A0A087WWS5_HUMAN Loading...

Solute carrier family 38 member 3

AlphaFold DB , UniProt , Accession A0A087WWS5, Species HUMAN (Homo sapiens, Human), Gene SLC38A3, Length 216 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M62.9Low75.9Confident162 Ų16291.5 Ų91.580%0.79846%0.46SS*.  0-490-63.1-49.6169.200112.5S3 Y4M1-S3 VanDerWaalsContact C-N 3.28Å; M1-S3 PolarHBondContact O-N 3.3Å; M1-Y4 PolarHBondContact O-N 3.48Å; M1-Y4 HydrophobicContact SD-CD2 4.24Å; M1-Y4 HydrophobicContact SD-CE2 4.15Å
2S71.9Confident76.1Confident99 Ų9987.5 Ų87.569%0.69244%0.441SS*.Hα-helixtrans-64.2-27.9174.549.20000114.4Y4 L5 Y6S2-Y4 PolarHBondContact O-N 3.04Å; S2-L5 PolarHBondContact O-N 2.8Å; S2-Y6 PolarHBondContact O-N 3.33Å; S2-Y6 VanDerWaalsContact O-N 3.15Å
3S74.8Confident75.9Confident64 Ų6482.2 Ų82.245%0.44842%0.416SS..Hα-helixtrans-56.7-43.1175.347.30000113.2M1 L5 Y6 I7M1-S3 VanDerWaalsContact C-N 3.28Å; M1-S3 PolarHBondContact O-N 3.3Å; S3-L5 VanDerWaalsContact C-N 3.33Å; S3-L5 PolarHBondContact O-N 3.49Å; S3-Y6 WeakPolarHBondContact O-CB 3.4Å; S3-Y6 PolarHBondContact O-N 3.17Å; S3-I7 WeakPolarHBondContact O-CG1 3.29Å; S3-I7 PolarHBondContact O-N 3.47Å
4Y76.3Confident75.6Confident148 Ų14879.7 Ų79.758%0.5840%0.404SS*.Hα-helixtrans-64.3-37.2178.3-60.2-74.4000112.4M1 S2 Y6 I7 I8M1-Y4 PolarHBondContact O-N 3.48Å; M1-Y4 HydrophobicContact SD-CD2 4.24Å; M1-Y4 HydrophobicContact SD-CE2 4.15Å; S2-Y4 PolarHBondContact O-N 3.04Å; Y4-Y6 VanDerWaalsContact C-N 3.31Å; Y4-Y6 PolarHBondContact O-N 3.42Å; Y4-I7 PolarHBondContact O-N 3Å; Y4-I8 VanDerWaalsContact O-CG1 3.32Å; Y4-I8 WeakPolarHBondContact O-CG1 3.48Å; Y4-I8 PolarHBondContact O-N 2.84Å
5L77.5Confident75.4Confident70 Ų7075.8 Ų75.837%0.36639%0.386SS..Hα-helixtrans-66.7-34.7175.9-62.6176.4000111.9S2 S3 K9 I45S2-L5 PolarHBondContact O-N 2.8Å; S3-L5 VanDerWaalsContact C-N 3.33Å; S3-L5 PolarHBondContact O-N 3.49Å; L5-K9 WeakPolarHBondContact O-CB 3.47Å; L5-K9 PolarHBondContact O-N 3.41Å; L5-I45 HydrophobicContact CD2-CD1 3.42Å; L5-I45 VanDerWaalsContact CD2-CD1 3.42Å
6Y80.2Confident75.1Confident165 Ų16573.5 Ų73.565%0.64737%0.374SS*.Hα-helixtrans-67.7-40.8174.7-175.1-93000111.9S2 S3 Y4 K9 S10S2-Y6 PolarHBondContact O-N 3.33Å; S2-Y6 VanDerWaalsContact O-N 3.15Å; S3-Y6 WeakPolarHBondContact O-CB 3.4Å; S3-Y6 PolarHBondContact O-N 3.17Å; Y4-Y6 VanDerWaalsContact C-N 3.31Å; Y4-Y6 PolarHBondContact O-N 3.42Å; Y6-K9 VanDerWaalsContact O-CB 3.25Å; Y6-K9 WeakPolarHBondContact O-CB 3.3Å; Y6-K9 PolarHBondContact O-N 3.36Å; Y6-K9 VanDerWaalsContact O-N 3.17Å; Y6-S10 PolarHBondContact O-N 3.26Å; Y6-S10 PolarHBondContact O-OG 2.84Å
7I79.6Confident74.8Confident89 Ų8973.4 Ų73.446%0.45637%0.372SS..Hα-helixtrans-63.4-44.4175.6-64.4165.5000110.7S3 Y4 K9 S10 E11S3-I7 WeakPolarHBondContact O-CG1 3.29Å; S3-I7 PolarHBondContact O-N 3.47Å; Y4-I7 PolarHBondContact O-N 3Å; I7-K9 PolarHBondContact O-N 3.36Å; I7-S10 PolarHBondContact O-N 2.87Å; I7-S10 PolarHBondContact O-OG 3.28Å; I7-S10 VanDerWaalsContact O-OG 3.04Å; I7-E11 HydrophobicContact CG2-CG 4.13Å; I7-E11 WeakPolarHBondContact O-CB 3.43Å; I7-E11 WeakPolarHBondContact O-CG 3.44Å; I7-E11 PolarHBondContact O-N 3.39Å
8I77.3Confident74.4Confident49 Ų4970.9 Ų70.925%0.25136%0.361SS..Hα-helixtrans-59.7-39.1174.7-67.1166.2000110.5Y4 S10 L12 V37 V40 I45Y4-I8 VanDerWaalsContact O-CG1 3.32Å; Y4-I8 WeakPolarHBondContact O-CG1 3.48Å; Y4-I8 PolarHBondContact O-N 2.84Å; I8-S10 PolarHBondContact O-N 3.21Å; I8-L12 HydrophobicContact CG2-CB 4.4Å; I8-L12 HydrophobicContact CG2-CD1 3.8Å; I8-L12 WeakPolarHBondContact O-CB 3.37Å; I8-L12 PolarHBondContact O-N 3.28Å; I8-L12 VanDerWaalsContact O-N 3.16Å; I8-V37 HydrophobicContact CG2-CG2 4.36Å; I8-V40 HydrophobicContact CG2-CG1 4.35Å; I8-I45 HydrophobicContact CD1-CD1 4.26Å
9K80.8Confident74.1Confident82 Ų8274.9 Ų74.936%0.35738%0.376SS..Hα-helixtrans-61.4-42.9177-171.4175.7154.6173.40113L5 Y6 I7 P13 N34 V37L5-K9 WeakPolarHBondContact O-CB 3.47Å; L5-K9 PolarHBondContact O-N 3.41Å; Y6-K9 VanDerWaalsContact O-CB 3.25Å; Y6-K9 WeakPolarHBondContact O-CB 3.3Å; Y6-K9 PolarHBondContact O-N 3.36Å; Y6-K9 VanDerWaalsContact O-N 3.17Å; I7-K9 PolarHBondContact O-N 3.36Å; K9-P13 VanDerWaalsContact O-CD 3.32Å; K9-P13 WeakPolarHBondContact O-CD 3.39Å; K9-N34 WeakPolarHBondContact CE-OD1 3.46Å; K9-N34 PolarHBondContact NZ-OD1 3.42Å; K9-V37 HydrophobicContact CB-CG2 3.38Å; K9-V37 HydrophobicContact CG-CG2 3.8Å
10S75.8Confident73.9Confident44 Ų4475.4 Ų75.431%0.30838%0.379SS..Hα-helixtrans-78.8-42.6-175.857.10000112Y6 I7 I8 L14Y6-S10 PolarHBondContact O-N 3.26Å; Y6-S10 PolarHBondContact O-OG 2.84Å; I7-S10 PolarHBondContact O-N 2.87Å; I7-S10 PolarHBondContact O-OG 3.28Å; I7-S10 VanDerWaalsContact O-OG 3.04Å; I8-S10 PolarHBondContact O-N 3.21Å; S10-L14 WeakPolarHBondContact O-CD1 3.38Å
11E78.2Confident73.5Confident34 Ų3477 Ų7716%0.15939%0.389CS..Hα-helixtrans-87-38.3-170.2-63.9-55129.800113.7I7 L14 V15I7-E11 HydrophobicContact CG2-CG 4.13Å; I7-E11 WeakPolarHBondContact O-CB 3.43Å; I7-E11 WeakPolarHBondContact O-CG 3.44Å; I7-E11 PolarHBondContact O-N 3.39Å; E11-L14 WeakPolarHBondContact O-CA 3.49Å; E11-L14 WeakPolarHBondContact O-CB 3.27Å; E11-L14 PolarHBondContact O-N 2.93Å; E11-V15 WeakPolarHBondContact O-CG2 3.36Å; E11-V15 PolarHBondContact O-N 3.39Å; E11-V15 VanDerWaalsContact O-N 3.07Å
12L77.4Confident73.5Confident44 Ų4472.3 Ų72.323%0.2337%0.367CS..Hα-helixtrans-61.5-39.7-170.4-150.2168.7000113.6I8 L14 V15 I16 L36 V40I8-L12 HydrophobicContact CG2-CB 4.4Å; I8-L12 HydrophobicContact CG2-CD1 3.8Å; I8-L12 WeakPolarHBondContact O-CB 3.37Å; I8-L12 PolarHBondContact O-N 3.28Å; I8-L12 VanDerWaalsContact O-N 3.16Å; L12-L14 VanDerWaalsContact C-N 3.28Å; L12-L14 PolarHBondContact O-N 3.41Å; L12-V15 PolarHBondContact O-N 3.2Å; L12-V15 VanDerWaalsContact O-N 3.16Å; L12-I16 HydrophobicContact CD2-CD1 3.28Å; L12-I16 HydrophobicContact CD2-CG1 3.63Å; L12-I16 PolarHBondContact O-N 3.25Å; L12-L36 HydrophobicContact CB-CD2 3.81Å; L12-L36 HydrophobicContact CD1-CD2 3.3Å; L12-L36 HydrophobicContact CD2-CD1 4.44Å; L12-L36 HydrophobicContact CD2-CD2 3.18Å; L12-L36 HydrophobicContact CD2-CG 4.38Å; L12-L36 HydrophobicContact CG-CD2 3.54Å; L12-V40 HydrophobicContact CD1-CG2 3.69Å
13P74.4Confident72.8Confident18 Ų1876.4 Ų76.412%0.11738%0.375CS..Hα-helixtrans-58.1-38.6172.2-24.535.2000113.1K9 I16 Q17K9-P13 VanDerWaalsContact O-CD 3.32Å; K9-P13 WeakPolarHBondContact O-CD 3.39Å; P13-I16 PolarHBondContact O-N 3.21Å; P13-Q17 WeakPolarHBondContact O-CB 3.5Å; P13-Q17 PolarHBondContact O-N 2.64Å
14L70.7Confident71.9Confident48 Ų4880.7 Ų80.725%0.25139%0.388SS..Hα-helixtrans-66.9-38.7176.9-76.590.3000111.3S10 E11 L12 Q17 T18S10-L14 WeakPolarHBondContact O-CD1 3.38Å; E11-L14 WeakPolarHBondContact O-CA 3.49Å; E11-L14 WeakPolarHBondContact O-CB 3.27Å; E11-L14 PolarHBondContact O-N 2.93Å; L12-L14 VanDerWaalsContact C-N 3.28Å; L12-L14 PolarHBondContact O-N 3.41Å; L14-Q17 PolarHBondContact O-N 3.04Å; L14-T18 WeakPolarHBondContact O-CG2 3.41Å; L14-T18 PolarHBondContact O-N 2.94Å; L14-T18 PolarHBondContact O-OG1 3.33Å; L14-T18 VanDerWaalsContact O-OG1 3.06Å
15V73.4Confident70.7Confident21 Ų2183.3 Ų83.313%0.12740%0.403CS..Hα-helixtrans-62.1-47.9176.2-174.50000110.9E11 L12 Q17 T18 F19 R214 V215E11-V15 WeakPolarHBondContact O-CG2 3.36Å; E11-V15 PolarHBondContact O-N 3.39Å; E11-V15 VanDerWaalsContact O-N 3.07Å; L12-V15 PolarHBondContact O-N 3.2Å; L12-V15 VanDerWaalsContact O-N 3.16Å; V15-Q17 VanDerWaalsContact C-N 3.33Å; V15-Q17 PolarHBondContact O-N 3.31Å; V15-T18 WeakPolarHBondContact CA-OG1 3.11Å; V15-T18 PolarHBondContact O-N 3.48Å; V15-T18 PolarHBondContact O-OG1 2.85Å; V15-F19 WeakPolarHBondContact O-CB 3.2Å; V15-F19 PolarHBondContact O-N 3.03Å; V15-R214 HydrophobicContact CG2-CB 3.86Å; V15-V215 HydrophobicContact CG1-CG2 3.62Å
16I71Confident69.7Low39 Ų3982.4 Ų82.420%0.240%0.4CS..Hα-helixtrans-62.1-42.3179-70.3170.8000111.1L12 P13 T18 F19 L20 Y30 M31 L36L12-I16 HydrophobicContact CD2-CD1 3.28Å; L12-I16 HydrophobicContact CD2-CG1 3.63Å; L12-I16 PolarHBondContact O-N 3.25Å; P13-I16 PolarHBondContact O-N 3.21Å; I16-T18 VanDerWaalsContact C-N 3.34Å; I16-T18 PolarHBondContact O-N 3.29Å; I16-F19 PolarHBondContact O-N 3.47Å; I16-L20 HydrophobicContact CG2-CD1 3.59Å; I16-L20 HydrophobicContact CG2-CG 4.26Å; I16-L20 WeakPolarHBondContact O-CB 3.33Å; I16-L20 WeakPolarHBondContact O-CG 3.5Å; I16-L20 PolarHBondContact O-N 2.92Å; I16-Y30 HydrophobicContact CG2-CD2 4.1Å; I16-M31 HydrophobicContact CG2-CE 4.41Å; I16-L36 HydrophobicContact CD1-CD1 3.31Å; I16-L36 HydrophobicContact CD1-CD2 4.21Å; I16-L36 HydrophobicContact CD1-CG 4.36Å
17Q68.8Low68.6Low72 Ų7280.6 Ų80.634%0.33641%0.411SS..Hα-helixtrans-59.5-46.1177.2-174.5177.84.800111.6P13 L14 V15 N21 M31P13-Q17 WeakPolarHBondContact O-CB 3.5Å; P13-Q17 PolarHBondContact O-N 2.64Å; L14-Q17 PolarHBondContact O-N 3.04Å; V15-Q17 VanDerWaalsContact C-N 3.33Å; V15-Q17 PolarHBondContact O-N 3.31Å; Q17-N21 PolarHBondContact O-N 3.25Å; Q17-M31 HydrophobicContact CB-CE 3.83Å; Q17-M31 HydrophobicContact CB-SD 4.27Å; Q17-M31 HydrophobicContact CG-CE 4.15Å
18T67.6Low68Low29 Ų2979.4 Ų79.418%0.17841%0.406CS..Hα-helixtrans-67.8-34.5177.151.30000112.9L14 V15 I16 L211L14-T18 WeakPolarHBondContact O-CG2 3.41Å; L14-T18 PolarHBondContact O-N 2.94Å; L14-T18 PolarHBondContact O-OG1 3.33Å; L14-T18 VanDerWaalsContact O-OG1 3.06Å; V15-T18 WeakPolarHBondContact CA-OG1 3.11Å; V15-T18 PolarHBondContact O-N 3.48Å; V15-T18 PolarHBondContact O-OG1 2.85Å; I16-T18 VanDerWaalsContact C-N 3.34Å; I16-T18 PolarHBondContact O-N 3.29Å; T18-L211 VanDerWaalsContact OG1-CD1 3.24Å; T18-L211 WeakPolarHBondContact OG1-CD1 3.41Å
19F70.1Confident67.7Low147 Ų14785.2 Ų85.265%0.64543%0.425SS*.Hα-helixtrans-73.7-34.5-179.9-164.2-92.4000112.9V15 I16 N21 L211V15-F19 WeakPolarHBondContact O-CB 3.2Å; V15-F19 PolarHBondContact O-N 3.03Å; I16-F19 PolarHBondContact O-N 3.47Å; F19-N21 VanDerWaalsContact C-N 3.32Å; F19-L211 HydrophobicContact CB-CD1 4.38Å; F19-L211 HydrophobicContact CD2-CD1 4.42Å; F19-L211 HydrophobicContact CD2-CD2 4.15Å
20L68.9Low67.1Low84 Ų8483.8 Ų83.844%0.4442%0.418SS..Hα-helixtrans-85.2-4.2178.9-66.7174000113.5I16 L22 Y30I16-L20 HydrophobicContact CG2-CD1 3.59Å; I16-L20 HydrophobicContact CG2-CG 4.26Å; I16-L20 WeakPolarHBondContact O-CB 3.33Å; I16-L20 WeakPolarHBondContact O-CG 3.5Å; I16-L20 PolarHBondContact O-N 2.92Å; L20-L22 HydrophobicContact CB-CD1 3.73Å; L20-L22 HydrophobicContact CB-CG 3.79Å; L20-L22 HydrophobicContact CD1-CD1 3.97Å; L20-L22 HydrophobicContact CG-CD1 4.5Å; L20-L22 PolarHBondContact O-N 3.44Å; L20-L22 VanDerWaalsContact O-N 3.15Å; L20-Y30 HydrophobicContact CD1-CD2 4.43Å; L20-Y30 HydrophobicContact CD1-CE2 3.99Å
21N65Low66.7Low110 Ų11083.5 Ų83.559%0.58841%0.412SS*.THydrogen-bonded Turntrans51.835.4-179.5-149.158.6000112.9Q17 F19 F206Q17-N21 PolarHBondContact O-N 3.25Å; F19-N21 VanDerWaalsContact C-N 3.32Å; N21-F206 VanDerWaalsContact OD1-CD1 3.29Å; N21-F206 WeakPolarHBondContact OD1-CD1 3.45Å; N21-F206 WeakPolarHBondContact OD1-CE1 3.44Å
22L62.8Low66.5Low63 Ų6385.3 Ų85.333%0.3342%0.422SS..  trans-91.3115.9-177.1-67.3171.3000109.8L20 E24 Y30 M31L20-L22 HydrophobicContact CB-CD1 3.73Å; L20-L22 HydrophobicContact CB-CG 3.79Å; L20-L22 HydrophobicContact CD1-CD1 3.97Å; L20-L22 HydrophobicContact CG-CD1 4.5Å; L20-L22 PolarHBondContact O-N 3.44Å; L20-L22 VanDerWaalsContact O-N 3.15Å; L22-E24 VanDerWaalsContact C-N 3.31Å; L22-E24 PolarHBondContact O-N 2.94Å; L22-Y30 HydrophobicContact CD1-CE2 4.4Å; L22-M31 HydrophobicContact CD1-CE 4.36Å
23E58Low66.2Low185 Ų18583.7 Ų83.786%0.86442%0.416SS*.  trans-77.5-15.7-175.8-145.3163.4164.800112.9
24E55.4Low66.4Low154 Ų15486.8 Ų86.872%0.7243%0.432SS*.SBendtrans-118.1143.6-179.4-67.8-156.6158.200113.8L22 T26L22-E24 VanDerWaalsContact C-N 3.31Å; L22-E24 PolarHBondContact O-N 2.94Å; E24-T26 PolarHBondContact O-N 3.21Å
25K51.8Low66.9Low203 Ų20391.4 Ų91.488%0.88345%0.447SS*.  trans-63.782.8165.8-92.2-178.9171.4171.30109.1
