A0A060WVE8_ONCMY Loading...

CKLF-like MARVEL transmembrane domain containing 3

AlphaFold DB , UniProt , Accession A0A060WVE8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110526282, Length 173 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45.4Very low53.7Low227 Ų227134.2 Ų134.2100%1.11880%0.799SS**  0100.90-108.860-177.100106.7
2G49.5Very low53.6Low72 Ų72132.2 Ų132.274%0.74279%0.792SS**  trans-101.5112.1173.900000107.1
3D54.3Low53.5Low155 Ų155129.1 Ų129.183%0.82978%0.78SS**  trans-91108.9175-66.1-37.7000107.9E5D3-E5 PolarHBondContact O-N 3.45Å
4I60.2Low53.4Low160 Ų160130 Ų13082%0.82177%0.772SS**  trans-74106.4170.5-83.6157.1000106.9A6I4-A6 PolarHBondContact O-N 3.42Å
5E57.5Low53.5Low197 Ų197125.8 Ų125.892%0.92175%0.752SS**  trans-83.1105162.1-114.4173.3113.700107.8D3D3-E5 PolarHBondContact O-N 3.45Å
6A61.6Low53.7Low79 Ų79122.8 Ų122.865%0.65373%0.734SS**PPolyproline II helixtrans-86.9131167.700000108.6I4I4-A6 PolarHBondContact O-N 3.42Å
7P55.3Low53.7Low121 Ų121122.4 Ų122.479%0.78673%0.727SS**PPolyproline II helixtrans-77.2133.2178.830.2-31.3000110.5T9P7-T9 PolarHBondContact O-N 3.13Å
8D51.5Low54Low156 Ų156123.4 Ų123.483%0.83472%0.723SS**PPolyproline II helixtrans-52.9121.8175.2-83.1-42.6000111.9T10D8-T10 VanDerWaalsContact C-N 3.29Å; D8-T10 PolarHBondContact O-N 3.25Å
9T53Low54.1Low142 Ų142121.3 Ų121.387%0.87171%0.712SS**  trans-77.176.1169.835.70000110P7 G11P7-T9 PolarHBondContact O-N 3.13Å; T9-G11 PolarHBondContact O-N 2.92Å
10T51.8Low54.1Low122 Ų122119.9 Ų119.975%0.74870%0.7SS**  trans-68.2100.9163.240.50000109D8D8-T10 VanDerWaalsContact C-N 3.29Å; D8-T10 PolarHBondContact O-N 3.25Å
11G50.3Low54.3Low45 Ų45120.5 Ų120.546%0.46470%0.7SS.*  trans-62151.7-17700000113.7T9 S13T9-G11 PolarHBondContact O-N 2.92Å; G11-S13 PolarHBondContact O-N 3Å
12P52.9Low54.9Low110 Ų110113 Ų11371%0.71467%0.668SS**THydrogen-bonded Turntrans-65.65.2-176.627.6-36000115.2S15 V16P12-S15 PolarHBondContact O-OG 3.36Å; P12-V16 WeakPolarHBondContact O-CG2 3.36Å
13S51.7Low55.2Low92 Ų92114.6 Ų114.664%0.64366%0.659SS**Hα-helixtrans-79.7-28.8-172.8-155.60000113G11G11-S13 PolarHBondContact O-N 3Å
14Q52.3Low55.3Low142 Ų142109.4 Ų109.466%0.66464%0.637SS**Hα-helixtrans-77-33.8-177.7-72.5-163.4-43.700113.5Q18Q14-Q18 WeakPolarHBondContact O-CG 3.45Å; Q14-Q18 PolarHBondContact O-N 2.94Å
15S55.8Low55.2Low67 Ų67109.7 Ų109.747%0.46963%0.632SS.*Hα-helixtrans-70.8-34.9179.747.40000112.4P12 T19P12-S15 PolarHBondContact O-OG 3.36Å; S15-T19 WeakPolarHBondContact O-CB 3.38Å; S15-T19 PolarHBondContact O-N 3.04Å; S15-T19 PolarHBondContact O-OG1 3.42Å
16V56.3Low55.4Low78 Ų78107.9 Ų107.947%0.47362%0.624SS.*Hα-helixtrans-66.8-45.8178.7178.40000111P12 Q18 T19 I20P12-V16 WeakPolarHBondContact O-CG2 3.36Å; V16-Q18 PolarHBondContact O-N 3.24Å; V16-T19 PolarHBondContact O-N 3.34Å; V16-I20 HydrophobicContact CG1-CD1 3.6Å; V16-I20 HydrophobicContact CG1-CG1 4.32Å; V16-I20 WeakPolarHBondContact O-CB 3.49Å; V16-I20 WeakPolarHBondContact O-CG1 3.49Å; V16-I20 PolarHBondContact O-N 2.87Å
