A0A077Z133_TRITR Loading...

DUF2013 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z133, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 416 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
1M37Very low47.3Very low245 Ų245151.1 Ų151.1100%1.20778%0.779SS**  076.60-77.2171.9162.200109.5
2S35.2Very low50.5Low104 Ų104145 Ų14573%0.72775%0.749SS**  trans-114.968.8169.2162.70000106.8
3Q34.3Very low53.3Low183 Ų183138 Ų13886%0.85571%0.707SS**  trans-100.769.6174.3-78.1-175.9-10.700108.7
4F44.1Very low55.9Low174 Ų174130.9 Ų130.976%0.76368%0.676SS**  trans-118.7114.7150.9-89.6-81.5000106.2Y6F4-Y6 VanDerWaalsContact C-N 3.33Å; F4-Y6 PolarHBondContact O-N 3.28Å
5P43.3Very low58.2Low114 Ų114129.3 Ų129.374%0.7466%0.662SS**  trans-67104168.928.4-27.1000105.1K7P5-K7 VanDerWaalsContact C-N 3.29Å; P5-K7 PolarHBondContact O-N 3.15Å
6Y45.7Very low60.2Low165 Ų165124.4 Ų124.465%0.64764%0.64SS**  trans-55.997.6173.9-77.6-86.3000107.5F4 R8 Q54F4-Y6 VanDerWaalsContact C-N 3.33Å; F4-Y6 PolarHBondContact O-N 3.28Å; Y6-R8 PolarHBondContact O-N 3.36Å; Y6-Q54 VanDerWaalsContact CD1-OE1 3.25Å
7K49.8Very low62.1Low199 Ų199117.1 Ų117.187%0.86560%0.603SS**  trans-56.4125.9170.5-84.9-178174.6178.20106P5 A9P5-K7 VanDerWaalsContact C-N 3.29Å; P5-K7 PolarHBondContact O-N 3.15Å; K7-A9 PolarHBondContact O-N 3.24Å
8R50.7Low63.8Low240 Ų240114.3 Ų114.391%0.90658%0.583SS**  trans-40.3132.9170.8-91.9-179.9172.8171.1-3109.2Y6Y6-R8 PolarHBondContact O-N 3.36Å
9A55.5Low65.3Low59 Ų59115.1 Ų115.149%0.48858%0.582SS.*  trans-37.2130.516800000110.4K7 A11 Y13K7-A9 PolarHBondContact O-N 3.24Å; A9-A11 PolarHBondContact O-N 3.27Å; A9-Y13 HydrophobicContact CB-CE1 4.45Å; A9-Y13 HydrophobicContact CB-CE2 4.33Å; A9-Y13 WeakPolarHBondContact CB-OH 3.48Å
10P59.9Low66.7Low62 Ų62113.1 Ų113.140%0.40357%0.571SS.*  trans-55.4136.2179.819.7-29.2000109.8D12 Y13 V16P10-D12 PolarHBondContact O-N 3.12Å; P10-Y13 HydrophobicContact CG-CD1 3.74Å; P10-Y13 HydrophobicContact CG-CE1 3.69Å; P10-V16 HydrophobicContact CB-CG2 3.83Å; P10-V16 HydrophobicContact CG-CG2 3.93Å
11A64.5Low68Low117 Ų117107.7 Ų107.797%0.96754%0.544SS*.SBendtrans-61.1-13.2-173.700000114A9A9-A11 PolarHBondContact O-N 3.27Å
12D85.5Confident70.7Confident78 Ų7897.5 Ų97.542%0.41749%0.494SS..  trans-144.991.6178.4-174.4-11.8000110P10 S14 K15 V16P10-D12 PolarHBondContact O-N 3.12Å; D12-S14 PolarHBondContact O-N 3.28Å; D12-S14 WeakPolarHBondContact OD1-CB 3.5Å; D12-S14 PolarHBondContact OD1-N 3.36Å; D12-K15 HydrophobicContact CB-CB 4.11Å; D12-K15 PolarHBondContact O-N 2.96Å; D12-K15 PolarHBondContact OD1-N 3.18Å; D12-K15 WeakPolarHBondContact OD2-CB 3.39Å; D12-V16 PolarHBondContact O-N 3.35Å
13Y88Confident73.5Confident54 Ų5495.4 Ų95.421%0.21248%0.48CS..Hα-helixtrans-60-32.5175.5-80.2-49.3000112.7A9 P10 V16 A17 P57 F58A9-Y13 HydrophobicContact CB-CE1 4.45Å; A9-Y13 HydrophobicContact CB-CE2 4.33Å; A9-Y13 WeakPolarHBondContact CB-OH 3.48Å; P10-Y13 HydrophobicContact CG-CD1 3.74Å; P10-Y13 HydrophobicContact CG-CE1 3.69Å; Y13-V16 PolarHBondContact O-N 3.38Å; Y13-A17 WeakPolarHBondContact O-CB 3.46Å; Y13-A17 PolarHBondContact O-N 3.44Å; Y13-P57 HydrophobicContact CE2-CB 4.02Å; Y13-F58 HydrophobicContact CD1-CB 3.86Å; Y13-F58 AromaticContact CD1-CD2 3.35Å; Y13-F58 HydrophobicContact CD1-CD2 3.35Å; Y13-F58 HydrophobicContact CD1-CE2 4.21Å; Y13-F58 AromaticContact CD1-CG 3.94Å; Y13-F58 HydrophobicContact CD1-CG 3.94Å; Y13-F58 HydrophobicContact CE1-CB 3.84Å; Y13-F58 HydrophobicContact CE1-CD2 4.1Å; Y13-F58 HydrophobicContact CE1-CG 4.26Å; Y13-F58 HydrophobicContact CG-CB 4.34Å; Y13-F58 AromaticContact CG-CD2 3.85Å; Y13-F58 HydrophobicContact CG-CD2 3.85Å; Y13-F58 WeakPolarHBondContact O-CE2 3.44Å
14S88.9Confident76.4Confident39 Ų3988.5 Ų88.527%0.27345%0.448SS..Hα-helixtrans-65.1-45.6179.1-58.90000110.8D12 V16 A17 R18 V61 I65D12-S14 PolarHBondContact O-N 3.28Å; D12-S14 WeakPolarHBondContact OD1-CB 3.5Å; D12-S14 PolarHBondContact OD1-N 3.36Å; S14-V16 VanDerWaalsContact C-N 3.3Å; S14-V16 PolarHBondContact O-N 3.25Å; S14-A17 PolarHBondContact O-N 3.02Å; S14-R18 WeakPolarHBondContact O-CG 3.39Å; S14-R18 PolarHBondContact O-N 3.46Å; S14-V61 WeakPolarHBondContact OG-CG1 3.4Å; S14-I65 WeakPolarHBondContact O-CD1 3.42Å
15K89.9Confident78.7Confident107 Ų10780.2 Ų80.247%0.46541%0.412SS..Hα-helixtrans-60.7-39.5176.6-173.1168.8-171.2162.90112.7D12 K19D12-K15 HydrophobicContact CB-CB 4.11Å; D12-K15 PolarHBondContact O-N 2.96Å; D12-K15 PolarHBondContact OD1-N 3.18Å; D12-K15 WeakPolarHBondContact OD2-CB 3.39Å; K15-K19 WeakPolarHBondContact O-CG 3.47Å; K15-K19 PolarHBondContact O-N 2.95Å; K15-K19 VanDerWaalsContact O-N 3.16Å
16V90.8Very high81Confident51 Ų5179.1 Ų79.131%0.30940%0.404SS..Hα-helixtrans-65.9-46177176.70000111P10 D12 Y13 S14 R18 K19 M20 F58P10-V16 HydrophobicContact CB-CG2 3.83Å; P10-V16 HydrophobicContact CG-CG2 3.93Å; D12-V16 PolarHBondContact O-N 3.35Å; Y13-V16 PolarHBondContact O-N 3.38Å; S14-V16 VanDerWaalsContact C-N 3.3Å; S14-V16 PolarHBondContact O-N 3.25Å; V16-R18 PolarHBondContact O-N 3.47Å; V16-K19 PolarHBondContact O-N 3.07Å; V16-M20 HydrophobicContact CG1-SD 4.34Å; V16-M20 WeakPolarHBondContact O-CG 2.93Å; V16-M20 PolarHBondContact O-N 3.42Å; V16-F58 HydrophobicContact CB-CE2 4.25Å; V16-F58 HydrophobicContact CG1-CE2 4.15Å; V16-F58 HydrophobicContact CG1-CZ 4.17Å
17A92.4Very high83.2Confident0 Ų080.8 Ų80.80%041%0.409CS..Hα-helixtrans-59.5-46.7178.200000112.2Y13 S14 K19 M20 I21 F58 L62 I65Y13-A17 WeakPolarHBondContact O-CB 3.46Å; Y13-A17 PolarHBondContact O-N 3.44Å; S14-A17 PolarHBondContact O-N 3.02Å; A17-K19 VanDerWaalsContact C-N 3.35Å; A17-K19 PolarHBondContact O-N 3.28Å; A17-M20 PolarHBondContact O-N 3.47Å; A17-I21 WeakPolarHBondContact O-CG1 3.32Å; A17-I21 PolarHBondContact O-N 3.44Å; A17-I21 VanDerWaalsContact O-N 3.12Å; A17-F58 HydrophobicContact CB-CE2 3.78Å; A17-F58 HydrophobicContact CB-CZ 4.04Å; A17-L62 HydrophobicContact CB-CD1 3.65Å; A17-I65 HydrophobicContact CB-CD1 3.38Å
18R92.9Very high85.1Confident67 Ų6776.7 Ų76.725%0.25339%0.391SS..Hα-helixtrans-58.5-45.6175.7-68.3-176.4-168.3130.35.4111.9S14 V16 M20 I21 D22 I65 T66S14-R18 WeakPolarHBondContact O-CG 3.39Å; S14-R18 PolarHBondContact O-N 3.46Å; V16-R18 PolarHBondContact O-N 3.47Å; R18-M20 VanDerWaalsContact C-N 3.29Å; R18-M20 PolarHBondContact O-N 3.03Å; R18-I21 PolarHBondContact O-N 3.36Å; R18-D22 PolarHBondContact O-N 3.06Å; R18-I65 HydrophobicContact CG-CD1 3.66Å; R18-I65 HydrophobicContact CG-CG1 4.2Å; R18-T66 PolarHBondContact NE-O 3.21Å
19K91.7Very high86.7Confident129 Ų12967.2 Ų67.256%0.56136%0.358SS*.Hα-helixtrans-61.6-34.8177.7-76.3-175175.2-165.10113.5K15 V16 A17 S23K15-K19 WeakPolarHBondContact O-CG 3.47Å; K15-K19 PolarHBondContact O-N 2.95Å; K15-K19 VanDerWaalsContact O-N 3.16Å; V16-K19 PolarHBondContact O-N 3.07Å; A17-K19 VanDerWaalsContact C-N 3.35Å; A17-K19 PolarHBondContact O-N 3.28Å; K19-S23 VanDerWaalsContact O-CB 3.3Å; K19-S23 WeakPolarHBondContact O-CB 3.47Å; K19-S23 PolarHBondContact O-N 2.92Å; K19-S23 PolarHBondContact O-OG 3.35Å
20M93.4Very high88.5Confident75 Ų7568.9 Ų68.937%0.36936%0.355SS..Hα-helixtrans-67.2-44.1175.8-69.6-178.785.400111.1V16 A17 R18 S23 L24 V39 F58V16-M20 HydrophobicContact CG1-SD 4.34Å; V16-M20 WeakPolarHBondContact O-CG 2.93Å; V16-M20 PolarHBondContact O-N 3.42Å; A17-M20 PolarHBondContact O-N 3.47Å; R18-M20 VanDerWaalsContact C-N 3.29Å; R18-M20 PolarHBondContact O-N 3.03Å; M20-S23 PolarHBondContact O-N 3Å; M20-L24 PolarHBondContact O-N 2.74Å; M20-V39 HydrophobicContact CB-CG1 4.01Å; M20-V39 HydrophobicContact CB-CG2 4.18Å; M20-V39 HydrophobicContact CE-CG1 4.33Å; M20-V39 HydrophobicContact SD-CG1 4.25Å; M20-F58 HydrophobicContact SD-CE1 4.08Å; M20-F58 HydrophobicContact SD-CZ 3.8Å
21I95Very high90.1Very high0 Ų067.8 Ų67.80%035%0.348CS..Hα-helixtrans-62.5-48.3176.5-61.8169.6000110.2A17 R18 S23 L24 R25 Y32 C35 K36 V39 L62 I65A17-I21 WeakPolarHBondContact O-CG1 3.32Å; A17-I21 PolarHBondContact O-N 3.44Å; A17-I21 VanDerWaalsContact O-N 3.12Å; R18-I21 PolarHBondContact O-N 3.36Å; I21-S23 VanDerWaalsContact C-N 3.28Å; I21-S23 PolarHBondContact O-N 2.73Å; I21-L24 PolarHBondContact O-N 3.22Å; I21-L24 VanDerWaalsContact O-N 3.09Å; I21-R25 PolarHBondContact O-N 3.48Å; I21-Y32 HydrophobicContact CG2-CD2 4.02Å; I21-Y32 HydrophobicContact CG2-CE2 3.63Å; I21-C35 HydrophobicContact CG2-CB 4.04Å; I21-K36 HydrophobicContact CD1-CB 4.1Å; I21-K36 HydrophobicContact CD1-CG 4.08Å; I21-V39 HydrophobicContact CG1-CB 4.46Å; I21-V39 HydrophobicContact CG1-CG2 3.98Å; I21-L62 HydrophobicContact CD1-CD1 4.39Å; I21-I65 HydrophobicContact CD1-CG2 4.03Å
22D93.6Very high91.5Very high30 Ų3062.6 Ų62.616%0.1630%0.303CS..Hα-helixtrans-61.8-35.4178-83.610.2000112.5R18 L24 R25 T26 C72 V73R18-D22 PolarHBondContact O-N 3.06Å; D22-L24 VanDerWaalsContact C-N 3.33Å; D22-L24 PolarHBondContact O-N 3.3Å; D22-R25 PolarHBondContact O-N 3.35Å; D22-T26 WeakPolarHBondContact O-CB 2.87Å; D22-T26 PolarHBondContact O-N 3.02Å; D22-T26 PolarHBondContact O-OG1 3.1Å; D22-C72 WeakPolarHBondContact OD2-CA 3.41Å; D22-V73 HydrophobicContact CB-CB 4.41Å; D22-V73 HydrophobicContact CB-CG1 4.11Å; D22-V73 PolarHBondContact OD2-N 3.32Å; D22-V73 VanDerWaalsContact OD2-N 3.11Å
23S93.3Very high91.9Very high61 Ų6163.8 Ų63.843%0.42731%0.31SS..Hα-helixtrans-64.2-37.8175.3-63.60000112K19 M20 I21 R27K19-S23 VanDerWaalsContact O-CB 3.3Å; K19-S23 WeakPolarHBondContact O-CB 3.47Å; K19-S23 PolarHBondContact O-N 2.92Å; K19-S23 PolarHBondContact O-OG 3.35Å; M20-S23 PolarHBondContact O-N 3Å; I21-S23 VanDerWaalsContact C-N 3.28Å; I21-S23 PolarHBondContact O-N 2.73Å; S23-R27 WeakPolarHBondContact O-CG 3.28Å; S23-R27 PolarHBondContact O-N 3.11Å
24L95.1Very high92.3Very high37 Ų3766.1 Ų66.119%0.19432%0.323CS..Hα-helixtrans-70.2-45.2173.6-69.9-177.7000111.5M20 I21 D22 T26 R27 F28 C35 C38 V39M20-L24 PolarHBondContact O-N 2.74Å; I21-L24 PolarHBondContact O-N 3.22Å; I21-L24 VanDerWaalsContact O-N 3.09Å; D22-L24 VanDerWaalsContact C-N 3.33Å; D22-L24 PolarHBondContact O-N 3.3Å; L24-T26 VanDerWaalsContact C-N 3.27Å; L24-T26 PolarHBondContact O-N 2.9Å; L24-R27 PolarHBondContact O-N 2.97Å; L24-F28 HydrophobicContact CD2-CD2 3.95Å; L24-F28 HydrophobicContact CD2-CE2 3.82Å; L24-F28 PolarHBondContact O-N 3.48Å; L24-C35 HydrophobicContact CB-CB 4.22Å; L24-C38 HydrophobicContact CD1-CB 3.98Å; L24-V39 HydrophobicContact CD1-CG2 3.55Å; L24-V39 HydrophobicContact CG-CG2 4.43Å
25R93.6Very high92.6Very high0 Ų064.3 Ų64.30%031%0.31CS..Hα-helixtrans-54.7-44.4176.2-78.5-68.2-65.8130.73.8111.9I21 D22 R27 D29 F30 C35 V73 D74I21-R25 PolarHBondContact O-N 3.48Å; D22-R25 PolarHBondContact O-N 3.35Å; R25-R27 VanDerWaalsContact C-N 3.3Å; R25-R27 PolarHBondContact O-N 3.29Å; R25-D29 IonicContact NH1-OD1 3.33Å; R25-D29 PolarHBondContact NH1-OD1 3.23Å; R25-D29 IonicContact NH2-OD1 3.1Å; R25-D29 PolarHBondContact O-N 3.04Å; R25-F30 WeakPolarHBondContact CD-O 3.26Å; R25-F30 PolarHBondContact NH1-O 3.17Å; R25-C35 VanDerWaalsContact CD-SG 3.54Å; R25-C35 HydrophobicContact CG-CB 4.17Å; R25-V73 HydrophobicContact CB-CG1 3.85Å; R25-D74 IonicContact CZ-OD1 3.69Å; R25-D74 IonicContact CZ-OD2 3.01Å; R25-D74 IonicContact NE-OD1 2.94Å; R25-D74 PolarHBondContact NE-OD1 3.5Å; R25-D74 IonicContact NE-OD2 3.48Å; R25-D74 PolarHBondContact NE-OD2 3.35Å; R25-D74 VanDerWaalsContact NH2-CG 3.29Å; R25-D74 IonicContact NH2-OD1 3.47Å; R25-D74 PolarHBondContact NH2-OD1 2.98Å; R25-D74 IonicContact NH2-OD2 3.05Å; R25-D74 PolarHBondContact NH2-OD2 2.9Å
26T91.6Very high92.8Very high92 Ų9261 Ų6156%0.56430%0.296SS*.Hα-helixtrans-63.4-34.9178.8-53.40000112.5D22 L24D22-T26 WeakPolarHBondContact O-CB 2.87Å; D22-T26 PolarHBondContact O-N 3.02Å; D22-T26 PolarHBondContact O-OG1 3.1Å; L24-T26 VanDerWaalsContact C-N 3.27Å; L24-T26 PolarHBondContact O-N 2.9Å
27R92Very high93Very high199 Ų19963.6 Ų63.675%0.75130%0.304SS*.Hα-helixtrans-90.7-36.2-172.4-72.9-179.7-178-161.80.9114.3S23 L24 R25S23-R27 WeakPolarHBondContact O-CG 3.28Å; S23-R27 PolarHBondContact O-N 3.11Å; L24-R27 PolarHBondContact O-N 2.97Å; R25-R27 VanDerWaalsContact C-N 3.3Å; R25-R27 PolarHBondContact O-N 3.29Å
28F88Confident93.2Very high113 Ų11366 Ų6650%0.49632%0.321SS..Hα-helixtrans-118.6-7.4-167-61.1-71.5000114.5L24 F30L24-F28 HydrophobicContact CD2-CD2 3.95Å; L24-F28 HydrophobicContact CD2-CE2 3.82Å; L24-F28 PolarHBondContact O-N 3.48Å; F28-F30 HydrophobicContact CB-CD1 4.29Å; F28-F30 HydrophobicContact CB-CD2 3.47Å; F28-F30 VanDerWaalsContact CB-CD2 3.47Å; F28-F30 HydrophobicContact CB-CE1 4.26Å; F28-F30 HydrophobicContact CB-CE2 3.44Å; F28-F30 VanDerWaalsContact CB-CE2 3.44Å; F28-F30 HydrophobicContact CB-CG 3.91Å; F28-F30 HydrophobicContact CB-CZ 3.85Å; F28-F30 HydrophobicContact CD1-CE2 4.26Å; F28-F30 HydrophobicContact CD1-CZ 4.43Å; F28-F30 HydrophobicContact CG-CD2 4.24Å; F28-F30 AromaticContact CG-CE2 3.86Å; F28-F30 HydrophobicContact CG-CE2 3.86Å; F28-F30 HydrophobicContact CG-CZ 4.37Å; F28-F30 WeakPolarHBondContact O-CD1 3.33Å; F28-F30 PolarHBondContact O-N 2.74Å
29D85.4Confident93.3Very high41 Ų4163 Ų6322%0.21931%0.31CS..  trans45.933.9-176-159.849.6000113.9R25 R77 S115 K119R25-D29 IonicContact NH1-OD1 3.33Å; R25-D29 PolarHBondContact NH1-OD1 3.23Å; R25-D29 IonicContact NH2-OD1 3.1Å; R25-D29 PolarHBondContact O-N 3.04Å; D29-R77 IonicContact OD1-CZ 3.73Å; D29-R77 IonicContact OD1-NH1 3.64Å; D29-R77 PolarHBondContact OD1-NH1 2.96Å; D29-R77 IonicContact OD1-NH2 3.75Å; D29-R77 PolarHBondContact OD1-NH2 3.13Å; D29-S115 PolarHBondContact OD2-OG 2.84Å; D29-K119 WeakPolarHBondContact O-CD 3.32Å; D29-K119 WeakPolarHBondContact O-CE 3.33Å; D29-K119 PolarHBondContact O-NZ 3.08Å; D29-K119 IonicContact OD2-NZ 2.74Å; D29-K119 PolarHBondContact OD2-NZ 2.88Å
30F92.1Very high93.5Very high94 Ų9457.7 Ų57.741%0.41229%0.287SS..  trans-81.1152.9173.3-62.4-33.5000111.3R25 F28 C35R25-F30 WeakPolarHBondContact CD-O 3.26Å; R25-F30 PolarHBondContact NH1-O 3.17Å; F28-F30 HydrophobicContact CB-CD1 4.29Å; F28-F30 HydrophobicContact CB-CD2 3.47Å; F28-F30 VanDerWaalsContact CB-CD2 3.47Å; F28-F30 HydrophobicContact CB-CE1 4.26Å; F28-F30 HydrophobicContact CB-CE2 3.44Å; F28-F30 VanDerWaalsContact CB-CE2 3.44Å; F28-F30 HydrophobicContact CB-CG 3.91Å; F28-F30 HydrophobicContact CB-CZ 3.85Å; F28-F30 HydrophobicContact CD1-CE2 4.26Å; F28-F30 HydrophobicContact CD1-CZ 4.43Å; F28-F30 HydrophobicContact CG-CD2 4.24Å; F28-F30 AromaticContact CG-CE2 3.86Å; F28-F30 HydrophobicContact CG-CE2 3.86Å; F28-F30 HydrophobicContact CG-CZ 4.37Å; F28-F30 WeakPolarHBondContact O-CD1 3.33Å; F28-F30 PolarHBondContact O-N 2.74Å; F30-C35 PolarHBondContact O-SG 3.26Å
31P94.3Very high93.5Very high40 Ų4060.3 Ų60.326%0.2630%0.3SS..  trans-46.4144.9173.5-28.235.6000113.5D33 E34 C35 K119P31-D33 VanDerWaalsContact C-N 3.26Å; P31-D33 PolarHBondContact O-N 3.3Å; P31-E34 HydrophobicContact CB-CB 4.33Å; P31-E34 HydrophobicContact CB-CG 4.12Å; P31-E34 WeakPolarHBondContact CD-OE2 3.43Å; P31-E34 HydrophobicContact CG-CG 4.28Å; P31-E34 PolarHBondContact O-N 3.44Å; P31-E34 VanDerWaalsContact O-N 3.13Å; P31-C35 PolarHBondContact O-N 3.05Å; P31-C35 PolarHBondContact O-SG 2.91Å; P31-K119 WeakPolarHBondContact CA-O 3.4Å; P31-K119 HydrophobicContact CG-CG 4.38Å
32Y94.9Very high93.5Very high8 Ų865.4 Ų65.43%0.03133%0.326CS..Hα-helixtrans-54.6-44.1-179.2178.4-89.1000112.1I21 E34 C35 K36 V67 K119 H121I21-Y32 HydrophobicContact CG2-CD2 4.02Å; I21-Y32 HydrophobicContact CG2-CE2 3.63Å; Y32-E34 VanDerWaalsContact C-N 3.35Å; Y32-E34 PolarHBondContact O-N 3.05Å; Y32-C35 WeakPolarHBondContact O-CB 3.49Å; Y32-C35 PolarHBondContact O-N 3.28Å; Y32-K36 HydrophobicContact CE1-CD 4.47Å; Y32-K36 WeakPolarHBondContact O-CB 3.47Å; Y32-K36 PolarHBondContact O-N 3.4Å; Y32-V67 HydrophobicContact CE1-CB 4.42Å; Y32-V67 HydrophobicContact CE2-CB 4.12Å; Y32-V67 HydrophobicContact CE2-CG2 3.7Å; Y32-V67 WeakPolarHBondContact OH-CB 3.25Å; Y32-K119 PolarHBondContact N-O 3.24Å; Y32-H121 HydrophobicContact CD1-CB 4.04Å; Y32-H121 AromaticContact CD1-CD2 3.62Å; Y32-H121 HydrophobicContact CD2-CB 4.39Å; Y32-H121 HydrophobicContact CE1-CB 4.45Å; Y32-H121 AromaticContact CE1-CD2 3.69Å; Y32-H121 HydrophobicContact CG-CB 4Å
33D93.4Very high93.4Very high103 Ų10364.4 Ų64.455%0.55132%0.321SS*.Hα-helixtrans-65.3-39.2-179.9-64.8-42.5000111.8P31 K36 Q37P31-D33 VanDerWaalsContact C-N 3.26Å; P31-D33 PolarHBondContact O-N 3.3Å; D33-K36 PolarHBondContact O-N 3.21Å; D33-Q37 VanDerWaalsContact O-CG 3.29Å; D33-Q37 WeakPolarHBondContact O-CG 3.39Å; D33-Q37 PolarHBondContact O-N 2.85Å
34E95.3Very high93.4Very high103 Ų10363.8 Ų63.848%0.48131%0.313SS..Hα-helixtrans-65-43.2174.2-68.2179.9-15800111.4P31 Y32 K36 Q37 C38P31-E34 HydrophobicContact CB-CB 4.33Å; P31-E34 HydrophobicContact CB-CG 4.12Å; P31-E34 WeakPolarHBondContact CD-OE2 3.43Å; P31-E34 HydrophobicContact CG-CG 4.28Å; P31-E34 PolarHBondContact O-N 3.44Å; P31-E34 VanDerWaalsContact O-N 3.13Å; Y32-E34 VanDerWaalsContact C-N 3.35Å; Y32-E34 PolarHBondContact O-N 3.05Å; E34-K36 VanDerWaalsContact C-N 3.32Å; E34-K36 PolarHBondContact O-N 2.98Å; E34-Q37 PolarHBondContact O-N 2.7Å; E34-C38 WeakPolarHBondContact O-CB 3.41Å; E34-C38 PolarHBondContact O-N 3.13Å; E34-C38 PolarHBondContact O-SG 2.98Å
35C95.4Very high93.3Very high1 Ų164.6 Ų64.61%0.00733%0.325CS..Hα-helixtrans-59.5-44.6174.7-69.60000111.1I21 L24 R25 F30 P31 Y32 C38 V39I21-C35 HydrophobicContact CG2-CB 4.04Å; L24-C35 HydrophobicContact CB-CB 4.22Å; R25-C35 VanDerWaalsContact CD-SG 3.54Å; R25-C35 HydrophobicContact CG-CB 4.17Å; F30-C35 PolarHBondContact O-SG 3.26Å; P31-C35 PolarHBondContact O-N 3.05Å; P31-C35 PolarHBondContact O-SG 2.91Å; Y32-C35 WeakPolarHBondContact O-CB 3.49Å; Y32-C35 PolarHBondContact O-N 3.28Å; C35-C38 PolarHBondContact O-N 2.66Å; C35-V39 WeakPolarHBondContact O-CG2 3.32Å; C35-V39 PolarHBondContact O-N 3.5Å; C35-V39 VanDerWaalsContact O-N 3.1Å
36K95.3Very high93.2Very high37 Ų3765.6 Ų65.616%0.16133%0.334CS..Hα-helixtrans-60.1-47175.9179.2175172.9176.90111I21 Y32 D33 E34 C38 V39 I40 T63 I65I21-K36 HydrophobicContact CD1-CB 4.1Å; I21-K36 HydrophobicContact CD1-CG 4.08Å; Y32-K36 HydrophobicContact CE1-CD 4.47Å; Y32-K36 WeakPolarHBondContact O-CB 3.47Å; Y32-K36 PolarHBondContact O-N 3.4Å; D33-K36 PolarHBondContact O-N 3.21Å; E34-K36 VanDerWaalsContact C-N 3.32Å; E34-K36 PolarHBondContact O-N 2.98Å; K36-C38 PolarHBondContact O-N 3.09Å; K36-V39 PolarHBondContact O-N 2.89Å; K36-I40 HydrophobicContact CG-CD1 3.92Å; K36-I40 VanDerWaalsContact O-CG1 3.3Å; K36-I40 WeakPolarHBondContact O-CG1 3.4Å; K36-I40 PolarHBondContact O-N 2.92Å; K36-T63 PolarHBondContact NZ-O 3.26Å; K36-I65 HydrophobicContact CD-CG2 4.48Å; K36-I65 PolarHBondContact NZ-O 3.15Å
37Q95.2Very high93.1Very high105 Ų10564 Ų6449%0.49132%0.317SS..Hα-helixtrans-63.6-40.3177.7-68.8-55.2-29.500112.3D33 E34 V39 I40 M41D33-Q37 VanDerWaalsContact O-CG 3.29Å; D33-Q37 WeakPolarHBondContact O-CG 3.39Å; D33-Q37 PolarHBondContact O-N 2.85Å; E34-Q37 PolarHBondContact O-N 2.7Å; Q37-V39 PolarHBondContact O-N 2.94Å; Q37-I40 WeakPolarHBondContact O-CB 3.46Å; Q37-I40 PolarHBondContact O-N 3.3Å; Q37-M41 VanDerWaalsContact O-CG 3.32Å; Q37-M41 WeakPolarHBondContact O-CG 3.29Å; Q37-M41 PolarHBondContact O-N 3.4Å
38C95.5Very high93.1Very high51 Ų5158.7 Ų58.735%0.34531%0.307SS..Hα-helixtrans-59.4-45.3175.2-73.90000112.2L24 E34 C35 K36 I40 M41 I42L24-C38 HydrophobicContact CD1-CB 3.98Å; E34-C38 WeakPolarHBondContact O-CB 3.41Å; E34-C38 PolarHBondContact O-N 3.13Å; E34-C38 PolarHBondContact O-SG 2.98Å; C35-C38 PolarHBondContact O-N 2.66Å; K36-C38 PolarHBondContact O-N 3.09Å; C38-I40 VanDerWaalsContact C-N 3.34Å; C38-I40 PolarHBondContact O-N 3.49Å; C38-M41 PolarHBondContact O-N 2.77Å; C38-I42 WeakPolarHBondContact O-CD1 3.2Å; C38-I42 VanDerWaalsContact O-CG1 3.26Å; C38-I42 WeakPolarHBondContact O-CG1 3.42Å; C38-I42 PolarHBondContact O-N 2.72Å
39V95.3Very high93.1Very high4 Ų457 Ų572%0.02431%0.314CS..Hα-helixtrans-63.7-42.3176.6-175.20000110.5M20 I21 L24 C35 K36 Q37 M41 I42 V43 L62M20-V39 HydrophobicContact CB-CG1 4.01Å; M20-V39 HydrophobicContact CB-CG2 4.18Å; M20-V39 HydrophobicContact CE-CG1 4.33Å; M20-V39 HydrophobicContact SD-CG1 4.25Å; I21-V39 HydrophobicContact CG1-CB 4.46Å; I21-V39 HydrophobicContact CG1-CG2 3.98Å; L24-V39 HydrophobicContact CD1-CG2 3.55Å; L24-V39 HydrophobicContact CG-CG2 4.43Å; C35-V39 WeakPolarHBondContact O-CG2 3.32Å; C35-V39 PolarHBondContact O-N 3.5Å; C35-V39 VanDerWaalsContact O-N 3.1Å; K36-V39 PolarHBondContact O-N 2.89Å; Q37-V39 PolarHBondContact O-N 2.94Å; V39-M41 PolarHBondContact O-N 3.5Å; V39-I42 PolarHBondContact O-N 3.44Å; V39-V43 HydrophobicContact CG1-CG2 4.25Å; V39-V43 VanDerWaalsContact O-CG2 3.3Å; V39-V43 WeakPolarHBondContact O-CG2 3.35Å; V39-V43 PolarHBondContact O-N 3.06Å; V39-L62 HydrophobicContact CB-CD1 4.41Å; V39-L62 HydrophobicContact CB-CD2 4.38Å; V39-L62 HydrophobicContact CG1-CD1 3.93Å; V39-L62 HydrophobicContact CG1-CD2 3.76Å
40I95.3Very high93.3Very high17 Ų1760.9 Ų60.99%0.08733%0.334CS..Hα-helixtrans-57.6-49.3176.8-70.7167.1000110.6K36 Q37 C38 I42 V43 D44 Y59 L62 T63K36-I40 HydrophobicContact CG-CD1 3.92Å; K36-I40 VanDerWaalsContact O-CG1 3.3Å; K36-I40 WeakPolarHBondContact O-CG1 3.4Å; K36-I40 PolarHBondContact O-N 2.92Å; Q37-I40 WeakPolarHBondContact O-CB 3.46Å; Q37-I40 PolarHBondContact O-N 3.3Å; C38-I40 VanDerWaalsContact C-N 3.34Å; C38-I40 PolarHBondContact O-N 3.49Å; I40-I42 PolarHBondContact O-N 2.92Å; I40-V43 PolarHBondContact O-N 3.22Å; I40-D44 WeakPolarHBondContact O-CB 3.35Å; I40-D44 PolarHBondContact O-N 3.37Å; I40-Y59 HydrophobicContact CG2-CE2 3.91Å; I40-L62 HydrophobicContact CB-CD2 4.35Å; I40-L62 HydrophobicContact CG1-CD2 3.79Å; I40-L62 HydrophobicContact CG1-CG 3.7Å; I40-T63 HydrophobicContact CG2-CG2 4.49Å
41M94.3Very high93Very high130 Ų13064.2 Ų64.264%0.6435%0.351SS*.Hα-helixtrans-62.3-41.7-179.9-71.6176.868.700112.5Q37 C38 V39 A45Q37-M41 VanDerWaalsContact O-CG 3.32Å; Q37-M41 WeakPolarHBondContact O-CG 3.29Å; Q37-M41 PolarHBondContact O-N 3.4Å; C38-M41 PolarHBondContact O-N 2.77Å; V39-M41 PolarHBondContact O-N 3.5Å; M41-A45 VanDerWaalsContact O-CB 3.25Å; M41-A45 WeakPolarHBondContact O-CB 3.36Å; M41-A45 PolarHBondContact O-N 2.92Å
42I93.8Very high92.8Very high108 Ų10865.5 Ų65.555%0.55436%0.355SS*.Hα-helixtrans-65.9-43.8179.4-68.9165.9000110.7C38 V39 I40 A45 A46C38-I42 WeakPolarHBondContact O-CD1 3.2Å; C38-I42 VanDerWaalsContact O-CG1 3.26Å; C38-I42 WeakPolarHBondContact O-CG1 3.42Å; C38-I42 PolarHBondContact O-N 2.72Å; V39-I42 PolarHBondContact O-N 3.44Å; I40-I42 PolarHBondContact O-N 2.92Å; I42-A45 PolarHBondContact O-N 3.01Å; I42-A46 WeakPolarHBondContact O-CB 3.49Å; I42-A46 PolarHBondContact O-N 3.46Å
43V93Very high92.1Very high8 Ų871.3 Ų71.35%0.04839%0.386CS..Hα-helixtrans-67.5-41.1179.1173.50000110.8V39 I40 A46 R47 F58 Y59 L62V39-V43 HydrophobicContact CG1-CG2 4.25Å; V39-V43 VanDerWaalsContact O-CG2 3.3Å; V39-V43 WeakPolarHBondContact O-CG2 3.35Å; V39-V43 PolarHBondContact O-N 3.06Å; I40-V43 PolarHBondContact O-N 3.22Å; V43-A46 PolarHBondContact O-N 3.32Å; V43-R47 WeakPolarHBondContact O-CB 3.31Å; V43-R47 PolarHBondContact O-N 2.92Å; V43-F58 HydrophobicContact CG1-CD1 3.85Å; V43-F58 HydrophobicContact CG1-CE1 4.3Å; V43-F58 HydrophobicContact CG2-CD1 4.07Å; V43-F58 HydrophobicContact CG2-CE1 3.67Å; V43-Y59 HydrophobicContact CG1-CD2 4.24Å; V43-L62 HydrophobicContact CB-CD2 4.07Å; V43-L62 HydrophobicContact CG1-CD2 4.49Å; V43-L62 HydrophobicContact CG2-CD2 3.88Å
44D92.8Very high91.7Very high48 Ų4871.8 Ų71.826%0.25739%0.385SS..Hα-helixtrans-66.2-41.6177.1-164.743.6000112I40 A46 R47 V48 Y59I40-D44 WeakPolarHBondContact O-CB 3.35Å; I40-D44 PolarHBondContact O-N 3.37Å; D44-A46 VanDerWaalsContact C-N 3.32Å; D44-A46 PolarHBondContact O-N 3.32Å; D44-R47 WeakPolarHBondContact O-CB 3.4Å; D44-R47 PolarHBondContact O-N 3.26Å; D44-R47 IonicContact OD1-CZ 3.03Å; D44-R47 IonicContact OD1-NE 2.68Å; D44-R47 PolarHBondContact OD1-NE 3.07Å; D44-R47 IonicContact OD1-NH2 2.87Å; D44-R47 PolarHBondContact OD1-NH2 3.47Å; D44-V48 WeakPolarHBondContact O-CB 3.41Å; D44-V48 WeakPolarHBondContact O-CG2 3.32Å; D44-V48 PolarHBondContact O-N 3.06Å; D44-Y59 HydrophobicContact CB-CD2 4.21Å; D44-Y59 HydrophobicContact CB-CE2 3.69Å
45A91.9Very high91.4Very high54 Ų5469 Ų6945%0.44637%0.373SS..Hα-helixtrans-61.5-41174.300000111.7M41 I42 R47 A49M41-A45 VanDerWaalsContact O-CB 3.25Å; M41-A45 WeakPolarHBondContact O-CB 3.36Å; M41-A45 PolarHBondContact O-N 2.92Å; I42-A45 PolarHBondContact O-N 3.01Å; A45-R47 VanDerWaalsContact C-N 3.34Å; A45-A49 WeakPolarHBondContact O-CA 3.25Å; A45-A49 WeakPolarHBondContact O-CB 3.37Å; A45-A49 PolarHBondContact O-N 3.28Å
46A91.7Very high91Very high22 Ų2272.1 Ų72.118%0.18239%0.388CS..Hα-helixtrans-66.4-36.3175.100000112.4I42 V43 D44 L50 L55I42-A46 WeakPolarHBondContact O-CB 3.49Å; I42-A46 PolarHBondContact O-N 3.46Å; V43-A46 PolarHBondContact O-N 3.32Å; D44-A46 VanDerWaalsContact C-N 3.32Å; D44-A46 PolarHBondContact O-N 3.32Å; A46-L50 HydrophobicContact CB-CD1 4.44Å; A46-L50 WeakPolarHBondContact O-CB 3.47Å; A46-L50 PolarHBondContact O-N 3.31Å; A46-L55 HydrophobicContact CB-CD1 3.77Å
47R91.2Very high90.6Very high59 Ų5973.4 Ų73.422%0.22340%0.4CS..Hα-helixtrans-67.7-50.8177.4-173.9-174.874.782.74.1111.6V43 D44 A45 E51 I52 L55 E56V43-R47 WeakPolarHBondContact O-CB 3.31Å; V43-R47 PolarHBondContact O-N 2.92Å; D44-R47 WeakPolarHBondContact O-CB 3.4Å; D44-R47 PolarHBondContact O-N 3.26Å; D44-R47 IonicContact OD1-CZ 3.03Å; D44-R47 IonicContact OD1-NE 2.68Å; D44-R47 PolarHBondContact OD1-NE 3.07Å; D44-R47 IonicContact OD1-NH2 2.87Å; D44-R47 PolarHBondContact OD1-NH2 3.47Å; A45-R47 VanDerWaalsContact C-N 3.34Å; R47-E51 WeakPolarHBondContact O-CA 3.43Å; R47-E51 PolarHBondContact O-N 3.47Å; R47-I52 PolarHBondContact O-N 3.04Å; R47-L55 HydrophobicContact CB-CB 4.49Å; R47-E56 VanDerWaalsContact CD-OE2 3.24Å; R47-E56 WeakPolarHBondContact CD-OE2 3.25Å; R47-E56 IonicContact CZ-OE2 3.2Å; R47-E56 IonicContact NE-OE2 3.49Å; R47-E56 IonicContact NH1-OE1 3.38Å; R47-E56 IonicContact NH1-OE2 2.94Å; R47-E56 PolarHBondContact NH1-OE2 3.37Å
48V90Very high90.4Very high87 Ų8768.9 Ų68.953%0.52738%0.378SS..Hα-helixtrans-83.4-49.3-173.2179.10000112.3D44D44-V48 WeakPolarHBondContact O-CB 3.41Å; D44-V48 WeakPolarHBondContact O-CG2 3.32Å; D44-V48 PolarHBondContact O-N 3.06Å
49A89.4Confident90.2Very high78 Ų7869 Ų6965%0.64537%0.372SS*.Hα-helixtrans-84-25.2-171.900000113.4A45A45-A49 WeakPolarHBondContact O-CA 3.25Å; A45-A49 WeakPolarHBondContact O-CB 3.37Å; A45-A49 PolarHBondContact O-N 3.28Å
50L89.5Confident89.9Confident121 Ų12173.9 Ų73.963%0.63440%0.395SS*.SBendtrans-106.64.9177.4-52.3176.1000113.1A46 I52A46-L50 HydrophobicContact CB-CD1 4.44Å; A46-L50 WeakPolarHBondContact O-CB 3.47Å; A46-L50 PolarHBondContact O-N 3.31Å; L50-I52 VanDerWaalsContact C-N 3.27Å; L50-I52 HydrophobicContact CB-CD1 4Å; L50-I52 HydrophobicContact CB-CG1 3.92Å; L50-I52 HydrophobicContact CD1-CD1 4.32Å; L50-I52 PolarHBondContact O-N 3.29Å
51E86.5Confident89.7Confident165 Ų16575.1 Ų75.177%0.77140%0.403SS*.  trans53.440.3177.6-58.7-18017300113.3R47 D53R47-E51 WeakPolarHBondContact O-CA 3.43Å; R47-E51 PolarHBondContact O-N 3.47Å; E51-D53 PolarHBondContact O-N 3.34Å
52I88.3Confident89.6Confident67 Ų6769 Ų6934%0.34437%0.373SS..  trans-93.275179.2-48.6177.2000109.9R47 L50 Q54 L55R47-I52 PolarHBondContact O-N 3.04Å; L50-I52 VanDerWaalsContact C-N 3.27Å; L50-I52 HydrophobicContact CB-CD1 4Å; L50-I52 HydrophobicContact CB-CG1 3.92Å; L50-I52 HydrophobicContact CD1-CD1 4.32Å; L50-I52 PolarHBondContact O-N 3.29Å; I52-Q54 PolarHBondContact O-N 2.98Å; I52-L55 HydrophobicContact CB-CD1 4.08Å; I52-L55 HydrophobicContact CB-CG 4.31Å; I52-L55 HydrophobicContact CG2-CD1 4.06Å; I52-L55 HydrophobicContact CG2-CG 3.88Å; I52-L55 WeakPolarHBondContact O-CB 3.44Å; I52-L55 PolarHBondContact O-N 3.47Å
53D81.8Confident89.5Confident130 Ų13066.3 Ų66.370%0.69536%0.361SS*.G310 helixtrans-55.6-25.8-177.9-66.1-26.5000114E51 L55 E56E51-D53 PolarHBondContact O-N 3.34Å; D53-L55 PolarHBondContact O-N 3Å; D53-L55 VanDerWaalsContact O-N 3.07Å; D53-E56 WeakPolarHBondContact O-CB 3.42Å; D53-E56 PolarHBondContact O-N 3.29Å; D53-E56 VanDerWaalsContact O-N 3.08Å
54Q84.9Confident89.4Confident112 Ų11273.8 Ų73.852%0.52339%0.393SS..G310 helixtrans-63.5-13.8178.1-61.4178.416.800113.4Y6 I52Y6-Q54 VanDerWaalsContact CD1-OE1 3.25Å; I52-Q54 PolarHBondContact O-N 2.98Å
55L87.6Confident89.3Confident45 Ų4572 Ų7224%0.23638%0.384CS..G310 helixtrans-85.1-11.2176.2-66177.8000113.5A46 R47 I52 D53 F58 Y59A46-L55 HydrophobicContact CB-CD1 3.77Å; R47-L55 HydrophobicContact CB-CB 4.49Å; I52-L55 HydrophobicContact CB-CD1 4.08Å; I52-L55 HydrophobicContact CB-CG 4.31Å; I52-L55 HydrophobicContact CG2-CD1 4.06Å; I52-L55 HydrophobicContact CG2-CG 3.88Å; I52-L55 WeakPolarHBondContact O-CB 3.44Å; I52-L55 PolarHBondContact O-N 3.47Å; D53-L55 PolarHBondContact O-N 3Å; D53-L55 VanDerWaalsContact O-N 3.07Å; L55-F58 HydrophobicContact CD2-CD1 4.48Å; L55-F58 WeakPolarHBondContact O-CA 3.45Å; L55-F58 WeakPolarHBondContact O-CB 3.5Å; L55-F58 PolarHBondContact O-N 2.83Å; L55-Y59 PolarHBondContact O-N 2.61Å
56E87.1Confident89.2Confident66 Ų6674 Ų7431%0.30839%0.39SS..Hα-helixtrans-54-48.8-178.9-167.170-130.800112.7R47 D53 F58 Y59 E60R47-E56 VanDerWaalsContact CD-OE2 3.24Å; R47-E56 WeakPolarHBondContact CD-OE2 3.25Å; R47-E56 IonicContact CZ-OE2 3.2Å; R47-E56 IonicContact NE-OE2 3.49Å; R47-E56 IonicContact NH1-OE1 3.38Å; R47-E56 IonicContact NH1-OE2 2.94Å; R47-E56 PolarHBondContact NH1-OE2 3.37Å; D53-E56 WeakPolarHBondContact O-CB 3.42Å; D53-E56 PolarHBondContact O-N 3.29Å; D53-E56 VanDerWaalsContact O-N 3.08Å; E56-F58 VanDerWaalsContact C-N 3.25Å; E56-F58 PolarHBondContact O-N 3Å; E56-Y59 WeakPolarHBondContact O-CB 3.49Å; E56-Y59 PolarHBondContact O-N 3.03Å; E56-Y59 VanDerWaalsContact O-N 3.16Å; E56-E60 PolarHBondContact O-N 3.06Å
57P88.5Confident89.1Confident64 Ų6473.7 Ų73.742%0.41639%0.386SS..Hα-helixtrans-63.8-31.9178.1-19.933.7000112.8Y13 V61Y13-P57 HydrophobicContact CE2-CB 4.02Å; P57-V61 WeakPolarHBondContact O-CG2 3.31Å; P57-V61 PolarHBondContact O-N 3.3Å
58F90.5Very high89.1Confident10 Ų1073.4 Ų73.44%0.04439%0.389CS..Hα-helixtrans-71.6-40.5176.7-178.8-121.5000111.5Y13 V16 A17 M20 V43 L55 E56 V61 L62Y13-F58 HydrophobicContact CD1-CB 3.86Å; Y13-F58 AromaticContact CD1-CD2 3.35Å; Y13-F58 HydrophobicContact CD1-CD2 3.35Å; Y13-F58 HydrophobicContact CD1-CE2 4.21Å; Y13-F58 AromaticContact CD1-CG 3.94Å; Y13-F58 HydrophobicContact CD1-CG 3.94Å; Y13-F58 HydrophobicContact CE1-CB 3.84Å; Y13-F58 HydrophobicContact CE1-CD2 4.1Å; Y13-F58 HydrophobicContact CE1-CG 4.26Å; Y13-F58 HydrophobicContact CG-CB 4.34Å; Y13-F58 AromaticContact CG-CD2 3.85Å; Y13-F58 HydrophobicContact CG-CD2 3.85Å; Y13-F58 WeakPolarHBondContact O-CE2 3.44Å; V16-F58 HydrophobicContact CB-CE2 4.25Å; V16-F58 HydrophobicContact CG1-CE2 4.15Å; V16-F58 HydrophobicContact CG1-CZ 4.17Å; A17-F58 HydrophobicContact CB-CE2 3.78Å; A17-F58 HydrophobicContact CB-CZ 4.04Å; M20-F58 HydrophobicContact SD-CE1 4.08Å; M20-F58 HydrophobicContact SD-CZ 3.8Å; V43-F58 HydrophobicContact CG1-CD1 3.85Å; V43-F58 HydrophobicContact CG1-CE1 4.3Å; V43-F58 HydrophobicContact CG2-CD1 4.07Å; V43-F58 HydrophobicContact CG2-CE1 3.67Å; L55-F58 HydrophobicContact CD2-CD1 4.48Å; L55-F58 WeakPolarHBondContact O-CA 3.45Å; L55-F58 WeakPolarHBondContact O-CB 3.5Å; L55-F58 PolarHBondContact O-N 2.83Å; E56-F58 VanDerWaalsContact C-N 3.25Å; E56-F58 PolarHBondContact O-N 3Å; F58-V61 PolarHBondContact O-N 3.15Å; F58-L62 VanDerWaalsContact O-CB 3.28Å; F58-L62 WeakPolarHBondContact O-CB 3.48Å; F58-L62 PolarHBondContact O-N 2.74Å
59Y90.9Very high89.1Confident54 Ų5471.3 Ų71.321%0.21238%0.377CS..Hα-helixtrans-61.6-45.1176.6179.1-100.8000111.7I40 V43 D44 L55 E56 V61 L62 T63I40-Y59 HydrophobicContact CG2-CE2 3.91Å; V43-Y59 HydrophobicContact CG1-CD2 4.24Å; D44-Y59 HydrophobicContact CB-CD2 4.21Å; D44-Y59 HydrophobicContact CB-CE2 3.69Å; L55-Y59 PolarHBondContact O-N 2.61Å; E56-Y59 WeakPolarHBondContact O-CB 3.49Å; E56-Y59 PolarHBondContact O-N 3.03Å; E56-Y59 VanDerWaalsContact O-N 3.16Å; Y59-V61 VanDerWaalsContact C-N 3.32Å; Y59-V61 PolarHBondContact O-N 2.94Å; Y59-L62 PolarHBondContact O-N 3.05Å; Y59-T63 HydrophobicContact CD1-CG2 4.42Å; Y59-T63 HydrophobicContact CD2-CG2 4.48Å; Y59-T63 HydrophobicContact CE1-CG2 3.98Å; Y59-T63 HydrophobicContact CE2-CG2 4.06Å; Y59-T63 WeakPolarHBondContact O-CG2 3.4Å; Y59-T63 PolarHBondContact O-N 3.28Å; Y59-T63 PolarHBondContact O-OG1 2.88Å
60E89.2Confident89Confident107 Ų10772.9 Ų72.950%0.537%0.371SS..Hα-helixtrans-60-39.9175.6-70.9-171.2165.600112.8E56 T63E56-E60 PolarHBondContact O-N 3.06Å; E60-T63 PolarHBondContact O-OG1 3.49Å
61V91.7Very high89Confident43 Ų4372.7 Ų72.726%0.26137%0.37SS..Hα-helixtrans-68.3-43.6175.6171.20000111S14 P57 F58 Y59 T63 K64 I65S14-V61 WeakPolarHBondContact OG-CG1 3.4Å; P57-V61 WeakPolarHBondContact O-CG2 3.31Å; P57-V61 PolarHBondContact O-N 3.3Å; F58-V61 PolarHBondContact O-N 3.15Å; Y59-V61 VanDerWaalsContact C-N 3.32Å; Y59-V61 PolarHBondContact O-N 2.94Å; V61-T63 PolarHBondContact O-N 3.37Å; V61-K64 PolarHBondContact O-N 2.68Å; V61-I65 PolarHBondContact O-N 3.45Å
62L91.6Very high89.3Confident0 Ų065.1 Ų65.10%034%0.336CS..Hα-helixtrans-64.4-40.3-176.8179.366.5000112.5A17 I21 V39 I40 V43 F58 Y59 K64 I65A17-L62 HydrophobicContact CB-CD1 3.65Å; I21-L62 HydrophobicContact CD1-CD1 4.39Å; V39-L62 HydrophobicContact CB-CD1 4.41Å; V39-L62 HydrophobicContact CB-CD2 4.38Å; V39-L62 HydrophobicContact CG1-CD1 3.93Å; V39-L62 HydrophobicContact CG1-CD2 3.76Å; I40-L62 HydrophobicContact CB-CD2 4.35Å; I40-L62 HydrophobicContact CG1-CD2 3.79Å; I40-L62 HydrophobicContact CG1-CG 3.7Å; V43-L62 HydrophobicContact CB-CD2 4.07Å; V43-L62 HydrophobicContact CG1-CD2 4.49Å; V43-L62 HydrophobicContact CG2-CD2 3.88Å; F58-L62 VanDerWaalsContact O-CB 3.28Å; F58-L62 WeakPolarHBondContact O-CB 3.48Å; F58-L62 PolarHBondContact O-N 2.74Å; Y59-L62 PolarHBondContact O-N 3.05Å; L62-K64 VanDerWaalsContact C-N 3.28Å; L62-K64 PolarHBondContact O-N 3.25Å; L62-I65 HydrophobicContact CD1-CG2 4.42Å; L62-I65 VanDerWaalsContact O-CG2 3.24Å; L62-I65 WeakPolarHBondContact O-CG2 3.34Å; L62-I65 PolarHBondContact O-N 2.9Å