26T55.5Low67.1Low50 Ų5090.9 Ų90.931%0.30744%0.444SS..  trans-71133.7164.258.90000108.6E24 D28 Y30E24-T26 PolarHBondContact O-N 3.21Å; T26-D28 WeakPolarHBondContact CB-OD2 2.98Å; T26-D28 PolarHBondContact O-N 3.28Å; T26-D28 PolarHBondContact OG1-OD2 3.08Å; T26-Y30 PolarHBondContact OG1-OH 2.7Å
27S57.2Low67.6Low127 Ų12790.2 Ų90.289%0.88844%0.441SS*.  trans-74.938.2179.556.60000112
28D68.8Low68.2Low64 Ų6491.6 Ų91.634%0.34245%0.45SS..  trans-84.3150.3-175.8-66.5-46000110.8T26 Y30 M31T26-D28 WeakPolarHBondContact CB-OD2 2.98Å; T26-D28 PolarHBondContact O-N 3.28Å; T26-D28 PolarHBondContact OG1-OD2 3.08Å; D28-Y30 HydrophobicContact CB-CD1 3.52Å; D28-Y30 HydrophobicContact CB-CE1 3.14Å; D28-Y30 HydrophobicContact CB-CE2 4.33Å; D28-Y30 HydrophobicContact CB-CG 4.27Å; D28-Y30 PolarHBondContact O-N 3.36Å; D28-Y30 PolarHBondContact OD2-OH 3.04Å; D28-Y30 VanDerWaalsContact OD2-OH 3.07Å; D28-M31 PolarHBondContact O-N 3.25Å
29W71.2Confident68.9Low171 Ų17194.4 Ų94.465%0.64846%0.463SS*.G310 helixtrans-55.9-27-176.168.3-87.2000113.4N32W29-N32 PolarHBondContact O-N 3.18Å
30Y67.3Low69.5Low53 Ų5388.4 Ų88.421%0.20844%0.439CS..G310 helixtrans-79-14.6-179.562.5-100.8000114.3I16 L20 L22 T26 D28 L36I16-Y30 HydrophobicContact CG2-CD2 4.1Å; L20-Y30 HydrophobicContact CD1-CD2 4.43Å; L20-Y30 HydrophobicContact CD1-CE2 3.99Å; L22-Y30 HydrophobicContact CD1-CE2 4.4Å; T26-Y30 PolarHBondContact OG1-OH 2.7Å; D28-Y30 HydrophobicContact CB-CD1 3.52Å; D28-Y30 HydrophobicContact CB-CE1 3.14Å; D28-Y30 HydrophobicContact CB-CE2 4.33Å; D28-Y30 HydrophobicContact CB-CG 4.27Å; D28-Y30 PolarHBondContact O-N 3.36Å; D28-Y30 PolarHBondContact OD2-OH 3.04Å; D28-Y30 VanDerWaalsContact OD2-OH 3.07Å; Y30-L36 WeakPolarHBondContact O-CD1 3.07Å
31M66.8Low70.1Confident37 Ų3786.1 Ų86.118%0.18243%0.43CS..G310 helixtrans-90.2-10.1173.5-70.1-62.1-173.800112.6I16 Q17 L22 D28 G33I16-M31 HydrophobicContact CG2-CE 4.41Å; Q17-M31 HydrophobicContact CB-CE 3.83Å; Q17-M31 HydrophobicContact CB-SD 4.27Å; Q17-M31 HydrophobicContact CG-CE 4.15Å; L22-M31 HydrophobicContact CD1-CE 4.36Å; D28-M31 PolarHBondContact O-N 3.25Å; M31-G33 PolarHBondContact O-N 3.48Å
32N74.9Confident71Confident72 Ų7284.9 Ų84.939%0.38543%0.426SS..  trans-87.1103.2-178.5-169.2-19.6000110.3W29 N34 Y35 L36W29-N32 PolarHBondContact O-N 3.18Å; N32-N34 PolarHBondContact O-N 3.15Å; N32-N34 PolarHBondContact OD1-N 3.23Å; N32-Y35 HydrophobicContact CB-CD2 3.87Å; N32-Y35 PolarHBondContact O-N 3.43Å; N32-L36 PolarHBondContact O-N 3.42Å
33G71.6Confident71.9Confident10 Ų1085.8 Ų85.810%0.10343%0.434CS..Hα-helixtrans-53-26.3-176.900000114.6M31 V37M31-G33 PolarHBondContact O-N 3.48Å; G33-V37 WeakPolarHBondContact O-CB 3.43Å; G33-V37 WeakPolarHBondContact O-CG2 3.12Å; G33-V37 PolarHBondContact O-N 3.46Å
34N78.8Confident73Confident84 Ų8481.5 Ų81.545%0.44942%0.416SS..Hα-helixtrans-65.6-48.2175.5-77.7-10.1000112.8K9 N32 L36 I38K9-N34 WeakPolarHBondContact CE-OD1 3.46Å; K9-N34 PolarHBondContact NZ-OD1 3.42Å; N32-N34 PolarHBondContact O-N 3.15Å; N32-N34 PolarHBondContact OD1-N 3.23Å; N34-L36 VanDerWaalsContact C-N 3.27Å; N34-L36 PolarHBondContact O-N 3.36Å; N34-I38 WeakPolarHBondContact O-CD1 3.46Å; N34-I38 VanDerWaalsContact O-CG1 3.29Å; N34-I38 WeakPolarHBondContact O-CG1 3.18Å; N34-I38 PolarHBondContact O-N 3.25Å
35Y81.1Confident74.3Confident144 Ų14477.2 Ų77.257%0.56540%0.398SS*.Hα-helixtrans-67.7-35.5179.1-72.3-78000111.2N32 I38 L39N32-Y35 HydrophobicContact CB-CD2 3.87Å; N32-Y35 PolarHBondContact O-N 3.43Å; Y35-I38 WeakPolarHBondContact O-CB 3.33Å; Y35-I38 PolarHBondContact O-N 3.45Å; Y35-L39 PolarHBondContact O-N 3.33Å
36L77.5Confident75.8Confident11 Ų1172 Ų726%0.05838%0.379CS..Hα-helixtrans-75.1-36.1-174-155.1131.1000112.6L12 I16 Y30 N32 N34 I38 L39 V40L12-L36 HydrophobicContact CB-CD2 3.81Å; L12-L36 HydrophobicContact CD1-CD2 3.3Å; L12-L36 HydrophobicContact CD2-CD1 4.44Å; L12-L36 HydrophobicContact CD2-CD2 3.18Å; L12-L36 HydrophobicContact CD2-CG 4.38Å; L12-L36 HydrophobicContact CG-CD2 3.54Å; I16-L36 HydrophobicContact CD1-CD1 3.31Å; I16-L36 HydrophobicContact CD1-CD2 4.21Å; I16-L36 HydrophobicContact CD1-CG 4.36Å; Y30-L36 WeakPolarHBondContact O-CD1 3.07Å; N32-L36 PolarHBondContact O-N 3.42Å; N34-L36 VanDerWaalsContact C-N 3.27Å; N34-L36 PolarHBondContact O-N 3.36Å; L36-I38 VanDerWaalsContact C-N 3.31Å; L36-I38 PolarHBondContact O-N 3.42Å; L36-L39 PolarHBondContact O-N 2.95Å; L36-V40 HydrophobicContact CD2-CG2 4.25Å; L36-V40 WeakPolarHBondContact O-CB 3.46Å; L36-V40 WeakPolarHBondContact O-CG2 3.46Å; L36-V40 PolarHBondContact O-N 3.37Å
37V79.9Confident77Confident25 Ų2572.3 Ų72.315%0.15238%0.382CS..Hα-helixtrans-62.5-40.3169.3171.80000111.3I8 K9 G33 S41I8-V37 HydrophobicContact CG2-CG2 4.36Å; K9-V37 HydrophobicContact CB-CG2 3.38Å; K9-V37 HydrophobicContact CG-CG2 3.8Å; G33-V37 WeakPolarHBondContact O-CB 3.43Å; G33-V37 WeakPolarHBondContact O-CG2 3.12Å; G33-V37 PolarHBondContact O-N 3.46Å; V37-S41 WeakPolarHBondContact O-CB 3.29Å; V37-S41 PolarHBondContact O-N 3.34Å; V37-S41 PolarHBondContact O-OG 3.02Å
38I82.3Confident77.9Confident101 Ų10171.4 Ų71.452%0.51837%0.367SS..Hα-helixtrans-61.6-48.8176.1-66.2165.6000109.4N34 Y35 L36 V40 S41 V42N34-I38 WeakPolarHBondContact O-CD1 3.46Å; N34-I38 VanDerWaalsContact O-CG1 3.29Å; N34-I38 WeakPolarHBondContact O-CG1 3.18Å; N34-I38 PolarHBondContact O-N 3.25Å; Y35-I38 WeakPolarHBondContact O-CB 3.33Å; Y35-I38 PolarHBondContact O-N 3.45Å; L36-I38 VanDerWaalsContact C-N 3.31Å; L36-I38 PolarHBondContact O-N 3.42Å; I38-V40 PolarHBondContact O-N 3.24Å; I38-S41 PolarHBondContact O-N 3.37Å; I38-S41 PolarHBondContact O-OG 3.25Å; I38-V42 WeakPolarHBondContact O-CG2 3.31Å; I38-V42 PolarHBondContact O-N 3.14Å
39L83.3Confident78.2Confident87 Ų8772.2 Ų72.246%0.45538%0.382SS..Hα-helixtrans-56.7-52.5177.9-173.5104.3000111.8Y35 L36 S41 V42 T43Y35-L39 PolarHBondContact O-N 3.33Å; L36-L39 PolarHBondContact O-N 2.95Å; L39-S41 VanDerWaalsContact C-N 3.33Å; L39-S41 PolarHBondContact O-N 3.44Å; L39-V42 PolarHBondContact O-N 2.98Å; L39-T43 WeakPolarHBondContact O-CB 3.1Å; L39-T43 WeakPolarHBondContact O-CG2 3.32Å; L39-T43 PolarHBondContact O-N 3.31Å; L39-T43 PolarHBondContact O-OG1 3.44Å
40V80.9Confident78.4Confident21 Ų2170.3 Ų70.313%0.12738%0.384CS..Hα-helixtrans-63.9-38.7-179.3171.10000111.6I8 L12 L36 I38 V42 I44 I45I8-V40 HydrophobicContact CG2-CG1 4.35Å; L12-V40 HydrophobicContact CD1-CG2 3.69Å; L36-V40 HydrophobicContact CD2-CG2 4.25Å; L36-V40 WeakPolarHBondContact O-CB 3.46Å; L36-V40 WeakPolarHBondContact O-CG2 3.46Å; L36-V40 PolarHBondContact O-N 3.37Å; I38-V40 PolarHBondContact O-N 3.24Å; V40-V42 PolarHBondContact O-N 3.47Å; V40-I44 HydrophobicContact CG1-CD1 4.36Å; V40-I44 WeakPolarHBondContact O-CB 3.4Å; V40-I44 PolarHBondContact O-N 3.47Å; V40-I45 PolarHBondContact O-N 3.44Å
41S81.4Confident78.5Confident36 Ų3673.3 Ų73.325%0.25240%0.401SS..Iπ-helixtrans-64.3-41.7178.572.70000112.1V37 I38 L39 I45 L46V37-S41 WeakPolarHBondContact O-CB 3.29Å; V37-S41 PolarHBondContact O-N 3.34Å; V37-S41 PolarHBondContact O-OG 3.02Å; I38-S41 PolarHBondContact O-N 3.37Å; I38-S41 PolarHBondContact O-OG 3.25Å; L39-S41 VanDerWaalsContact C-N 3.33Å; L39-S41 PolarHBondContact O-N 3.44Å; S41-I45 PolarHBondContact O-N 2.86Å; S41-L46 VanDerWaalsContact O-CB 3.3Å; S41-L46 WeakPolarHBondContact O-CB 3.13Å; S41-L46 PolarHBondContact O-N 3.04Å
42V84.3Confident78.3Confident84 Ų8483.1 Ų83.151%0.50944%0.436SS..Iπ-helixtrans-76.4-37.6-179.1174.60000112I38 L39 V40 P47I38-V42 WeakPolarHBondContact O-CG2 3.31Å; I38-V42 PolarHBondContact O-N 3.14Å; L39-V42 PolarHBondContact O-N 2.98Å; V40-V42 PolarHBondContact O-N 3.47Å; V42-P47 WeakPolarHBondContact O-CD 3.32Å
43T82.5Confident77.7Confident82 Ų8287.5 Ų87.550%0.50345%0.454SS..Iπ-helixtrans-89.2-28.8-173.254.30000114.4L39 P47L39-T43 WeakPolarHBondContact O-CB 3.1Å; L39-T43 WeakPolarHBondContact O-CG2 3.32Å; L39-T43 PolarHBondContact O-N 3.31Å; L39-T43 PolarHBondContact O-OG1 3.44Å; T43-P47 WeakPolarHBondContact O-CG 3.5Å
44I81.5Confident77.4Confident95 Ų9591 Ų9149%0.48747%0.47SS..Iπ-helixtrans-117.7-54.7-175.1-55.6-178.7000111.1V40 P47 L48V40-I44 HydrophobicContact CG1-CD1 4.36Å; V40-I44 WeakPolarHBondContact O-CB 3.4Å; V40-I44 PolarHBondContact O-N 3.47Å; I44-P47 WeakPolarHBondContact O-CD 3.42Å; I44-P47 WeakPolarHBondContact O-CG 3.47Å; I44-L48 WeakPolarHBondContact O-CB 3.42Å; I44-L48 PolarHBondContact O-N 3.24Å
45I81.8Confident76.7Confident65 Ų6589.1 Ų89.133%0.33347%0.471SS..Iπ-helixtrans-70.3-45.1-171.1-55.5178.8000111.3L5 I8 V40 S41 L48 A49L5-I45 HydrophobicContact CD2-CD1 3.42Å; L5-I45 VanDerWaalsContact CD2-CD1 3.42Å; I8-I45 HydrophobicContact CD1-CD1 4.26Å; V40-I45 PolarHBondContact O-N 3.44Å; S41-I45 PolarHBondContact O-N 2.86Å; I45-L48 PolarHBondContact O-N 3.36Å; I45-A49 VanDerWaalsContact O-CB 3.27Å; I45-A49 WeakPolarHBondContact O-CB 3.3Å; I45-A49 PolarHBondContact O-N 3.46Å
46L82.8Confident76.1Confident92 Ų9290.4 Ų90.448%0.48248%0.476SS..Hα-helixtrans-61.9-49.4-179.8-177.166000113.2S41 L48 A49 L50S41-L46 VanDerWaalsContact O-CB 3.3Å; S41-L46 WeakPolarHBondContact O-CB 3.13Å; S41-L46 PolarHBondContact O-N 3.04Å; L46-L48 VanDerWaalsContact C-N 3.34Å; L46-L48 PolarHBondContact O-N 3.32Å; L46-A49 PolarHBondContact O-N 3.17Å; L46-L50 HydrophobicContact CD1-CD1 4.22Å; L46-L50 HydrophobicContact CG-CD1 4.03Å; L46-L50 WeakPolarHBondContact O-CB 3.25Å; L46-L50 WeakPolarHBondContact O-CD1 3.49Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.01Å
47P82.3Confident75.6Confident58 Ų5894.8 Ų94.838%0.37750%0.499SS..Hα-helixtrans-65.2-35.4176.119.3-27.8000112.9V42 T43 I44 L50 M51V42-P47 WeakPolarHBondContact O-CD 3.32Å; T43-P47 WeakPolarHBondContact O-CG 3.5Å; I44-P47 WeakPolarHBondContact O-CD 3.42Å; I44-P47 WeakPolarHBondContact O-CG 3.47Å; P47-L50 PolarHBondContact O-N 3.16Å; P47-M51 PolarHBondContact O-N 2.99Å
48L75.1Confident75.3Confident108 Ų10896.2 Ų96.257%0.56552%0.519SS*.Hα-helixtrans-65-41.2173.1-107.263.4000112.1I44 I45 L46 L50 M51I44-L48 WeakPolarHBondContact O-CB 3.42Å; I44-L48 PolarHBondContact O-N 3.24Å; I45-L48 PolarHBondContact O-N 3.36Å; L46-L48 VanDerWaalsContact C-N 3.34Å; L46-L48 PolarHBondContact O-N 3.32Å; L48-L50 VanDerWaalsContact C-N 3.26Å; L48-L50 PolarHBondContact O-N 3.49Å; L48-M51 HydrophobicContact CD1-CE 3.93Å; L48-M51 HydrophobicContact CG-CE 4.17Å; L48-M51 PolarHBondContact O-N 2.98Å
49A74.2Confident75.1Confident80 Ų80100 Ų10066%0.66153%0.528SS*.Hα-helixtrans-68.3-26.2177.700000112.8I45 L46I45-A49 VanDerWaalsContact O-CB 3.27Å; I45-A49 WeakPolarHBondContact O-CB 3.3Å; I45-A49 PolarHBondContact O-N 3.46Å; L46-A49 PolarHBondContact O-N 3.17Å
50L76.7Confident75Confident131 Ų13198.7 Ų98.769%0.68653%0.526SS*.Hα-helixtrans-79.3-16.2174.9-79160.4000113.1L46 P47 L48 R52L46-L50 HydrophobicContact CD1-CD1 4.22Å; L46-L50 HydrophobicContact CG-CD1 4.03Å; L46-L50 WeakPolarHBondContact O-CB 3.25Å; L46-L50 WeakPolarHBondContact O-CD1 3.49Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.01Å; P47-L50 PolarHBondContact O-N 3.16Å; L48-L50 VanDerWaalsContact C-N 3.26Å; L48-L50 PolarHBondContact O-N 3.49Å; L50-R52 PolarHBondContact O-N 3.2Å
51M69Low75Confident116 Ų116101 Ų10157%0.57154%0.544SS*.  trans-74.7112.7175.7-74.3-158.4-68.700110.9P47 L48 Q53P47-M51 PolarHBondContact O-N 2.99Å; L48-M51 HydrophobicContact CD1-CE 3.93Å; L48-M51 HydrophobicContact CG-CE 4.17Å; L48-M51 PolarHBondContact O-N 2.98Å; M51-Q53 VanDerWaalsContact C-N 3.31Å; M51-Q53 PolarHBondContact O-N 3.03Å
52R62.4Low75.2Confident244 Ų244101.3 Ų101.392%0.92155%0.552SS**  trans-86.38.4-171.1-146.1177.1114.7130.32.2114.8L50L50-R52 PolarHBondContact O-N 3.2Å
53Q62.9Low75.3Confident163 Ų163104.6 Ų104.676%0.76256%0.559SS**  trans-113.197.3-170-133.1144.5-11.200110.2M51 G55 Y56M51-Q53 VanDerWaalsContact C-N 3.31Å; M51-Q53 PolarHBondContact O-N 3.03Å; Q53-G55 PolarHBondContact O-N 2.93Å; Q53-G55 VanDerWaalsContact O-N 3.08Å; Q53-Y56 PolarHBondContact O-N 3.33Å
54L65.1Low75.4Confident83 Ų83103.4 Ų103.444%0.43556%0.555SS.*G310 helixtrans-59.3-19-179-86.599.6000113.8Y56 L57 P149 E153L54-Y56 PolarHBondContact O-N 3.38Å; L54-L57 WeakPolarHBondContact O-CB 3.23Å; L54-L57 PolarHBondContact O-N 3.04Å; L54-P149 HydrophobicContact CD2-CB 3.91Å; L54-E153 HydrophobicContact CB-CG 4.11Å; L54-E153 HydrophobicContact CD2-CG 4.38Å
