-CB 3.21Å; Y283-R287 WeakPolarHBondContact O-CG 3.47Å; Y283-R287 PolarHBondContact O-N 2.69Å; Y283-R287 VanDerWaalsContact O-N 3.09Å; S284-R287 PolarHBondContact O-N 3.31Å; L285-R287 VanDerWaalsContact C-N 3.27Å; L285-R287 PolarHBondContact O-N 3.48Å; R287-S290 PolarHBondContact O-OG 3.28Å; R287-Y302 HydrophobicContact CG-CE1 4.24Å; R287-Y302 WeakPolarHBondContact CG-OH 3.45Å
288F77Confident71.4Confident116 Ų11665.7 Ų65.751%0.50936%0.36SS..Hα-helixtrans-93.8-24.2177.2-63.8-63.1000112.3S284 S290 T291S284-F288 WeakPolarHBondContact O-CB 3.36Å; S284-F288 WeakPolarHBondContact O-CD2 3.45Å; S284-F288 PolarHBondContact O-N 2.77Å; F288-S290 PolarHBondContact O-N 2.78Å; F288-T291 PolarHBondContact O-N 2.86Å; F288-T291 PolarHBondContact O-OG1 2.73Å
289S71.5Confident70.4Confident24 Ų2464.9 Ų64.917%0.16836%0.359CS..G310 helixtrans-70.1-24.5172.8-164.80000112.3L285 T291 D292 F295L285-S289 WeakPolarHBondContact O-CA 3.27Å; L285-S289 WeakPolarHBondContact O-CB 3.41Å; L285-S289 PolarHBondContact O-N 3.3Å; S289-T291 PolarHBondContact O-N 3.28Å; S289-T291 VanDerWaalsContact O-N 3.12Å; S289-D292 PolarHBondContact O-N 3.08Å; S289-D292 VanDerWaalsContact O-N 3.16Å; S289-F295 WeakPolarHBondContact OG-CD1 3.46Å; S289-F295 WeakPolarHBondContact OG-CE1 3.47Å; S289-F295 WeakPolarHBondContact OG-CG 3.28Å
290S59.2Low69.8Low49 Ų4965.6 Ų65.634%0.34336%0.363SS..G310 helixtrans-67.1-6.3175.546.70000115R287 F288R287-S290 PolarHBondContact O-OG 3.28Å; F288-S290 PolarHBondContact O-N 2.78Å
291T55.3Low69.5Low76 Ų7667 Ų6747%0.46637%0.37SS..G310 helixtrans-78.1-24171.2490000113F288 S289 A293F288-T291 PolarHBondContact O-N 2.86Å; F288-T291 PolarHBondContact O-OG1 2.73Å; S289-T291 PolarHBondContact O-N 3.28Å; S289-T291 VanDerWaalsContact O-N 3.12Å; T291-A293 PolarHBondContact O-N 3.16Å
292D52.8Low69.3Low106 Ų10665.1 Ų65.157%0.56735%0.354SS*.SBendtrans-83.5115.3179-82.5-22.6000109.9S289 N294 F295S289-D292 PolarHBondContact O-N 3.08Å; S289-D292 VanDerWaalsContact O-N 3.16Å; D292-N294 PolarHBondContact O-N 2.92Å; D292-F295 HydrophobicContact CB-CB 4.3Å; D292-F295 PolarHBondContact O-N 3.46Å
293A49.2Very low69.1Low109 Ų10963.8 Ų63.890%0.90135%0.349SS*.THydrogen-bonded Turntrans-55.1-18.8177.200000113.8T291T291-A293 PolarHBondContact O-N 3.16Å
294N44.9Very low69.2Low161 Ų16165.7 Ų65.786%0.86136%0.36SS*.THydrogen-bonded Turntrans-91.3-14.1179.7-69.3-19.6000114D292 K296D292-N294 PolarHBondContact O-N 2.92Å; N294-K296 PolarHBondContact O-N 2.92Å
295F42.6Very low69.5Low113 Ų11364.4 Ų64.450%0.49635%0.35SS..  trans-90.3102.4-178.2-145.9-91.5000110.1S289 D292 Q297S289-F295 WeakPolarHBondContact OG-CD1 3.46Å; S289-F295 WeakPolarHBondContact OG-CE1 3.47Å; S289-F295 WeakPolarHBondContact OG-CG 3.28Å; D292-F295 HydrophobicContact CB-CB 4.3Å; D292-F295 PolarHBondContact O-N 3.46Å; F295-Q297 PolarHBondContact O-N 3.4Å
296K46.6Very low69.8Low159 Ų15960.5 Ų60.569%0.69133%0.33SS*.  trans-62.3103.7171.6-71.7-177.9-179.8177.10108.6N294 T298N294-K296 PolarHBondContact O-N 2.92Å; K296-T298 VanDerWaalsContact O-CG2 3.28Å; K296-T298 WeakPolarHBondContact O-CG2 3.48Å; K296-T298 PolarHBondContact O-N 2.86Å
297Q50.6Low70.2Confident103 Ų10362.5 Ų62.548%0.48134%0.338SS..  trans-57.5109.6175.5-174.7179.1-7.300109.5F295 Y302F295-Q297 PolarHBondContact O-N 3.4Å; Q297-Y302 VanDerWaalsContact NE2-CE2 3.31Å
298T56.3Low70.8Confident37 Ų3763.7 Ų63.723%0.22734%0.344CS..  trans-85-12.4-174.262.10000113.6E29 K296 V300E29-T298 HydrophobicContact CG-CG2 4.15Å; E29-T298 WeakPolarHBondContact OE1-CG2 3.34Å; K296-T298 VanDerWaalsContact O-CG2 3.28Å; K296-T298 WeakPolarHBondContact O-CG2 3.48Å; K296-T298 PolarHBondContact O-N 2.86Å; T298-V300 PolarHBondContact O-N 3.15Å; T298-V300 VanDerWaalsContact O-N 3.12Å; T298-V300 WeakPolarHBondContact OG1-CB 3.37Å; T298-V300 WeakPolarHBondContact OG1-CG2 3.49Å; T298-V300 PolarHBondContact OG1-N 3.33Å
299G72.9Confident71.6Confident27 Ų2758.2 Ų58.228%0.27832%0.32SS..SBendtrans72.2-13-169.600000113.7D301 Y302 D303G299-D301 VanDerWaalsContact C-N 3.34Å; G299-D301 PolarHBondContact O-N 3.41Å; G299-Y302 PolarHBondContact O-N 3.33Å; G299-D303 PolarHBondContact O-N 3.5Å; G299-D303 VanDerWaalsContact O-N 3.13Å
300V82.6Confident72.7Confident14 Ų1457 Ų579%0.08531%0.312CS..Hα-helixtrans-62.9-39.8-177.31750000111.4V32 R33 V36 T298 Y302 D303 I304V32-V300 HydrophobicContact CG1-CG1 4.42Å; R33-V300 HydrophobicContact CG-CG2 3.77Å; V36-V300 HydrophobicContact CG1-CG1 4.42Å; V36-V300 HydrophobicContact CG2-CG1 4.09Å; T298-V300 PolarHBondContact O-N 3.15Å; T298-V300 VanDerWaalsContact O-N 3.12Å; T298-V300 WeakPolarHBondContact OG1-CB 3.37Å; T298-V300 WeakPolarHBondContact OG1-CG2 3.49Å; T298-V300 PolarHBondContact OG1-N 3.33Å; V300-Y302 VanDerWaalsContact C-N 3.3Å; V300-Y302 PolarHBondContact O-N 2.74Å; V300-D303 WeakPolarHBondContact O-CB 3.31Å; V300-D303 PolarHBondContact O-N 3.13Å; V300-D303 VanDerWaalsContact O-N 3.12Å; V300-I304 HydrophobicContact CG1-CD1 3.7Å; V300-I304 HydrophobicContact CG1-CG1 4.2Å; V300-I304 WeakPolarHBondContact O-CG1 3.36Å; V300-I304 PolarHBondContact O-N 2.86Å
301D86Confident74.4Confident35 Ų3557.1 Ų57.119%0.18731%0.308CS..Hα-helixtrans-64-36.2179.2-59.1-44.8000112.3A286 G299 G305A286-D301 HydrophobicContact CB-CB 3.55Å; G299-D301 VanDerWaalsContact C-N 3.34Å; G299-D301 PolarHBondContact O-N 3.41Å; D301-G305 PolarHBondContact O-N 3.3Å