63T90.9Very high89.6Confident52 Ų5263.4 Ų63.432%0.31933%0.328SS..Hα-helixtrans-63.4-36.6178.252.50000112K36 I40 Y59 E60 V61K36-T63 PolarHBondContact NZ-O 3.26Å; I40-T63 HydrophobicContact CG2-CG2 4.49Å; Y59-T63 HydrophobicContact CD1-CG2 4.42Å; Y59-T63 HydrophobicContact CD2-CG2 4.48Å; Y59-T63 HydrophobicContact CE1-CG2 3.98Å; Y59-T63 HydrophobicContact CE2-CG2 4.06Å; Y59-T63 WeakPolarHBondContact O-CG2 3.4Å; Y59-T63 PolarHBondContact O-N 3.28Å; Y59-T63 PolarHBondContact O-OG1 2.88Å; E60-T63 PolarHBondContact O-OG1 3.49Å; V61-T63 PolarHBondContact O-N 3.37Å
64K91.3Very high90.2Very high166 Ų16657.3 Ų57.372%0.72230%0.295SS*.THydrogen-bonded Turntrans-92.11.2-178.7-64174.1-174.7167.60114.1V61 L62 T66V61-K64 PolarHBondContact O-N 2.68Å; L62-K64 VanDerWaalsContact C-N 3.28Å; L62-K64 PolarHBondContact O-N 3.25Å; K64-T66 PolarHBondContact O-N 3.01Å
65I91.3Very high90.7Very high10 Ų1054.2 Ų54.25%0.05128%0.28CS..PPolyproline II helixtrans-68.9136.8-171.3-157.3156000112.7S14 A17 R18 I21 K36 V61 L62S14-I65 WeakPolarHBondContact O-CD1 3.42Å; A17-I65 HydrophobicContact CB-CD1 3.38Å; R18-I65 HydrophobicContact CG-CD1 3.66Å; R18-I65 HydrophobicContact CG-CG1 4.2Å; I21-I65 HydrophobicContact CD1-CG2 4.03Å; K36-I65 HydrophobicContact CD-CG2 4.48Å; K36-I65 PolarHBondContact NZ-O 3.15Å; V61-I65 PolarHBondContact O-N 3.45Å; L62-I65 HydrophobicContact CD1-CG2 4.42Å; L62-I65 VanDerWaalsContact O-CG2 3.24Å; L62-I65 WeakPolarHBondContact O-CG2 3.34Å; L62-I65 PolarHBondContact O-N 2.9Å
66T89.5Confident91Very high96 Ų9655.5 Ų55.559%0.58929%0.293SS*.PPolyproline II helixtrans-101.8148.7169.856.40000110.4R18 K64R18-T66 PolarHBondContact NE-O 3.21Å; K64-T66 PolarHBondContact O-N 3.01Å
67V90Very high91.4Very high16 Ų1655.6 Ų55.610%0.09729%0.291CS..PPolyproline II helixtrans-65.5143.1175.172.60000109.9Y32 T69 C72 H121 V124Y32-V67 HydrophobicContact CE1-CB 4.42Å; Y32-V67 HydrophobicContact CE2-CB 4.12Å; Y32-V67 HydrophobicContact CE2-CG2 3.7Å; Y32-V67 WeakPolarHBondContact OH-CB 3.25Å; V67-T69 HydrophobicContact CG1-CG2 4.2Å; V67-C72 HydrophobicContact CG2-CB 4.37Å; V67-H121 HydrophobicContact CB-CB 4.44Å; V67-H121 HydrophobicContact CG1-CB 4.04Å; V67-H121 WeakPolarHBondContact CG1-ND1 3.45Å; V67-V124 HydrophobicContact CB-CG2 4.43Å; V67-V124 HydrophobicContact CG1-CG2 3.82Å; V67-V124 HydrophobicContact CG2-CG2 3.72Å
68D90.5Very high91.7Very high52 Ų5252.6 Ų52.628%0.27827%0.271SS..  trans-82.6114.9164.5-166.8-41.3000107.8E70 D71 C72D68-E70 PolarHBondContact O-N 2.91Å; D68-E70 PolarHBondContact OD1-N 3.41Å; D68-E70 VanDerWaalsContact OD1-N 3.15Å; D68-D71 PolarHBondContact OD1-N 2.9Å; D68-C72 VanDerWaalsContact O-CB 3.31Å; D68-C72 WeakPolarHBondContact O-CB 3.41Å; D68-C72 PolarHBondContact O-SG 3.46Å; D68-C72 VanDerWaalsContact O-SG 3.33Å
69T90.6Very high91.9Very high43 Ų4354.6 Ų54.626%0.26429%0.287SS..SBendtrans-72.4-17.7-17251.30000113.8V67 F75 D123 V124V67-T69 HydrophobicContact CG1-CG2 4.2Å; T69-F75 WeakPolarHBondContact O-CD2 3.43Å; T69-F75 WeakPolarHBondContact O-CG 3.47Å; T69-D123 HydrophobicContact CG2-CB 3.72Å; T69-V124 HydrophobicContact CG2-CG2 4.4Å
70E87.6Confident92.2Very high111 Ų11158.9 Ų58.952%0.51931%0.306SS..SBendtrans-111.4-38.2-176-63-175.8171.500111.4D68 C72 F75 K127D68-E70 PolarHBondContact O-N 2.91Å; D68-E70 PolarHBondContact OD1-N 3.41Å; D68-E70 VanDerWaalsContact OD1-N 3.15Å; E70-C72 PolarHBondContact O-N 3.18Å; E70-F75 WeakPolarHBondContact O-CD1 3.23Å; E70-K127 WeakPolarHBondContact OE1-CE 3.49Å; E70-K127 IonicContact OE1-NZ 3.61Å; E70-K127 PolarHBondContact OE1-NZ 3.33Å
71D89Confident92.4Very high117 Ų11753.9 Ų53.963%0.62628%0.283SS*.SBendtrans-10264.3176.6-168.523.8000111.4D68D68-D71 PolarHBondContact OD1-N 2.9Å
72C92.3Very high92.6Very high7 Ų752 Ų525%0.04727%0.272CS..SBendtrans-138.5158.3170.2720000112.9D22 V67 D68 E70 D74 F75 S76D22-C72 WeakPolarHBondContact OD2-CA 3.41Å; V67-C72 HydrophobicContact CG2-CB 4.37Å; D68-C72 VanDerWaalsContact O-CB 3.31Å; D68-C72 WeakPolarHBondContact O-CB 3.41Å; D68-C72 PolarHBondContact O-SG 3.46Å; D68-C72 VanDerWaalsContact O-SG 3.33Å; E70-C72 PolarHBondContact O-N 3.18Å; C72-D74 VanDerWaalsContact C-N 3.27Å; C72-D74 PolarHBondContact O-N 3.29Å; C72-F75 PolarHBondContact O-N 3.4Å; C72-F75 PolarHBondContact SG-N 3.49Å; C72-F75 VanDerWaalsContact SG-N 3.43Å; C72-S76 PolarHBondContact O-N 3.01Å; C72-S76 PolarHBondContact O-OG 3.23Å
73V94Very high92.8Very high30 Ų3052.9 Ų52.918%0.18228%0.28CS..Hα-helixtrans-59.7-37.6-179.669.50000112.6D22 R25 S76 R77D22-V73 HydrophobicContact CB-CB 4.41Å; D22-V73 HydrophobicContact CB-CG1 4.11Å; D22-V73 PolarHBondContact OD2-N 3.32Å; D22-V73 VanDerWaalsContact OD2-N 3.11Å; R25-V73 HydrophobicContact CB-CG1 3.85Å; V73-S76 PolarHBondContact O-N 3.05Å; V73-R77 HydrophobicContact CG2-CG 4.42Å; V73-R77 VanDerWaalsContact O-CG 3.31Å; V73-R77 WeakPolarHBondContact O-CG 3.3Å; V73-R77 PolarHBondContact O-N 3.04Å
74D95.2Very high93Very high2 Ų252.4 Ų52.41%0.01128%0.276CS..Hα-helixtrans-69-39.1-177.5-75-23.1000111.7R25 C72 S76 R77 F78 L116 A120 V124R25-D74 IonicContact CZ-OD1 3.69Å; R25-D74 IonicContact CZ-OD2 3.01Å; R25-D74 IonicContact NE-OD1 2.94Å; R25-D74 PolarHBondContact NE-OD1 3.5Å; R25-D74 IonicContact NE-OD2 3.48Å; R25-D74 PolarHBondContact NE-OD2 3.35Å; R25-D74 VanDerWaalsContact NH2-CG 3.29Å; R25-D74 IonicContact NH2-OD1 3.47Å; R25-D74 PolarHBondContact NH2-OD1 2.98Å; R25-D74 IonicContact NH2-OD2 3.05Å; R25-D74 PolarHBondContact NH2-OD2 2.9Å; C72-D74 VanDerWaalsContact C-N 3.27Å; C72-D74 PolarHBondContact O-N 3.29Å; D74-S76 VanDerWaalsContact C-N 3.34Å; D74-S76 PolarHBondContact O-N 3.23Å; D74-R77 PolarHBondContact O-N 3.35Å; D74-F78 VanDerWaalsContact O-CD2 3.25Å; D74-F78 WeakPolarHBondContact O-CD2 3.41Å; D74-F78 PolarHBondContact O-N 3.24Å; D74-L116 HydrophobicContact CB-CD2 4.49Å; D74-A120 HydrophobicContact CB-CB 3.95Å; D74-V124 HydrophobicContact CB-CG1 4.04Å
75F95.1Very high93.1Very high47 Ų4744.7 Ų44.721%0.20624%0.243CC..Hα-helixtrans-62.5-42.4174.9-175-96.4000111.7T69 E70 C72 F78 S79 V124 K127 A128T69-F75 WeakPolarHBondContact O-CD2 3.43Å; T69-F75 WeakPolarHBondContact O-CG 3.47Å; E70-F75 WeakPolarHBondContact O-CD1 3.23Å; C72-F75 PolarHBondContact O-N 3.4Å; C72-F75 PolarHBondContact SG-N 3.49Å; C72-F75 VanDerWaalsContact SG-N 3.43Å; F75-F78 PolarHBondContact O-N 2.97Å; F75-S79 WeakPolarHBondContact O-CB 3.45Å; F75-S79 PolarHBondContact O-N 3.01Å; F75-S79 PolarHBondContact O-OG 3.28Å; F75-V124 HydrophobicContact CB-CG1 3.96Å; F75-K127 HydrophobicContact CE2-CG 4.03Å; F75-A128 HydrophobicContact CD2-CB 3.94Å; F75-A128 HydrophobicContact CE2-CB 4Å
76S95Very high93.3Very high72 Ų7244.5 Ų44.550%0.50324%0.242SC..Hα-helixtrans-63.6-41.6176.6-61.20000111.7C72 V73 D74 S79 K80C72-S76 PolarHBondContact O-N 3.01Å; C72-S76 PolarHBondContact O-OG 3.23Å; V73-S76 PolarHBondContact O-N 3.05Å; D74-S76 VanDerWaalsContact C-N 3.34Å; D74-S76 PolarHBondContact O-N 3.23Å; S76-S79 PolarHBondContact O-N 3.43Å; S76-K80 PolarHBondContact O-N 3.22Å
77R95Very high93.4Very high69 Ų6944.3 Ų44.326%0.2624%0.238SC..Hα-helixtrans-65.3-41.9175.9-71.9175.870.4-172.12112D29 V73 D74 C81 L116D29-R77 IonicContact OD1-CZ 3.73Å; D29-R77 IonicContact OD1-NH1 3.64Å; D29-R77 PolarHBondContact OD1-NH1 2.96Å; D29-R77 IonicContact OD1-NH2 3.75Å; D29-R77 PolarHBondContact OD1-NH2 3.13Å; V73-R77 HydrophobicContact CG2-CG 4.42Å; V73-R77 VanDerWaalsContact O-CG 3.31Å; V73-R77 WeakPolarHBondContact O-CG 3.3Å; V73-R77 PolarHBondContact O-N 3.04Å; D74-R77 PolarHBondContact O-N 3.35Å; R77-C81 WeakPolarHBondContact O-CB 3.37Å; R77-C81 PolarHBondContact O-N 3.18Å; R77-L116 HydrophobicContact CB-CD1 3.83Å; R77-L116 HydrophobicContact CB-CD2 3.82Å; R77-L116 HydrophobicContact CB-CG 4.45Å
78F95.5Very high93.4Very high0 Ų044.1 Ų44.10%024%0.237CC..Hα-helixtrans-59.8-50.2173.2-88.9-66.9000111.1D74 F75 K80 C81 L82 L113 L116 T117 A120 V124 A128 L129D74-F78 VanDerWaalsContact O-CD2 3.25Å; D74-F78 WeakPolarHBondContact O-CD2 3.41Å; D74-F78 PolarHBondContact O-N 3.24Å; F75-F78 PolarHBondContact O-N 2.97Å; F78-K80 VanDerWaalsContact C-N 3.3Å; F78-K80 PolarHBondContact O-N 3.17Å; F78-C81 PolarHBondContact O-N 2.77Å; F78-L82 HydrophobicContact CB-CD1 4.44Å; F78-L82 HydrophobicContact CD1-CD1 4.38Å; F78-L82 VanDerWaalsContact O-CB 3.28Å; F78-L82 WeakPolarHBondContact O-CB 3.45Å; F78-L82 VanDerWaalsContact O-CG 3.27Å; F78-L82 WeakPolarHBondContact O-CG 3.38Å; F78-L82 PolarHBondContact O-N 2.79Å; F78-L113 HydrophobicContact CD1-CD1 4Å; F78-L113 HydrophobicContact CE1-CD1 3.89Å; F78-L116 HydrophobicContact CB-CD1 4.49Å; F78-L116 HydrophobicContact CD1-CB 4.09Å; F78-L116 HydrophobicContact CD1-CD1 3.97Å; F78-L116 HydrophobicContact CD2-CB 4.3Å; F78-L116 HydrophobicContact CD2-CD1 4.39Å; F78-L116 HydrophobicContact CE1-CB 3.6Å; F78-L116 HydrophobicContact CE1-CD1 4.33Å; F78-L116 HydrophobicContact CE2-CB 3.84Å; F78-L116 HydrophobicContact CG-CB 4.42Å; F78-L116 HydrophobicContact CG-CD1 4Å; F78-L116 HydrophobicContact CZ-CB 3.47Å; F78-L116 VanDerWaalsContact CZ-CB 3.47Å; F78-T117 HydrophobicContact CE1-CG2 4.29Å; F78-T117 HydrophobicContact CZ-CG2 4.37Å; F78-A120 HydrophobicContact CE2-CB 3.81Å; F78-A120 HydrophobicContact CZ-CB 4.42Å; F78-V124 HydrophobicContact CD2-CG1 4.34Å; F78-A128 HydrophobicContact CB-CB 3.59Å; F78-A128 HydrophobicContact CD1-CB 4.39Å; F78-A128 HydrophobicContact CD2-CB 3.93Å; F78-A128 HydrophobicContact CG-CB 3.75Å; F78-L129 HydrophobicContact CD1-CD2 4.4Å; F78-L129 HydrophobicContact CE1-CD2 4.16Å; F78-L129 HydrophobicContact CE1-CG 4.33Å
79S94.8Very high93.4Very high53 Ų5341.7 Ų41.737%0.37122%0.224SC..Hα-helixtrans-58.7-43.8-177.7-59.40000111.6F75 S76 G83F75-S79 WeakPolarHBondContact O-CB 3.45Å; F75-S79 PolarHBondContact O-N 3.01Å; F75-S79 PolarHBondContact O-OG 3.28Å; S76-S79 PolarHBondContact O-N 3.43Å; S79-G83 PolarHBondContact O-N 2.62Å
80K95.4Very high93.4Very high143 Ų14342.3 Ų42.362%0.62223%0.226SC*.Hα-helixtrans-62.8-57.1175.1-176.9-178.7177.2-169.40111.2S76 F78 L82 G83 D84S76-K80 PolarHBondContact O-N 3.22Å; F78-K80 VanDerWaalsContact C-N 3.3Å; F78-K80 PolarHBondContact O-N 3.17Å; K80-L82 VanDerWaalsContact C-N 3.34Å; K80-L82 PolarHBondContact O-N 3.21Å; K80-G83 WeakPolarHBondContact O-CA 3.46Å; K80-G83 PolarHBondContact O-N 3.26Å; K80-G83 VanDerWaalsContact O-N 3.11Å; K80-D84 WeakPolarHBondContact CE-OD2 3.4Å; K80-D84 WeakPolarHBondContact CG-OD2 3.45Å; K80-D84 PolarHBondContact O-N 3.41Å
81C95.1Very high93.4Very high3 Ų340.2 Ų40.22%0.0222%0.218CC..Hα-helixtrans-59.5-42.1-175.5174.10000113R77 F78 L85 N109 T112R77-C81 WeakPolarHBondContact O-CB 3.37Å; R77-C81 PolarHBondContact O-N 3.18Å; F78-C81 PolarHBondContact O-N 2.77Å; C81-L85 WeakPolarHBondContact O-CD1 3.45Å; C81-L85 VanDerWaalsContact O-CG 3.27Å; C81-L85 WeakPolarHBondContact O-CG 3.48Å; C81-L85 PolarHBondContact O-N 3.48Å; C81-L85 VanDerWaalsContact O-N 3.16Å; C81-N109 PolarHBondContact SG-O 3.5Å; C81-T112 HydrophobicContact CB-CG2 4.32Å
82L95.4Very high93.1Very high3 Ų334.9 Ų34.92%0.01619%0.191CC..Hα-helixtrans-71.6-35.4177.4-67.7171.4000111.6F78 K80 S86 L113 L129 H136F78-L82 HydrophobicContact CB-CD1 4.44Å; F78-L82 HydrophobicContact CD1-CD1 4.38Å; F78-L82 VanDerWaalsContact O-CB 3.28Å; F78-L82 WeakPolarHBondContact O-CB 3.45Å; F78-L82 VanDerWaalsContact O-CG 3.27Å; F78-L82 WeakPolarHBondContact O-CG 3.38Å; F78-L82 PolarHBondContact O-N 2.79Å; K80-L82 VanDerWaalsContact C-N 3.34Å; K80-L82 PolarHBondContact O-N 3.21Å; L82-S86 WeakPolarHBondContact O-CB 3.25Å; L82-S86 PolarHBondContact O-N 2.97Å; L82-S86 PolarHBondContact O-OG 3.31Å; L82-L113 HydrophobicContact CD2-CD1 3.75Å; L82-L113 HydrophobicContact CD2-CD2 4.1Å; L82-L113 HydrophobicContact CG-CD1 4.36Å; L82-L129 HydrophobicContact CD1-CD2 4.16Å; L82-L129 HydrophobicContact CD2-CD2 4.44Å; L82-H136 HydrophobicContact CB-CB 3.98Å; L82-H136 HydrophobicContact CD1-CB 4.2Å; L82-H136 HydrophobicContact CD2-CB 4Å; L82-H136 HydrophobicContact CG-CB 4.28Å
83G95.3Very high92.7Very high18 Ų1840 Ų4019%0.18622%0.215CC..Hα-helixtrans-60.4-56172.500000111.2S79 K80 L85 S86 D87S79-G83 PolarHBondContact O-N 2.62Å; K80-G83 WeakPolarHBondContact O-CA 3.46Å; K80-G83 PolarHBondContact O-N 3.26Å; K80-G83 VanDerWaalsContact O-N 3.11Å; G83-L85 VanDerWaalsContact C-N 3.28Å; G83-L85 PolarHBondContact O-N 2.7Å; G83-S86 WeakPolarHBondContact O-CA 3.21Å; G83-S86 WeakPolarHBondContact O-CB 3.42Å; G83-S86 PolarHBondContact O-N 2.9Å; G83-D87 PolarHBondContact O-N 2.99Å
84D94.9Very high91.9Very high42 Ų4245.8 Ų45.823%0.22524%0.239CC..Hα-helixtrans-56.6-41.3-179.4-60-12.3000111.3K80 D87 A88 N109K80-D84 WeakPolarHBondContact CE-OD2 3.4Å; K80-D84 WeakPolarHBondContact CG-OD2 3.45Å; K80-D84 PolarHBondContact O-N 3.41Å; D84-D87 PolarHBondContact O-N 3.38Å; D84-A88 WeakPolarHBondContact O-CB 3.37Å; D84-A88 PolarHBondContact O-N 2.88Å; D84-N109 VanDerWaalsContact CB-ND2 3.35Å; D84-N109 WeakPolarHBondContact CB-ND2 3.39Å
85L94.2Very high90.9Very high4 Ų453.4 Ų53.42%0.02127%0.268CS..Hα-helixtrans-67.5-37.3174.7-72167.9000113.1C81 G83 V89 I106 N109 L110 L113 L140 L143C81-L85 WeakPolarHBondContact O-CD1 3.45Å; C81-L85 VanDerWaalsContact O-CG 3.27Å; C81-L85 WeakPolarHBondContact O-CG 3.48Å; C81-L85 PolarHBondContact O-N 3.48Å; C81-L85 VanDerWaalsContact O-N 3.16Å; G83-L85 VanDerWaalsContact C-N 3.28Å; G83-L85 PolarHBondContact O-N 2.7Å; L85-V89 VanDerWaalsContact O-CG2 3.28Å; L85-V89 WeakPolarHBondContact O-CG2 3.47Å; L85-V89 PolarHBondContact O-N 3.23Å; L85-I106 HydrophobicContact CD2-CG2 3.97Å; L85-N109 HydrophobicContact CD1-CB 4.12Å; L85-N109 HydrophobicContact CD2-CB 3.78Å; L85-N109 HydrophobicContact CG-CB 3.76Å; L85-L110 HydrophobicContact CD1-CD2 3.98Å; L85-L110 HydrophobicContact CD2-CD2 4.13Å; L85-L110 HydrophobicContact CD2-CG 4.12Å; L85-L113 HydrophobicContact CD1-CD2 4.1Å; L85-L140 HydrophobicContact CD1-CD2 3.96Å; L85-L143 HydrophobicContact CD2-CD2 4.23Å
86S94.1Very high89.4Confident6 Ų656.1 Ų56.14%0.04229%0.293CS..Hα-helixtrans-67.6-41.2177.6-560000110.6L82 G83 V89 L90 H136 Y139L82-S86 WeakPolarHBondContact O-CB 3.25Å; L82-S86 PolarHBondContact O-N 2.97Å; L82-S86 PolarHBondContact O-OG 3.31Å; G83-S86 WeakPolarHBondContact O-CA 3.21Å; G83-S86 WeakPolarHBondContact O-CB 3.42Å; G83-S86 PolarHBondContact O-N 2.9Å; S86-V89 PolarHBondContact O-N 3.49Å; S86-L90 WeakPolarHBondContact O-CG 3.29Å; S86-L90 PolarHBondContact O-N 2.93Å; S86-H136 PolarHBondContact OG-ND1 2.93Å; S86-Y139 VanDerWaalsContact CB-CD2 3.48Å; S86-Y139 WeakPolarHBondContact OG-CD2 3.46Å
87D92.5Very high88Confident93 Ų9361.5 Ų61.550%0.49730%0.302SS..Hα-helixtrans-65.8-44.1177.9-69.2-16.2000111G83 D84 V89 L90 D91G83-D87 PolarHBondContact O-N 2.99Å; D84-D87 PolarHBondContact O-N 3.38Å; D87-V89 VanDerWaalsContact C-N 3.26Å; D87-V89 PolarHBondContact O-N 3.37Å; D87-L90 PolarHBondContact O-N 3.3Å; D87-L90 VanDerWaalsContact O-N 3.14Å; D87-D91 WeakPolarHBondContact O-CB 3.43Å; D87-D91 PolarHBondContact O-N 3.14Å
88A90.7Very high87Confident11 Ų1158.8 Ų58.89%0.09129%0.294CS..Hα-helixtrans-57.2-39.4174.600000112.5D84 G92 I106D84-A88 WeakPolarHBondContact O-CB 3.37Å; D84-A88 PolarHBondContact O-N 2.88Å; A88-G92 PolarHBondContact O-N 2.92Å; A88-I106 HydrophobicContact CB-CD1 4.17Å; A88-I106 HydrophobicContact CB-CG1 4.03Å
89V90.4Very high86.2Confident1 Ų159.3 Ų59.31%0.00630%0.297CS..Hα-helixtrans-67.6-45.7175.8171.40000111.5L85 S86 D87 D91 G92 Q93 Y139 L142 L143 M146L85-V89 VanDerWaalsContact O-CG2 3.28Å; L85-V89 WeakPolarHBondContact O-CG2 3.47Å; L85-V89 PolarHBondContact O-N 3.23Å; S86-V89 PolarHBondContact O-N 3.49Å; D87-V89 VanDerWaalsContact C-N 3.26Å; D87-V89 PolarHBondContact O-N 3.37Å; V89-D91 VanDerWaalsContact C-N 3.33Å; V89-D91 PolarHBondContact O-N 3.34Å; V89-G92 PolarHBondContact O-N 3.2Å; V89-Q93 WeakPolarHBondContact O-CG 3.47Å; V89-Q93 PolarHBondContact O-N 3.28Å; V89-Y139 HydrophobicContact CB-CD1 4.4Å; V89-Y139 HydrophobicContact CG1-CD1 3.93Å; V89-L142 HydrophobicContact CG1-CB 4.13Å; V89-L142 HydrophobicContact CG1-CD2 3.38Å; V89-L142 HydrophobicContact CG1-CG 3.71Å; V89-L143 HydrophobicContact CG2-CB 3.56Å; V89-L143 HydrophobicContact CG2-CD1 3.91Å; V89-L143 HydrophobicContact CG2-CD2 4.31Å; V89-L143 HydrophobicContact CG2-CG 4.11Å; V89-M146 HydrophobicContact CG1-SD 4Å
90L90.5Very high85.2Confident56 Ų5661.5 Ų61.529%0.29330%0.297SS..Hα-helixtrans-62.4-41.8178.9-72.7170.8000111.7S86 D87 Q93 Q94 Y139S86-L90 WeakPolarHBondContact O-CG 3.29Å; S86-L90 PolarHBondContact O-N 2.93Å; D87-L90 PolarHBondContact O-N 3.3Å; D87-L90 VanDerWaalsContact O-N 3.14Å; L90-Q93 PolarHBondContact O-N 3.37Å; L90-Q94 WeakPolarHBondContact O-CG 3.33Å; L90-Q94 PolarHBondContact O-N 3.09Å; L90-Y139 HydrophobicContact CD2-CE1 3.81Å; L90-Y139 HydrophobicContact CG-CE1 4.07Å
91D87.2Confident84.4Confident67 Ų6761.1 Ų61.136%0.35830%0.303SS..Hα-helixtrans-66.1-42.5175.3-86.35.7000111.1D87 V89 Q93 Q94 R95D87-D91 WeakPolarHBondContact O-CB 3.43Å; D87-D91 PolarHBondContact O-N 3.14Å; V89-D91 VanDerWaalsContact C-N 3.33Å; V89-D91 PolarHBondContact O-N 3.34Å; D91-Q93 VanDerWaalsContact C-N 3.32Å; D91-Q93 PolarHBondContact O-N 2.89Å; D91-Q94 CarbonylContact O-C 3.59Å; D91-Q94 PolarHBondContact O-N 3.43Å; D91-R95 PolarHBondContact O-N 2.96Å
92G82.8Confident84Confident6 Ų663.4 Ų63.46%0.06232%0.315CS..Hα-helixtrans-62.2-34.9175.900000113.8A88 V89 Q94 R95 S98A88-G92 PolarHBondContact O-N 2.92Å; V89-G92 PolarHBondContact O-N 3.2Å; G92-Q94 PolarHBondContact O-N 3.35Å; G92-R95 CarbonylContact O-C 3.44Å; G92-R95 PolarHBondContact O-N 3.49Å; G92-S98 WeakPolarHBondContact CA-OG 3.36Å; G92-S98 PolarHBondContact N-OG 3.17Å
93Q82.7Confident83.5Confident115 Ų11566 Ų6654%0.53733%0.327SS..Hα-helixtrans-66.5-28.8173.9-74.7-161.6-40.900112.6V89 L90 D91 L142 M146V89-Q93 WeakPolarHBondContact O-CG 3.47Å; V89-Q93 PolarHBondContact O-N 3.28Å; L90-Q93 PolarHBondContact O-N 3.37Å; D91-Q93 VanDerWaalsContact C-N 3.32Å; D91-Q93 PolarHBondContact O-N 2.89Å; Q93-L142 HydrophobicContact CG-CD2 4.31Å; Q93-M146 HydrophobicContact CG-CE 4.02Å; Q93-M146 HydrophobicContact CG-SD 3.93Å
94Q78.7Confident83.3Confident150 Ų15073.2 Ų73.270%0.70136%0.355SS*.Hα-helixtrans-88.4-29.8178-64.7-179.727.300112.4L90 D91 G92L90-Q94 WeakPolarHBondContact O-CG 3.33Å; L90-Q94 PolarHBondContact O-N 3.09Å; D91-Q94 CarbonylContact O-C 3.59Å; D91-Q94 PolarHBondContact O-N 3.43Å; G92-Q94 PolarHBondContact O-N 3.35Å
95R72.9Confident83.2Confident163 Ų16376.3 Ų76.362%0.61537%0.369SS*.  trans-133.5105-173.7-59.8-178.5-173.7169.47.1109.7D91 G92 W97 S98D91-R95 PolarHBondContact O-N 2.96Å; G92-R95 CarbonylContact O-C 3.44Å; G92-R95 PolarHBondContact O-N 3.49Å; R95-W97 PolarHBondContact O-N 3.39Å; R95-S98 PolarHBondContact O-N 2.91Å; R95-S98 VanDerWaalsContact O-N 3.14Å; R95-S98 PolarHBondContact O-OG 3.24Å
96S65.1Low83.1Confident104 Ų10476.2 Ų76.273%0.72737%0.368SS*.THydrogen-bonded Turntrans-55.9-15.9-172.8-40.40000115.9
97W65Low83Confident184 Ų18478 Ų7870%0.69738%0.377SS*.THydrogen-bonded Turntrans-109.8-9.6-175.7-58.496.2000114.9R95 L99 Y100R95-W97 PolarHBondContact O-N 3.39Å; W97-L99 VanDerWaalsContact C-N 3.26Å; W97-L99 PolarHBondContact O-N 2.88Å; W97-Y100 AromaticContact CE3-CD2 3.89Å; W97-Y100 HydrophobicContact CE3-CD2 3.89Å; W97-Y100 AromaticContact CE3-CE2 3.92Å; W97-Y100 HydrophobicContact CE3-CE2 3.92Å; W97-Y100 HydrophobicContact CZ3-CE2 4.31Å; W97-Y100 WeakPolarHBondContact O-CB 3.48Å; W97-Y100 PolarHBondContact O-N 2.87Å
98S74.7Confident83.1Confident12 Ų1276.9 Ų76.98%0.08438%0.376CS..Hα-helixtrans-64.4-30.2-171.762.30000113.3G92 R95 Y100 D101 D102G92-S98 WeakPolarHBondContact CA-OG 3.36Å; G92-S98 PolarHBondContact N-OG 3.17Å; R95-S98 PolarHBondContact O-N 2.91Å; R95-S98 VanDerWaalsContact O-N 3.14Å; R95-S98 PolarHBondContact O-OG 3.24Å; S98-Y100 PolarHBondContact O-N 3.44Å; S98-D101 PolarHBondContact O-N 3.03Å; S98-D101 VanDerWaalsContact O-N 3.13Å; S98-D102 PolarHBondContact O-N 3.15Å
99L77.2Confident83.3Confident12 Ų1277.2 Ų77.26%0.06338%0.377CS..Hα-helixtrans-62.1-24.9176-63.6-179.4000113.5W97 I106 L143 M146 V147W97-L99 VanDerWaalsContact C-N 3.26Å; W97-L99 PolarHBondContact O-N 2.88Å; L99-I106 HydrophobicContact CD2-CD1 3.73Å; L99-L143 HydrophobicContact CD1-CD1 4.35Å; L99-L143 HydrophobicContact CD2-CD1 4.01Å; L99-M146 HydrophobicContact CD1-CB 3.96Å; L99-M146 HydrophobicContact CD1-CE 3.73Å; L99-M146 HydrophobicContact CG-CE 4.48Å; L99-V147 HydrophobicContact CD1-CG1 4.2Å
100Y74.1Confident83.4Confident98 Ų9877.2 Ų77.238%0.38438%0.376SS..Hα-helixtrans-78-39.1175.4-64.5-87.4000111.5W97 S98 D102 M151W97-Y100 AromaticContact CE3-CD2 3.89Å; W97-Y100 HydrophobicContact CE3-CD2 3.89Å; W97-Y100 AromaticContact CE3-CE2 3.92Å; W97-Y100 HydrophobicContact CE3-CE2 3.92Å; W97-Y100 HydrophobicContact CZ3-CE2 4.31Å; W97-Y100 WeakPolarHBondContact O-CB 3.48Å; W97-Y100 PolarHBondContact O-N 2.87Å; S98-Y100 PolarHBondContact O-N 3.44Å; Y100-D102 VanDerWaalsContact C-N 3.33Å; Y100-M151 HydrophobicContact CD1-CE 3.62Å; Y100-M151 HydrophobicContact CD1-CG 4.44Å; Y100-M151 HydrophobicContact CD1-SD 3.76Å; Y100-M151 HydrophobicContact CE1-CE 4Å; Y100-M151 HydrophobicContact CE1-CG 3.84Å; Y100-M151 HydrophobicContact CE1-SD 3.6Å; Y100-M151 VanDerWaalsContact CE1-SD 3.6Å; Y100-M151 HydrophobicContact CE2-SD 4.43Å; Y100-M151 HydrophobicContact CG-CE 4.18Å; Y100-M151 HydrophobicContact CG-SD 4.24Å
101D79.4Confident83.5Confident136 Ų13678.5 Ų78.573%0.72739%0.387SS*.Hα-helixtrans-70.6-34.6179.9-66.7-25.7000111S98 E103S98-D101 PolarHBondContact O-N 3.03Å; S98-D101 VanDerWaalsContact O-N 3.13Å; D101-E103 VanDerWaalsContact C-N 3.34Å; D101-E103 PolarHBondContact O-N 2.81Å
102D85.4Confident83.8Confident51 Ų5177.1 Ų77.127%0.27338%0.381SS..THydrogen-bonded Turntrans-94.416.8-176.7-57.6-31000113.3S98 Y100 E104 E105 I106S98-D102 PolarHBondContact O-N 3.15Å; Y100-D102 VanDerWaalsContact C-N 3.33Å; D102-E104 PolarHBondContact O-N 3.39Å; D102-E105 PolarHBondContact O-N 2.92Å; D102-E105 VanDerWaalsContact O-N 3.15Å; D102-I106 HydrophobicContact CB-CD1 4.23Å; D102-I106 HydrophobicContact CB-CG1 4.41Å; D102-I106 WeakPolarHBondContact O-CG1 3.33Å; D102-I106 PolarHBondContact O-N 3.24Å
103E86.8Confident84.4Confident58 Ų5876.9 Ų76.927%0.27138%0.378SS..Hα-helixtrans-56.2-50.4-170.9179.4-172.4144.900113.4D101 E105 I106 L107 M151 Q153 F154D101-E103 VanDerWaalsContact C-N 3.34Å; D101-E103 PolarHBondContact O-N 2.81Å; E103-E105 VanDerWaalsContact C-N 3.27Å; E103-E105 PolarHBondContact O-N 3.42Å; E103-I106 PolarHBondContact O-N 3.32Å; E103-L107 HydrophobicContact CG-CD1 4.13Å; E103-L107 WeakPolarHBondContact O-CG 3.33Å; E103-L107 PolarHBondContact O-N 3.43Å; E103-M151 HydrophobicContact CG-CE 4.39Å; E103-Q153 VanDerWaalsContact CD-CD 3.46Å; E103-Q153 PolarHBondContact OE1-NE2 3.39Å; E103-Q153 PolarHBondContact OE1-OE1 3.17Å; E103-Q153 PolarHBondContact OE2-NE2 3.06Å; E103-F154 HydrophobicContact CB-CZ 4.17Å; E103-F154 HydrophobicContact CG-CE1 4.19Å; E103-F154 HydrophobicContact CG-CZ 3.74Å
104E90.2Very high84.8Confident168 Ų16876.1 Ų76.179%0.78537%0.37SS*.Hα-helixtrans-62.6-36.8-179-69.9-169.9169.500111.7D102 S108D102-E104 PolarHBondContact O-N 3.39Å; E104-S108 VanDerWaalsContact O-CB 3.23Å; E104-S108 WeakPolarHBondContact O-CB 3.39Å; E104-S108 PolarHBondContact O-N 3.39Å
105E92.7Very high85.5Confident108 Ų10869.9 Ų69.951%0.50534%0.344SS..Hα-helixtrans-70.1-44.5179.3-177.3162.9-166.600111.2D102 E103 L107 S108 N109D102-E105 PolarHBondContact O-N 2.92Å; D102-E105 VanDerWaalsContact O-N 3.15Å; E103-E105 VanDerWaalsContact C-N 3.27Å; E103-E105 PolarHBondContact O-N 3.42Å; E105-L107 PolarHBondContact O-N 2.94Å; E105-S108 WeakPolarHBondContact O-CB 3.5Å; E105-S108 PolarHBondContact O-N 3.02Å; E105-N109 WeakPolarHBondContact O-CB 3.17Å; E105-N109 PolarHBondContact O-N 3.12Å; E105-N109 PolarHBondContact O-ND2 3.02Å
106I92.1Very high86.5Confident2 Ų262.1 Ų62.11%0.0131%0.314CS..Hα-helixtrans-60.9-46.5175.5-65166.9000110.3L85 A88 L99 D102 E103 S108 N109 L110 L143 F154L85-I106 HydrophobicContact CD2-CG2 3.97Å; A88-I106 HydrophobicContact CB-CD1 4.17Å; A88-I106 HydrophobicContact CB-CG1 4.03Å; L99-I106 HydrophobicContact CD2-CD1 3.73Å; D102-I106 HydrophobicContact CB-CD1 4.23Å; D102-I106 HydrophobicContact CB-CG1 4.41Å; D102-I106 WeakPolarHBondContact O-CG1 3.33Å; D102-I106 PolarHBondContact O-N 3.24Å; E103-I106 PolarHBondContact O-N 3.32Å; I106-S108 VanDerWaalsContact C-N 3.35Å; I106-S108 PolarHBondContact O-N 3.15Å; I106-N109 PolarHBondContact O-N 3.45Å; I106-L110 HydrophobicContact CG2-CD1 3.99Å; I106-L110 HydrophobicContact CG2-CG 4.38Å; I106-L110 WeakPolarHBondContact O-CG 3.32Å; I106-L110 PolarHBondContact O-N 2.99Å; I106-L143 HydrophobicContact CG2-CD2 4.03Å; I106-F154 HydrophobicContact CB-CE1 3.67Å; I106-F154 HydrophobicContact CB-CZ 4.16Å; I106-F154 HydrophobicContact CD1-CZ 4.24Å; I106-F154 HydrophobicContact CG2-CD1 3.77Å; I106-F154 HydrophobicContact CG2-CE1 3.4Å; I106-F154 VanDerWaalsContact CG2-CE1 3.4Å; I106-F154 HydrophobicContact CG2-CZ 4.08Å
107L92.1Very high87.8Confident43 Ų4357.2 Ų57.223%0.22528%0.28CS..Hα-helixtrans-62.7-40.9177.7-74.8174.4000112.3E103 E105 N109 L110 T111 Q153 F154 P157E103-L107 HydrophobicContact CG-CD1 4.13Å; E103-L107 WeakPolarHBondContact O-CG 3.33Å; E103-L107 PolarHBondContact O-N 3.43Å; E105-L107 PolarHBondContact O-N 2.94Å; L107-N109 VanDerWaalsContact C-N 3.34Å; L107-L110 PolarHBondContact O-N 2.84Å; L107-T111 WeakPolarHBondContact O-CB 3.34Å; L107-T111 PolarHBondContact O-N 3.22Å; L107-T111 PolarHBondContact O-OG1 2.99Å; L107-Q153 HydrophobicContact CD1-CG 4.46Å; L107-F154 HydrophobicContact CD2-CD1 3.55Å; L107-F154 HydrophobicContact CD2-CE1 3.87Å; L107-F154 HydrophobicContact CG-CD1 3.92Å; L107-F154 HydrophobicContact CG-CE1 3.67Å; L107-P157 HydrophobicContact CD2-CG 4.15Å
108S93.8Very high89Confident70 Ų7052.4 Ų52.449%0.4927%0.267SS..Hα-helixtrans-61.9-43.1175.5-177.90000111.6E104 E105 I106 T111 T112E104-S108 VanDerWaalsContact O-CB 3.23Å; E104-S108 WeakPolarHBondContact O-CB 3.39Å; E104-S108 PolarHBondContact O-N 3.39Å; E105-S108 WeakPolarHBondContact O-CB 3.5Å; E105-S108 PolarHBondContact O-N 3.02Å; I106-S108 VanDerWaalsContact C-N 3.35Å; I106-S108 PolarHBondContact O-N 3.15Å; S108-T111 PolarHBondContact O-N 3.08Å; S108-T112 WeakPolarHBondContact O-CB 3.32Å; S108-T112 PolarHBondContact O-N 3Å; S108-T112 PolarHBondContact O-OG1 2.73Å
109N95Very high89.9Confident18 Ų1854.8 Ų54.810%0.09628%0.276CS..Hα-helixtrans-66.9-45176.4-76.8-33.9000111.7C81 D84 L85 E105 I106 L107 T111 T112 L113C81-N109 PolarHBondContact SG-O 3.5Å; D84-N109 VanDerWaalsContact CB-ND2 3.35Å; D84-N109 WeakPolarHBondContact CB-ND2 3.39Å; L85-N109 HydrophobicContact CD1-CB 4.12Å; L85-N109 HydrophobicContact CD2-CB 3.78Å; L85-N109 HydrophobicContact CG-CB 3.76Å; E105-N109 WeakPolarHBondContact O-CB 3.17Å; E105-N109 PolarHBondContact O-N 3.12Å; E105-N109 PolarHBondContact O-ND2 3.02Å; I106-N109 PolarHBondContact O-N 3.45Å; L107-N109 VanDerWaalsContact C-N 3.34Å; N109-T111 VanDerWaalsContact C-N 3.29Å; N109-T111 PolarHBondContact O-N 2.63Å; N109-T112 CarbonylContact O-C 3.59Å; N109-T112 WeakPolarHBondContact O-CB 3.17Å; N109-T112 PolarHBondContact O-N 3.36Å; N109-T112 VanDerWaalsContact O-N 3.12Å; N109-L113 WeakPolarHBondContact O-CB 3.16Å; N109-L113 PolarHBondContact O-N 2.71Å
110L94.1Very high90.7Very high0 Ų054.5 Ų54.50%028%0.275CS..Hα-helixtrans-61.1-38.3175.1-68.4173.1000112.4L85 I106 L107 L113 R114 L140 F154 P157 L158L85-L110 HydrophobicContact CD1-CD2 3.98Å; L85-L110 HydrophobicContact CD2-CD2 4.13Å; L85-L110 HydrophobicContact CD2-CG 4.12Å; I106-L110 HydrophobicContact CG2-CD1 3.99Å; I106-L110 HydrophobicContact CG2-CG 4.38Å; I106-L110 WeakPolarHBondContact O-CG 3.32Å; I106-L110 PolarHBondContact O-N 2.99Å; L107-L110 PolarHBondContact O-N 2.84Å; L110-L113 PolarHBondContact O-N 3.38Å; L110-R114 WeakPolarHBondContact O-CB 3.36Å; L110-R114 PolarHBondContact O-N 3.42Å; L110-L140 HydrophobicContact CD2-CD2 4.08Å; L110-F154 HydrophobicContact CD1-CD1 4.15Å; L110-P157 HydrophobicContact CB-CB 3.93Å; L110-P157 HydrophobicContact CD1-CB 3.99Å; L110-L158 HydrophobicContact CD1-CD2 3.95Å; L110-L158 HydrophobicContact CD1-CG 3.84Å; L110-L158 HydrophobicContact CD2-CD2 3.56Å; L110-L158 HydrophobicContact CD2-CG 4.27Å; L110-L158 HydrophobicContact CG-CD2 4.42Å
111T92.6Very high91.6Very high83 Ų8352 Ų5251%0.50927%0.267SS..Hα-helixtrans-64.9-41.6174.6-58.70000111.4L107 S108 N109 S115L107-T111 WeakPolarHBondContact O-CB 3.34Å; L107-T111 PolarHBondContact O-N 3.22Å; L107-T111 PolarHBondContact O-OG1 2.99Å; S108-T111 PolarHBondContact O-N 3.08Å; N109-T111 VanDerWaalsContact C-N 3.29Å; N109-T111 PolarHBondContact O-N 2.63Å; T111-S115 PolarHBondContact O-N 3.24Å
112T93.3Very high92.1Very high39 Ų3947.3 Ų47.324%0.23925%0.247CC..Hα-helixtrans-63.9-46.4175.7-63.70000111C81 S108 N109 R114 S115 L116C81-T112 HydrophobicContact CB-CG2 4.32Å; S108-T112 WeakPolarHBondContact O-CB 3.32Å; S108-T112 PolarHBondContact O-N 3Å; S108-T112 PolarHBondContact O-OG1 2.73Å; N109-T112 CarbonylContact O-C 3.59Å; N109-T112 WeakPolarHBondContact O-CB 3.17Å; N109-T112 PolarHBondContact O-N 3.36Å; N109-T112 VanDerWaalsContact O-N 3.12Å; T112-R114 PolarHBondContact O-N 3.1Å; T112-S115 PolarHBondContact O-N 3.44Å; T112-L116 HydrophobicContact CG2-CD1 3.9Å; T112-L116 HydrophobicContact CG2-CG 4.3Å; T112-L116 VanDerWaalsContact O-CG 3.3Å; T112-L116 WeakPolarHBondContact O-CG 3.47Å; T112-L116 PolarHBondContact O-N 2.94Å
113L94.9Very high92.4Very high0 Ų047.8 Ų47.80%025%0.25CC..Hα-helixtrans-56-51177.2-178.856.4000110.7F78 L82 L85 N109 L110 S115 L116 T117 L129 L140 I165F78-L113 HydrophobicContact CD1-CD1 4Å; F78-L113 HydrophobicContact CE1-CD1 3.89Å; L82-L113 HydrophobicContact CD2-CD1 3.75Å; L82-L113 HydrophobicContact CD2-CD2 4.1Å; L82-L113 HydrophobicContact CG-CD1 4.36Å; L85-L113 HydrophobicContact CD1-CD2 4.1Å; N109-L113 WeakPolarHBondContact O-CB 3.16Å; N109-L113 PolarHBondContact O-N 2.71Å; L110-L113 PolarHBondContact O-N 3.38Å; L113-S115 PolarHBondContact O-N 2.9Å; L113-L116 PolarHBondContact O-N 3.46Å; L113-T117 PolarHBondContact O-N 2.83Å; L113-T117 PolarHBondContact O-OG1 3.39Å; L113-L129 HydrophobicContact CD1-CD2 4.31Å; L113-L140 HydrophobicContact CD2-CD1 3.84Å; L113-L140 HydrophobicContact CD2-CD2 4.2Å; L113-I165 HydrophobicContact CD2-CD1 4.14Å
114R91.5Very high92.8Very high99 Ų9945 Ų4537%0.37424%0.237SC..Hα-helixtrans-53.8-51.3175.2178.6179.7-176.1-1096.9111.8L110 T112 L116 T117 L118 E160 F164L110-R114 WeakPolarHBondContact O-CB 3.36Å; L110-R114 PolarHBondContact O-N 3.42Å; T112-R114 PolarHBondContact O-N 3.1Å; R114-L116 VanDerWaalsContact C-N 3.33Å; R114-L116 PolarHBondContact O-N 3.25Å; R114-T117 WeakPolarHBondContact CA-OG1 3.46Å; R114-T117 PolarHBondContact O-N 2.88Å; R114-T117 PolarHBondContact O-OG1 3.39Å; R114-L118 HydrophobicContact CG-CD1 4.13Å; R114-L118 PolarHBondContact O-N 3.3Å; R114-E160 IonicContact CZ-OE2 3.38Å; R114-E160 VanDerWaalsContact CZ-OE2 3.23Å; R114-E160 IonicContact NE-OE2 2.69Å; R114-E160 PolarHBondContact NE-OE2 3.01Å; R114-E160 IonicContact NH2-OE2 3.83Å; R114-E160 PolarHBondContact NH2-OE2 3.47Å; R114-E160 VanDerWaalsContact NH2-OE2 3.13Å; R114-F164 HydrophobicContact CG-CD2 3.93Å; R114-F164 HydrophobicContact CG-CE2 3.85Å
115S92.7Very high92.9Very high20 Ų2037 Ų3714%0.1420%0.2CC..Hα-helixtrans-58.8-44.8178.5-169.70000111.6D29 T111 T112 L113 L118 K119D29-S115 PolarHBondContact OD2-OG 2.84Å; T111-S115 PolarHBondContact O-N 3.24Å; T112-S115 PolarHBondContact O-N 3.44Å; L113-S115 PolarHBondContact O-N 2.9Å; S115-L118 PolarHBondContact O-N 3.48Å; S115-K119 VanDerWaalsContact O-CB 3.27Å; S115-K119 WeakPolarHBondContact O-CB 3.46Å; S115-K119 VanDerWaalsContact O-CG 3.3Å; S115-K119 WeakPolarHBondContact O-CG 3.11Å; S115-K119 PolarHBondContact O-N 3.27Å; S115-K119 WeakPolarHBondContact OG-CD 3.35Å; S115-K119 WeakPolarHBondContact OG-CE 3.33Å; S115-K119 PolarHBondContact OG-NZ 3.22Å
116L94.4Very high92.9Very high0 Ų037.1 Ų37.10%020%0.196CC..Hα-helixtrans-62.5-49.2178-70.5169.4000111.5D74 R77 F78 T112 L113 R114 L118 K119 A120D74-L116 HydrophobicContact CB-CD2 4.49Å; R77-L116 HydrophobicContact CB-CD1 3.83Å; R77-L116 HydrophobicContact CB-CD2 3.82Å; R77-L116 HydrophobicContact CB-CG 4.45Å; F78-L116 HydrophobicContact CB-CD1 4.49Å; F78-L116 HydrophobicContact CD1-CB 4.09Å; F78-L116 HydrophobicContact CD1-CD1 3.97Å; F78-L116 HydrophobicContact CD2-CB 4.3Å; F78-L116 HydrophobicContact CD2-CD1 4.39Å; F78-L116 HydrophobicContact CE1-CB 3.6Å; F78-L116 HydrophobicContact CE1-CD1 4.33Å; F78-L116 HydrophobicContact CE2-CB 3.84Å; F78-L116 HydrophobicContact CG-CB 4.42Å; F78-L116 HydrophobicContact CG-CD1 4Å; F78-L116 HydrophobicContact CZ-CB 3.47Å; F78-L116 VanDerWaalsContact CZ-CB 3.47Å; T112-L116 HydrophobicContact CG2-CD1 3.9Å; T112-L116 HydrophobicContact CG2-CG 4.3Å; T112-L116 VanDerWaalsContact O-CG 3.3Å; T112-L116 WeakPolarHBondContact O-CG 3.47Å; T112-L116 PolarHBondContact O-N 2.94Å; L113-L116 PolarHBondContact O-N 3.46Å; R114-L116 VanDerWaalsContact C-N 3.33Å; R114-L116 PolarHBondContact O-N 3.25Å; L116-L118 PolarHBondContact O-N 3.21Å; L116-K119 PolarHBondContact O-N 2.75Å; L116-A120 WeakPolarHBondContact O-CB 3.15Å; L116-A120 PolarHBondContact O-N 3.26Å
117T92.2Very high92.9Very high0 Ų041.4 Ų41.40%021%0.214CC..Hα-helixtrans-59.6-34.417625.80000112.6F78 L113 R114 L129 F164 I165 K168F78-T117 HydrophobicContact CE1-CG2 4.29Å; F78-T117 HydrophobicContact CZ-CG2 4.37Å; L113-T117 PolarHBondContact O-N 2.83Å; L113-T117 PolarHBondContact O-OG1 3.39Å; R114-T117 WeakPolarHBondContact CA-OG1 3.46Å; R114-T117 PolarHBondContact O-N 2.88Å; R114-T117 PolarHBondContact O-OG1 3.39Å; T117-L129 HydrophobicContact CG2-CD1 3.75Å; T117-F164 HydrophobicContact CG2-CB 4.41Å; T117-I165 HydrophobicContact CG2-CG1 3.81Å; T117-K168 HydrophobicContact CG2-CG 4.3Å; T117-K168 WeakPolarHBondContact O-CE 3.38Å; T117-K168 PolarHBondContact O-NZ 3.32Å
118L90.7Very high93Very high84 Ų8439.8 Ų39.844%0.4421%0.207SC..Hα-helixtrans-74.3-41.4178.3-80.1167.1000112.6R114 S115 L116 F164R114-L118 HydrophobicContact CG-CD1 4.13Å; R114-L118 PolarHBondContact O-N 3.3Å; S115-L118 PolarHBondContact O-N 3.48Å; L116-L118 PolarHBondContact O-N 3.21Å; L118-F164 HydrophobicContact CD1-CE1 4.32Å; L118-F164 HydrophobicContact CD1-CE2 4.25Å; L118-F164 HydrophobicContact CD1-CZ 4.06Å; L118-F164 HydrophobicContact CD2-CD1 3.69Å; L118-F164 HydrophobicContact CD2-CE1 3.43Å; L118-F164 VanDerWaalsContact CD2-CE1 3.43Å; L118-F164 HydrophobicContact CD2-CG 4.47Å; L118-F164 HydrophobicContact CD2-CZ 4.01Å; L118-F164 HydrophobicContact CG-CD1 4.09Å; L118-F164 HydrophobicContact CG-CE1 4.04Å; L118-F164 HydrophobicContact CG-CG 4.4Å; L118-F164 HydrophobicContact CG-CZ 4.26Å