17L54.1Low55.2Low115 Ų115106.2 Ų106.260%0.60260%0.602SS**Hα-helixtrans-67.8-36178.6-63.6-164.3000112.8T19 L21L17-T19 VanDerWaalsContact C-N 3.31Å; L17-T19 PolarHBondContact O-N 2.99Å; L17-L21 WeakPolarHBondContact O-CB 3.36Å; L17-L21 PolarHBondContact O-N 3.03Å; L17-L21 VanDerWaalsContact O-N 3.12Å
18Q58.7Low55.4Low141 Ų141102.1 Ų102.166%0.65958%0.578SS**Hα-helixtrans-70.8-26.3176.5-72.4-179.6-3.200113.2Q14 V16 P22Q14-Q18 WeakPolarHBondContact O-CG 3.45Å; Q14-Q18 PolarHBondContact O-N 2.94Å; V16-Q18 PolarHBondContact O-N 3.24Å; Q18-P22 WeakPolarHBondContact O-CD 2.99Å
19T55.5Low55.8Low84 Ų8499.2 Ų99.252%0.51557%0.57SS.*Hα-helixtrans-84.9-33.5176.8-49.20000111.8S15 V16 L17 P22 I23S15-T19 WeakPolarHBondContact O-CB 3.38Å; S15-T19 PolarHBondContact O-N 3.04Å; S15-T19 PolarHBondContact O-OG1 3.42Å; V16-T19 PolarHBondContact O-N 3.34Å; L17-T19 VanDerWaalsContact C-N 3.31Å; L17-T19 PolarHBondContact O-N 2.99Å; T19-P22 WeakPolarHBondContact O-CD 3.33Å; T19-P22 WeakPolarHBondContact O-CG 3.47Å; T19-I23 HydrophobicContact CG2-CD1 4.28Å; T19-I23 WeakPolarHBondContact O-CD1 3.27Å
20I55.2Low56.8Low92 Ų9294.4 Ų94.447%0.47254%0.542SS..Hα-helixtrans-73.1-33177.3-67.7176.3000111.6V16 I23 A24V16-I20 HydrophobicContact CG1-CD1 3.6Å; V16-I20 HydrophobicContact CG1-CG1 4.32Å; V16-I20 WeakPolarHBondContact O-CB 3.49Å; V16-I20 WeakPolarHBondContact O-CG1 3.49Å; V16-I20 PolarHBondContact O-N 2.87Å; I20-I23 PolarHBondContact O-N 3.4Å; I20-A24 HydrophobicContact CG2-CB 4.46Å; I20-A24 WeakPolarHBondContact O-CB 3.24Å; I20-A24 PolarHBondContact O-N 3.18Å
21L57.9Low57.9Low134 Ų13497 Ų9770%0.70254%0.538SS*.Hα-helixtrans-57.5-49.1-178.7-149.197.7000114.6L17 K25L17-L21 WeakPolarHBondContact O-CB 3.36Å; L17-L21 PolarHBondContact O-N 3.03Å; L17-L21 VanDerWaalsContact O-N 3.12Å; L21-K25 VanDerWaalsContact O-CB 3.29Å; L21-K25 WeakPolarHBondContact O-CB 3.2Å; L21-K25 PolarHBondContact O-N 3.25Å
22P57.3Low59.2Low70 Ų7099.3 Ų99.346%0.45554%0.536SS..Hα-helixtrans-72.4-34.9177.827.1-34.4000112.7Q18 T19 K25 E26Q18-P22 WeakPolarHBondContact O-CD 2.99Å; T19-P22 WeakPolarHBondContact O-CD 3.33Å; T19-P22 WeakPolarHBondContact O-CG 3.47Å; P22-K25 PolarHBondContact O-N 2.87Å; P22-E26 PolarHBondContact O-N 3.34Å
23I56.4Low60.5Low105 Ų10594 Ų9454%0.53850%0.502SS..Hα-helixtrans-66.2-46.4175.6-76.3163.4000110.2T19 I20 K25 E26 F27T19-I23 HydrophobicContact CG2-CD1 4.28Å; T19-I23 WeakPolarHBondContact O-CD1 3.27Å; I20-I23 PolarHBondContact O-N 3.4Å; I23-K25 PolarHBondContact O-N 3.16Å; I23-E26 PolarHBondContact O-N 2.96Å; I23-F27 WeakPolarHBondContact O-CB 3.39Å; I23-F27 PolarHBondContact O-N 2.79Å