302Y87.1Confident76.3Confident45 Ų4553.5 Ų53.518%0.17629%0.286CS..Hα-helixtrans-66.8-41.6172.9-74-77.4000111.3Y283 A286 R287 Q297 G299 V300 G305 D306Y283-Y302 AromaticContact CD1-CD1 3.94Å; Y283-Y302 HydrophobicContact CD1-CD1 3.94Å; Y283-Y302 HydrophobicContact CD1-CE1 4.38Å; Y283-Y302 AromaticContact CE1-CD1 3.97Å; Y283-Y302 HydrophobicContact CE1-CD1 3.97Å; A286-Y302 HydrophobicContact CB-CD1 4.1Å; A286-Y302 HydrophobicContact CB-CD2 3.73Å; A286-Y302 HydrophobicContact CB-CE1 3.92Å; A286-Y302 HydrophobicContact CB-CE2 3.5Å; A286-Y302 VanDerWaalsContact CB-CE2 3.5Å; A286-Y302 HydrophobicContact CB-CG 4.01Å; A286-Y302 PolarHBondContact O-OH 2.7Å; R287-Y302 HydrophobicContact CG-CE1 4.24Å; R287-Y302 WeakPolarHBondContact CG-OH 3.45Å; Q297-Y302 VanDerWaalsContact NE2-CE2 3.31Å; G299-Y302 PolarHBondContact O-N 3.33Å; V300-Y302 VanDerWaalsContact C-N 3.3Å; V300-Y302 PolarHBondContact O-N 2.74Å; Y302-G305 PolarHBondContact O-N 3.41Å; Y302-D306 WeakPolarHBondContact O-CB 3.5Å; Y302-D306 PolarHBondContact O-N 2.99Å
303D88.5Confident78.2Confident26 Ų2648.5 Ų48.514%0.13926%0.259CS..Hα-helixtrans-65.1-39.3178.5-72.7-20.9000112.3V36 V40 R103 G299 V300 F307V36-D303 HydrophobicContact CG1-CB 3.62Å; V40-D303 HydrophobicContact CG2-CB 4.38Å; R103-D303 IonicContact CZ-OD1 3.66Å; R103-D303 IonicContact NH1-OD1 3.19Å; R103-D303 PolarHBondContact NH1-OD1 3.15Å; R103-D303 IonicContact NH1-OD2 2.69Å; R103-D303 IonicContact NH2-OD1 3.57Å; R103-D303 PolarHBondContact NH2-OD1 3.19Å; G299-D303 PolarHBondContact O-N 3.5Å; G299-D303 VanDerWaalsContact O-N 3.13Å; V300-D303 WeakPolarHBondContact O-CB 3.31Å; V300-D303 PolarHBondContact O-N 3.13Å; V300-D303 VanDerWaalsContact O-N 3.12Å; D303-F307 WeakPolarHBondContact O-CB 3.16Å; D303-F307 PolarHBondContact O-N 3.35Å
304I90.6Very high80.3Confident47 Ų4745.6 Ų45.624%0.24123%0.228CC..Hα-helixtrans-69.5-41.1174.1-62.5168.9000110.4F282 V300 D306 F307 F308F282-I304 HydrophobicContact CD1-CB 3.99Å; F282-I304 HydrophobicContact CD1-CD1 4.35Å; F282-I304 HydrophobicContact CD1-CG2 3.68Å; F282-I304 HydrophobicContact CD2-CG2 3.6Å; F282-I304 HydrophobicContact CE1-CB 4.25Å; F282-I304 HydrophobicContact CE1-CD1 4Å; F282-I304 HydrophobicContact CE1-CG2 3.66Å; F282-I304 HydrophobicContact CE2-CG2 3.6Å; F282-I304 HydrophobicContact CG-CB 4.17Å; F282-I304 HydrophobicContact CG-CG2 3.66Å; F282-I304 HydrophobicContact CZ-CG2 3.62Å; V300-I304 HydrophobicContact CG1-CD1 3.7Å; V300-I304 HydrophobicContact CG1-CG1 4.2Å; V300-I304 WeakPolarHBondContact O-CG1 3.36Å; V300-I304 PolarHBondContact O-N 2.86Å; I304-D306 PolarHBondContact O-N 2.91Å; I304-F307 WeakPolarHBondContact O-CA 3.34Å; I304-F307 VanDerWaalsContact O-CB 3.27Å; I304-F307 WeakPolarHBondContact O-CB 3.39Å; I304-F307 PolarHBondContact O-N 3.36Å; I304-F307 VanDerWaalsContact O-N 3.1Å; I304-F308 HydrophobicContact CG2-CD2 4.25Å; I304-F308 HydrophobicContact CG2-CE2 3.88Å; I304-F308 VanDerWaalsContact O-CD2 3.3Å; I304-F308 WeakPolarHBondContact O-CD2 3.38Å; I304-F308 PolarHBondContact O-N 3.33Å
305G92.2Very high82.7Confident0 Ų038.9 Ų38.90%019%0.191CC..Hα-helixtrans-58.5-44.9173.300000112.5Q279 D301 Y302 F307 F308Q279-G305 WeakPolarHBondContact CG-O 3.21Å; Q279-G305 PolarHBondContact NE2-O 2.63Å; D301-G305 PolarHBondContact O-N 3.3Å; Y302-G305 PolarHBondContact O-N 3.41Å; G305-F307 VanDerWaalsContact C-N 3.28Å; G305-F307 PolarHBondContact O-N 3.33Å; G305-F308 PolarHBondContact O-N 3.12Å
306D92.1Very high85.3Confident7 Ų733.6 Ų33.64%0.03717%0.167CC..Hα-helixtrans-62.4-37173.3-74.50000111F94 Q99 R103 Y283 Y302 I304 F308 W309 Y310F94-D306 HydrophobicContact CZ-CB 4.12Å; Q99-D306 PolarHBondContact NE2-OD2 2.9Å; R103-D306 IonicContact NH2-OD2 3.28Å; Y283-D306 PolarHBondContact OH-OD1 2.94Å; Y302-D306 WeakPolarHBondContact O-CB 3.5Å; Y302-D306 PolarHBondContact O-N 2.99Å; I304-D306 PolarHBondContact O-N 2.91Å; D306-F308 VanDerWaalsContact C-N 3.3Å; D306-F308 PolarHBondContact O-N 2.85Å; D306-W309 WeakPolarHBondContact O-CA 3.35Å; D306-W309 VanDerWaalsContact O-CB 3.22Å; D306-W309 WeakPolarHBondContact O-CB 3.32Å; D306-W309 PolarHBondContact O-N 3.01Å; D306-Y310 HydrophobicContact CB-CE2 4.41Å; D306-Y310 WeakPolarHBondContact O-CD1 3.46Å; D306-Y310 PolarHBondContact O-N 3.41Å; D306-Y310 VanDerWaalsContact O-N 3.14Å
307F93.3Very high87.6Confident46 Ų4628.2 Ų28.220%0.20215%0.146CC..Hα-helixtrans-59.7-37.6176.9-168.9-100.2000113.2V40 W43 D303 I304 G305 W309 Y310 L311V40-F307 HydrophobicContact CG2-CD2 4.48Å; W43-F307 AromaticContact CD1-CE2 3.88Å; W43-F307 AromaticContact CD2-CE2 3.79Å; W43-F307 HydrophobicContact CD2-CE2 3.79Å; W43-F307 HydrophobicContact CD2-CZ 4.3Å; W43-F307 AromaticContact CE2-CE2 3.8Å; W43-F307 AromaticContact CE2-CZ 3.91Å; W43-F307 HydrophobicContact CE3-CE2 4.36Å; W43-F307 AromaticContact CG-CE2 3.85Å; W43-F307 HydrophobicContact CG-CE2 3.85Å; W43-F307 HydrophobicContact CZ2-CE2 4.41Å; W43-F307 HydrophobicContact CZ2-CZ 4.09Å; W43-F307 AromaticContact NE1-CE2 3.83Å; D303-F307 WeakPolarHBondContact O-CB 3.16Å; D303-F307 PolarHBondContact O-N 3.35Å; I304-F307 WeakPolarHBondContact O-CA 3.34Å; I304-F307 VanDerWaalsContact O-CB 3.27Å; I304-F307 WeakPolarHBondContact O-CB 3.39Å; I304-F307 PolarHBondContact O-N 3.36Å; I304-F307 VanDerWaalsContact O-N 3.1Å; G305-F307 VanDerWaalsContact C-N 3.28Å; G305-F307 PolarHBondContact O-N 3.33Å; F307-W309 VanDerWaalsContact C-N 3.27Å; F307-W309 PolarHBondContact O-N 2.73Å; F307-Y310 VanDerWaalsContact CA-CD2 3.47Å; F307-Y310 HydrophobicContact CB-CD2 4.29Å; F307-Y310 AromaticContact CD2-CD2 3.84Å; F307-Y310 HydrophobicContact CD2-CD2 3.84Å; F307-Y310 HydrophobicContact CD2-CE2 4.47Å; F307-Y310 HydrophobicContact CG-CD2 4.39Å; F307-Y310 VanDerWaalsContact O-CB 3.3Å; F307-Y310 WeakPolarHBondContact O-CB 3.09Å; F307-Y310 PolarHBondContact O-N 3.17Å; F307-Y310 VanDerWaalsContact O-N 3.11Å; F307-L311 HydrophobicContact CD1-CD1 3.89Å; F307-L311 HydrophobicContact CD1-CG 4.12Å; F307-L311 HydrophobicContact CE1-CD1 3.64Å; F307-L311 HydrophobicContact CE1-CD2 4.15Å; F307-L311 HydrophobicContact CE1-CG 3.83Å; F307-L311 HydrophobicContact CZ-CD2 4.33Å; F307-L311 HydrophobicContact CZ-CG 4.37Å; F307-L311 PolarHBondContact O-N 3.27Å