55G64Low75.7Confident46 Ų46102.7 Ų102.747%0.47455%0.551SS.*G310 helixtrans-61.9-26.1177.600000114.7Q53 L57Q53-G55 PolarHBondContact O-N 2.93Å; Q53-G55 VanDerWaalsContact O-N 3.08Å; G55-L57 VanDerWaalsContact C-N 3.27Å; G55-L57 PolarHBondContact O-N 3.06Å
56Y67.4Low76Confident170 Ų170103.4 Ų103.467%0.66756%0.562SS**G310 helixtrans-75.7-17.7176-122.7-91.9000112.9Q53 L54 G58 Y59 S60Q53-Y56 PolarHBondContact O-N 3.33Å; L54-Y56 PolarHBondContact O-N 3.38Å; Y56-G58 VanDerWaalsContact C-N 3.27Å; Y56-G58 PolarHBondContact O-N 3Å; Y56-Y59 PolarHBondContact O-N 3.46Å; Y56-S60 PolarHBondContact O-N 3.36Å
57L68.4Low76.2Confident104 Ų10499.8 Ų99.855%0.54554%0.544SS..Hα-helixtrans-69.7-25.8-175.9-153.669.8000112.4L54 G55 S60 S61L54-L57 WeakPolarHBondContact O-CB 3.23Å; L54-L57 PolarHBondContact O-N 3.04Å; G55-L57 VanDerWaalsContact C-N 3.27Å; G55-L57 PolarHBondContact O-N 3.06Å; L57-S60 WeakPolarHBondContact CA-OG 3.39Å; L57-S60 PolarHBondContact O-OG 3.13Å; L57-S61 VanDerWaalsContact O-CB 3.3Å; L57-S61 WeakPolarHBondContact O-CB 3.48Å; L57-S61 PolarHBondContact O-N 2.95Å
58G72.4Confident76.5Confident55 Ų55101.5 Ų101.557%0.56755%0.549SS*.Hα-helixtrans-63.5-39.3173.600000112.8Y56 G62Y56-G58 VanDerWaalsContact C-N 3.27Å; Y56-G58 PolarHBondContact O-N 3Å; G58-G62 PolarHBondContact O-N 3.28Å; G58-G62 VanDerWaalsContact O-N 3.1Å
59Y77.7Confident77.1Confident179 Ų17999.3 Ų99.370%0.70254%0.539SS*.Hα-helixtrans-71.3-43.9179.1-68.4-78.9000111.9Y56 S61 G62 F63Y56-Y59 PolarHBondContact O-N 3.46Å; Y59-S61 VanDerWaalsContact C-N 3.32Å; Y59-S61 PolarHBondContact O-N 3.29Å; Y59-G62 PolarHBondContact O-N 3.44Å; Y59-F63 PolarHBondContact O-N 3.44Å; Y59-F63 VanDerWaalsContact O-N 3.08Å
60S82Confident77.8Confident61 Ų6199.3 Ų99.343%0.42752%0.524SS..Hα-helixtrans-64-37.817656.10000111.9Y56 L57 G62 F63 S64Y56-S60 PolarHBondContact O-N 3.36Å; L57-S60 WeakPolarHBondContact CA-OG 3.39Å; L57-S60 PolarHBondContact O-OG 3.13Å; S60-G62 VanDerWaalsContact C-N 3.35Å; S60-F63 PolarHBondContact O-N 3.01Å; S60-S64 PolarHBondContact O-N 2.87Å; S60-S64 PolarHBondContact O-OG 3.45Å
61S81.8Confident78.3Confident70 Ų7095.2 Ų95.249%0.4950%0.501SS..Hα-helixtrans-66.1-35.7176-178.10000112.7L57 Y59 S64 L65L57-S61 VanDerWaalsContact O-CB 3.3Å; L57-S61 WeakPolarHBondContact O-CB 3.48Å; L57-S61 PolarHBondContact O-N 2.95Å; Y59-S61 VanDerWaalsContact C-N 3.32Å; Y59-S61 PolarHBondContact O-N 3.29Å; S61-S64 WeakPolarHBondContact CA-OG 3.49Å; S61-S64 PolarHBondContact O-OG 2.94Å; S61-L65 WeakPolarHBondContact O-CB 3.44Å; S61-L65 PolarHBondContact O-N 3.34Å
62G85.4Confident79.1Confident41 Ų4190.7 Ų90.742%0.42348%0.479SS..Hα-helixtrans-66.2-43.4174.800000112G58 Y59 S60 L65 S66G58-G62 PolarHBondContact O-N 3.28Å; G58-G62 VanDerWaalsContact O-N 3.1Å; Y59-G62 PolarHBondContact O-N 3.44Å; S60-G62 VanDerWaalsContact C-N 3.35Å; G62-L65 PolarHBondContact O-N 2.97Å; G62-S66 PolarHBondContact O-N 3.24Å
63F85.9Confident80.3Confident153 Ų15383.8 Ų83.867%0.67146%0.46SS*.Hα-helixtrans-60.9-46.3174.5179.8-100.5000111.8Y59 S60 L65 S66 C67Y59-F63 PolarHBondContact O-N 3.44Å; Y59-F63 VanDerWaalsContact O-N 3.08Å; S60-F63 PolarHBondContact O-N 3.01Å; F63-L65 VanDerWaalsContact C-N 3.33Å; F63-L65 PolarHBondContact O-N 3.43Å; F63-S66 WeakPolarHBondContact O-CB 3.12Å; F63-S66 PolarHBondContact O-N 3.47Å; F63-C67 PolarHBondContact O-N 3.25Å
64S85.2Confident81.3Confident58 Ų5876.3 Ų76.341%0.40643%0.426SS..Hα-helixtrans-63.3-37.5177.362.10000112.8S60 S61 S66 C67 M68S60-S64 PolarHBondContact O-N 2.87Å; S60-S64 PolarHBondContact O-OG 3.45Å; S61-S64 WeakPolarHBondContact CA-OG 3.49Å; S61-S64 PolarHBondContact O-OG 2.94Å; S64-S66 VanDerWaalsContact C-N 3.34Å; S64-C67 PolarHBondContact O-N 3.13Å; S64-M68 VanDerWaalsContact O-CG 3.3Å; S64-M68 WeakPolarHBondContact O-CG 3.39Å; S64-M68 PolarHBondContact O-N 3.42Å
65L87.3Confident82.1Confident79 Ų7972.5 Ų72.541%0.41441%0.406SS..Hα-helixtrans-64.9-40.8175.9-175.167.5000111.2S61 G62 F63 M68 V69 M176S61-L65 WeakPolarHBondContact O-CB 3.44Å; S61-L65 PolarHBondContact O-N 3.34Å; G62-L65 PolarHBondContact O-N 2.97Å; F63-L65 VanDerWaalsContact C-N 3.33Å; F63-L65 PolarHBondContact O-N 3.43Å; L65-M68 PolarHBondContact O-N 2.85Å; L65-V69 WeakPolarHBondContact O-CG2 3.34Å; L65-V69 PolarHBondContact O-N 2.94Å; L65-M176 HydrophobicContact CD1-SD 4.14Å
66S88.9Confident83.1Confident80 Ų8072.4 Ų72.456%0.55939%0.394SS*.Hα-helixtrans-61.6-43175.6-171.20000111.9G62 F63 S64 V69 F70G62-S66 PolarHBondContact O-N 3.24Å; F63-S66 WeakPolarHBondContact O-CB 3.12Å; F63-S66 PolarHBondContact O-N 3.47Å; S64-S66 VanDerWaalsContact C-N 3.34Å; S66-V69 PolarHBondContact O-N 3.15Å; S66-F70 PolarHBondContact O-N 3.1Å
67C85.5Confident83.7Confident16 Ų1670.1 Ų70.111%0.10839%0.385CS..Hα-helixtrans-57.9-49.7172.4159.50000111.5F63 S64 V69 F70 F71 A216F63-C67 PolarHBondContact O-N 3.25Å; S64-C67 PolarHBondContact O-N 3.13Å; C67-V69 VanDerWaalsContact C-N 3.26Å; C67-V69 PolarHBondContact O-N 3.36Å; C67-F70 WeakPolarHBondContact O-CA 3.42Å; C67-F70 WeakPolarHBondContact O-CB 3.39Å; C67-F70 PolarHBondContact O-N 2.98Å; C67-F71 PolarHBondContact O-N 3.42Å; C67-A216 HydrophobicContact CB-CB 4.06Å; C67-A216 WeakPolarHBondContact SG-CB 3.36Å; C67-A216 PolarHBondContact SG-O 3.37Å; C67-A216 PolarHBondContact SG-OXT 3.47Å; C67-A216 VanDerWaalsContact SG-OXT 3.34Å
68M88.1Confident84Confident95 Ų9565.9 Ų65.947%0.46836%0.362SS..Hα-helixtrans-60.2-37-179.1-72.6-75.316800112.3S64 L65 L72 M176S64-M68 VanDerWaalsContact O-CG 3.3Å; S64-M68 WeakPolarHBondContact O-CG 3.39Å; S64-M68 PolarHBondContact O-N 3.42Å; L65-M68 PolarHBondContact O-N 2.85Å; M68-L72 WeakPolarHBondContact O-CB 3.08Å; M68-L72 PolarHBondContact O-N 2.98Å; M68-L72 VanDerWaalsContact O-N 3.1Å; M68-M176 HydrophobicContact CB-CE 3.69Å
69V89.6Confident84.1Confident61 Ų6165.5 Ų65.537%0.3735%0.345SS..Hα-helixtrans-67.9-42.6173.6173.10000111.1L65 S66 C67 F71 L72 I73 M176L65-V69 WeakPolarHBondContact O-CG2 3.34Å; L65-V69 PolarHBondContact O-N 2.94Å; S66-V69 PolarHBondContact O-N 3.15Å; C67-V69 VanDerWaalsContact C-N 3.26Å; C67-V69 PolarHBondContact O-N 3.36Å; V69-F71 PolarHBondContact O-N 3.07Å; V69-L72 PolarHBondContact O-N 3.45Å; V69-I73 HydrophobicContact CG1-CD1 3.92Å; V69-I73 HydrophobicContact CG1-CG1 4.5Å; V69-I73 VanDerWaalsContact O-CG1 3.32Å; V69-I73 WeakPolarHBondContact O-CG1 3Å; V69-I73 PolarHBondContact O-N 3.24Å; V69-M176 HydrophobicContact CG2-CE 3.73Å; V69-M176 HydrophobicContact CG2-SD 4.28Å
70F88.3Confident83.8Confident80 Ų8064.4 Ų64.435%0.35134%0.344SS..Hα-helixtrans-59.5-45.1175.2173.1-100.4000111.9S66 C67 L72 I73 A74 L209 C212 V213S66-F70 PolarHBondContact O-N 3.1Å; C67-F70 WeakPolarHBondContact O-CA 3.42Å; C67-F70 WeakPolarHBondContact O-CB 3.39Å; C67-F70 PolarHBondContact O-N 2.98Å; F70-L72 VanDerWaalsContact C-N 3.35Å; F70-L72 PolarHBondContact O-N 3.03Å; F70-I73 PolarHBondContact O-N 3.49Å; F70-A74 PolarHBondContact O-N 3.41Å; F70-L209 HydrophobicContact CZ-CD1 4.13Å; F70-C212 HydrophobicContact CE1-CB 3.94Å; F70-C212 HydrophobicContact CZ-CB 4Å; F70-V213 HydrophobicContact CD1-CG2 4.33Å; F70-V213 HydrophobicContact CE1-CG2 3.89Å
71F86.4Confident83Confident45 Ų4566.9 Ų66.920%0.19735%0.349CS..Hα-helixtrans-57.3-47174.2171.6-116.6000112.2C67 V69 I73 A74 V75 L196 V213C67-F71 PolarHBondContact O-N 3.42Å; V69-F71 PolarHBondContact O-N 3.07Å; F71-I73 VanDerWaalsContact C-N 3.32Å; F71-I73 PolarHBondContact O-N 3.25Å; F71-A74 WeakPolarHBondContact O-CB 3.49Å; F71-A74 PolarHBondContact O-N 2.71Å; F71-A74 VanDerWaalsContact O-N 3.15Å; F71-V75 HydrophobicContact CD2-CG2 4Å; F71-V75 HydrophobicContact CE1-CG2 4.18Å; F71-V75 HydrophobicContact CE2-CG2 3.6Å; F71-V75 HydrophobicContact CZ-CG2 3.72Å; F71-V75 WeakPolarHBondContact O-CG2 3.36Å; F71-V75 PolarHBondContact O-N 2.83Å; F71-L196 HydrophobicContact CE2-CD2 4.14Å; F71-L196 HydrophobicContact CZ-CD2 3.55Å; F71-V213 HydrophobicContact CD2-CB 4.29Å; F71-V213 HydrophobicContact CD2-CG1 3.25Å; F71-V213 HydrophobicContact CD2-CG2 4.06Å; F71-V213 HydrophobicContact CE2-CG1 3.62Å; F71-V213 HydrophobicContact CG-CG1 4.35Å
72L87.4Confident82.2Confident22 Ų2265 Ų6512%0.11533%0.334CS..Hα-helixtrans-60.7-42.2178179.6143.4000111.7M68 V69 F70 A74 V75 I76 M176 L179M68-L72 WeakPolarHBondContact O-CB 3.08Å; M68-L72 PolarHBondContact O-N 2.98Å; M68-L72 VanDerWaalsContact O-N 3.1Å; V69-L72 PolarHBondContact O-N 3.45Å; F70-L72 VanDerWaalsContact C-N 3.35Å; F70-L72 PolarHBondContact O-N 3.03Å; L72-A74 VanDerWaalsContact C-N 3.34Å; L72-V75 PolarHBondContact O-N 2.97Å; L72-I76 HydrophobicContact CD2-CD1 3.52Å; L72-I76 HydrophobicContact CG-CD1 4.15Å; L72-I76 VanDerWaalsContact O-CG1 3.24Å; L72-I76 WeakPolarHBondContact O-CG1 3.29Å; L72-I76 PolarHBondContact O-N 3.08Å; L72-M176 HydrophobicContact CD1-CB 4.23Å; L72-M176 HydrophobicContact CD1-CG 4.37Å; L72-M176 WeakPolarHBondContact CD1-O 3.42Å; L72-L179 HydrophobicContact CD1-CB 3.91Å; L72-L179 HydrophobicContact CD1-CD1 4.42Å
73I86.6Confident80.9Confident99 Ų9968.1 Ų68.151%0.50835%0.347SS..Hα-helixtrans-61.9-43.8174.8-67.2165.2000110.5V69 F70 F71 I76 Y77V69-I73 HydrophobicContact CG1-CD1 3.92Å; V69-I73 HydrophobicContact CG1-CG1 4.5Å; V69-I73 VanDerWaalsContact O-CG1 3.32Å; V69-I73 WeakPolarHBondContact O-CG1 3Å; V69-I73 PolarHBondContact O-N 3.24Å; F70-I73 PolarHBondContact O-N 3.49Å; F71-I73 VanDerWaalsContact C-N 3.32Å; F71-I73 PolarHBondContact O-N 3.25Å; I73-I76 PolarHBondContact O-N 3.16Å; I73-Y77 WeakPolarHBondContact O-CB 3.1Å; I73-Y77 PolarHBondContact O-N 3.35Å
74A83.7Confident79.5Confident6 Ų663.3 Ų63.35%0.0533%0.332CS..Hα-helixtrans-61.9-43.5178.700000112.3F70 F71 L72 Y77 K78 L209 V213F70-A74 PolarHBondContact O-N 3.41Å; F71-A74 WeakPolarHBondContact O-CB 3.49Å; F71-A74 PolarHBondContact O-N 2.71Å; F71-A74 VanDerWaalsContact O-N 3.15Å; L72-A74 VanDerWaalsContact C-N 3.34Å; A74-Y77 PolarHBondContact O-N 2.98Å; A74-K78 WeakPolarHBondContact O-CB 3.49Å; A74-K78 PolarHBondContact O-N 3.07Å; A74-L209 HydrophobicContact CB-CD1 3.82Å; A74-L209 HydrophobicContact CB-CD2 4.07Å; A74-L209 HydrophobicContact CB-CG 3.94Å; A74-V213 HydrophobicContact CB-CG2 3.63Å
75V82.6Confident78.1Confident3 Ų364.9 Ų64.92%0.01834%0.34CS..Hα-helixtrans-64.1-43.1176.7171.90000111.1F71 L72 K78 K79 F183 L196 Y200F71-V75 HydrophobicContact CD2-CG2 4Å; F71-V75 HydrophobicContact CE1-CG2 4.18Å; F71-V75 HydrophobicContact CE2-CG2 3.6Å; F71-V75 HydrophobicContact CZ-CG2 3.72Å; F71-V75 WeakPolarHBondContact O-CG2 3.36Å; F71-V75 PolarHBondContact O-N 2.83Å; L72-V75 PolarHBondContact O-N 2.97Å; V75-K78 PolarHBondContact O-N 3Å; V75-K79 PolarHBondContact O-N 3.37Å; V75-F183 HydrophobicContact CG1-CB 3.91Å; V75-L196 HydrophobicContact CG2-CD2 4.08Å; V75-Y200 HydrophobicContact CG2-CE2 4.45Å
76I83.6Confident76.7Confident43 Ų4363.2 Ų63.222%0.22133%0.332CS..Hα-helixtrans-62.6-46.2175.7-68.7171.3000110.4L72 I73 K78 K79 F80 F183L72-I76 HydrophobicContact CD2-CD1 3.52Å; L72-I76 HydrophobicContact CG-CD1 4.15Å; L72-I76 VanDerWaalsContact O-CG1 3.24Å; L72-I76 WeakPolarHBondContact O-CG1 3.29Å; L72-I76 PolarHBondContact O-N 3.08Å; I73-I76 PolarHBondContact O-N 3.16Å; I76-K78 PolarHBondContact O-N 3.07Å; I76-K79 WeakPolarHBondContact O-CB 3.27Å; I76-K79 PolarHBondContact O-N 2.91Å; I76-F80 HydrophobicContact CG2-CD2 4.12Å; I76-F80 HydrophobicContact CG2-CE2 3.71Å; I76-F80 WeakPolarHBondContact O-CD2 3.47Å; I76-F80 PolarHBondContact O-N 3.28Å; I76-F183 HydrophobicContact CD1-CD2 4.06Å; I76-F183 HydrophobicContact CD1-CE2 4.03Å; I76-F183 HydrophobicContact CG1-CB 4.38Å; I76-F183 HydrophobicContact CG1-CD2 3.51Å; I76-F183 HydrophobicContact CG1-CE2 3.85Å; I76-F183 HydrophobicContact CG1-CG 3.95Å