24A56.9Low61.9Low45 Ų4594.6 Ų94.637%0.37249%0.494SS..Hα-helixtrans-62.3-32.4173.700000111.8I20 A28I20-A24 HydrophobicContact CG2-CB 4.46Å; I20-A24 WeakPolarHBondContact O-CB 3.24Å; I20-A24 PolarHBondContact O-N 3.18Å; A24-A28 WeakPolarHBondContact O-CA 3.39Å; A24-A28 WeakPolarHBondContact O-CB 3.21Å; A24-A28 PolarHBondContact O-N 3.33Å
25K56.8Low63.5Low166 Ų16688.9 Ų88.972%0.72247%0.468SS*.Hα-helixtrans-72-41.5175.8-173.3-178.2173.9-174.20112.8L21 P22 I23 S29L21-K25 VanDerWaalsContact O-CB 3.29Å; L21-K25 WeakPolarHBondContact O-CB 3.2Å; L21-K25 PolarHBondContact O-N 3.25Å; P22-K25 PolarHBondContact O-N 2.87Å; I23-K25 PolarHBondContact O-N 3.16Å; K25-S29 PolarHBondContact O-N 3.48Å
26E62.1Low65Low160 Ų16086.3 Ų86.375%0.74845%0.449SS*.Hα-helixtrans-66.3-42172.1-82.1-110.8133.800111.4P22 I23 S29 S30P22-E26 PolarHBondContact O-N 3.34Å; I23-E26 PolarHBondContact O-N 2.96Å; E26-S29 WeakPolarHBondContact O-CA 3.24Å; E26-S29 WeakPolarHBondContact O-CB 3.49Å; E26-S29 PolarHBondContact O-N 3.46Å; E26-S30 PolarHBondContact O-N 3.46Å
27F58.1Low66.5Low44 Ų4485.9 Ų85.919%0.19344%0.443CS..Hα-helixtrans-69.7-37.9178.6-148.4-99.7000112.2I23 S29 S30 L73 Y76 S77I23-F27 WeakPolarHBondContact O-CB 3.39Å; I23-F27 PolarHBondContact O-N 2.79Å; F27-S29 PolarHBondContact O-N 2.89Å; F27-S30 PolarHBondContact O-N 3Å; F27-L73 HydrophobicContact CE1-CD1 4.22Å; F27-Y76 HydrophobicContact CD1-CD1 4.38Å; F27-Y76 HydrophobicContact CD1-CE1 4.31Å; F27-Y76 HydrophobicContact CD2-CE1 4.46Å; F27-Y76 AromaticContact CE1-CD1 3.3Å; F27-Y76 HydrophobicContact CE1-CD1 3.3Å; F27-Y76 AromaticContact CE1-CE1 3.6Å; F27-Y76 HydrophobicContact CE1-CE1 3.6Å; F27-Y76 HydrophobicContact CE1-CG 4.44Å; F27-Y76 AromaticContact CE2-CD1 3.83Å; F27-Y76 HydrophobicContact CE2-CD1 3.83Å; F27-Y76 AromaticContact CE2-CE1 3.76Å; F27-Y76 HydrophobicContact CE2-CE1 3.76Å; F27-Y76 AromaticContact CZ-CD1 2.96Å; F27-Y76 HydrophobicContact CZ-CD1 2.96Å; F27-Y76 AromaticContact CZ-CE1 3.3Å; F27-Y76 HydrophobicContact CZ-CE1 3.3Å; F27-Y76 AromaticContact CZ-CG 3.84Å; F27-Y76 HydrophobicContact CZ-CG 3.84Å; F27-S77 VanDerWaalsContact CZ-OG 3.24Å; F27-S77 WeakPolarHBondContact CZ-OG 3.45Å
28A58.7Low68.1Low35 Ų3582 Ų8229%0.28943%0.428SS..THydrogen-bonded Turntrans-73.9-4.5168.900000112.9A24 Q34 I37A24-A28 WeakPolarHBondContact O-CA 3.39Å; A24-A28 WeakPolarHBondContact O-CB 3.21Å; A24-A28 PolarHBondContact O-N 3.33Å; A28-Q34 VanDerWaalsContact O-CD 3.26Å; A28-Q34 WeakPolarHBondContact O-CG 3.41Å; A28-Q34 PolarHBondContact O-NE2 3.35Å; A28-I37 HydrophobicContact CB-CD1 4.09Å
29S59.1Low69.6Low94 Ų9475.3 Ų75.366%0.65740%0.397SS*.THydrogen-bonded Turntrans-86.1-27.7169.5-164.10000111.2K25 E26 F27 R31K25-S29 PolarHBondContact O-N 3.48Å; E26-S29 WeakPolarHBondContact O-CA 3.24Å; E26-S29 WeakPolarHBondContact O-CB 3.49Å; E26-S29 PolarHBondContact O-N 3.46Å; F27-S29 PolarHBondContact O-N 2.89Å; S29-R31 PolarHBondContact O-N 3.35Å