308F94.9Very high89.7Confident37 Ų3726.5 Ų26.516%0.16214%0.14CC..Hα-helixtrans-67.4-27.5173.5-78.6-76.8000113.1M275 C278 Q279 F282 I304 G305 D306 L311 N312M275-F308 HydrophobicContact CE-CB 4.48Å; M275-F308 HydrophobicContact CE-CD1 3.65Å; M275-F308 HydrophobicContact CE-CE1 4.43Å; M275-F308 WeakPolarHBondContact CE-O 3.05Å; C278-F308 HydrophobicContact CB-CD1 3.44Å; C278-F308 VanDerWaalsContact CB-CD1 3.44Å; C278-F308 HydrophobicContact CB-CD2 4.03Å; C278-F308 HydrophobicContact CB-CE1 3.27Å; C278-F308 HydrophobicContact CB-CE2 3.88Å; C278-F308 HydrophobicContact CB-CG 3.84Å; C278-F308 HydrophobicContact CB-CZ 3.52Å; Q279-F308 HydrophobicContact CB-CB 3.77Å; Q279-F308 HydrophobicContact CG-CB 4.48Å; F282-F308 AromaticContact CD2-CD2 3.97Å; F282-F308 HydrophobicContact CD2-CD2 3.97Å; F282-F308 AromaticContact CD2-CE2 3.6Å; F282-F308 HydrophobicContact CD2-CE2 3.6Å; F282-F308 HydrophobicContact CE2-CD2 4.32Å; F282-F308 AromaticContact CE2-CE2 3.49Å; F282-F308 HydrophobicContact CE2-CE2 3.49Å; F282-F308 VanDerWaalsContact CE2-CE2 3.49Å; F282-F308 HydrophobicContact CE2-CZ 4.24Å; I304-F308 HydrophobicContact CG2-CD2 4.25Å; I304-F308 HydrophobicContact CG2-CE2 3.88Å; I304-F308 VanDerWaalsContact O-CD2 3.3Å; I304-F308 WeakPolarHBondContact O-CD2 3.38Å; I304-F308 PolarHBondContact O-N 3.33Å; G305-F308 PolarHBondContact O-N 3.12Å; D306-F308 VanDerWaalsContact C-N 3.3Å; D306-F308 PolarHBondContact O-N 2.85Å; F308-L311 HydrophobicContact CD1-CD1 4.23Å; F308-L311 HydrophobicContact CE1-CD1 4.33Å; F308-N312 VanDerWaalsContact O-CB 3.29Å; F308-N312 WeakPolarHBondContact O-CB 3.24Å; F308-N312 PolarHBondContact O-N 3.48Å
309W93.9Very high91.5Very high1 Ų125 Ų250%0.00413%0.13CC..Hα-helixtrans-65.6-41.8168.9-168.5-78.2000111.3A90 N91 F94 Y132 M139 L220 D306 F307 L311 N312 S313A90-W309 HydrophobicContact CB-CH2 4.22Å; A90-W309 HydrophobicContact CB-CZ2 3.8Å; N91-W309 PolarHBondContact OD1-NE1 3.09Å; F94-W309 HydrophobicContact CD1-CB 4.44Å; F94-W309 AromaticContact CD1-CD1 3.11Å; F94-W309 HydrophobicContact CD1-CD2 4.32Å; F94-W309 AromaticContact CD1-CG 3.72Å; F94-W309 HydrophobicContact CD1-CG 3.72Å; F94-W309 AromaticContact CD1-NE1 3.37Å; F94-W309 HydrophobicContact CE1-CB 3.69Å; F94-W309 AromaticContact CE1-CD1 3.19Å; F94-W309 HydrophobicContact CE1-CD2 4.35Å; F94-W309 AromaticContact CE1-CG 3.44Å; F94-W309 HydrophobicContact CE1-CG 3.44Å; F94-W309 VanDerWaalsContact CE1-CG 3.44Å; F94-W309 AromaticContact CE1-NE1 3.93Å; F94-W309 AromaticContact CG-NE1 3.99Å; F94-W309 HydrophobicContact CZ-CB 4.08Å; F94-W309 HydrophobicContact CZ-CG 4.09Å; Y132-W309 AromaticContact CE2-CH2 3.87Å; Y132-W309 HydrophobicContact CE2-CH2 3.87Å; Y132-W309 AromaticContact CE2-CZ2 3.76Å; Y132-W309 HydrophobicContact CE2-CZ2 3.76Å; Y132-W309 HydrophobicContact CE2-CZ3 4.33Å; M139-W309 HydrophobicContact CE-CH2 4.09Å; L220-W309 HydrophobicContact CD1-CE3 4.44Å; L220-W309 HydrophobicContact CD2-CE3 3.93Å; L220-W309 HydrophobicContact CD2-CH2 4.29Å; L220-W309 HydrophobicContact CD2-CZ3 3.63Å; L220-W309 HydrophobicContact CG-CE3 3.81Å; L220-W309 HydrophobicContact CG-CZ3 3.77Å; D306-W309 WeakPolarHBondContact O-CA 3.35Å; D306-W309 VanDerWaalsContact O-CB 3.22Å; D306-W309 WeakPolarHBondContact O-CB 3.32Å; D306-W309 PolarHBondContact O-N 3.01Å; F307-W309 VanDerWaalsContact C-N 3.27Å; F307-W309 PolarHBondContact O-N 2.73Å; W309-L311 PolarHBondContact O-N 3.01Å; W309-N312 WeakPolarHBondContact O-CA 3.39Å; W309-N312 WeakPolarHBondContact O-CB 3.19Å; W309-N312 PolarHBondContact O-N 2.84Å; W309-N312 VanDerWaalsContact O-N 3.11Å; W309-S313 PolarHBondContact O-N 3.32Å; W309-S313 PolarHBondContact O-OG 3.48Å
310Y94.7Very high92.5Very high0 Ų025 Ų250%012%0.123CC..Hα-helixtrans-60.1-46.9177.8-54.9-25000112.1V40 C44 L48 F94 Q99 D306 F307 N312 S313 I314V40-Y310 HydrophobicContact CG1-CE2 3.76Å; C44-Y310 VanDerWaalsContact SG-CZ 3.59Å; C44-Y310 PolarHBondContact SG-OH 2.97Å; L48-Y310 HydrophobicContact CD1-CD1 3.18Å; L48-Y310 HydrophobicContact CD1-CD2 3.96Å; L48-Y310 HydrophobicContact CD1-CE1 3.62Å; L48-Y310 HydrophobicContact CD1-CE2 4.42Å; L48-Y310 HydrophobicContact CD1-CG 3.39Å; L48-Y310 HydrophobicContact CD2-CD1 4.32Å; L48-Y310 HydrophobicContact CD2-CG 4.21Å; L48-Y310 HydrophobicContact CG-CD1 4.31Å; L48-Y310 HydrophobicContact CG-CG 4.21Å; F94-Y310 HydrophobicContact CD1-CE1 4.39Å; F94-Y310 AromaticContact CE1-CD1 3.86Å; F94-Y310 HydrophobicContact CE1-CD1 3.86Å; F94-Y310 AromaticContact CE1-CE1 3.42Å; F94-Y310 HydrophobicContact CE1-CE1 3.42Å; F94-Y310 VanDerWaalsContact CE1-CE1 3.42Å; F94-Y310 AromaticContact CZ-CE1 3.95Å; F94-Y310 HydrophobicContact CZ-CE1 3.95Å; Q99-Y310 HydrophobicContact CB-CE1 4.26Å; Q99-Y310 HydrophobicContact CG-CE1 4Å; Q99-Y310 PolarHBondContact