119K93.3Very high92.9Very high61 Ų6136.4 Ų36.427%0.26518%0.183SC..Hα-helixtrans-107.9-23.4-162.1-59.8-175.7-170.7175.50114.6D29 P31 Y32 S115 L116D29-K119 WeakPolarHBondContact O-CD 3.32Å; D29-K119 WeakPolarHBondContact O-CE 3.33Å; D29-K119 PolarHBondContact O-NZ 3.08Å; D29-K119 IonicContact OD2-NZ 2.74Å; D29-K119 PolarHBondContact OD2-NZ 2.88Å; P31-K119 WeakPolarHBondContact CA-O 3.4Å; P31-K119 HydrophobicContact CG-CG 4.38Å; Y32-K119 PolarHBondContact N-O 3.24Å; S115-K119 VanDerWaalsContact O-CB 3.27Å; S115-K119 WeakPolarHBondContact O-CB 3.46Å; S115-K119 VanDerWaalsContact O-CG 3.3Å; S115-K119 WeakPolarHBondContact O-CG 3.11Å; S115-K119 PolarHBondContact O-N 3.27Å; S115-K119 WeakPolarHBondContact OG-CD 3.35Å; S115-K119 WeakPolarHBondContact OG-CE 3.33Å; S115-K119 PolarHBondContact OG-NZ 3.22Å; L116-K119 PolarHBondContact O-N 2.75Å
120A94.2Very high92.8Very high6 Ų637.6 Ų37.65%0.0519%0.193CC..SBendtrans-73.6159.3179.800000111.2D74 F78 L116D74-A120 HydrophobicContact CB-CB 3.95Å; F78-A120 HydrophobicContact CE2-CB 3.81Å; F78-A120 HydrophobicContact CZ-CB 4.42Å; L116-A120 WeakPolarHBondContact O-CB 3.15Å; L116-A120 PolarHBondContact O-N 3.26Å
121H93Very high92.5Very high45 Ų4538.8 Ų38.821%0.20821%0.205CC..  trans-59.1142.7174.3-167.4-94.8000111Y32 V67 D123 V124 S125Y32-H121 HydrophobicContact CD1-CB 4.04Å; Y32-H121 AromaticContact CD1-CD2 3.62Å; Y32-H121 HydrophobicContact CD2-CB 4.39Å; Y32-H121 HydrophobicContact CE1-CB 4.45Å; Y32-H121 AromaticContact CE1-CD2 3.69Å; Y32-H121 HydrophobicContact CG-CB 4Å; V67-H121 HydrophobicContact CB-CB 4.44Å; V67-H121 HydrophobicContact CG1-CB 4.04Å; V67-H121 WeakPolarHBondContact CG1-ND1 3.45Å; H121-D123 VanDerWaalsContact C-N 3.33Å; H121-D123 IonicContact CE1-OD2 3.8Å; H121-D123 PolarHBondContact CE1-OD2 2.82Å; H121-D123 PolarHBondContact ND1-N 3.15Å; H121-D123 IonicContact ND1-OD2 3.34Å; H121-D123 PolarHBondContact O-N 3.42Å; H121-V124 HydrophobicContact CB-CB 4.43Å; H121-V124 HydrophobicContact CB-CG2 4.01Å; H121-V124 PolarHBondContact O-N 3.1Å; H121-S125 PolarHBondContact O-N 3.31Å; H121-S125 PolarHBondContact O-OG 2.71Å; H121-S125 VanDerWaalsContact O-OG 3.09Å
122A90.2Very high92.2Very high38 Ų3841 Ų4131%0.31421%0.214SC..Hα-helixtrans-60.1-41.1-174.500000112.6S125 R126A122-S125 PolarHBondContact O-N 3.01Å; A122-R126 WeakPolarHBondContact O-CB 3.33Å; A122-R126 WeakPolarHBondContact O-CG 3.4Å; A122-R126 PolarHBondContact O-N 3.43Å
123D91.6Very high92Very high61 Ų6147.6 Ų47.633%0.32624%0.242SC..Hα-helixtrans-67.1-36.6178.5-65.2-42.2000112.9T69 H121 R126 K127T69-D123 HydrophobicContact CG2-CB 3.72Å; H121-D123 VanDerWaalsContact C-N 3.33Å; H121-D123 IonicContact CE1-OD2 3.8Å; H121-D123 PolarHBondContact CE1-OD2 2.82Å; H121-D123 PolarHBondContact ND1-N 3.15Å; H121-D123 IonicContact ND1-OD2 3.34Å; H121-D123 PolarHBondContact O-N 3.42Å; D123-R126 PolarHBondContact O-N 3.47Å; D123-R126 IonicContact OD1-CZ 3.55Å; D123-R126 IonicContact OD1-NH1 2.74Å; D123-R126 PolarHBondContact OD1-NH1 2.99Å; D123-R126 IonicContact OD1-NH2 2.72Å; D123-R126 PolarHBondContact OD1-NH2 3.03Å; D123-K127 WeakPolarHBondContact O-CB 3.36Å; D123-K127 PolarHBondContact O-N 3.43Å
124V94.4Very high91.9Very high1 Ų148.3 Ų48.31%0.00625%0.245CC..Hα-helixtrans-65.4-47.5176.4176.70000109.7V67 T69 D74 F75 F78 H121 R126 K127 A128V67-V124 HydrophobicContact CB-CG2 4.43Å; V67-V124 HydrophobicContact CG1-CG2 3.82Å; V67-V124 HydrophobicContact CG2-CG2 3.72Å; T69-V124 HydrophobicContact CG2-CG2 4.4Å; D74-V124 HydrophobicContact CB-CG1 4.04Å; F75-V124 HydrophobicContact CB-CG1 3.96Å; F78-V124 HydrophobicContact CD2-CG1 4.34Å; H121-V124 HydrophobicContact CB-CB 4.43Å; H121-V124 HydrophobicContact CB-CG2 4.01Å; H121-V124 PolarHBondContact O-N 3.1Å; V124-R126 VanDerWaalsContact C-N 3.35Å; V124-R126 PolarHBondContact O-N 3.31Å; V124-K127 PolarHBondContact O-N 3.01Å; V124-A128 WeakPolarHBondContact O-CB 3.49Å; V124-A128 PolarHBondContact O-N 3.47Å
125S93.2Very high91.9Very high0 Ų046.2 Ų46.20%024%0.241CC..Hα-helixtrans-58.6-48.3176.3-54.50000110.4H121 A122 K127 A128 L129H121-S125 PolarHBondContact O-N 3.31Å; H121-S125 PolarHBondContact O-OG 2.71Å; H121-S125 VanDerWaalsContact O-OG 3.09Å; A122-S125 PolarHBondContact O-N 3.01Å; S125-K127 PolarHBondContact O-N 3.06Å; S125-A128 PolarHBondContact O-N 2.8Å; S125-L129 VanDerWaalsContact O-CB 3.23Å; S125-L129 WeakPolarHBondContact O-CB 3.21Å; S125-L129 VanDerWaalsContact O-CD1 3.31Å; S125-L129 WeakPolarHBondContact O-CD1 3.49Å; S125-L129 WeakPolarHBondContact O-CG 3.42Å; S125-L129 PolarHBondContact O-N 2.99Å
126R92Very high91.9Very high110 Ų11047.3 Ų47.342%0.41524%0.243SC..Hα-helixtrans-58-48.8178.4-82.2-169.3-96.7115.33.3111.9A122 D123 V124 S130 K168 L169A122-R126 WeakPolarHBondContact O-CB 3.33Å; A122-R126 WeakPolarHBondContact O-CG 3.4Å; A122-R126 PolarHBondContact O-N 3.43Å; D123-R126 PolarHBondContact O-N 3.47Å; D123-R126 IonicContact OD1-CZ 3.55Å; D123-R126 IonicContact OD1-NH1 2.74Å; D123-R126 PolarHBondContact OD1-NH1 2.99Å; D123-R126 IonicContact OD1-NH2 2.72Å; D123-R126 PolarHBondContact OD1-NH2 3.03Å; V124-R126 VanDerWaalsContact C-N 3.35Å; V124-R126 PolarHBondContact O-N 3.31Å; R126-S130 VanDerWaalsContact O-CB 3.25Å; R126-S130 WeakPolarHBondContact O-CB 3.35Å; R126-S130 PolarHBondContact O-N 3.17Å; R126-S130 PolarHBondContact O-OG 3.12Å; R126-K168 WeakPolarHBondContact CD-O 3.41Å; R126-K168 WeakPolarHBondContact CG-O 3.29Å; R126-L169 HydrophobicContact CB-CD2 4.18Å; R126-L169 HydrophobicContact CG-CD2 3.95Å
127K92.5Very high91.9Very high92 Ų9247.4 Ų47.440%0.424%0.244SC..Hα-helixtrans-63.2-45.2179.9-179.369.1177.2-153.10112.2E70 F75 D123 V124 S125E70-K127 WeakPolarHBondContact OE1-CE 3.49Å; E70-K127 IonicContact OE1-NZ 3.61Å; E70-K127 PolarHBondContact OE1-NZ 3.33Å; F75-K127 HydrophobicContact CE2-CG 4.03Å; D123-K127 WeakPolarHBondContact O-CB 3.36Å; D123-K127 PolarHBondContact O-N 3.43Å; V124-K127 PolarHBondContact O-N 3.01Å; S125-K127 PolarHBondContact O-N 3.06Å
128A93.2Very high92Very high8 Ų855.1 Ų55.17%0.06627%0.273CS..Hα-helixtrans-68-42.3-17900000112.5F75 F78 V124 S125F75-A128 HydrophobicContact CD2-CB 3.94Å; F75-A128 HydrophobicContact CE2-CB 4Å; F78-A128 HydrophobicContact CB-CB 3.59Å; F78-A128 HydrophobicContact CD1-CB 4.39Å; F78-A128 HydrophobicContact CD2-CB 3.93Å; F78-A128 HydrophobicContact CG-CB 3.75Å; V124-A128 WeakPolarHBondContact O-CB 3.49Å; V124-A128 PolarHBondContact O-N 3.47Å; S125-A128 PolarHBondContact O-N 2.8Å
129L92.7Very high92.1Very high0 Ų053.6 Ų53.60%026%0.262CS..Hα-helixtrans-78.6-27.4-175.4-63.7165.2000113.3F78 L82 L113 T117 S125 G131 I165 K168 L169F78-L129 HydrophobicContact CD1-CD2 4.4Å; F78-L129 HydrophobicContact CE1-CD2 4.16Å; F78-L129 HydrophobicContact CE1-CG 4.33Å; L82-L129 HydrophobicContact CD1-CD2 4.16Å; L82-L129 HydrophobicContact CD2-CD2 4.44Å; L113-L129 HydrophobicContact CD1-CD2 4.31Å; T117-L129 HydrophobicContact CG2-CD1 3.75Å; S125-L129 VanDerWaalsContact O-CB 3.23Å; S125-L129 WeakPolarHBondContact O-CB 3.21Å; S125-L129 VanDerWaalsContact O-CD1 3.31Å; S125-L129 WeakPolarHBondContact O-CD1 3.49Å; S125-L129 WeakPolarHBondContact O-CG 3.42Å; S125-L129 PolarHBondContact O-N 2.99Å; L129-G131 VanDerWaalsContact C-N 3.31Å; L129-I165 HydrophobicContact CB-CG2 4.43Å; L129-I165 HydrophobicContact CD1-CB 4.39Å; L129-I165 HydrophobicContact CD1-CG1 4.13Å; L129-I165 HydrophobicContact CD1-CG2 4.03Å; L129-I165 HydrophobicContact CD2-CD1 4.1Å; L129-I165 HydrophobicContact CD2-CG1 3.89Å; L129-I165 HydrophobicContact CD2-CG2 4.16Å; L129-I165 HydrophobicContact CG-CG2 4.43Å; L129-K168 HydrophobicContact CD1-CB 4.37Å; L129-L169 HydrophobicContact CB-CD1 3.72Å; L129-L169 HydrophobicContact CB-CD2 4.02Å; L129-L169 HydrophobicContact CB-CG 4.13Å
130S91.6Very high92.2Very high43 Ų4350.9 Ų50.930%0.30125%0.25SC..THydrogen-bonded Turntrans-85.3-0.7176.261.30000114.3R126 N132R126-S130 VanDerWaalsContact O-CB 3.25Å; R126-S130 WeakPolarHBondContact O-CB 3.35Å; R126-S130 PolarHBondContact O-N 3.17Å; R126-S130 PolarHBondContact O-OG 3.12Å; S130-N132 PolarHBondContact O-N 3.03Å
131G87.7Confident92.1Very high24 Ų2450.9 Ų50.925%0.24725%0.249CC..Hα-helixtrans-53.5135.9-179.400000112.8L129 E133 F134 I135L129-G131 VanDerWaalsContact C-N 3.31Å; G131-E133 PolarHBondContact O-N 2.8Å; G131-F134 PolarHBondContact O-N 3.47Å; G131-I135 PolarHBondContact O-N 3.32Å
132N87.7Confident92Very high131 Ų13150.3 Ų50.370%0.70125%0.248SC*.Hα-helixtrans47.352.6177.5-62.2-24.7000113.6S130 F134 I135S130-N132 PolarHBondContact O-N 3.03Å; N132-F134 VanDerWaalsContact C-N 3.33Å; N132-F134 PolarHBondContact O-N 2.87Å; N132-I135 HydrophobicContact CB-CB 4.08Å; N132-I135 HydrophobicContact CB-CG2 3.73Å; N132-I135 WeakPolarHBondContact O-CB 3.4Å; N132-I135 PolarHBondContact O-N 2.68Å
133E88.4Confident92.1Very high176 Ų17648.5 Ų48.582%0.82223%0.233SC*.Hα-helixtrans56.644.9177.8-56.8-178.6166.200112.8G131 I135G131-E133 PolarHBondContact O-N 2.8Å; E133-I135 VanDerWaalsContact C-N 3.32Å; E133-I135 PolarHBondContact O-N 2.92Å
134F92.1Very high92Very high16 Ų1645.6 Ų45.67%0.0722%0.217CC..Hα-helixtrans64.928.9178.8-49.2-65.9000114.5G131 N132 H136 I137 R138 L169 Q172 L173 Y176G131-F134 PolarHBondContact O-N 3.47Å; N132-F134 VanDerWaalsContact C-N 3.33Å; N132-F134 PolarHBondContact O-N 2.87Å; F134-H136 VanDerWaalsContact C-N 3.26Å; F134-H136 PolarHBondContact O-N 2.86Å; F134-I137 HydrophobicContact CB-CB 4.19Å; F134-I137 HydrophobicContact CB-CD1 4.08Å; F134-I137 HydrophobicContact CB-CG1 4.35Å; F134-I137 HydrophobicContact CD1-CD1 3.67Å; F134-I137 HydrophobicContact CG-CD1 4.25Å; F134-I137 PolarHBondContact O-N 3Å; F134-R138 PolarHBondContact O-N 3.42Å; F134-L169 HydrophobicContact CD1-CD1 3.93Å; F134-L169 HydrophobicContact CE1-CD1 3.64Å; F134-Q172 HydrophobicContact CE2-CG 4.17Å; F134-Q172 HydrophobicContact CZ-CG 3.82Å; F134-L173 HydrophobicContact CD1-CD1 4.19Å; F134-L173 HydrophobicContact CE1-CD1 4.42Å; F134-L173 HydrophobicContact CG-CD1 4.41Å; F134-Y176 HydrophobicContact CB-CE1 4.5Å; F134-Y176 HydrophobicContact CD2-CD2 4.1Å; F134-Y176 HydrophobicContact CD2-CG 4.16Å
135I93Very high91.7Very high55 Ų5548.8 Ų48.828%0.28223%0.232SC..Hα-helixtrans-53-42.8-177.7-162.4172.5000112.8G131 N132 E133 I137 R138 Y139G131-I135 PolarHBondContact O-N 3.32Å; N132-I135 HydrophobicContact CB-CB 4.08Å; N132-I135 HydrophobicContact CB-CG2 3.73Å; N132-I135 WeakPolarHBondContact O-CB 3.4Å; N132-I135 PolarHBondContact O-N 2.68Å; E133-I135 VanDerWaalsContact C-N 3.32Å; E133-I135 PolarHBondContact O-N 2.92Å; I135-I137 VanDerWaalsContact C-N 3.32Å; I135-I137 PolarHBondContact O-N 2.98Å; I135-R138 VanDerWaalsContact O-CB 3.31Å; I135-R138 WeakPolarHBondContact O-CB 3.24Å; I135-R138 PolarHBondContact O-N 3.11Å; I135-Y139 HydrophobicContact CD1-CE2 4.11Å; I135-Y139 HydrophobicContact CG1-CD2 4.24Å; I135-Y139 HydrophobicContact CG1-CE2 3.69Å; I135-Y139 WeakPolarHBondContact O-CD2 3.31Å; I135-Y139 PolarHBondContact O-N 3.13Å; I135-Y139 VanDerWaalsContact O-N 3.11Å
136H92.6Very high91.4Very high43 Ų4351.3 Ų51.320%0.19924%0.244CC..Hα-helixtrans-69.9-32.9-179.4-60.9-61.9000112L82 S86 F134 R138 Y139 L140L82-H136 HydrophobicContact CB-CB 3.98Å; L82-H136 HydrophobicContact CD1-CB 4.2Å; L82-H136 HydrophobicContact CD2-CB 4Å; L82-H136 HydrophobicContact CG-CB 4.28Å; S86-H136 PolarHBondContact OG-ND1 2.93Å; F134-H136 VanDerWaalsContact C-N 3.26Å; F134-H136 PolarHBondContact O-N 2.86Å; H136-R138 VanDerWaalsContact C-N 3.34Å; H136-Y139 PolarHBondContact O-N 3.3Å; H136-L140 WeakPolarHBondContact O-CG 3.46Å; H136-L140 PolarHBondContact O-N 3.39Å
137I93.2Very high91Very high1 Ų146.1 Ų46.11%0.00523%0.225CC..Hα-helixtrans-70.4-36.9175.8-53.3177.8000110.1F134 I135 Y139 L140 I141 L162 I165 L169 L173 L177F134-I137 HydrophobicContact CB-CB 4.19Å; F134-I137 HydrophobicContact CB-CD1 4.08Å; F134-I137 HydrophobicContact CB-CG1 4.35Å; F134-I137 HydrophobicContact CD1-CD1 3.67Å; F134-I137 HydrophobicContact CG-CD1 4.25Å; F134-I137 PolarHBondContact O-N 3Å; I135-I137 VanDerWaalsContact C-N 3.32Å; I135-I137 PolarHBondContact O-N 2.98Å; I137-Y139 VanDerWaalsContact C-N 3.28Å; I137-Y139 PolarHBondContact O-N 2.81Å; I137-L140 WeakPolarHBondContact O-CB 3.31Å; I137-L140 PolarHBondContact O-N 3.12Å; I137-L140 VanDerWaalsContact O-N 3.14Å; I137-I141 HydrophobicContact CG2-CD1 4.33Å; I137-I141 WeakPolarHBondContact O-CG1 3.28Å; I137-I141 PolarHBondContact O-N 3.09Å; I137-L162 HydrophobicContact CG2-CD2 4.15Å; I137-I165 HydrophobicContact CD1-CG2 3.64Å; I137-I165 HydrophobicContact CG1-CG2 4.23Å; I137-L169 HydrophobicContact CD1-CD1 3.51Å; I137-L173 HydrophobicContact CD1-CD1 3.43Å; I137-L173 VanDerWaalsContact CD1-CD1 3.43Å; I137-L173 HydrophobicContact CD1-CD2 4.01Å; I137-L173 HydrophobicContact CD1-CG 4.35Å; I137-L173 HydrophobicContact CG2-CD1 4.13Å; I137-L177 HydrophobicContact CG2-CD2 4.32Å
138R94Very high90.1Very high162 Ų16242.6 Ų42.661%0.61121%0.211SC*.Hα-helixtrans-56.7-44.2170.7-172.4-179.2168-169.1-3.4111.4F134 I135 H136 I141 L142 Y176F134-R138 PolarHBondContact O-N 3.42Å; I135-R138 VanDerWaalsContact O-CB 3.31Å; I135-R138 WeakPolarHBondContact O-CB 3.24Å; I135-R138 PolarHBondContact O-N 3.11Å; H136-R138 VanDerWaalsContact C-N 3.34Å; R138-I141 PolarHBondContact O-N 3.02Å; R138-L142 WeakPolarHBondContact O-CB 3.47Å; R138-L142 PolarHBondContact O-N 3.2Å; R138-Y176 WeakPolarHBondContact CB-OH 3.4Å
139Y93.9Very high89.1Confident52 Ų5244.3 Ų44.320%0.20423%0.23CC..Hα-helixtrans-66.4-35.6175.7-69.3-57.4000112.8S86 V89 L90 I135 H136 I137 L142 L143S86-Y139 VanDerWaalsContact CB-CD2 3.48Å; S86-Y139 WeakPolarHBondContact OG-CD2 3.46Å; V89-Y139 HydrophobicContact CB-CD1 4.4Å; V89-Y139 HydrophobicContact CG1-CD1 3.93Å; L90-Y139 HydrophobicContact CD2-CE1 3.81Å; L90-Y139 HydrophobicContact CG-CE1 4.07Å; I135-Y139 HydrophobicContact CD1-CE2 4.11Å; I135-Y139 HydrophobicContact CG1-CD2 4.24Å; I135-Y139 HydrophobicContact CG1-CE2 3.69Å; I135-Y139 WeakPolarHBondContact O-CD2 3.31Å; I135-Y139 PolarHBondContact O-N 3.13Å; I135-Y139 VanDerWaalsContact O-N 3.11Å; H136-Y139 PolarHBondContact O-N 3.3Å; I137-Y139 VanDerWaalsContact C-N 3.28Å; I137-Y139 PolarHBondContact O-N 2.81Å; Y139-L142 HydrophobicContact CD1-CD2 4.32Å; Y139-L142 PolarHBondContact O-N 3.2Å; Y139-L143 WeakPolarHBondContact O-CB 3.38Å; Y139-L143 PolarHBondContact O-N 3.34Å
140L93.8Very high88.2Confident4 Ų452.8 Ų52.82%0.02126%0.263CS..Hα-helixtrans-63.7-40.2172.7-69.3172.8000112.7L85 L110 L113 H136 I137 L142 L143 Y144 L158 L162 I165L85-L140 HydrophobicContact CD1-CD2 3.96Å; L110-L140 HydrophobicContact CD2-CD2 4.08Å; L113-L140 HydrophobicContact CD2-CD1 3.84Å; L113-L140 HydrophobicContact CD2-CD2 4.2Å; H136-L140 WeakPolarHBondContact O-CG 3.46Å; H136-L140 PolarHBondContact O-N 3.39Å; I137-L140 WeakPolarHBondContact O-CB 3.31Å; I137-L140 PolarHBondContact O-N 3.12Å; I137-L140 VanDerWaalsContact O-N 3.14Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L140-L143 WeakPolarHBondContact O-CB 3.34Å; L140-L143 PolarHBondContact O-N 2.97Å; L140-Y144 PolarHBondContact O-N 3.17Å; L140-L158 HydrophobicContact CD2-CD2 4.18Å; L140-L162 HydrophobicContact CB-CD2 4.35Å; L140-I165 HydrophobicContact CD1-CD1 3.63Å
141I92.6Very high87.5Confident7 Ų751.2 Ų51.24%0.03625%0.251CS..Hα-helixtrans-63.8-44.1174.5-65.2165.2000109.7I137 R138 L143 Y144 Q145 Y176 L177 L182I137-I141 HydrophobicContact CG2-CD1 4.33Å; I137-I141 WeakPolarHBondContact O-CG1 3.28Å; I137-I141 PolarHBondContact O-N 3.09Å; R138-I141 PolarHBondContact O-N 3.02Å; I141-L143 VanDerWaalsContact C-N 3.34Å; I141-L143 PolarHBondContact O-N 3.17Å; I141-Y144 WeakPolarHBondContact O-CB 3.23Å; I141-Y144 PolarHBondContact O-N 3.44Å; I141-Q145 WeakPolarHBondContact O-CG 3.48Å; I141-Q145 PolarHBondContact O-N 3.49Å; I141-Y176 HydrophobicContact CD1-CD1 4.5Å; I141-Y176 HydrophobicContact CD1-CE1 3.87Å; I141-L177 HydrophobicContact CD1-CD2 3.86Å; I141-L177 HydrophobicContact CG1-CD2 4.42Å; I141-L182 HydrophobicContact CG1-CD2 4.5Å; I141-L182 HydrophobicContact CG2-CB 4.22Å
142L91.9Very high87.1Confident33 Ų3354.1 Ų54.117%0.17326%0.255CS..Hα-helixtrans-64.2-40177.5-178.660.9000111.9V89 Q93 R138 Y139 L140 Y144 Q145 M146V89-L142 HydrophobicContact CG1-CB 4.13Å; V89-L142 HydrophobicContact CG1-CD2 3.38Å; V89-L142 HydrophobicContact CG1-CG 3.71Å; Q93-L142 HydrophobicContact CG-CD2 4.31Å; R138-L142 WeakPolarHBondContact O-CB 3.47Å; R138-L142 PolarHBondContact O-N 3.2Å; Y139-L142 HydrophobicContact CD1-CD2 4.32Å; Y139-L142 PolarHBondContact O-N 3.2Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L142-Y144 VanDerWaalsContact C-N 3.32Å; L142-Y144 PolarHBondContact O-N 2.98Å; L142-Q145 WeakPolarHBondContact O-CB 3.47Å; L142-Q145 PolarHBondContact O-N 3.48Å; L142-Q145 VanDerWaalsContact O-N 3.16Å; L142-M146 HydrophobicContact CD1-CG 4.42Å; L142-M146 HydrophobicContact CD1-SD 4.44Å; L142-M146 HydrophobicContact CG-SD 4.04Å; L142-M146 VanDerWaalsContact O-CG 3.28Å; L142-M146 WeakPolarHBondContact O-CG 3.47Å; L142-M146 PolarHBondContact O-N 2.96Å
143L91.8Very high86.8Confident0 Ų051.9 Ų51.90%024%0.24CC..Hα-helixtrans-57.8-47.4172.9-17553.4000110.3L85 V89 L99 I106 Y139 L140 I141 Q145 M146 V147 L158L85-L143 HydrophobicContact CD2-CD2 4.23Å; V89-L143 HydrophobicContact CG2-CB 3.56Å; V89-L143 HydrophobicContact CG2-CD1 3.91Å; V89-L143 HydrophobicContact CG2-CD2 4.31Å; V89-L143 HydrophobicContact CG2-CG 4.11Å; L99-L143 HydrophobicContact CD1-CD1 4.35Å; L99-L143 HydrophobicContact CD2-CD1 4.01Å; I106-L143 HydrophobicContact CG2-CD2 4.03Å; Y139-L143 WeakPolarHBondContact O-CB 3.38Å; Y139-L143 PolarHBondContact O-N 3.34Å; L140-L143 WeakPolarHBondContact O-CB 3.34Å; L140-L143 PolarHBondContact O-N 2.97Å; I141-L143 VanDerWaalsContact C-N 3.34Å; I141-L143 PolarHBondContact O-N 3.17Å; L143-Q145 VanDerWaalsContact C-N 3.29Å; L143-Q145 PolarHBondContact O-N 3.36Å; L143-M146 PolarHBondContact O-N 3.25Å; L143-V147 HydrophobicContact CD1-CG1 3.97Å; L143-V147 WeakPolarHBondContact O-CG1 3.4Å; L143-V147 VanDerWaalsContact O-CG2 3.26Å; L143-V147 WeakPolarHBondContact O-CG2 3.46Å; L143-V147 PolarHBondContact O-N 3.04Å; L143-L158 HydrophobicContact CB-CD2 4.49Å; L143-L158 HydrophobicContact CD2-CD2 3.92Å; L143-L158 HydrophobicContact CG-CD1 4.2Å; L143-L158 HydrophobicContact CG-CD2 4.24Å
144Y90.5Very high86.6Confident0 Ų043.5 Ų43.50%020%0.201CC..Hα-helixtrans-55.4-44.8175.2-175.6-93.9000112L140 I141 L142 C148 H155 L158 K159 L182 Q185 V186 D189L140-Y144 PolarHBondContact O-N 3.17Å; I141-Y144 WeakPolarHBondContact O-CB 3.23Å; I141-Y144 PolarHBondContact O-N 3.44Å; L142-Y144 VanDerWaalsContact C-N 3.32Å; L142-Y144 PolarHBondContact O-N 2.98Å; Y144-C148 WeakPolarHBondContact O-CB 3.16Å; Y144-C148 PolarHBondContact O-N 3.41Å; Y144-C148 VanDerWaalsContact O-N 3.13Å; Y144-H155 AromaticContact CE2-ND1 3.84Å; Y144-L158 HydrophobicContact CD2-CB 4.2Å; Y144-L158 HydrophobicContact CD2-CD1 4.18Å; Y144-K159 HydrophobicContact CE2-CD 4.44Å; Y144-K159 HydrophobicContact CE2-CG 3.99Å; Y144-K159 PolarHBondContact OH-NZ 2.93Å; Y144-L182 HydrophobicContact CD1-CD1 3.79Å; Y144-L182 HydrophobicContact CE1-CD1 4.23Å; Y144-L182 HydrophobicContact CG-CD1 4.19Å; Y144-Q185 HydrophobicContact CD1-CG 4.12Å; Y144-Q185 HydrophobicContact CE1-CB 4.37Å; Y144-Q185 HydrophobicContact CE1-CG 3.72Å; Y144-V186 HydrophobicContact CE1-CG2 3.95Å; Y144-D189 PolarHBondContact OH-OD2 3.35Å
145Q87.8Confident86.1Confident67 Ų6743 Ų4331%0.31320%0.199SC..Hα-helixtrans-64.1-42177.6-67.6178.7-48.300112.6I141 L142 L143 C148 S181I141-Q145 WeakPolarHBondContact O-CG 3.48Å; I141-Q145 PolarHBondContact O-N 3.49Å; L142-Q145 WeakPolarHBondContact O-CB 3.47Å; L142-Q145 PolarHBondContact O-N 3.48Å; L142-Q145 VanDerWaalsContact O-N 3.16Å; L143-Q145 VanDerWaalsContact C-N 3.29Å; L143-Q145 PolarHBondContact O-N 3.36Å; Q145-C148 VanDerWaalsContact O-CB 3.3Å; Q145-C148 WeakPolarHBondContact O-CB 3.46Å; Q145-C148 PolarHBondContact O-N 3.24Å; Q145-S181 PolarHBondContact NE2-OG 3.17Å
146M86Confident85.7Confident53 Ų5344.4 Ų44.426%0.26121%0.207SC..Hα-helixtrans-68.2-35.8-178.3-70.6172.17300112.7V89 Q93 L99 L142 L143 C148V89-M146 HydrophobicContact CG1-SD 4Å; Q93-M146 HydrophobicContact CG-CE 4.02Å; Q93-M146 HydrophobicContact CG-SD 3.93Å; L99-M146 HydrophobicContact CD1-CB 3.96Å; L99-M146 HydrophobicContact CD1-CE 3.73Å; L99-M146 HydrophobicContact CG-CE 4.48Å; L142-M146 HydrophobicContact CD1-CG 4.42Å; L142-M146 HydrophobicContact CD1-SD 4.44Å; L142-M146 HydrophobicContact CG-SD 4.04Å; L142-M146 VanDerWaalsContact O-CG 3.28Å; L142-M146 WeakPolarHBondContact O-CG 3.47Å; L142-M146 PolarHBondContact O-N 2.96Å; L143-M146 PolarHBondContact O-N 3.25Å; M146-C148 VanDerWaalsContact C-N 3.33Å
147V82.8Confident85.5Confident2 Ų243.7 Ų43.71%0.01221%0.206CC..Hα-helixtrans-89.1-3.5-179.5-56.40000113.1L99 L143 G149 Y150 M151 F154 H155 L158L99-V147 HydrophobicContact CD1-CG1 4.2Å; L143-V147 HydrophobicContact CD1-CG1 3.97Å; L143-V147 WeakPolarHBondContact O-CG1 3.4Å; L143-V147 VanDerWaalsContact O-CG2 3.26Å; L143-V147 WeakPolarHBondContact O-CG2 3.46Å; L143-V147 PolarHBondContact O-N 3.04Å; V147-G149 PolarHBondContact O-N 3.36Å; V147-Y150 PolarHBondContact O-N 2.91Å; V147-M151 HydrophobicContact CB-CB 4.18Å; V147-M151 PolarHBondContact O-N 3.16Å; V147-M151 VanDerWaalsContact O-N 3.15Å; V147-F154 HydrophobicContact CB-CD2 3.97Å; V147-F154 HydrophobicContact CG1-CD2 3.62Å; V147-F154 HydrophobicContact CG1-CE2 4.06Å; V147-F154 HydrophobicContact CG1-CG 4.41Å; V147-F154 HydrophobicContact CG2-CB 4.03Å; V147-F154 HydrophobicContact CG2-CD2 4.39Å; V147-H155 PolarHBondContact O-NE2 3.45Å; V147-L158 HydrophobicContact CG2-CD1 3.84Å
148C74.9Confident85.4Confident17 Ų1743.7 Ų43.712%0.11521%0.206CC..THydrogen-bonded Turntrans-62.5124.9-176.1-162.10000111.8Y144 Q145 M146 Y150 Q185 D189Y144-C148 WeakPolarHBondContact O-CB 3.16Å; Y144-C148 PolarHBondContact O-N 3.41Å; Y144-C148 VanDerWaalsContact O-N 3.13Å; Q145-C148 VanDerWaalsContact O-CB 3.3Å; Q145-C148 WeakPolarHBondContact O-CB 3.46Å; Q145-C148 PolarHBondContact O-N 3.24Å; M146-C148 VanDerWaalsContact C-N 3.33Å; C148-Y150 VanDerWaalsContact C-N 3.28Å; C148-Y150 WeakPolarHBondContact O-CD2 3.44Å; C148-Y150 PolarHBondContact O-N 3.43Å; C148-Q185 PolarHBondContact SG-NE2 2.8Å; C148-D189 PolarHBondContact SG-OD1 2.9Å; C148-D189 PolarHBondContact SG-OD2 3.02Å
149G71.5Confident85.2Confident44 Ų4436.3 Ų36.345%0.45418%0.178SC..THydrogen-bonded Turntrans81.3-11178.200000116.5V147V147-G149 PolarHBondContact O-N 3.36Å
150Y73.3Confident84.9Confident179 Ų17936.4 Ų36.470%0.70218%0.18SC*.THydrogen-bonded Turntrans-116.6-42-177-57.6-79.6000113.4V147 C148V147-Y150 PolarHBondContact O-N 2.91Å; C148-Y150 VanDerWaalsContact C-N 3.28Å; C148-Y150 WeakPolarHBondContact O-CD2 3.44Å; C148-Y150 PolarHBondContact O-N 3.43Å
151M78.7Confident84.6Confident10 Ų1036.3 Ų36.35%0.04918%0.18CC..  trans-125.472.4-170.9-60.6-179.482.700111.4Y100 E103 V147 Q153 F154 H155Y100-M151 HydrophobicContact CD1-CE 3.62Å; Y100-M151 HydrophobicContact CD1-CG 4.44Å; Y100-M151 HydrophobicContact CD1-SD 3.76Å; Y100-M151 HydrophobicContact CE1-CE 4Å; Y100-M151 HydrophobicContact CE1-CG 3.84Å; Y100-M151 HydrophobicContact CE1-SD 3.6Å; Y100-M151 VanDerWaalsContact CE1-SD 3.6Å; Y100-M151 HydrophobicContact CE2-SD 4.43Å; Y100-M151 HydrophobicContact CG-CE 4.18Å; Y100-M151 HydrophobicContact CG-SD 4.24Å; E103-M151 HydrophobicContact CG-CE 4.39Å; V147-M151 HydrophobicContact CB-CB 4.18Å; V147-M151 PolarHBondContact O-N 3.16Å; V147-M151 VanDerWaalsContact O-N 3.15Å; M151-Q153 PolarHBondContact O-N 3.36Å; M151-Q153 VanDerWaalsContact O-N 3.09Å; M151-F154 HydrophobicContact CB-CD2 3.61Å; M151-F154 HydrophobicContact CB-CE2 3.88Å; M151-F154 HydrophobicContact CE-CD2 4.3Å; M151-F154 HydrophobicContact CE-CE2 3.35Å; M151-F154 HydrophobicContact CE-CZ 3.98Å; M151-F154 HydrophobicContact CG-CE2 4.4Å; M151-F154 PolarHBondContact O-N 3.21Å; M151-F154 HydrophobicContact SD-CD2 4.31Å; M151-F154 HydrophobicContact SD-CE2 3.68Å; M151-H155 PolarHBondContact O-CD2 3.08Å
152W77.9Confident84.5Confident85 Ų8536 Ų3632%0.32218%0.178SC..Hα-helixtrans-59.2-22.3-175.5-71.298.4000114.7F154 H155 L193 K199W152-F154 PolarHBondContact O-N 3.2Å; W152-H155 HydrophobicContact CE3-CB 4.27Å; W152-H155 AromaticContact CE3-CE1 3.89Å; W152-H155 AromaticContact CE3-CG 3.76Å; W152-H155 AromaticContact CE3-ND1 3.57Å; W152-H155 AromaticContact CZ3-CE1 3.82Å; W152-H155 AromaticContact CZ3-ND1 3.53Å; W152-H155 WeakPolarHBondContact O-CB 3.06Å; W152-H155 PolarHBondContact O-N 3.34Å; W152-H155 VanDerWaalsContact O-N 3.11Å; W152-L193 HydrophobicContact CH2-CD2 4.17Å; W152-L193 HydrophobicContact CZ3-CD2 4.47Å; W152-K199 HydrophobicContact CE3-CD 4.01Å; W152-K199 HydrophobicContact CZ3-CD 4.36Å
153Q82.8Confident84.3Confident84 Ų8436 Ų3639%0.39318%0.178SC..Hα-helixtrans-62.3-26.6177.166.7-139.92.400114E103 L107 M151 P157E103-Q153 VanDerWaalsContact CD-CD 3.46Å; E103-Q153 PolarHBondContact OE1-NE2 3.39Å; E103-Q153 PolarHBondContact OE1-OE1 3.17Å; E103-Q153 PolarHBondContact OE2-NE2 3.06Å; L107-Q153 HydrophobicContact CD1-CG 4.46Å; M151-Q153 PolarHBondContact O-N 3.36Å; M151-Q153 VanDerWaalsContact O-N 3.09Å; Q153-P157 WeakPolarHBondContact O-CD 3.01Å; Q153-P157 WeakPolarHBondContact O-CG 3.29Å
154F82.6Confident84Confident0 Ų038 Ų380%019%0.187CC..Hα-helixtrans-82.1-22.6175.9-62.1-60.5000113.2E103 I106 L107 L110 V147 M151 W152 L156 P157 L158E103-F154 HydrophobicContact CB-CZ 4.17Å; E103-F154 HydrophobicContact CG-CE1 4.19Å; E103-F154 HydrophobicContact CG-CZ 3.74Å; I106-F154 HydrophobicContact CB-CE1 3.67Å; I106-F154 HydrophobicContact CB-CZ 4.16Å; I106-F154 HydrophobicContact CD1-CZ 4.24Å; I106-F154 HydrophobicContact CG2-CD1 3.77Å; I106-F154 HydrophobicContact CG2-CE1 3.4Å; I106-F154 VanDerWaalsContact CG2-CE1 3.4Å; I106-F154 HydrophobicContact CG2-CZ 4.08Å; L107-F154 HydrophobicContact CD2-CD1 3.55Å; L107-F154 HydrophobicContact CD2-CE1 3.87Å; L107-F154 HydrophobicContact CG-CD1 3.92Å; L107-F154 HydrophobicContact CG-CE1 3.67Å; L110-F154 HydrophobicContact CD1-CD1 4.15Å; V147-F154 HydrophobicContact CB-CD2 3.97Å; V147-F154 HydrophobicContact CG1-CD2 3.62Å; V147-F154 HydrophobicContact CG1-CE2 4.06Å; V147-F154 HydrophobicContact CG1-CG 4.41Å; V147-F154 HydrophobicContact CG2-CB 4.03Å; V147-F154 HydrophobicContact CG2-CD2 4.39Å; M151-F154 HydrophobicContact CB-CD2 3.61Å; M151-F154 HydrophobicContact CB-CE2 3.88Å; M151-F154 HydrophobicContact CE-CD2 4.3Å; M151-F154 HydrophobicContact CE-CE2 3.35Å; M151-F154 HydrophobicContact CE-CZ 3.98Å; M151-F154 HydrophobicContact CG-CE2 4.4Å; M151-F154 PolarHBondContact O-N 3.21Å; M151-F154 HydrophobicContact SD-CD2 4.31Å; M151-F154 HydrophobicContact SD-CE2 3.68Å; W152-F154 PolarHBondContact O-N 3.2Å; F154-L156 PolarHBondContact O-N 3.16Å; F154-P157 WeakPolarHBondContact O-CD 3.06Å; F154-L158 HydrophobicContact CB-CD1 3.87Å; F154-L158 HydrophobicContact CB-CG 4.45Å; F154-L158 VanDerWaalsContact O-CB 3.24Å; F154-L158 WeakPolarHBondContact O-CB 3.15Å; F154-L158 WeakPolarHBondContact O-CD1 3.19Å; F154-L158 VanDerWaalsContact O-CG 3.22Å; F154-L158 WeakPolarHBondContact O-CG 3.33Å; F154-L158 PolarHBondContact O-N 3.09Å
155H81.9Confident83.8Confident4 Ų438 Ų382%0.01919%0.187CC..Hα-helixtrans-61.4-46.5-169.7-83.8-121000112.2Y144 V147 M151 W152 K159Y144-H155 AromaticContact CE2-ND1 3.84Å; V147-H155 PolarHBondContact O-NE2 3.45Å; M151-H155 PolarHBondContact O-CD2 3.08Å; W152-H155 HydrophobicContact CE3-CB 4.27Å; W152-H155 AromaticContact CE3-CE1 3.89Å; W152-H155 AromaticContact CE3-CG 3.76Å; W152-H155 AromaticContact CE3-ND1 3.57Å; W152-H155 AromaticContact CZ3-CE1 3.82Å; W152-H155 AromaticContact CZ3-ND1 3.53Å; W152-H155 WeakPolarHBondContact O-CB 3.06Å; W152-H155 PolarHBondContact O-N 3.34Å; W152-H155 VanDerWaalsContact O-N 3.11Å; H155-K159 PolarHBondContact ND1-NZ 3.25Å; H155-K159 WeakPolarHBondContact O-CB 3.5Å; H155-K159 VanDerWaalsContact O-CE 3.3Å; H155-K159 WeakPolarHBondContact O-CE 3.43Å; H155-K159 VanDerWaalsContact O-CG 3.25Å; H155-K159 WeakPolarHBondContact O-CG 3.48Å; H155-K159 PolarHBondContact O-N 3.29Å
156L86.1Confident83.8Confident86 Ų8634.9 Ų34.945%0.4517%0.173SC..Hα-helixtrans-67.5-52.3-179.7178.967.4000111.1F154 L158 K159 E160 A202F154-L156 PolarHBondContact O-N 3.16Å; L156-L158 VanDerWaalsContact C-N 3.3Å; L156-L158 PolarHBondContact O-N 3.3Å; L156-K159 PolarHBondContact O-N 2.94Å; L156-E160 HydrophobicContact CD1-CG 4.1Å; L156-E160 HydrophobicContact CG-CG 4.48Å; L156-E160 WeakPolarHBondContact O-CB 3.42Å; L156-E160 WeakPolarHBondContact O-CG 3.04Å; L156-E160 PolarHBondContact O-N 3Å; L156-A202 HydrophobicContact CD1-CB 3.58Å
157P87.6Confident83.7Confident28 Ų2834.2 Ų34.218%0.18217%0.173CC..Hα-helixtrans-55.3-40174.3-27.334000114.3L107 L110 Q153 F154 S161L107-P157 HydrophobicContact CD2-CG 4.15Å; L110-P157 HydrophobicContact CB-CB 3.93Å; L110-P157 HydrophobicContact CD1-CB 3.99Å; Q153-P157 WeakPolarHBondContact O-CD 3.01Å; Q153-P157 WeakPolarHBondContact O-CG 3.29Å; F154-P157 WeakPolarHBondContact O-CD 3.06Å; P157-S161 VanDerWaalsContact O-CB 3.25Å; P157-S161 WeakPolarHBondContact O-CB 3.49Å; P157-S161 PolarHBondContact O-N 2.8Å; P157-S161 PolarHBondContact O-OG 2.96Å
158L91Very high83.7Confident1 Ų136.8 Ų36.81%0.00518%0.184CC..Hα-helixtrans-66.3-50177.7-77167.9000111.9L110 L140 L143 Y144 V147 F154 L156 E160 S161 L162L110-L158 HydrophobicContact CD1-CD2 3.95Å; L110-L158 HydrophobicContact CD1-CG 3.84Å; L110-L158 HydrophobicContact CD2-CD2 3.56Å; L110-L158 HydrophobicContact CD2-CG 4.27Å; L110-L158 HydrophobicContact CG-CD2 4.42Å; L140-L158 HydrophobicContact CD2-CD2 4.18Å; L143-L158 HydrophobicContact CB-CD2 4.49Å; L143-L158 HydrophobicContact CD2-CD2 3.92Å; L143-L158 HydrophobicContact CG-CD1 4.2Å; L143-L158 HydrophobicContact CG-CD2 4.24Å; Y144-L158 HydrophobicContact CD2-CB 4.2Å; Y144-L158 HydrophobicContact CD2-CD1 4.18Å; V147-L158 HydrophobicContact CG2-CD1 3.84Å; F154-L158 HydrophobicContact CB-CD1 3.87Å; F154-L158 HydrophobicContact CB-CG 4.45Å; F154-L158 VanDerWaalsContact O-CB 3.24Å; F154-L158 WeakPolarHBondContact O-CB 3.15Å; F154-L158 WeakPolarHBondContact O-CD1 3.19Å; F154-L158 VanDerWaalsContact O-CG 3.22Å; F154-L158 WeakPolarHBondContact O-CG 3.33Å; F154-L158 PolarHBondContact O-N 3.09Å; L156-L158 VanDerWaalsContact C-N 3.3Å; L156-L158 PolarHBondContact O-N 3.3Å; L158-E160 VanDerWaalsContact C-N 3.34Å; L158-E160 PolarHBondContact O-N 2.94Å; L158-S161 PolarHBondContact O-N 3.49Å; L158-L162 WeakPolarHBondContact O-CB 3.37Å; L158-L162 WeakPolarHBondContact O-CG 3.07Å; L158-L162 PolarHBondContact O-N 2.59Å
159K89.3Confident84.1Confident6 Ų636.9 Ų36.93%0.02618%0.183CC..Hα-helixtrans-61.5-43.7179.1-74.8-175.2-92.1-97.40111.4Y144 H155 L156 L162 L163 A202 H203 L206Y144-K159 HydrophobicContact CE2-CD 4.44Å; Y144-K159 HydrophobicContact CE2-CG 3.99Å; Y144-K159 PolarHBondContact OH-NZ 2.93Å; H155-K159 PolarHBondContact ND1-NZ 3.25Å; H155-K159 WeakPolarHBondContact O-CB 3.5Å; H155-K159 VanDerWaalsContact O-CE 3.3Å; H155-K159 WeakPolarHBondContact O-CE 3.43Å; H155-K159 VanDerWaalsContact O-CG 3.25Å; H155-K159 WeakPolarHBondContact O-CG 3.48Å; H155-K159 PolarHBondContact O-N 3.29Å; L156-K159 PolarHBondContact O-N 2.94Å; K159-L162 PolarHBondContact O-N 2.69Å; K159-L163 WeakPolarHBondContact O-CB 3.46Å; K159-L163 PolarHBondContact O-N 3.49Å; K159-A202 HydrophobicContact CD-CB 4.24Å; K159-H203 PolarHBondContact NZ-CE1 3.37Å; K159-H203 PolarHBondContact NZ-NE2 3.43Å; K159-L206 HydrophobicContact CB-CD2 4.14Å; K159-L206 HydrophobicContact CD-CD2 4.39Å; K159-L206 HydrophobicContact CG-CD2 3.75Å
160E87.8Confident84.7Confident55 Ų5535.4 Ų35.426%0.25717%0.168SC..Hα-helixtrans-62.1-45.5174.9-74-167.1174.900111.5R114 L156 L158 L162 L163 F164R114-E160 IonicContact CZ-OE2 3.38Å; R114-E160 VanDerWaalsContact CZ-OE2 3.23Å; R114-E160 IonicContact NE-OE2 2.69Å; R114-E160 PolarHBondContact NE-OE2 3.01Å; R114-E160 IonicContact NH2-OE2 3.83Å; R114-E160 PolarHBondContact NH2-OE2 3.47Å; R114-E160 VanDerWaalsContact NH2-OE2 3.13Å; L156-E160 HydrophobicContact CD1-CG 4.1Å; L156-E160 HydrophobicContact CG-CG 4.48Å; L156-E160 WeakPolarHBondContact O-CB 3.42Å; L156-E160 WeakPolarHBondContact O-CG 3.04Å; L156-E160 PolarHBondContact O-N 3Å; L158-E160 VanDerWaalsContact C-N 3.34Å; L158-E160 PolarHBondContact O-N 2.94Å; E160-L162 PolarHBondContact O-N 3.24Å; E160-L163 WeakPolarHBondContact O-CB 3.44Å; E160-L163 PolarHBondContact O-N 2.92Å; E160-F164 HydrophobicContact CB-CD2 4.34Å; E160-F164 HydrophobicContact CB-CE2 4.05Å; E160-F164 WeakPolarHBondContact O-CD2 3.33Å; E160-F164 WeakPolarHBondContact O-CG 3.46Å; E160-F164 PolarHBondContact O-N 2.86Å
161S88.6Confident85.3Confident1 Ų130.9 Ų30.91%0.00716%0.16CC..Hα-helixtrans-59.1-48177.1-61.40000111P157 L158 L163 F164 I165P157-S161 VanDerWaalsContact O-CB 3.25Å; P157-S161 WeakPolarHBondContact O-CB 3.49Å; P157-S161 PolarHBondContact O-N 2.8Å; P157-S161 PolarHBondContact O-OG 2.96Å; L158-S161 PolarHBondContact O-N 3.49Å; S161-L163 VanDerWaalsContact C-N 3.32Å; S161-L163 PolarHBondContact O-N 3.24Å; S161-F164 PolarHBondContact O-N 3.32Å; S161-I165 WeakPolarHBondContact O-CB 3.29Å; S161-I165 WeakPolarHBondContact O-CD1 3.26Å; S161-I165 WeakPolarHBondContact O-CG1 3.38Å; S161-I165 PolarHBondContact O-N 3.01Å
162L90Very high85.6Confident0 Ų036.3 Ų36.30%019%0.185CC..Hα-helixtrans-60.3-40.8177.1-71.6167.9000112I137 L140 L158 K159 E160 I165 A166 L182 L206I137-L162 HydrophobicContact CG2-CD2 4.15Å; L140-L162 HydrophobicContact CB-CD2 4.35Å; L158-L162 WeakPolarHBondContact O-CB 3.37Å; L158-L162 WeakPolarHBondContact O-CG 3.07Å; L158-L162 PolarHBondContact O-N 2.59Å; K159-L162 PolarHBondContact O-N 2.69Å; E160-L162 PolarHBondContact O-N 3.24Å; L162-I165 PolarHBondContact O-N 3.44Å; L162-A166 WeakPolarHBondContact O-CB 3.4Å; L162-A166 PolarHBondContact O-N 3.29Å; L162-L182 HydrophobicContact CD1-CD1 4.22Å; L162-L182 HydrophobicContact CD1-CD2 3.91Å; L162-L206 HydrophobicContact CB-CD1 4.07Å; L162-L206 HydrophobicContact CD1-CD2 4.44Å
163L87.7Confident86Confident33 Ų3332.2 Ų32.217%0.17317%0.169CC..Hα-helixtrans-62.8-44.8175.8-176.465.8000111.9K159 E160 S161 A166 S167 K205 A209K159-L163 WeakPolarHBondContact O-CB 3.46Å; K159-L163 PolarHBondContact O-N 3.49Å; E160-L163 WeakPolarHBondContact O-CB 3.44Å; E160-L163 PolarHBondContact O-N 2.92Å; S161-L163 VanDerWaalsContact C-N 3.32Å; S161-L163 PolarHBondContact O-N 3.24Å; L163-A166 PolarHBondContact O-N 3.05Å; L163-S167 PolarHBondContact O-N 2.91Å; L163-K205 HydrophobicContact CD2-CB 4.2Å; L163-A209 HydrophobicContact CD1-CB 3.45Å; L163-A209 VanDerWaalsContact CD1-CB 3.45Å