30S74Confident71.3Confident42 Ų4272.2 Ų72.229%0.29438%0.378SS..SBendtrans-69.6128.3174.1-178.80000110.9E26 F27 K32 G33 Q34 Y76E26-S30 PolarHBondContact O-N 3.46Å; F27-S30 PolarHBondContact O-N 3Å; S30-K32 VanDerWaalsContact C-N 3.25Å; S30-K32 PolarHBondContact O-N 3.2Å; S30-G33 WeakPolarHBondContact O-CA 3.38Å; S30-G33 PolarHBondContact O-N 3.46Å; S30-Q34 PolarHBondContact O-N 3.39Å; S30-Y76 PolarHBondContact OG-OH 3.45Å
31R75Confident72.9Confident176 Ų17670 Ų7066%0.66437%0.372SS*.Hα-helixtrans-57.7-35.8-177-147.6176.5-169.5-179.71.6112.9S29 L35S29-R31 PolarHBondContact O-N 3.35Å; R31-L35 PolarHBondContact O-N 2.96Å
32K78.1Confident74.4Confident93 Ų9364.6 Ų64.640%0.40434%0.344SS..Hα-helixtrans-72.5-38.5174.8-69.3-170.4175.3-175.60112.2S30 L35 L36 D144S30-K32 VanDerWaalsContact C-N 3.25Å; S30-K32 PolarHBondContact O-N 3.2Å; K32-L35 PolarHBondContact O-N 3.42Å; K32-L36 PolarHBondContact O-N 3.13Å; K32-L36 VanDerWaalsContact O-N 3.14Å; K32-D144 IonicContact NZ-OD2 2.67Å; K32-D144 PolarHBondContact NZ-OD2 3.06Å
33G80.1Confident76Confident0 Ų061.3 Ų61.30%032%0.323CS..Hα-helixtrans-65-38176.400000112.6S30 L36 I37S30-G33 WeakPolarHBondContact O-CA 3.38Å; S30-G33 PolarHBondContact O-N 3.46Å; G33-L36 PolarHBondContact O-N 2.96Å; G33-I37 WeakPolarHBondContact O-CB 3.06Å; G33-I37 WeakPolarHBondContact O-CD1 3.49Å; G33-I37 WeakPolarHBondContact O-CG1 3.36Å; G33-I37 PolarHBondContact O-N 3.29Å
34Q82.4Confident77.6Confident103 Ų10359.4 Ų59.448%0.48131%0.314SS..Hα-helixtrans-61.4-43.4174.6-71.1-177.8-7.500112.8A28 S30 I37 A38A28-Q34 VanDerWaalsContact O-CD 3.26Å; A28-Q34 WeakPolarHBondContact O-CG 3.41Å; A28-Q34 PolarHBondContact O-NE2 3.35Å; S30-Q34 PolarHBondContact O-N 3.39Å; Q34-I37 PolarHBondContact O-N 3.22Å; Q34-A38 VanDerWaalsContact O-CB 3.32Å; Q34-A38 WeakPolarHBondContact O-CB 3.47Å; Q34-A38 PolarHBondContact O-N 3.45Å
35L85.4Confident79.3Confident23 Ų2360.5 Ų60.512%0.1231%0.312CS..Hα-helixtrans-63.7-48.9177.9-77.9159.9000111R31 K32 I37 A38 E39 V133 L136 D137 F140R31-L35 PolarHBondContact O-N 2.96Å; K32-L35 PolarHBondContact O-N 3.42Å; L35-I37 VanDerWaalsContact C-N 3.34Å; L35-I37 PolarHBondContact O-N 2.92Å; L35-A38 WeakPolarHBondContact O-CB 2.95Å; L35-A38 PolarHBondContact O-N 3.18Å; L35-A38 VanDerWaalsContact O-N 3.1Å; L35-E39 WeakPolarHBondContact O-CG 2.95Å; L35-E39 PolarHBondContact O-N 3.02Å; L35-V133 HydrophobicContact CD2-CG1 4.28Å; L35-L136 HydrophobicContact CD2-CB 4.36Å; L35-D137 WeakPolarHBondContact CB-OD1 3.32Å; L35-D137 HydrophobicContact CD2-CB 4.41Å; L35-F140 HydrophobicContact CD1-CD2 3.69Å; L35-F140 HydrophobicContact CD1-CE2 4.17Å; L35-F140 HydrophobicContact CD1-CG 4.35Å