77Y81.4Confident75.2Confident123 Ų12363.1 Ų63.148%0.48233%0.33SS..Hα-helixtrans-60.5-46.2179-177.2-100.4000111.8I73 A74 K79 F80 H81 L209I73-Y77 WeakPolarHBondContact O-CB 3.1Å; I73-Y77 PolarHBondContact O-N 3.35Å; A74-Y77 PolarHBondContact O-N 2.98Å; Y77-K79 VanDerWaalsContact C-N 3.31Å; Y77-K79 PolarHBondContact O-N 3.27Å; Y77-F80 PolarHBondContact O-N 3.1Å; Y77-F80 VanDerWaalsContact O-N 3.08Å; Y77-H81 AromaticContact CE1-CE1 3.89Å; Y77-H81 AromaticContact CE1-CG 3.93Å; Y77-H81 AromaticContact CE1-ND1 3.68Å; Y77-H81 AromaticContact CE2-NE2 3.74Å; Y77-H81 AromaticContact CZ-CD2 3.91Å; Y77-H81 AromaticContact CZ-CE1 3.35Å; Y77-H81 AromaticContact CZ-CG 3.99Å; Y77-H81 AromaticContact CZ-ND1 3.64Å; Y77-H81 AromaticContact CZ-NE2 3.5Å; Y77-H81 PolarHBondContact O-N 3.46Å; Y77-H81 VanDerWaalsContact O-N 3.12Å; Y77-H81 PolarHBondContact OH-CE1 3.28Å; Y77-H81 PolarHBondContact OH-ND1 3.37Å; Y77-H81 PolarHBondContact OH-NE2 2.85Å; Y77-L209 HydrophobicContact CD1-CD2 4.1Å
78K74.4Confident73.6Confident14 Ų1467.8 Ų67.86%0.06136%0.359CS..Hα-helixtrans-61-37.8177-83.8-72.7-171.1175.20112.3A74 V75 I76 F80 H81 V82 Y200 D204 D207 L209A74-K78 WeakPolarHBondContact O-CB 3.49Å; A74-K78 PolarHBondContact O-N 3.07Å; V75-K78 PolarHBondContact O-N 3Å; I76-K78 PolarHBondContact O-N 3.07Å; K78-F80 PolarHBondContact O-N 2.87Å; K78-H81 PolarHBondContact O-N 3.41Å; K78-H81 VanDerWaalsContact O-N 3.12Å; K78-V82 HydrophobicContact CD-CG2 4.1Å; K78-V82 WeakPolarHBondContact O-CB 3.38Å; K78-V82 VanDerWaalsContact O-CG2 3.27Å; K78-V82 WeakPolarHBondContact O-CG2 3.29Å; K78-V82 PolarHBondContact O-N 2.98Å; K78-Y200 HydrophobicContact CB-CE1 3.81Å; K78-Y200 HydrophobicContact CD-CE1 4.29Å; K78-Y200 HydrophobicContact CG-CE1 3.87Å; K78-D204 IonicContact NZ-OD2 3Å; K78-D204 PolarHBondContact NZ-OD2 3.34Å; K78-D207 WeakPolarHBondContact CE-OD2 3.27Å; K78-D207 IonicContact NZ-OD2 2.61Å; K78-D207 PolarHBondContact NZ-OD2 3.12Å; K78-L209 HydrophobicContact CD-CD2 4.48Å; K78-L209 HydrophobicContact CG-CD2 3.92Å
79K73.4Confident71.8Confident47 Ų4769.7 Ų69.720%0.20437%0.372CS..Hα-helixtrans-56.1-38.5173.5172.961.6-177.3175.30112.8V75 I76 Y77 F183 L186 Y189V75-K79 PolarHBondContact O-N 3.37Å; I76-K79 WeakPolarHBondContact O-CB 3.27Å; I76-K79 PolarHBondContact O-N 2.91Å; Y77-K79 VanDerWaalsContact C-N 3.31Å; Y77-K79 PolarHBondContact O-N 3.27Å; K79-F183 HydrophobicContact CB-CD1 4.42Å; K79-F183 HydrophobicContact CG-CD1 4.11Å; K79-L186 HydrophobicContact CD-CB 4.01Å; K79-L186 PolarHBondContact NZ-O 3.23Å; K79-Y189 PolarHBondContact NZ-OH 3.49Å; K79-Y189 VanDerWaalsContact NZ-OH 3.13Å
80F72.7Confident70Confident157 Ų15770.2 Ų70.269%0.68937%0.369SS*.Hα-helixtrans-79.8-24.1179.3-70.1-72000113.4I76 Y77 K78I76-F80 HydrophobicContact CG2-CD2 4.12Å; I76-F80 HydrophobicContact CG2-CE2 3.71Å; I76-F80 WeakPolarHBondContact O-CD2 3.47Å; I76-F80 PolarHBondContact O-N 3.28Å; Y77-F80 PolarHBondContact O-N 3.1Å; Y77-F80 VanDerWaalsContact O-N 3.08Å; K78-F80 PolarHBondContact O-N 2.87Å
81H64.5Low67.9Low113 Ų11371.9 Ų71.952%0.52338%0.382SS..Hα-helixtrans-96.4-20.7-176.1-92.9-133.6000114.8Y77 K78 P83Y77-H81 AromaticContact CE1-CE1 3.89Å; Y77-H81 AromaticContact CE1-CG 3.93Å; Y77-H81 AromaticContact CE1-ND1 3.68Å; Y77-H81 AromaticContact CE2-NE2 3.74Å; Y77-H81 AromaticContact CZ-CD2 3.91Å; Y77-H81 AromaticContact CZ-CE1 3.35Å; Y77-H81 AromaticContact CZ-CG 3.99Å; Y77-H81 AromaticContact CZ-ND1 3.64Å; Y77-H81 AromaticContact CZ-NE2 3.5Å; Y77-H81 PolarHBondContact O-N 3.46Å; Y77-H81 VanDerWaalsContact O-N 3.12Å; Y77-H81 PolarHBondContact OH-CE1 3.28Å; Y77-H81 PolarHBondContact OH-ND1 3.37Å; Y77-H81 PolarHBondContact OH-NE2 2.85Å; K78-H81 PolarHBondContact O-N 3.41Å; K78-H81 VanDerWaalsContact O-N 3.12Å; H81-P83 WeakPolarHBondContact O-CD 3.31Å
82V64.5Low65.7Low30 Ų3076.2 Ų76.218%0.18241%0.407CS..SBendtrans-89.4100.8178.4179.10000108.7K78 C84K78-V82 HydrophobicContact CD-CG2 4.1Å; K78-V82 WeakPolarHBondContact O-CB 3.38Å; K78-V82 VanDerWaalsContact O-CG2 3.27Å; K78-V82 WeakPolarHBondContact O-CG2 3.29Å; K78-V82 PolarHBondContact O-N 2.98Å; V82-C84 PolarHBondContact O-N 3.47Å
83P58.5Low63.7Low106 Ų10681.7 Ų81.769%0.68844%0.441SS*.PPolyproline II helixtrans-68126.6170.929.1-34.1000108.8H81H81-P83 WeakPolarHBondContact O-CD 3.31Å
84C56.9Low61.6Low53 Ų5383.6 Ų83.636%0.35846%0.458SS..SBendtrans-68.5134.3161.1-730000108.4V82 C119V82-C84 PolarHBondContact O-N 3.47Å; C84-C119 HydrophobicContact CB-CB 4.22Å; C84-C119 VanDerWaalsContact CB-SG 3.54Å
85P54.9Low59.5Low90 Ų9086.6 Ų86.658%0.58449%0.489SS*.SBendcis-94.3151.31434.4-33.8000115.8
86L59.7Low57Low44 Ų4494.1 Ų94.123%0.2353%0.53CS..PPolyproline II helixtrans-64.5145.2173-83.582.6000111.7F90 F188 V203L86-F90 HydrophobicContact CD2-CD2 4.01Å; L86-F90 HydrophobicContact CD2-CE2 4.01Å; L86-F188 HydrophobicContact CD2-CD1 3.86Å; L86-F188 HydrophobicContact CD2-CE1 4.24Å; L86-V203 HydrophobicContact CD2-CG2 3.73Å
87P57.2Low55.1Low79 Ų79102.2 Ų102.251%0.51356%0.564SS.*PPolyproline II helixtrans-63147.1177.423.1-30.5000112.3N89P87-N89 PolarHBondContact O-N 3.43Å
88P52.2Low52.7Low113 Ų113101.2 Ų101.273%0.73458%0.575SS**G310 helixtrans-68.63.7-166.727.2-36.1000116.1F90P88-F90 PolarHBondContact O-N 2.93Å; P88-F90 VanDerWaalsContact O-N 3.15Å
89N50.1Low50.8Low136 Ų136108.6 Ų108.673%0.72761%0.609SS**G310 helixtrans-73.7-0.3177.4-72.5-13.3000113.5P87 N91P87-N89 PolarHBondContact O-N 3.43Å; N89-N91 PolarHBondContact O-N 2.98Å
90F50Low48.6Very low71 Ų71112.5 Ų112.531%0.31164%0.636SS.*G310 helixtrans-69.2-12.8-179.3-139.6-95000114.1L86 P88 G191 T199 V203L86-F90 HydrophobicContact CD2-CD2 4.01Å; L86-F90 HydrophobicContact CD2-CE2 4.01Å; P88-F90 PolarHBondContact O-N 2.93Å; P88-F90 VanDerWaalsContact O-N 3.15Å; F90-G191 VanDerWaalsContact CE1-O 3.31Å; F90-G191 WeakPolarHBondContact CE1-O 3.23Å; F90-G191 VanDerWaalsContact CZ-O 3.23Å; F90-G191 WeakPolarHBondContact CZ-O 3.47Å; F90-T199 HydrophobicContact CE2-CG2 4.37Å; F90-T199 HydrophobicContact CZ-CG2 4Å; F90-V203 HydrophobicContact CD2-CG2 4.47Å; F90-V203 HydrophobicContact CE2-CG2 4.04Å
91N44.8Very low46.7Very low116 Ų116113.1 Ų113.162%0.6264%0.641SS**SBendtrans-126.5-0.4-175.5-75-5.3000117N89 T93N89-N91 PolarHBondContact O-N 2.98Å; N91-T93 VanDerWaalsContact C-N 3.26Å; N91-T93 PolarHBondContact O-N 3.19Å
92N40.5Very low45.1Very low136 Ų136114.9 Ų114.973%0.72765%0.653SS**  trans-87.249.9-175.1-83.4-6.8000114.3
93T46Very low43.2Very low136 Ų136119.2 Ų119.283%0.83468%0.679SS**  trans-143.160.1160.5-43.60000111N91N91-T93 VanDerWaalsContact C-N 3.26Å; N91-T93 PolarHBondContact O-N 3.19Å
94T42.6Very low42.1Very low140 Ų140123.8 Ų123.886%0.85969%0.688SS**SBendtrans-145123.9149.7-45.50000107.4
95G39.3Very low40.5Very low69 Ų69129.7 Ų129.771%0.71171%0.711SS**  trans-68148.9-154.600000117.2
96N29.1Very low39.4Very low161 Ų161134.7 Ų134.786%0.86172%0.723SS**  -166141.7100.2-109.3-11.7000110.6S98N96-S98 PolarHBondContact O-N 3.43Å
97F43.6Very low37.7Very low213 Ų213138.8 Ų138.893%0.93475%0.75SS**  trans-70.5105.6177.9-157.4-92.1000109.4
98S32.5Very low36.5Very low102 Ų102144.2 Ų144.271%0.71377%0.768SS**  trans-156.194.3158.548.90000109.6N96N96-S98 PolarHBondContact O-N 3.43Å
99H34.4Very low35.2Very low169 Ų169145.3 Ų145.378%0.78277%0.767SS**  trans32.7118.4134.5-148.3-80.1000116.8
100V26.3Very low34.3Very low129 Ų129146.9 Ų146.978%0.78277%0.77SS**  177.5108.41251560000107
101E33.4Very low33.3Very low170 Ų170150.3 Ų150.379%0.79480%0.797SS**  trans-53.4151.4154.8-80177.6121.300109.6
102I29.5Very low32.9Very low150 Ų150152.8 Ų152.877%0.76981%0.805SS**  169.2109.6128.3-76.8-115.3000109.4
103V25.8Very low32.6Very low121 Ų121150.7 Ų150.773%0.73380%0.798SS**  69.2125.9129.1-176.50000121.2E105V103-E105 PolarHBondContact O-N 3.15Å
104K34.4Very low32.3Very low201 Ų201151.5 Ų151.587%0.87479%0.792SS**  trans-48.4121153.4-81.8174.5167174.90111.7
105E23.1Very low32.4Very low177 Ų177147.9 Ų147.983%0.82778%0.777SS**  trans-170.7155.5130.8-128.2174.3128.800113.1V103V103-E105 PolarHBondContact O-N 3.15Å
106K32.9Very low32.7Very low196 Ų196147.4 Ų147.485%0.85276%0.763SS**  trans-45128.3-177.6-67.5168.7174.7175.10114
107V24.4Very low33.8Very low129 Ų129142.1 Ų142.178%0.78274%0.741SS**  trans-140.5105.7158.6-178.80000109.3
108Q30.8Very low34.5Very low193 Ų193137.4 Ų137.490%0.90272%0.721SS**  trans-67.8141147.8-78.7178.8-33.700107.4
109L26.4Very low36Very low137 Ų137134.3 Ų134.372%0.71770%0.699SS**SBendtrans118.9103.8157.9-153.2153.8000114.8
110Q30.4Very low37.6Very low168 Ų168130 Ų13079%0.78568%0.684SS**  trans63.294.6151.8-59.5176.2-29.600120
111V29.3Very low39.7Very low143 Ų143125.9 Ų125.987%0.86766%0.66SS**  trans-144.693.5135.2-174.90000108.2
112E36.9Very low41.5Very low169 Ų169120.2 Ų120.279%0.7964%0.639SS**  trans-124101168.6-165.2180149.400105.6
113P34.2Very low43.6Very low91 Ų91122.8 Ų122.859%0.59164%0.641SS**SBend-1508117.635.6-16.3000115.9
114E39.3Very low45.8Very low153 Ų153124.7 Ų124.772%0.71564%0.639SS**SBendtrans-107.5-28.8-173.1-65.9-170171.200114.8F118E114-F118 WeakPolarHBondContact O-CD2 3.44Å
115A44.8Very low47.8Very low64 Ų64119.8 Ų119.853%0.52963%0.626SS.*SBendtrans-77.4-27.4178.300000113.4A117A115-A117 VanDerWaalsContact C-N 3.32Å
116S44.5Very low50.4Low59 Ų59117.6 Ų117.641%0.41362%0.62SS.*SBendtrans-75.8-19176.250.30000112.9F118 C119S116-F118 VanDerWaalsContact C-N 3.34Å; S116-F118 PolarHBondContact O-N 3.45Å; S116-C119 PolarHBondContact O-N 3.26Å
117A52.3Low52.8Low50 Ų50112.4 Ų112.441%0.41360%0.601SS.*G310 helixtrans-71.7-26.7178.300000113A115 T120A115-A117 VanDerWaalsContact C-N 3.32Å; A117-T120 PolarHBondContact O-OG1 3.07Å; A117-T120 VanDerWaalsContact O-OG1 3.08Å
118F58Low55.7Low115 Ų115110.1 Ų110.150%0.50459%0.591SS.*G310 helixtrans-77.7-20.3178.7-75.7-83.4000113.8E114 S116 Y189 N190E114-F118 WeakPolarHBondContact O-CD2 3.44Å; S116-F118 VanDerWaalsContact C-N 3.34Å; S116-F118 PolarHBondContact O-N 3.45Å; F118-Y189 WeakPolarHBondContact O-CB 3.28Å; F118-N190 HydrophobicContact CD1-CB 4.45Å
119C65.7Low58.1Low37 Ų37107.2 Ų107.225%0.2558%0.578CS.*G310 helixtrans-104.618.3-174.6-53.20000112.6C84 S116C84-C119 HydrophobicContact CB-CB 4.22Å; C84-C119 VanDerWaalsContact CB-SG 3.54Å; S116-C119 PolarHBondContact O-N 3.26Å
120T66.2Low60.8Low77 Ų77103.3 Ų103.347%0.47256%0.56SS.*SBendtrans-101.6129.7174.453.50000109.8A117 S122A117-T120 PolarHBondContact O-OG1 3.07Å; A117-T120 VanDerWaalsContact O-OG1 3.08Å; T120-S122 PolarHBondContact O-N 3.17Å
121P70.8Confident63.5Low44 Ų4498 Ų9829%0.28655%0.545SS..  trans-68.7124.1176.127.6-32.5000109.7Y123 Y189P121-Y123 HydrophobicContact CB-CE1 4.34Å; P121-Y123 HydrophobicContact CB-CE2 4.24Å; P121-Y123 HydrophobicContact CG-CE1 4.37Å; P121-Y123 HydrophobicContact CG-CE2 3.79Å; P121-Y123 WeakPolarHBondContact CG-OH 3.31Å; P121-Y123 WeakPolarHBondContact O-CD2 3.41Å; P121-Y189 HydrophobicContact CB-CD1 4.37Å; P121-Y189 HydrophobicContact CB-CE1 4.2Å
122S72.4Confident66.3Low51 Ų5199.6 Ų99.636%0.35754%0.536SS..  trans-87.9111.5168.3-166.30000108.4T120 T125 Y185T120-S122 PolarHBondContact O-N 3.17Å; S122-T125 VanDerWaalsContact OG-CG2 3.3Å; S122-T125 WeakPolarHBondContact OG-CG2 3.32Å; S122-Y185 PolarHBondContact N-OH 2.95Å; S122-Y185 VanDerWaalsContact N-OH 3.12Å
123Y72.4Confident68.5Low204 Ų20494.7 Ų94.780%0.852%0.518SS*.  trans-80-24.2-173.5-65.4-80.8000113.4P121P121-Y123 HydrophobicContact CB-CE1 4.34Å; P121-Y123 HydrophobicContact CB-CE2 4.24Å; P121-Y123 HydrophobicContact CG-CE1 4.37Å; P121-Y123 HydrophobicContact CG-CE2 3.79Å; P121-Y123 WeakPolarHBondContact CG-OH 3.31Å; P121-Y123 WeakPolarHBondContact O-CD2 3.41Å
124F73.3Confident71.1Confident160 Ų16096.2 Ų96.270%0.70252%0.52SS*.  trans-153.3103.4-174.1-161.7-107.8000112.2L126F124-L126 HydrophobicContact CD1-CD1 4.48Å; F124-L126 HydrophobicContact CD1-CG 4.16Å; F124-L126 HydrophobicContact CE1-CD1 3.39Å; F124-L126 HydrophobicContact CE1-CD2 4.21Å; F124-L126 HydrophobicContact CE1-CG 3.44Å; F124-L126 VanDerWaalsContact CE1-CG 3.44Å; F124-L126 HydrophobicContact CE2-CD2 4.14Å; F124-L126 HydrophobicContact CE2-CG 4.26Å; F124-L126 HydrophobicContact CZ-CD1 3.44Å; F124-L126 VanDerWaalsContact CZ-CD1 3.44Å; F124-L126 HydrophobicContact CZ-CD2 3.77Å; F124-L126 HydrophobicContact CZ-CG 3.51Å
125T76.1Confident73.4Confident98 Ų9892 Ų9260%0.60151%0.506SS*.  trans-123.1107.8170.952.90000109.2S122 T130S122-T125 VanDerWaalsContact OG-CG2 3.3Å; S122-T125 WeakPolarHBondContact OG-CG2 3.32Å; T125-T130 PolarHBondContact O-OG1 3.5Å