OE1-OH 2.76Å; Q99-Y310 VanDerWaalsContact OE1-OH 3.08Å; D306-Y310 HydrophobicContact CB-CE2 4.41Å; D306-Y310 WeakPolarHBondContact O-CD1 3.46Å; D306-Y310 PolarHBondContact O-N 3.41Å; D306-Y310 VanDerWaalsContact O-N 3.14Å; F307-Y310 VanDerWaalsContact CA-CD2 3.47Å; F307-Y310 HydrophobicContact CB-CD2 4.29Å; F307-Y310 AromaticContact CD2-CD2 3.84Å; F307-Y310 HydrophobicContact CD2-CD2 3.84Å; F307-Y310 HydrophobicContact CD2-CE2 4.47Å; F307-Y310 HydrophobicContact CG-CD2 4.39Å; F307-Y310 VanDerWaalsContact O-CB 3.3Å; F307-Y310 WeakPolarHBondContact O-CB 3.09Å; F307-Y310 PolarHBondContact O-N 3.17Å; F307-Y310 VanDerWaalsContact O-N 3.11Å; Y310-N312 VanDerWaalsContact C-N 3.29Å; Y310-N312 PolarHBondContact O-N 3.17Å; Y310-S313 WeakPolarHBondContact O-CB 3.45Å; Y310-S313 PolarHBondContact O-N 2.97Å; Y310-I314 PolarHBondContact O-N 2.99Å
311L95.4Very high93Very high51 Ų5130.2 Ų30.227%0.26714%0.142SC..Hα-helixtrans-64.6-35.7174.9-68.8179.4000111.6W43 M275 F307 F308 W309 S313 I314 R315W43-L311 HydrophobicContact CH2-CD2 3.79Å; W43-L311 HydrophobicContact CZ3-CD2 4.18Å; M275-L311 HydrophobicContact CE-CB 3.06Å; M275-L311 HydrophobicContact CE-CD1 3.81Å; M275-L311 HydrophobicContact CE-CG 4.09Å; M275-L311 HydrophobicContact SD-CB 4.49Å; F307-L311 HydrophobicContact CD1-CD1 3.89Å; F307-L311 HydrophobicContact CD1-CG 4.12Å; F307-L311 HydrophobicContact CE1-CD1 3.64Å; F307-L311 HydrophobicContact CE1-CD2 4.15Å; F307-L311 HydrophobicContact CE1-CG 3.83Å; F307-L311 HydrophobicContact CZ-CD2 4.33Å; F307-L311 HydrophobicContact CZ-CG 4.37Å; F307-L311 PolarHBondContact O-N 3.27Å; F308-L311 HydrophobicContact CD1-CD1 4.23Å; F308-L311 HydrophobicContact CE1-CD1 4.33Å; W309-L311 PolarHBondContact O-N 3.01Å; L311-S313 VanDerWaalsContact C-N 3.3Å; L311-S313 PolarHBondContact O-N 3.44Å; L311-I314 PolarHBondContact O-N 3.04Å; L311-R315 WeakPolarHBondContact O-CB 3.36Å; L311-R315 PolarHBondContact O-N 3.48Å
312N95Very high93.4Very high0 Ų028.7 Ų28.70%013%0.134CC..Hα-helixtrans-60.7-38.9174177.163.8000111.8L220 M275 F308 W309 Y310 I314 R315 E316L220-N312 HydrophobicContact CD1-CB 4.21Å; M275-N312 HydrophobicContact CB-CB 4.22Å; M275-N312 HydrophobicContact CG-CB 4.47Å; F308-N312 VanDerWaalsContact O-CB 3.29Å; F308-N312 WeakPolarHBondContact O-CB 3.24Å; F308-N312 PolarHBondContact O-N 3.48Å; W309-N312 WeakPolarHBondContact O-CA 3.39Å; W309-N312 WeakPolarHBondContact O-CB 3.19Å; W309-N312 PolarHBondContact O-N 2.84Å; W309-N312 VanDerWaalsContact O-N 3.11Å; Y310-N312 VanDerWaalsContact C-N 3.29Å; Y310-N312 PolarHBondContact O-N 3.17Å; N312-I314 VanDerWaalsContact C-N 3.35Å; N312-I314 PolarHBondContact O-N 2.88Å; N312-R315 VanDerWaalsContact CG-NH2 3.34Å; N312-R315 PolarHBondContact ND2-NH2 2.88Å; N312-R315 WeakPolarHBondContact O-CB 3.43Å; N312-R315 PolarHBondContact O-N 3.44Å; N312-R315 PolarHBondContact O-NE 2.68Å; N312-R315 PolarHBondContact O-NH2 3.34Å; N312-R315 VanDerWaalsContact OD1-CZ 3.26Å; N312-R315 PolarHBondContact OD1-NE 3.31Å; N312-R315 PolarHBondContact OD1-NH2 3.36Å; N312-E316 PolarHBondContact O-N 3.23Å; N312-E316 VanDerWaalsContact O-N 3.12Å
313S92.6Very high93.6Very high1 Ų126.8 Ų26.81%0.00713%0.127CC..Hα-helixtrans-66.4-34.9175.7-53.80000112.4N91 I95 W309 Y310 L311 E316N91-S313 PolarHBondContact OD1-OG 3.4Å; I95-S313 WeakPolarHBondContact CD1-OG 3.29Å; W309-S313 PolarHBondContact O-N 3.32Å; W309-S313 PolarHBondContact O-OG 3.48Å; Y310-S313 WeakPolarHBondContact O-CB 3.45Å; Y310-S313 PolarHBondContact O-N 2.97Å; L311-S313 VanDerWaalsContact C-N 3.3Å; L311-S313 PolarHBondContact O-N 3.44Å; S313-E316 WeakPolarHBondContact O-CB 3.32Å; S313-E316 PolarHBondContact O-N 2.94Å
314I93.8Very high93.6Very high47 Ų4728.7 Ų28.724%0.24113%0.134CC..Hα-helixtrans-67.8-39.9170.7-64.9-173.9000110.8W43 V47 F51 Y310 L311 N312 E316 L317W43-I314 HydrophobicContact CH2-CD1 3.69Å; W43-I314 HydrophobicContact CZ3-CD1 3.4Å; W43-I314 VanDerWaalsContact CZ3-CD1 3.4Å; W43-I314 HydrophobicContact CZ3-CG1 4.47Å; V47-I314 HydrophobicContact CG1-CD1 4.25Å; F51-I314 HydrophobicContact CB-CG1 4.19Å; F51-I314 HydrophobicContact CD2-CD1 3.85Å; F51-I314 HydrophobicContact CD2-CG1 4.06Å; F51-I314 HydrophobicContact CE2-CD1 4.17Å; F51-I314 HydrophobicContact CG-CD1 4.47Å; F51-I314 HydrophobicContact CG-CG1 4.22Å; Y310-I314 PolarHBondContact O-N 2.99Å; L311-I314 PolarHBondContact O-N 3.04Å; N312-I314 VanDerWaalsContact C-N 3.35Å; N312-I314 PolarHBondContact O-N 2.88Å; I314-E316 PolarHBondContact O-N 3.41Å; I314-E316 VanDerWaalsContact O-N 3.17Å; I314-L317 HydrophobicContact CG2-CD1 4.27Å; I314-L317 VanDerWaalsContact O-CB 3.25Å; I314-L317 WeakPolarHBondContact O-CB 3.14Å; I314-L317 WeakPolarHBondContact O-CG 3.24Å; I314-L317 PolarHBondContact O-N 2.96Å
315R95.7Very high93.5Very high21 Ų2131.7 Ų31.78%0.07915%0.145CC..Hα-helixtrans-58-26.3175.5176-73.6-37.3150.92.7112S271 M275 L311 N312 L317 L318 D319S271-R315 WeakPolarHBondContact OG-CD 3.35Å; S271-R315 WeakPolarHBondContact OG-CG 3.35Å; M275-R315 HydrophobicContact CG-CG 4.44Å; L311-R315 WeakPolarHBondContact O-CB 3.36Å; L311-R315 PolarHBondContact O-N 3.48Å; N312-R315 VanDerWaalsContact CG-NH2 3.34Å; N312-R315 PolarHBondContact ND2-NH2 2.88Å; N312-R315 WeakPolarHBondContact O-CB 3.43Å; N312-R315 PolarHBondContact O-N 3.44Å; N312-R315 PolarHBondContact O-NE 2.68Å; N312-R315 PolarHBondContact O-NH2 3.34Å; N312-R315 VanDerWaalsContact OD1-CZ 3.26Å; N312-R315 PolarHBondContact OD1-NE 3.31Å; N312-R315 PolarHBondContact OD1-NH2 3.36Å; R315-L317 PolarHBondContact O-N 3.5Å; R315-L318 VanDerWaalsContact O-CB 3.24Å; R315-L318 WeakPolarHBondContact O-CB 3.17Å; R315-L318 PolarHBondContact O-N 2.89Å; R315-D319 IonicContact CZ-OD2 3.84Å; R315-D319 IonicContact NH1-OD1 2.63Å; R315-D319 PolarHBondContact NH1-OD1 3Å; R315-D319 VanDerWaalsContact NH1-OD1 3.16Å; R315-D319 IonicContact NH1-OD2 2.7Å; R315-D319 PolarHBondContact NH1-OD2 3.31Å; R315-D319 PolarHBondContact O-N 3.43Å