36L86.4Confident80.9Confident12 Ų1252.6 Ų52.66%0.06328%0.278CS..Hα-helixtrans-57.3-44.3175.4-87.9163.9000112.8K32 G33 A38 E39 V40 L72 L73 Y76K32-L36 PolarHBondContact O-N 3.13Å; K32-L36 VanDerWaalsContact O-N 3.14Å; G33-L36 PolarHBondContact O-N 2.96Å; L36-A38 VanDerWaalsContact C-N 3.34Å; L36-E39 PolarHBondContact O-N 2.96Å; L36-V40 VanDerWaalsContact O-CG2 3.29Å; L36-V40 WeakPolarHBondContact O-CG2 3.43Å; L36-V40 PolarHBondContact O-N 3.06Å; L36-L72 HydrophobicContact CD2-CB 3.81Å; L36-L73 HydrophobicContact CB-CD1 4.14Å; L36-Y76 HydrophobicContact CD1-CD1 4.16Å; L36-Y76 HydrophobicContact CD1-CG 4.37Å
37I87.5Confident82.2Confident69 Ų6947.1 Ų47.135%0.35425%0.252SS..Hα-helixtrans-64.1-41.7177.1-69.2165.4000110.7A28 G33 Q34 L35 V40 A41 L73A28-I37 HydrophobicContact CB-CD1 4.09Å; G33-I37 WeakPolarHBondContact O-CB 3.06Å; G33-I37 WeakPolarHBondContact O-CD1 3.49Å; G33-I37 WeakPolarHBondContact O-CG1 3.36Å; G33-I37 PolarHBondContact O-N 3.29Å; Q34-I37 PolarHBondContact O-N 3.22Å; L35-I37 VanDerWaalsContact C-N 3.34Å; L35-I37 PolarHBondContact O-N 2.92Å; I37-V40 PolarHBondContact O-N 2.72Å; I37-A41 WeakPolarHBondContact O-CB 3.21Å; I37-A41 PolarHBondContact O-N 3.17Å; I37-L73 HydrophobicContact CG1-CD1 4.02Å
38A89.1Confident83.8Confident34 Ų3449.6 Ų49.628%0.28127%0.266SS..Hα-helixtrans-63.5-41.3177.300000111.7Q34 L35 L36 A41 L42 V133Q34-A38 VanDerWaalsContact O-CB 3.32Å; Q34-A38 WeakPolarHBondContact O-CB 3.47Å; Q34-A38 PolarHBondContact O-N 3.45Å; L35-A38 WeakPolarHBondContact O-CB 2.95Å; L35-A38 PolarHBondContact O-N 3.18Å; L35-A38 VanDerWaalsContact O-N 3.1Å; L36-A38 VanDerWaalsContact C-N 3.34Å; A38-A41 PolarHBondContact O-N 3.2Å; A38-L42 VanDerWaalsContact O-CB 3.29Å; A38-L42 WeakPolarHBondContact O-CB 3.45Å; A38-L42 VanDerWaalsContact O-CG 3.3Å; A38-L42 WeakPolarHBondContact O-CG 3.49Å; A38-L42 PolarHBondContact O-N 3.43Å; A38-V133 HydrophobicContact CB-CG1 4.02Å
39E89.6Confident85.2Confident1 Ų149 Ų491%0.00526%0.26CS..Hα-helixtrans-63.3-46.1175.3-72.3-177.5175.700112.4L35 L36 A41 L42 S43 R96 V133 F134 D137L35-E39 WeakPolarHBondContact O-CG 2.95Å; L35-E39 PolarHBondContact O-N 3.02Å; L36-E39 PolarHBondContact O-N 2.96Å; E39-A41 VanDerWaalsContact C-N 3.33Å; E39-A41 PolarHBondContact O-N 3.32Å; E39-L42 PolarHBondContact O-N 2.67Å; E39-S43 VanDerWaalsContact O-CB 3.26Å; E39-S43 WeakPolarHBondContact O-CB 3.36Å; E39-S43 PolarHBondContact O-N 2.79Å; E39-S43 PolarHBondContact O-OG 3.29Å; E39-R96 IonicContact OE2-CZ 3.55Å; E39-R96 IonicContact OE2-NH1 3.5Å; E39-R96 PolarHBondContact OE2-NH1 3.32Å; E39-R96 IonicContact OE2-NH2 2.71Å; E39-R96 PolarHBondContact OE2-NH2 2.88Å; E39-V133 HydrophobicContact CG-CG1 3.98Å; E39-F134 HydrophobicContact CB-CE1 3.96Å; E39-F134 HydrophobicContact CB-CZ 3.94Å; E39-F134 HydrophobicContact CG-CD1 3.86Å; E39-F134 HydrophobicContact CG-CE1 3.58Å; E39-F134 HydrophobicContact CG-CE2 4.5Å; E39-F134 HydrophobicContact CG-CG 4.43Å; E39-F134 HydrophobicContact CG-CZ 3.91Å; E39-F134 WeakPolarHBondContact OE1-CD1 3.45Å; E39-F134 WeakPolarHBondContact OE1-CE1 3.39Å; E39-F134 VanDerWaalsContact OE2-CE1 3.27Å; E39-F134 WeakPolarHBondContact OE2-CE1 3.24Å; E39-D137 WeakPolarHBondContact OE1-CB 3.48Å; E39-D137 VanDerWaalsContact OE1-CG 3.26Å