126L78.4Confident75.5Confident132 Ų13294.2 Ų94.269%0.69151%0.507SS*.  trans-93.3104.6173.1-68.5-178.5000109F124F124-L126 HydrophobicContact CD1-CD1 4.48Å; F124-L126 HydrophobicContact CD1-CG 4.16Å; F124-L126 HydrophobicContact CE1-CD1 3.39Å; F124-L126 HydrophobicContact CE1-CD2 4.21Å; F124-L126 HydrophobicContact CE1-CG 3.44Å; F124-L126 VanDerWaalsContact CE1-CG 3.44Å; F124-L126 HydrophobicContact CE2-CD2 4.14Å; F124-L126 HydrophobicContact CE2-CG 4.26Å; F124-L126 HydrophobicContact CZ-CD1 3.44Å; F124-L126 VanDerWaalsContact CZ-CD1 3.44Å; F124-L126 HydrophobicContact CZ-CD2 3.77Å; F124-L126 HydrophobicContact CZ-CG 3.51Å
127N82.2Confident77.5Confident86 Ų8696.3 Ų96.346%0.4651%0.512SS..  trans-120.2162.7172.5-168-3.4000109.6Q129 T130N127-Q129 HydrophobicContact CB-CB 4.47Å; N127-Q129 PolarHBondContact ND2-OE1 2.93Å; N127-Q129 VanDerWaalsContact ND2-OE1 3.15Å; N127-Q129 PolarHBondContact O-N 3.4Å; N127-Q129 VanDerWaalsContact O-N 3.15Å; N127-T130 PolarHBondContact N-OG1 3.47Å; N127-T130 VanDerWaalsContact O-CB 3.23Å; N127-T130 WeakPolarHBondContact O-CB 3.44Å; N127-T130 PolarHBondContact O-N 3.15Å; N127-T130 PolarHBondContact O-OG1 3.04Å
128S84.6Confident79.2Confident82 Ų8296.9 Ų96.957%0.57352%0.517SS*.Hα-helixtrans-49.6-32.5165.759.70000112.7T130 A131S128-T130 VanDerWaalsContact C-N 3.3Å; S128-T130 PolarHBondContact O-N 2.94Å; S128-A131 WeakPolarHBondContact O-CB 3.45Å; S128-A131 PolarHBondContact O-N 3.27Å; S128-A131 VanDerWaalsContact O-N 3.17Å
129Q81.6Confident80.6Confident131 Ų13198.9 Ų98.961%0.61253%0.526SS*.Hα-helixtrans-62.7-33.6174.8-70.7173.6-40.900113.2N127 A131 Y132N127-Q129 HydrophobicContact CB-CB 4.47Å; N127-Q129 PolarHBondContact ND2-OE1 2.93Å; N127-Q129 VanDerWaalsContact ND2-OE1 3.15Å; N127-Q129 PolarHBondContact O-N 3.4Å; N127-Q129 VanDerWaalsContact O-N 3.15Å; Q129-A131 PolarHBondContact O-N 3.43Å; Q129-Y132 PolarHBondContact O-N 3.26Å
130T84.1Confident81.6Confident56 Ų5699.5 Ų99.534%0.34453%0.533SS..Hα-helixtrans-62.1-29.3176.5-43.80000111.6T125 N127 S128 Y132 T133T125-T130 PolarHBondContact O-OG1 3.5Å; N127-T130 PolarHBondContact N-OG1 3.47Å; N127-T130 VanDerWaalsContact O-CB 3.23Å; N127-T130 WeakPolarHBondContact O-CB 3.44Å; N127-T130 PolarHBondContact O-N 3.15Å; N127-T130 PolarHBondContact O-OG1 3.04Å; S128-T130 VanDerWaalsContact C-N 3.3Å; S128-T130 PolarHBondContact O-N 2.94Å; T130-Y132 VanDerWaalsContact C-N 3.31Å; T130-Y132 PolarHBondContact O-N 2.9Å; T130-T133 WeakPolarHBondContact O-CB 3.24Å; T130-T133 PolarHBondContact O-N 2.8Å
131A87.3Confident82.5Confident57 Ų5799.6 Ų99.647%0.47153%0.527SS..Hα-helixtrans-66.7-31.9176.200000112.5S128 Q129 T133 I134 P135S128-A131 WeakPolarHBondContact O-CB 3.45Å; S128-A131 PolarHBondContact O-N 3.27Å; S128-A131 VanDerWaalsContact O-N 3.17Å; Q129-A131 PolarHBondContact O-N 3.43Å; A131-T133 VanDerWaalsContact C-N 3.25Å; A131-T133 PolarHBondContact O-N 3.06Å; A131-I134 PolarHBondContact O-N 3.44Å; A131-P135 WeakPolarHBondContact O-CD 3.48Å
132Y86.5Confident83.3Confident175 Ų175100.7 Ų100.769%0.68653%0.533SS*.Hα-helixtrans-73.5-16.8175.4-61.1-60.4000113Q129 T130 P135 I136Q129-Y132 PolarHBondContact O-N 3.26Å; T130-Y132 VanDerWaalsContact C-N 3.31Å; T130-Y132 PolarHBondContact O-N 2.9Å; Y132-P135 WeakPolarHBondContact O-CD 3.41Å; Y132-I136 WeakPolarHBondContact O-CD1 3.5Å
133T85Confident84Confident67 Ų67101 Ų10141%0.41153%0.534SS..Hα-helixtrans-77.4-27.2175.2-48.90000112.4T130 A131 I136 M137T130-T133 WeakPolarHBondContact O-CB 3.24Å; T130-T133 PolarHBondContact O-N 2.8Å; A131-T133 VanDerWaalsContact C-N 3.25Å; A131-T133 PolarHBondContact O-N 3.06Å; T133-I136 WeakPolarHBondContact O-CB 3.33Å; T133-I136 PolarHBondContact O-N 2.94Å; T133-I136 VanDerWaalsContact O-N 3.13Å; T133-M137 HydrophobicContact CG2-CG 4.06Å; T133-M137 WeakPolarHBondContact O-CG 3.31Å; T133-M137 PolarHBondContact O-N 3.17Å
134I87.3Confident84.6Confident122 Ų12297.8 Ų97.863%0.62653%0.526SS*.Hα-helixtrans-58.1-49.3-177.3-61.5170.3000111.8A131 I136 M137 A138A131-I134 PolarHBondContact O-N 3.44Å; I134-I136 VanDerWaalsContact C-N 3.32Å; I134-I136 PolarHBondContact O-N 3.34Å; I134-M137 PolarHBondContact O-N 3.46Å; I134-A138 PolarHBondContact O-N 3.02Å
135P89.1Confident85.2Confident64 Ų6493.3 Ų93.342%0.41651%0.513SS..Hα-helixtrans-63-37176-22.934.6000113A131 Y132 A138 F139A131-P135 WeakPolarHBondContact O-CD 3.48Å; Y132-P135 WeakPolarHBondContact O-CD 3.41Å; P135-A138 PolarHBondContact O-N 3.02Å; P135-F139 HydrophobicContact CB-CD2 4.44Å; P135-F139 HydrophobicContact CB-CE2 4.48Å; P135-F139 WeakPolarHBondContact O-CB 3.36Å; P135-F139 WeakPolarHBondContact O-CD2 3.44Å; P135-F139 PolarHBondContact O-N 3.37Å
136I87.1Confident85.6Confident111 Ų11193.2 Ų93.257%0.56951%0.506SS*.Hα-helixtrans-62.2-47.2179.9-59.1171.9000109.8Y132 T133 I134 A138 F139 A140Y132-I136 WeakPolarHBondContact O-CD1 3.5Å; T133-I136 WeakPolarHBondContact O-CB 3.33Å; T133-I136 PolarHBondContact O-N 2.94Å; T133-I136 VanDerWaalsContact O-N 3.13Å; I134-I136 VanDerWaalsContact C-N 3.32Å; I134-I136 PolarHBondContact O-N 3.34Å; I136-A138 VanDerWaalsContact C-N 3.35Å; I136-A138 PolarHBondContact O-N 3.01Å; I136-F139 PolarHBondContact O-N 3.4Å; I136-A140 WeakPolarHBondContact O-CB 3.39Å; I136-A140 PolarHBondContact O-N 3.34Å
137M88.1Confident86Confident104 Ų10489.1 Ų89.151%0.51249%0.486SS..Hα-helixtrans-62.8-41.8175.4-65.6-59.2-69.700111.6T133 I134 A140 F141T133-M137 HydrophobicContact CG2-CG 4.06Å; T133-M137 WeakPolarHBondContact O-CG 3.31Å; T133-M137 PolarHBondContact O-N 3.17Å; I134-M137 PolarHBondContact O-N 3.46Å; M137-A140 PolarHBondContact O-N 3.33Å; M137-F141 HydrophobicContact CE-CE2 4.17Å; M137-F141 VanDerWaalsContact O-CD2 3.31Å; M137-F141 WeakPolarHBondContact O-CD2 3.38Å; M137-F141 PolarHBondContact O-N 3.12Å
138A88.3Confident86.2Confident61 Ų6191.2 Ų91.250%0.50450%0.497SS..Hα-helixtrans-60.3-48.5176.500000111.4I134 P135 I136 A140 F141 V142I134-A138 PolarHBondContact O-N 3.02Å; P135-A138 PolarHBondContact O-N 3.02Å; I136-A138 VanDerWaalsContact C-N 3.35Å; I136-A138 PolarHBondContact O-N 3.01Å; A138-A140 VanDerWaalsContact C-N 3.35Å; A138-A140 PolarHBondContact O-N 3.4Å; A138-F141 PolarHBondContact O-N 3.26Å; A138-V142 WeakPolarHBondContact O-CG2 3.3Å; A138-V142 PolarHBondContact O-N 2.98Å
139F86.3Confident86.2Confident158 Ų15889.5 Ų89.569%0.69348%0.483SS*.Hα-helixtrans-63.7-35.4178.2-81.2-64.8000113.1P135 I136 F141 V142P135-F139 HydrophobicContact CB-CD2 4.44Å; P135-F139 HydrophobicContact CB-CE2 4.48Å; P135-F139 WeakPolarHBondContact O-CB 3.36Å; P135-F139 WeakPolarHBondContact O-CD2 3.44Å; P135-F139 PolarHBondContact O-N 3.37Å; I136-F139 PolarHBondContact O-N 3.4Å; F139-F141 PolarHBondContact O-N 3.19Å; F139-V142 HydrophobicContact CD1-CG2 4.35Å; F139-V142 WeakPolarHBondContact O-CB 3.22Å; F139-V142 PolarHBondContact O-N 3.02Å; F139-V142 VanDerWaalsContact O-N 3.13Å
140A86.6Confident86.4Confident49 Ų4987.6 Ų87.641%0.40548%0.477SS..Hα-helixtrans-62-29.6177.900000113.1I136 M137 A138I136-A140 WeakPolarHBondContact O-CB 3.39Å; I136-A140 PolarHBondContact O-N 3.34Å; M137-A140 PolarHBondContact O-N 3.33Å; A138-A140 VanDerWaalsContact C-N 3.35Å; A138-A140 PolarHBondContact O-N 3.4Å
141F85.7Confident86.5Confident79 Ų7988.5 Ų88.535%0.34647%0.474SS..THydrogen-bonded Turntrans-100.29177-67.6-74.9000113.6M137 A138 F139 C143 Y174 Y177M137-F141 HydrophobicContact CE-CE2 4.17Å; M137-F141 VanDerWaalsContact O-CD2 3.31Å; M137-F141 WeakPolarHBondContact O-CD2 3.38Å; M137-F141 PolarHBondContact O-N 3.12Å; A138-F141 PolarHBondContact O-N 3.26Å; F139-F141 PolarHBondContact O-N 3.19Å; F141-C143 PolarHBondContact O-N 3Å; F141-Y174 HydrophobicContact CE1-CD2 4.39Å; F141-Y174 HydrophobicContact CZ-CD2 4.01Å; F141-Y177 HydrophobicContact CE1-CD2 4.25Å; F141-Y177 HydrophobicContact CZ-CD2 4.05Å
142V87.8Confident86.4Confident68 Ų6890.7 Ų90.741%0.41248%0.482SS..  trans-72.394.5172.3171.30000109.4A138 F139 P145A138-V142 WeakPolarHBondContact O-CG2 3.3Å; A138-V142 PolarHBondContact O-N 2.98Å; F139-V142 HydrophobicContact CD1-CG2 4.35Å; F139-V142 WeakPolarHBondContact O-CB 3.22Å; F139-V142 PolarHBondContact O-N 3.02Å; F139-V142 VanDerWaalsContact O-N 3.13Å; V142-P145 HydrophobicContact CG1-CG 4.12Å
143C86.1Confident86.3Confident57 Ų5787.8 Ų87.839%0.38548%0.475SS..  trans-110.5-10.5173670000113.5F141 E146 V147F141-C143 PolarHBondContact O-N 3Å; C143-E146 PolarHBondContact O-N 3.3Å; C143-V147 WeakPolarHBondContact O-CG2 3.37Å
144H84.4Confident86.2Confident137 Ų13786.9 Ų86.963%0.63447%0.467SS*.G310 helixtrans-56-35.4-173.574.2-89.9000116.2E146 V147H144-E146 VanDerWaalsContact C-N 3.27Å; H144-E146 PolarHBondContact O-N 2.79Å; H144-V147 PolarHBondContact O-N 2.65Å
145P87.1Confident85.9Confident65 Ų6589.6 Ų89.642%0.42247%0.474SS..G310 helixtrans-67.5-29.5-177.9-1933.8000112.9V142V142-P145 HydrophobicContact CG1-CG 4.12Å
146E85.1Confident85.8Confident97 Ų9792 Ų9245%0.45348%0.483SS..G310 helixtrans-89.9-11.3-174.2-57.7-59.1146.300112.7C143 H144 L148 P149 I150C143-E146 PolarHBondContact O-N 3.3Å; H144-E146 VanDerWaalsContact C-N 3.27Å; H144-E146 PolarHBondContact O-N 2.79Å; E146-L148 VanDerWaalsContact C-N 3.31Å; E146-L148 PolarHBondContact O-N 3.36Å; E146-P149 WeakPolarHBondContact O-CD 3.31Å; E146-I150 HydrophobicContact CB-CD1 4.21Å; E146-I150 VanDerWaalsContact O-CD1 3.31Å; E146-I150 WeakPolarHBondContact O-CD1 3.36Å; E146-I150 WeakPolarHBondContact O-CG1 3.47Å; E146-I150 PolarHBondContact O-N 3.45Å; E146-I150 VanDerWaalsContact O-N 3.14Å
147V86.7Confident85.7Confident45 Ų4589.9 Ų89.927%0.27348%0.477SS..Hα-helixtrans-61.8-38.1-178174.50000111.7C143 H144 Y151 M162C143-V147 WeakPolarHBondContact O-CG2 3.37Å; H144-V147 PolarHBondContact O-N 2.65Å; V147-Y151 WeakPolarHBondContact O-CB 3.46Å; V147-Y151 PolarHBondContact O-N 3.28Å; V147-M162 HydrophobicContact CB-CE 4.28Å; V147-M162 HydrophobicContact CG1-CE 3.54Å; V147-M162 VanDerWaalsContact O-CE 3.29Å; V147-M162 WeakPolarHBondContact O-CE 3.24Å
148L86.4Confident85.9Confident131 Ų13187.3 Ų87.369%0.68647%0.47SS*.Hα-helixtrans-69-50.6-178.1-68.7174.3000112.4E146 I150 Y151 T152E146-L148 VanDerWaalsContact C-N 3.31Å; E146-L148 PolarHBondContact O-N 3.36Å; L148-I150 VanDerWaalsContact C-N 3.32Å; L148-I150 PolarHBondContact O-N 3.2Å; L148-Y151 WeakPolarHBondContact O-CB 3.46Å; L148-Y151 PolarHBondContact O-N 3.46Å; L148-T152 PolarHBondContact O-N 2.91Å; L148-T152 PolarHBondContact O-OG1 2.88Å
149P84.3Confident85.9Confident45 Ų4592.9 Ų92.929%0.29248%0.482SS..Hα-helixtrans-55.8-41.5171.1-26.532.4000114L54 E146 Y151 T152 E153L54-P149 HydrophobicContact CD2-CB 3.91Å; E146-P149 WeakPolarHBondContact O-CD 3.31Å; P149-Y151 VanDerWaalsContact C-N 3.33Å; P149-Y151 PolarHBondContact O-N 2.89Å; P149-T152 PolarHBondContact O-N 3.32Å; P149-T152 PolarHBondContact O-OG1 3.46Å; P149-E153 PolarHBondContact O-N 3.48Å
150I84.9Confident86.1Confident91 Ų9194 Ų9447%0.46749%0.487SS..Hα-helixtrans-64.7-39.7178.1-65.7164.5000110.8E146 L148 T152 E153 L154 M162E146-I150 HydrophobicContact CB-CD1 4.21Å; E146-I150 VanDerWaalsContact O-CD1 3.31Å; E146-I150 WeakPolarHBondContact O-CD1 3.36Å; E146-I150 WeakPolarHBondContact O-CG1 3.47Å; E146-I150 PolarHBondContact O-N 3.45Å; E146-I150 VanDerWaalsContact O-N 3.14Å; L148-I150 VanDerWaalsContact C-N 3.32Å; L148-I150 PolarHBondContact O-N 3.2Å; I150-T152 VanDerWaalsContact C-N 3.32Å; I150-T152 PolarHBondContact O-N 3.42Å; I150-E153 PolarHBondContact O-N 2.98Å; I150-L154 PolarHBondContact O-N 2.99Å; I150-M162 HydrophobicContact CB-CE 4.02Å; I150-M162 HydrophobicContact CG2-CE 3.8Å; I150-M162 HydrophobicContact CG2-SD 4.35Å
151Y85.7Confident86.2Confident75 Ų7596.7 Ų96.729%0.29449%0.49SS..Hα-helixtrans-63.8-37179.5-175.4-98.1000112.5V147 L148 P149 P157 M162V147-Y151 WeakPolarHBondContact O-CB 3.46Å; V147-Y151 PolarHBondContact O-N 3.28Å; L148-Y151 WeakPolarHBondContact O-CB 3.46Å; L148-Y151 PolarHBondContact O-N 3.46Å; P149-Y151 VanDerWaalsContact C-N 3.33Å; P149-Y151 PolarHBondContact O-N 2.89Å; Y151-P157 HydrophobicContact CD1-CB 4.31Å; Y151-P157 HydrophobicContact CD2-CB 4.36Å; Y151-P157 HydrophobicContact CE1-CB 3.85Å; Y151-P157 HydrophobicContact CE1-CG 4.5Å; Y151-P157 HydrophobicContact CE2-CB 3.93Å; Y151-M162 HydrophobicContact CD2-CB 3.79Å; Y151-M162 HydrophobicContact CD2-CG 3.71Å; Y151-M162 HydrophobicContact CD2-SD 4.06Å; Y151-M162 HydrophobicContact CE2-CB 4.03Å; Y151-M162 HydrophobicContact CE2-CG 4.41Å