164F85.9Confident86.4Confident44 Ų4428.2 Ų28.219%0.19315%0.151CC..Hα-helixtrans-70.2-34.9177.4-68.4-58.5000112.9R114 T117 L118 E160 S161 S167 K168R114-F164 HydrophobicContact CG-CD2 3.93Å; R114-F164 HydrophobicContact CG-CE2 3.85Å; T117-F164 HydrophobicContact CG2-CB 4.41Å; L118-F164 HydrophobicContact CD1-CE1 4.32Å; L118-F164 HydrophobicContact CD1-CE2 4.25Å; L118-F164 HydrophobicContact CD1-CZ 4.06Å; L118-F164 HydrophobicContact CD2-CD1 3.69Å; L118-F164 HydrophobicContact CD2-CE1 3.43Å; L118-F164 VanDerWaalsContact CD2-CE1 3.43Å; L118-F164 HydrophobicContact CD2-CG 4.47Å; L118-F164 HydrophobicContact CD2-CZ 4.01Å; L118-F164 HydrophobicContact CG-CD1 4.09Å; L118-F164 HydrophobicContact CG-CE1 4.04Å; L118-F164 HydrophobicContact CG-CG 4.4Å; L118-F164 HydrophobicContact CG-CZ 4.26Å; E160-F164 HydrophobicContact CB-CD2 4.34Å; E160-F164 HydrophobicContact CB-CE2 4.05Å; E160-F164 WeakPolarHBondContact O-CD2 3.33Å; E160-F164 WeakPolarHBondContact O-CG 3.46Å; E160-F164 PolarHBondContact O-N 2.86Å; S161-F164 PolarHBondContact O-N 3.32Å; F164-S167 PolarHBondContact O-N 2.93Å; F164-S167 PolarHBondContact O-OG 3.47Å; F164-K168 WeakPolarHBondContact O-CG 3.37Å; F164-K168 PolarHBondContact O-N 3.39Å
165I86Confident86.7Confident0 Ų029.1 Ų29.10%016%0.158CC..Hα-helixtrans-65.7-44.7174.5-68.2167.5000109.4L113 T117 L129 I137 L140 S161 L162 S167 K168 L169 L173L113-I165 HydrophobicContact CD2-CD1 4.14Å; T117-I165 HydrophobicContact CG2-CG1 3.81Å; L129-I165 HydrophobicContact CB-CG2 4.43Å; L129-I165 HydrophobicContact CD1-CB 4.39Å; L129-I165 HydrophobicContact CD1-CG1 4.13Å; L129-I165 HydrophobicContact CD1-CG2 4.03Å; L129-I165 HydrophobicContact CD2-CD1 4.1Å; L129-I165 HydrophobicContact CD2-CG1 3.89Å; L129-I165 HydrophobicContact CD2-CG2 4.16Å; L129-I165 HydrophobicContact CG-CG2 4.43Å; I137-I165 HydrophobicContact CD1-CG2 3.64Å; I137-I165 HydrophobicContact CG1-CG2 4.23Å; L140-I165 HydrophobicContact CD1-CD1 3.63Å; S161-I165 WeakPolarHBondContact O-CB 3.29Å; S161-I165 WeakPolarHBondContact O-CD1 3.26Å; S161-I165 WeakPolarHBondContact O-CG1 3.38Å; S161-I165 PolarHBondContact O-N 3.01Å; L162-I165 PolarHBondContact O-N 3.44Å; I165-S167 VanDerWaalsContact C-N 3.29Å; I165-S167 PolarHBondContact O-N 3.46Å; I165-K168 PolarHBondContact O-N 3.17Å; I165-K168 VanDerWaalsContact O-N 3.11Å; I165-L169 HydrophobicContact CG2-CD1 3.88Å; I165-L169 HydrophobicContact CG2-CG 4.44Å; I165-L169 PolarHBondContact O-N 3.21Å; I165-L173 HydrophobicContact CB-CD2 4.27Å; I165-L173 HydrophobicContact CG2-CD2 3.44Å; I165-L173 VanDerWaalsContact CG2-CD2 3.44Å
166A86.5Confident87.3Confident1 Ų132.2 Ų32.21%0.00817%0.17CC..Hα-helixtrans-54.6-48.6173.400000110.1L162 L163 K168 L169 G170 L173 L177 W307L162-A166 WeakPolarHBondContact O-CB 3.4Å; L162-A166 PolarHBondContact O-N 3.29Å; L163-A166 PolarHBondContact O-N 3.05Å; A166-K168 PolarHBondContact O-N 3.41Å; A166-K168 VanDerWaalsContact O-N 3.11Å; A166-L169 PolarHBondContact O-N 3.35Å; A166-G170 PolarHBondContact O-N 3.25Å; A166-L173 HydrophobicContact CB-CD2 4.2Å; A166-L177 HydrophobicContact CB-CD1 4.4Å; A166-W307 HydrophobicContact CB-CH2 3.7Å; A166-W307 HydrophobicContact CB-CZ3 4.37Å; A166-W307 WeakPolarHBondContact O-CH2 3.4Å; A166-W307 WeakPolarHBondContact O-CZ2 3.39Å
167S84.5Confident87.6Confident39 Ų3928.2 Ų28.227%0.27315%0.149SC..Hα-helixtrans-58.1-28.8-179.780.70000113.6L163 F164 I165L163-S167 PolarHBondContact O-N 2.91Å; F164-S167 PolarHBondContact O-N 2.93Å; F164-S167 PolarHBondContact O-OG 3.47Å; I165-S167 VanDerWaalsContact C-N 3.29Å; I165-S167 PolarHBondContact O-N 3.46Å
168K83.4Confident88Confident55 Ų5526.9 Ų26.924%0.23914%0.14CC..Hα-helixtrans-85.3-37.8176.8-65.1-52.1-172.5-175.10114.7T117 R126 L129 F164 I165 A166T117-K168 HydrophobicContact CG2-CG 4.3Å; T117-K168 WeakPolarHBondContact O-CE 3.38Å; T117-K168 PolarHBondContact O-NZ 3.32Å; R126-K168 WeakPolarHBondContact CD-O 3.41Å; R126-K168 WeakPolarHBondContact CG-O 3.29Å; L129-K168 HydrophobicContact CD1-CB 4.37Å; F164-K168 WeakPolarHBondContact O-CG 3.37Å; F164-K168 PolarHBondContact O-N 3.39Å; I165-K168 PolarHBondContact O-N 3.17Å; I165-K168 VanDerWaalsContact O-N 3.11Å; A166-K168 PolarHBondContact O-N 3.41Å; A166-K168 VanDerWaalsContact O-N 3.11Å
169L84.1Confident88.1Confident19 Ų1931.3 Ų31.310%0.09916%0.164CC..Hα-helixtrans-88.1-21.5-176-65.6-177.8000113R126 L129 F134 I137 I165 A166 L173R126-L169 HydrophobicContact CB-CD2 4.18Å; R126-L169 HydrophobicContact CG-CD2 3.95Å; L129-L169 HydrophobicContact CB-CD1 3.72Å; L129-L169 HydrophobicContact CB-CD2 4.02Å; L129-L169 HydrophobicContact CB-CG 4.13Å; F134-L169 HydrophobicContact CD1-CD1 3.93Å; F134-L169 HydrophobicContact CE1-CD1 3.64Å; I137-L169 HydrophobicContact CD1-CD1 3.51Å; I165-L169 HydrophobicContact CG2-CD1 3.88Å; I165-L169 HydrophobicContact CG2-CG 4.44Å; I165-L169 PolarHBondContact O-N 3.21Å; A166-L169 PolarHBondContact O-N 3.35Å; L169-L173 HydrophobicContact CB-CB 3.54Å; L169-L173 HydrophobicContact CB-CD2 4.17Å; L169-L173 HydrophobicContact CB-CG 4.43Å; L169-L173 HydrophobicContact CD1-CB 4.01Å; L169-L173 HydrophobicContact CD1-CD1 4.16Å; L169-L173 HydrophobicContact CD1-CD2 3.77Å; L169-L173 HydrophobicContact CD1-CG 4.18Å; L169-L173 HydrophobicContact CG-CB 4.37Å; L169-L173 HydrophobicContact CG-CD2 4.37Å
170G84.1Confident88.4Confident13 Ų1331.8 Ų31.813%0.13417%0.168CC..THydrogen-bonded Turntrans67.9-148178.400000113A166 Q172 L173 V174A166-G170 PolarHBondContact O-N 3.25Å; G170-Q172 VanDerWaalsContact C-N 3.27Å; G170-Q172 PolarHBondContact O-N 3.35Å; G170-L173 PolarHBondContact O-N 2.98Å; G170-L173 VanDerWaalsContact O-N 3.15Å; G170-V174 PolarHBondContact O-N 3.32Å
171T84.7Confident88.6Confident85 Ų8531.6 Ų31.652%0.52117%0.172SC..Hα-helixtrans-59.6-33.1-169.855.40000113.7L173 V174 A175 T213T171-L173 VanDerWaalsContact C-N 3.31Å; T171-L173 PolarHBondContact O-N 3.1Å; T171-V174 PolarHBondContact O-N 3.08Å; T171-A175 PolarHBondContact O-N 3.34Å; T171-T213 HydrophobicContact CG2-CG2 3.85Å
172Q84.3Confident88.9Confident123 Ų12331.6 Ų31.658%0.57517%0.172SC*.Hα-helixtrans-60.6-40.1179.1-168.4-174.41800112.3F134 G170 Y176F134-Q172 HydrophobicContact CE2-CG 4.17Å; F134-Q172 HydrophobicContact CZ-CG 3.82Å; G170-Q172 VanDerWaalsContact C-N 3.27Å; G170-Q172 PolarHBondContact O-N 3.35Å; Q172-Y176 PolarHBondContact O-N 3.24Å
173L88.1Confident89.2Confident0 Ų031.6 Ų31.60%017%0.172CC..Hα-helixtrans-76.5-40.2176.4-177.963.9000111.7F134 I137 I165 A166 L169 G170 T171 A175 Y176 L177F134-L173 HydrophobicContact CD1-CD1 4.19Å; F134-L173 HydrophobicContact CE1-CD1 4.42Å; F134-L173 HydrophobicContact CG-CD1 4.41Å; I137-L173 HydrophobicContact CD1-CD1 3.43Å; I137-L173 VanDerWaalsContact CD1-CD1 3.43Å; I137-L173 HydrophobicContact CD1-CD2 4.01Å; I137-L173 HydrophobicContact CD1-CG 4.35Å; I137-L173 HydrophobicContact CG2-CD1 4.13Å; I165-L173 HydrophobicContact CB-CD2 4.27Å; I165-L173 HydrophobicContact CG2-CD2 3.44Å; I165-L173 VanDerWaalsContact CG2-CD2 3.44Å; A166-L173 HydrophobicContact CB-CD2 4.2Å; L169-L173 HydrophobicContact CB-CB 3.54Å; L169-L173 HydrophobicContact CB-CD2 4.17Å; L169-L173 HydrophobicContact CB-CG 4.43Å; L169-L173 HydrophobicContact CD1-CB 4.01Å; L169-L173 HydrophobicContact CD1-CD1 4.16Å; L169-L173 HydrophobicContact CD1-CD2 3.77Å; L169-L173 HydrophobicContact CD1-CG 4.18Å; L169-L173 HydrophobicContact CG-CB 4.37Å; L169-L173 HydrophobicContact CG-CD2 4.37Å; G170-L173 PolarHBondContact O-N 2.98Å; G170-L173 VanDerWaalsContact O-N 3.15Å; T171-L173 VanDerWaalsContact C-N 3.31Å; T171-L173 PolarHBondContact O-N 3.1Å; L173-A175 PolarHBondContact O-N 2.92Å; L173-Y176 HydrophobicContact CD1-CD1 4.18Å; L173-Y176 CarbonylContact O-C 3.4Å; L173-Y176 WeakPolarHBondContact O-CA 3.48Å; L173-Y176 WeakPolarHBondContact O-CB 3.23Å; L173-Y176 PolarHBondContact O-N 2.85Å; L173-L177 HydrophobicContact CD1-CD2 4.44Å; L173-L177 HydrophobicContact CD1-CG 4.2Å; L173-L177 HydrophobicContact CD2-CD1 4.13Å; L173-L177 HydrophobicContact CG-CD1 3.97Å; L173-L177 HydrophobicContact CG-CG 3.97Å; L173-L177 WeakPolarHBondContact O-CG 3.46Å; L173-L177 PolarHBondContact O-N 2.95Å
174V89.2Confident89.6Confident0 Ų031 Ų310%017%0.17CC..Hα-helixtrans-54.1-43.3177.9177.40000109.7G170 T171 Y176 L177 V178 I210 T213 W307G170-V174 PolarHBondContact O-N 3.32Å; T171-V174 PolarHBondContact O-N 3.08Å; V174-Y176 PolarHBondContact O-N 3.02Å; V174-L177 PolarHBondContact O-N 3.34Å; V174-V178 HydrophobicContact CG1-CG2 4.23Å; V174-V178 VanDerWaalsContact O-CG2 3.29Å; V174-V178 WeakPolarHBondContact O-CG2 3.11Å; V174-V178 PolarHBondContact O-N 3.24Å; V174-I210 WeakPolarHBondContact CG1-O 3.44Å; V174-T213 HydrophobicContact CB-CG2 4.01Å; V174-T213 HydrophobicContact CG1-CG2 3.73Å; V174-T213 WeakPolarHBondContact CG1-OG1 3.49Å; V174-T213 HydrophobicContact CG2-CG2 4.38Å; V174-W307 HydrophobicContact CG2-CE3 4.43Å; V174-W307 HydrophobicContact CG2-CH2 4.49Å; V174-W307 HydrophobicContact CG2-CZ3 4.36Å
175A90.6Very high89.9Confident18 Ų1831.5 Ų31.515%0.14917%0.174CC..Hα-helixtrans-55.2-48.3173.300000113.4T171 L173 L177 V178 N179 E215T171-A175 PolarHBondContact O-N 3.34Å; L173-A175 PolarHBondContact O-N 2.92Å; A175-L177 PolarHBondContact O-N 3.35Å; A175-V178 PolarHBondContact O-N 3.18Å; A175-N179 PolarHBondContact O-N 3.35Å; A175-N179 PolarHBondContact O-ND2 3.39Å; A175-E215 WeakPolarHBondContact CA-OE2 3.49Å; A175-E215 WeakPolarHBondContact CB-OE1 3.32Å; A175-E215 WeakPolarHBondContact CB-OE2 3.49Å
176Y93.4Very high90.3Very high70 Ų7031.5 Ų31.528%0.27517%0.174SC..Hα-helixtrans-62.7-41.7177.1-179.2-91.2000112.2F134 R138 I141 Q172 L173 V174 N179 S180F134-Y176 HydrophobicContact CB-CE1 4.5Å; F134-Y176 HydrophobicContact CD2-CD2 4.1Å; F134-Y176 HydrophobicContact CD2-CG 4.16Å; R138-Y176 WeakPolarHBondContact CB-OH 3.4Å; I141-Y176 HydrophobicContact CD1-CD1 4.5Å; I141-Y176 HydrophobicContact CD1-CE1 3.87Å; Q172-Y176 PolarHBondContact O-N 3.24Å; L173-Y176 HydrophobicContact CD1-CD1 4.18Å; L173-Y176 CarbonylContact O-C 3.4Å; L173-Y176 WeakPolarHBondContact O-CA 3.48Å; L173-Y176 WeakPolarHBondContact O-CB 3.23Å; L173-Y176 PolarHBondContact O-N 2.85Å; V174-Y176 PolarHBondContact O-N 3.02Å; Y176-N179 PolarHBondContact O-N 3.45Å; Y176-S180 PolarHBondContact O-N 2.69Å; Y176-S180 VanDerWaalsContact O-N 3.13Å
177L93.8Very high90.7Very high1 Ų131.5 Ų31.51%0.00517%0.173CC..Hα-helixtrans-67.8-42.4179.5-65.2177000111.9I137 I141 A166 L173 V174 A175 N179 S180 L182 P183 I210I137-L177 HydrophobicContact CG2-CD2 4.32Å; I141-L177 HydrophobicContact CD1-CD2 3.86Å; I141-L177 HydrophobicContact CG1-CD2 4.42Å; A166-L177 HydrophobicContact CB-CD1 4.4Å; L173-L177 HydrophobicContact CD1-CD2 4.44Å; L173-L177 HydrophobicContact CD1-CG 4.2Å; L173-L177 HydrophobicContact CD2-CD1 4.13Å; L173-L177 HydrophobicContact CG-CD1 3.97Å; L173-L177 HydrophobicContact CG-CG 3.97Å; L173-L177 WeakPolarHBondContact O-CG 3.46Å; L173-L177 PolarHBondContact O-N 2.95Å; V174-L177 PolarHBondContact O-N 3.34Å; A175-L177 PolarHBondContact O-N 3.35Å; L177-N179 PolarHBondContact O-N 3.22Å; L177-S180 WeakPolarHBondContact O-CB 3.41Å; L177-S180 PolarHBondContact O-N 3.1Å; L177-S180 VanDerWaalsContact O-N 3.1Å; L177-S180 PolarHBondContact O-OG 2.87Å; L177-L182 HydrophobicContact CD2-CD2 4Å; L177-P183 WeakPolarHBondContact O-CD 3.24Å; L177-P183 WeakPolarHBondContact O-CG 3.46Å; L177-I210 HydrophobicContact CB-CG1 4.15Å; L177-I210 HydrophobicContact CD1-CG1 4.3Å
178V94.3Very high91.2Very high0 Ų031.8 Ų31.80%018%0.176CC..Hα-helixtrans-58.7-37.3176.1169.70000111.3V174 A175 I210 E215 V217 P218 H221V174-V178 HydrophobicContact CG1-CG2 4.23Å; V174-V178 VanDerWaalsContact O-CG2 3.29Å; V174-V178 WeakPolarHBondContact O-CG2 3.11Å; V174-V178 PolarHBondContact O-N 3.24Å; A175-V178 PolarHBondContact O-N 3.18Å; V178-I210 HydrophobicContact CB-CG2 4.49Å; V178-I210 HydrophobicContact CG2-CG2 3.64Å; V178-I210 WeakPolarHBondContact CG2-O 3.36Å; V178-E215 HydrophobicContact CG1-CB 4.44Å; V178-V217 HydrophobicContact CG1-CG2 4.23Å; V178-P218 WeakPolarHBondContact O-CD 3.17Å; V178-H221 PolarHBondContact O-CE1 2.74Å
179N94.6Very high91.5Very high94 Ų9429.8 Ų29.850%0.50317%0.167SC..THydrogen-bonded Turntrans-85.7-4.8179.2-73.8-77.6000114.2A175 Y176 L177A175-N179 PolarHBondContact O-N 3.35Å; A175-N179 PolarHBondContact O-ND2 3.39Å; Y176-N179 PolarHBondContact O-N 3.45Å; L177-N179 PolarHBondContact O-N 3.22Å
180S94.5Very high92Very high16 Ų1628.9 Ų28.911%0.11216%0.163CC..SBendtrans-86.2171.9176.878.50000111.7Y176 L177 L182 P183 H221Y176-S180 PolarHBondContact O-N 2.69Å; Y176-S180 VanDerWaalsContact O-N 3.13Å; L177-S180 WeakPolarHBondContact O-CB 3.41Å; L177-S180 PolarHBondContact O-N 3.1Å; L177-S180 VanDerWaalsContact O-N 3.1Å; L177-S180 PolarHBondContact O-OG 2.87Å; S180-L182 PolarHBondContact O-N 3.13Å; S180-L182 VanDerWaalsContact OG-CB 3.24Å; S180-L182 WeakPolarHBondContact OG-CB 3.31Å; S180-L182 PolarHBondContact OG-N 3.39Å; S180-P183 WeakPolarHBondContact O-CD 3.48Å; S180-H221 PolarHBondContact O-CE1 3.17Å; S180-H221 PolarHBondContact O-NE2 3.36Å
181S92.8Very high92.4Very high51 Ų5129.9 Ų29.936%0.35717%0.166SC..SBendtrans-72.2-2.9171.550.30000114.4Q145 P184 Q185Q145-S181 PolarHBondContact NE2-OG 3.17Å; S181-P184 WeakPolarHBondContact O-CD 3.19Å; S181-P184 WeakPolarHBondContact O-CG 3.27Å; S181-Q185 WeakPolarHBondContact O-CB 3.46Å; S181-Q185 PolarHBondContact O-N 2.84Å
182L94.3Very high92.6Very high1 Ų130.6 Ų30.61%0.00517%0.17CC..Hα-helixtrans-64-47.6-176-175.470000113.5I141 Y144 L162 L177 S180 Q185 V186 L206 I210I141-L182 HydrophobicContact CG1-CD2 4.5Å; I141-L182 HydrophobicContact CG2-CB 4.22Å; Y144-L182 HydrophobicContact CD1-CD1 3.79Å; Y144-L182 HydrophobicContact CE1-CD1 4.23Å; Y144-L182 HydrophobicContact CG-CD1 4.19Å; L162-L182 HydrophobicContact CD1-CD1 4.22Å; L162-L182 HydrophobicContact CD1-CD2 3.91Å; L177-L182 HydrophobicContact CD2-CD2 4Å; S180-L182 PolarHBondContact O-N 3.13Å; S180-L182 VanDerWaalsContact OG-CB 3.24Å; S180-L182 WeakPolarHBondContact OG-CB 3.31Å; S180-L182 PolarHBondContact OG-N 3.39Å; L182-Q185 PolarHBondContact O-N 3.44Å; L182-V186 HydrophobicContact CD1-CG2 3.74Å; L182-V186 HydrophobicContact CG-CG2 3.96Å; L182-V186 WeakPolarHBondContact O-CG2 3.44Å; L182-V186 PolarHBondContact O-N 3.11Å; L182-L206 HydrophobicContact CD2-CD2 4.39Å; L182-I210 HydrophobicContact CD2-CD1 3.82Å; L182-I210 HydrophobicContact CG-CD1 4.26Å
183P95.9Very high92.8Very high0 Ų025.6 Ų25.60%015%0.148CC..Hα-helixtrans-57.8-51-176.7-1829.3000113.9L177 S180 Q185 V186 A187 I210 F211L177-P183 WeakPolarHBondContact O-CD 3.24Å; L177-P183 WeakPolarHBondContact O-CG 3.46Å; S180-P183 WeakPolarHBondContact O-CD 3.48Å; P183-Q185 VanDerWaalsContact C-N 3.29Å; P183-Q185 PolarHBondContact O-N 2.82Å; P183-V186 PolarHBondContact O-N 2.62Å; P183-A187 WeakPolarHBondContact O-CB 3.25Å; P183-A187 PolarHBondContact O-N 3.24Å; P183-I210 HydrophobicContact CB-CG2 4.31Å; P183-I210 HydrophobicContact CG-CG2 3.83Å; P183-F211 HydrophobicContact CB-CE1 4.17Å; P183-F211 HydrophobicContact CB-CZ 3.83Å
184P95.8Very high92.7Very high20 Ų2030.3 Ų30.313%0.1317%0.173CC..Hα-helixtrans-66.8-31177.626.7-33.2000112.1S181 S188 H221 V224S181-P184 WeakPolarHBondContact O-CD 3.19Å; S181-P184 WeakPolarHBondContact O-CG 3.27Å; P184-S188 VanDerWaalsContact O-CB 3.26Å; P184-S188 WeakPolarHBondContact O-CB 3.4Å; P184-S188 PolarHBondContact O-N 2.85Å; P184-H221 HydrophobicContact CG-CB 4.46Å; P184-V224 HydrophobicContact CB-CB 3.93Å; P184-V224 HydrophobicContact CB-CG2 4Å; P184-V224 WeakPolarHBondContact O-CG1 3.43Å
185Q92.8Very high92.2Very high56 Ų5631.7 Ų31.726%0.26218%0.182SC..Hα-helixtrans-65.2-50.6175.6-169.965.548.900111.4Y144 C148 S181 L182 P183 A187 S188 D189Y144-Q185 HydrophobicContact CD1-CG 4.12Å; Y144-Q185 HydrophobicContact CE1-CB 4.37Å; Y144-Q185 HydrophobicContact CE1-CG 3.72Å; C148-Q185 PolarHBondContact SG-NE2 2.8Å; S181-Q185 WeakPolarHBondContact O-CB 3.46Å; S181-Q185 PolarHBondContact O-N 2.84Å; L182-Q185 PolarHBondContact O-N 3.44Å; P183-Q185 VanDerWaalsContact C-N 3.29Å; P183-Q185 PolarHBondContact O-N 2.82Å; Q185-A187 VanDerWaalsContact C-N 3.29Å; Q185-A187 PolarHBondContact O-N 3.12Å; Q185-S188 WeakPolarHBondContact O-CB 3.4Å; Q185-S188 PolarHBondContact O-N 3.34Å; Q185-D189 PolarHBondContact NE2-OD1 3.25Å; Q185-D189 PolarHBondContact O-N 3.47Å
186V94.2Very high91.6Very high0 Ų033.9 Ų33.90%019%0.189CC..Hα-helixtrans-63-38179.3177.80000110.8Y144 L182 P183 L190 H203 L206 L207Y144-V186 HydrophobicContact CE1-CG2 3.95Å; L182-V186 HydrophobicContact CD1-CG2 3.74Å; L182-V186 HydrophobicContact CG-CG2 3.96Å; L182-V186 WeakPolarHBondContact O-CG2 3.44Å; L182-V186 PolarHBondContact O-N 3.11Å; P183-V186 PolarHBondContact O-N 2.62Å; V186-L190 VanDerWaalsContact O-CB 3.26Å; V186-L190 WeakPolarHBondContact O-CB 3.35Å; V186-L190 PolarHBondContact O-N 3.15Å; V186-H203 HydrophobicContact CG1-CB 4.07Å; V186-L206 HydrophobicContact CG2-CD2 3.95Å; V186-L207 HydrophobicContact CB-CD2 4.17Å; V186-L207 HydrophobicContact CB-CG 4.32Å; V186-L207 HydrophobicContact CG1-CD1 3.91Å; V186-L207 HydrophobicContact CG1-CD2 4.12Å; V186-L207 HydrophobicContact CG1-CG 3.72Å
187A95.9Very high91.3Very high0 Ų032.3 Ų32.30%019%0.186CC..Hα-helixtrans-65.8-42.8174.600000112.2P183 Q185 D189 L190 V191 V224 L225 F229P183-A187 WeakPolarHBondContact O-CB 3.25Å; P183-A187 PolarHBondContact O-N 3.24Å; Q185-A187 VanDerWaalsContact C-N 3.29Å; Q185-A187 PolarHBondContact O-N 3.12Å; A187-D189 VanDerWaalsContact C-N 3.35Å; A187-L190 PolarHBondContact O-N 3.46Å; A187-V191 WeakPolarHBondContact O-CG1 3.13Å; A187-V191 WeakPolarHBondContact O-CG2 3.42Å; A187-V191 PolarHBondContact O-N 2.98Å; A187-V224 HydrophobicContact CB-CG1 4.04Å; A187-L225 HydrophobicContact CB-CD2 3.45Å; A187-L225 VanDerWaalsContact CB-CD2 3.45Å; A187-F229 HydrophobicContact CB-CD2 3.86Å; A187-F229 HydrophobicContact CB-CE2 3.68Å; A187-F229 HydrophobicContact CB-CZ 4.18Å
188S94Very high90.8Very high46 Ų4638.8 Ų38.832%0.32222%0.22SC..Hα-helixtrans-61.2-44.2176.2-175.40000111.3P184 Q185 V191 T192P184-S188 VanDerWaalsContact O-CB 3.26Å; P184-S188 WeakPolarHBondContact O-CB 3.4Å; P184-S188 PolarHBondContact O-N 2.85Å; Q185-S188 WeakPolarHBondContact O-CB 3.4Å; Q185-S188 PolarHBondContact O-N 3.34Å; S188-V191 WeakPolarHBondContact O-CG2 3.45Å; S188-T192 WeakPolarHBondContact O-CG2 3.31Å
189D90.8Very high90.4Very high12 Ų1242 Ų426%0.06423%0.234CC..Hα-helixtrans-63.2-46.1177.3-61.2-18.8000110.3Y144 C148 Q185 A187 V191 T192 L193Y144-D189 PolarHBondContact OH-OD2 3.35Å; C148-D189 PolarHBondContact SG-OD1 2.9Å; C148-D189 PolarHBondContact SG-OD2 3.02Å; Q185-D189 PolarHBondContact NE2-OD1 3.25Å; Q185-D189 PolarHBondContact O-N 3.47Å; A187-D189 VanDerWaalsContact C-N 3.35Å; D189-V191 PolarHBondContact O-N 3.18Å; D189-T192 PolarHBondContact O-N 3.27Å; D189-T192 VanDerWaalsContact O-N 3.07Å; D189-T192 PolarHBondContact O-OG1 2.91Å; D189-L193 PolarHBondContact O-N 3.37Å
190L92.9Very high90.2Very high0 Ų037.6 Ų37.60%021%0.211CC..Hα-helixtrans-58.1-45.3-179.2176.258.4000112.5V186 A187 T192 L193 V200 H203 L204 L207 F229 F232 L233V186-L190 VanDerWaalsContact O-CB 3.26Å; V186-L190 WeakPolarHBondContact O-CB 3.35Å; V186-L190 PolarHBondContact O-N 3.15Å; A187-L190 PolarHBondContact O-N 3.46Å; L190-T192 PolarHBondContact O-N 3.38Å; L190-L193 WeakPolarHBondContact O-CB 3.42Å; L190-L193 PolarHBondContact O-N 3.11Å; L190-L193 VanDerWaalsContact O-N 3.09Å; L190-V200 HydrophobicContact CD1-CB 4.44Å; L190-V200 HydrophobicContact CD1-CG1 4.06Å; L190-V200 HydrophobicContact CD1-CG2 4.22Å; L190-H203 HydrophobicContact CB-CB 4.12Å; L190-H203 HydrophobicContact CD1-CB 3.98Å; L190-H203 HydrophobicContact CD2-CB 4.3Å; L190-H203 HydrophobicContact CG-CB 4.35Å; L190-L204 HydrophobicContact CD2-CD2 3.61Å; L190-L204 HydrophobicContact CD2-CG 4.36Å; L190-L207 HydrophobicContact CD2-CD1 3.86Å; L190-F229 HydrophobicContact CD2-CE2 4.3Å; L190-F232 HydrophobicContact CD1-CE1 3.86Å; L190-F232 HydrophobicContact CD1-CZ 4.47Å; L190-F232 HydrophobicContact CD2-CE1 4.4Å; L190-F232 HydrophobicContact CG-CD1 4.34Å; L190-F232 HydrophobicContact CG-CE1 3.71Å; L190-F232 WeakPolarHBondContact O-CZ 3.05Å; L190-L233 HydrophobicContact CD2-CD2 4.2Å
191V93.3Very high90Very high34 Ų3438.2 Ų38.221%0.20621%0.214CC..Hα-helixtrans-70-10.2-179.9-61.50000113.9A187 S188 D189 F229 F232A187-V191 WeakPolarHBondContact O-CG1 3.13Å; A187-V191 WeakPolarHBondContact O-CG2 3.42Å; A187-V191 PolarHBondContact O-N 2.98Å; S188-V191 WeakPolarHBondContact O-CG2 3.45Å; D189-V191 PolarHBondContact O-N 3.18Å; V191-F229 HydrophobicContact CG1-CD2 4.04Å; V191-F232 HydrophobicContact CG1-CB 4.24Å; V191-F232 HydrophobicContact CG1-CD1 4.21Å; V191-F232 HydrophobicContact CG1-CG 4.16Å
192T90.1Very high89.9Confident100 Ų10036.6 Ų36.661%0.61320%0.204SC*.Hα-helixtrans-90.1-15.3172.7670000113.2S188 D189 L190S188-T192 WeakPolarHBondContact O-CG2 3.31Å; D189-T192 PolarHBondContact O-N 3.27Å; D189-T192 VanDerWaalsContact O-N 3.07Å; D189-T192 PolarHBondContact O-OG1 2.91Å; L190-T192 PolarHBondContact O-N 3.38Å
193L87.4Confident89.8Confident19 Ų1936.5 Ų36.510%0.09920%0.204CC..SBendtrans-79.8153.9178.2-62.9176.5000111.2W152 D189 L190 D197 K199 V200W152-L193 HydrophobicContact CH2-CD2 4.17Å; W152-L193 HydrophobicContact CZ3-CD2 4.47Å; D189-L193 PolarHBondContact O-N 3.37Å; L190-L193 WeakPolarHBondContact O-CB 3.42Å; L190-L193 PolarHBondContact O-N 3.11Å; L190-L193 VanDerWaalsContact O-N 3.09Å; L193-D197 HydrophobicContact CB-CB 4.36Å; L193-K199 HydrophobicContact CD1-CB 4.12Å; L193-V200 HydrophobicContact CB-CG2 4.14Å; L193-V200 HydrophobicContact CD1-CG2 4.18Å
194N85.7Confident89.7Confident99 Ų9936.5 Ų36.553%0.52920%0.204SC..  trans-69.6141.1162.6-171.9-55.1000108.6H196 D197 V200N194-H196 PolarHBondContact O-N 3.13Å; N194-H196 WeakPolarHBondContact OD1-CB 3.32Å; N194-H196 PolarHBondContact OD1-CD2 3.42Å; N194-H196 PolarHBondContact OD1-N 2.91Å; N194-D197 HydrophobicContact CB-CB 4.49Å; N194-D197 VanDerWaalsContact O-CB 3.27Å; N194-D197 WeakPolarHBondContact O-CB 3.37Å; N194-D197 PolarHBondContact O-N 3.19Å; N194-V200 VanDerWaalsContact O-CG2 3.29Å; N194-V200 WeakPolarHBondContact O-CG2 3.5Å
195S79.1Confident89.5Confident28 Ų2839.7 Ų39.720%0.19622%0.215CC..THydrogen-bonded Turntrans-54.8-22.5176.549.80000113.8
196H78.4Confident89.5Confident65 Ų6537.1 Ų37.130%0.30120%0.203SC..THydrogen-bonded Turntrans-98.33.8-179.7-52.8-47.5000113.8N194 D239 Q242N194-H196 PolarHBondContact O-N 3.13Å; N194-H196 WeakPolarHBondContact OD1-CB 3.32Å; N194-H196 PolarHBondContact OD1-CD2 3.42Å; N194-H196 PolarHBondContact OD1-N 2.91Å; H196-D239 IonicContact CE1-OD2 3.13Å; H196-D239 IonicContact NE2-OD2 3.23Å; H196-Q242 WeakPolarHBondContact CE1-CB 3.34Å; H196-Q242 PolarHBondContact CE1-O 2.85Å; H196-Q242 PolarHBondContact ND1-O 3.04Å; H196-Q242 VanDerWaalsContact ND1-O 3.16Å
197D85.8Confident89.6Confident36 Ų3637.1 Ų37.119%0.19320%0.203CC..  trans-69.6137.5176.4-173.5-66.3000110.3L193 N194 K199 V200L193-D197 HydrophobicContact CB-CB 4.36Å; N194-D197 HydrophobicContact CB-CB 4.49Å; N194-D197 VanDerWaalsContact O-CB 3.27Å; N194-D197 WeakPolarHBondContact O-CB 3.37Å; N194-D197 PolarHBondContact O-N 3.19Å; D197-K199 PolarHBondContact O-N 2.99Å; D197-K199 VanDerWaalsContact O-N 3.09Å; D197-K199 WeakPolarHBondContact OD1-CB 3.35Å; D197-K199 VanDerWaalsContact OD1-CD 3.27Å; D197-K199 WeakPolarHBondContact OD1-CD 3.39Å; D197-K199 WeakPolarHBondContact OD1-CG 3.23Å; D197-K199 PolarHBondContact OD1-N 3.11Å; D197-K199 IonicContact OD1-NZ 2.82Å; D197-K199 PolarHBondContact OD1-NZ 2.99Å; D197-K199 IonicContact OD2-NZ 2.8Å; D197-K199 PolarHBondContact OD2-NZ 2.86Å; D197-V200 HydrophobicContact CB-CG2 4.22Å; D197-V200 WeakPolarHBondContact O-CB 3.47Å; D197-V200 WeakPolarHBondContact O-CG2 3.42Å; D197-V200 PolarHBondContact O-N 3.14Å; D197-V200 VanDerWaalsContact O-N 3.11Å
198D85.3Confident89.5Confident137 Ų13737.1 Ų37.173%0.73320%0.203SC*.THydrogen-bonded Turntrans-64-14.8-176.762.4-31.8000113.4P201D198-P201 WeakPolarHBondContact O-CD 3.41Å
199K85.5Confident89.4Confident69 Ų6935 Ų3530%0.319%0.189SC..THydrogen-bonded Turntrans-86.3-18177.9-55.9160.7-153.51310113.2W152 L193 D197 P201 A202 H203W152-K199 HydrophobicContact CE3-CD 4.01Å; W152-K199 HydrophobicContact CZ3-CD 4.36Å; L193-K199 HydrophobicContact CD1-CB 4.12Å; D197-K199 PolarHBondContact O-N 2.99Å; D197-K199 VanDerWaalsContact O-N 3.09Å; D197-K199 WeakPolarHBondContact OD1-CB 3.35Å; D197-K199 VanDerWaalsContact OD1-CD 3.27Å; D197-K199 WeakPolarHBondContact OD1-CD 3.39Å; D197-K199 WeakPolarHBondContact OD1-CG 3.23Å; D197-K199 PolarHBondContact OD1-N 3.11Å; D197-K199 IonicContact OD1-NZ 2.82Å; D197-K199 PolarHBondContact OD1-NZ 2.99Å; D197-K199 IonicContact OD2-NZ 2.8Å; D197-K199 PolarHBondContact OD2-NZ 2.86Å; K199-P201 VanDerWaalsContact C-CD 3.43Å; K199-A202 PolarHBondContact O-N 2.7Å; K199-H203 PolarHBondContact O-ND1 2.92Å
200V90.1Very high89.5Confident0 Ų034.5 Ų34.50%019%0.186CC..Hα-helixtrans-52.7-46.5-178.9168.90000112.6L190 L193 N194 D197 A202 H203 L204 I236 I247L190-V200 HydrophobicContact CD1-CB 4.44Å; L190-V200 HydrophobicContact CD1-CG1 4.06Å; L190-V200 HydrophobicContact CD1-CG2 4.22Å; L193-V200 HydrophobicContact CB-CG2 4.14Å; L193-V200 HydrophobicContact CD1-CG2 4.18Å; N194-V200 VanDerWaalsContact O-CG2 3.29Å; N194-V200 WeakPolarHBondContact O-CG2 3.5Å; D197-V200 HydrophobicContact CB-CG2 4.22Å; D197-V200 WeakPolarHBondContact O-CB 3.47Å; D197-V200 WeakPolarHBondContact O-CG2 3.42Å; D197-V200 PolarHBondContact O-N 3.14Å; D197-V200 VanDerWaalsContact O-N 3.11Å; V200-A202 VanDerWaalsContact C-N 3.27Å; V200-A202 PolarHBondContact O-N 3.01Å; V200-H203 PolarHBondContact O-N 3.21Å; V200-H203 VanDerWaalsContact O-N 3.13Å; V200-L204 HydrophobicContact CG1-CD1 3.57Å; V200-L204 HydrophobicContact CG1-CG 4.03Å; V200-L204 WeakPolarHBondContact O-CG 3.29Å; V200-L204 PolarHBondContact O-N 2.94Å; V200-L204 VanDerWaalsContact O-N 3.08Å; V200-I236 HydrophobicContact CG1-CD1 4.27Å; V200-I247 HydrophobicContact CG1-CG2 4.02Å
201P90.7Very high89.6Confident30 Ų3034.7 Ų34.720%0.19519%0.187CC..Hα-helixtrans-55.9-37.8-178.9-25.833.9000114.2D198 K199 K205 I247 L250D198-P201 WeakPolarHBondContact O-CD 3.41Å; K199-P201 VanDerWaalsContact C-CD 3.43Å; P201-K205 WeakPolarHBondContact O-CB 3.33Å; P201-K205 VanDerWaalsContact O-CG 3.3Å; P201-K205 WeakPolarHBondContact O-CG 3.22Å; P201-K205 PolarHBondContact O-N 3.41Å; P201-I247 HydrophobicContact CG-CD1 3.71Å; P201-I247 HydrophobicContact CG-CG1 3.99Å; P201-L250 HydrophobicContact CB-CD1 3.8Å
202A89.4Confident89.5Confident16 Ų1633.2 Ų33.213%0.13218%0.178CC..Hα-helixtrans-69.3-37.3-178.300000112.1L156 K159 K199 V200 L206L156-A202 HydrophobicContact CD1-CB 3.58Å; K159-A202 HydrophobicContact CD-CB 4.24Å; K199-A202 PolarHBondContact O-N 2.7Å; V200-A202 VanDerWaalsContact C-N 3.27Å; V200-A202 PolarHBondContact O-N 3.01Å; A202-L206 WeakPolarHBondContact O-CB 3.31Å; A202-L206 PolarHBondContact O-N 3.35Å
203H92.8Very high89.5Confident0 Ų030.2 Ų30.20%016%0.159CC..Hα-helixtrans-67.6-46.5175.8-6579.6000110.8K159 V186 L190 K199 V200 K205 L206 L207K159-H203 PolarHBondContact NZ-CE1 3.37Å; K159-H203 PolarHBondContact NZ-NE2 3.43Å; V186-H203 HydrophobicContact CG1-CB 4.07Å; L190-H203 HydrophobicContact CB-CB 4.12Å; L190-H203 HydrophobicContact CD1-CB 3.98Å; L190-H203 HydrophobicContact CD2-CB 4.3Å; L190-H203 HydrophobicContact CG-CB 4.35Å; K199-H203 PolarHBondContact O-ND1 2.92Å; V200-H203 PolarHBondContact O-N 3.21Å; V200-H203 VanDerWaalsContact O-N 3.13Å; H203-K205 PolarHBondContact O-N 3.06Å; H203-L206 PolarHBondContact O-N 3.43Å; H203-L207 WeakPolarHBondContact O-CG 3.45Å; H203-L207 PolarHBondContact O-N 2.79Å
204L94.1Very high89.7Confident0 Ų030.5 Ų30.50%017%0.167CC..Hα-helixtrans-61.8-45.7179.8-65.3174.3000111.6L190 V200 L206 L207 A208 L233 I247 L250 A251 V254L190-L204 HydrophobicContact CD2-CD2 3.61Å; L190-L204 HydrophobicContact CD2-CG 4.36Å; V200-L204 HydrophobicContact CG1-CD1 3.57Å; V200-L204 HydrophobicContact CG1-CG 4.03Å; V200-L204 WeakPolarHBondContact O-CG 3.29Å; V200-L204 PolarHBondContact O-N 2.94Å; V200-L204 VanDerWaalsContact O-N 3.08Å; L204-L206 VanDerWaalsContact C-N 3.35Å; L204-L206 PolarHBondContact O-N 3.14Å; L204-L207 PolarHBondContact O-N 2.65Å; L204-A208 VanDerWaalsContact O-CB 3.32Å; L204-A208 WeakPolarHBondContact O-CB 3.47Å; L204-A208 PolarHBondContact O-N 3.01Å; L204-L233 HydrophobicContact CD2-CD2 3.51Å; L204-I247 HydrophobicContact CD1-CG2 3.94Å; L204-L250 HydrophobicContact CB-CB 3.74Å; L204-L250 HydrophobicContact CD1-CB 3.75Å; L204-L250 HydrophobicContact CG-CB 4.4Å; L204-A251 HydrophobicContact CD1-CB 4.32Å; L204-V254 HydrophobicContact CB-CG2 4.04Å; L204-V254 HydrophobicContact CD2-CG2 3.82Å; L204-V254 WeakPolarHBondContact O-CG2 3.46Å
205K92.1Very high90Very high87 Ų8729.2 Ų29.238%0.37816%0.158SC..Hα-helixtrans-59.6-44.4177.4-76176.3-178.5-1790112.4L163 P201 H203 A209 L250L163-K205 HydrophobicContact CD2-CB 4.2Å; P201-K205 WeakPolarHBondContact O-CB 3.33Å; P201-K205 VanDerWaalsContact O-CG 3.3Å; P201-K205 WeakPolarHBondContact O-CG 3.22Å; P201-K205 PolarHBondContact O-N 3.41Å; H203-K205 PolarHBondContact O-N 3.06Å; K205-A209 WeakPolarHBondContact O-CB 3.48Å; K205-A209 PolarHBondContact O-N 3.2Å; K205-L250 HydrophobicContact CD-CD2 4.49Å; K205-L250 HydrophobicContact CG-CD1 4.14Å; K205-L250 HydrophobicContact CG-CD2 3.68Å
206L92.5Very high90.6Very high2 Ų232.9 Ų32.91%0.0118%0.179CC..Hα-helixtrans-65.8-44.4179.3-179.559.5000111.5K159 L162 L182 V186 A202 H203 L204 A209 I210K159-L206 HydrophobicContact CB-CD2 4.14Å; K159-L206 HydrophobicContact CD-CD2 4.39Å; K159-L206 HydrophobicContact CG-CD2 3.75Å; L162-L206 HydrophobicContact CB-CD1 4.07Å; L162-L206 HydrophobicContact CD1-CD2 4.44Å; L182-L206 HydrophobicContact CD2-CD2 4.39Å; V186-L206 HydrophobicContact CG2-CD2 3.95Å; A202-L206 WeakPolarHBondContact O-CB 3.31Å; A202-L206 PolarHBondContact O-N 3.35Å; H203-L206 PolarHBondContact O-N 3.43Å; L204-L206 VanDerWaalsContact C-N 3.35Å; L204-L206 PolarHBondContact O-N 3.14Å; L206-A209 WeakPolarHBondContact O-CB 3.46Å; L206-A209 PolarHBondContact O-N 2.92Å; L206-I210 HydrophobicContact CD1-CD1 4.02Å; L206-I210 HydrophobicContact CD1-CG1 4.24Å; L206-I210 HydrophobicContact CG-CD1 3.86Å; L206-I210 HydrophobicContact CG-CG1 4.49Å; L206-I210 VanDerWaalsContact O-CG1 3.27Å; L206-I210 WeakPolarHBondContact O-CG1 3.26Å; L206-I210 PolarHBondContact O-N 3.15Å
207L95.1Very high91.4Very high0 Ų030.5 Ų30.50%017%0.169CC..Hα-helixtrans-64.3-43177.4-73.7165.4000112V186 L190 H203 L204 A209 I210 F211 F229 V254V186-L207 HydrophobicContact CB-CD2 4.17Å; V186-L207 HydrophobicContact CB-CG 4.32Å; V186-L207 HydrophobicContact CG1-CD1 3.91Å; V186-L207 HydrophobicContact CG1-CD2 4.12Å; V186-L207 HydrophobicContact CG1-CG 3.72Å; L190-L207 HydrophobicContact CD2-CD1 3.86Å; H203-L207 WeakPolarHBondContact O-CG 3.45Å; H203-L207 PolarHBondContact O-N 2.79Å; L204-L207 PolarHBondContact O-N 2.65Å; L207-A209 VanDerWaalsContact C-N 3.27Å; L207-A209 PolarHBondContact O-N 2.81Å; L207-I210 PolarHBondContact O-N 2.78Å; L207-F211 HydrophobicContact CB-CD2 4.46Å; L207-F211 HydrophobicContact CB-CE2 4.34Å; L207-F211 HydrophobicContact CD2-CE2 3.78Å; L207-F211 HydrophobicContact CD2-CZ 4.31Å; L207-F211 WeakPolarHBondContact O-CD2 3.2Å; L207-F211 PolarHBondContact O-N 3.18Å; L207-F229 HydrophobicContact CD1-CE2 4.18Å; L207-F229 HydrophobicContact CD1-CZ 4.13Å; L207-V254 HydrophobicContact CB-CG1 3.98Å; L207-V254 HydrophobicContact CB-CG2 3.96Å
208A94.2Very high91.9Very high0 Ų030.3 Ų30.30%017%0.17CC..Hα-helixtrans-60-39.9175.500000111.2L204 S212 A253 V254 C302L204-A208 VanDerWaalsContact O-CB 3.32Å; L204-A208 WeakPolarHBondContact O-CB 3.47Å; L204-A208 PolarHBondContact O-N 3.01Å; A208-S212 VanDerWaalsContact O-CB 3.31Å; A208-S212 WeakPolarHBondContact O-CB 3.5Å; A208-S212 PolarHBondContact O-N 3.24Å; A208-S212 VanDerWaalsContact O-N 3.08Å; A208-A253 HydrophobicContact CB-CB 3.96Å; A208-V254 HydrophobicContact CB-CG2 4.02Å; A208-C302 HydrophobicContact CB-CB 3.77Å
209A91.8Very high92.3Very high1 Ų132 Ų321%0.00817%0.171CC..Hα-helixtrans-65.1-46175.100000113.3L163 K205 L206 L207 F211 S212 T303 W307L163-A209 HydrophobicContact CD1-CB 3.45Å; L163-A209 VanDerWaalsContact CD1-CB 3.45Å; K205-A209 WeakPolarHBondContact O-CB 3.48Å; K205-A209 PolarHBondContact O-N 3.2Å; L206-A209 WeakPolarHBondContact O-CB 3.46Å; L206-A209 PolarHBondContact O-N 2.92Å; L207-A209 VanDerWaalsContact C-N 3.27Å; L207-A209 PolarHBondContact O-N 2.81Å; A209-F211 VanDerWaalsContact C-N 3.34Å; A209-F211 PolarHBondContact O-N 3.21Å; A209-S212 WeakPolarHBondContact O-CB 3.47Å; A209-S212 PolarHBondContact O-N 3.46Å; A209-S212 PolarHBondContact O-OG 2.86Å; A209-T303 VanDerWaalsContact CA-CG2 3.43Å; A209-T303 HydrophobicContact CB-CG2 3.81Å; A209-W307 HydrophobicContact CB-CZ3 4.12Å
210I93.4Very high92.7Very high1 Ų135.5 Ų35.51%0.00519%0.193CC..Hα-helixtrans-60.9-43178.5-72.5170.2000111.1V174 L177 V178 L182 P183 L206 L207V174-I210 WeakPolarHBondContact CG1-O 3.44Å; L177-I210 HydrophobicContact CB-CG1 4.15Å; L177-I210 HydrophobicContact CD1-CG1 4.3Å; V178-I210 HydrophobicContact CB-CG2 4.49Å; V178-I210 HydrophobicContact CG2-CG2 3.64Å; V178-I210 WeakPolarHBondContact CG2-O 3.36Å; L182-I210 HydrophobicContact CD2-CD1 3.82Å; L182-I210 HydrophobicContact CG-CD1 4.26Å; P183-I210 HydrophobicContact CB-CG2 4.31Å; P183-I210 HydrophobicContact CG-CG2 3.83Å; L206-I210 HydrophobicContact CD1-CD1 4.02Å; L206-I210 HydrophobicContact CD1-CG1 4.24Å; L206-I210 HydrophobicContact CG-CD1 3.86Å; L206-I210 HydrophobicContact CG-CG1 4.49Å; L206-I210 VanDerWaalsContact O-CG1 3.27Å; L206-I210 WeakPolarHBondContact O-CG1 3.26Å; L206-I210 PolarHBondContact O-N 3.15Å; L207-I210 PolarHBondContact O-N 2.78Å