316E96.2Very high93.3Very high2 Ų232.8 Ų32.81%0.00915%0.153CC..Hα-helixtrans-61.9-23.9172.3-64.7177.1-177.600114T55 N59 S87 N91 N312 S313 I314 L318 D319 I320T55-E316 HydrophobicContact CG2-CB 3.81Å; N59-E316 PolarHBondContact ND2-OE2 3.45Å; S87-E316 PolarHBondContact OG-OE1 2.91Å; S87-E316 PolarHBondContact OG-OE2 3.23Å; N91-E316 PolarHBondContact ND2-OE1 3.48Å; N91-E316 PolarHBondContact ND2-OE2 3.34Å; N312-E316 PolarHBondContact O-N 3.23Å; N312-E316 VanDerWaalsContact O-N 3.12Å; S313-E316 WeakPolarHBondContact O-CB 3.32Å; S313-E316 PolarHBondContact O-N 2.94Å; I314-E316 PolarHBondContact O-N 3.41Å; I314-E316 VanDerWaalsContact O-N 3.17Å; E316-L318 PolarHBondContact O-N 3.28Å; E316-D319 WeakPolarHBondContact O-CB 3.46Å; E316-D319 PolarHBondContact O-N 3.41Å; E316-D319 VanDerWaalsContact O-N 3.16Å; E316-I320 WeakPolarHBondContact O-CG1 3.17Å; E316-I320 PolarHBondContact O-N 3.12Å
317L95.2Very high92.9Very high46 Ų4633 Ų3324%0.24115%0.153CC..Hα-helixtrans-64.4-34.3172.8-61.6168.3000111.4F51 I54 T55 I314 R315 I320 Y321F51-L317 HydrophobicContact CB-CD1 4.35Å; F51-L317 HydrophobicContact CD1-CD1 3.42Å; F51-L317 VanDerWaalsContact CD1-CD1 3.42Å; F51-L317 HydrophobicContact CE1-CD1 3.99Å; F51-L317 HydrophobicContact CG-CD1 4.15Å; I54-L317 HydrophobicContact CB-CD2 4.45Å; I54-L317 HydrophobicContact CG2-CD2 3.96Å; T55-L317 HydrophobicContact CG2-CD2 3.5Å; T55-L317 HydrophobicContact CG2-CG 3.79Å; I314-L317 HydrophobicContact CG2-CD1 4.27Å; I314-L317 VanDerWaalsContact O-CB 3.25Å; I314-L317 WeakPolarHBondContact O-CB 3.14Å; I314-L317 WeakPolarHBondContact O-CG 3.24Å; I314-L317 PolarHBondContact O-N 2.96Å; R315-L317 PolarHBondContact O-N 3.5Å; L317-I320 HydrophobicContact CD2-CD1 4.48Å; L317-I320 PolarHBondContact O-N 3.48Å; L317-Y321 WeakPolarHBondContact O-CB 3.41Å; L317-Y321 PolarHBondContact O-N 3.26Å
318L95.4Very high92.4Very high67 Ų6737 Ų3735%0.35117%0.171SC..Hα-helixtrans-64.9-41.7172.7176.263.5000110.8R315 E316 Y321 I322R315-L318 VanDerWaalsContact O-CB 3.24Å; R315-L318 WeakPolarHBondContact O-CB 3.17Å; R315-L318 PolarHBondContact O-N 2.89Å; E316-L318 PolarHBondContact O-N 3.28Å; L318-Y321 WeakPolarHBondContact O-CB 3.41Å; L318-Y321 PolarHBondContact O-N 3.17Å; L318-I322 HydrophobicContact CD1-CD1 3.91Å; L318-I322 HydrophobicContact CD1-CG1 4.3Å; L318-I322 HydrophobicContact CD2-CD1 4.47Å; L318-I322 HydrophobicContact CG-CD1 3.78Å; L318-I322 WeakPolarHBondContact O-CB 3.47Å; L318-I322 VanDerWaalsContact O-CG1 3.29Å; L318-I322 WeakPolarHBondContact O-CG1 3.13Å; L318-I322 PolarHBondContact O-N 3.01Å
319D94.4Very high91.6Very high4 Ų438.8 Ų38.82%0.02118%0.181CC..Hα-helixtrans-60.4-48.6175.2-80.520.8000111.2S268 R315 E316 Y321 I322 Y323S268-D319 WeakPolarHBondContact CB-OD1 3.45Å; S268-D319 PolarHBondContact OG-OD1 3.31Å; S268-D319 PolarHBondContact OG-OD2 2.86Å; R315-D319 IonicContact CZ-OD2 3.84Å; R315-D319 IonicContact NH1-OD1 2.63Å; R315-D319 PolarHBondContact NH1-OD1 3Å; R315-D319 VanDerWaalsContact NH1-OD1 3.16Å; R315-D319 IonicContact NH1-OD2 2.7Å; R315-D319 PolarHBondContact NH1-OD2 3.31Å; R315-D319 PolarHBondContact O-N 3.43Å; E316-D319 WeakPolarHBondContact O-CB 3.46Å; E316-D319 PolarHBondContact O-N 3.41Å; E316-D319 VanDerWaalsContact O-N 3.16Å; D319-Y321 VanDerWaalsContact C-N 3.29Å; D319-Y321 PolarHBondContact O-N 3.07Å; D319-I322 CarbonylContact O-C 3.35Å; D319-I322 WeakPolarHBondContact O-CB 3.39Å; D319-I322 PolarHBondContact O-N 2.9Å; D319-I322 VanDerWaalsContact O-N 3.1Å; D319-Y323 HydrophobicContact CB-CD2 4.44Å; D319-Y323 HydrophobicContact CB-CE1 4.49Å; D319-Y323 HydrophobicContact CB-CE2 3.78Å; D319-Y323 WeakPolarHBondContact O-CB 3.38Å; D319-Y323 WeakPolarHBondContact O-CD1 3.46Å; D319-Y323 WeakPolarHBondContact O-CD2 3.49Å; D319-Y323 PolarHBondContact O-N 3.3Å; D319-Y323 PolarHBondContact OD2-OH 3.01Å; D319-Y323 VanDerWaalsContact OD2-OH 3.12Å
320I93.3Very high90.8Very high27 Ų2739.2 Ų39.214%0.13818%0.184CC..Hα-helixtrans-55.8-46.7176.8-71.5164.4000110.6T55 T58 E316 L317 I322 Y323 F324T55-I320 HydrophobicContact CG2-CD1 4.03Å; T58-I320 HydrophobicContact CG2-CB 4.45Å; T58-I320 HydrophobicContact CG2-CD1 3.88Å; T58-I320 HydrophobicContact CG2-CG1 3.89Å; T58-I320 HydrophobicContact CG2-CG2 3.72Å; E316-I320 WeakPolarHBondContact O-CG1 3.17Å; E316-I320 PolarHBondContact O-N 3.12Å; L317-I320 HydrophobicContact CD2-CD1 4.48Å; L317-I320 PolarHBondContact O-N 3.48Å; I320-I322 PolarHBondContact O-N 3.37Å; I320-Y323 PolarHBondContact O-N 3.04Å; I320-F324 WeakPolarHBondContact O-CB 3.32Å; I320-F324 PolarHBondContact O-N 2.93Å
321Y93.3Very high90.1Very high124 Ų12444 Ų4449%0.48620%0.202SC..Hα-helixtrans-60.8-43.7176.7177.8-103.7000112.5L317 L318 D319 F324 K325L317-Y321 WeakPolarHBondContact O-CB 3.41Å; L317-Y321 PolarHBondContact O-N 3.26Å; L318-Y321 WeakPolarHBondContact O-CB 3.41Å; L318-Y321 PolarHBondContact O-N 3.17Å; D319-Y321 VanDerWaalsContact C-N 3.29Å; D319-Y321 PolarHBondContact O-N 3.07Å; Y321-F324 PolarHBondContact O-N 2.89Å; Y321-K325 HydrophobicContact CD1-CD 4.48Å; Y321-K325 HydrophobicContact CE1-CD 3.85Å; Y321-K325 VanDerWaalsContact CZ-NZ 3.31Å; Y321-K325 PolarHBondContact O-N 3.22Å; Y321-K325 WeakPolarHBondContact OH-CE 3.14Å; Y321-K325 PolarHBondContact OH-NZ 2.95Å