152T85.9Confident86.3Confident104 Ų10493.9 Ų93.964%0.63848%0.478SS*.Hα-helixtrans-75.1-25.6-178.949.10000113.8L148 P149 I150L148-T152 PolarHBondContact O-N 2.91Å; L148-T152 PolarHBondContact O-OG1 2.88Å; P149-T152 PolarHBondContact O-N 3.32Å; P149-T152 PolarHBondContact O-OG1 3.46Å; I150-T152 VanDerWaalsContact C-N 3.32Å; I150-T152 PolarHBondContact O-N 3.42Å
153E84.4Confident86.4Confident114 Ų11496.9 Ų96.953%0.53349%0.487SS..Hα-helixtrans-87.8-12.6177-66.3-66.1141.300112.8L54 P149 I150 K155L54-E153 HydrophobicContact CB-CG 4.11Å; L54-E153 HydrophobicContact CD2-CG 4.38Å; P149-E153 PolarHBondContact O-N 3.48Å; I150-E153 PolarHBondContact O-N 2.98Å; E153-K155 PolarHBondContact O-N 3.27Å
154L83.6Confident86.6Confident47 Ų47100.5 Ų100.525%0.24650%0.498CS..SBendtrans-70.4128.9-178.1-166.773.1000111.3I150 D156 P157 I165I150-L154 PolarHBondContact O-N 2.99Å; L154-D156 PolarHBondContact O-N 3.39Å; L154-P157 WeakPolarHBondContact O-CD 3.27Å; L154-I165 HydrophobicContact CD1-CD1 3.79Å; L154-I165 HydrophobicContact CD2-CD1 3.87Å
155K80.9Confident86.9Confident180 Ų18097.1 Ų97.178%0.78348%0.484SS*.SBendtrans-62.9119.8173.4-169.9174.4-178.51790110.7E153E153-K155 PolarHBondContact O-N 3.27Å
156D85.9Confident87Confident113 Ų11395.4 Ų95.460%0.60447%0.473SS*.SBendtrans54.773.3-175-56.8-48.8000113.3L154 S158 K161L154-D156 PolarHBondContact O-N 3.39Å; D156-S158 PolarHBondContact O-N 3.05Å; D156-K161 PolarHBondContact O-NZ 2.94Å
157P84.8Confident87.3Confident68 Ų6895.6 Ų95.644%0.44248%0.478SS..  trans-69.6130-171.129.4-34.8000111.4Y151 L154Y151-P157 HydrophobicContact CD1-CB 4.31Å; Y151-P157 HydrophobicContact CD2-CB 4.36Å; Y151-P157 HydrophobicContact CE1-CB 3.85Å; Y151-P157 HydrophobicContact CE1-CG 4.5Å; Y151-P157 HydrophobicContact CE2-CB 3.93Å; L154-P157 WeakPolarHBondContact O-CD 3.27Å
158S92.4Very high87.5Confident50 Ų5098.2 Ų98.235%0.3549%0.49SS..  trans-142.2141.9177.11760000110D156 K160 K161 M162D156-S158 PolarHBondContact O-N 3.05Å; S158-K160 VanDerWaalsContact C-N 3.26Å; S158-K160 PolarHBondContact O-N 3.47Å; S158-K161 PolarHBondContact O-N 3Å; S158-K161 VanDerWaalsContact O-N 3.15Å; S158-M162 PolarHBondContact O-N 3.35Å
159K89.2Confident87.7Confident178 Ų17895.1 Ų95.177%0.77448%0.479SS*.Hα-helixtrans-54.1-41.9179-63.5-175.4-178.8-178.40112.4Q163K159-Q163 WeakPolarHBondContact O-CB 3.33Å; K159-Q163 PolarHBondContact O-N 2.87Å
160K89.9Confident88Confident182 Ų18296.5 Ų96.579%0.79148%0.483SS*.Hα-helixtrans-66.4-43.4179.8-69.3-175.6178.7-179.40112S158 H164S158-K160 VanDerWaalsContact C-N 3.26Å; S158-K160 PolarHBondContact O-N 3.47Å; K160-H164 WeakPolarHBondContact O-CB 3.23Å; K160-H164 PolarHBondContact O-N 3.26Å; K160-H164 VanDerWaalsContact O-N 3.1Å
161K88.1Confident88.4Confident105 Ų10594.2 Ų94.246%0.45748%0.478SS..Hα-helixtrans-65-47177.9-69.7-176.9-178.1174.40110.9D156 S158 Q163 H164 I165D156-K161 PolarHBondContact O-NZ 2.94Å; S158-K161 PolarHBondContact O-N 3Å; S158-K161 VanDerWaalsContact O-N 3.15Å; K161-Q163 PolarHBondContact O-N 3.48Å; K161-H164 PolarHBondContact O-N 3.15Å; K161-I165 VanDerWaalsContact O-CG1 3.27Å; K161-I165 WeakPolarHBondContact O-CG1 3.32Å; K161-I165 PolarHBondContact O-N 3.22Å
162M89.1Confident88.7Confident19 Ų1993.7 Ų93.79%0.09448%0.482CS..Hα-helixtrans-61.3-43.2179.2-171.664.6-179.300112.1V147 I150 Y151 S158 H164 I165 S166V147-M162 HydrophobicContact CB-CE 4.28Å; V147-M162 HydrophobicContact CG1-CE 3.54Å; V147-M162 VanDerWaalsContact O-CE 3.29Å; V147-M162 WeakPolarHBondContact O-CE 3.24Å; I150-M162 HydrophobicContact CB-CE 4.02Å; I150-M162 HydrophobicContact CG2-CE 3.8Å; I150-M162 HydrophobicContact CG2-SD 4.35Å; Y151-M162 HydrophobicContact CD2-CB 3.79Å; Y151-M162 HydrophobicContact CD2-CG 3.71Å; Y151-M162 HydrophobicContact CD2-SD 4.06Å; Y151-M162 HydrophobicContact CE2-CB 4.03Å; Y151-M162 HydrophobicContact CE2-CG 4.41Å; S158-M162 PolarHBondContact O-N 3.35Å; M162-H164 VanDerWaalsContact C-N 3.34Å; M162-H164 PolarHBondContact O-N 3.16Å; M162-I165 PolarHBondContact O-N 3.3Å; M162-S166 VanDerWaalsContact O-CB 3.23Å; M162-S166 WeakPolarHBondContact O-CB 3.49Å; M162-S166 PolarHBondContact O-N 3.18Å
163Q89.4Confident88.9Confident131 Ų13191.7 Ų91.761%0.61247%0.466SS*.Hα-helixtrans-63.3-40.7177.4-170.864.236.700112K159 K161 N167K159-Q163 WeakPolarHBondContact O-CB 3.33Å; K159-Q163 PolarHBondContact O-N 2.87Å; K161-Q163 PolarHBondContact O-N 3.48Å; Q163-N167 VanDerWaalsContact O-CB 3.29Å; Q163-N167 WeakPolarHBondContact O-CB 3.29Å; Q163-N167 PolarHBondContact O-N 3.42Å
164H90.7Very high89.2Confident133 Ų13392.6 Ų92.662%0.61647%0.466SS*.Hα-helixtrans-65.8-46.6177.9-172.869.1000111.8K160 K161 M162 N167 L168K160-H164 WeakPolarHBondContact O-CB 3.23Å; K160-H164 PolarHBondContact O-N 3.26Å; K160-H164 VanDerWaalsContact O-N 3.1Å; K161-H164 PolarHBondContact O-N 3.15Å; M162-H164 VanDerWaalsContact C-N 3.34Å; M162-H164 PolarHBondContact O-N 3.16Å; H164-N167 PolarHBondContact O-N 3.05Å; H164-L168 WeakPolarHBondContact O-CB 3.03Å; H164-L168 PolarHBondContact O-N 3.31Å
165I89.7Confident89.7Confident67 Ų6795 Ų9534%0.34448%0.478SS..Hα-helixtrans-60.1-48.8176.7-65.8163.9000109.9L154 K161 M162 N167 L168 S169L154-I165 HydrophobicContact CD1-CD1 3.79Å; L154-I165 HydrophobicContact CD2-CD1 3.87Å; K161-I165 VanDerWaalsContact O-CG1 3.27Å; K161-I165 WeakPolarHBondContact O-CG1 3.32Å; K161-I165 PolarHBondContact O-N 3.22Å; M162-I165 PolarHBondContact O-N 3.3Å; I165-N167 PolarHBondContact O-N 3.2Å; I165-L168 PolarHBondContact O-N 3.43Å; I165-S169 WeakPolarHBondContact O-CB 3.29Å; I165-S169 PolarHBondContact O-N 3.16Å; I165-S169 PolarHBondContact O-OG 3.4Å; I165-S169 VanDerWaalsContact O-OG 3.07Å
166S89.8Confident90.2Very high28 Ų2887.7 Ų87.720%0.19645%0.447CS..Hα-helixtrans-59.8-47.2179.2-179.10000112.4M162 L168 S169 I170M162-S166 VanDerWaalsContact O-CB 3.23Å; M162-S166 WeakPolarHBondContact O-CB 3.49Å; M162-S166 PolarHBondContact O-N 3.18Å; S166-L168 VanDerWaalsContact C-N 3.33Å; S166-L168 PolarHBondContact O-N 2.97Å; S166-S169 PolarHBondContact O-N 2.97Å; S166-I170 VanDerWaalsContact O-CG1 3.31Å; S166-I170 WeakPolarHBondContact O-CG1 3.37Å; S166-I170 PolarHBondContact O-N 3.2Å
167N90.8Very high90.4Very high101 Ų10186.9 Ų86.954%0.5444%0.436SS..Hα-helixtrans-63.6-39.2178.8-169.250.7000112.1Q163 H164 I165 A171Q163-N167 VanDerWaalsContact O-CB 3.29Å; Q163-N167 WeakPolarHBondContact O-CB 3.29Å; Q163-N167 PolarHBondContact O-N 3.42Å; H164-N167 PolarHBondContact O-N 3.05Å; I165-N167 PolarHBondContact O-N 3.2Å; N167-A171 WeakPolarHBondContact O-CB 3.47Å; N167-A171 PolarHBondContact O-N 3.35Å
168L92.6Very high90.7Very high101 Ų10188.9 Ų88.953%0.52944%0.438SS..Hα-helixtrans-65.1-46.2175.2-178.861.9000111.4H164 I165 S166 I170 A171 V172H164-L168 WeakPolarHBondContact O-CB 3.03Å; H164-L168 PolarHBondContact O-N 3.31Å; I165-L168 PolarHBondContact O-N 3.43Å; S166-L168 VanDerWaalsContact C-N 3.33Å; S166-L168 PolarHBondContact O-N 2.97Å; L168-I170 PolarHBondContact O-N 3.29Å; L168-A171 PolarHBondContact O-N 3.24Å; L168-V172 HydrophobicContact CD1-CG2 4.35Å; L168-V172 WeakPolarHBondContact O-CG2 3.3Å; L168-V172 PolarHBondContact O-N 3.42Å
169S90.6Very high90.6Very high65 Ų6589 Ų8946%0.45544%0.435SS..Hα-helixtrans-60.3-45.5177.6-63.40000111.9I165 S166 A171 V172 M173I165-S169 WeakPolarHBondContact O-CB 3.29Å; I165-S169 PolarHBondContact O-N 3.16Å; I165-S169 PolarHBondContact O-OG 3.4Å; I165-S169 VanDerWaalsContact O-OG 3.07Å; S166-S169 PolarHBondContact O-N 2.97Å; S169-A171 VanDerWaalsContact C-N 3.34Å; S169-A171 PolarHBondContact O-N 3.46Å; S169-V172 PolarHBondContact O-N 3.1Å; S169-M173 WeakPolarHBondContact O-CB 3.44Å; S169-M173 VanDerWaalsContact O-CG 3.29Å; S169-M173 WeakPolarHBondContact O-CG 3.41Å; S169-M173 PolarHBondContact O-N 3.1Å
170I90.8Very high90.6Very high74 Ų7481.6 Ų81.638%0.37941%0.407SS..Hα-helixtrans-62.4-42.4176.8-68.1167.3000110.7S166 L168 M173 Y174S166-I170 VanDerWaalsContact O-CG1 3.31Å; S166-I170 WeakPolarHBondContact O-CG1 3.37Å; S166-I170 PolarHBondContact O-N 3.2Å; L168-I170 PolarHBondContact O-N 3.29Å; I170-M173 PolarHBondContact O-N 2.92Å; I170-Y174 VanDerWaalsContact O-CB 3.27Å; I170-Y174 WeakPolarHBondContact O-CB 3.4Å; I170-Y174 PolarHBondContact O-N 3.49Å
171A92.4Very high90.5Very high43 Ų4376.1 Ų76.136%0.35540%0.395SS..Hα-helixtrans-63.2-44.5178.100000112.3N167 L168 S169 Y174 I175N167-A171 WeakPolarHBondContact O-CB 3.47Å; N167-A171 PolarHBondContact O-N 3.35Å; L168-A171 PolarHBondContact O-N 3.24Å; S169-A171 VanDerWaalsContact C-N 3.34Å; S169-A171 PolarHBondContact O-N 3.46Å; A171-Y174 PolarHBondContact O-N 2.86Å; A171-I175 VanDerWaalsContact O-CG1 3.31Å; A171-I175 WeakPolarHBondContact O-CG1 3.5Å; A171-I175 PolarHBondContact O-N 3.11Å
172V91.7Very high90.5Very high65 Ų6574.3 Ų74.339%0.39439%0.39SS..Hα-helixtrans-62.5-47.7177.1172.20000110.8L168 S169 Y174 I175 M176L168-V172 HydrophobicContact CD1-CG2 4.35Å; L168-V172 WeakPolarHBondContact O-CG2 3.3Å; L168-V172 PolarHBondContact O-N 3.42Å; S169-V172 PolarHBondContact O-N 3.1Å; V172-Y174 VanDerWaalsContact C-N 3.34Å; V172-Y174 PolarHBondContact O-N 2.9Å; V172-I175 PolarHBondContact O-N 3.44Å; V172-M176 HydrophobicContact CG1-SD 4.34Å; V172-M176 WeakPolarHBondContact O-CG 3.46Å; V172-M176 PolarHBondContact O-N 3.26Å
173M90.4Very high90.3Very high61 Ų6175.5 Ų75.530%0.340%0.395SS..Hα-helixtrans-61.8-41.6178.2-71-58.8-59.800112.1S169 I170 I175 M176 Y177S169-M173 WeakPolarHBondContact O-CB 3.44Å; S169-M173 VanDerWaalsContact O-CG 3.29Å; S169-M173 WeakPolarHBondContact O-CG 3.41Å; S169-M173 PolarHBondContact O-N 3.1Å; I170-M173 PolarHBondContact O-N 2.92Å; M173-I175 PolarHBondContact O-N 3.15Å; M173-M176 PolarHBondContact O-N 3.42Å; M173-Y177 HydrophobicContact CE-CD1 4.5Å; M173-Y177 HydrophobicContact CE-CE1 3.64Å; M173-Y177 HydrophobicContact CE-CE2 3.83Å; M173-Y177 WeakPolarHBondContact CE-OH 3.46Å; M173-Y177 WeakPolarHBondContact O-CB 3.33Å; M173-Y177 PolarHBondContact O-N 3.03Å
174Y91.5Very high90Very high134 Ų13469.3 Ų69.353%0.52537%0.366SS..Hα-helixtrans-59.2-46.5175.7177.6-92.9000111.8F141 I170 A171 V172 Y177 F178F141-Y174 HydrophobicContact CE1-CD2 4.39Å; F141-Y174 HydrophobicContact CZ-CD2 4.01Å; I170-Y174 VanDerWaalsContact O-CB 3.27Å; I170-Y174 WeakPolarHBondContact O-CB 3.4Å; I170-Y174 PolarHBondContact O-N 3.49Å; A171-Y174 PolarHBondContact O-N 2.86Å; V172-Y174 VanDerWaalsContact C-N 3.34Å; V172-Y174 PolarHBondContact O-N 2.9Å; Y174-Y177 PolarHBondContact O-N 2.96Å; Y174-F178 VanDerWaalsContact O-CB 3.24Å; Y174-F178 WeakPolarHBondContact O-CB 3.32Å; Y174-F178 PolarHBondContact O-N 3.23Å
175I93.1Very high89.7Confident98 Ų9866.2 Ų66.250%0.50335%0.349SS..Hα-helixtrans-62-46177.9-68.1165.3000110.5A171 V172 M173 F178 L179A171-I175 VanDerWaalsContact O-CG1 3.31Å; A171-I175 WeakPolarHBondContact O-CG1 3.5Å; A171-I175 PolarHBondContact O-N 3.11Å; V172-I175 PolarHBondContact O-N 3.44Å; M173-I175 PolarHBondContact O-N 3.15Å; I175-F178 PolarHBondContact O-N 3.27Å; I175-L179 HydrophobicContact CG2-CD1 3.84Å; I175-L179 HydrophobicContact CG2-CG 4.33Å; I175-L179 WeakPolarHBondContact O-CB 3.49Å; I175-L179 VanDerWaalsContact O-CG 3.28Å; I175-L179 WeakPolarHBondContact O-CG 3.24Å; I175-L179 PolarHBondContact O-N 3.01Å
176M90.7Very high89.2Confident26 Ų2664.9 Ų64.913%0.12834%0.342CS..Hα-helixtrans-61-47.8178.9-72.8-173.367.200112.1L65 M68 V69 L72 V172 M173 F178 L179 A180L65-M176 HydrophobicContact CD1-SD 4.14Å; M68-M176 HydrophobicContact CB-CE 3.69Å; V69-M176 HydrophobicContact CG2-CE 3.73Å; V69-M176 HydrophobicContact CG2-SD 4.28Å; L72-M176 HydrophobicContact CD1-CB 4.23Å; L72-M176 HydrophobicContact CD1-CG 4.37Å; L72-M176 WeakPolarHBondContact CD1-O 3.42Å; V172-M176 HydrophobicContact CG1-SD 4.34Å; V172-M176 WeakPolarHBondContact O-CG 3.46Å; V172-M176 PolarHBondContact O-N 3.26Å; M173-M176 PolarHBondContact O-N 3.42Å; M176-F178 PolarHBondContact O-N 3Å; M176-L179 PolarHBondContact O-N 3.27Å; M176-A180 WeakPolarHBondContact O-CB 3.31Å; M176-A180 PolarHBondContact O-N 3.49Å