211F94.1Very high93Very high5 Ų536.2 Ų36.22%0.02220%0.196CC..Hα-helixtrans-88.3-2.6-177.3-59.4-52.4000114.3P183 L207 A209 T213 G214 V217 L225 A257 F258P183-F211 HydrophobicContact CB-CE1 4.17Å; P183-F211 HydrophobicContact CB-CZ 3.83Å; L207-F211 HydrophobicContact CB-CD2 4.46Å; L207-F211 HydrophobicContact CB-CE2 4.34Å; L207-F211 HydrophobicContact CD2-CE2 3.78Å; L207-F211 HydrophobicContact CD2-CZ 4.31Å; L207-F211 WeakPolarHBondContact O-CD2 3.2Å; L207-F211 PolarHBondContact O-N 3.18Å; A209-F211 VanDerWaalsContact C-N 3.34Å; A209-F211 PolarHBondContact O-N 3.21Å; F211-T213 PolarHBondContact O-N 3.13Å; F211-T213 VanDerWaalsContact O-N 3.09Å; F211-G214 PolarHBondContact O-N 3.16Å; F211-G214 VanDerWaalsContact O-N 3.16Å; F211-V217 HydrophobicContact CD1-CG2 4.08Å; F211-V217 HydrophobicContact CE1-CG2 3.82Å; F211-L225 HydrophobicContact CE1-CD1 4.29Å; F211-L225 HydrophobicContact CZ-CD1 3.75Å; F211-L225 HydrophobicContact CZ-CD2 4.39Å; F211-A257 HydrophobicContact CB-CB 3.83Å; F211-A257 VanDerWaalsContact O-O 3.14Å; F211-F258 HydrophobicContact CD1-CD2 4.18Å; F211-F258 HydrophobicContact CD2-CB 4.01Å; F211-F258 HydrophobicContact CD2-CD2 4.1Å; F211-F258 HydrophobicContact CD2-CG 4.48Å; F211-F258 HydrophobicContact CE1-CD2 4.06Å; F211-F258 HydrophobicContact CE1-CE2 4.47Å; F211-F258 HydrophobicContact CE2-CB 4.46Å; F211-F258 AromaticContact CE2-CD2 3.96Å; F211-F258 HydrophobicContact CE2-CD2 3.96Å; F211-F258 HydrophobicContact CG-CB 4.35Å; F211-F258 HydrophobicContact CG-CD2 4.22Å; F211-F258 AromaticContact CZ-CD2 3.95Å; F211-F258 HydrophobicContact CZ-CD2 3.95Å; F211-F258 HydrophobicContact CZ-CE2 4.37Å
212S92.4Very high93.3Very high2 Ų237.5 Ų37.51%0.01420%0.197CC..THydrogen-bonded Turntrans-60.7-23.9-170.761.50000115.6A208 A209 L260A208-S212 VanDerWaalsContact O-CB 3.31Å; A208-S212 WeakPolarHBondContact O-CB 3.5Å; A208-S212 PolarHBondContact O-N 3.24Å; A208-S212 VanDerWaalsContact O-N 3.08Å; A209-S212 WeakPolarHBondContact O-CB 3.47Å; A209-S212 PolarHBondContact O-N 3.46Å; A209-S212 PolarHBondContact O-OG 2.86Å; S212-L260 WeakPolarHBondContact O-CD1 3.36Å
213T90.1Very high93.6Very high38 Ų3839.7 Ų39.723%0.23322%0.221CC..THydrogen-bonded Turntrans-88.8-9.9-177.4570000113.8T171 V174 F211 E215T171-T213 HydrophobicContact CG2-CG2 3.85Å; V174-T213 HydrophobicContact CB-CG2 4.01Å; V174-T213 HydrophobicContact CG1-CG2 3.73Å; V174-T213 WeakPolarHBondContact CG1-OG1 3.49Å; V174-T213 HydrophobicContact CG2-CG2 4.38Å; F211-T213 PolarHBondContact O-N 3.13Å; F211-T213 VanDerWaalsContact O-N 3.09Å; T213-E215 PolarHBondContact O-N 3.4Å
214G90.9Very high93.7Very high24 Ų2441.9 Ų41.925%0.24724%0.235CC..  trans6721.5-173.900000114.3F211 H261F211-G214 PolarHBondContact O-N 3.16Å; F211-G214 VanDerWaalsContact O-N 3.16Å; G214-H261 WeakPolarHBondContact O-CA 3.33Å
215E91.4Very high93.9Very high73 Ų7341.9 Ų41.934%0.34124%0.235SC..PPolyproline II helixtrans-65145.3171.9-81.3-152.4178.600112.2A175 V178 T213 V217 H261A175-E215 WeakPolarHBondContact CA-OE2 3.49Å; A175-E215 WeakPolarHBondContact CB-OE1 3.32Å; A175-E215 WeakPolarHBondContact CB-OE2 3.49Å; V178-E215 HydrophobicContact CG1-CB 4.44Å; T213-E215 PolarHBondContact O-N 3.4Å; E215-V217 PolarHBondContact O-N 3.17Å; E215-H261 WeakPolarHBondContact O-CB 3.26Å
216T92.6Very high94Very high105 Ų10540.4 Ų40.464%0.64423%0.231SC*.PPolyproline II helixtrans-60.4128.7-179.853.20000111.2
217V94.5Very high94.2Very high14 Ų1444 Ų449%0.08525%0.247CC..PPolyproline II helixtrans-85.1134.9178.5-177.50000109.9V178 F211 E215 H221 L225 F258V178-V217 HydrophobicContact CG1-CG2 4.23Å; F211-V217 HydrophobicContact CD1-CG2 4.08Å; F211-V217 HydrophobicContact CE1-CG2 3.82Å; E215-V217 PolarHBondContact O-N 3.17Å; V217-H221 HydrophobicContact CG1-CB 3.72Å; V217-L225 HydrophobicContact CG1-CD1 3.93Å; V217-F258 HydrophobicContact CG2-CE2 4.34Å
218P96.2Very high94.2Very high33 Ų3352.7 Ų52.721%0.21428%0.28CS..PPolyproline II helixtrans-54.7140.2173.6-27.733.9000113.3V178 D220 H221V178-P218 WeakPolarHBondContact O-CD 3.17Å; P218-D220 VanDerWaalsContact C-N 3.25Å; P218-D220 PolarHBondContact O-N 2.51Å; P218-H221 WeakPolarHBondContact O-CB 3.23Å; P218-H221 PolarHBondContact O-N 3.45Å
219F93.8Very high94.4Very high172 Ų17252.8 Ų52.875%0.75428%0.281SS*.G310 helixtrans-57.2-37.8-176.5-178-99.1000113.1H221 Y222F219-H221 PolarHBondContact O-N 3.11Å; F219-H221 VanDerWaalsContact O-N 3.09Å; F219-Y222 HydrophobicContact CD2-CD2 4.29Å; F219-Y222 VanDerWaalsContact O-CD2 3.32Å; F219-Y222 WeakPolarHBondContact O-CD2 3.48Å; F219-Y222 PolarHBondContact O-N 3.38Å; F219-Y222 VanDerWaalsContact O-N 3.13Å
220D95.2Very high94.7Very high142 Ų14252.8 Ų52.876%0.75928%0.281SS*.G310 helixtrans-63.9-19-178.5-61.3-21.4000112.8P218 Y222 G223P218-D220 VanDerWaalsContact C-N 3.25Å; P218-D220 PolarHBondContact O-N 2.51Å; D220-Y222 VanDerWaalsContact C-N 3.32Å; D220-Y222 PolarHBondContact O-N 2.58Å; D220-G223 PolarHBondContact O-N 2.86Å
221H96.7Very high94.8Very high16 Ų1654.9 Ų54.97%0.07429%0.292CS..G310 helixtrans-72.4-25.1178.3-63.7-176.3000112.8V178 S180 P184 V217 P218 F219 G223 V224 L225V178-H221 PolarHBondContact O-CE1 2.74Å; S180-H221 PolarHBondContact O-CE1 3.17Å; S180-H221 PolarHBondContact O-NE2 3.36Å; P184-H221 HydrophobicContact CG-CB 4.46Å; V217-H221 HydrophobicContact CG1-CB 3.72Å; P218-H221 WeakPolarHBondContact O-CB 3.23Å; P218-H221 PolarHBondContact O-N 3.45Å; F219-H221 PolarHBondContact O-N 3.11Å; F219-H221 VanDerWaalsContact O-N 3.09Å; H221-G223 PolarHBondContact O-N 3.26Å; H221-G223 VanDerWaalsContact O-N 3.12Å; H221-V224 PolarHBondContact O-N 2.96Å; H221-L225 HydrophobicContact CB-CD1 3.74Å; H221-L225 HydrophobicContact CB-CG 4.28Å; H221-L225 WeakPolarHBondContact O-CB 3.49Å; H221-L225 WeakPolarHBondContact O-CG 3.49Å; H221-L225 PolarHBondContact O-N 3.33Å
222Y95.9Very high94.9Very high57 Ų5756.4 Ų56.422%0.22430%0.298CS..G310 helixtrans-67.6-8.8177.6-64.2-76000113.3F219 D220 V224 L225 N226 F258 H261 F262F219-Y222 HydrophobicContact CD2-CD2 4.29Å; F219-Y222 VanDerWaalsContact O-CD2 3.32Å; F219-Y222 WeakPolarHBondContact O-CD2 3.48Å; F219-Y222 PolarHBondContact O-N 3.38Å; F219-Y222 VanDerWaalsContact O-N 3.13Å; D220-Y222 VanDerWaalsContact C-N 3.32Å; D220-Y222 PolarHBondContact O-N 2.58Å; Y222-V224 PolarHBondContact O-N 2.92Å; Y222-L225 WeakPolarHBondContact CD1-O 3.33Å; Y222-N226 WeakPolarHBondContact O-CB 3.46Å; Y222-F258 HydrophobicContact CD1-CZ 4.48Å; Y222-F258 AromaticContact CE1-CZ 3.99Å; Y222-F258 HydrophobicContact CE1-CZ 3.99Å; Y222-H261 AromaticContact CZ-NE2 3.78Å; Y222-H261 PolarHBondContact OH-NE2 2.82Å; Y222-F262 HydrophobicContact CE1-CE1 4.25Å; Y222-F262 HydrophobicContact CE1-CZ 4.1Å
223G95.1Very high95.1Very high61 Ų6156.3 Ų56.363%0.62930%0.298SS*.G310 helixtrans-56.7-33.2165.300000112.5D220 H221 N226D220-G223 PolarHBondContact O-N 2.86Å; H221-G223 PolarHBondContact O-N 3.26Å; H221-G223 VanDerWaalsContact O-N 3.12Å; G223-N226 PolarHBondContact O-ND2 3.18Å
224V96.3Very high95.4Very high47 Ų4754.6 Ų54.629%0.28529%0.287SS..THydrogen-bonded Turntrans-110.3-42176.5-176.20000112P184 A187 H221 Y222 N226 F229P184-V224 HydrophobicContact CB-CB 3.93Å; P184-V224 HydrophobicContact CB-CG2 4Å; P184-V224 WeakPolarHBondContact O-CG1 3.43Å; A187-V224 HydrophobicContact CB-CG1 4.04Å; H221-V224 PolarHBondContact O-N 2.96Å; Y222-V224 PolarHBondContact O-N 2.92Å; V224-N226 PolarHBondContact O-N 3.4Å; V224-F229 WeakPolarHBondContact O-CB 3.22Å
225L97.1Very high95.5Very high0 Ų058.8 Ų58.80%030%0.296CS..SBendtrans-77.753.1-179.4-55.5-179.6000111.9A187 F211 V217 H221 Y222 F229 F258A187-L225 HydrophobicContact CB-CD2 3.45Å; A187-L225 VanDerWaalsContact CB-CD2 3.45Å; F211-L225 HydrophobicContact CE1-CD1 4.29Å; F211-L225 HydrophobicContact CZ-CD1 3.75Å; F211-L225 HydrophobicContact CZ-CD2 4.39Å; V217-L225 HydrophobicContact CG1-CD1 3.93Å; H221-L225 HydrophobicContact CB-CD1 3.74Å; H221-L225 HydrophobicContact CB-CG 4.28Å; H221-L225 WeakPolarHBondContact O-CB 3.49Å; H221-L225 WeakPolarHBondContact O-CG 3.49Å; H221-L225 PolarHBondContact O-N 3.33Å; Y222-L225 WeakPolarHBondContact CD1-O 3.33Å; L225-F229 HydrophobicContact CD2-CD1 4.01Å; L225-F229 HydrophobicContact CD2-CE1 3.91Å; L225-F229 HydrophobicContact CD2-CG 4.46Å; L225-F229 HydrophobicContact CD2-CZ 4.28Å; L225-F258 HydrophobicContact CB-CE2 4.19Å; L225-F258 HydrophobicContact CB-CZ 3.86Å; L225-F258 HydrophobicContact CD1-CE2 3.93Å; L225-F258 HydrophobicContact CD1-CZ 4.44Å
226N95.6Very high95.7Very high56 Ų5655.3 Ų55.330%0.29928%0.28SS..SBendtrans-106.2-171.1-175.258.743.8000112.3Y222 G223 V224 R228 F229 V230Y222-N226 WeakPolarHBondContact O-CB 3.46Å; G223-N226 PolarHBondContact O-ND2 3.18Å; V224-N226 PolarHBondContact O-N 3.4Å; N226-R228 PolarHBondContact O-N 3.18Å; N226-R228 VanDerWaalsContact O-N 3.17Å; N226-R228 VanDerWaalsContact OD1-CB 3.23Å; N226-R228 WeakPolarHBondContact OD1-CB 3.49Å; N226-R228 PolarHBondContact OD1-N 2.97Å; N226-F229 WeakPolarHBondContact O-CB 3.36Å; N226-F229 PolarHBondContact O-N 2.85Å; N226-V230 PolarHBondContact O-N 3.42Å; N226-V230 VanDerWaalsContact O-N 3.17Å
227E95.9Very high95.8Very high76 Ų7650.3 Ų50.336%0.35525%0.249SC..Hα-helixtrans-55.5-32179.1-63.2-180-150.100113.1V230 D231 V270 K273 C274E227-V230 PolarHBondContact O-N 2.9Å; E227-D231 VanDerWaalsContact O-CB 3.31Å; E227-D231 WeakPolarHBondContact O-CB 3.31Å; E227-D231 PolarHBondContact O-N 3.18Å; E227-V270 HydrophobicContact CB-CG2 4.36Å; E227-V270 HydrophobicContact CG-CG2 3.55Å; E227-K273 WeakPolarHBondContact OE1-CD 3.12Å; E227-K273 WeakPolarHBondContact OE1-CE 3.37Å; E227-K273 IonicContact OE1-NZ 3.94Å; E227-K273 PolarHBondContact OE1-NZ 3.45Å; E227-C274 HydrophobicContact CB-CB 4.42Å; E227-C274 HydrophobicContact CG-CB 4.46Å; E227-C274 PolarHBondContact O-SG 2.94Å
228R95.8Very high95.7Very high183 Ų18350.8 Ų50.869%0.69125%0.25SS*.Hα-helixtrans-67.6-38.5177.3-177.3-178173.9177.6-2.1111.8N226 F232N226-R228 PolarHBondContact O-N 3.18Å; N226-R228 VanDerWaalsContact O-N 3.17Å; N226-R228 VanDerWaalsContact OD1-CB 3.23Å; N226-R228 WeakPolarHBondContact OD1-CB 3.49Å; N226-R228 PolarHBondContact OD1-N 2.97Å; R228-F232 WeakPolarHBondContact O-CB 3.35Å; R228-F232 PolarHBondContact O-N 3.14Å; R228-F232 VanDerWaalsContact O-N 3.11Å
229F97.4Very high95.3Very high2 Ų251.8 Ų51.81%0.00925%0.254CS..Hα-helixtrans-65.8-44175.4168.5-111.7000110.9A187 L190 V191 L207 V224 L225 N226 F232 L233 V254A187-F229 HydrophobicContact CB-CD2 3.86Å; A187-F229 HydrophobicContact CB-CE2 3.68Å; A187-F229 HydrophobicContact CB-CZ 4.18Å; L190-F229 HydrophobicContact CD2-CE2 4.3Å; V191-F229 HydrophobicContact CG1-CD2 4.04Å; L207-F229 HydrophobicContact CD1-CE2 4.18Å; L207-F229 HydrophobicContact CD1-CZ 4.13Å; V224-F229 WeakPolarHBondContact O-CB 3.22Å; L225-F229 HydrophobicContact CD2-CD1 4.01Å; L225-F229 HydrophobicContact CD2-CE1 3.91Å; L225-F229 HydrophobicContact CD2-CG 4.46Å; L225-F229 HydrophobicContact CD2-CZ 4.28Å; N226-F229 WeakPolarHBondContact O-CB 3.36Å; N226-F229 PolarHBondContact O-N 2.85Å; F229-F232 WeakPolarHBondContact O-CB 3.13Å; F229-F232 PolarHBondContact O-N 2.92Å; F229-L233 HydrophobicContact CD1-CD1 4.31Å; F229-L233 HydrophobicContact CE1-CD1 3.73Å; F229-L233 HydrophobicContact CE2-CD1 4.06Å; F229-L233 HydrophobicContact CE2-CD2 4.39Å; F229-L233 HydrophobicContact CE2-CG 4.25Å; F229-L233 HydrophobicContact CZ-CD1 3.6Å; F229-L233 HydrophobicContact CZ-CG 4.28Å; F229-L233 WeakPolarHBondContact O-CG 3.44Å; F229-L233 PolarHBondContact O-N 2.92Å; F229-V254 HydrophobicContact CZ-CG1 3.96Å
230V97.5Very high94.4Very high1 Ų147.7 Ų47.71%0.00624%0.237CC..Hα-helixtrans-65.6-44.1177.5-177.90000111.6N226 E227 F232 L233 I234 F258 V270 V271 C274N226-V230 PolarHBondContact O-N 3.42Å; N226-V230 VanDerWaalsContact O-N 3.17Å; E227-V230 PolarHBondContact O-N 2.9Å; V230-F232 VanDerWaalsContact C-N 3.28Å; V230-F232 PolarHBondContact O-N 3.26Å; V230-L233 PolarHBondContact O-N 2.96Å; V230-L233 VanDerWaalsContact O-N 3.11Å; V230-I234 HydrophobicContact CG1-CD1 3.9Å; V230-I234 HydrophobicContact CG1-CG1 4.29Å; V230-I234 WeakPolarHBondContact O-CG1 3.38Å; V230-I234 PolarHBondContact O-N 3.49Å; V230-F258 HydrophobicContact CG2-CE1 4.33Å; V230-V270 HydrophobicContact CG2-CG1 4.26Å; V230-V271 HydrophobicContact CG1-CG1 4.42Å; V230-V271 HydrophobicContact CG2-CG2 4.16Å; V230-C274 HydrophobicContact CB-CB 3.98Å; V230-C274 HydrophobicContact CG1-CB 3.81Å
231D96.4Very high93.3Very high46 Ų4650.1 Ų50.125%0.24624%0.244CC..Hα-helixtrans-56.2-43.9176177.688.3000111.1E227 L233 I234 R235 C274 H278E227-D231 VanDerWaalsContact O-CB 3.31Å; E227-D231 WeakPolarHBondContact O-CB 3.31Å; E227-D231 PolarHBondContact O-N 3.18Å; D231-L233 PolarHBondContact O-N 2.97Å; D231-I234 PolarHBondContact O-N 3.33Å; D231-R235 WeakPolarHBondContact O-CG 3.44Å; D231-R235 PolarHBondContact O-N 3.42Å; D231-R235 IonicContact OD1-CZ 4Å; D231-R235 IonicContact OD1-NE 2.82Å; D231-R235 IonicContact OD1-NH2 3.38Å; D231-R235 PolarHBondContact OD1-NH2 3.03Å; D231-R235 IonicContact OD2-CZ 3.27Å; D231-R235 IonicContact OD2-NE 2.86Å; D231-R235 PolarHBondContact OD2-NE 2.92Å; D231-R235 IonicContact OD2-NH2 3.47Å; D231-C274 PolarHBondContact N-SG 3.49Å; D231-H278 IonicContact OD1-CD2 3.89Å; D231-H278 PolarHBondContact OD1-CD2 3.31Å; D231-H278 IonicContact OD1-NE2 3.87Å; D231-H278 PolarHBondContact OD1-NE2 3.02Å
232F95.4Very high92Very high36 Ų3655.6 Ų55.616%0.15827%0.27CS..Hα-helixtrans-59.2-44.9176.1-179.3-96.5000112.5L190 V191 R228 F229 V230 R235 I236L190-F232 HydrophobicContact CD1-CE1 3.86Å; L190-F232 HydrophobicContact CD1-CZ 4.47Å; L190-F232 HydrophobicContact CD2-CE1 4.4Å; L190-F232 HydrophobicContact CG-CD1 4.34Å; L190-F232 HydrophobicContact CG-CE1 3.71Å; L190-F232 WeakPolarHBondContact O-CZ 3.05Å; V191-F232 HydrophobicContact CG1-CB 4.24Å; V191-F232 HydrophobicContact CG1-CD1 4.21Å; V191-F232 HydrophobicContact CG1-CG 4.16Å; R228-F232 WeakPolarHBondContact O-CB 3.35Å; R228-F232 PolarHBondContact O-N 3.14Å; R228-F232 VanDerWaalsContact O-N 3.11Å; F229-F232 WeakPolarHBondContact O-CB 3.13Å; F229-F232 PolarHBondContact O-N 2.92Å; V230-F232 VanDerWaalsContact C-N 3.28Å; V230-F232 PolarHBondContact O-N 3.26Å; F232-R235 PolarHBondContact O-N 2.96Å; F232-I236 HydrophobicContact CD1-CD1 3.84Å; F232-I236 HydrophobicContact CE1-CD1 3.27Å; F232-I236 HydrophobicContact CE1-CG1 4.29Å; F232-I236 HydrophobicContact CZ-CD1 3.73Å; F232-I236 HydrophobicContact CZ-CG1 4.48Å; F232-I236 WeakPolarHBondContact O-CG1 3.48Å; F232-I236 PolarHBondContact O-N 3.34Å; F232-I236 VanDerWaalsContact O-N 3.13Å
233L96.6Very high90.8Very high1 Ų153.5 Ų53.51%0.00526%0.263CS..Hα-helixtrans-65.4-41.4176.9-64.6173.8000112.1L190 L204 F229 V230 D231 R235 I236 F237 V254 I255L190-L233 HydrophobicContact CD2-CD2 4.2Å; L204-L233 HydrophobicContact CD2-CD2 3.51Å; F229-L233 HydrophobicContact CD1-CD1 4.31Å; F229-L233 HydrophobicContact CE1-CD1 3.73Å; F229-L233 HydrophobicContact CE2-CD1 4.06Å; F229-L233 HydrophobicContact CE2-CD2 4.39Å; F229-L233 HydrophobicContact CE2-CG 4.25Å; F229-L233 HydrophobicContact CZ-CD1 3.6Å; F229-L233 HydrophobicContact CZ-CG 4.28Å; F229-L233 WeakPolarHBondContact O-CG 3.44Å; F229-L233 PolarHBondContact O-N 2.92Å; V230-L233 PolarHBondContact O-N 2.96Å; V230-L233 VanDerWaalsContact O-N 3.11Å; D231-L233 PolarHBondContact O-N 2.97Å; L233-R235 VanDerWaalsContact C-N 3.32Å; L233-R235 PolarHBondContact O-N 3.34Å; L233-I236 PolarHBondContact O-N 3.08Å; L233-F237 PolarHBondContact O-N 3.15Å; L233-V254 HydrophobicContact CD1-CB 4.08Å; L233-V254 HydrophobicContact CD1-CG1 3.57Å; L233-V254 HydrophobicContact CD2-CB 4.29Å; L233-V254 HydrophobicContact CD2-CG1 4.24Å; L233-I255 HydrophobicContact CB-CD1 3.82Å; L233-I255 HydrophobicContact CB-CG1 3.63Å; L233-I255 HydrophobicContact CD1-CG1 3.9Å; L233-I255 HydrophobicContact CG-CG1 4.42Å
234I96.3Very high89.7Confident1 Ų153.6 Ų53.61%0.00525%0.253CS..Hα-helixtrans-59.8-45.4176.4-69.6171.8000109.6V230 D231 I236 F237 I238 I255 L275 F284V230-I234 HydrophobicContact CG1-CD1 3.9Å; V230-I234 HydrophobicContact CG1-CG1 4.29Å; V230-I234 WeakPolarHBondContact O-CG1 3.38Å; V230-I234 PolarHBondContact O-N 3.49Å; D231-I234 PolarHBondContact O-N 3.33Å; I234-I236 VanDerWaalsContact C-N 3.35Å; I234-I236 PolarHBondContact O-N 3.13Å; I234-F237 PolarHBondContact O-N 3.37Å; I234-F237 VanDerWaalsContact O-N 3.14Å; I234-I238 HydrophobicContact CG2-CG1 4.13Å; I234-I238 VanDerWaalsContact O-CG1 3.23Å; I234-I238 WeakPolarHBondContact O-CG1 2.68Å; I234-I238 PolarHBondContact O-N 3.47Å; I234-I255 HydrophobicContact CG1-CD1 4.09Å; I234-L275 HydrophobicContact CD1-CB 4.38Å; I234-L275 HydrophobicContact CD1-CD1 4.37Å; I234-F284 HydrophobicContact CG1-CD2 4.26Å; I234-F284 HydrophobicContact CG1-CE2 4.11Å; I234-F284 HydrophobicContact CG2-CD2 4.05Å
235R94.4Very high88.9Confident112 Ų11260 Ų6042%0.42328%0.283SS..Hα-helixtrans-59.2-43.5177.7-71.6178.2-174-72.4-13.5112.4D231 F232 L233 F237 I238 D239 E279D231-R235 WeakPolarHBondContact O-CG 3.44Å; D231-R235 PolarHBondContact O-N 3.42Å; D231-R235 IonicContact OD1-CZ 4Å; D231-R235 IonicContact OD1-NE 2.82Å; D231-R235 IonicContact OD1-NH2 3.38Å; D231-R235 PolarHBondContact OD1-NH2 3.03Å; D231-R235 IonicContact OD2-CZ 3.27Å; D231-R235 IonicContact OD2-NE 2.86Å; D231-R235 PolarHBondContact OD2-NE 2.92Å; D231-R235 IonicContact OD2-NH2 3.47Å; F232-R235 PolarHBondContact O-N 2.96Å; L233-R235 VanDerWaalsContact C-N 3.32Å; L233-R235 PolarHBondContact O-N 3.34Å; R235-F237 VanDerWaalsContact C-N 3.35Å; R235-F237 PolarHBondContact O-N 2.92Å; R235-I238 PolarHBondContact O-N 3.38Å; R235-D239 WeakPolarHBondContact O-CB 3.37Å; R235-D239 PolarHBondContact O-N 3.02Å; R235-E279 IonicContact CZ-OE1 3.78Å; R235-E279 IonicContact NH1-OE1 3.71Å; R235-E279 PolarHBondContact NH1-OE1 2.6Å; R235-E279 IonicContact NH2-OE1 3.86Å; R235-E279 PolarHBondContact NH2-OE1 3.26Å; R235-E279 VanDerWaalsContact NH2-OE1 3.13Å
236I94.2Very high88.4Confident1 Ų161.5 Ų61.51%0.00530%0.299CS..Hα-helixtrans-60.9-44.3174.6-67.3174.3000111.2V200 F232 L233 I234 I238 T243 I247 A251V200-I236 HydrophobicContact CG1-CD1 4.27Å; F232-I236 HydrophobicContact CD1-CD1 3.84Å; F232-I236 HydrophobicContact CE1-CD1 3.27Å; F232-I236 HydrophobicContact CE1-CG1 4.29Å; F232-I236 HydrophobicContact CZ-CD1 3.73Å; F232-I236 HydrophobicContact CZ-CG1 4.48Å; F232-I236 WeakPolarHBondContact O-CG1 3.48Å; F232-I236 PolarHBondContact O-N 3.34Å; F232-I236 VanDerWaalsContact O-N 3.13Å; L233-I236 PolarHBondContact O-N 3.08Å; I234-I236 VanDerWaalsContact C-N 3.35Å; I234-I236 PolarHBondContact O-N 3.13Å; I236-I238 VanDerWaalsContact C-N 3.28Å; I236-I238 PolarHBondContact O-N 3.35Å; I236-T243 HydrophobicContact CG2-CG2 4.32Å; I236-I247 HydrophobicContact CG2-CG2 3.59Å; I236-A251 HydrophobicContact CB-CB 3.91Å; I236-A251 HydrophobicContact CG2-CB 3.58Å
237F94.8Very high88.2Confident0 Ų059.1 Ų59.10%029%0.286CS..Hα-helixtrans-65.4-32.9-179.7176.3-117000112.7L233 I234 R235 A248 A251 L252 F284 R287 Y291L233-F237 PolarHBondContact O-N 3.15Å; I234-F237 PolarHBondContact O-N 3.37Å; I234-F237 VanDerWaalsContact O-N 3.14Å; R235-F237 VanDerWaalsContact C-N 3.35Å; R235-F237 PolarHBondContact O-N 2.92Å; F237-A248 HydrophobicContact CD2-CB 4.14Å; F237-A248 WeakPolarHBondContact CD2-O 3.42Å; F237-A251 HydrophobicContact CB-CB 4.35Å; F237-L252 HydrophobicContact CD2-CB 3.78Å; F237-L252 HydrophobicContact CE1-CD1 4.37Å; F237-L252 HydrophobicContact CE2-CB 3.83Å; F237-L252 HydrophobicContact CE2-CD1 4.31Å; F237-L252 HydrophobicContact CE2-CD2 3.78Å; F237-L252 HydrophobicContact CE2-CG 4.18Å; F237-L252 HydrophobicContact CG-CB 4.45Å; F237-L252 HydrophobicContact CZ-CD1 4.16Å; F237-L252 HydrophobicContact CZ-CD2 3.96Å; F237-L252 HydrophobicContact CZ-CG 4.44Å; F237-F284 AromaticContact CD1-CD2 3.42Å; F237-F284 HydrophobicContact CD1-CD2 3.42Å; F237-F284 VanDerWaalsContact CD1-CD2 3.42Å; F237-F284 AromaticContact CD1-CE2 3.47Å; F237-F284 HydrophobicContact CD1-CE2 3.47Å; F237-F284 VanDerWaalsContact CD1-CE2 3.47Å; F237-F284 HydrophobicContact CD1-CG 4.35Å; F237-F284 HydrophobicContact CD1-CZ 4.44Å; F237-F284 AromaticContact CE1-CD2 3.77Å; F237-F284 HydrophobicContact CE1-CD2 3.77Å; F237-F284 AromaticContact CE1-CE2 3.84Å; F237-F284 HydrophobicContact CE1-CE2 3.84Å; F237-F284 HydrophobicContact CE1-CG 4.3Å; F237-F284 HydrophobicContact CE1-CZ 4.45Å; F237-F284 HydrophobicContact CG-CE2 4.39Å; F237-R287 HydrophobicContact CE1-CB 3.75Å; F237-R287 HydrophobicContact CZ-CB 3.54Å; F237-R287 PolarHBondContact O-NH1 3.42Å; F237-Y291 AromaticContact CE2-CE2 3.9Å; F237-Y291 HydrophobicContact CE2-CE2 3.9Å; F237-Y291 AromaticContact CZ-CE2 3.99Å; F237-Y291 HydrophobicContact CZ-CE2 3.99Å
238I92.9Very high88Confident23 Ų2355.7 Ų55.712%0.11827%0.27CS..Hα-helixtrans-79.6-39.4-179.5-64.6-65.1000112.3I234 R235 I236 Q240 L283 F284 R287I234-I238 HydrophobicContact CG2-CG1 4.13Å; I234-I238 VanDerWaalsContact O-CG1 3.23Å; I234-I238 WeakPolarHBondContact O-CG1 2.68Å; I234-I238 PolarHBondContact O-N 3.47Å; R235-I238 PolarHBondContact O-N 3.38Å; I236-I238 VanDerWaalsContact C-N 3.28Å; I236-I238 PolarHBondContact O-N 3.35Å; I238-Q240 PolarHBondContact O-N 2.92Å; I238-L283 HydrophobicContact CD1-CB 4.19Å; I238-L283 HydrophobicContact CD1-CD2 4.25Å; I238-L283 HydrophobicContact CD1-CG 3.94Å; I238-L283 HydrophobicContact CG2-CD2 3.71Å; I238-F284 HydrophobicContact CD1-CB 3.97Å; I238-R287 VanDerWaalsContact C-NH1 3.28Å; I238-R287 VanDerWaalsContact O-CZ 3.32Å; I238-R287 PolarHBondContact O-NH1 3.23Å; I238-R287 PolarHBondContact O-NH2 3.44Å; I238-R287 VanDerWaalsContact O-NH2 3.16Å
239D87.4Confident87.9Confident55 Ų5548.7 Ų48.729%0.29425%0.247SC..  trans-81.154.4-173.8-168.516000114.2H196 R235 E241 Q242 T243H196-D239 IonicContact CE1-OD2 3.13Å; H196-D239 IonicContact NE2-OD2 3.23Å; R235-D239 WeakPolarHBondContact O-CB 3.37Å; R235-D239 PolarHBondContact O-N 3.02Å; D239-E241 VanDerWaalsContact C-N 3.29Å; D239-E241 PolarHBondContact O-N 3.44Å; D239-Q242 PolarHBondContact O-N 3.47Å; D239-T243 WeakPolarHBondContact O-CB 3.46Å; D239-T243 WeakPolarHBondContact O-CG2 3.46Å; D239-T243 PolarHBondContact O-N 3.44Å; D239-T243 PolarHBondContact O-OG1 3.44Å
240Q75.3Confident87.8Confident86 Ų8649.5 Ų49.540%0.40225%0.251SS..THydrogen-bonded Turntrans-65.1-27.4-176.2-85.4-177.15.500114.4I238 Q242 T243 A248 R287I238-Q240 PolarHBondContact O-N 2.92Å; Q240-Q242 VanDerWaalsContact C-N 3.27Å; Q240-Q242 PolarHBondContact O-N 2.88Å; Q240-T243 WeakPolarHBondContact CA-OG1 3.44Å; Q240-A248 HydrophobicContact CG-CB 3.65Å; Q240-R287 VanDerWaalsContact CD-NH1 3.31Å
241E72.4Confident87.7Confident193 Ų19349.5 Ų49.590%0.90225%0.251SS*.THydrogen-bonded Turntrans-69.4-29.2-177.1-67-172.6176.500112.2D239D239-E241 VanDerWaalsContact C-N 3.29Å; D239-E241 PolarHBondContact O-N 3.44Å
242Q70.1Confident87.7Confident131 Ų13147.3 Ų47.361%0.61224%0.239SC*.THydrogen-bonded Turntrans-104.8-24.1-179-57.4-170.416.700112.6H196 D239 Q240H196-Q242 WeakPolarHBondContact CE1-CB 3.34Å; H196-Q242 PolarHBondContact CE1-O 2.85Å; H196-Q242 PolarHBondContact ND1-O 3.04Å; H196-Q242 VanDerWaalsContact ND1-O 3.16Å; D239-Q242 PolarHBondContact O-N 3.47Å; Q240-Q242 VanDerWaalsContact C-N 3.27Å; Q240-Q242 PolarHBondContact O-N 2.88Å
243T68.9Low87.7Confident13 Ų1345.6 Ų45.68%0.0823%0.232CC..SBendtrans-75.6138.5179.8570000112.3I236 D239 Q240I236-T243 HydrophobicContact CG2-CG2 4.32Å; D239-T243 WeakPolarHBondContact O-CB 3.46Å; D239-T243 WeakPolarHBondContact O-CG2 3.46Å; D239-T243 PolarHBondContact O-N 3.44Å; D239-T243 PolarHBondContact O-OG1 3.44Å; Q240-T243 WeakPolarHBondContact CA-OG1 3.44Å
244P73.7Confident87.7Confident63 Ų6345.5 Ų45.541%0.40923%0.231SC..PPolyproline II helixtrans-50.1145.5169.3-24.928000113.1G246 I247P244-G246 PolarHBondContact O-N 2.88Å; P244-I247 HydrophobicContact CB-CD1 3.64Å; P244-I247 HydrophobicContact CB-CG1 4.03Å; P244-I247 HydrophobicContact CG-CD1 3.59Å; P244-I247 HydrophobicContact CG-CG1 4.48Å; P244-I247 WeakPolarHBondContact O-CB 3.36Å; P244-I247 WeakPolarHBondContact O-CG1 3.32Å; P244-I247 PolarHBondContact O-N 3.11Å; P244-I247 VanDerWaalsContact O-N 3.09Å
245I78.3Confident87.8Confident182 Ų18245.6 Ų45.693%0.93323%0.232SC*.THydrogen-bonded Turntrans-51.5127.9-176.9-60.8171.7000110.5I247I245-I247 VanDerWaalsContact C-N 3.35Å; I245-I247 PolarHBondContact O-N 3.39Å
246G86.6Confident87.9Confident31 Ų3140.2 Ų40.232%0.3221%0.211SC..THydrogen-bonded Turntrans85.8-9.1176.400000115.4P244 A248 D249 L250P244-G246 PolarHBondContact O-N 2.88Å; G246-A248 VanDerWaalsContact C-N 3.34Å; G246-A248 PolarHBondContact O-N 3.42Å; G246-D249 WeakPolarHBondContact O-CB 3.34Å; G246-D249 PolarHBondContact O-N 3.22Å; G246-L250 WeakPolarHBondContact O-CG 3.3Å; G246-L250 PolarHBondContact O-N 2.84Å
247I91.3Very high88Confident5 Ų540.2 Ų40.23%0.02621%0.211CC..Hα-helixtrans-66.5-38176.6-64.9-168.2000111.4V200 P201 L204 I236 P244 I245 D249 L250 A251V200-I247 HydrophobicContact CG1-CG2 4.02Å; P201-I247 HydrophobicContact CG-CD1 3.71Å; P201-I247 HydrophobicContact CG-CG1 3.99Å; L204-I247 HydrophobicContact CD1-CG2 3.94Å; I236-I247 HydrophobicContact CG2-CG2 3.59Å; P244-I247 HydrophobicContact CB-CD1 3.64Å; P244-I247 HydrophobicContact CB-CG1 4.03Å; P244-I247 HydrophobicContact CG-CD1 3.59Å; P244-I247 HydrophobicContact CG-CG1 4.48Å; P244-I247 WeakPolarHBondContact O-CB 3.36Å; P244-I247 WeakPolarHBondContact O-CG1 3.32Å; P244-I247 PolarHBondContact O-N 3.11Å; P244-I247 VanDerWaalsContact O-N 3.09Å; I245-I247 VanDerWaalsContact C-N 3.35Å; I245-I247 PolarHBondContact O-N 3.39Å; I247-D249 VanDerWaalsContact C-N 3.29Å; I247-D249 PolarHBondContact O-N 2.82Å; I247-L250 WeakPolarHBondContact O-CB 3.33Å; I247-L250 PolarHBondContact O-N 3.33Å; I247-L250 VanDerWaalsContact O-N 3.11Å; I247-A251 PolarHBondContact O-N 2.98Å
248A92.8Very high88.1Confident4 Ų440.2 Ų40.23%0.03321%0.211CC..Hα-helixtrans-57.3-42.4173.900000111.8F237 Q240 G246 L250 A251 L252F237-A248 HydrophobicContact CD2-CB 4.14Å; F237-A248 WeakPolarHBondContact CD2-O 3.42Å; Q240-A248 HydrophobicContact CG-CB 3.65Å; G246-A248 VanDerWaalsContact C-N 3.34Å; G246-A248 PolarHBondContact O-N 3.42Å; A248-L250 VanDerWaalsContact C-N 3.31Å; A248-L250 PolarHBondContact O-N 3.01Å; A248-A251 PolarHBondContact O-N 2.91Å; A248-L252 PolarHBondContact O-N 3.29Å
249D92.9Very high88.3Confident37 Ų3739.1 Ų39.120%0.19821%0.206CC..Hα-helixtrans-60.5-41.5175.7-65.8-18.9000111.6G246 I247 L252 A253 Y291 R301G246-D249 WeakPolarHBondContact O-CB 3.34Å; G246-D249 PolarHBondContact O-N 3.22Å; I247-D249 VanDerWaalsContact C-N 3.29Å; I247-D249 PolarHBondContact O-N 2.82Å; D249-L252 PolarHBondContact O-N 2.97Å; D249-A253 WeakPolarHBondContact O-CB 3.37Å; D249-A253 PolarHBondContact O-N 3.48Å; D249-Y291 PolarHBondContact OD1-OH 3.49Å; D249-R301 IonicContact OD1-NH1 2.73Å; D249-R301 IonicContact OD2-NH1 2.62Å; D249-R301 PolarHBondContact OD2-NH1 3.42Å
250L94.5Very high88.7Confident19 Ų1937.7 Ų37.710%0.09920%0.198CC..Hα-helixtrans-66.9-39.2177.9-62.3177.1000111.5P201 L204 K205 G246 I247 A248 A253 V254 C302P201-L250 HydrophobicContact CB-CD1 3.8Å; L204-L250 HydrophobicContact CB-CB 3.74Å; L204-L250 HydrophobicContact CD1-CB 3.75Å; L204-L250 HydrophobicContact CG-CB 4.4Å; K205-L250 HydrophobicContact CD-CD2 4.49Å; K205-L250 HydrophobicContact CG-CD1 4.14Å; K205-L250 HydrophobicContact CG-CD2 3.68Å; G246-L250 WeakPolarHBondContact O-CG 3.3Å; G246-L250 PolarHBondContact O-N 2.84Å; I247-L250 WeakPolarHBondContact O-CB 3.33Å; I247-L250 PolarHBondContact O-N 3.33Å; I247-L250 VanDerWaalsContact O-N 3.11Å; A248-L250 VanDerWaalsContact C-N 3.31Å; A248-L250 PolarHBondContact O-N 3.01Å; L250-A253 WeakPolarHBondContact O-CB 3.44Å; L250-A253 PolarHBondContact O-N 3.42Å; L250-V254 WeakPolarHBondContact O-CG2 3.39Å; L250-V254 PolarHBondContact O-N 3.29Å; L250-C302 WeakPolarHBondContact CD2-SG 3.35Å
251A95.8Very high89.6Confident0 Ų034.3 Ų34.30%018%0.182CC..Hα-helixtrans-64.4-44.6175.800000111L204 I236 F237 I247 A248 A253 V254 I255L204-A251 HydrophobicContact CD1-CB 4.32Å; I236-A251 HydrophobicContact CB-CB 3.91Å; I236-A251 HydrophobicContact CG2-CB 3.58Å; F237-A251 HydrophobicContact CB-CB 4.35Å; I247-A251 PolarHBondContact O-N 2.98Å; A248-A251 PolarHBondContact O-N 2.91Å; A251-A253 VanDerWaalsContact C-N 3.31Å; A251-A253 PolarHBondContact O-N 3.22Å; A251-V254 PolarHBondContact O-N 2.97Å; A251-I255 WeakPolarHBondContact O-CG1 3.32Å; A251-I255 PolarHBondContact O-N 3.3Å
252L96.4Very high90.6Very high0 Ų025.5 Ų25.50%014%0.141CC..Hα-helixtrans-60-42.6173.5-175.663.4000111.3F237 A248 D249 V254 I255 V256 F284 L288 Y291 P298 I313F237-L252 HydrophobicContact CD2-CB 3.78Å; F237-L252 HydrophobicContact CE1-CD1 4.37Å; F237-L252 HydrophobicContact CE2-CB 3.83Å; F237-L252 HydrophobicContact CE2-CD1 4.31Å; F237-L252 HydrophobicContact CE2-CD2 3.78Å; F237-L252 HydrophobicContact CE2-CG 4.18Å; F237-L252 HydrophobicContact CG-CB 4.45Å; F237-L252 HydrophobicContact CZ-CD1 4.16Å; F237-L252 HydrophobicContact CZ-CD2 3.96Å; F237-L252 HydrophobicContact CZ-CG 4.44Å; A248-L252 PolarHBondContact O-N 3.29Å; D249-L252 PolarHBondContact O-N 2.97Å; L252-V254 VanDerWaalsContact C-N 3.29Å; L252-V254 PolarHBondContact O-N 3.4Å; L252-I255 PolarHBondContact O-N 3.18Å; L252-I255 VanDerWaalsContact O-N 3.14Å; L252-V256 HydrophobicContact CD1-CG1 3.94Å; L252-V256 HydrophobicContact CG-CG1 4.25Å; L252-V256 WeakPolarHBondContact O-CG2 3.39Å; L252-V256 PolarHBondContact O-N 3.33Å; L252-F284 HydrophobicContact CD1-CZ 4.17Å; L252-L288 HydrophobicContact CD1-CD1 4.08Å; L252-Y291 HydrophobicContact CD2-CD1 3.84Å; L252-Y291 HydrophobicContact CD2-CD2 3.5Å; L252-Y291 HydrophobicContact CD2-CE1 3.79Å; L252-Y291 HydrophobicContact CD2-CE2 3.48Å; L252-Y291 VanDerWaalsContact CD2-CE2 3.48Å; L252-Y291 HydrophobicContact CD2-CG 3.7Å; L252-P298 HydrophobicContact CB-CG 4.4Å; L252-P298 HydrophobicContact CD2-CG 3.96Å; L252-P298 HydrophobicContact CG-CG 3.9Å; L252-I313 HydrophobicContact CD2-CD1 4.25Å
253A95.9Very high91.7Very high0 Ų023.1 Ų23.10%014%0.137CC..Hα-helixtrans-55.4-44.217600000111.9A208 D249 L250 A251 A257 P298 C302A208-A253 HydrophobicContact CB-CB 3.96Å; D249-A253 WeakPolarHBondContact O-CB 3.37Å; D249-A253 PolarHBondContact O-N 3.48Å; L250-A253 WeakPolarHBondContact O-CB 3.44Å; L250-A253 PolarHBondContact O-N 3.42Å; A251-A253 VanDerWaalsContact C-N 3.31Å; A251-A253 PolarHBondContact O-N 3.22Å; A253-A257 WeakPolarHBondContact O-CB 3.44Å; A253-A257 PolarHBondContact O-N 3.44Å; A253-P298 HydrophobicContact CB-CB 3.96Å; A253-P298 HydrophobicContact CB-CG 4.46Å; A253-P298 WeakPolarHBondContact CB-O 3.49Å; A253-C302 VanDerWaalsContact CB-SG 3.51Å
254V97Very high92.2Very high0 Ų025.7 Ų25.70%016%0.16CC..Hα-helixtrans-66-44.1176.5-179.30000111.2L204 L207 A208 F229 L233 L250 A251 L252 V256 A257 F258L204-V254 HydrophobicContact CB-CG2 4.04Å; L204-V254 HydrophobicContact CD2-CG2 3.82Å; L204-V254 WeakPolarHBondContact O-CG2 3.46Å; L207-V254 HydrophobicContact CB-CG1 3.98Å; L207-V254 HydrophobicContact CB-CG2 3.96Å; A208-V254 HydrophobicContact CB-CG2 4.02Å; F229-V254 HydrophobicContact CZ-CG1 3.96Å; L233-V254 HydrophobicContact CD1-CB 4.08Å; L233-V254 HydrophobicContact CD1-CG1 3.57Å; L233-V254 HydrophobicContact CD2-CB 4.29Å; L233-V254 HydrophobicContact CD2-CG1 4.24Å; L250-V254 WeakPolarHBondContact O-CG2 3.39Å; L250-V254 PolarHBondContact O-N 3.29Å; A251-V254 PolarHBondContact O-N 2.97Å; L252-V254 VanDerWaalsContact C-N 3.29Å; L252-V254 PolarHBondContact O-N 3.4Å; V254-V256 PolarHBondContact O-N 3.3Å; V254-A257 PolarHBondContact O-N 3.11Å; V254-F258 WeakPolarHBondContact O-CB 3.34Å; V254-F258 PolarHBondContact O-N 3.4Å
255I98Very high92.4Very high2 Ų227.9 Ų27.91%0.0117%0.168CC..Hα-helixtrans-58.7-51.3179.8-66.7167.6000110.3L233 I234 A251 L252 N259 V271 F284 L316L233-I255 HydrophobicContact CB-CD1 3.82Å; L233-I255 HydrophobicContact CB-CG1 3.63Å; L233-I255 HydrophobicContact CD1-CG1 3.9Å; L233-I255 HydrophobicContact CG-CG1 4.42Å; I234-I255 HydrophobicContact CG1-CD1 4.09Å; A251-I255 WeakPolarHBondContact O-CG1 3.32Å; A251-I255 PolarHBondContact O-N 3.3Å; L252-I255 PolarHBondContact O-N 3.18Å; L252-I255 VanDerWaalsContact O-N 3.14Å; I255-N259 WeakPolarHBondContact O-CB 3.38Å; I255-N259 PolarHBondContact O-N 3.27Å; I255-V271 HydrophobicContact CG2-CG1 3.85Å; I255-F284 HydrophobicContact CD1-CE2 3.89Å; I255-F284 HydrophobicContact CD1-CZ 4.34Å; I255-F284 HydrophobicContact CG2-CZ 4.34Å; I255-L316 HydrophobicContact CG2-CD2 4.35Å
256V97.2Very high92.7Very high0 Ų023.7 Ų23.70%014%0.141CC..Hα-helixtrans-72.5-36.7-175.7-56.40000111.5L252 V254 N259 L260 P298 V299 S312 I313 L316L252-V256 HydrophobicContact CD1-CG1 3.94Å; L252-V256 HydrophobicContact CG-CG1 4.25Å; L252-V256 WeakPolarHBondContact O-CG2 3.39Å; L252-V256 PolarHBondContact O-N 3.33Å; V254-V256 PolarHBondContact O-N 3.3Å; V256-N259 PolarHBondContact O-N 3.09Å; V256-L260 WeakPolarHBondContact O-CG 3.28Å; V256-L260 PolarHBondContact O-N 2.73Å; V256-P298 HydrophobicContact CG2-CG 4Å; V256-V299 HydrophobicContact CG2-CG2 3.48Å; V256-V299 VanDerWaalsContact CG2-CG2 3.48Å; V256-S312 WeakPolarHBondContact CG2-OG 3.49Å; V256-I313 HydrophobicContact CG1-CD1 3.76Å; V256-L316 HydrophobicContact CG1-CD2 3.88Å
257A95.8Very high92.4Very high0 Ų029.1 Ų29.10%016%0.158CC..Hα-helixtrans-65.9-46.617500000111.1F211 A253 V254 N259 L260 V299F211-A257 HydrophobicContact CB-CB 3.83Å; F211-A257 VanDerWaalsContact O-O 3.14Å; A253-A257 WeakPolarHBondContact O-CB 3.44Å; A253-A257 PolarHBondContact O-N 3.44Å; V254-A257 PolarHBondContact O-N 3.11Å; A257-N259 PolarHBondContact O-N 3.22Å; A257-L260 WeakPolarHBondContact O-CB 3.39Å; A257-L260 PolarHBondContact O-N 2.77Å; A257-L260 VanDerWaalsContact O-N 3.08Å; A257-V299 HydrophobicContact CB-CG1 4.48Å; A257-V299 HydrophobicContact CB-CG2 3.96Å
258F97.1Very high92.2Very high1 Ų133.5 Ų33.50%0.00418%0.181CC..Hα-helixtrans-61.1-34.4175-177.8-124.3000111F211 V217 Y222 L225 V230 V254 L260 H261 F262 V270 V271F211-F258 HydrophobicContact CD1-CD2 4.18Å; F211-F258 HydrophobicContact CD2-CB 4.01Å; F211-F258 HydrophobicContact CD2-CD2 4.1Å; F211-F258 HydrophobicContact CD2-CG 4.48Å; F211-F258 HydrophobicContact CE1-CD2 4.06Å; F211-F258 HydrophobicContact CE1-CE2 4.47Å; F211-F258 HydrophobicContact CE2-CB 4.46Å; F211-F258 AromaticContact CE2-CD2 3.96Å; F211-F258 HydrophobicContact CE2-CD2 3.96Å; F211-F258 HydrophobicContact CG-CB 4.35Å; F211-F258 HydrophobicContact CG-CD2 4.22Å; F211-F258 AromaticContact CZ-CD2 3.95Å; F211-F258 HydrophobicContact CZ-CD2 3.95Å; F211-F258 HydrophobicContact CZ-CE2 4.37Å; V217-F258 HydrophobicContact CG2-CE2 4.34Å; Y222-F258 HydrophobicContact CD1-CZ 4.48Å; Y222-F258 AromaticContact CE1-CZ 3.99Å; Y222-F258 HydrophobicContact CE1-CZ 3.99Å; L225-F258 HydrophobicContact CB-CE2 4.19Å; L225-F258 HydrophobicContact CB-CZ 3.86Å; L225-F258 HydrophobicContact CD1-CE2 3.93Å; L225-F258 HydrophobicContact CD1-CZ 4.44Å; V230-F258 HydrophobicContact CG2-CE1 4.33Å; V254-F258 WeakPolarHBondContact O-CB 3.34Å; V254-F258 PolarHBondContact O-N 3.4Å; F258-L260 VanDerWaalsContact C-N 3.29Å; F258-L260 PolarHBondContact O-N 3.38Å; F258-H261 AromaticContact CD2-CE1 3.76Å; F258-H261 AromaticContact CE2-CE1 3.47Å; F258-H261 VanDerWaalsContact CE2-CE1 3.47Å; F258-H261 WeakPolarHBondContact CE2-CE1 3.38Å; F258-H261 AromaticContact CZ-CE1 3.94Å; F258-H261 PolarHBondContact O-CE1 3.01Å; F258-H261 PolarHBondContact O-ND1 3.16Å; F258-F262 HydrophobicContact CE1-CE2 4.42Å; F258-F262 HydrophobicContact CE1-CZ 4.46Å; F258-F262 HydrophobicContact CZ-CZ 4.42Å; F258-V270 HydrophobicContact CE1-CG1 3.7Å; F258-V270 HydrophobicContact CZ-CG1 4.26Å; F258-V271 HydrophobicContact CD1-CG2 3.66Å; F258-V271 HydrophobicContact CE1-CG2 4.04Å