322I93.3Very high89.5Confident4 Ų445.6 Ų45.62%0.02121%0.208CC..Hα-helixtrans-63.8-44.2176.7-75.1165.3000110.6L264 L265 L318 D319 I320 F324 K325 C326L264-I322 HydrophobicContact CB-CG2 3.87Å; L265-I322 HydrophobicContact CD2-CG2 4.18Å; L318-I322 HydrophobicContact CD1-CD1 3.91Å; L318-I322 HydrophobicContact CD1-CG1 4.3Å; L318-I322 HydrophobicContact CD2-CD1 4.47Å; L318-I322 HydrophobicContact CG-CD1 3.78Å; L318-I322 WeakPolarHBondContact O-CB 3.47Å; L318-I322 VanDerWaalsContact O-CG1 3.29Å; L318-I322 WeakPolarHBondContact O-CG1 3.13Å; L318-I322 PolarHBondContact O-N 3.01Å; D319-I322 CarbonylContact O-C 3.35Å; D319-I322 WeakPolarHBondContact O-CB 3.39Å; D319-I322 PolarHBondContact O-N 2.9Å; D319-I322 VanDerWaalsContact O-N 3.1Å; I320-I322 PolarHBondContact O-N 3.37Å; I322-F324 PolarHBondContact O-N 2.85Å; I322-K325 PolarHBondContact O-N 3.03Å; I322-C326 VanDerWaalsContact O-CB 3.25Å; I322-C326 WeakPolarHBondContact O-CB 3.38Å; I322-C326 PolarHBondContact O-N 3.38Å; I322-C326 PolarHBondContact O-SG 3.31Å
323Y91.4Very high88.5Confident4 Ų446.3 Ų46.32%0.01621%0.213CC..Hα-helixtrans-63.3-42.8178.6-60.6-19.9000111.1I62 I80 L265 D319 I320 K325 C326 F327I62-Y323 HydrophobicContact CD1-CD2 4.08Å; I80-Y323 HydrophobicContact CD1-CD1 4.04Å; I80-Y323 HydrophobicContact CD1-CE1 3.82Å; I80-Y323 HydrophobicContact CG1-CE1 4.1Å; I80-Y323 HydrophobicContact CG2-CD1 4.21Å; I80-Y323 HydrophobicContact CG2-CD2 3.84Å; I80-Y323 HydrophobicContact CG2-CE1 3.96Å; I80-Y323 HydrophobicContact CG2-CE2 3.57Å; I80-Y323 HydrophobicContact CG2-CG 4.18Å; L265-Y323 HydrophobicContact CD2-CD1 4.13Å; L265-Y323 HydrophobicContact CD2-CE1 3.8Å; D319-Y323 HydrophobicContact CB-CD2 4.44Å; D319-Y323 HydrophobicContact CB-CE1 4.49Å; D319-Y323 HydrophobicContact CB-CE2 3.78Å; D319-Y323 WeakPolarHBondContact O-CB 3.38Å; D319-Y323 WeakPolarHBondContact O-CD1 3.46Å; D319-Y323 WeakPolarHBondContact O-CD2 3.49Å; D319-Y323 PolarHBondContact O-N 3.3Å; D319-Y323 PolarHBondContact OD2-OH 3.01Å; D319-Y323 VanDerWaalsContact OD2-OH 3.12Å; I320-Y323 PolarHBondContact O-N 3.04Å; Y323-K325 VanDerWaalsContact C-N 3.31Å; Y323-K325 PolarHBondContact O-N 2.83Å; Y323-C326 PolarHBondContact O-N 3.18Å; Y323-F327 HydrophobicContact CD1-CE2 4.2Å; Y323-F327 WeakPolarHBondContact O-CD2 3.42Å; Y323-F327 PolarHBondContact O-N 3.02Å
324F89.7Confident87.6Confident67 Ų6748.8 Ų48.829%0.29423%0.226SC..Hα-helixtrans-59.4-40.2174.1-173.9-94.5000112.5I320 Y321 I322 R331 L334 L335I320-F324 WeakPolarHBondContact O-CB 3.32Å; I320-F324 PolarHBondContact O-N 2.93Å; Y321-F324 PolarHBondContact O-N 2.89Å; I322-F324 PolarHBondContact O-N 2.85Å; F324-R331 HydrophobicContact CD1-CG 4.43Å; F324-R331 HydrophobicContact CD2-CB 4.1Å; F324-R331 HydrophobicContact CD2-CG 4.12Å; F324-R331 HydrophobicContact CE1-CG 3.93Å; F324-R331 HydrophobicContact CE2-CB 4.03Å; F324-R331 HydrophobicContact CE2-CG 3.59Å; F324-R331 HydrophobicContact CZ-CB 4.37Å; F324-R331 HydrophobicContact CZ-CG 3.5Å; F324-L334 HydrophobicContact CD2-CD1 3.99Å; F324-L335 HydrophobicContact CE2-CG 4.34Å; F324-L335 HydrophobicContact CZ-CD1 4.23Å; F324-L335 HydrophobicContact CZ-CD2 4.4Å; F324-L335 HydrophobicContact CZ-CG 4.29Å
325K88.8Confident86.8Confident109 Ų10951.7 Ų51.747%0.47424%0.242SC..Hα-helixtrans-71.6-36.9174.6-80.9-169.3171176.60113.5L264 Y321 I322 Y323L264-K325 HydrophobicContact CD1-CB 4.5Å; Y321-K325 HydrophobicContact CD1-CD 4.48Å; Y321-K325 HydrophobicContact CE1-CD 3.85Å; Y321-K325 VanDerWaalsContact CZ-NZ 3.31Å; Y321-K325 PolarHBondContact O-N 3.22Å; Y321-K325 WeakPolarHBondContact OH-CE 3.14Å; Y321-K325 PolarHBondContact OH-NZ 2.95Å; I322-K325 PolarHBondContact O-N 3.03Å; Y323-K325 VanDerWaalsContact C-N 3.31Å; Y323-K325 PolarHBondContact O-N 2.83Å
326C87.1Confident85.3Confident23 Ų2353.2 Ų53.216%0.15525%0.254CS..Hα-helixtrans-81.2-32.5-172.2-72.90000113.5R261 I322 Y323R261-C326 HydrophobicContact CG-CB 3.9Å; I322-C326 VanDerWaalsContact O-CB 3.25Å; I322-C326 WeakPolarHBondContact O-CB 3.38Å; I322-C326 PolarHBondContact O-N 3.38Å; I322-C326 PolarHBondContact O-SG 3.31Å; Y323-C326 PolarHBondContact O-N 3.18Å
327F84.5Confident83.4Confident11 Ų1154.6 Ų54.65%0.04826%0.263CS..  trans-121.597.4-168.5-56.9-68000111.9Q76 I77 I80 Y323 L329 L330 R331Q76-F327 HydrophobicContact CG-CZ 4.26Å; I77-F327 HydrophobicContact CD1-CB 4.03Å; I77-F327 HydrophobicContact CD1-CD1 3.34Å; I77-F327 HydrophobicContact CD1-CD2 4.47Å; I77-F327 HydrophobicContact CD1-CE1 3.85Å; I77-F327 HydrophobicContact CD1-CG 3.69Å; I77-F327 HydrophobicContact CG1-CD1 3.51Å; I77-F327 HydrophobicContact CG1-CD2 4.3Å; I77-F327 HydrophobicContact CG1-CE1 3.46Å; I77-F327 VanDerWaalsContact CG1-CE1 3.46Å; I77-F327 HydrophobicContact CG1-CE2 4.29Å; I77-F327 HydrophobicContact CG1-CG 3.93Å; I77-F327 HydrophobicContact CG1-CZ 3.88Å; I80-F327 HydrophobicContact CD1-CE2 3.4Å; I80-F327 HydrophobicContact CD1-CZ 3.53Å; Y323-F327 HydrophobicContact CD1-CE2 4.2Å; Y323-F327 WeakPolarHBondContact O-CD2 3.42Å; Y323-F327 PolarHBondContact O-N 3.02Å; F327-L329 VanDerWaalsContact C-N 3.25Å; F327-L329 PolarHBondContact O-N 2.93Å; F327-L330 HydrophobicContact CB-CB 4.07Å; F327-L330 PolarHBondContact O-N 2.72Å; F327-R331 PolarHBondContact O-N 3.44Å