177Y90.8Very high88.6Confident96 Ų9663.7 Ų63.738%0.37633%0.334SS..Hα-helixtrans-64.5-39.8178-69-18.7000112.5F141 M173 Y174 A181F141-Y177 HydrophobicContact CE1-CD2 4.25Å; F141-Y177 HydrophobicContact CZ-CD2 4.05Å; M173-Y177 HydrophobicContact CE-CD1 4.5Å; M173-Y177 HydrophobicContact CE-CE1 3.64Å; M173-Y177 HydrophobicContact CE-CE2 3.83Å; M173-Y177 WeakPolarHBondContact CE-OH 3.46Å; M173-Y177 WeakPolarHBondContact O-CB 3.33Å; M173-Y177 PolarHBondContact O-N 3.03Å; Y174-Y177 PolarHBondContact O-N 2.96Å; Y177-A181 VanDerWaalsContact O-CB 3.24Å; Y177-A181 WeakPolarHBondContact O-CB 3.24Å; Y177-A181 PolarHBondContact O-N 2.86Å
178F91.5Very high87.7Confident109 Ų10959.2 Ų59.248%0.47831%0.31SS..Hα-helixtrans-63-47176.7179.5-98.9000111.9Y174 I175 M176 A181 L182Y174-F178 VanDerWaalsContact O-CB 3.24Å; Y174-F178 WeakPolarHBondContact O-CB 3.32Å; Y174-F178 PolarHBondContact O-N 3.23Å; I175-F178 PolarHBondContact O-N 3.27Å; M176-F178 PolarHBondContact O-N 3Å; F178-A181 PolarHBondContact O-N 3.35Å; F178-L182 HydrophobicContact CE1-CD2 4.14Å; F178-L182 HydrophobicContact CZ-CD2 4.5Å; F178-L182 VanDerWaalsContact O-CB 3.23Å; F178-L182 WeakPolarHBondContact O-CB 3.48Å; F178-L182 PolarHBondContact O-N 3.48Å
179L90.9Very high87Confident54 Ų5455.9 Ų55.928%0.28329%0.29SS..Hα-helixtrans-65.3-43.9178.4-68.1174.7000111.7L72 I175 M176 A181 L182 F183L72-L179 HydrophobicContact CD1-CB 3.91Å; L72-L179 HydrophobicContact CD1-CD1 4.42Å; I175-L179 HydrophobicContact CG2-CD1 3.84Å; I175-L179 HydrophobicContact CG2-CG 4.33Å; I175-L179 WeakPolarHBondContact O-CB 3.49Å; I175-L179 VanDerWaalsContact O-CG 3.28Å; I175-L179 WeakPolarHBondContact O-CG 3.24Å; I175-L179 PolarHBondContact O-N 3.01Å; M176-L179 PolarHBondContact O-N 3.27Å; L179-A181 VanDerWaalsContact C-N 3.35Å; L179-A181 PolarHBondContact O-N 3.43Å; L179-L182 PolarHBondContact O-N 2.83Å; L179-F183 HydrophobicContact CB-CD2 4.37Å; L179-F183 HydrophobicContact CD2-CE2 3.99Å; L179-F183 WeakPolarHBondContact O-CB 3.48Å; L179-F183 VanDerWaalsContact O-CD2 3.23Å; L179-F183 WeakPolarHBondContact O-CD2 3.3Å; L179-F183 PolarHBondContact O-N 2.94Å
180A88.6Confident86.1Confident22 Ų2256.8 Ų56.818%0.18229%0.29CS..Hα-helixtrans-61.3-43.1176.700000111.7M176 G184M176-A180 WeakPolarHBondContact O-CB 3.31Å; M176-A180 PolarHBondContact O-N 3.49Å; A180-G184 VanDerWaalsContact O-CA 3.3Å; A180-G184 WeakPolarHBondContact O-CA 3.2Å; A180-G184 PolarHBondContact O-N 2.9Å
181A87.6Confident85.1Confident66 Ų6654.1 Ų54.155%0.54528%0.281SS..Hα-helixtrans-66.5-43.5176.400000112Y177 F178 L179 Y185Y177-A181 VanDerWaalsContact O-CB 3.24Å; Y177-A181 WeakPolarHBondContact O-CB 3.24Å; Y177-A181 PolarHBondContact O-N 2.86Å; F178-A181 PolarHBondContact O-N 3.35Å; L179-A181 VanDerWaalsContact C-N 3.35Å; L179-A181 PolarHBondContact O-N 3.43Å; A181-Y185 WeakPolarHBondContact O-CB 3.3Å; A181-Y185 PolarHBondContact O-N 2.91Å
182L87.5Confident84.2Confident68 Ų6854.8 Ų54.836%0.35628%0.28SS..Hα-helixtrans-63.3-54.7179.8-179.864.6000111.4F178 L179 L186F178-L182 HydrophobicContact CE1-CD2 4.14Å; F178-L182 HydrophobicContact CZ-CD2 4.5Å; F178-L182 VanDerWaalsContact O-CB 3.23Å; F178-L182 WeakPolarHBondContact O-CB 3.48Å; F178-L182 PolarHBondContact O-N 3.48Å; L179-L182 PolarHBondContact O-N 2.83Å; L182-L186 HydrophobicContact CD1-CD1 3.95Å; L182-L186 HydrophobicContact CD1-CG 4.38Å; L182-L186 HydrophobicContact CG-CD1 3.98Å; L182-L186 VanDerWaalsContact O-CB 3.25Å; L182-L186 WeakPolarHBondContact O-CB 3.23Å; L182-L186 WeakPolarHBondContact O-CG 3.28Å; L182-L186 PolarHBondContact O-N 3.49Å
183F86.5Confident83.5Confident44 Ų4455 Ų5519%0.19328%0.277CS..Hα-helixtrans-73.1-33.3-178.7-69.7-65.2000112.5V75 I76 K79 L179 L186 T187V75-F183 HydrophobicContact CG1-CB 3.91Å; I76-F183 HydrophobicContact CD1-CD2 4.06Å; I76-F183 HydrophobicContact CD1-CE2 4.03Å; I76-F183 HydrophobicContact CG1-CB 4.38Å; I76-F183 HydrophobicContact CG1-CD2 3.51Å; I76-F183 HydrophobicContact CG1-CE2 3.85Å; I76-F183 HydrophobicContact CG1-CG 3.95Å; K79-F183 HydrophobicContact CB-CD1 4.42Å; K79-F183 HydrophobicContact CG-CD1 4.11Å; L179-F183 HydrophobicContact CB-CD2 4.37Å; L179-F183 HydrophobicContact CD2-CE2 3.99Å; L179-F183 WeakPolarHBondContact O-CB 3.48Å; L179-F183 VanDerWaalsContact O-CD2 3.23Å; L179-F183 WeakPolarHBondContact O-CD2 3.3Å; L179-F183 PolarHBondContact O-N 2.94Å; F183-L186 PolarHBondContact O-N 3.37Å; F183-T187 PolarHBondContact O-N 3.46Å; F183-T187 PolarHBondContact O-OG1 3.22Å
184G83Confident82.8Confident0 Ų057.4 Ų57.40%030%0.3CS..Hα-helixtrans-61.6-49.5172.900000112.1A180 T187A180-G184 VanDerWaalsContact O-CA 3.3Å; A180-G184 WeakPolarHBondContact O-CA 3.2Å; A180-G184 PolarHBondContact O-N 2.9Å; G184-T187 PolarHBondContact O-N 3.21Å
185Y83.7Confident82.2Confident68 Ų6855.8 Ų55.827%0.26730%0.297SS..Hα-helixtrans-63.2-47174.5176.4-105000111.5S122 A181 T187 F188 Y189 V192S122-Y185 PolarHBondContact N-OH 2.95Å; S122-Y185 VanDerWaalsContact N-OH 3.12Å; A181-Y185 WeakPolarHBondContact O-CB 3.3Å; A181-Y185 PolarHBondContact O-N 2.91Å; Y185-T187 PolarHBondContact O-N 3.43Å; Y185-T187 VanDerWaalsContact O-N 3.09Å; Y185-F188 PolarHBondContact O-N 2.89Å; Y185-Y189 WeakPolarHBondContact CE2-O 3.4Å; Y185-Y189 WeakPolarHBondContact O-CA 3.49Å; Y185-Y189 PolarHBondContact O-N 3.04Å; Y185-V192 HydrophobicContact CD2-CG1 4.24Å
186L79.3Confident81.5Confident39 Ų3953.1 Ų53.120%0.20428%0.284CS..Hα-helixtrans-62.7-18.5179.4-75173.9000113.3K79 L182 F183 Y189K79-L186 HydrophobicContact CD-CB 4.01Å; K79-L186 PolarHBondContact NZ-O 3.23Å; L182-L186 HydrophobicContact CD1-CD1 3.95Å; L182-L186 HydrophobicContact CD1-CG 4.38Å; L182-L186 HydrophobicContact CG-CD1 3.98Å; L182-L186 VanDerWaalsContact O-CB 3.25Å; L182-L186 WeakPolarHBondContact O-CB 3.23Å; L182-L186 WeakPolarHBondContact O-CG 3.28Å; L182-L186 PolarHBondContact O-N 3.49Å; F183-L186 PolarHBondContact O-N 3.37Å; L186-Y189 HydrophobicContact CD2-CE1 3.82Å; L186-Y189 WeakPolarHBondContact O-CE2 3.32Å
187T76.4Confident80.7Confident4 Ų453.9 Ų53.93%0.02529%0.288CS..Hα-helixtrans-75-36.1178.1-58.30000111.8F183 G184 Y185 Y200F183-T187 PolarHBondContact O-N 3.46Å; F183-T187 PolarHBondContact O-OG1 3.22Å; G184-T187 PolarHBondContact O-N 3.21Å; Y185-T187 PolarHBondContact O-N 3.43Å; Y185-T187 VanDerWaalsContact O-N 3.09Å; T187-Y200 HydrophobicContact CG2-CE1 4.2Å
188F71.7Confident79.8Confident6 Ų652.3 Ų52.33%0.02628%0.284CS..Hα-helixtrans-121.9-11.3-172.5-59.9-63.5000114.9L86 Y185 N190 G191 V192 T199 Y200 V203L86-F188 HydrophobicContact CD2-CD1 3.86Å; L86-F188 HydrophobicContact CD2-CE1 4.24Å; Y185-F188 PolarHBondContact O-N 2.89Å; F188-N190 PolarHBondContact O-N 3.03Å; F188-G191 PolarHBondContact O-N 3.45Å; F188-V192 HydrophobicContact CB-CB 4.22Å; F188-T199 HydrophobicContact CB-CG2 4.07Å; F188-T199 HydrophobicContact CD1-CG2 3.62Å; F188-T199 HydrophobicContact CD2-CG2 3.45Å; F188-T199 VanDerWaalsContact CD2-CG2 3.45Å; F188-T199 HydrophobicContact CE1-CG2 3.84Å; F188-T199 HydrophobicContact CE2-CG2 3.65Å; F188-T199 HydrophobicContact CG-CG2 3.41Å; F188-T199 VanDerWaalsContact CG-CG2 3.41Å; F188-T199 HydrophobicContact CZ-CG2 3.84Å; F188-Y200 HydrophobicContact CE2-CD1 4.03Å; F188-Y200 AromaticContact CE2-CD2 3.74Å; F188-Y200 HydrophobicContact CE2-CD2 3.74Å; F188-Y200 AromaticContact CE2-CE1 3.85Å; F188-Y200 HydrophobicContact CE2-CE1 3.85Å; F188-Y200 AromaticContact CE2-CE2 3.56Å; F188-Y200 HydrophobicContact CE2-CE2 3.56Å; F188-Y200 AromaticContact CE2-CG 3.96Å; F188-Y200 HydrophobicContact CE2-CG 3.96Å; F188-Y200 AromaticContact CE2-CZ 3.61Å; F188-Y200 AromaticContact CZ-CD1 3.58Å; F188-Y200 HydrophobicContact CZ-CD1 3.58Å; F188-Y200 HydrophobicContact CZ-CD2 4.11Å; F188-Y200 AromaticContact CZ-CE1 3.59Å; F188-Y200 HydrophobicContact CZ-CE1 3.59Å; F188-Y200 HydrophobicContact CZ-CE2 4.13Å; F188-Y200 AromaticContact CZ-CG 3.84Å; F188-Y200 HydrophobicContact CZ-CG 3.84Å; F188-Y200 AromaticContact CZ-CZ 3.87Å; F188-V203 HydrophobicContact CE1-CB 4.49Å; F188-V203 HydrophobicContact CE1-CG2 3.82Å
189Y79.6Confident78.9Confident31 Ų3147.1 Ų47.112%0.12226%0.261CS..G310 helixtrans47.9-118.2-178.9-63.7-88000111.9K79 F118 P121 Y185 L186 G191 V192K79-Y189 PolarHBondContact NZ-OH 3.49Å; K79-Y189 VanDerWaalsContact NZ-OH 3.13Å; F118-Y189 WeakPolarHBondContact O-CB 3.28Å; P121-Y189 HydrophobicContact CB-CD1 4.37Å; P121-Y189 HydrophobicContact CB-CE1 4.2Å; Y185-Y189 WeakPolarHBondContact CE2-O 3.4Å; Y185-Y189 WeakPolarHBondContact O-CA 3.49Å; Y185-Y189 PolarHBondContact O-N 3.04Å; L186-Y189 HydrophobicContact CD2-CE1 3.82Å; L186-Y189 WeakPolarHBondContact O-CE2 3.32Å; Y189-G191 PolarHBondContact O-N 3.19Å; Y189-V192 PolarHBondContact O-N 3.42Å
190N70.5Confident78Confident85 Ų8545 Ų4546%0.45525%0.25SC..G310 helixtrans-73.8-6.4-178.3-65.5-40.5000113.7F118 F188F118-N190 HydrophobicContact CD1-CB 4.45Å; F188-N190 PolarHBondContact O-N 3.03Å
191G68.9Low77Confident17 Ų1745 Ų4518%0.17525%0.248CC..G310 helixtrans-967.4177.400000114.9F90 F188 Y189F90-G191 VanDerWaalsContact CE1-O 3.31Å; F90-G191 WeakPolarHBondContact CE1-O 3.23Å; F90-G191 VanDerWaalsContact CZ-O 3.23Å; F90-G191 WeakPolarHBondContact CZ-O 3.47Å; F188-G191 PolarHBondContact O-N 3.45Å; Y189-G191 PolarHBondContact O-N 3.19Å
192V74.6Confident76Confident58 Ų5847.1 Ų47.135%0.35225%0.245SC..  trans-71.5130.6179.172.50000111Y185 F188 Y189 L196Y185-V192 HydrophobicContact CD2-CG1 4.24Å; F188-V192 HydrophobicContact CB-CB 4.22Å; Y189-V192 PolarHBondContact O-N 3.42Å; V192-L196 HydrophobicContact CG2-CD1 4.4Å
193E76.4Confident75Confident68 Ų6845.3 Ų45.332%0.31824%0.237SC..  trans-86.2173.8174.7-155165.7144.700110.5E195 H198 T199 K202E193-E195 PolarHBondContact O-N 2.87Å; E193-H198 IonicContact OE1-CE1 3.3Å; E193-H198 PolarHBondContact OE1-CE1 3.01Å; E193-H198 VanDerWaalsContact OE1-CE1 3.3Å; E193-H198 IonicContact OE1-CG 3.82Å; E193-H198 IonicContact OE1-ND1 2.79Å; E193-H198 PolarHBondContact OE1-ND1 3.03Å; E193-H198 IonicContact OE2-ND1 3.63Å; E193-T199 VanDerWaalsContact CB-OG1 3.24Å; E193-T199 WeakPolarHBondContact CB-OG1 3.15Å; E193-T199 PolarHBondContact N-OG1 2.91Å; E193-K202 IonicContact OE1-NZ 3.78Å; E193-K202 IonicContact OE2-NZ 2.65Å; E193-K202 PolarHBondContact OE2-NZ 3.35Å
194S76.4Confident73.8Confident112 Ų11246.3 Ų46.378%0.78324%0.244SC*.SBendtrans-60.1-26.2175.353.80000113
195E78.5Confident72.7Confident100 Ų10049.2 Ų49.247%0.46726%0.263SS..SBendtrans-117.5115177.3-62.6-63.4164.100110.1E193 L197 H198 T199E193-E195 PolarHBondContact O-N 2.87Å; E195-L197 VanDerWaalsContact C-N 3.27Å; E195-L197 PolarHBondContact O-N 3.34Å; E195-H198 HydrophobicContact CB-CB 4.1Å; E195-H198 WeakPolarHBondContact O-CB 3.24Å; E195-H198 PolarHBondContact O-N 3.23Å; E195-H198 VanDerWaalsContact O-N 3.12Å; E195-T199 PolarHBondContact O-N 2.84Å
196L77.9Confident71.3Confident43 Ų4352.3 Ų52.323%0.22528%0.278CS..Hα-helixtrans-58.2-40.3-176.7-166.998.1000112.1F71 V75 V192 H198 T199 Y200F71-L196 HydrophobicContact CE2-CD2 4.14Å; F71-L196 HydrophobicContact CZ-CD2 3.55Å; V75-L196 HydrophobicContact CG2-CD2 4.08Å; V192-L196 HydrophobicContact CG2-CD1 4.4Å; L196-H198 VanDerWaalsContact C-N 3.28Å; L196-H198 PolarHBondContact O-N 3.24Å; L196-T199 WeakPolarHBondContact O-CB 3.25Å; L196-T199 PolarHBondContact O-N 3.27Å; L196-Y200 HydrophobicContact CD2-CD2 4.08Å; L196-Y200 HydrophobicContact CD2-CE2 3.64Å; L196-Y200 HydrophobicContact CG-CD2 4.04Å; L196-Y200 HydrophobicContact CG-CE2 3.83Å; L196-Y200 VanDerWaalsContact O-CD2 3.3Å; L196-Y200 WeakPolarHBondContact O-CD2 3.23Å; L196-Y200 PolarHBondContact O-N 2.74Å; L196-Y200 VanDerWaalsContact O-N 3.1Å
197L74.1Confident70.6Confident41 Ų4153.1 Ų53.122%0.21528%0.282CS..Hα-helixtrans-65.2-31.6-179.3-79.5159.8000112.6E195 S201 V213 R214E195-L197 VanDerWaalsContact C-N 3.27Å; E195-L197 PolarHBondContact O-N 3.34Å; L197-S201 WeakPolarHBondContact O-CB 3.49Å; L197-S201 PolarHBondContact O-N 3.19Å; L197-S201 VanDerWaalsContact O-N 3.11Å; L197-V213 HydrophobicContact CD2-CG1 3.6Å; L197-R214 HydrophobicContact CD2-CG 3.71Å; L197-R214 PolarHBondContact O-NH2 3.35Å