40V91.1Very high86.5Confident19 Ų1944.5 Ų44.512%0.11523%0.228CC..Hα-helixtrans-60.3-44.9175.81720000110.4L36 I37 S43 L44 F66 A69 L70L36-V40 VanDerWaalsContact O-CG2 3.29Å; L36-V40 WeakPolarHBondContact O-CG2 3.43Å; L36-V40 PolarHBondContact O-N 3.06Å; I37-V40 PolarHBondContact O-N 2.72Å; V40-S43 WeakPolarHBondContact CA-OG 3.43Å; V40-S43 PolarHBondContact O-OG 3.37Å; V40-L44 VanDerWaalsContact O-CB 3.24Å; V40-L44 WeakPolarHBondContact O-CB 3.32Å; V40-L44 PolarHBondContact O-N 2.76Å; V40-F66 HydrophobicContact CG1-CD2 4.14Å; V40-F66 HydrophobicContact CG1-CE2 3.72Å; V40-A69 HydrophobicContact CG2-CB 3.58Å; V40-L70 HydrophobicContact CG1-CD2 3.72Å; V40-L70 HydrophobicContact CG1-CG 4.33Å; V40-L70 HydrophobicContact CG2-CD2 4.27Å
41A89.9Confident87.2Confident44 Ų4446.5 Ų46.536%0.36424%0.239SC..Hα-helixtrans-65.5-46.2179.500000112.1I37 A38 E39 L44 I45I37-A41 WeakPolarHBondContact O-CB 3.21Å; I37-A41 PolarHBondContact O-N 3.17Å; A38-A41 PolarHBondContact O-N 3.2Å; E39-A41 VanDerWaalsContact C-N 3.33Å; E39-A41 PolarHBondContact O-N 3.32Å; A41-L44 PolarHBondContact O-N 2.8Å; A41-I45 VanDerWaalsContact O-CG1 3.25Å; A41-I45 WeakPolarHBondContact O-CG1 3.06Å; A41-I45 PolarHBondContact O-N 3.02Å
42L89.3Confident87.8Confident22 Ų2241.9 Ų41.912%0.11524%0.238CC..Hα-helixtrans-69.4-39.7-178.3-75.7165.8000112.5A38 E39 T46 F126 I129 A130 V133A38-L42 VanDerWaalsContact O-CB 3.29Å; A38-L42 WeakPolarHBondContact O-CB 3.45Å; A38-L42 VanDerWaalsContact O-CG 3.3Å; A38-L42 WeakPolarHBondContact O-CG 3.49Å; A38-L42 PolarHBondContact O-N 3.43Å; E39-L42 PolarHBondContact O-N 2.67Å; L42-T46 VanDerWaalsContact O-CB 3.32Å; L42-T46 WeakPolarHBondContact O-CB 3.48Å; L42-T46 PolarHBondContact O-N 3.49Å; L42-T46 PolarHBondContact O-OG1 3.06Å; L42-F126 HydrophobicContact CD2-CD1 4.49Å; L42-I129 HydrophobicContact CD1-CG2 4.09Å; L42-I129 HydrophobicContact CD2-CB 4.38Å; L42-I129 HydrophobicContact CD2-CG2 3.92Å; L42-A130 HydrophobicContact CB-CB 4Å; L42-V133 HydrophobicContact CD1-CB 3.94Å; L42-V133 HydrophobicContact CD1-CG1 4.31Å; L42-V133 HydrophobicContact CD1-CG2 3.54Å
43S89.6Confident88.1Confident0 Ų038 Ų380%022%0.222CC..Hα-helixtrans-64.4-41.1174560000111.4E39 V40 T46 F47E39-S43 VanDerWaalsContact O-CB 3.26Å; E39-S43 WeakPolarHBondContact O-CB 3.36Å; E39-S43 PolarHBondContact O-N 2.79Å; E39-S43 PolarHBondContact O-OG 3.29Å; V40-S43 WeakPolarHBondContact CA-OG 3.43Å; V40-S43 PolarHBondContact O-OG 3.37Å; S43-T46 PolarHBondContact O-N 3.26Å; S43-F47 VanDerWaalsContact O-CB 3.22Å; S43-F47 WeakPolarHBondContact O-CB 3.47Å; S43-F47 PolarHBondContact O-N 3.1Å