328K82.5Confident81.4Confident131 Ų13156.6 Ų56.657%0.5728%0.279SS*.Hα-helixtrans-52.1-41.9177.8-177.8176.7169.3-178.90112.7L330 R331 E332K328-L330 VanDerWaalsContact C-N 3.29Å; K328-L330 PolarHBondContact O-N 2.66Å; K328-R331 PolarHBondContact O-N 3.38Å; K328-E332 WeakPolarHBondContact CE-OE1 3.47Å; K328-E332 HydrophobicContact CG-CG 4.29Å; K328-E332 IonicContact NZ-OE1 2.73Å; K328-E332 WeakPolarHBondContact O-CB 3.34Å; K328-E332 WeakPolarHBondContact O-CG 3.05Å; K328-E332 PolarHBondContact O-N 3.05Å
329L77.2Confident79.1Confident74 Ų7463 Ų6339%0.38730%0.299SS..Hα-helixtrans-61.5-34.4179.3-71.1173.1000113.6Y65 F327 S333Y65-L329 PolarHBondContact OH-O 3.35Å; F327-L329 VanDerWaalsContact C-N 3.25Å; F327-L329 PolarHBondContact O-N 2.93Å; L329-S333 WeakPolarHBondContact O-CB 3.38Å; L329-S333 PolarHBondContact O-N 3.18Å; L329-S333 PolarHBondContact O-OG 3.08Å
330L76.6Confident76.8Confident11 Ų1168.7 Ų68.76%0.05832%0.319CS..Hα-helixtrans-79.2-40.8177.8-177.270.5000110.5Y61 I62 Y65 F327 K328 E332 S333 L334Y61-L330 HydrophobicContact CD1-CD1 4.37Å; Y61-L330 HydrophobicContact CE1-CD1 4.06Å; I62-L330 HydrophobicContact CD1-CD2 4.1Å; I62-L330 HydrophobicContact CG1-CD1 3.81Å; I62-L330 HydrophobicContact CG1-CD2 3.84Å; I62-L330 HydrophobicContact CG1-CG 4.42Å; Y65-L330 HydrophobicContact CD1-CD1 4.18Å; F327-L330 HydrophobicContact CB-CB 4.07Å; F327-L330 PolarHBondContact O-N 2.72Å; K328-L330 VanDerWaalsContact C-N 3.29Å; K328-L330 PolarHBondContact O-N 2.66Å; L330-E332 PolarHBondContact O-N 2.89Å; L330-S333 PolarHBondContact O-N 3.26Å; L330-S333 PolarHBondContact O-OG 3.49Å; L330-L334 HydrophobicContact CD1-CD1 4.44Å; L330-L334 HydrophobicContact CG-CD1 4.01Å; L330-L334 WeakPolarHBondContact O-CB 3.41Å; L330-L334 WeakPolarHBondContact O-CG 3.24Å; L330-L334 PolarHBondContact O-N 2.89Å
331R81.2Confident74.6Confident100 Ų10073.3 Ų73.338%0.37734%0.344SS..Hα-helixtrans-58.9-48174.1176173.576.7-1777.9112.1F324 F327 K328 S333 L334 L335F324-R331 HydrophobicContact CD1-CG 4.43Å; F324-R331 HydrophobicContact CD2-CB 4.1Å; F324-R331 HydrophobicContact CD2-CG 4.12Å; F324-R331 HydrophobicContact CE1-CG 3.93Å; F324-R331 HydrophobicContact CE2-CB 4.03Å; F324-R331 HydrophobicContact CE2-CG 3.59Å; F324-R331 HydrophobicContact CZ-CB 4.37Å; F324-R331 HydrophobicContact CZ-CG 3.5Å; F327-R331 PolarHBondContact O-N 3.44Å; K328-R331 PolarHBondContact O-N 3.38Å; R331-S333 VanDerWaalsContact C-N 3.32Å; R331-S333 PolarHBondContact O-N 3.28Å; R331-L334 PolarHBondContact O-N 2.86Å; R331-L335 HydrophobicContact CG-CD1 3.8Å; R331-L335 HydrophobicContact CG-CG 4.48Å; R331-L335 WeakPolarHBondContact O-CB 3.48Å; R331-L335 VanDerWaalsContact O-CG 3.3Å; R331-L335 WeakPolarHBondContact O-CG 3.46Å; R331-L335 PolarHBondContact O-N 2.78Å
332E81.3Confident72.5Confident84 Ų8472.2 Ų72.239%0.39336%0.355SS..Hα-helixtrans-63.9-38.4178.1-74.5175.8169.800111.5K328 L330 C336K328-E332 WeakPolarHBondContact CE-OE1 3.47Å; K328-E332 HydrophobicContact CG-CG 4.29Å; K328-E332 IonicContact NZ-OE1 2.73Å; K328-E332 WeakPolarHBondContact O-CB 3.34Å; K328-E332 WeakPolarHBondContact O-CG 3.05Å; K328-E332 PolarHBondContact O-N 3.05Å; L330-E332 PolarHBondContact O-N 2.89Å; E332-C336 WeakPolarHBondContact O-CB 3.47Å; E332-C336 PolarHBondContact O-N 2.89Å; E332-C336 PolarHBondContact O-SG 3.27Å; E332-C336 VanDerWaalsContact O-SG 3.34Å
333S75.4Confident70Confident15 Ų1580 Ų8011%0.10539%0.388CS..Hα-helixtrans-67.7-46.8177.274.60000111.3Y61 L329 L330 R331 L335 C336 T337Y61-S333 VanDerWaalsContact OH-C 3.29Å; Y61-S333 WeakPolarHBondContact OH-CB 3.14Å; Y61-S333 PolarHBondContact OH-O 3.19Å; Y61-S333 PolarHBondContact OH-OG 3.41Å; L329-S333 WeakPolarHBondContact O-CB 3.38Å; L329-S333 PolarHBondContact O-N 3.18Å; L329-S333 PolarHBondContact O-OG 3.08Å; L330-S333 PolarHBondContact O-N 3.26Å; L330-S333 PolarHBondContact O-OG 3.49Å; R331-S333 VanDerWaalsContact C-N 3.32Å; R331-S333 PolarHBondContact O-N 3.28Å; S333-L335 PolarHBondContact O-N 3.13Å; S333-C336 PolarHBondContact O-N 2.93Å; S333-T337 WeakPolarHBondContact O-CB 3.3Å; S333-T337 PolarHBondContact O-N 3.35Å; S333-T337 PolarHBondContact O-OG1 3.24Å
334L73.2Confident67.6Low53 Ų5383.3 Ų83.328%0.27742%0.424SS..Hα-helixtrans-60.3-43.5177.6-74167.6000112.2Y61 F324 L330 R331 P338Y61-L334 HydrophobicContact CD1-CD2 3.57Å; Y61-L334 HydrophobicContact CD1-CG 4.27Å; Y61-L334 HydrophobicContact CE1-CD2 3.42Å; Y61-L334 VanDerWaalsContact CE1-CD2 3.42Å; Y61-L334 HydrophobicContact CE1-CG 3.75Å; Y61-L334 HydrophobicContact CG-CD2 4.35Å; F324-L334 HydrophobicContact CD2-CD1 3.99Å; L330-L334 HydrophobicContact CD1-CD1 4.44Å; L330-L334 HydrophobicContact CG-CD1 4.01Å; L330-L334 WeakPolarHBondContact O-CB 3.41Å; L330-L334 WeakPolarHBondContact O-CG 3.24Å; L330-L334 PolarHBondContact O-N 2.89Å; R331-L334 PolarHBondContact O-N 2.86Å; L334-P338 WeakPolarHBondContact O-CD 3.43Å
335L77.3Confident65.6Low109 Ų10982.4 Ų82.457%0.57143%0.426SS*.Hα-helixtrans-74-30.7178.4-67.5173000113.6F324 R331 S333 P338F324-L335 HydrophobicContact CE2-CG 4.34Å; F324-L335 HydrophobicContact CZ-CD1 4.23Å; F324-L335 HydrophobicContact CZ-CD2 4.4Å; F324-L335 HydrophobicContact CZ-CG 4.29Å; R331-L335 HydrophobicContact CG-CD1 3.8Å; R331-L335 HydrophobicContact CG-CG 4.48Å; R331-L335 WeakPolarHBondContact O-CB 3.48Å; R331-L335 VanDerWaalsContact O-CG 3.3Å; R331-L335 WeakPolarHBondContact O-CG 3.46Å; R331-L335 PolarHBondContact O-N 2.78Å; S333-L335 PolarHBondContact O-N 3.13Å; L335-P338 WeakPolarHBondContact O-CD 3.41Å