198H72.4Confident69.9Low63 Ų6357.7 Ų57.729%0.29231%0.31SS..Hα-helixtrans-70.6-41.8176.8-167-170.6000110.6E193 E195 L196 Y200 S201 K202E193-H198 IonicContact OE1-CE1 3.3Å; E193-H198 PolarHBondContact OE1-CE1 3.01Å; E193-H198 VanDerWaalsContact OE1-CE1 3.3Å; E193-H198 IonicContact OE1-CG 3.82Å; E193-H198 IonicContact OE1-ND1 2.79Å; E193-H198 PolarHBondContact OE1-ND1 3.03Å; E193-H198 IonicContact OE2-ND1 3.63Å; E195-H198 HydrophobicContact CB-CB 4.1Å; E195-H198 WeakPolarHBondContact O-CB 3.24Å; E195-H198 PolarHBondContact O-N 3.23Å; E195-H198 VanDerWaalsContact O-N 3.12Å; L196-H198 VanDerWaalsContact C-N 3.28Å; L196-H198 PolarHBondContact O-N 3.24Å; H198-Y200 PolarHBondContact O-N 3.15Å; H198-S201 PolarHBondContact O-N 2.68Å; H198-K202 WeakPolarHBondContact NE2-CE 3.35Å; H198-K202 PolarHBondContact O-N 3.28Å
199T71.7Confident69.6Low0 Ų059.2 Ų59.20%032%0.319CS..Hα-helixtrans-59-45.4174.1-53.40000111.7F90 F188 E193 E195 L196 S201 K202 V203F90-T199 HydrophobicContact CE2-CG2 4.37Å; F90-T199 HydrophobicContact CZ-CG2 4Å; F188-T199 HydrophobicContact CB-CG2 4.07Å; F188-T199 HydrophobicContact CD1-CG2 3.62Å; F188-T199 HydrophobicContact CD2-CG2 3.45Å; F188-T199 VanDerWaalsContact CD2-CG2 3.45Å; F188-T199 HydrophobicContact CE1-CG2 3.84Å; F188-T199 HydrophobicContact CE2-CG2 3.65Å; F188-T199 HydrophobicContact CG-CG2 3.41Å; F188-T199 VanDerWaalsContact CG-CG2 3.41Å; F188-T199 HydrophobicContact CZ-CG2 3.84Å; E193-T199 VanDerWaalsContact CB-OG1 3.24Å; E193-T199 WeakPolarHBondContact CB-OG1 3.15Å; E193-T199 PolarHBondContact N-OG1 2.91Å; E195-T199 PolarHBondContact O-N 2.84Å; L196-T199 WeakPolarHBondContact O-CB 3.25Å; L196-T199 PolarHBondContact O-N 3.27Å; T199-S201 VanDerWaalsContact C-N 3.35Å; T199-S201 PolarHBondContact O-N 3.19Å; T199-K202 PolarHBondContact O-N 3.01Å; T199-V203 PolarHBondContact O-N 2.91Å
200Y71.9Confident69Low11 Ų1158.2 Ų58.24%0.04332%0.315CS..Hα-helixtrans-60.5-41.2176-87.3-70.5000113.2V75 K78 T187 F188 L196 H198 K202 V203 D204 I210V75-Y200 HydrophobicContact CG2-CE2 4.45Å; K78-Y200 HydrophobicContact CB-CE1 3.81Å; K78-Y200 HydrophobicContact CD-CE1 4.29Å; K78-Y200 HydrophobicContact CG-CE1 3.87Å; T187-Y200 HydrophobicContact CG2-CE1 4.2Å; F188-Y200 HydrophobicContact CE2-CD1 4.03Å; F188-Y200 AromaticContact CE2-CD2 3.74Å; F188-Y200 HydrophobicContact CE2-CD2 3.74Å; F188-Y200 AromaticContact CE2-CE1 3.85Å; F188-Y200 HydrophobicContact CE2-CE1 3.85Å; F188-Y200 AromaticContact CE2-CE2 3.56Å; F188-Y200 HydrophobicContact CE2-CE2 3.56Å; F188-Y200 AromaticContact CE2-CG 3.96Å; F188-Y200 HydrophobicContact CE2-CG 3.96Å; F188-Y200 AromaticContact CE2-CZ 3.61Å; F188-Y200 AromaticContact CZ-CD1 3.58Å; F188-Y200 HydrophobicContact CZ-CD1 3.58Å; F188-Y200 HydrophobicContact CZ-CD2 4.11Å; F188-Y200 AromaticContact CZ-CE1 3.59Å; F188-Y200 HydrophobicContact CZ-CE1 3.59Å; F188-Y200 HydrophobicContact CZ-CE2 4.13Å; F188-Y200 AromaticContact CZ-CG 3.84Å; F188-Y200 HydrophobicContact CZ-CG 3.84Å; F188-Y200 AromaticContact CZ-CZ 3.87Å; L196-Y200 HydrophobicContact CD2-CD2 4.08Å; L196-Y200 HydrophobicContact CD2-CE2 3.64Å; L196-Y200 HydrophobicContact CG-CD2 4.04Å; L196-Y200 HydrophobicContact CG-CE2 3.83Å; L196-Y200 VanDerWaalsContact O-CD2 3.3Å; L196-Y200 WeakPolarHBondContact O-CD2 3.23Å; L196-Y200 PolarHBondContact O-N 2.74Å; L196-Y200 VanDerWaalsContact O-N 3.1Å; H198-Y200 PolarHBondContact O-N 3.15Å; Y200-K202 VanDerWaalsContact C-N 3.28Å; Y200-K202 PolarHBondContact O-N 3.47Å; Y200-V203 PolarHBondContact O-N 2.91Å; Y200-D204 PolarHBondContact O-N 3.12Å; Y200-I210 HydrophobicContact CD1-CD1 4.07Å; Y200-I210 HydrophobicContact CD1-CG1 4.36Å; Y200-I210 HydrophobicContact CG-CD1 4.38Å; Y200-I210 HydrophobicContact CG-CG1 4.49Å
201S68.1Low68.8Low21 Ų2156.1 Ų56.115%0.14730%0.304CS..Hα-helixtrans-68-24.2-179.9-173.60000114.3L197 H198 T199 P205 R214L197-S201 WeakPolarHBondContact O-CB 3.49Å; L197-S201 PolarHBondContact O-N 3.19Å; L197-S201 VanDerWaalsContact O-N 3.11Å; H198-S201 PolarHBondContact O-N 2.68Å; T199-S201 VanDerWaalsContact C-N 3.35Å; T199-S201 PolarHBondContact O-N 3.19Å; S201-P205 WeakPolarHBondContact O-CA 3.1Å; S201-P205 WeakPolarHBondContact O-CB 3.09Å; S201-R214 PolarHBondContact OG-NH1 2.88Å; S201-R214 PolarHBondContact OG-NH2 3.09Å
202K67Low68.6Low110 Ų11058 Ų5848%0.47831%0.313SS..Hα-helixtrans-77.4-27.6174.5-72.8178.5178.6171.10112.5E193 H198 T199 Y200E193-K202 IonicContact OE1-NZ 3.78Å; E193-K202 IonicContact OE2-NZ 2.65Å; E193-K202 PolarHBondContact OE2-NZ 3.35Å; H198-K202 WeakPolarHBondContact NE2-CE 3.35Å; H198-K202 PolarHBondContact O-N 3.28Å; T199-K202 PolarHBondContact O-N 3.01Å; Y200-K202 VanDerWaalsContact C-N 3.28Å; Y200-K202 PolarHBondContact O-N 3.47Å
203V65.7Low68.5Low31 Ų3155.9 Ų55.919%0.18830%0.301CS..Hα-helixtrans-86.7-47.5-177.5178.40000111L86 F90 F188 T199 Y200L86-V203 HydrophobicContact CD2-CG2 3.73Å; F90-V203 HydrophobicContact CD2-CG2 4.47Å; F90-V203 HydrophobicContact CE2-CG2 4.04Å; F188-V203 HydrophobicContact CE1-CB 4.49Å; F188-V203 HydrophobicContact CE1-CG2 3.82Å; T199-V203 PolarHBondContact O-N 2.91Å; Y200-V203 PolarHBondContact O-N 2.91Å
204D62.1Low68.3Low65 Ų6553.8 Ų53.835%0.34829%0.29SS..  trans-138.286.5178-68-48.3000110.8K78 Y200 F206 D207 I210K78-D204 IonicContact NZ-OD2 3Å; K78-D204 PolarHBondContact NZ-OD2 3.34Å; Y200-D204 PolarHBondContact O-N 3.12Å; D204-F206 PolarHBondContact O-N 2.61Å; D204-D207 HydrophobicContact CB-CB 4.07Å; D204-I210 HydrophobicContact CB-CD1 4.02Å; D204-I210 VanDerWaalsContact O-CD1 3.28Å; D204-I210 WeakPolarHBondContact O-CD1 3.35Å
205P58.9Low67.8Low61 Ų6153 Ų5340%0.39628%0.28SS..THydrogen-bonded Turntrans-66.5-18.8-176.522.2-31.2000114.8S201S201-P205 WeakPolarHBondContact O-CA 3.1Å; S201-P205 WeakPolarHBondContact O-CB 3.09Å
206F55Low67Low132 Ų13251.5 Ų51.558%0.57929%0.285SS*.THydrogen-bonded Turntrans-114.69.6-174-61.2-71.8000114.5N21 D204 V208N21-F206 VanDerWaalsContact OD1-CD1 3.29Å; N21-F206 WeakPolarHBondContact OD1-CD1 3.45Å; N21-F206 WeakPolarHBondContact OD1-CE1 3.44Å; D204-F206 PolarHBondContact O-N 2.61Å; F206-V208 PolarHBondContact O-N 3.08Å
207D64Low66.4Low56 Ų5652 Ų5230%0.29929%0.288SS..  trans-72.3120.3176.9-161.9-16.1000109.9K78 D204 L209 I210 L211K78-D207 WeakPolarHBondContact CE-OD2 3.27Å; K78-D207 IonicContact NZ-OD2 2.61Å; K78-D207 PolarHBondContact NZ-OD2 3.12Å; D204-D207 HydrophobicContact CB-CB 4.07Å; D207-L209 PolarHBondContact O-N 3Å; D207-L209 PolarHBondContact OD1-N 3.48Å; D207-I210 HydrophobicContact CB-CD1 4.13Å; D207-I210 HydrophobicContact CB-CG1 4.43Å; D207-I210 PolarHBondContact O-N 3.46Å; D207-L211 PolarHBondContact O-N 2.91Å; D207-L211 VanDerWaalsContact O-N 3.16Å
208V61.7Low66Low100 Ų10052.5 Ų52.561%0.60629%0.292SS*.Hα-helixtrans-52.2-30.5177.8179.80000110.7F206 L211 C212F206-V208 PolarHBondContact O-N 3.08Å; V208-L211 PolarHBondContact O-N 3.38Å; V208-C212 WeakPolarHBondContact O-CB 3.45Å; V208-C212 PolarHBondContact O-N 3.25Å; V208-C212 PolarHBondContact O-SG 3.13Å
209L65.8Low65.6Low39 Ų3951.9 Ų51.920%0.20429%0.292CS..Hα-helixtrans-64.3-42.4175.9-170.867.4000112.9F70 A74 Y77 K78 D207 C212 V213F70-L209 HydrophobicContact CZ-CD1 4.13Å; A74-L209 HydrophobicContact CB-CD1 3.82Å; A74-L209 HydrophobicContact CB-CD2 4.07Å; A74-L209 HydrophobicContact CB-CG 3.94Å; Y77-L209 HydrophobicContact CD1-CD2 4.1Å; K78-L209 HydrophobicContact CD-CD2 4.48Å; K78-L209 HydrophobicContact CG-CD2 3.92Å; D207-L209 PolarHBondContact O-N 3Å; D207-L209 PolarHBondContact OD1-N 3.48Å; L209-C212 PolarHBondContact O-N 2.7Å; L209-V213 WeakPolarHBondContact O-CB 3.42Å; L209-V213 VanDerWaalsContact O-CG2 3.29Å; L209-V213 WeakPolarHBondContact O-CG2 3.13Å; L209-V213 PolarHBondContact O-N 3.48Å
210I67.7Low65.3Low10 Ų1055 Ų555%0.05131%0.309CS..Hα-helixtrans-71.1-37.5178.8-68.9163.9000110.1Y200 D204 D207 V213 R214Y200-I210 HydrophobicContact CD1-CD1 4.07Å; Y200-I210 HydrophobicContact CD1-CG1 4.36Å; Y200-I210 HydrophobicContact CG-CD1 4.38Å; Y200-I210 HydrophobicContact CG-CG1 4.49Å; D204-I210 HydrophobicContact CB-CD1 4.02Å; D204-I210 VanDerWaalsContact O-CD1 3.28Å; D204-I210 WeakPolarHBondContact O-CD1 3.35Å; D207-I210 HydrophobicContact CB-CD1 4.13Å; D207-I210 HydrophobicContact CB-CG1 4.43Å; D207-I210 PolarHBondContact O-N 3.46Å; I210-V213 PolarHBondContact O-N 3.49Å; I210-R214 WeakPolarHBondContact O-CB 3.01Å; I210-R214 WeakPolarHBondContact O-CG 3.49Å; I210-R214 PolarHBondContact O-N 3.08Å
211L66.8Low64.9Low40 Ų4057.8 Ų57.821%0.20933%0.326CS..Hα-helixtrans-62.6-48.2173.4-175.870.1000111.3T18 F19 D207 V208 V213 R214 V215T18-L211 VanDerWaalsContact OG1-CD1 3.24Å; T18-L211 WeakPolarHBondContact OG1-CD1 3.41Å; F19-L211 HydrophobicContact CB-CD1 4.38Å; F19-L211 HydrophobicContact CD2-CD1 4.42Å; F19-L211 HydrophobicContact CD2-CD2 4.15Å; D207-L211 PolarHBondContact O-N 2.91Å; D207-L211 VanDerWaalsContact O-N 3.16Å; V208-L211 PolarHBondContact O-N 3.38Å; L211-V213 VanDerWaalsContact C-N 3.32Å; L211-V213 PolarHBondContact O-N 2.88Å; L211-R214 PolarHBondContact O-N 3.26Å; L211-V215 VanDerWaalsContact O-CG2 3.31Å; L211-V215 WeakPolarHBondContact O-CG2 3.49Å; L211-V215 PolarHBondContact O-N 3.41Å
212C64.8Low64.7Low56 Ų5660.2 Ų60.238%0.37834%0.338SS..Hα-helixtrans-60.3-41.6176.9-74.30000111.9F70 V208 L209 V215 A216F70-C212 HydrophobicContact CE1-CB 3.94Å; F70-C212 HydrophobicContact CZ-CB 4Å; V208-C212 WeakPolarHBondContact O-CB 3.45Å; V208-C212 PolarHBondContact O-N 3.25Å; V208-C212 PolarHBondContact O-SG 3.13Å; L209-C212 PolarHBondContact O-N 2.7Å; C212-V215 PolarHBondContact O-N 3.48Å; C212-A216 VanDerWaalsContact O-CB 3.22Å; C212-A216 WeakPolarHBondContact O-CB 2.99Å; C212-A216 PolarHBondContact O-N 3.12Å
213V72.1Confident64.5Low14 Ų1456.6 Ų56.69%0.08533%0.328CS..Hα-helixtrans-65.1-38.2176.1159.20000112.4F70 F71 A74 L197 L209 I210 L211 V215F70-V213 HydrophobicContact CD1-CG2 4.33Å; F70-V213 HydrophobicContact CE1-CG2 3.89Å; F71-V213 HydrophobicContact CD2-CB 4.29Å; F71-V213 HydrophobicContact CD2-CG1 3.25Å; F71-V213 HydrophobicContact CD2-CG2 4.06Å; F71-V213 HydrophobicContact CE2-CG1 3.62Å; F71-V213 HydrophobicContact CG-CG1 4.35Å; A74-V213 HydrophobicContact CB-CG2 3.63Å; L197-V213 HydrophobicContact CD2-CG1 3.6Å; L209-V213 WeakPolarHBondContact O-CB 3.42Å; L209-V213 VanDerWaalsContact O-CG2 3.29Å; L209-V213 WeakPolarHBondContact O-CG2 3.13Å; L209-V213 PolarHBondContact O-N 3.48Å; I210-V213 PolarHBondContact O-N 3.49Å; L211-V213 VanDerWaalsContact C-N 3.32Å; L211-V213 PolarHBondContact O-N 2.88Å; V213-V215 VanDerWaalsContact C-N 3.34Å
214R71.3Confident64.4Low24 Ų2458.6 Ų58.69%0.09134%0.338CS..Hα-helixtrans-71.3-29.5179.3-82.9-179.6160.2179.8-6.1113.5V15 L197 S201 I210 L211V15-R214 HydrophobicContact CG2-CB 3.86Å; L197-R214 HydrophobicContact CD2-CG 3.71Å; L197-R214 PolarHBondContact O-NH2 3.35Å; S201-R214 PolarHBondContact OG-NH1 2.88Å; S201-R214 PolarHBondContact OG-NH2 3.09Å; I210-R214 WeakPolarHBondContact O-CB 3.01Å; I210-R214 WeakPolarHBondContact O-CG 3.49Å; I210-R214 PolarHBondContact O-N 3.08Å; L211-R214 PolarHBondContact O-N 3.26Å
215V67.2Low64.6Low96 Ų9658.1 Ų58.158%0.58234%0.338SS*.Hα-helixtrans-83-33.1178.5172.30000111.7V15 L211 C212 V213V15-V215 HydrophobicContact CG1-CG2 3.62Å; L211-V215 VanDerWaalsContact O-CG2 3.31Å; L211-V215 WeakPolarHBondContact O-CG2 3.49Å; L211-V215 PolarHBondContact O-N 3.41Å; C212-V215 PolarHBondContact O-N 3.48Å; V213-V215 VanDerWaalsContact C-N 3.34Å
216A60Low65.1Low69 Ų6957.8 Ų57.857%0.5733%0.332SS*.  trans-69.50-17900000111.4C67 C212C67-A216 HydrophobicContact CB-CB 4.06Å; C67-A216 WeakPolarHBondContact SG-CB 3.36Å; C67-A216 PolarHBondContact SG-O 3.37Å; C67-A216 PolarHBondContact SG-OXT 3.47Å; C67-A216 VanDerWaalsContact SG-OXT 3.34Å; C212-A216 VanDerWaalsContact O-CB 3.22Å; C212-A216 WeakPolarHBondContact O-CB 2.99Å; C212-A216 PolarHBondContact O-N 3.12Å

Retrieved 216 of 216 residues in 247.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).