44L91.4Very high87.9Confident66 Ų6643.3 Ų43.335%0.34626%0.255SS..Hα-helixtrans-63.3-48175.4-177.562.7000112.6V40 A41 T46 F47 I48 F66V40-L44 VanDerWaalsContact O-CB 3.24Å; V40-L44 WeakPolarHBondContact O-CB 3.32Å; V40-L44 PolarHBondContact O-N 2.76Å; A41-L44 PolarHBondContact O-N 2.8Å; L44-T46 VanDerWaalsContact C-N 3.33Å; L44-T46 PolarHBondContact O-N 3.26Å; L44-F47 WeakPolarHBondContact O-CB 3.18Å; L44-F47 PolarHBondContact O-N 3.43Å; L44-I48 HydrophobicContact CD1-CD1 4.1Å; L44-I48 HydrophobicContact CD1-CG1 4.4Å; L44-I48 HydrophobicContact CG-CD1 4.01Å; L44-I48 WeakPolarHBondContact O-CG1 3.37Å; L44-I48 PolarHBondContact O-N 3.14Å; L44-F66 HydrophobicContact CB-CD2 3.86Å; L44-F66 HydrophobicContact CB-CE2 3.75Å; L44-F66 HydrophobicContact CD1-CD2 4.35Å; L44-F66 HydrophobicContact CD1-CE1 4.44Å; L44-F66 HydrophobicContact CD1-CE2 3.88Å; L44-F66 HydrophobicContact CD1-CZ 3.92Å; L44-F66 HydrophobicContact CD2-CE2 4.29Å; L44-F66 HydrophobicContact CG-CE2 4.18Å
45I91.9Very high87.6Confident67 Ų6738.4 Ų38.434%0.34423%0.232SC..Hα-helixtrans-60.1-47.9178.3-69.7164.7000109.7A41 F47 I48 C49 F126A41-I45 VanDerWaalsContact O-CG1 3.25Å; A41-I45 WeakPolarHBondContact O-CG1 3.06Å; A41-I45 PolarHBondContact O-N 3.02Å; I45-F47 VanDerWaalsContact C-N 3.33Å; I45-F47 PolarHBondContact O-N 3.14Å; I45-I48 PolarHBondContact O-N 2.86Å; I45-C49 PolarHBondContact O-N 3.36Å; I45-C49 PolarHBondContact O-SG 3.45Å; I45-F126 HydrophobicContact CG2-CB 4.24Å; I45-F126 HydrophobicContact CG2-CD1 4.02Å; I45-F126 HydrophobicContact CG2-CD2 3.66Å; I45-F126 HydrophobicContact CG2-CE1 4.29Å; I45-F126 HydrophobicContact CG2-CE2 3.96Å; I45-F126 HydrophobicContact CG2-CG 3.71Å; I45-F126 HydrophobicContact CG2-CZ 4.27Å
46T89.5Confident87.1Confident0 Ų039.9 Ų39.90%025%0.247CC..Hα-helixtrans-63.1-40.6-179.9-53.80000111.4L42 S43 L44 C49 F50 P62 F104L42-T46 VanDerWaalsContact O-CB 3.32Å; L42-T46 WeakPolarHBondContact O-CB 3.48Å; L42-T46 PolarHBondContact O-N 3.49Å; L42-T46 PolarHBondContact O-OG1 3.06Å; S43-T46 PolarHBondContact O-N 3.26Å; L44-T46 VanDerWaalsContact C-N 3.33Å; L44-T46 PolarHBondContact O-N 3.26Å; T46-C49 PolarHBondContact O-N 3.37Å; T46-F50 HydrophobicContact CG2-CD2 3.66Å; T46-F50 HydrophobicContact CG2-CE2 3.49Å; T46-F50 VanDerWaalsContact CG2-CE2 3.49Å; T46-F50 VanDerWaalsContact O-CD2 3.24Å; T46-F50 WeakPolarHBondContact O-CD2 3.15Å; T46-F50 PolarHBondContact O-N 2.96Å; T46-P62 HydrophobicContact CG2-CG 4.22Å; T46-F104 HydrophobicContact CG2-CD1 4.14Å; T46-F104 HydrophobicContact CG2-CE1 3.66Å