336C64.2Low63.4Low52 Ų5282.3 Ų82.335%0.35143%0.43SS..Hα-helixtrans-88.3-13.2178-71.60000113.8E332 S333 R339 R340E332-C336 WeakPolarHBondContact O-CB 3.47Å; E332-C336 PolarHBondContact O-N 2.89Å; E332-C336 PolarHBondContact O-SG 3.27Å; E332-C336 VanDerWaalsContact O-SG 3.34Å; S333-C336 PolarHBondContact O-N 2.93Å; C336-R339 PolarHBondContact O-N 2.73Å; C336-R339 VanDerWaalsContact O-N 3.08Å; C336-R340 PolarHBondContact O-N 3.02Å
337T56.8Low61.3Low31 Ų3189.6 Ų89.619%0.1946%0.459CS..Hα-helixtrans-57.4-42.8178.5-60.80000111.6Y61 S333 R339 R340 L341Y61-T337 PolarHBondContact OH-OG1 2.88Å; Y61-T337 VanDerWaalsContact OH-OG1 3.06Å; S333-T337 WeakPolarHBondContact O-CB 3.3Å; S333-T337 PolarHBondContact O-N 3.35Å; S333-T337 PolarHBondContact O-OG1 3.24Å; T337-R339 PolarHBondContact O-N 2.05Å; T337-R340 PolarHBondContact O-N 3.13Å; T337-L341 HydrophobicContact CG2-CD1 3.56Å; T337-L341 HydrophobicContact CG2-CG 4.19Å; T337-L341 VanDerWaalsContact O-CB 3.31Å; T337-L341 WeakPolarHBondContact O-CB 3.33Å; T337-L341 WeakPolarHBondContact O-CG 3.42Å; T337-L341 PolarHBondContact O-N 2.72Å
338P52.7Low59.2Low88 Ų8897.6 Ų97.657%0.57149%0.494SS*.Hα-helixtrans-59.4-42.7172.2-21.931.1000113.3L334 L335 S342L334-P338 WeakPolarHBondContact O-CD 3.43Å; L335-P338 WeakPolarHBondContact O-CD 3.41Å; P338-S342 PolarHBondContact O-N 3.13Å
339R46.6Very low57.3Low203 Ų20396 Ų9677%0.76650%0.499SS*.Hα-helixtrans-72.8-29.5-179.6-81.4-173.9176.1-177.8-0.8113.8C336 T337C336-R339 PolarHBondContact O-N 2.73Å; C336-R339 VanDerWaalsContact O-N 3.08Å; T337-R339 PolarHBondContact O-N 2.05Å
340R45.6Very low55.6Low122 Ų12299.2 Ų99.246%0.4652%0.517SS..Hα-helixtrans-89.7-29.5-179.9-75.1-171.7-173.7-167.1-1.1113.4C336 T337 S342 K343 G344C336-R340 PolarHBondContact O-N 3.02Å; T337-R340 PolarHBondContact O-N 3.13Å; R340-S342 VanDerWaalsContact C-N 3.27Å; R340-K343 CarbonylContact O-C 3.43Å; R340-K343 WeakPolarHBondContact O-CA 3.18Å; R340-K343 PolarHBondContact O-N 2.94Å; R340-G344 PolarHBondContact O-N 3.19Å
341L48.6Very low53.7Low125 Ų125106.9 Ų106.965%0.65455%0.553SS**Hα-helixtrans-61.5-38.7168.2-83.3162.6000110.8T337 K343T337-L341 HydrophobicContact CG2-CD1 3.56Å; T337-L341 HydrophobicContact CG2-CG 4.19Å; T337-L341 VanDerWaalsContact O-CB 3.31Å; T337-L341 WeakPolarHBondContact O-CB 3.33Å; T337-L341 WeakPolarHBondContact O-CG 3.42Å; T337-L341 PolarHBondContact O-N 2.72Å; L341-K343 PolarHBondContact O-N 3.47Å
342S48.5Very low51.7Low101 Ų101107.8 Ų107.871%0.70657%0.571SS**THydrogen-bonded Turntrans-59.8-22.3169.31580000114.1P338 R340P338-S342 PolarHBondContact O-N 3.13Å; R340-S342 VanDerWaalsContact C-N 3.27Å
343K40.5Very low49.6Very low166 Ų166115.3 Ų115.372%0.72260%0.596SS**THydrogen-bonded Turntrans-118.316.9-175.2-71.7-167.7174.9-172.80114.8R340 L341 S345R340-K343 CarbonylContact O-C 3.43Å; R340-K343 WeakPolarHBondContact O-CA 3.18Å; R340-K343 PolarHBondContact O-N 2.94Å; L341-K343 PolarHBondContact O-N 3.47Å; K343-S345 PolarHBondContact O-N 3.33Å
344G42.3Very low47.8Very low75 Ų75122.8 Ų122.877%0.77363%0.633SS**THydrogen-bonded Turntrans5519.1169.200000117.1R340R340-G344 PolarHBondContact O-N 3.19Å
345S46.6Very low47Very low47 Ų47128.9 Ų128.933%0.32968%0.68SS.*  trans-10715.1-16659.70000115K343 F347K343-S345 PolarHBondContact O-N 3.33Å; S345-F347 PolarHBondContact O-N 3.37Å; S345-F347 VanDerWaalsContact O-N 3.15Å
346L42.2Very low45.5Very low107 Ų107129.9 Ų129.956%0.5669%0.685SS**THydrogen-bonded Turntrans-62.6-23.1-179.9-140.199.9000112.8
347F44.4Very low44.5Very low177 Ų177133.9 Ų133.978%0.77670%0.703SS**THydrogen-bonded Turntrans-109.512.1-173.4-78.6-76.9000116.1S345 S349S345-F347 PolarHBondContact O-N 3.37Å; S345-F347 VanDerWaalsContact O-N 3.15Å; F347-S349 PolarHBondContact O-N 2.82Å
348K38.8Very low43.8Very low178 Ų178139.7 Ų139.777%0.77473%0.731SS**  trans-72.288.8166-84.8-170.4176.6-1770108.7D350K348-D350 PolarHBondContact O-N 2.88Å
349S44.4Very low43.3Very low98 Ų98142.7 Ų142.769%0.68574%0.741SS**  trans-55.2118.3157.956.30000107.1F347 Q351F347-S349 PolarHBondContact O-N 2.82Å; S349-Q351 PolarHBondContact O-N 3Å
350D41.3Very low43.1Very low141 Ų141138.9 Ų138.975%0.75474%0.739SS**  trans-60.291.3170.3-66.3-42.7000107.6K348K348-D350 PolarHBondContact O-N 2.88Å
351Q35.2Very low42.9Very low173 Ų173140.1 Ų140.181%0.80876%0.758SS**PPolyproline II helixtrans-64.1126.6165.8-89.8-170.9-27.500107.4S349 R353S349-Q351 PolarHBondContact O-N 3Å; Q351-R353 PolarHBondContact O-N 3.21Å
352P40.2Very low42.5Very low118 Ų118141.1 Ų141.177%0.76677%0.765SS**PPolyproline II helixtrans-64.3123.217225.9-30.8000108.6I354P352-I354 PolarHBondContact O-N 3.11Å
353R37.5Very low42.1Very low243 Ų243144.2 Ų144.292%0.91777%0.77SS**PPolyproline II helixtrans-61.8119.2170.7-73.6-175.2-169.6-175.82.1108Q351 S355Q351-R353 PolarHBondContact O-N 3.21Å; R353-S355 PolarHBondContact O-N 3.45Å
354I36.5Very low42.2Very low171 Ų171142.4 Ų142.488%0.87777%0.774SS**PPolyproline II helixtrans-67.8120.8163.6-59.8169000106.3P352P352-I354 PolarHBondContact O-N 3.11Å
355S57.3Low42.2Very low181 Ų181148.5 Ų148.5100%1.26677%0.774SS**  trans-1370155.762.10000107.3R353R353-S355 PolarHBondContact O-N 3.45Å

Retrieved 355 of 355 residues in 1343.8 ms (Link to these results)

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