259N96.9Very high92.3Very high0 Ų033.5 Ų33.50%018%0.18CC..Hα-helixtrans-67.5-26.4176.8-17068.2000113.6I255 V256 A257 H261 F262 N269 V271 K315 L316 D319I255-N259 WeakPolarHBondContact O-CB 3.38Å; I255-N259 PolarHBondContact O-N 3.27Å; V256-N259 PolarHBondContact O-N 3.09Å; A257-N259 PolarHBondContact O-N 3.22Å; N259-H261 PolarHBondContact O-N 2.88Å; N259-H261 VanDerWaalsContact O-N 3.1Å; N259-F262 WeakPolarHBondContact O-CD2 3.48Å; N259-F262 PolarHBondContact O-N 3.38Å; N259-N269 PolarHBondContact OD1-ND2 3.27Å; N259-N269 PolarHBondContact OD1-OD1 3.38Å; N259-V271 HydrophobicContact CB-CG1 4.43Å; N259-V271 HydrophobicContact CB-CG2 4.34Å; N259-K315 VanDerWaalsContact ND2-CD 3.29Å; N259-K315 WeakPolarHBondContact ND2-CD 3.28Å; N259-K315 WeakPolarHBondContact O-CE 3.43Å; N259-K315 PolarHBondContact O-NZ 3.49Å; N259-L316 HydrophobicContact CB-CD1 4.18Å; N259-L316 WeakPolarHBondContact ND2-CA 3.24Å; N259-D319 PolarHBondContact ND2-OD2 3.14Å; N259-D319 PolarHBondContact OD1-OD2 2.98Å
260L94.9Very high92.4Very high25 Ų2532.5 Ų32.513%0.13118%0.176CC..THydrogen-bonded Turntrans-55.2-34.2-173.3-74.2171.9000114.3S212 V256 A257 F258 F262 K315S212-L260 WeakPolarHBondContact O-CD1 3.36Å; V256-L260 WeakPolarHBondContact O-CG 3.28Å; V256-L260 PolarHBondContact O-N 2.73Å; A257-L260 WeakPolarHBondContact O-CB 3.39Å; A257-L260 PolarHBondContact O-N 2.77Å; A257-L260 VanDerWaalsContact O-N 3.08Å; F258-L260 VanDerWaalsContact C-N 3.29Å; F258-L260 PolarHBondContact O-N 3.38Å; L260-F262 VanDerWaalsContact C-N 3.33Å; L260-F262 PolarHBondContact O-N 3.05Å; L260-K315 HydrophobicContact CD2-CB 4.26Å; L260-K315 HydrophobicContact CD2-CG 4.21Å; L260-K315 WeakPolarHBondContact O-CE 3.3Å
261H94.2Very high92.6Very high15 Ų1531.7 Ų31.77%0.06917%0.172CC..THydrogen-bonded Turntrans-76.8-15.1-173.678.3-85.2000114.8G214 E215 Y222 F258 N259G214-H261 WeakPolarHBondContact O-CA 3.33Å; E215-H261 WeakPolarHBondContact O-CB 3.26Å; Y222-H261 AromaticContact CZ-NE2 3.78Å; Y222-H261 PolarHBondContact OH-NE2 2.82Å; F258-H261 AromaticContact CD2-CE1 3.76Å; F258-H261 AromaticContact CE2-CE1 3.47Å; F258-H261 VanDerWaalsContact CE2-CE1 3.47Å; F258-H261 WeakPolarHBondContact CE2-CE1 3.38Å; F258-H261 AromaticContact CZ-CE1 3.94Å; F258-H261 PolarHBondContact O-CE1 3.01Å; F258-H261 PolarHBondContact O-ND1 3.16Å; N259-H261 PolarHBondContact O-N 2.88Å; N259-H261 VanDerWaalsContact O-N 3.1Å
262F95.1Very high92.6Very high7 Ų731.9 Ų31.93%0.03117%0.173CC..SBendtrans-69.1128178-67.4-70000109.7Y222 F258 N259 L260 Y266 N269 V270 V271 K315Y222-F262 HydrophobicContact CE1-CE1 4.25Å; Y222-F262 HydrophobicContact CE1-CZ 4.1Å; F258-F262 HydrophobicContact CE1-CE2 4.42Å; F258-F262 HydrophobicContact CE1-CZ 4.46Å; F258-F262 HydrophobicContact CZ-CZ 4.42Å; N259-F262 WeakPolarHBondContact O-CD2 3.48Å; N259-F262 PolarHBondContact O-N 3.38Å; L260-F262 VanDerWaalsContact C-N 3.33Å; L260-F262 PolarHBondContact O-N 3.05Å; F262-Y266 AromaticContact CD1-CD1 3.53Å; F262-Y266 HydrophobicContact CD1-CD1 3.53Å; F262-Y266 AromaticContact CD1-CE1 3.8Å; F262-Y266 HydrophobicContact CD1-CE1 3.8Å; F262-Y266 HydrophobicContact CD1-CG 4.42Å; F262-Y266 HydrophobicContact CE1-CD1 4.14Å; F262-Y266 AromaticContact CE1-CE1 3.97Å; F262-Y266 HydrophobicContact CE1-CE1 3.97Å; F262-Y266 HydrophobicContact CG-CD1 4.39Å; F262-N269 WeakPolarHBondContact CD2-ND2 3.44Å; F262-N269 HydrophobicContact CG-CB 4.34Å; F262-V270 HydrophobicContact CE2-CG1 4.31Å; F262-V270 HydrophobicContact CZ-CG1 3.78Å; F262-V271 HydrophobicContact CE2-CG2 4.05Å; F262-K315 WeakPolarHBondContact O-CE 3.42Å; F262-K315 PolarHBondContact O-NZ 3.33Å
263P92.2Very high92.5Very high81 Ų8136.1 Ų36.153%0.52619%0.191SC..PPolyproline II helixtrans-67.1159176.525.2-27.9000110.8Y266P263-Y266 HydrophobicContact CG-CD2 4.32Å; P263-Y266 HydrophobicContact CG-CG 4.38Å; P263-Y266 VanDerWaalsContact O-CB 3.3Å; P263-Y266 WeakPolarHBondContact O-CB 3.42Å; P263-Y266 PolarHBondContact O-N 3.48Å
264A80.6Confident92.5Very high68 Ų6836.5 Ų36.556%0.56219%0.194SC*.THydrogen-bonded Turntrans-54.9146.1169.200000110Y266A264-Y266 PolarHBondContact O-N 2.86Å
265D77.6Confident92.5Very high108 Ų10836.6 Ų36.658%0.57819%0.194SC*.THydrogen-bonded Turntrans6514.1-177.4-47.4-55.4000116.3H267 Q322D265-H267 PolarHBondContact O-N 3.31Å; D265-Q322 VanDerWaalsContact N-OE1 3.14Å; D265-Q322 PolarHBondContact OD1-OE1 3.25Å
266Y84Confident92.3Very high94 Ų9437.8 Ų37.837%0.36920%0.203SC..  trans-79.191.2176.6-166.6-105.5000112.4F262 P263 A264 D268 N269 C323F262-Y266 AromaticContact CD1-CD1 3.53Å; F262-Y266 HydrophobicContact CD1-CD1 3.53Å; F262-Y266 AromaticContact CD1-CE1 3.8Å; F262-Y266 HydrophobicContact CD1-CE1 3.8Å; F262-Y266 HydrophobicContact CD1-CG 4.42Å; F262-Y266 HydrophobicContact CE1-CD1 4.14Å; F262-Y266 AromaticContact CE1-CE1 3.97Å; F262-Y266 HydrophobicContact CE1-CE1 3.97Å; F262-Y266 HydrophobicContact CG-CD1 4.39Å; P263-Y266 HydrophobicContact CG-CD2 4.32Å; P263-Y266 HydrophobicContact CG-CG 4.38Å; P263-Y266 VanDerWaalsContact O-CB 3.3Å; P263-Y266 WeakPolarHBondContact O-CB 3.42Å; P263-Y266 PolarHBondContact O-N 3.48Å; A264-Y266 PolarHBondContact O-N 2.86Å; Y266-D268 HydrophobicContact CE1-CB 3.85Å; Y266-D268 VanDerWaalsContact CE1-O 3.23Å; Y266-D268 WeakPolarHBondContact CE1-O 3.27Å; Y266-D268 PolarHBondContact O-N 3.39Å; Y266-N269 HydrophobicContact CD1-CB 4.23Å; Y266-N269 WeakPolarHBondContact O-CB 3.46Å; Y266-N269 PolarHBondContact O-N 3Å; Y266-C323 PolarHBondContact O-SG 3.39Å
267H80.9Confident92.2Very high146 Ų14643.5 Ų43.568%0.67623%0.233SC*.THydrogen-bonded Turntrans-66.5-14.3-176.9-63.2-54.2000115.8D265 N269D265-H267 PolarHBondContact O-N 3.31Å; H267-N269 VanDerWaalsContact C-N 3.31Å
268D87Confident92.2Very high97 Ų9743.8 Ų43.852%0.51924%0.235SC..THydrogen-bonded Turntrans-98.628.9175.5-159.328.4000112.2Y266 V270Y266-D268 HydrophobicContact CE1-CB 3.85Å; Y266-D268 VanDerWaalsContact CE1-O 3.23Å; Y266-D268 WeakPolarHBondContact CE1-O 3.27Å; Y266-D268 PolarHBondContact O-N 3.39Å; D268-V270 PolarHBondContact O-N 3.4Å
269N94.2Very high92.2Very high3 Ų350.2 Ų50.22%0.01627%0.265CS..  trans-62.4107.8175.2-177.7-29.3000110N259 F262 Y266 H267 V271 V272 K273 D319N259-N269 PolarHBondContact OD1-ND2 3.27Å; N259-N269 PolarHBondContact OD1-OD1 3.38Å; F262-N269 WeakPolarHBondContact CD2-ND2 3.44Å; F262-N269 HydrophobicContact CG-CB 4.34Å; Y266-N269 HydrophobicContact CD1-CB 4.23Å; Y266-N269 WeakPolarHBondContact O-CB 3.46Å; Y266-N269 PolarHBondContact O-N 3Å; H267-N269 VanDerWaalsContact C-N 3.31Å; N269-V271 PolarHBondContact O-N 3Å; N269-V271 WeakPolarHBondContact OD1-CA 3.1Å; N269-V271 WeakPolarHBondContact OD1-CB 3.35Å; N269-V271 PolarHBondContact OD1-N 3.31Å; N269-V272 HydrophobicContact CB-CB 4.28Å; N269-V272 HydrophobicContact CB-CG2 4.21Å; N269-V272 PolarHBondContact O-N 3.28Å; N269-V272 PolarHBondContact OD1-N 3.3Å; N269-K273 WeakPolarHBondContact O-CB 3.25Å; N269-K273 PolarHBondContact O-N 3.4Å; N269-D319 PolarHBondContact ND2-OD2 3.49Å
270V95.7Very high92Very high17 Ų1751.7 Ų51.710%0.10328%0.275CS..Hα-helixtrans-59.6-31.6-176.976.20000112.5E227 V230 F258 F262 D268 C274E227-V270 HydrophobicContact CB-CG2 4.36Å; E227-V270 HydrophobicContact CG-CG2 3.55Å; V230-V270 HydrophobicContact CG2-CG1 4.26Å; F258-V270 HydrophobicContact CE1-CG1 3.7Å; F258-V270 HydrophobicContact CZ-CG1 4.26Å; F262-V270 HydrophobicContact CE2-CG1 4.31Å; F262-V270 HydrophobicContact CZ-CG1 3.78Å; D268-V270 PolarHBondContact O-N 3.4Å; V270-C274 WeakPolarHBondContact O-CB 3.49Å; V270-C274 PolarHBondContact O-N 2.64Å
271V97.3Very high92.1Very high2 Ų254.6 Ų54.61%0.01228%0.284CS..Hα-helixtrans-69.2-52179.4178.70000109.9V230 I255 F258 N259 F262 N269 K273 C274 L275 L316V230-V271 HydrophobicContact CG1-CG1 4.42Å; V230-V271 HydrophobicContact CG2-CG2 4.16Å; I255-V271 HydrophobicContact CG2-CG1 3.85Å; F258-V271 HydrophobicContact CD1-CG2 3.66Å; F258-V271 HydrophobicContact CE1-CG2 4.04Å; N259-V271 HydrophobicContact CB-CG1 4.43Å; N259-V271 HydrophobicContact CB-CG2 4.34Å; F262-V271 HydrophobicContact CE2-CG2 4.05Å; N269-V271 PolarHBondContact O-N 3Å; N269-V271 WeakPolarHBondContact OD1-CA 3.1Å; N269-V271 WeakPolarHBondContact OD1-CB 3.35Å; N269-V271 PolarHBondContact OD1-N 3.31Å; V271-K273 VanDerWaalsContact C-N 3.34Å; V271-K273 PolarHBondContact O-N 2.9Å; V271-C274 PolarHBondContact O-N 3.21Å; V271-L275 WeakPolarHBondContact O-CB 3.25Å; V271-L275 PolarHBondContact O-N 2.77Å; V271-L316 HydrophobicContact CG1-CD1 3.92Å
272V96Very high92.1Very high3 Ų356.7 Ų56.72%0.01830%0.296CS..Hα-helixtrans-65-39.9-179.71800000111.3N269 L275 S276 D319 I320 C323N269-V272 HydrophobicContact CB-CB 4.28Å; N269-V272 HydrophobicContact CB-CG2 4.21Å; N269-V272 PolarHBondContact O-N 3.28Å; N269-V272 PolarHBondContact OD1-N 3.3Å; V272-L275 PolarHBondContact O-N 3.26Å; V272-S276 VanDerWaalsContact O-CB 3.32Å; V272-S276 WeakPolarHBondContact O-CB 3.43Å; V272-S276 PolarHBondContact O-N 3.16Å; V272-S276 PolarHBondContact O-OG 3.36Å; V272-D319 HydrophobicContact CG2-CB 3.82Å; V272-I320 HydrophobicContact CG1-CG1 4.29Å; V272-I320 HydrophobicContact CG2-CG1 4.07Å; V272-C323 HydrophobicContact CB-CB 4.46Å; V272-C323 HydrophobicContact CG1-CB 3.89Å
273K95.3Very high92.1Very high89 Ų8959.4 Ų59.439%0.38731%0.31SS..Hα-helixtrans-64-46177.4-174.3-176.3176.5-159.70111.9E227 N269 V271 N277E227-K273 WeakPolarHBondContact OE1-CD 3.12Å; E227-K273 WeakPolarHBondContact OE1-CE 3.37Å; E227-K273 IonicContact OE1-NZ 3.94Å; E227-K273 PolarHBondContact OE1-NZ 3.45Å; N269-K273 WeakPolarHBondContact O-CB 3.25Å; N269-K273 PolarHBondContact O-N 3.4Å; V271-K273 VanDerWaalsContact C-N 3.34Å; V271-K273 PolarHBondContact O-N 2.9Å; K273-N277 PolarHBondContact O-N 3.18Å; K273-N277 PolarHBondContact O-ND2 3.14Å
274C96.5Very high92.2Very high9 Ų955.6 Ų55.66%0.06129%0.285CS..Hα-helixtrans-63.4-47.7176.8-179.60000110.7E227 V230 D231 V270 V271 S276 N277 H278E227-C274 HydrophobicContact CB-CB 4.42Å; E227-C274 HydrophobicContact CG-CB 4.46Å; E227-C274 PolarHBondContact O-SG 2.94Å; V230-C274 HydrophobicContact CB-CB 3.98Å; V230-C274 HydrophobicContact CG1-CB 3.81Å; D231-C274 PolarHBondContact N-SG 3.49Å; V270-C274 WeakPolarHBondContact O-CB 3.49Å; V270-C274 PolarHBondContact O-N 2.64Å; V271-C274 PolarHBondContact O-N 3.21Å; C274-S276 PolarHBondContact O-N 2.99Å; C274-N277 PolarHBondContact O-N 3.28Å; C274-H278 WeakPolarHBondContact O-CB 3.37Å; C274-H278 PolarHBondContact O-N 2.97Å
275L96.5Very high93Very high2 Ų252.4 Ų52.41%0.0126%0.259CS..Hα-helixtrans-57.6-46.3177.6176.762.2000112.3I234 V271 V272 N277 H278 R281 F284 M285 I320I234-L275 HydrophobicContact CD1-CB 4.38Å; I234-L275 HydrophobicContact CD1-CD1 4.37Å; V271-L275 WeakPolarHBondContact O-CB 3.25Å; V271-L275 PolarHBondContact O-N 2.77Å; V272-L275 PolarHBondContact O-N 3.26Å; L275-N277 PolarHBondContact O-N 3.02Å; L275-H278 WeakPolarHBondContact O-CB 3.33Å; L275-H278 PolarHBondContact O-N 3.39Å; L275-H278 VanDerWaalsContact O-N 3.16Å; L275-R281 HydrophobicContact CD1-CB 4.36Å; L275-R281 WeakPolarHBondContact O-CB 3.3Å; L275-F284 HydrophobicContact CD1-CB 3.81Å; L275-F284 HydrophobicContact CD1-CD1 3.3Å; L275-F284 HydrophobicContact CD1-CD2 4.13Å; L275-F284 HydrophobicContact CD1-CE1 3.84Å; L275-F284 HydrophobicContact CD1-CG 3.47Å; L275-F284 VanDerWaalsContact CD1-CG 3.47Å; L275-F284 HydrophobicContact CD1-CZ 4.48Å; L275-F284 HydrophobicContact CD2-CD1 3.9Å; L275-F284 HydrophobicContact CD2-CE1 3.84Å; L275-F284 HydrophobicContact CG-CD1 4.25Å; L275-M285 HydrophobicContact CD2-SD 4.09Å; L275-I320 HydrophobicContact CD2-CD1 3.53Å; L275-I320 HydrophobicContact CD2-CG1 4.14Å
276S94.5Very high93.8Very high27 Ų2751.8 Ų51.819%0.18925%0.252CS..Hα-helixtrans-63.4-31.2-177-59.20000112.5V272 C274 R281 S324V272-S276 VanDerWaalsContact O-CB 3.32Å; V272-S276 WeakPolarHBondContact O-CB 3.43Å; V272-S276 PolarHBondContact O-N 3.16Å; V272-S276 PolarHBondContact O-OG 3.36Å; C274-S276 PolarHBondContact O-N 2.99Å; S276-R281 WeakPolarHBondContact O-CD 3.29Å; S276-S324 WeakPolarHBondContact OG-CB 3.39Å; S276-S324 PolarHBondContact OG-OG 3.13Å
277N94.6Very high94.2Very high119 Ų11949.3 Ų49.364%0.63624%0.242SC*.Hα-helixtrans-93.4-7179.4-66.2-57000113.6K273 C274 L275K273-N277 PolarHBondContact O-N 3.18Å; K273-N277 PolarHBondContact O-ND2 3.14Å; C274-N277 PolarHBondContact O-N 3.28Å; L275-N277 PolarHBondContact O-N 3.02Å
278H96.2Very high94.9Very high7 Ų742.4 Ų42.43%0.03221%0.21CC..  trans-71.4144.4-176.1-164.6-89.1000111.8D231 C274 L275 S280 R281D231-H278 IonicContact OD1-CD2 3.89Å; D231-H278 PolarHBondContact OD1-CD2 3.31Å; D231-H278 IonicContact OD1-NE2 3.87Å; D231-H278 PolarHBondContact OD1-NE2 3.02Å; C274-H278 WeakPolarHBondContact O-CB 3.37Å; C274-H278 PolarHBondContact O-N 2.97Å; L275-H278 WeakPolarHBondContact O-CB 3.33Å; L275-H278 PolarHBondContact O-N 3.39Å; L275-H278 VanDerWaalsContact O-N 3.16Å; H278-S280 VanDerWaalsContact C-N 3.33Å; H278-S280 PolarHBondContact ND1-N 2.84Å; H278-S280 PolarHBondContact O-N 3.18Å; H278-R281 WeakPolarHBondContact O-CB 3.41Å; H278-R281 WeakPolarHBondContact O-CD 3.42Å; H278-R281 WeakPolarHBondContact O-CG 3.25Å; H278-R281 PolarHBondContact O-N 2.66Å; H278-R281 PolarHBondContact O-NH1 2.98Å
279E95.1Very high95.3Very high135 Ų13538 Ų3863%0.63119%0.187SC*.THydrogen-bonded Turntrans-63.7-38.1-179.464.7-169.615400112.2R235R235-E279 IonicContact CZ-OE1 3.78Å; R235-E279 IonicContact NH1-OE1 3.71Å; R235-E279 PolarHBondContact NH1-OE1 2.6Å; R235-E279 IonicContact NH2-OE1 3.86Å; R235-E279 PolarHBondContact NH2-OE1 3.26Å; R235-E279 VanDerWaalsContact NH2-OE1 3.13Å
280S94.6Very high95.3Very high31 Ų3142.8 Ų42.822%0.21721%0.211CC..THydrogen-bonded Turntrans-93.620.6-179.7-43.10000114.4H278 L282 L283 F284H278-S280 VanDerWaalsContact C-N 3.33Å; H278-S280 PolarHBondContact ND1-N 2.84Å; H278-S280 PolarHBondContact O-N 3.18Å; S280-L282 VanDerWaalsContact C-N 3.29Å; S280-L282 PolarHBondContact O-N 3.18Å; S280-L283 PolarHBondContact O-N 3.34Å; S280-L283 VanDerWaalsContact O-N 3.15Å; S280-F284 PolarHBondContact O-N 3.07Å
281R95.2Very high95.2Very high86 Ų8643 Ų4333%0.32521%0.21SC..Hα-helixtrans-57.5-36.6-174.369.2-167.6178.3-90.90.8114.3L275 S276 H278 F284 M285 L329L275-R281 HydrophobicContact CD1-CB 4.36Å; L275-R281 WeakPolarHBondContact O-CB 3.3Å; S276-R281 WeakPolarHBondContact O-CD 3.29Å; H278-R281 WeakPolarHBondContact O-CB 3.41Å; H278-R281 WeakPolarHBondContact O-CD 3.42Å; H278-R281 WeakPolarHBondContact O-CG 3.25Å; H278-R281 PolarHBondContact O-N 2.66Å; H278-R281 PolarHBondContact O-NH1 2.98Å; R281-F284 WeakPolarHBondContact O-CB 3.49Å; R281-F284 PolarHBondContact O-N 3.39Å; R281-M285 WeakPolarHBondContact O-CG 2.95Å; R281-M285 PolarHBondContact O-N 3.09Å; R281-L329 HydrophobicContact CB-CD2 4.18Å; R281-L329 HydrophobicContact CG-CD2 3.96Å
282L94.8Very high95.1Very high60 Ų6043 Ų4331%0.31421%0.21SC..Hα-helixtrans-64.4-46.3177-61.8179000111.3S280 F284 M285 E286 L329 F331S280-L282 VanDerWaalsContact C-N 3.29Å; S280-L282 PolarHBondContact O-N 3.18Å; L282-F284 VanDerWaalsContact C-N 3.32Å; L282-F284 PolarHBondContact O-N 3.07Å; L282-M285 PolarHBondContact O-N 3.36Å; L282-E286 PolarHBondContact O-N 2.86Å; L282-L329 VanDerWaalsContact CD2-O 3.31Å; L282-L329 WeakPolarHBondContact CD2-O 3.46Å; L282-F331 HydrophobicContact CB-CE2 4.33Å; L282-F331 HydrophobicContact CD1-CE1 4.3Å; L282-F331 HydrophobicContact CD1-CE2 4.38Å; L282-F331 HydrophobicContact CD1-CZ 3.83Å
283L94.5Very high95Very high63 Ų6345.7 Ų45.733%0.3323%0.225SC..Hα-helixtrans-67.1-34.7177.9-178.859.7000111.8I238 S280 R287I238-L283 HydrophobicContact CD1-CB 4.19Å; I238-L283 HydrophobicContact CD1-CD2 4.25Å; I238-L283 HydrophobicContact CD1-CG 3.94Å; I238-L283 HydrophobicContact CG2-CD2 3.71Å; S280-L283 PolarHBondContact O-N 3.34Å; S280-L283 VanDerWaalsContact O-N 3.15Å; L283-R287 WeakPolarHBondContact O-CG 3.48Å; L283-R287 PolarHBondContact O-N 3.45Å; L283-R287 VanDerWaalsContact O-N 3.13Å
284F96.1Very high94.9Very high2 Ų245.4 Ų45.41%0.00923%0.233CC..Hα-helixtrans-59.2-49.7172-176.3-83.6000110.7I234 F237 I238 L252 I255 L275 S280 R281 L282 R287 L288 L316I234-F284 HydrophobicContact CG1-CD2 4.26Å; I234-F284 HydrophobicContact CG1-CE2 4.11Å; I234-F284 HydrophobicContact CG2-CD2 4.05Å; F237-F284 AromaticContact CD1-CD2 3.42Å; F237-F284 HydrophobicContact CD1-CD2 3.42Å; F237-F284 VanDerWaalsContact CD1-CD2 3.42Å; F237-F284 AromaticContact CD1-CE2 3.47Å; F237-F284 HydrophobicContact CD1-CE2 3.47Å; F237-F284 VanDerWaalsContact CD1-CE2 3.47Å; F237-F284 HydrophobicContact CD1-CG 4.35Å; F237-F284 HydrophobicContact CD1-CZ 4.44Å; F237-F284 AromaticContact CE1-CD2 3.77Å; F237-F284 HydrophobicContact CE1-CD2 3.77Å; F237-F284 AromaticContact CE1-CE2 3.84Å; F237-F284 HydrophobicContact CE1-CE2 3.84Å; F237-F284 HydrophobicContact CE1-CG 4.3Å; F237-F284 HydrophobicContact CE1-CZ 4.45Å; F237-F284 HydrophobicContact CG-CE2 4.39Å; I238-F284 HydrophobicContact CD1-CB 3.97Å; L252-F284 HydrophobicContact CD1-CZ 4.17Å; I255-F284 HydrophobicContact CD1-CE2 3.89Å; I255-F284 HydrophobicContact CD1-CZ 4.34Å; I255-F284 HydrophobicContact CG2-CZ 4.34Å; L275-F284 HydrophobicContact CD1-CB 3.81Å; L275-F284 HydrophobicContact CD1-CD1 3.3Å; L275-F284 HydrophobicContact CD1-CD2 4.13Å; L275-F284 HydrophobicContact CD1-CE1 3.84Å; L275-F284 HydrophobicContact CD1-CG 3.47Å; L275-F284 VanDerWaalsContact CD1-CG 3.47Å; L275-F284 HydrophobicContact CD1-CZ 4.48Å; L275-F284 HydrophobicContact CD2-CD1 3.9Å; L275-F284 HydrophobicContact CD2-CE1 3.84Å; L275-F284 HydrophobicContact CG-CD1 4.25Å; S280-F284 PolarHBondContact O-N 3.07Å; R281-F284 WeakPolarHBondContact O-CB 3.49Å; R281-F284 PolarHBondContact O-N 3.39Å; L282-F284 VanDerWaalsContact C-N 3.32Å; L282-F284 PolarHBondContact O-N 3.07Å; F284-R287 PolarHBondContact O-N 2.88Å; F284-L288 HydrophobicContact CD1-CB 4.5Å; F284-L288 HydrophobicContact CE1-CB 4.37Å; F284-L288 HydrophobicContact CE1-CD2 4.1Å; F284-L288 WeakPolarHBondContact O-CB 3.31Å; F284-L288 PolarHBondContact O-N 2.91Å; F284-L316 HydrophobicContact CE1-CD2 4.44Å
285M96.3Very high94.6Very high0 Ų050.7 Ų50.70%025%0.251CS..Hα-helixtrans-64.4-42.8-179.9-70.4-54.7-7000112.4L275 R281 L282 R287 L288 M289 L317 I320 L326 L329 C330L275-M285 HydrophobicContact CD2-SD 4.09Å; R281-M285 WeakPolarHBondContact O-CG 2.95Å; R281-M285 PolarHBondContact O-N 3.09Å; L282-M285 PolarHBondContact O-N 3.36Å; M285-R287 VanDerWaalsContact C-N 3.29Å; M285-R287 PolarHBondContact O-N 3.46Å; M285-L288 HydrophobicContact CE-CD2 4.39Å; M285-L288 PolarHBondContact O-N 3.46Å; M285-L288 HydrophobicContact SD-CD2 4.1Å; M285-M289 HydrophobicContact CE-CE 3.83Å; M285-M289 VanDerWaalsContact O-CG 3.28Å; M285-M289 WeakPolarHBondContact O-CG 3.39Å; M285-M289 PolarHBondContact O-N 2.93Å; M285-L317 HydrophobicContact CE-CD2 3.82Å; M285-I320 HydrophobicContact CE-CD1 4.28Å; M285-I320 HydrophobicContact SD-CD1 3.97Å; M285-L326 HydrophobicContact CE-CD2 4.34Å; M285-L329 VanDerWaalsContact CB-O 3.31Å; M285-L329 WeakPolarHBondContact CB-O 3.27Å; M285-L329 HydrophobicContact CG-CB 3.89Å; M285-L329 VanDerWaalsContact CG-O 3.24Å; M285-L329 WeakPolarHBondContact CG-O 3.3Å; M285-C330 VanDerWaalsContact CE-SG 3.51Å
286E93.8Very high94.2Very high96 Ų9652.7 Ų52.745%0.44926%0.262SS..Hα-helixtrans-54.2-47.7175.1-175.9-175.6169.700111L282 M289L282-E286 PolarHBondContact O-N 2.86Å; E286-M289 PolarHBondContact O-N 3.29Å
287R93.6Very high94Very high42 Ų4252.4 Ų52.416%0.15826%0.259CS..Hα-helixtrans-68.9-41.7177.9-69.1-175.2177.7179.25.5112.5F237 I238 Q240 L283 F284 M285 M289 I290 Y291F237-R287 HydrophobicContact CE1-CB 3.75Å; F237-R287 HydrophobicContact CZ-CB 3.54Å; F237-R287 PolarHBondContact O-NH1 3.42Å; I238-R287 VanDerWaalsContact C-NH1 3.28Å; I238-R287 VanDerWaalsContact O-CZ 3.32Å; I238-R287 PolarHBondContact O-NH1 3.23Å; I238-R287 PolarHBondContact O-NH2 3.44Å; I238-R287 VanDerWaalsContact O-NH2 3.16Å; Q240-R287 VanDerWaalsContact CD-NH1 3.31Å; L283-R287 WeakPolarHBondContact O-CG 3.48Å; L283-R287 PolarHBondContact O-N 3.45Å; L283-R287 VanDerWaalsContact O-N 3.13Å; F284-R287 PolarHBondContact O-N 2.88Å; M285-R287 VanDerWaalsContact C-N 3.29Å; M285-R287 PolarHBondContact O-N 3.46Å; R287-M289 PolarHBondContact O-N 2.97Å; R287-I290 WeakPolarHBondContact O-CB 3.21Å; R287-I290 PolarHBondContact O-N 2.83Å; R287-Y291 VanDerWaalsContact O-CD2 3.29Å; R287-Y291 WeakPolarHBondContact O-CD2 3.06Å
288L95.6Very high93.9Very high0 Ų046.8 Ų46.80%023%0.229CC..Hα-helixtrans-57.9-38.8176.7-175.468.2000111.3L252 F284 M285 I290 Y291 F292 I313 L316 L317 I320L252-L288 HydrophobicContact CD1-CD1 4.08Å; F284-L288 HydrophobicContact CD1-CB 4.5Å; F284-L288 HydrophobicContact CE1-CB 4.37Å; F284-L288 HydrophobicContact CE1-CD2 4.1Å; F284-L288 WeakPolarHBondContact O-CB 3.31Å; F284-L288 PolarHBondContact O-N 2.91Å; M285-L288 HydrophobicContact CE-CD2 4.39Å; M285-L288 PolarHBondContact O-N 3.46Å; M285-L288 HydrophobicContact SD-CD2 4.1Å; L288-I290 PolarHBondContact O-N 2.9Å; L288-Y291 PolarHBondContact O-N 3.21Å; L288-Y291 VanDerWaalsContact O-N 3.17Å; L288-F292 PolarHBondContact O-N 3.33Å; L288-I313 HydrophobicContact CD1-CD1 3.56Å; L288-I313 HydrophobicContact CD1-CG2 4.08Å; L288-I313 HydrophobicContact CG-CG2 4.47Å; L288-L316 HydrophobicContact CD1-CD2 4.29Å; L288-L316 HydrophobicContact CD2-CD2 4.11Å; L288-L317 HydrophobicContact CD2-CD2 3.61Å; L288-L317 HydrophobicContact CD2-CG 4.1Å; L288-L317 HydrophobicContact CG-CD2 4.41Å; L288-I320 HydrophobicContact CD2-CD1 4.46Å
289M94.5Very high93.7Very high5 Ų546.5 Ų46.53%0.02523%0.227CC..Hα-helixtrans-62.8-28177.3-71.6-60.9160.500113M285 E286 R287 F292 N293 L317 F338M285-M289 HydrophobicContact CE-CE 3.83Å; M285-M289 VanDerWaalsContact O-CG 3.28Å; M285-M289 WeakPolarHBondContact O-CG 3.39Å; M285-M289 PolarHBondContact O-N 2.93Å; E286-M289 PolarHBondContact O-N 3.29Å; R287-M289 PolarHBondContact O-N 2.97Å; M289-F292 PolarHBondContact O-N 3.43Å; M289-F292 HydrophobicContact SD-CD1 4.09Å; M289-N293 WeakPolarHBondContact O-CB 3.47Å; M289-N293 PolarHBondContact O-N 2.82Å; M289-L317 HydrophobicContact CE-CD2 3.61Å; M289-F338 HydrophobicContact CE-CB 4.28Å; M289-F338 HydrophobicContact CE-CD2 3.68Å; M289-F338 HydrophobicContact CE-CE2 4.36Å; M289-F338 HydrophobicContact CE-CG 4.3Å; M289-F338 HydrophobicContact SD-CB 4.07Å; M289-F338 HydrophobicContact SD-CD2 3.93Å; M289-F338 HydrophobicContact SD-CG 4.49Å
290I93.9Very high93.2Very high103 Ų10341.5 Ų41.553%0.52821%0.212SC..Hα-helixtrans-64.5-48.6173.3-58.8172.3000110.3R287 L288 F292 N293 C294R287-I290 WeakPolarHBondContact O-CB 3.21Å; R287-I290 PolarHBondContact O-N 2.83Å; L288-I290 PolarHBondContact O-N 2.9Å; I290-F292 VanDerWaalsContact C-N 3.31Å; I290-F292 PolarHBondContact O-N 2.87Å; I290-N293 PolarHBondContact O-N 2.98Å; I290-C294 WeakPolarHBondContact O-CB 3.46Å; I290-C294 PolarHBondContact O-N 3.23Å; I290-C294 PolarHBondContact O-SG 3.13Å; I290-C294 VanDerWaalsContact O-SG 3.35Å
291Y94.4Very high92.5Very high22 Ų2246.2 Ų46.29%0.08623%0.225CC..Hα-helixtrans-62.5-40.9177.2-67.9-95.9000111.2F237 D249 L252 R287 L288 C294 R295 D296F237-Y291 AromaticContact CE2-CE2 3.9Å; F237-Y291 HydrophobicContact CE2-CE2 3.9Å; F237-Y291 AromaticContact CZ-CE2 3.99Å; F237-Y291 HydrophobicContact CZ-CE2 3.99Å; D249-Y291 PolarHBondContact OD1-OH 3.49Å; L252-Y291 HydrophobicContact CD2-CD1 3.84Å; L252-Y291 HydrophobicContact CD2-CD2 3.5Å; L252-Y291 HydrophobicContact CD2-CE1 3.79Å; L252-Y291 HydrophobicContact CD2-CE2 3.48Å; L252-Y291 VanDerWaalsContact CD2-CE2 3.48Å; L252-Y291 HydrophobicContact CD2-CG 3.7Å; R287-Y291 VanDerWaalsContact O-CD2 3.29Å; R287-Y291 WeakPolarHBondContact O-CD2 3.06Å; L288-Y291 PolarHBondContact O-N 3.21Å; L288-Y291 VanDerWaalsContact O-N 3.17Å; Y291-C294 PolarHBondContact O-N 3.03Å; Y291-R295 PolarHBondContact O-N 2.91Å; Y291-R295 VanDerWaalsContact O-N 3.08Å; Y291-D296 HydrophobicContact CD1-CB 4.4Å; Y291-D296 PolarHBondContact O-N 3.22Å; Y291-D296 VanDerWaalsContact O-N 3.1Å
292F95.5Very high91.7Very high3 Ų342.6 Ų42.61%0.01321%0.213CC..Hα-helixtrans-60-46.7176.6-176-122.6000112.2L288 M289 I290 R295 I313 V314 L317 F338 I341 I342 Y358 L361L288-F292 PolarHBondContact O-N 3.33Å; M289-F292 PolarHBondContact O-N 3.43Å; M289-F292 HydrophobicContact SD-CD1 4.09Å; I290-F292 VanDerWaalsContact C-N 3.31Å; I290-F292 PolarHBondContact O-N 2.87Å; F292-R295 PolarHBondContact O-N 3.35Å; F292-I313 HydrophobicContact CB-CG2 3.94Å; F292-I313 HydrophobicContact CD2-CG2 4.11Å; F292-I313 HydrophobicContact CG-CG2 4.49Å; F292-V314 HydrophobicContact CE2-CG2 4.18Å; F292-L317 HydrophobicContact CB-CD1 4.05Å; F292-L317 HydrophobicContact CD1-CD1 4.04Å; F292-L317 HydrophobicContact CD2-CD1 3.48Å; F292-L317 VanDerWaalsContact CD2-CD1 3.48Å; F292-L317 HydrophobicContact CE1-CD1 4.35Å; F292-L317 HydrophobicContact CE2-CD1 3.82Å; F292-L317 HydrophobicContact CG-CD1 3.6Å; F292-L317 HydrophobicContact CZ-CD1 4.24Å; F292-F338 HydrophobicContact CD1-CD2 4.24Å; F292-F338 AromaticContact CE1-CD2 3.74Å; F292-F338 HydrophobicContact CE1-CD2 3.74Å; F292-F338 HydrophobicContact CE1-CE2 4.21Å; F292-F338 HydrophobicContact CZ-CD2 4.39Å; F292-F338 HydrophobicContact CZ-CE2 4.43Å; F292-I341 HydrophobicContact CD1-CB 4.18Å; F292-I341 HydrophobicContact CD1-CD1 3.74Å; F292-I341 HydrophobicContact CD1-CG2 3.79Å; F292-I341 HydrophobicContact CE1-CB 3.75Å; F292-I341 HydrophobicContact CE1-CD1 4.16Å; F292-I341 HydrophobicContact CE1-CG2 3.42Å; F292-I341 VanDerWaalsContact CE1-CG2 3.42Å; F292-I341 HydrophobicContact CG-CG2 4.49Å; F292-I341 HydrophobicContact CZ-CG2 3.86Å; F292-I342 HydrophobicContact CE1-CG1 4.1Å; F292-I342 HydrophobicContact CZ-CD1 4.43Å; F292-I342 HydrophobicContact CZ-CG1 3.7Å; F292-Y358 HydrophobicContact CE2-CD1 4.24Å; F292-Y358 AromaticContact CE2-CE1 3.41Å; F292-Y358 HydrophobicContact CE2-CE1 3.41Å; F292-Y358 VanDerWaalsContact CE2-CE1 3.41Å; F292-Y358 HydrophobicContact CZ-CD1 4.14Å; F292-Y358 AromaticContact CZ-CE1 3.6Å; F292-Y358 HydrophobicContact CZ-CE1 3.6Å; F292-L361 HydrophobicContact CE2-CD2 4.12Å; F292-L361 HydrophobicContact CZ-CD2 3.93Å
293N94Very high90.8Very high59 Ų5940.7 Ų40.732%0.31620%0.203SC..Hα-helixtrans-65.4-40.1177.9-172.231.6000112.5M289 I290 R295 I341 R344M289-N293 WeakPolarHBondContact O-CB 3.47Å; M289-N293 PolarHBondContact O-N 2.82Å; I290-N293 PolarHBondContact O-N 2.98Å; N293-R295 PolarHBondContact O-N 3.39Å; N293-I341 HydrophobicContact CB-CD1 3.57Å; N293-I341 HydrophobicContact CB-CG1 4.31Å; N293-R344 PolarHBondContact OD1-NH2 3.42Å
294C92.4Very high89.6Confident83 Ų8340.8 Ų40.856%0.56120%0.204SC*.Hα-helixtrans-75.6-6.6180-69.70000113.9I290 Y291 D296I290-C294 WeakPolarHBondContact O-CB 3.46Å; I290-C294 PolarHBondContact O-N 3.23Å; I290-C294 PolarHBondContact O-SG 3.13Å; I290-C294 VanDerWaalsContact O-SG 3.35Å; Y291-C294 PolarHBondContact O-N 3.03Å; C294-D296 HydrophobicContact CB-CB 3.99Å; C294-D296 PolarHBondContact O-N 3.17Å
295R90.1Very high87.8Confident120 Ų12044.1 Ų44.145%0.45323%0.233SC..THydrogen-bonded Turntrans54.931.8-172.1-50.4175.6-176.6-178.8-3.2112.3Y291 F292 N293 E345Y291-R295 PolarHBondContact O-N 2.91Å; Y291-R295 VanDerWaalsContact O-N 3.08Å; F292-R295 PolarHBondContact O-N 3.35Å; N293-R295 PolarHBondContact O-N 3.39Å; R295-E345 VanDerWaalsContact CZ-CD 3.44Å; R295-E345 IonicContact CZ-OE1 3.16Å; R295-E345 IonicContact CZ-OE2 2.79Å; R295-E345 IonicContact NE-OE1 2.58Å; R295-E345 PolarHBondContact NE-OE1 3.01Å; R295-E345 IonicContact NE-OE2 2.65Å; R295-E345 PolarHBondContact NE-OE2 3.13Å; R295-E345 IonicContact NH1-OE2 3.72Å; R295-E345 IonicContact NH2-OE1 3.63Å; R295-E345 PolarHBondContact NH2-OE1 2.7Å; R295-E345 IonicContact NH2-OE2 3.03Å; R295-E345 PolarHBondContact NH2-OE2 3.33Å
296D89.1Confident86.5Confident44 Ų4452.6 Ų52.624%0.23527%0.269CS..  trans-98.1115.1-171.7179.837.4000109.9Y291 C294 P298 R301Y291-D296 HydrophobicContact CD1-CB 4.4Å; Y291-D296 PolarHBondContact O-N 3.22Å; Y291-D296 VanDerWaalsContact O-N 3.1Å; C294-D296 HydrophobicContact CB-CB 3.99Å; C294-D296 PolarHBondContact O-N 3.17Å; D296-P298 WeakPolarHBondContact O-CD 3.47Å; D296-R301 IonicContact OD1-CZ 2.79Å; D296-R301 IonicContact OD1-NE 2.99Å; D296-R301 PolarHBondContact OD1-NE 3.05Å; D296-R301 IonicContact OD1-NH2 2.7Å; D296-R301 PolarHBondContact OD1-NH2 3.33Å; D296-R301 IonicContact OD2-CZ 3.65Å; D296-R301 VanDerWaalsContact OD2-CZ 3.27Å; D296-R301 IonicContact OD2-NE 3.83Å; D296-R301 IonicContact OD2-NH1 3.41Å; D296-R301 IonicContact OD2-NH2 2.77Å; D296-R301 PolarHBondContact OD2-NH2 2.83Å
297D89.9Confident85.4Confident21 Ų2149.3 Ų49.311%0.11225%0.253CS..  trans-96.7109.2178.5-172.9-12.8000110.3V299 G300 S308 G310 S312D297-V299 PolarHBondContact O-N 3.26Å; D297-V299 VanDerWaalsContact OD1-CB 3.29Å; D297-V299 WeakPolarHBondContact OD1-CB 3.39Å; D297-V299 WeakPolarHBondContact OD1-CG2 3.49Å; D297-V299 PolarHBondContact OD1-N 3.28Å; D297-G300 PolarHBondContact O-N 3.04Å; D297-S308 PolarHBondContact OD2-OG 2.98Å; D297-G310 VanDerWaalsContact OD2-CA 3.26Å; D297-G310 WeakPolarHBondContact OD2-CA 3.44Å; D297-S312 PolarHBondContact OD1-OG 3Å; D297-S312 PolarHBondContact OD2-OG 3.22Å
298P92.1Very high84.4Confident1 Ų148.1 Ų48.11%0.00625%0.251CS..THydrogen-bonded Turntrans-66.2-20.5-178.328.9-35.9000113L252 A253 V256 D296 G300 R301 I313L252-P298 HydrophobicContact CB-CG 4.4Å; L252-P298 HydrophobicContact CD2-CG 3.96Å; L252-P298 HydrophobicContact CG-CG 3.9Å; A253-P298 HydrophobicContact CB-CB 3.96Å; A253-P298 HydrophobicContact CB-CG 4.46Å; A253-P298 WeakPolarHBondContact CB-O 3.49Å; V256-P298 HydrophobicContact CG2-CG 4Å; D296-P298 WeakPolarHBondContact O-CD 3.47Å; P298-G300 VanDerWaalsContact C-N 3.31Å; P298-G300 PolarHBondContact O-N 3.27Å; P298-R301 WeakPolarHBondContact O-CB 3.17Å; P298-R301 PolarHBondContact O-N 3Å; P298-I313 HydrophobicContact CG-CD1 4.36Å
299V91.5Very high83.6Confident0 Ų052 Ų520%027%0.272CS..Hα-helixtrans-64.1-39.1175.5-175.60000110.9V256 A257 D297 R301 C302 T303V256-V299 HydrophobicContact CG2-CG2 3.48Å; V256-V299 VanDerWaalsContact CG2-CG2 3.48Å; A257-V299 HydrophobicContact CB-CG1 4.48Å; A257-V299 HydrophobicContact CB-CG2 3.96Å; D297-V299 PolarHBondContact O-N 3.26Å; D297-V299 VanDerWaalsContact OD1-CB 3.29Å; D297-V299 WeakPolarHBondContact OD1-CB 3.39Å; D297-V299 WeakPolarHBondContact OD1-CG2 3.49Å; D297-V299 PolarHBondContact OD1-N 3.28Å; V299-R301 PolarHBondContact O-N 3.48Å; V299-C302 PolarHBondContact O-N 3.09Å; V299-T303 HydrophobicContact CG1-CG2 4.37Å; V299-T303 PolarHBondContact O-N 3.27Å; V299-T303 PolarHBondContact O-OG1 3.4Å
300G85Confident83.1Confident30 Ų3053 Ų5331%0.30928%0.284SS..Hα-helixtrans-65.3-18.517900000113.9D297 P298 T303D297-G300 PolarHBondContact O-N 3.04Å; P298-G300 VanDerWaalsContact C-N 3.31Å; P298-G300 PolarHBondContact O-N 3.27Å; G300-T303 VanDerWaalsContact O-O 3.13Å
301R79.7Confident83Confident130 Ų13048.6 Ų48.649%0.49126%0.261SS..Hα-helixtrans-80.6-21.9173.7-58.9-179.9-179.7-170.1-5.2112.8D249 D296 P298 V299D249-R301 IonicContact OD1-NH1 2.73Å; D249-R301 IonicContact OD2-NH1 2.62Å; D249-R301 PolarHBondContact OD2-NH1 3.42Å; D296-R301 IonicContact OD1-CZ 2.79Å; D296-R301 IonicContact OD1-NE 2.99Å; D296-R301 PolarHBondContact OD1-NE 3.05Å; D296-R301 IonicContact OD1-NH2 2.7Å; D296-R301 PolarHBondContact OD1-NH2 3.33Å; D296-R301 IonicContact OD2-CZ 3.65Å; D296-R301 VanDerWaalsContact OD2-CZ 3.27Å; D296-R301 IonicContact OD2-NE 3.83Å; D296-R301 IonicContact OD2-NH1 3.41Å; D296-R301 IonicContact OD2-NH2 2.77Å; D296-R301 PolarHBondContact OD2-NH2 2.83Å; P298-R301 WeakPolarHBondContact O-CB 3.17Å; P298-R301 PolarHBondContact O-N 3Å; V299-R301 PolarHBondContact O-N 3.48Å
302C78.6Confident83Confident11 Ų1147.5 Ų47.57%0.07426%0.257CS..Hα-helixtrans-95.8-19.3-177.9-58.40000112.7A208 L250 A253 V299A208-C302 HydrophobicContact CB-CB 3.77Å; L250-C302 WeakPolarHBondContact CD2-SG 3.35Å; A253-C302 VanDerWaalsContact CB-SG 3.51Å; V299-C302 PolarHBondContact O-N 3.09Å
303T75.3Confident83.1Confident19 Ų1947.9 Ų47.912%0.11726%0.259CS..SBendtrans-134169.5-165.860.20000111.9A209 V299 G300 A305 W307A209-T303 VanDerWaalsContact CA-CG2 3.43Å; A209-T303 HydrophobicContact CB-CG2 3.81Å; V299-T303 HydrophobicContact CG1-CG2 4.37Å; V299-T303 PolarHBondContact O-N 3.27Å; V299-T303 PolarHBondContact O-OG1 3.4Å; G300-T303 VanDerWaalsContact O-O 3.13Å; T303-A305 PolarHBondContact O-N 3.01Å; T303-W307 VanDerWaalsContact CB-CE3 3.49Å; T303-W307 HydrophobicContact CG2-CE3 3.71Å; T303-W307 HydrophobicContact CG2-CZ3 3.89Å
304D69.7Low83.2Confident65 Ų6545.3 Ų45.335%0.34825%0.245SC..  trans-65.6129.4166.6-160.9-24.8000108.1K306 W307D304-K306 PolarHBondContact O-N 3.3Å; D304-W307 HydrophobicContact CB-CZ2 4.45Å; D304-W307 PolarHBondContact O-N 3.37Å
305A57.9Low83.3Confident73 Ų7343.2 Ų43.260%0.60323%0.227SC*.THydrogen-bonded Turntrans-56.5-14.6-172.100000113.7T303 W307T303-A305 PolarHBondContact O-N 3.01Å; A305-W307 VanDerWaalsContact C-N 3.3Å; A305-W307 PolarHBondContact O-N 3.36Å
306K69.4Low83.6Confident177 Ų17737.5 Ų37.577%0.7721%0.205SC*.THydrogen-bonded Turntrans-73.3-14.6177.7-62177.1-176.2170.60114.5D304D304-K306 PolarHBondContact O-N 3.3Å
307W70.5Confident84Confident27 Ų2735.4 Ų35.410%0.10219%0.194CC..SBendtrans-91-31.9-176.7-57.9-12.9000113.4A166 V174 A209 T303 D304 A305A166-W307 HydrophobicContact CB-CH2 3.7Å; A166-W307 HydrophobicContact CB-CZ3 4.37Å; A166-W307 WeakPolarHBondContact O-CH2 3.4Å; A166-W307 WeakPolarHBondContact O-CZ2 3.39Å; V174-W307 HydrophobicContact CG2-CE3 4.43Å; V174-W307 HydrophobicContact CG2-CH2 4.49Å; V174-W307 HydrophobicContact CG2-CZ3 4.36Å; A209-W307 HydrophobicContact CB-CZ3 4.12Å; T303-W307 VanDerWaalsContact CB-CE3 3.49Å; T303-W307 HydrophobicContact CG2-CE3 3.71Å; T303-W307 HydrophobicContact CG2-CZ3 3.89Å; D304-W307 HydrophobicContact CB-CZ2 4.45Å; D304-W307 PolarHBondContact O-N 3.37Å; A305-W307 VanDerWaalsContact C-N 3.3Å; A305-W307 PolarHBondContact O-N 3.36Å
308S72.2Confident84.2Confident18 Ų1835.4 Ų35.413%0.12619%0.194CC..  trans-85.8137.6174.9-174.30000110.2D297 G310D297-S308 PolarHBondContact OD2-OG 2.98Å; S308-G310 PolarHBondContact O-N 3.36Å; S308-G310 PolarHBondContact OG-N 3.26Å
309N79.5Confident84.4Confident81 Ų8135.6 Ų35.643%0.43320%0.195SC..  trans-76-1.2165.964.72.6000112.6L311N309-L311 VanDerWaalsContact C-N 3.26Å; N309-L311 PolarHBondContact O-N 3.04Å; N309-L311 WeakPolarHBondContact OD1-CB 3.44Å; N309-L311 PolarHBondContact OD1-N 2.96Å
310G84.8Confident84.6Confident27 Ų2735.6 Ų35.628%0.27820%0.195SC..SBendtrans72.618.7-179.400000113.6D297 S308 R354D297-G310 VanDerWaalsContact OD2-CA 3.26Å; D297-G310 WeakPolarHBondContact OD2-CA 3.44Å; S308-G310 PolarHBondContact O-N 3.36Å; S308-G310 PolarHBondContact OG-N 3.26Å; G310-R354 PolarHBondContact O-NH1 3.38Å
311L91.9Very high85Confident9 Ų934.4 Ų34.45%0.04718%0.182CC..  trans-122.712.7-175.3-58.4172.6000112.8N309 I313 V314 K315 E353 R354 A357N309-L311 VanDerWaalsContact C-N 3.26Å; N309-L311 PolarHBondContact O-N 3.04Å; N309-L311 WeakPolarHBondContact OD1-CB 3.44Å; N309-L311 PolarHBondContact OD1-N 2.96Å; L311-I313 VanDerWaalsContact C-N 3.31Å; L311-I313 PolarHBondContact O-N 2.94Å; L311-V314 HydrophobicContact CB-CB 4.37Å; L311-V314 HydrophobicContact CD2-CB 4.47Å; L311-V314 HydrophobicContact CD2-CG2 3.97Å; L311-V314 WeakPolarHBondContact O-CB 3.41Å; L311-V314 PolarHBondContact O-N 3.02Å; L311-V314 VanDerWaalsContact O-N 3.1Å; L311-K315 WeakPolarHBondContact O-CB 3.24Å; L311-K315 PolarHBondContact O-N 3.25Å; L311-E353 HydrophobicContact CD1-CG 4.33Å; L311-R354 HydrophobicContact CD2-CB 4.24Å; L311-R354 HydrophobicContact CD2-CG 3.85Å; L311-A357 HydrophobicContact CD1-CB 4.03Å
312S94.7Very high85.6Confident0 Ų029.8 Ų29.80%017%0.166CC..Hα-helixtrans-56.3-42.7-178.766.60000113V256 D297 K315 L316V256-S312 WeakPolarHBondContact CG2-OG 3.49Å; D297-S312 PolarHBondContact OD1-OG 3Å; D297-S312 PolarHBondContact OD2-OG 3.22Å; S312-K315 PolarHBondContact O-N 3.03Å; S312-L316 PolarHBondContact O-N 3.04Å
313I96.2Very high86.2Confident10 Ų1031.3 Ų31.35%0.05118%0.176CC..Hα-helixtrans-66.4-44.8175.6-59.6-73.1000111.1L252 V256 L288 F292 P298 L311 K315 L316 L317L252-I313 HydrophobicContact CD2-CD1 4.25Å; V256-I313 HydrophobicContact CG1-CD1 3.76Å; L288-I313 HydrophobicContact CD1-CD1 3.56Å; L288-I313 HydrophobicContact CD1-CG2 4.08Å; L288-I313 HydrophobicContact CG-CG2 4.47Å; F292-I313 HydrophobicContact CB-CG2 3.94Å; F292-I313 HydrophobicContact CD2-CG2 4.11Å; F292-I313 HydrophobicContact CG-CG2 4.49Å; P298-I313 HydrophobicContact CG-CD1 4.36Å; L311-I313 VanDerWaalsContact C-N 3.31Å; L311-I313 PolarHBondContact O-N 2.94Å; I313-K315 VanDerWaalsContact C-N 3.29Å; I313-K315 PolarHBondContact O-N 3.08Å; I313-L316 PolarHBondContact O-N 3.37Å; I313-L317 HydrophobicContact CG2-CD1 4.07Å; I313-L317 WeakPolarHBondContact O-CG 3.48Å; I313-L317 PolarHBondContact O-N 2.88Å
314V96.1Very high86.9Confident5 Ų531.6 Ų31.63%0.0318%0.179CC..Hα-helixtrans-60.9-43.1178.5-173.40000109.9F292 L311 L317 D318 A357 Y358 L361F292-V314 HydrophobicContact CE2-CG2 4.18Å; L311-V314 HydrophobicContact CB-CB 4.37Å; L311-V314 HydrophobicContact CD2-CB 4.47Å; L311-V314 HydrophobicContact CD2-CG2 3.97Å; L311-V314 WeakPolarHBondContact O-CB 3.41Å; L311-V314 PolarHBondContact O-N 3.02Å; L311-V314 VanDerWaalsContact O-N 3.1Å; V314-L317 PolarHBondContact O-N 3.16Å; V314-D318 WeakPolarHBondContact O-CB 3.45Å; V314-D318 PolarHBondContact O-N 2.85Å; V314-A357 HydrophobicContact CG1-CB 4.11Å; V314-Y358 HydrophobicContact CG2-CE1 4.23Å; V314-Y358 HydrophobicContact CG2-CE2 4.28Å; V314-L361 HydrophobicContact CG1-CB 4.49Å; V314-L361 HydrophobicContact CG1-CD2 4.01Å
315K95.5Very high87.8Confident40 Ų4030.8 Ų30.817%0.17417%0.174CC..Hα-helixtrans-62.1-46.8177.5-164.8-80.1-176.8-1670111.5N259 L260 F262 L311 S312 I313 L317 D318 D319N259-K315 VanDerWaalsContact ND2-CD 3.29Å; N259-K315 WeakPolarHBondContact ND2-CD 3.28Å; N259-K315 WeakPolarHBondContact O-CE 3.43Å; N259-K315 PolarHBondContact O-NZ 3.49Å; L260-K315 HydrophobicContact CD2-CB 4.26Å; L260-K315 HydrophobicContact CD2-CG 4.21Å; L260-K315 WeakPolarHBondContact O-CE 3.3Å; F262-K315 WeakPolarHBondContact O-CE 3.42Å; F262-K315 PolarHBondContact O-NZ 3.33Å; L311-K315 WeakPolarHBondContact O-CB 3.24Å; L311-K315 PolarHBondContact O-N 3.25Å; S312-K315 PolarHBondContact O-N 3.03Å; I313-K315 VanDerWaalsContact C-N 3.29Å; I313-K315 PolarHBondContact O-N 3.08Å; K315-L317 PolarHBondContact O-N 2.72Å; K315-D318 PolarHBondContact O-N 2.77Å; K315-D319 WeakPolarHBondContact CD-OD2 3.46Å; K315-D319 WeakPolarHBondContact CE-OD2 3.49Å; K315-D319 IonicContact NZ-OD1 2.91Å; K315-D319 PolarHBondContact NZ-OD1 3.42Å; K315-D319 IonicContact NZ-OD2 3.47Å; K315-D319 PolarHBondContact NZ-OD2 3.28Å; K315-D319 PolarHBondContact O-N 3.41Å
316L96.3Very high89.4Confident0 Ų027.3 Ų27.30%015%0.146CC..Hα-helixtrans-60.5-44.7175.917861.7000111.9I255 V256 N259 V271 F284 L288 S312 I313 D318 D319 I320I255-L316 HydrophobicContact CG2-CD2 4.35Å; V256-L316 HydrophobicContact CG1-CD2 3.88Å; N259-L316 HydrophobicContact CB-CD1 4.18Å; N259-L316 WeakPolarHBondContact ND2-CA 3.24Å; V271-L316 HydrophobicContact CG1-CD1 3.92Å; F284-L316 HydrophobicContact CE1-CD2 4.44Å; L288-L316 HydrophobicContact CD1-CD2 4.29Å; L288-L316 HydrophobicContact CD2-CD2 4.11Å; S312-L316 PolarHBondContact O-N 3.04Å; I313-L316 PolarHBondContact O-N 3.37Å; L316-D318 VanDerWaalsContact C-N 3.28Å; L316-D318 PolarHBondContact O-N 3.47Å; L316-D319 PolarHBondContact O-N 3.49Å; L316-I320 HydrophobicContact CD1-CD1 4.16Å; L316-I320 HydrophobicContact CD1-CG1 4.35Å; L316-I320 HydrophobicContact CG-CD1 3.95Å; L316-I320 WeakPolarHBondContact O-CD1 3.28Å; L316-I320 WeakPolarHBondContact O-CG1 3.19Å; L316-I320 PolarHBondContact O-N 2.93Å
317L96.4Very high90.4Very high0 Ų022.1 Ų22.10%013%0.129CC..Hα-helixtrans-62.8-37176.6-70.7169.2000112M285 L288 M289 F292 I313 V314 K315 I320 A321 F338 L361M285-L317 HydrophobicContact CE-CD2 3.82Å; L288-L317 HydrophobicContact CD2-CD2 3.61Å; L288-L317 HydrophobicContact CD2-CG 4.1Å; L288-L317 HydrophobicContact CG-CD2 4.41Å; M289-L317 HydrophobicContact CE-CD2 3.61Å; F292-L317 HydrophobicContact CB-CD1 4.05Å; F292-L317 HydrophobicContact CD1-CD1 4.04Å; F292-L317 HydrophobicContact CD2-CD1 3.48Å; F292-L317 VanDerWaalsContact CD2-CD1 3.48Å; F292-L317 HydrophobicContact CE1-CD1 4.35Å; F292-L317 HydrophobicContact CE2-CD1 3.82Å; F292-L317 HydrophobicContact CG-CD1 3.6Å; F292-L317 HydrophobicContact CZ-CD1 4.24Å; I313-L317 HydrophobicContact CG2-CD1 4.07Å; I313-L317 WeakPolarHBondContact O-CG 3.48Å; I313-L317 PolarHBondContact O-N 2.88Å; V314-L317 PolarHBondContact O-N 3.16Å; K315-L317 PolarHBondContact O-N 2.72Å; L317-I320 PolarHBondContact O-N 3.28Å; L317-A321 WeakPolarHBondContact O-CB 3.16Å; L317-A321 PolarHBondContact O-N 2.93Å; L317-F338 HydrophobicContact CB-CE2 4.42Å; L317-F338 HydrophobicContact CD1-CE2 4.18Å; L317-F338 HydrophobicContact CD2-CE2 4.5Å; L317-L361 VanDerWaalsContact C-CD1 3.49Å; L317-L361 HydrophobicContact CB-CD1 3.83Å; L317-L361 HydrophobicContact CB-CD2 4.15Å
318D95.4Very high91.4Very high21 Ų2126.9 Ų26.911%0.11215%0.152CC..Hα-helixtrans-67.2-41.8178.6-168.846.2000111.5V314 K315 L316 A321 Q322 L361 H364V314-D318 WeakPolarHBondContact O-CB 3.45Å; V314-D318 PolarHBondContact O-N 2.85Å; K315-D318 PolarHBondContact O-N 2.77Å; L316-D318 VanDerWaalsContact C-N 3.28Å; L316-D318 PolarHBondContact O-N 3.47Å; D318-A321 PolarHBondContact O-N 3.2Å; D318-Q322 WeakPolarHBondContact O-CG 3.45Å; D318-Q322 PolarHBondContact O-N 2.98Å; D318-Q322 PolarHBondContact O-NE2 3.31Å; D318-Q322 PolarHBondContact OD1-NE2 2.94Å; D318-Q322 PolarHBondContact OD2-NE2 2.99Å; D318-L361 HydrophobicContact CB-CD1 4.03Å; D318-L361 VanDerWaalsContact OD1-CA 3.32Å; D318-L361 WeakPolarHBondContact OD1-CA 3.47Å; D318-L361 PolarHBondContact OD1-N 2.85Å; D318-H364 IonicContact OD1-CE1 2.72Å; D318-H364 IonicContact OD1-CG 2.8Å; D318-H364 IonicContact OD1-ND1 3.24Å; D318-H364 PolarHBondContact OD1-ND1 3.32Å; D318-H364 IonicContact OD2-CE1 2.7Å; D318-H364 IonicContact OD2-ND1 2.89Å
319D95.9Very high92.4Very high5 Ų526.1 Ų26.13%0.02715%0.147CC..Hα-helixtrans-66-38.7174.5-67.7-14.9000112.1N259 N269 V272 K315 L316 A321 Q322 C323N259-D319 PolarHBondContact ND2-OD2 3.14Å; N259-D319 PolarHBondContact OD1-OD2 2.98Å; N269-D319 PolarHBondContact ND2-OD2 3.49Å; V272-D319 HydrophobicContact CG2-CB 3.82Å; K315-D319 WeakPolarHBondContact CD-OD2 3.46Å; K315-D319 WeakPolarHBondContact CE-OD2 3.49Å; K315-D319 IonicContact NZ-OD1 2.91Å; K315-D319 PolarHBondContact NZ-OD1 3.42Å; K315-D319 IonicContact NZ-OD2 3.47Å; K315-D319 PolarHBondContact NZ-OD2 3.28Å; K315-D319 PolarHBondContact O-N 3.41Å; L316-D319 PolarHBondContact O-N 3.49Å; D319-A321 VanDerWaalsContact C-N 3.33Å; D319-Q322 PolarHBondContact O-N 3.49Å; D319-C323 WeakPolarHBondContact O-CB 3.28Å; D319-C323 PolarHBondContact O-N 3.02Å
320I95.1Very high93Very high0 Ų022.6 Ų22.60%013%0.129CC..Hα-helixtrans-61.9-44.3174.8-68.2165000109.9V272 L275 M285 L288 L316 L317 Q322 C323 S324 L326 L329V272-I320 HydrophobicContact CG1-CG1 4.29Å; V272-I320 HydrophobicContact CG2-CG1 4.07Å; L275-I320 HydrophobicContact CD2-CD1 3.53Å; L275-I320 HydrophobicContact CD2-CG1 4.14Å; M285-I320 HydrophobicContact CE-CD1 4.28Å; M285-I320 HydrophobicContact SD-CD1 3.97Å; L288-I320 HydrophobicContact CD2-CD1 4.46Å; L316-I320 HydrophobicContact CD1-CD1 4.16Å; L316-I320 HydrophobicContact CD1-CG1 4.35Å; L316-I320 HydrophobicContact CG-CD1 3.95Å; L316-I320 WeakPolarHBondContact O-CD1 3.28Å; L316-I320 WeakPolarHBondContact O-CG1 3.19Å; L316-I320 PolarHBondContact O-N 2.93Å; L317-I320 PolarHBondContact O-N 3.28Å; I320-Q322 VanDerWaalsContact C-N 3.26Å; I320-Q322 PolarHBondContact O-N 2.86Å; I320-C323 PolarHBondContact O-N 3.15Å; I320-S324 CarbonylContact O-C 3.56Å; I320-S324 WeakPolarHBondContact O-CA 3.43Å; I320-S324 WeakPolarHBondContact O-CB 3.47Å; I320-S324 PolarHBondContact O-N 3.18Å; I320-S324 VanDerWaalsContact O-O 3.11Å; I320-L326 HydrophobicContact CB-CD2 4.47Å; I320-L326 HydrophobicContact CG2-CD2 3.64Å; I320-L326 HydrophobicContact CG2-CG 4.47Å; I320-L329 HydrophobicContact CG2-CD1 3.48Å; I320-L329 VanDerWaalsContact CG2-CD1 3.48Å
321A93.6Very high93.3Very high4 Ų427 Ų273%0.03314%0.14CC..Hα-helixtrans-63.5-31.2178.100000113L317 D318 D319 L326 L361 H364 S365 Q368L317-A321 WeakPolarHBondContact O-CB 3.16Å; L317-A321 PolarHBondContact O-N 2.93Å; D318-A321 PolarHBondContact O-N 3.2Å; D319-A321 VanDerWaalsContact C-N 3.33Å; A321-L326 HydrophobicContact CB-CD1 3.86Å; A321-L326 HydrophobicContact CB-CG 4.39Å; A321-L361 HydrophobicContact CB-CD1 4.47Å; A321-H364 HydrophobicContact CB-CB 4.26Å; A321-S365 WeakPolarHBondContact CB-OG 3.3Å; A321-Q368 PolarHBondContact O-NE2 3.33Å
322Q92.3Very high93.2Very high34 Ų3431.9 Ų31.916%0.15916%0.161CC..Hα-helixtrans-82.8-38.6178.9-74.2167.171.600113.2D265 D318 D319 I320 H364D265-Q322 VanDerWaalsContact N-OE1 3.14Å; D265-Q322 PolarHBondContact OD1-OE1 3.25Å; D318-Q322 WeakPolarHBondContact O-CG 3.45Å; D318-Q322 PolarHBondContact O-N 2.98Å; D318-Q322 PolarHBondContact O-NE2 3.31Å; D318-Q322 PolarHBondContact OD1-NE2 2.94Å; D318-Q322 PolarHBondContact OD2-NE2 2.99Å; D319-Q322 PolarHBondContact O-N 3.49Å; I320-Q322 VanDerWaalsContact C-N 3.26Å; I320-Q322 PolarHBondContact O-N 2.86Å; Q322-H364 HydrophobicContact CG-CB 3.99Å; Q322-H364 PolarHBondContact NE2-ND1 3.2Å
323C91.1Very high92.9Very high43 Ų4334.2 Ų34.229%0.29119%0.185SC..Hα-helixtrans-104.5-12.2-169.9-59.90000114.1Y266 V272 D319 I320Y266-C323 PolarHBondContact O-SG 3.39Å; V272-C323 HydrophobicContact CB-CB 4.46Å; V272-C323 HydrophobicContact CG1-CB 3.89Å; D319-C323 WeakPolarHBondContact O-CB 3.28Å; D319-C323 PolarHBondContact O-N 3.02Å; I320-C323 PolarHBondContact O-N 3.15Å
324S89.7Confident92.7Very high25 Ų2535.1 Ų35.118%0.17519%0.19CC..SBendtrans-141.2176.3-176.7-1620000111.8S276 I320 Q368S276-S324 WeakPolarHBondContact OG-CB 3.39Å; S276-S324 PolarHBondContact OG-OG 3.13Å; I320-S324 CarbonylContact O-C 3.56Å; I320-S324 WeakPolarHBondContact O-CA 3.43Å; I320-S324 WeakPolarHBondContact O-CB 3.47Å; I320-S324 PolarHBondContact O-N 3.18Å; I320-S324 VanDerWaalsContact O-O 3.11Å; S324-Q368 PolarHBondContact O-NE2 3.44Å
325N89.1Confident92.6Very high47 Ų4735.3 Ų35.325%0.25119%0.191SC..  trans-101.1104178.7-173.1-4.5000110.5T327 E328 L329 Q368N325-T327 PolarHBondContact ND2-OG1 3.32Å; N325-T327 VanDerWaalsContact ND2-OG1 3.15Å; N325-T327 PolarHBondContact O-N 3.36Å; N325-T327 VanDerWaalsContact O-N 3.14Å; N325-T327 WeakPolarHBondContact OD1-CB 3.26Å; N325-T327 PolarHBondContact OD1-N 3.11Å; N325-T327 PolarHBondContact OD1-OG1 2.98Å; N325-E328 HydrophobicContact CB-CB 4.29Å; N325-E328 HydrophobicContact CB-CG 4.07Å; N325-E328 PolarHBondContact ND2-OE1 2.84Å; N325-E328 WeakPolarHBondContact O-CB 3.5Å; N325-E328 PolarHBondContact O-N 3.38Å; N325-L329 PolarHBondContact O-N 3.34Å; N325-Q368 PolarHBondContact OD1-OE1 3.33Å
326L91.4Very high92.5Very high1 Ų136.7 Ų36.71%0.00520%0.198CC..Hα-helixtrans-52.2-33.6175-71.9171.8000112.4M285 I320 A321 E328 L329 C330 L335 F338 S365M285-L326 HydrophobicContact CE-CD2 4.34Å; I320-L326 HydrophobicContact CB-CD2 4.47Å; I320-L326 HydrophobicContact CG2-CD2 3.64Å; I320-L326 HydrophobicContact CG2-CG 4.47Å; A321-L326 HydrophobicContact CB-CD1 3.86Å; A321-L326 HydrophobicContact CB-CG 4.39Å; L326-E328 PolarHBondContact O-N 3.11Å; L326-L329 PolarHBondContact O-N 3.39Å; L326-L329 VanDerWaalsContact O-N 3.15Å; L326-C330 WeakPolarHBondContact O-CB 3.49Å; L326-C330 PolarHBondContact O-N 3.16Å; L326-L335 HydrophobicContact CB-CD2 4Å; L326-F338 HydrophobicContact CD1-CE1 4.4Å; L326-F338 HydrophobicContact CD1-CZ 4.37Å; L326-S365 WeakPolarHBondContact CD1-OG 3.5Å
327T90.3Very high92.3Very high67 Ų6739.7 Ų39.741%0.41121%0.214SC..Hα-helixtrans-69.7-17.8178.270.10000114.1N325 L335 Q368N325-T327 PolarHBondContact ND2-OG1 3.32Å; N325-T327 VanDerWaalsContact ND2-OG1 3.15Å; N325-T327 PolarHBondContact O-N 3.36Å; N325-T327 VanDerWaalsContact O-N 3.14Å; N325-T327 WeakPolarHBondContact OD1-CB 3.26Å; N325-T327 PolarHBondContact OD1-N 3.11Å; N325-T327 PolarHBondContact OD1-OG1 2.98Å; T327-L335 HydrophobicContact CG2-CD1 4Å; T327-Q368 HydrophobicContact CG2-CB 4.4Å
328E92.2Very high92.3Very high127 Ų12739.8 Ų39.859%0.59321%0.214SC*.Hα-helixtrans-92.6-16.1174-68173.1-151.800112.5N325 L326N325-E328 HydrophobicContact CB-CB 4.29Å; N325-E328 HydrophobicContact CB-CG 4.07Å; N325-E328 PolarHBondContact ND2-OE1 2.84Å; N325-E328 WeakPolarHBondContact O-CB 3.5Å; N325-E328 PolarHBondContact O-N 3.38Å; L326-E328 PolarHBondContact O-N 3.11Å
329L93.4Very high92.3Very high2 Ų238.8 Ų38.81%0.0121%0.208CC..Hα-helixtrans-104.4-18.3-176.4-59.1-179.7000113.4R281 L282 M285 I320 N325 L326R281-L329 HydrophobicContact CB-CD2 4.18Å; R281-L329 HydrophobicContact CG-CD2 3.96Å; L282-L329 VanDerWaalsContact CD2-O 3.31Å; L282-L329 WeakPolarHBondContact CD2-O 3.46Å; M285-L329 VanDerWaalsContact CB-O 3.31Å; M285-L329 WeakPolarHBondContact CB-O 3.27Å; M285-L329 HydrophobicContact CG-CB 3.89Å; M285-L329 VanDerWaalsContact CG-O 3.24Å; M285-L329 WeakPolarHBondContact CG-O 3.3Å; I320-L329 HydrophobicContact CG2-CD1 3.48Å; I320-L329 VanDerWaalsContact CG2-CD1 3.48Å; N325-L329 PolarHBondContact O-N 3.34Å; L326-L329 PolarHBondContact O-N 3.39Å; L326-L329 VanDerWaalsContact O-N 3.15Å
330C92.8Very high92.2Very high8 Ų842.5 Ų42.55%0.05423%0.226CC..SBendtrans-128.1147.1-176.8-68.40000111.3M285 L326 D334 L335M285-C330 VanDerWaalsContact CE-SG 3.51Å; L326-C330 WeakPolarHBondContact O-CB 3.49Å; L326-C330 PolarHBondContact O-N 3.16Å; C330-D334 HydrophobicContact CB-CB 4.08Å; C330-L335 HydrophobicContact CB-CD2 3.59Å; C330-L335 HydrophobicContact CB-CG 3.79Å
331F90.5Very high92.2Very high118 Ų11842.6 Ų42.652%0.51823%0.226SC..  trans-71.7159.3167-64.4-74.2000110.4L282 G333 D334 L335L282-F331 HydrophobicContact CB-CE2 4.33Å; L282-F331 HydrophobicContact CD1-CE1 4.3Å; L282-F331 HydrophobicContact CD1-CE2 4.38Å; L282-F331 HydrophobicContact CD1-CZ 3.83Å; F331-G333 PolarHBondContact O-N 2.87Å; F331-D334 WeakPolarHBondContact CB-OD2 3.22Å; F331-D334 WeakPolarHBondContact CD2-OD2 3.24Å; F331-D334 PolarHBondContact N-OD2 3.41Å; F331-D334 WeakPolarHBondContact O-CB 3.49Å; F331-D334 PolarHBondContact O-N 3.29Å; F331-L335 PolarHBondContact O-N 2.84Å; F331-L335 VanDerWaalsContact O-N 3.09Å
332K89Confident92.3Very high113 Ų11342.4 Ų42.449%0.49123%0.225SC..Hα-helixtrans-54.4-38.5178.7-168.5-173175-156.10112.4L335 Q336 E374K332-L335 PolarHBondContact O-N 3.03Å; K332-Q336 PolarHBondContact O-N 2.96Å; K332-Q336 VanDerWaalsContact O-N 3.12Å; K332-E374 WeakPolarHBondContact CE-OE2 3.45Å; K332-E374 IonicContact NZ-OE2 3.13Å; K332-E374 PolarHBondContact NZ-OE2 2.92Å
333G89.7Confident92.4Very high48 Ų4841 Ų4150%0.49522%0.218SC..Hα-helixtrans-63.8-40.2176.400000113.1F331 Q336 L337F331-G333 PolarHBondContact O-N 2.87Å; G333-Q336 PolarHBondContact O-N 3.42Å; G333-L337 PolarHBondContact O-N 3.29Å
334D91.7Very high92.5Very high30 Ų3043.5 Ų43.516%0.1622%0.222CC..Hα-helixtrans-67.2-38.9178-54.1-40.9000111.3C330 F331 Q336 L337 F338C330-D334 HydrophobicContact CB-CB 4.08Å; F331-D334 WeakPolarHBondContact CB-OD2 3.22Å; F331-D334 WeakPolarHBondContact CD2-OD2 3.24Å; F331-D334 PolarHBondContact N-OD2 3.41Å; F331-D334 WeakPolarHBondContact O-CB 3.49Å; F331-D334 PolarHBondContact O-N 3.29Å; D334-Q336 VanDerWaalsContact C-N 3.32Å; D334-Q336 PolarHBondContact O-N 2.95Å; D334-L337 PolarHBondContact O-N 3.36Å; D334-F338 VanDerWaalsContact O-CB 3.25Å; D334-F338 WeakPolarHBondContact O-CB 3.21Å; D334-F338 PolarHBondContact O-N 3.01Å
335L93.8Very high92.6Very high8 Ų842.3 Ų42.34%0.04221%0.214CC..Hα-helixtrans-65.7-35.2176-66.2178000112.6L326 T327 C330 F331 K332 S339 L369 I375L326-L335 HydrophobicContact CB-CD2 4Å; T327-L335 HydrophobicContact CG2-CD1 4Å; C330-L335 HydrophobicContact CB-CD2 3.59Å; C330-L335 HydrophobicContact CB-CG 3.79Å; F331-L335 PolarHBondContact O-N 2.84Å; F331-L335 VanDerWaalsContact O-N 3.09Å; K332-L335 PolarHBondContact O-N 3.03Å; L335-S339 WeakPolarHBondContact O-CB 3.4Å; L335-S339 PolarHBondContact O-N 2.89Å; L335-S339 PolarHBondContact O-OG 3.09Å; L335-L369 HydrophobicContact CB-CD2 4.09Å; L335-L369 HydrophobicContact CD1-CD2 4.29Å; L335-L369 HydrophobicContact CD2-CD2 4.04Å; L335-L369 HydrophobicContact CG-CD2 4.38Å; L335-I375 HydrophobicContact CB-CD1 4.11Å
336Q92.6Very high92.6Very high70 Ų7040.1 Ų40.133%0.32720%0.202SC..Hα-helixtrans-66-49.3173.6-172.7-179.2-20.400110.4K332 G333 D334 F338 S339 E340 I375K332-Q336 PolarHBondContact O-N 2.96Å; K332-Q336 VanDerWaalsContact O-N 3.12Å; G333-Q336 PolarHBondContact O-N 3.42Å; D334-Q336 VanDerWaalsContact C-N 3.32Å; D334-Q336 PolarHBondContact O-N 2.95Å; Q336-F338 VanDerWaalsContact C-N 3.33Å; Q336-F338 PolarHBondContact O-N 2.69Å; Q336-S339 PolarHBondContact O-N 3.24Å; Q336-E340 WeakPolarHBondContact CG-OE1 3.39Å; Q336-E340 PolarHBondContact NE2-OE1 2.92Å; Q336-E340 WeakPolarHBondContact O-CG 3.34Å; Q336-E340 PolarHBondContact O-N 2.94Å; Q336-I375 HydrophobicContact CB-CD1 4.45Å; Q336-I375 HydrophobicContact CB-CG1 4.4Å; Q336-I375 HydrophobicContact CG-CG1 4.48Å
337L93.3Very high92.5Very high63 Ų6342.8 Ų42.833%0.3322%0.218SC..Hα-helixtrans-58.2-44.5175.8176.462.2000111.8G333 D334 S339 E340 I341G333-L337 PolarHBondContact O-N 3.29Å; D334-L337 PolarHBondContact O-N 3.36Å; L337-S339 VanDerWaalsContact C-N 3.32Å; L337-S339 PolarHBondContact O-N 3.11Å; L337-E340 PolarHBondContact O-N 3.01Å; L337-I341 HydrophobicContact CD1-CD1 3.98Å; L337-I341 HydrophobicContact CD1-CG1 4.15Å; L337-I341 HydrophobicContact CD2-CD1 4.49Å; L337-I341 HydrophobicContact CG-CD1 3.79Å; L337-I341 HydrophobicContact CG-CG1 4.41Å; L337-I341 WeakPolarHBondContact O-CD1 3.15Å; L337-I341 VanDerWaalsContact O-CG1 3.23Å; L337-I341 WeakPolarHBondContact O-CG1 3.43Å; L337-I341 PolarHBondContact O-N 3.36Å
338F95.5Very high92.3Very high1 Ų144.5 Ų44.50%0.00423%0.225CC..Hα-helixtrans-54.3-47.7175169.2-97.9000111.8M289 F292 L317 L326 D334 Q336 I341 I342 L361 L369M289-F338 HydrophobicContact CE-CB 4.28Å; M289-F338 HydrophobicContact CE-CD2 3.68Å; M289-F338 HydrophobicContact CE-CE2 4.36Å; M289-F338 HydrophobicContact CE-CG 4.3Å; M289-F338 HydrophobicContact SD-CB 4.07Å; M289-F338 HydrophobicContact SD-CD2 3.93Å; M289-F338 HydrophobicContact SD-CG 4.49Å; F292-F338 HydrophobicContact CD1-CD2 4.24Å; F292-F338 AromaticContact CE1-CD2 3.74Å; F292-F338 HydrophobicContact CE1-CD2 3.74Å; F292-F338 HydrophobicContact CE1-CE2 4.21Å; F292-F338 HydrophobicContact CZ-CD2 4.39Å; F292-F338 HydrophobicContact CZ-CE2 4.43Å; L317-F338 HydrophobicContact CB-CE2 4.42Å; L317-F338 HydrophobicContact CD1-CE2 4.18Å; L317-F338 HydrophobicContact CD2-CE2 4.5Å; L326-F338 HydrophobicContact CD1-CE1 4.4Å; L326-F338 HydrophobicContact CD1-CZ 4.37Å; D334-F338 VanDerWaalsContact O-CB 3.25Å; D334-F338 WeakPolarHBondContact O-CB 3.21Å; D334-F338 PolarHBondContact O-N 3.01Å; Q336-F338 VanDerWaalsContact C-N 3.33Å; Q336-F338 PolarHBondContact O-N 2.69Å; F338-I341 PolarHBondContact O-N 3.35Å; F338-I342 HydrophobicContact CD1-CD1 3.81Å; F338-I342 HydrophobicContact CD2-CD1 4.14Å; F338-I342 HydrophobicContact CE1-CD1 3.34Å; F338-I342 HydrophobicContact CE2-CD1 3.74Å; F338-I342 HydrophobicContact CG-CD1 4.2Å; F338-I342 HydrophobicContact CZ-CD1 3.33Å; F338-I342 WeakPolarHBondContact O-CG1 3.27Å; F338-I342 PolarHBondContact O-N 3.48Å; F338-L361 HydrophobicContact CE2-CD1 4.15Å; F338-L361 HydrophobicContact CE2-CD2 3.84Å; F338-L361 HydrophobicContact CE2-CG 4.14Å; F338-L361 HydrophobicContact CZ-CD1 3.77Å; F338-L361 HydrophobicContact CZ-CD2 3.98Å; F338-L361 HydrophobicContact CZ-CG 3.76Å; F338-L369 HydrophobicContact CD1-CD1 4.34Å; F338-L369 HydrophobicContact CE1-CD1 4.15Å
339S95.2Very high92Very high0 Ų040.1 Ų40.10%021%0.205CC..Hα-helixtrans-67-40.3179.3-55.20000111.9L335 Q336 L337 I342 C343 I375L335-S339 WeakPolarHBondContact O-CB 3.4Å; L335-S339 PolarHBondContact O-N 2.89Å; L335-S339 PolarHBondContact O-OG 3.09Å; Q336-S339 PolarHBondContact O-N 3.24Å; L337-S339 VanDerWaalsContact C-N 3.32Å; L337-S339 PolarHBondContact O-N 3.11Å; S339-I342 PolarHBondContact O-N 2.96Å; S339-C343 WeakPolarHBondContact O-CB 3.38Å; S339-C343 PolarHBondContact O-N 2.87Å; S339-C343 PolarHBondContact O-SG 2.87Å; S339-C343 VanDerWaalsContact O-SG 3.39Å; S339-I375 VanDerWaalsContact OG-CG2 3.25Å; S339-I375 WeakPolarHBondContact OG-CG2 3.32Å
340E94.9Very high91.6Very high84 Ų8447.7 Ų47.739%0.39324%0.24SC..Hα-helixtrans-61.5-43.8174.6-73.1174.8-167.900112Q336 L337 R344 L378Q336-E340 WeakPolarHBondContact CG-OE1 3.39Å; Q336-E340 PolarHBondContact NE2-OE1 2.92Å; Q336-E340 WeakPolarHBondContact O-CG 3.34Å; Q336-E340 PolarHBondContact O-N 2.94Å; L337-E340 PolarHBondContact O-N 3.01Å; E340-R344 WeakPolarHBondContact O-CB 3.14Å; E340-R344 PolarHBondContact O-N 3.21Å; E340-L378 HydrophobicContact CB-CD2 4.27Å; E340-L378 HydrophobicContact CG-CD2 3.46Å; E340-L378 VanDerWaalsContact CG-CD2 3.46Å
341I95.4Very high91.1Very high1 Ų150.1 Ų50.11%0.00526%0.256CS..Hα-helixtrans-60.3-54.5175.7-66.8160.1000109.3F292 N293 L337 F338 C343 R344 E345F292-I341 HydrophobicContact CD1-CB 4.18Å; F292-I341 HydrophobicContact CD1-CD1 3.74Å; F292-I341 HydrophobicContact CD1-CG2 3.79Å; F292-I341 HydrophobicContact CE1-CB 3.75Å; F292-I341 HydrophobicContact CE1-CD1 4.16Å; F292-I341 HydrophobicContact CE1-CG2 3.42Å; F292-I341 VanDerWaalsContact CE1-CG2 3.42Å; F292-I341 HydrophobicContact CG-CG2 4.49Å; F292-I341 HydrophobicContact CZ-CG2 3.86Å; N293-I341 HydrophobicContact CB-CD1 3.57Å; N293-I341 HydrophobicContact CB-CG1 4.31Å; L337-I341 HydrophobicContact CD1-CD1 3.98Å; L337-I341 HydrophobicContact CD1-CG1 4.15Å; L337-I341 HydrophobicContact CD2-CD1 4.49Å; L337-I341 HydrophobicContact CG-CD1 3.79Å; L337-I341 HydrophobicContact CG-CG1 4.41Å; L337-I341 WeakPolarHBondContact O-CD1 3.15Å; L337-I341 VanDerWaalsContact O-CG1 3.23Å; L337-I341 WeakPolarHBondContact O-CG1 3.43Å; L337-I341 PolarHBondContact O-N 3.36Å; F338-I341 PolarHBondContact O-N 3.35Å; I341-C343 VanDerWaalsContact C-N 3.34Å; I341-C343 PolarHBondContact O-N 3.43Å; I341-R344 WeakPolarHBondContact O-CB 3.41Å; I341-R344 PolarHBondContact O-N 3.36Å; I341-R344 VanDerWaalsContact O-N 3.15Å; I341-E345 HydrophobicContact CG2-CG 4.08Å; I341-E345 VanDerWaalsContact O-CG 3.29Å; I341-E345 WeakPolarHBondContact O-CG 3.31Å; I341-E345 PolarHBondContact O-N 3.26Å
342I95.2Very high90.9Very high0 Ų046.3 Ų46.30%025%0.25CC..Hα-helixtrans-59-46.3-177.5-62.9164.7000111.5F292 F338 S339 R344 E345 V346 Y358 L361 L362F292-I342 HydrophobicContact CE1-CG1 4.1Å; F292-I342 HydrophobicContact CZ-CD1 4.43Å; F292-I342 HydrophobicContact CZ-CG1 3.7Å; F338-I342 HydrophobicContact CD1-CD1 3.81Å; F338-I342 HydrophobicContact CD2-CD1 4.14Å; F338-I342 HydrophobicContact CE1-CD1 3.34Å; F338-I342 HydrophobicContact CE2-CD1 3.74Å; F338-I342 HydrophobicContact CG-CD1 4.2Å; F338-I342 HydrophobicContact CZ-CD1 3.33Å; F338-I342 WeakPolarHBondContact O-CG1 3.27Å; F338-I342 PolarHBondContact O-N 3.48Å; S339-I342 PolarHBondContact O-N 2.96Å; I342-R344 VanDerWaalsContact C-N 3.32Å; I342-R344 PolarHBondContact O-N 3.31Å; I342-E345 PolarHBondContact O-N 2.87Å; I342-V346 HydrophobicContact CG2-CG2 4.07Å; I342-V346 WeakPolarHBondContact O-CB 3.3Å; I342-V346 VanDerWaalsContact O-CG2 3.31Å; I342-V346 WeakPolarHBondContact O-CG2 3.36Å; I342-V346 PolarHBondContact O-N 3.29Å; I342-Y358 HydrophobicContact CG1-CD1 4.18Å; I342-Y358 HydrophobicContact CG2-CD1 4.31Å; I342-L361 HydrophobicContact CD1-CD2 3.82Å; I342-L361 HydrophobicContact CD1-CG 3.86Å; I342-L361 HydrophobicContact CG1-CD2 4.17Å; I342-L362 HydrophobicContact CD1-CD1 4.44Å; I342-L362 HydrophobicContact CG2-CB 3.93Å; I342-L362 HydrophobicContact CG2-CD2 4.22Å; I342-L362 HydrophobicContact CG2-CG 4.47Å
343C93.9Very high90.8Very high4 Ų447.3 Ų47.33%0.02726%0.256CS..Hα-helixtrans-58.2-43.8178.1-79.10000112S339 I341 T347 T382S339-C343 WeakPolarHBondContact O-CB 3.38Å; S339-C343 PolarHBondContact O-N 2.87Å; S339-C343 PolarHBondContact O-SG 2.87Å; S339-C343 VanDerWaalsContact O-SG 3.39Å; I341-C343 VanDerWaalsContact C-N 3.34Å; I341-C343 PolarHBondContact O-N 3.43Å; C343-T347 WeakPolarHBondContact O-CG2 3.28Å; C343-T347 PolarHBondContact O-N 3.11Å; C343-T347 PolarHBondContact O-OG1 3.18Å; C343-T382 HydrophobicContact CB-CG2 3.87Å
344R92.9Very high90.8Very high97 Ų9748.2 Ų48.237%0.36625%0.245SC..Hα-helixtrans-62.2-48.3175179.4-178.667.8-158.30.7111.7N293 E340 I341 I342 V346 T347 D348N293-R344 PolarHBondContact OD1-NH2 3.42Å; E340-R344 WeakPolarHBondContact O-CB 3.14Å; E340-R344 PolarHBondContact O-N 3.21Å; I341-R344 WeakPolarHBondContact O-CB 3.41Å; I341-R344 PolarHBondContact O-N 3.36Å; I341-R344 VanDerWaalsContact O-N 3.15Å; I342-R344 VanDerWaalsContact C-N 3.32Å; I342-R344 PolarHBondContact O-N 3.31Å; R344-V346 VanDerWaalsContact C-N 3.35Å; R344-V346 PolarHBondContact O-N 3.16Å; R344-T347 PolarHBondContact O-N 3.2Å; R344-T347 PolarHBondContact O-OG1 3.45Å; R344-D348 WeakPolarHBondContact CG-OD2 3.45Å; R344-D348 WeakPolarHBondContact O-CB 3.27Å; R344-D348 PolarHBondContact O-N 2.69Å
345E91.4Very high90.8Very high0 Ų046.8 Ų46.80%024%0.237CC..Hα-helixtrans-62.4-41.9-178.9-63.8-54.5129.700112R295 I341 I342 T347 D348 I349 Y358R295-E345 VanDerWaalsContact CZ-CD 3.44Å; R295-E345 IonicContact CZ-OE1 3.16Å; R295-E345 IonicContact CZ-OE2 2.79Å; R295-E345 IonicContact NE-OE1 2.58Å; R295-E345 PolarHBondContact NE-OE1 3.01Å; R295-E345 IonicContact NE-OE2 2.65Å; R295-E345 PolarHBondContact NE-OE2 3.13Å; R295-E345 IonicContact NH1-OE2 3.72Å; R295-E345 IonicContact NH2-OE1 3.63Å; R295-E345 PolarHBondContact NH2-OE1 2.7Å; R295-E345 IonicContact NH2-OE2 3.03Å; R295-E345 PolarHBondContact NH2-OE2 3.33Å; I341-E345 HydrophobicContact CG2-CG 4.08Å; I341-E345 VanDerWaalsContact O-CG 3.29Å; I341-E345 WeakPolarHBondContact O-CG 3.31Å; I341-E345 PolarHBondContact O-N 3.26Å; I342-E345 PolarHBondContact O-N 2.87Å; E345-T347 VanDerWaalsContact C-N 3.32Å; E345-T347 PolarHBondContact O-N 2.94Å; E345-D348 PolarHBondContact O-N 3.38Å; E345-I349 HydrophobicContact CB-CD1 4.11Å; E345-I349 VanDerWaalsContact O-CB 3.32Å; E345-I349 WeakPolarHBondContact O-CB 3.27Å; E345-I349 WeakPolarHBondContact O-CD1 3.37Å; E345-I349 WeakPolarHBondContact O-CG1 3.3Å; E345-I349 PolarHBondContact O-N 2.92Å; E345-I349 VanDerWaalsContact O-N 3.15Å; E345-I349 WeakPolarHBondContact OE2-CD1 3.11Å; E345-Y358 HydrophobicContact CB-CD1 3.93Å; E345-Y358 HydrophobicContact CB-CD2 4.05Å; E345-Y358 HydrophobicContact CB-CE1 3.89Å; E345-Y358 HydrophobicContact CB-CE2 4.06Å; E345-Y358 HydrophobicContact CB-CG 4.01Å; E345-Y358 HydrophobicContact CG-CD1 4.15Å; E345-Y358 HydrophobicContact CG-CE1 3.62Å; E345-Y358 HydrophobicContact CG-CE2 4.19Å
346V90.2Very high90.7Very high0 Ų047.3 Ų47.30%024%0.241CC..Hα-helixtrans-65.1-36.2179.2170.20000111.7I342 R344 L359 F383 F386I342-V346 HydrophobicContact CG2-CG2 4.07Å; I342-V346 WeakPolarHBondContact O-CB 3.3Å; I342-V346 VanDerWaalsContact O-CG2 3.31Å; I342-V346 WeakPolarHBondContact O-CG2 3.36Å; I342-V346 PolarHBondContact O-N 3.29Å; R344-V346 VanDerWaalsContact C-N 3.35Å; R344-V346 PolarHBondContact O-N 3.16Å; V346-L359 HydrophobicContact CG1-CD2 3.74Å; V346-L359 HydrophobicContact CG1-CG 4.31Å; V346-L359 HydrophobicContact CG2-CD2 3.97Å; V346-L359 HydrophobicContact CG2-CG 4.15Å; V346-F383 HydrophobicContact CG1-CE1 4.37Å; V346-F383 HydrophobicContact CG1-CZ 4.22Å; V346-F386 HydrophobicContact CG1-CD2 4.06Å; V346-F386 HydrophobicContact CG1-CE2 3.68Å; V346-F386 HydrophobicContact CG1-CZ 4.05Å; V346-F386 WeakPolarHBondContact O-CE2 3.43Å
347T88Confident90.7Very high57 Ų5745.1 Ų45.135%0.3523%0.234SC..Hα-helixtrans-77.5-34178.8530000113.6C343 R344 E345 T382C343-T347 WeakPolarHBondContact O-CG2 3.28Å; C343-T347 PolarHBondContact O-N 3.11Å; C343-T347 PolarHBondContact O-OG1 3.18Å; R344-T347 PolarHBondContact O-N 3.2Å; R344-T347 PolarHBondContact O-OG1 3.45Å; E345-T347 VanDerWaalsContact C-N 3.32Å; E345-T347 PolarHBondContact O-N 2.94Å; T347-T382 HydrophobicContact CG2-CG2 3.6Å
348D87.5Confident90.8Very high104 Ų10442.2 Ų42.256%0.55622%0.219SC*.Hα-helixtrans-85.5-23.7-172.2-67.1-4000112.9R344 E345R344-D348 WeakPolarHBondContact CG-OD2 3.45Å; R344-D348 WeakPolarHBondContact O-CB 3.27Å; R344-D348 PolarHBondContact O-N 2.69Å; E345-D348 PolarHBondContact O-N 3.38Å
349I86.2Confident90.8Very high34 Ų3442.1 Ų42.117%0.17422%0.219CC..SBendtrans-98139.5-172-58.3171.6000111.8E345 R354 R355 Y358E345-I349 HydrophobicContact CB-CD1 4.11Å; E345-I349 VanDerWaalsContact O-CB 3.32Å; E345-I349 WeakPolarHBondContact O-CB 3.27Å; E345-I349 WeakPolarHBondContact O-CD1 3.37Å; E345-I349 WeakPolarHBondContact O-CG1 3.3Å; E345-I349 PolarHBondContact O-N 2.92Å; E345-I349 VanDerWaalsContact O-N 3.15Å; E345-I349 WeakPolarHBondContact OE2-CD1 3.11Å; I349-R354 HydrophobicContact CD1-CG 3.91Å; I349-R355 HydrophobicContact CG2-CB 4.46Å; I349-R355 WeakPolarHBondContact O-CD 3.47Å; I349-Y358 HydrophobicContact CD1-CE2 4.42Å
350E83.6Confident90.7Very high162 Ų16245.5 Ų45.576%0.75723%0.233SC*.PPolyproline II helixtrans-62.8157.7173.3-69.8-171.1172.800112.9G352E350-G352 PolarHBondContact O-N 3.34Å
351P82.6Confident90.7Very high59 Ų5941.5 Ų41.538%0.38321%0.214SC..SBendtrans-51.7124.4172-20.227.2000113.4R355P351-R355 VanDerWaalsContact CA-NH2 3.33Å; P351-R355 VanDerWaalsContact CG-NH2 3.34Å
352G85.5Confident90.7Very high37 Ų3741.4 Ų41.438%0.38121%0.214SC..SBendtrans169.8-178.9178.200000112.7E350 R354 R355 T356E350-G352 PolarHBondContact O-N 3.34Å; G352-R354 VanDerWaalsContact C-N 3.27Å; G352-R354 PolarHBondContact O-N 3.33Å; G352-R355 PolarHBondContact O-N 3.32Å; G352-T356 PolarHBondContact O-N 3.41Å; G352-T356 PolarHBondContact O-OG1 3.09Å
353E87.5Confident90.6Very high135 Ų13541.8 Ų41.863%0.63122%0.217SC*.Hα-helixtrans-51.6-43.9-175.2-174.4-176173.900112.9L311 R355 T356 A357L311-E353 HydrophobicContact CD1-CG 4.33Å; E353-R355 PolarHBondContact O-N 3.16Å; E353-T356 PolarHBondContact O-N 3.26Å; E353-A357 PolarHBondContact O-N 3.33Å
354R90.5Very high90.6Very high67 Ų6744.7 Ų44.725%0.25323%0.23SC..Hα-helixtrans-59.4-49.3178.2179.5163.6-164.599.85.2111.8G310 L311 I349 G352 T356 A357 Y358G310-R354 PolarHBondContact O-NH1 3.38Å; L311-R354 HydrophobicContact CD2-CB 4.24Å; L311-R354 HydrophobicContact CD2-CG 3.85Å; I349-R354 HydrophobicContact CD1-CG 3.91Å; G352-R354 VanDerWaalsContact C-N 3.27Å; G352-R354 PolarHBondContact O-N 3.33Å; R354-T356 VanDerWaalsContact C-N 3.32Å; R354-T356 PolarHBondContact O-N 2.87Å; R354-A357 WeakPolarHBondContact O-CB 3.43Å; R354-A357 PolarHBondContact O-N 2.92Å; R354-Y358 HydrophobicContact CG-CD2 4.02Å; R354-Y358 HydrophobicContact CG-CE2 3.78Å; R354-Y358 PolarHBondContact NH2-OH 3.02Å; R354-Y358 VanDerWaalsContact NH2-OH 3.12Å; R354-Y358 WeakPolarHBondContact O-CD2 3.08Å; R354-Y358 PolarHBondContact O-N 3.18Å
355R90.9Very high90.6Very high0 Ų040.1 Ų40.10%021%0.213CC..Hα-helixtrans-63.7-41.8179.8-170.2176.173-176.24.9111.1I349 P351 G352 E353 A357 Y358 L359 D397I349-R355 HydrophobicContact CG2-CB 4.46Å; I349-R355 WeakPolarHBondContact O-CD 3.47Å; P351-R355 VanDerWaalsContact CA-NH2 3.33Å; P351-R355 VanDerWaalsContact CG-NH2 3.34Å; G352-R355 PolarHBondContact O-N 3.32Å; E353-R355 PolarHBondContact O-N 3.16Å; R355-A357 VanDerWaalsContact C-N 3.3Å; R355-A357 PolarHBondContact O-N 3.12Å; R355-Y358 PolarHBondContact O-N 3.45Å; R355-L359 HydrophobicContact CG-CD1 4.31Å; R355-L359 WeakPolarHBondContact O-CG 3.46Å; R355-L359 PolarHBondContact O-N 2.85Å; R355-D397 IonicContact CZ-OD2 3.47Å; R355-D397 VanDerWaalsContact CZ-OD2 3.24Å; R355-D397 IonicContact NE-OD2 3.34Å; R355-D397 PolarHBondContact NE-OD2 2.94Å; R355-D397 IonicContact NH2-OD2 3.97Å; R355-D397 PolarHBondContact NH2-OD2 3.32Å
356T91.9Very high90.7Very high19 Ų1940.1 Ų40.112%0.11721%0.213CC..Hα-helixtrans-59.3-40.7175.5-53.30000111.5G352 E353 R354 L359 K360 E396 D397 L400G352-T356 PolarHBondContact O-N 3.41Å; G352-T356 PolarHBondContact O-OG1 3.09Å; E353-T356 PolarHBondContact O-N 3.26Å; R354-T356 VanDerWaalsContact C-N 3.32Å; R354-T356 PolarHBondContact O-N 2.87Å; T356-L359 PolarHBondContact O-N 3.18Å; T356-K360 HydrophobicContact CG2-CD 4.48Å; T356-K360 WeakPolarHBondContact O-CG 3.44Å; T356-K360 PolarHBondContact O-N 3.48Å; T356-E396 HydrophobicContact CG2-CG 4.16Å; T356-D397 WeakPolarHBondContact CA-OD1 3.39Å; T356-D397 WeakPolarHBondContact CB-OD1 3.48Å; T356-D397 PolarHBondContact OG1-OD1 2.7Å; T356-L400 HydrophobicContact CG2-CD1 4.09Å
357A93.7Very high90.5Very high23 Ų2346.1 Ų46.119%0.1924%0.239CC..Hα-helixtrans-62.7-44.1176.800000112.8L311 V314 E353 R354 R355 L359 K360 L361L311-A357 HydrophobicContact CD1-CB 4.03Å; V314-A357 HydrophobicContact CG1-CB 4.11Å; E353-A357 PolarHBondContact O-N 3.33Å; R354-A357 WeakPolarHBondContact O-CB 3.43Å; R354-A357 PolarHBondContact O-N 2.92Å; R355-A357 VanDerWaalsContact C-N 3.3Å; R355-A357 PolarHBondContact O-N 3.12Å; A357-L359 VanDerWaalsContact C-N 3.35Å; A357-L359 PolarHBondContact O-N 3.13Å; A357-K360 PolarHBondContact O-N 2.67Å; A357-L361 WeakPolarHBondContact O-CB 3.42Å; A357-L361 PolarHBondContact O-N 3.35Å
358Y95Very high90.7Very high2 Ų245.1 Ų45.11%0.00823%0.231CC..Hα-helixtrans-64.8-37.6174.8-79.6-79000112.6F292 V314 I342 E345 I349 R354 R355 L361 L362F292-Y358 HydrophobicContact CE2-CD1 4.24Å; F292-Y358 AromaticContact CE2-CE1 3.41Å; F292-Y358 HydrophobicContact CE2-CE1 3.41Å; F292-Y358 VanDerWaalsContact CE2-CE1 3.41Å; F292-Y358 HydrophobicContact CZ-CD1 4.14Å; F292-Y358 AromaticContact CZ-CE1 3.6Å; F292-Y358 HydrophobicContact CZ-CE1 3.6Å; V314-Y358 HydrophobicContact CG2-CE1 4.23Å; V314-Y358 HydrophobicContact CG2-CE2 4.28Å; I342-Y358 HydrophobicContact CG1-CD1 4.18Å; I342-Y358 HydrophobicContact CG2-CD1 4.31Å; E345-Y358 HydrophobicContact CB-CD1 3.93Å; E345-Y358 HydrophobicContact CB-CD2 4.05Å; E345-Y358 HydrophobicContact CB-CE1 3.89Å; E345-Y358 HydrophobicContact CB-CE2 4.06Å; E345-Y358 HydrophobicContact CB-CG 4.01Å; E345-Y358 HydrophobicContact CG-CD1 4.15Å; E345-Y358 HydrophobicContact CG-CE1 3.62Å; E345-Y358 HydrophobicContact CG-CE2 4.19Å; I349-Y358 HydrophobicContact CD1-CE2 4.42Å; R354-Y358 HydrophobicContact CG-CD2 4.02Å; R354-Y358 HydrophobicContact CG-CE2 3.78Å; R354-Y358 PolarHBondContact NH2-OH 3.02Å; R354-Y358 VanDerWaalsContact NH2-OH 3.12Å; R354-Y358 WeakPolarHBondContact O-CD2 3.08Å; R354-Y358 PolarHBondContact O-N 3.18Å; R355-Y358 PolarHBondContact O-N 3.45Å; Y358-L361 PolarHBondContact O-N 3.1Å; Y358-L362 PolarHBondContact O-N 3.45Å
359L94Very high90.7Very high0 Ų040.2 Ų40.20%020%0.204CC..Hα-helixtrans-65.4-41.3175-74.2173.2000112.1V346 R355 T356 A357 L362 A363 F383 D397 L400 V401 I404V346-L359 HydrophobicContact CG1-CD2 3.74Å; V346-L359 HydrophobicContact CG1-CG 4.31Å; V346-L359 HydrophobicContact CG2-CD2 3.97Å; V346-L359 HydrophobicContact CG2-CG 4.15Å; R355-L359 HydrophobicContact CG-CD1 4.31Å; R355-L359 WeakPolarHBondContact O-CG 3.46Å; R355-L359 PolarHBondContact O-N 2.85Å; T356-L359 PolarHBondContact O-N 3.18Å; A357-L359 VanDerWaalsContact C-N 3.35Å; A357-L359 PolarHBondContact O-N 3.13Å; L359-L362 PolarHBondContact O-N 2.92Å; L359-A363 VanDerWaalsContact O-CB 3.32Å; L359-A363 WeakPolarHBondContact O-CB 3.48Å; L359-A363 PolarHBondContact O-N 3.29Å; L359-F383 HydrophobicContact CD2-CE1 3.84Å; L359-F383 HydrophobicContact CD2-CZ 3.74Å; L359-D397 HydrophobicContact CD1-CB 3.88Å; L359-L400 HydrophobicContact CB-CB 4.11Å; L359-L400 HydrophobicContact CB-CD1 3.82Å; L359-V401 HydrophobicContact CD1-CG2 4.28Å; L359-V401 HydrophobicContact CD2-CG2 4.03Å; L359-I404 HydrophobicContact CD2-CD1 4.08Å
360K94.1Very high90.6Very high70 Ų7042.4 Ų42.430%0.30421%0.213SC..Hα-helixtrans-60.6-50.1173.9-76.2178177.5174.50111.3T356 A357 L362 A363 H364 E396 L400T356-K360 HydrophobicContact CG2-CD 4.48Å; T356-K360 WeakPolarHBondContact O-CG 3.44Å; T356-K360 PolarHBondContact O-N 3.48Å; A357-K360 PolarHBondContact O-N 2.67Å; K360-L362 VanDerWaalsContact C-N 3.28Å; K360-L362 PolarHBondContact O-N 3.43Å; K360-A363 PolarHBondContact O-N 3.32Å; K360-H364 PolarHBondContact O-N 2.86Å; K360-H364 PolarHBondContact O-ND1 2.83Å; K360-E396 WeakPolarHBondContact CE-OE1 3.46Å; K360-E396 IonicContact NZ-OE1 3.12Å; K360-E396 PolarHBondContact NZ-OE1 2.81Å; K360-L400 HydrophobicContact CG-CD1 3.74Å; K360-L400 HydrophobicContact CG-CD2 4.11Å
361L95.7Very high90.5Very high0 Ų040.9 Ų40.90%021%0.21CC..Hα-helixtrans-53.2-46.8176.5176.759.9000111.7F292 V314 L317 D318 A321 F338 I342 A357 Y358 S365F292-L361 HydrophobicContact CE2-CD2 4.12Å; F292-L361 HydrophobicContact CZ-CD2 3.93Å; V314-L361 HydrophobicContact CG1-CB 4.49Å; V314-L361 HydrophobicContact CG1-CD2 4.01Å; L317-L361 VanDerWaalsContact C-CD1 3.49Å; L317-L361 HydrophobicContact CB-CD1 3.83Å; L317-L361 HydrophobicContact CB-CD2 4.15Å; D318-L361 HydrophobicContact CB-CD1 4.03Å; D318-L361 VanDerWaalsContact OD1-CA 3.32Å; D318-L361 WeakPolarHBondContact OD1-CA 3.47Å; D318-L361 PolarHBondContact OD1-N 2.85Å; A321-L361 HydrophobicContact CB-CD1 4.47Å; F338-L361 HydrophobicContact CE2-CD1 4.15Å; F338-L361 HydrophobicContact CE2-CD2 3.84Å; F338-L361 HydrophobicContact CE2-CG 4.14Å; F338-L361 HydrophobicContact CZ-CD1 3.77Å; F338-L361 HydrophobicContact CZ-CD2 3.98Å; F338-L361 HydrophobicContact CZ-CG 3.76Å; I342-L361 HydrophobicContact CD1-CD2 3.82Å; I342-L361 HydrophobicContact CD1-CG 3.86Å; I342-L361 HydrophobicContact CG1-CD2 4.17Å; A357-L361 WeakPolarHBondContact O-CB 3.42Å; A357-L361 PolarHBondContact O-N 3.35Å; Y358-L361 PolarHBondContact O-N 3.1Å; L361-S365 VanDerWaalsContact O-CB 3.25Å; L361-S365 WeakPolarHBondContact O-CB 3.29Å; L361-S365 PolarHBondContact O-N 3.25Å; L361-S365 PolarHBondContact O-OG 3.32Å
362L95.3Very high90.7Very high0 Ų039 Ų390%020%0.197CC..Hα-helixtrans-66.1-43.5177.2-169.856.9000112.3I342 Y358 L359 K360 H364 S365 I366 L369 I379 F383 I404I342-L362 HydrophobicContact CD1-CD1 4.44Å; I342-L362 HydrophobicContact CG2-CB 3.93Å; I342-L362 HydrophobicContact CG2-CD2 4.22Å; I342-L362 HydrophobicContact CG2-CG 4.47Å; Y358-L362 PolarHBondContact O-N 3.45Å; L359-L362 PolarHBondContact O-N 2.92Å; K360-L362 VanDerWaalsContact C-N 3.28Å; K360-L362 PolarHBondContact O-N 3.43Å; L362-H364 VanDerWaalsContact C-N 3.34Å; L362-H364 PolarHBondContact O-N 3.25Å; L362-S365 PolarHBondContact O-N 2.88Å; L362-I366 WeakPolarHBondContact O-CB 3.32Å; L362-I366 PolarHBondContact O-N 3.02Å; L362-L369 HydrophobicContact CD1-CD1 4.47Å; L362-I379 HydrophobicContact CD1-CD1 3.88Å; L362-I379 HydrophobicContact CD2-CG2 4.35Å; L362-F383 HydrophobicContact CD2-CE2 3.54Å; L362-F383 HydrophobicContact CD2-CZ 3.93Å; L362-I404 HydrophobicContact CB-CD1 4.16Å; L362-I404 HydrophobicContact CD2-CD1 4.14Å; L362-I404 HydrophobicContact CD2-CG2 4.2Å; L362-I404 HydrophobicContact CG-CD1 4.22Å; L362-I404 HydrophobicContact CG-CG2 4.46Å
363A93.2Very high90.7Very high8 Ų841.1 Ų41.17%0.06620%0.204CC..Hα-helixtrans-61.8-39.9-18000000112.3L359 K360 I366 L400 I404L359-A363 VanDerWaalsContact O-CB 3.32Å; L359-A363 WeakPolarHBondContact O-CB 3.48Å; L359-A363 PolarHBondContact O-N 3.29Å; K360-A363 PolarHBondContact O-N 3.32Å; A363-I366 WeakPolarHBondContact O-CG2 3.48Å; A363-L400 HydrophobicContact CB-CD2 4.03Å; A363-I404 HydrophobicContact CB-CD1 4.23Å; A363-I404 HydrophobicContact CB-CG1 3.9Å
364H92.7Very high90.8Very high65 Ų6539.7 Ų39.730%0.30120%0.198SC..Hα-helixtrans-73.9-33.2176.2-60.1149.6000112.3D318 A321 Q322 K360 L362D318-H364 IonicContact OD1-CE1 2.72Å; D318-H364 IonicContact OD1-CG 2.8Å; D318-H364 IonicContact OD1-ND1 3.24Å; D318-H364 PolarHBondContact OD1-ND1 3.32Å; D318-H364 IonicContact OD2-CE1 2.7Å; D318-H364 IonicContact OD2-ND1 2.89Å; A321-H364 HydrophobicContact CB-CB 4.26Å; Q322-H364 HydrophobicContact CG-CB 3.99Å; Q322-H364 PolarHBondContact NE2-ND1 3.2Å; K360-H364 PolarHBondContact O-N 2.86Å; K360-H364 PolarHBondContact O-ND1 2.83Å; L362-H364 VanDerWaalsContact C-N 3.34Å; L362-H364 PolarHBondContact O-N 3.25Å
365S94.1Very high90.8Very high0 Ų036.5 Ų36.50%019%0.186CC..Hα-helixtrans-78.8-24-179.9-54.80000113.7A321 L326 L361 L362 F367 Q368 L369A321-S365 WeakPolarHBondContact CB-OG 3.3Å; L326-S365 WeakPolarHBondContact CD1-OG 3.5Å; L361-S365 VanDerWaalsContact O-CB 3.25Å; L361-S365 WeakPolarHBondContact O-CB 3.29Å; L361-S365 PolarHBondContact O-N 3.25Å; L361-S365 PolarHBondContact O-OG 3.32Å; L362-S365 PolarHBondContact O-N 2.88Å; S365-F367 VanDerWaalsContact C-N 3.27Å; S365-F367 PolarHBondContact O-N 3.34Å; S365-F367 VanDerWaalsContact O-N 3.13Å; S365-Q368 WeakPolarHBondContact O-CB 3.12Å; S365-Q368 PolarHBondContact O-N 3.47Å; S365-L369 WeakPolarHBondContact O-CG 3.41Å; S365-L369 PolarHBondContact O-N 3.47Å; S365-L369 VanDerWaalsContact O-N 3.15Å
366I91.6Very high90.8Very high1 Ų136.6 Ų36.61%0.00519%0.186CC..Hα-helixtrans-58.9-35.9-166-159.759.4000113.7L362 A363 Q368 L369 K370 I379 A407 V408L362-I366 WeakPolarHBondContact O-CB 3.32Å; L362-I366 PolarHBondContact O-N 3.02Å; A363-I366 WeakPolarHBondContact O-CG2 3.48Å; I366-Q368 PolarHBondContact O-N 2.99Å; I366-L369 PolarHBondContact O-N 3.5Å; I366-K370 WeakPolarHBondContact O-CB 3.46Å; I366-K370 PolarHBondContact O-N 3.2Å; I366-I379 HydrophobicContact CD1-CD1 3.42Å; I366-I379 VanDerWaalsContact CD1-CD1 3.42Å; I366-A407 HydrophobicContact CB-CB 4.47Å; I366-A407 HydrophobicContact CG1-CB 4Å; I366-A407 HydrophobicContact CG2-CB 3.59Å; I366-V408 HydrophobicContact CD1-CG2 3.69Å; I366-V408 HydrophobicContact CG1-CG2 3.92Å
367F87.5Confident90.7Very high125 Ų12542.4 Ų42.455%0.54821%0.21SC..Hα-helixtrans-65.7-26.7-179.3-71-70.5000112.9S365 K370S365-F367 VanDerWaalsContact C-N 3.27Å; S365-F367 PolarHBondContact O-N 3.34Å; S365-F367 VanDerWaalsContact O-N 3.13Å; F367-K370 WeakPolarHBondContact O-CD 3.34Å; F367-K370 WeakPolarHBondContact O-CE 3.4Å; F367-K370 WeakPolarHBondContact O-CG 3.36Å
368Q90.7Very high90.6Very high37 Ų3743.7 Ų43.717%0.17321%0.213CC..Hα-helixtrans-88.2-29.8178-48.3-173.120.800111.3A321 S324 N325 T327 S365 I366A321-Q368 PolarHBondContact O-NE2 3.33Å; S324-Q368 PolarHBondContact O-NE2 3.44Å; N325-Q368 PolarHBondContact OD1-OE1 3.33Å; T327-Q368 HydrophobicContact CG2-CB 4.4Å; S365-Q368 WeakPolarHBondContact O-CB 3.12Å; S365-Q368 PolarHBondContact O-N 3.47Å; I366-Q368 PolarHBondContact O-N 2.99Å
369L89.3Confident90.5Very high0 Ų043.7 Ų43.70%021%0.213CC..Hα-helixtrans-84.5-16.9-178.7-62.2175.6000113.8L335 F338 L362 S365 I366 D371 T372 I375L335-L369 HydrophobicContact CB-CD2 4.09Å; L335-L369 HydrophobicContact CD1-CD2 4.29Å; L335-L369 HydrophobicContact CD2-CD2 4.04Å; L335-L369 HydrophobicContact CG-CD2 4.38Å; F338-L369 HydrophobicContact CD1-CD1 4.34Å; F338-L369 HydrophobicContact CE1-CD1 4.15Å; L362-L369 HydrophobicContact CD1-CD1 4.47Å; S365-L369 WeakPolarHBondContact O-CG 3.41Å; S365-L369 PolarHBondContact O-N 3.47Å; S365-L369 VanDerWaalsContact O-N 3.15Å; I366-L369 PolarHBondContact O-N 3.5Å; L369-D371 PolarHBondContact O-N 3.07Å; L369-D371 VanDerWaalsContact O-N 3.09Å; L369-T372 PolarHBondContact O-N 3.5Å; L369-I375 HydrophobicContact CB-CG2 4.12Å; L369-I375 HydrophobicContact CD1-CG2 4.42Å; L369-I375 HydrophobicContact CD2-CD1 4.24Å
370K84Confident90.3Very high80 Ų8045.1 Ų45.135%0.34822%0.221SC..THydrogen-bonded Turntrans-60.4-23.1-171.672.7-176.2178.9174.80114.9I366 F367 T372 C376 S411I366-K370 WeakPolarHBondContact O-CB 3.46Å; I366-K370 PolarHBondContact O-N 3.2Å; F367-K370 WeakPolarHBondContact O-CD 3.34Å; F367-K370 WeakPolarHBondContact O-CE 3.4Å; F367-K370 WeakPolarHBondContact O-CG 3.36Å; K370-T372 PolarHBondContact O-N 2.86Å; K370-C376 VanDerWaalsContact CA-SG 3.56Å; K370-C376 PolarHBondContact O-SG 3.02Å; K370-S411 PolarHBondContact O-OG 2.95Å
371D81.2Confident90Very high130 Ų13045 Ų4570%0.69522%0.224SC*.THydrogen-bonded Turntrans-79.8-4.4-179.7-60.5-28.2000112.2L369 P373L369-D371 PolarHBondContact O-N 3.07Å; L369-D371 VanDerWaalsContact O-N 3.09Å; D371-P373 WeakPolarHBondContact O-CD 3.43Å
372T86Confident89.7Confident20 Ų2045.9 Ų45.912%0.12323%0.229CC..  trans-103.4103.3174.3-56.40000110.4L369 K370 E374 I375 C376L369-T372 PolarHBondContact O-N 3.5Å; K370-T372 PolarHBondContact O-N 2.86Å; T372-E374 VanDerWaalsContact C-N 3.27Å; T372-E374 HydrophobicContact CG2-CB 4.34Å; T372-E374 PolarHBondContact O-N 2.88Å; T372-I375 HydrophobicContact CG2-CB 4.15Å; T372-I375 HydrophobicContact CG2-CD1 3.74Å; T372-I375 HydrophobicContact CG2-CG1 3.73Å; T372-I375 PolarHBondContact O-N 3.45Å; T372-I375 VanDerWaalsContact O-N 3.13Å; T372-C376 PolarHBondContact O-N 3.33Å
373P86.2Confident89.3Confident82 Ų8246 Ų4653%0.53223%0.23SC..Hα-helixtrans-64.2-31.4-17323.8-33.6000112.9D371 C376 K377D371-P373 WeakPolarHBondContact O-CD 3.43Å; P373-C376 PolarHBondContact O-N 3.38Å; P373-K377 WeakPolarHBondContact O-CB 3.49Å; P373-K377 PolarHBondContact O-N 3.33Å
374E89.6Confident88.8Confident104 Ų10451.6 Ų51.649%0.48625%0.253SS..Hα-helixtrans-61.1-44.8175.8-66.5152.8163.700111.3K332 T372 K377 L378K332-E374 WeakPolarHBondContact CE-OE2 3.45Å; K332-E374 IonicContact NZ-OE2 3.13Å; K332-E374 PolarHBondContact NZ-OE2 2.92Å; T372-E374 VanDerWaalsContact C-N 3.27Å; T372-E374 HydrophobicContact CG2-CB 4.34Å; T372-E374 PolarHBondContact O-N 2.88Å; E374-K377 PolarHBondContact O-N 3.17Å; E374-L378 PolarHBondContact O-N 3.34Å
375I91Very high88Confident0 Ų054.6 Ų54.60%027%0.269CS..Hα-helixtrans-69.1-44.7178.1-66.6174.5000110.5L335 Q336 S339 L369 T372 K377 L378 I379L335-I375 HydrophobicContact CB-CD1 4.11Å; Q336-I375 HydrophobicContact CB-CD1 4.45Å; Q336-I375 HydrophobicContact CB-CG1 4.4Å; Q336-I375 HydrophobicContact CG-CG1 4.48Å; S339-I375 VanDerWaalsContact OG-CG2 3.25Å; S339-I375 WeakPolarHBondContact OG-CG2 3.32Å; L369-I375 HydrophobicContact CB-CG2 4.12Å; L369-I375 HydrophobicContact CD1-CG2 4.42Å; L369-I375 HydrophobicContact CD2-CD1 4.24Å; T372-I375 HydrophobicContact CG2-CB 4.15Å; T372-I375 HydrophobicContact CG2-CD1 3.74Å; T372-I375 HydrophobicContact CG2-CG1 3.73Å; T372-I375 PolarHBondContact O-N 3.45Å; T372-I375 VanDerWaalsContact O-N 3.13Å; I375-K377 VanDerWaalsContact C-N 3.29Å; I375-K377 PolarHBondContact O-N 3.36Å; I375-L378 WeakPolarHBondContact O-CB 3.36Å; I375-L378 PolarHBondContact O-N 3.03Å; I375-I379 HydrophobicContact CG2-CD1 3.71Å; I375-I379 HydrophobicContact CG2-CG1 4.36Å; I375-I379 WeakPolarHBondContact O-CG1 3.49Å; I375-I379 PolarHBondContact O-N 3.29Å
376C89.6Confident87.2Confident2 Ų255.2 Ų55.21%0.01427%0.272CS..Hα-helixtrans-58.5-42176.3-73.70000112.2K370 T372 P373 I379 N380 V408K370-C376 VanDerWaalsContact CA-SG 3.56Å; K370-C376 PolarHBondContact O-SG 3.02Å; T372-C376 PolarHBondContact O-N 3.33Å; P373-C376 PolarHBondContact O-N 3.38Å; C376-I379 PolarHBondContact O-N 2.84Å; C376-N380 WeakPolarHBondContact O-CB 3.42Å; C376-N380 PolarHBondContact O-N 3.01Å; C376-V408 HydrophobicContact CB-CG1 3.93Å
377K90.3Very high85.9Confident141 Ų14157.9 Ų57.961%0.61329%0.294SS*.Hα-helixtrans-62.9-47.6176.6-175.7-177.3175.9-172.40111.4P373 E374 I375 I379 N380 D381P373-K377 WeakPolarHBondContact O-CB 3.49Å; P373-K377 PolarHBondContact O-N 3.33Å; E374-K377 PolarHBondContact O-N 3.17Å; I375-K377 VanDerWaalsContact C-N 3.29Å; I375-K377 PolarHBondContact O-N 3.36Å; K377-I379 PolarHBondContact O-N 2.83Å; K377-N380 PolarHBondContact O-N 2.8Å; K377-D381 WeakPolarHBondContact O-CB 3.35Å; K377-D381 PolarHBondContact O-N 3.21Å
378L92.7Very high84Confident50 Ų5057.5 Ų57.526%0.26231%0.306SS..Hα-helixtrans-54.3-52.7176.3171.367.2000111.2E340 E374 I375 N380 D381 T382E340-L378 HydrophobicContact CB-CD2 4.27Å; E340-L378 HydrophobicContact CG-CD2 3.46Å; E340-L378 VanDerWaalsContact CG-CD2 3.46Å; E374-L378 PolarHBondContact O-N 3.34Å; I375-L378 WeakPolarHBondContact O-CB 3.36Å; I375-L378 PolarHBondContact O-N 3.03Å; L378-N380 PolarHBondContact O-N 3.39Å; L378-D381 PolarHBondContact O-N 3.28Å; L378-T382 WeakPolarHBondContact O-CB 3.32Å; L378-T382 PolarHBondContact O-N 2.96Å; L378-T382 PolarHBondContact O-OG1 3.14Å; L378-T382 VanDerWaalsContact O-OG1 3.04Å
379I92.2Very high82.2Confident2 Ų258.8 Ų58.81%0.0133%0.329CS..Hα-helixtrans-60.6-47.4-179.5-64.8169000110.4L362 I366 I375 C376 K377 D381 T382 F383 I404 V408L362-I379 HydrophobicContact CD1-CD1 3.88Å; L362-I379 HydrophobicContact CD2-CG2 4.35Å; I366-I379 HydrophobicContact CD1-CD1 3.42Å; I366-I379 VanDerWaalsContact CD1-CD1 3.42Å; I375-I379 HydrophobicContact CG2-CD1 3.71Å; I375-I379 HydrophobicContact CG2-CG1 4.36Å; I375-I379 WeakPolarHBondContact O-CG1 3.49Å; I375-I379 PolarHBondContact O-N 3.29Å; C376-I379 PolarHBondContact O-N 2.84Å; K377-I379 PolarHBondContact O-N 2.83Å; I379-D381 VanDerWaalsContact C-N 3.33Å; I379-D381 PolarHBondContact O-N 3.48Å; I379-T382 PolarHBondContact O-N 2.86Å; I379-F383 HydrophobicContact CG2-CD2 3.7Å; I379-F383 HydrophobicContact CG2-CE2 3.98Å; I379-F383 VanDerWaalsContact O-CD2 3.31Å; I379-F383 WeakPolarHBondContact O-CD2 3.44Å; I379-F383 PolarHBondContact O-N 3.37Å; I379-I404 HydrophobicContact CG2-CG2 3.81Å; I379-V408 HydrophobicContact CB-CG2 4.43Å; I379-V408 HydrophobicContact CG2-CG2 3.88Å
380N88.9Confident80.6Confident30 Ų3062.2 Ų62.216%0.1635%0.348CS..Hα-helixtrans-57.1-45.4177.3-94.2-20.4000112.5C376 K377 L378 F383 K384 V408C376-N380 WeakPolarHBondContact O-CB 3.42Å; C376-N380 PolarHBondContact O-N 3.01Å; K377-N380 PolarHBondContact O-N 2.8Å; L378-N380 PolarHBondContact O-N 3.39Å; N380-F383 PolarHBondContact O-N 2.88Å; N380-K384 VanDerWaalsContact O-CG 3.25Å; N380-K384 WeakPolarHBondContact O-CG 3.4Å; N380-K384 PolarHBondContact O-N 3.3Å; N380-V408 HydrophobicContact CB-CG1 4.42Å; N380-V408 VanDerWaalsContact ND2-CG1 3.26Å; N380-V408 WeakPolarHBondContact ND2-CG1 3.33Å; N380-V408 VanDerWaalsContact OD1-CG1 3.28Å; N380-V408 WeakPolarHBondContact OD1-CG1 3.43Å
381D88.9Confident79.1Confident67 Ų6765.6 Ų65.636%0.35837%0.365SS..Hα-helixtrans-69.2-39.8-178.4-69.3-20.3000111.5K377 L378 I379 K384K377-D381 WeakPolarHBondContact O-CB 3.35Å; K377-D381 PolarHBondContact O-N 3.21Å; L378-D381 PolarHBondContact O-N 3.28Å; I379-D381 VanDerWaalsContact C-N 3.33Å; I379-D381 PolarHBondContact O-N 3.48Å; D381-K384 IonicContact OD1-NZ 2.85Å; D381-K384 PolarHBondContact OD1-NZ 3.19Å
382T89.7Confident77.8Confident20 Ų2059.7 Ų59.712%0.12333%0.334CS..Hα-helixtrans-59.2-50.1172.8-61.90000111.6C343 T347 L378 I379 K384 I385 F386C343-T382 HydrophobicContact CB-CG2 3.87Å; T347-T382 HydrophobicContact CG2-CG2 3.6Å; L378-T382 WeakPolarHBondContact O-CB 3.32Å; L378-T382 PolarHBondContact O-N 2.96Å; L378-T382 PolarHBondContact O-OG1 3.14Å; L378-T382 VanDerWaalsContact O-OG1 3.04Å; I379-T382 PolarHBondContact O-N 2.86Å; T382-K384 PolarHBondContact O-N 3.26Å; T382-I385 PolarHBondContact O-N 3.27Å; T382-F386 PolarHBondContact O-N 3.46Å
383F86.5Confident76.3Confident2 Ų264.9 Ų64.91%0.00936%0.361CS..Hα-helixtrans-77.3-18.3-174-81.1-83.8000114.2V346 L359 L362 I379 N380 I385 F386 A387 V401 I404 R405V346-F383 HydrophobicContact CG1-CE1 4.37Å; V346-F383 HydrophobicContact CG1-CZ 4.22Å; L359-F383 HydrophobicContact CD2-CE1 3.84Å; L359-F383 HydrophobicContact CD2-CZ 3.74Å; L362-F383 HydrophobicContact CD2-CE2 3.54Å; L362-F383 HydrophobicContact CD2-CZ 3.93Å; I379-F383 HydrophobicContact CG2-CD2 3.7Å; I379-F383 HydrophobicContact CG2-CE2 3.98Å; I379-F383 VanDerWaalsContact O-CD2 3.31Å; I379-F383 WeakPolarHBondContact O-CD2 3.44Å; I379-F383 PolarHBondContact O-N 3.37Å; N380-F383 PolarHBondContact O-N 2.88Å; F383-I385 VanDerWaalsContact C-N 3.34Å; F383-F386 HydrophobicContact CD1-CB 4.23Å; F383-F386 HydrophobicContact CD1-CD1 4.13Å; F383-F386 HydrophobicContact CD1-CG 4.34Å; F383-F386 HydrophobicContact CE1-CD1 4.28Å; F383-A387 PolarHBondContact O-N 3.05Å; F383-V401 HydrophobicContact CD1-CB 4.45Å; F383-V401 HydrophobicContact CD1-CG1 3.72Å; F383-V401 HydrophobicContact CD1-CG2 4.19Å; F383-V401 HydrophobicContact CE1-CB 4.32Å; F383-V401 HydrophobicContact CE1-CG1 4.08Å; F383-V401 HydrophobicContact CE1-CG2 3.71Å; F383-I404 HydrophobicContact CD2-CG2 4.37Å; F383-I404 HydrophobicContact CE2-CG2 4.15Å; F383-I404 HydrophobicContact CZ-CD1 4.1Å; F383-I404 HydrophobicContact CZ-CG2 4.47Å; F383-R405 HydrophobicContact CB-CG 4.37Å; F383-R405 PolarHBondContact O-NH2 3.02Å
384K82Confident75.2Confident125 Ų12562.6 Ų62.654%0.54335%0.353SS..Hα-helixtrans-61.8-43.3166.2-77.6168.5-162.6160.40111.3N380 D381 T382N380-K384 VanDerWaalsContact O-CG 3.25Å; N380-K384 WeakPolarHBondContact O-CG 3.4Å; N380-K384 PolarHBondContact O-N 3.3Å; D381-K384 IonicContact OD1-NZ 2.85Å; D381-K384 PolarHBondContact OD1-NZ 3.19Å; T382-K384 PolarHBondContact O-N 3.26Å
385I77.2Confident74.4Confident128 Ų12862.7 Ų62.766%0.65637%0.365SS*.Hα-helixtrans-74.1-41.6-179.5-58.3168.4000110.1T382 F383 A387 C388T382-I385 PolarHBondContact O-N 3.27Å; F383-I385 VanDerWaalsContact C-N 3.34Å; I385-A387 PolarHBondContact O-N 3.48Å; I385-C388 PolarHBondContact O-N 3.34Å
386F76.4Confident74.2Confident14 Ų1467.1 Ų67.16%0.06139%0.385CS..Hα-helixtrans-55.8-34.3178.5-167.5-98.8000112.9V346 T382 F383 C388 V401V346-F386 HydrophobicContact CG1-CD2 4.06Å; V346-F386 HydrophobicContact CG1-CE2 3.68Å; V346-F386 HydrophobicContact CG1-CZ 4.05Å; V346-F386 WeakPolarHBondContact O-CE2 3.43Å; T382-F386 PolarHBondContact O-N 3.46Å; F383-F386 HydrophobicContact CD1-CB 4.23Å; F383-F386 HydrophobicContact CD1-CD1 4.13Å; F383-F386 HydrophobicContact CD1-CG 4.34Å; F383-F386 HydrophobicContact CE1-CD1 4.28Å; F386-C388 VanDerWaalsContact C-N 3.26Å; F386-C388 PolarHBondContact O-N 3.09Å; F386-V401 HydrophobicContact CD1-CG2 4.14Å; F386-V401 HydrophobicContact CE1-CG2 3.75Å
387A64.1Low74.1Confident56 Ų5667.2 Ų67.246%0.46339%0.386SS..Hα-helixtrans-60.4-31.4177.700000114.3F383 I385F383-A387 PolarHBondContact O-N 3.05Å; I385-A387 PolarHBondContact O-N 3.48Å
388C48Very low73.8Confident117 Ų11765.6 Ų65.679%0.79138%0.379SS*.Hα-helixtrans-94.3-12.9-163.2-71.20000113.9I385 F386I385-C388 PolarHBondContact O-N 3.34Å; F386-C388 VanDerWaalsContact C-N 3.26Å; F386-C388 PolarHBondContact O-N 3.09Å
389G53.7Low73.6Confident65 Ų6566.2 Ų66.267%0.6739%0.391SS*.Hα-helixtrans-126.2-27.9-169.700000116.1
390N54.5Low73.5Confident72 Ų7267.3 Ų67.339%0.38540%0.397SS..  trans-125.197.6-174.3-85.7-23.5000109.3A392N390-A392 PolarHBondContact O-N 3.4Å
391E52.6Low73.5Confident151 Ų15166.4 Ų66.471%0.70639%0.392SS*.  trans-58.2108161.3-72.2-168178.700107.1N393E391-N393 PolarHBondContact O-N 3.44Å; E391-N393 PolarHBondContact O-OD1 3.12Å
392A53.2Low73.4Confident6 Ų665.4 Ų65.45%0.0539%0.394CS..  trans-55.994.4163.900000107.3N390 G394 D397 K398N390-A392 PolarHBondContact O-N 3.4Å; A392-G394 PolarHBondContact O-N 2.93Å; A392-D397 HydrophobicContact CB-CB 3.68Å; A392-K398 HydrophobicContact CB-CG 3.55Å; A392-K398 WeakPolarHBondContact O-CD 3.38Å; A392-K398 WeakPolarHBondContact O-CE 3.36Å; A392-K398 WeakPolarHBondContact O-CG 3.42Å; A392-K398 PolarHBondContact O-NZ 2.89Å
393N55.1Low73.4Confident128 Ų12867.1 Ų67.168%0.68441%0.407SS*.  trans-66.2-22.3-178.4-71-23.7000111E391E391-N393 PolarHBondContact O-N 3.44Å; E391-N393 PolarHBondContact O-OD1 3.12Å
394G63.8Low73.6Confident35 Ų3567 Ų6736%0.36141%0.406SS..SBendtrans-79.1129.6168.400000112.4A392 E396 D397 K398A392-G394 PolarHBondContact O-N 2.93Å; G394-E396 PolarHBondContact O-N 2.9Å; G394-D397 PolarHBondContact O-N 3.47Å; G394-K398 PolarHBondContact O-N 2.78Å
395S72.7Confident73.9Confident106 Ų10664.6 Ų64.674%0.74139%0.394SS*.Hα-helixtrans-59.6-29.6174.351.60000112.8A399S395-A399 PolarHBondContact O-N 3.4Å
396E87.2Confident74.3Confident93 Ų9363.5 Ų63.544%0.43539%0.389SS..Hα-helixtrans-69.9-49.8-179.8-171.3173.2-171.100112.6T356 K360 G394 K398 A399 L400T356-E396 HydrophobicContact CG2-CG 4.16Å; K360-E396 WeakPolarHBondContact CE-OE1 3.46Å; K360-E396 IonicContact NZ-OE1 3.12Å; K360-E396 PolarHBondContact NZ-OE1 2.81Å; G394-E396 PolarHBondContact O-N 2.9Å; E396-K398 PolarHBondContact O-N 2.92Å; E396-A399 WeakPolarHBondContact O-CB 3.3Å; E396-A399 PolarHBondContact O-N 3.25Å; E396-L400 HydrophobicContact CG-CD1 4.2Å; E396-L400 PolarHBondContact O-N 2.74Å
397D87.1Confident74.8Confident4 Ų463.4 Ų63.42%0.02139%0.39CS..Hα-helixtrans-56.6-41.1177.2-80.29.1000111.4R355 T356 L359 A392 G394 A399 L400 V401R355-D397 IonicContact CZ-OD2 3.47Å; R355-D397 VanDerWaalsContact CZ-OD2 3.24Å; R355-D397 IonicContact NE-OD2 3.34Å; R355-D397 PolarHBondContact NE-OD2 2.94Å; R355-D397 IonicContact NH2-OD2 3.97Å; R355-D397 PolarHBondContact NH2-OD2 3.32Å; T356-D397 WeakPolarHBondContact CA-OD1 3.39Å; T356-D397 WeakPolarHBondContact CB-OD1 3.48Å; T356-D397 PolarHBondContact OG1-OD1 2.7Å; L359-D397 HydrophobicContact CD1-CB 3.88Å; A392-D397 HydrophobicContact CB-CB 3.68Å; G394-D397 PolarHBondContact O-N 3.47Å; D397-A399 VanDerWaalsContact C-N 3.34Å; D397-A399 PolarHBondContact O-N 2.8Å; D397-L400 PolarHBondContact O-N 3.33Å; D397-V401 WeakPolarHBondContact O-CB 3.39Å; D397-V401 WeakPolarHBondContact O-CG2 3.15Å; D397-V401 PolarHBondContact O-N 2.69Å
398K83.8Confident75.8Confident106 Ų10660.7 Ų60.746%0.46137%0.368SS..Hα-helixtrans-59.9-43.9175.7-75.4178.9165145.90111.9A392 G394 E396 A402A392-K398 HydrophobicContact CB-CG 3.55Å; A392-K398 WeakPolarHBondContact O-CD 3.38Å; A392-K398 WeakPolarHBondContact O-CE 3.36Å; A392-K398 WeakPolarHBondContact O-CG 3.42Å; A392-K398 PolarHBondContact O-NZ 2.89Å; G394-K398 PolarHBondContact O-N 2.78Å; E396-K398 PolarHBondContact O-N 2.92Å; K398-A402 WeakPolarHBondContact O-CB 3.5Å; K398-A402 PolarHBondContact O-N 3.47Å
399A88.1Confident77.4Confident64 Ų6460.8 Ų60.853%0.52936%0.357SS..Hα-helixtrans-65.6-43178.800000111.7S395 E396 D397 A402 S403S395-A399 PolarHBondContact O-N 3.4Å; E396-A399 WeakPolarHBondContact O-CB 3.3Å; E396-A399 PolarHBondContact O-N 3.25Å; D397-A399 VanDerWaalsContact C-N 3.34Å; D397-A399 PolarHBondContact O-N 2.8Å; A399-A402 PolarHBondContact O-N 3.37Å; A399-S403 PolarHBondContact O-N 3.36Å
400L90.6Very high78.4Confident24 Ų2461.1 Ų61.113%0.12635%0.349CS..Hα-helixtrans-63.4-46.7177.1-69.5168.3000111.7T356 L359 K360 A363 E396 D397 A402 S403 I404T356-L400 HydrophobicContact CG2-CD1 4.09Å; L359-L400 HydrophobicContact CB-CB 4.11Å; L359-L400 HydrophobicContact CB-CD1 3.82Å; K360-L400 HydrophobicContact CG-CD1 3.74Å; K360-L400 HydrophobicContact CG-CD2 4.11Å; A363-L400 HydrophobicContact CB-CD2 4.03Å; E396-L400 HydrophobicContact CG-CD1 4.2Å; E396-L400 PolarHBondContact O-N 2.74Å; D397-L400 PolarHBondContact O-N 3.33Å; L400-A402 VanDerWaalsContact C-N 3.32Å; L400-A402 PolarHBondContact O-N 2.8Å; L400-S403 WeakPolarHBondContact O-CB 3.26Å; L400-S403 PolarHBondContact O-N 3.33Å; L400-I404 WeakPolarHBondContact O-CD1 3.44Å; L400-I404 VanDerWaalsContact O-CG1 3.29Å; L400-I404 WeakPolarHBondContact O-CG1 3.34Å; L400-I404 PolarHBondContact O-N 3.07Å
401V88.7Confident79Confident11 Ų1158.6 Ų58.67%0.06734%0.337CS..Hα-helixtrans-60-42.7176.8171.30000111.5L359 F383 F386 D397 I404 R405L359-V401 HydrophobicContact CD1-CG2 4.28Å; L359-V401 HydrophobicContact CD2-CG2 4.03Å; F383-V401 HydrophobicContact CD1-CB 4.45Å; F383-V401 HydrophobicContact CD1-CG1 3.72Å; F383-V401 HydrophobicContact CD1-CG2 4.19Å; F383-V401 HydrophobicContact CE1-CB 4.32Å; F383-V401 HydrophobicContact CE1-CG1 4.08Å; F383-V401 HydrophobicContact CE1-CG2 3.71Å; F386-V401 HydrophobicContact CD1-CG2 4.14Å; F386-V401 HydrophobicContact CE1-CG2 3.75Å; D397-V401 WeakPolarHBondContact O-CB 3.39Å; D397-V401 WeakPolarHBondContact O-CG2 3.15Å; D397-V401 PolarHBondContact O-N 2.69Å; V401-I404 PolarHBondContact O-N 3.02Å; V401-R405 PolarHBondContact O-N 2.94Å
402A87Confident79.2Confident47 Ų4754.1 Ų54.139%0.38832%0.322SS..Hα-helixtrans-62.6-43.1176.400000111.6K398 A399 L400 R405 N406K398-A402 WeakPolarHBondContact O-CB 3.5Å; K398-A402 PolarHBondContact O-N 3.47Å; A399-A402 PolarHBondContact O-N 3.37Å; L400-A402 VanDerWaalsContact C-N 3.32Å; L400-A402 PolarHBondContact O-N 2.8Å; A402-R405 PolarHBondContact O-N 3.17Å; A402-N406 WeakPolarHBondContact O-CB 3.25Å; A402-N406 PolarHBondContact O-N 3.39Å; A402-N406 PolarHBondContact O-ND2 3.42Å
403S89.4Confident79.4Confident56 Ų5656.8 Ų56.839%0.39234%0.344SS..Hα-helixtrans-58.8-48.5175.5-171.80000111.9A399 L400 R405 N406 A407A399-S403 PolarHBondContact O-N 3.36Å; L400-S403 WeakPolarHBondContact O-CB 3.26Å; L400-S403 PolarHBondContact O-N 3.33Å; S403-R405 PolarHBondContact O-N 3.36Å; S403-N406 PolarHBondContact O-N 2.94Å; S403-A407 PolarHBondContact O-N 2.94Å
404I90.8Very high79.2Confident0 Ų055 Ų550%034%0.341CS..Hα-helixtrans-60.5-47.6179.7-66.7159.5000110.8L359 L362 A363 I379 F383 L400 V401 N406 A407 V408L359-I404 HydrophobicContact CD2-CD1 4.08Å; L362-I404 HydrophobicContact CB-CD1 4.16Å; L362-I404 HydrophobicContact CD2-CD1 4.14Å; L362-I404 HydrophobicContact CD2-CG2 4.2Å; L362-I404 HydrophobicContact CG-CD1 4.22Å; L362-I404 HydrophobicContact CG-CG2 4.46Å; A363-I404 HydrophobicContact CB-CD1 4.23Å; A363-I404 HydrophobicContact CB-CG1 3.9Å; I379-I404 HydrophobicContact CG2-CG2 3.81Å; F383-I404 HydrophobicContact CD2-CG2 4.37Å; F383-I404 HydrophobicContact CE2-CG2 4.15Å; F383-I404 HydrophobicContact CZ-CD1 4.1Å; F383-I404 HydrophobicContact CZ-CG2 4.47Å; L400-I404 WeakPolarHBondContact O-CD1 3.44Å; L400-I404 VanDerWaalsContact O-CG1 3.29Å; L400-I404 WeakPolarHBondContact O-CG1 3.34Å; L400-I404 PolarHBondContact O-N 3.07Å; V401-I404 PolarHBondContact O-N 3.02Å; I404-N406 PolarHBondContact O-N 3.01Å; I404-A407 PolarHBondContact O-N 3.23Å; I404-V408 WeakPolarHBondContact O-CG2 3.47Å; I404-V408 PolarHBondContact O-N 2.77Å
405R87.2Confident78.2Confident74 Ų7460 Ų6028%0.27936%0.36SS..Hα-helixtrans-60.6-46.7179-75.6-172.2-170.4158.210.3112.4F383 V401 A402 S403 A407 V408 E409F383-R405 HydrophobicContact CB-CG 4.37Å; F383-R405 PolarHBondContact O-NH2 3.02Å; V401-R405 PolarHBondContact O-N 2.94Å; A402-R405 PolarHBondContact O-N 3.17Å; S403-R405 PolarHBondContact O-N 3.36Å; R405-A407 VanDerWaalsContact C-N 3.27Å; R405-A407 PolarHBondContact O-N 3.5Å; R405-V408 PolarHBondContact O-N 3.27Å; R405-E409 WeakPolarHBondContact O-CB 3.43Å; R405-E409 WeakPolarHBondContact O-CG 3.23Å; R405-E409 PolarHBondContact O-N 3.45Å
406N86.9Confident76.5Confident105 Ų10566.8 Ų66.856%0.56138%0.376SS*.Hα-helixtrans-59.6-41.1179.1-69.7-18.3000111.4A402 S403 I404 S410A402-N406 WeakPolarHBondContact O-CB 3.25Å; A402-N406 PolarHBondContact O-N 3.39Å; A402-N406 PolarHBondContact O-ND2 3.42Å; S403-N406 PolarHBondContact O-N 2.94Å; I404-N406 PolarHBondContact O-N 3.01Å; N406-S410 WeakPolarHBondContact O-CB 3.16Å; N406-S410 PolarHBondContact O-N 2.99Å; N406-S410 VanDerWaalsContact O-N 3.15Å
407A86.8Confident75.9Confident11 Ų1165.5 Ų65.59%0.09137%0.373CS..Hα-helixtrans-63.3-44.7177.400000112I366 S403 I404 R405 S410 S411I366-A407 HydrophobicContact CB-CB 4.47Å; I366-A407 HydrophobicContact CG1-CB 4Å; I366-A407 HydrophobicContact CG2-CB 3.59Å; S403-A407 PolarHBondContact O-N 2.94Å; I404-A407 PolarHBondContact O-N 3.23Å; R405-A407 VanDerWaalsContact C-N 3.27Å; R405-A407 PolarHBondContact O-N 3.5Å; A407-S410 PolarHBondContact O-OG 3.03Å; A407-S411 PolarHBondContact O-N 2.89Å
408V84.9Confident75.3Confident0 Ų068.7 Ų68.70%039%0.392CS..Hα-helixtrans-71.1-41.3-179.7-174.60000112.2I366 C376 I379 N380 I404 R405 S410 S411 C412I366-V408 HydrophobicContact CD1-CG2 3.69Å; I366-V408 HydrophobicContact CG1-CG2 3.92Å; C376-V408 HydrophobicContact CB-CG1 3.93Å; I379-V408 HydrophobicContact CB-CG2 4.43Å; I379-V408 HydrophobicContact CG2-CG2 3.88Å; N380-V408 HydrophobicContact CB-CG1 4.42Å; N380-V408 VanDerWaalsContact ND2-CG1 3.26Å; N380-V408 WeakPolarHBondContact ND2-CG1 3.33Å; N380-V408 VanDerWaalsContact OD1-CG1 3.28Å; N380-V408 WeakPolarHBondContact OD1-CG1 3.43Å; I404-V408 WeakPolarHBondContact O-CG2 3.47Å; I404-V408 PolarHBondContact O-N 2.77Å; R405-V408 PolarHBondContact O-N 3.27Å; V408-S410 VanDerWaalsContact C-N 3.28Å; V408-S410 PolarHBondContact O-N 3.13Å; V408-S411 PolarHBondContact O-N 3.48Å; V408-S411 VanDerWaalsContact O-N 3.11Å; V408-C412 PolarHBondContact O-N 2.78Å; V408-C412 VanDerWaalsContact O-N 3.1Å
409E80.9Confident74.9Confident118 Ų11866.7 Ų66.755%0.55139%0.388SS*.Hα-helixtrans-59.7-39.5177.5-76-179.8-174.700112R405 S411 C412 A413R405-E409 WeakPolarHBondContact O-CB 3.43Å; R405-E409 WeakPolarHBondContact O-CG 3.23Å; R405-E409 PolarHBondContact O-N 3.45Å; E409-S411 VanDerWaalsContact C-N 3.26Å; E409-S411 PolarHBondContact O-N 3.15Å; E409-C412 PolarHBondContact O-N 2.84Å; E409-A413 PolarHBondContact O-N 3.38Å; E409-A413 VanDerWaalsContact O-N 3.12Å
410S75.6Confident74.1Confident73 Ų7366.8 Ų66.851%0.5138%0.38SS..Hα-helixtrans-62-33.4176.774.40000112.9N406 A407 V408 S414N406-S410 WeakPolarHBondContact O-CB 3.16Å; N406-S410 PolarHBondContact O-N 2.99Å; N406-S410 VanDerWaalsContact O-N 3.15Å; A407-S410 PolarHBondContact O-OG 3.03Å; V408-S410 VanDerWaalsContact C-N 3.28Å; V408-S410 PolarHBondContact O-N 3.13Å; S410-S414 PolarHBondContact O-OG 3.19Å
411S66.4Low73.1Confident18 Ų1869.5 Ų69.513%0.12640%0.396CS..Hα-helixtrans-75.2-42177.5-167.70000112.1K370 A407 V408 E409 A413 S414K370-S411 PolarHBondContact O-OG 2.95Å; A407-S411 PolarHBondContact O-N 2.89Å; V408-S411 PolarHBondContact O-N 3.48Å; V408-S411 VanDerWaalsContact O-N 3.11Å; E409-S411 VanDerWaalsContact C-N 3.26Å; E409-S411 PolarHBondContact O-N 3.15Å; S411-A413 PolarHBondContact O-N 3.35Å; S411-S414 PolarHBondContact O-N 2.93Å; S411-S414 PolarHBondContact O-OG 3.26Å
412C57.3Low72Confident57 Ų5773.4 Ų73.439%0.38542%0.418SS..Hα-helixtrans-69.5-20.1178.3-670000113.8V408 E409V408-C412 PolarHBondContact O-N 2.78Å; V408-C412 VanDerWaalsContact O-N 3.1Å; E409-C412 PolarHBondContact O-N 2.84Å
413A57.2Low70.9Confident63 Ų6375.3 Ų75.352%0.52142%0.42SS..Hα-helixtrans-79.4-25.8175.900000113.1E409 S411 D415E409-A413 PolarHBondContact O-N 3.38Å; E409-A413 VanDerWaalsContact O-N 3.12Å; S411-A413 PolarHBondContact O-N 3.35Å; A413-D415 VanDerWaalsContact C-N 3.29Å; A413-D415 PolarHBondContact O-N 2.9Å
414S49.8Very low69.5Low89 Ų8976.8 Ų76.862%0.62242%0.422SS*.THydrogen-bonded Turntrans-74.3-12.9178.221.40000114.9S410 S411S410-S414 PolarHBondContact O-OG 3.19Å; S411-S414 PolarHBondContact O-N 2.93Å; S411-S414 PolarHBondContact O-OG 3.26Å
415D43.9Very low67.7Low142 Ų14283.2 Ų83.276%0.75946%0.457SS*.THydrogen-bonded Turntrans-97.39.6178.1-86.3-20.1000113.8A413A413-D415 VanDerWaalsContact C-N 3.29Å; A413-D415 PolarHBondContact O-N 2.9Å
416K36Very low66Low248 Ų24884 Ų84100%1.07847%0.473SS*.  trans-111.40172.4-73.2-175-179.5176.50111

Retrieved 416 of 416 residues in 794.1 ms (Link to these results)

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