47F90.9Very high86.9Confident45 Ų4543.5 Ų43.520%0.19728%0.279CS..Hα-helixtrans-58.7-51.6173.6170.2-103.8000111.9S43 L44 I45 C49 F50 V51 V59 P62 L63S43-F47 VanDerWaalsContact O-CB 3.22Å; S43-F47 WeakPolarHBondContact O-CB 3.47Å; S43-F47 PolarHBondContact O-N 3.1Å; L44-F47 WeakPolarHBondContact O-CB 3.18Å; L44-F47 PolarHBondContact O-N 3.43Å; I45-F47 VanDerWaalsContact C-N 3.33Å; I45-F47 PolarHBondContact O-N 3.14Å; F47-C49 VanDerWaalsContact C-N 3.29Å; F47-C49 PolarHBondContact O-N 2.91Å; F47-F50 PolarHBondContact O-N 2.96Å; F47-F50 VanDerWaalsContact O-N 3.13Å; F47-V51 HydrophobicContact CD1-CG2 4.39Å; F47-V51 HydrophobicContact CD2-CG2 4.15Å; F47-V51 HydrophobicContact CE1-CG2 4.02Å; F47-V51 HydrophobicContact CE2-CG2 3.77Å; F47-V51 HydrophobicContact CG-CG2 4.45Å; F47-V51 HydrophobicContact CZ-CG2 3.68Å; F47-V51 WeakPolarHBondContact O-CG2 3.3Å; F47-V51 PolarHBondContact O-N 3.49Å; F47-V59 HydrophobicContact CD2-CG1 3.75Å; F47-V59 HydrophobicContact CE2-CG1 3.36Å; F47-V59 HydrophobicContact CZ-CG1 4.39Å; F47-P62 HydrophobicContact CB-CB 3.98Å; F47-L63 HydrophobicContact CD2-CB 3.8Å; F47-L63 HydrophobicContact CD2-CD1 4.27Å; F47-L63 HydrophobicContact CE2-CB 3.74Å; F47-L63 HydrophobicContact CE2-CD1 3.78Å; F47-L63 HydrophobicContact CE2-CD2 4.21Å; F47-L63 HydrophobicContact CE2-CG 4.11Å; F47-L63 HydrophobicContact CZ-CD1 4Å
48I91.1Very high86.8Confident96 Ų9642.9 Ų42.949%0.49227%0.274SS..Hα-helixtrans-60-42.2178.9-67167.6000110.6L44 I45 F50 V51 A52L44-I48 HydrophobicContact CD1-CD1 4.1Å; L44-I48 HydrophobicContact CD1-CG1 4.4Å; L44-I48 HydrophobicContact CG-CD1 4.01Å; L44-I48 WeakPolarHBondContact O-CG1 3.37Å; L44-I48 PolarHBondContact O-N 3.14Å; I45-I48 PolarHBondContact O-N 2.86Å; I48-F50 VanDerWaalsContact C-N 3.35Å; I48-F50 PolarHBondContact O-N 2.99Å; I48-V51 PolarHBondContact O-N 3.1Å; I48-A52 WeakPolarHBondContact O-CB 2.96Å; I48-A52 PolarHBondContact O-N 3.19Å
49C87.4Confident86.8Confident23 Ų2342.4 Ų42.416%0.15527%0.268CS..Hα-helixtrans-63-39.3176.7-66.90000112.2I45 T46 F47 S53 A123I45-C49 PolarHBondContact O-N 3.36Å; I45-C49 PolarHBondContact O-SG 3.45Å; T46-C49 PolarHBondContact O-N 3.37Å; F47-C49 VanDerWaalsContact C-N 3.29Å; F47-C49 PolarHBondContact O-N 2.91Å; C49-S53 WeakPolarHBondContact O-CB 3.43Å; C49-S53 PolarHBondContact O-N 3.28Å; C49-A123 HydrophobicContact CB-CB 3.52Å
50F86.8Confident86.8Confident0 Ų046.9 Ų46.90%030%0.295CS..Hα-helixtrans-71.5-33.5175.4-83.3-59000113.5T46 F47 I48 S53 A55 F58 V59 P62 I107 A123T46-F50 HydrophobicContact CG2-CD2 3.66Å; T46-F50 HydrophobicContact CG2-CE2 3.49Å; T46-F50 VanDerWaalsContact CG2-CE2 3.49Å; T46-F50 VanDerWaalsContact O-CD2 3.24Å; T46-F50 WeakPolarHBondContact O-CD2 3.15Å; T46-F50 PolarHBondContact O-N 2.96Å; F47-F50 PolarHBondContact O-N 2.96Å; F47-F50 VanDerWaalsContact O-N 3.13Å; I48-F50 VanDerWaalsContact C-N 3.35Å; I48-F50 PolarHBondContact O-N 2.99Å; F50-S53 PolarHBondContact O-N 3.11Å; F50-A55 HydrophobicContact CD1-CB 3.76Å; F50-A55 HydrophobicContact CE1-CB 3.81Å; F50-F58 HydrophobicContact CD1-CB 4.27Å; F50-F58 HydrophobicContact CE1-CB 4.2Å; F50-F58 HydrophobicContact CZ-CB 4.47Å; F50-V59 HydrophobicContact CB-CG2 3.57Å; F50-P62 HydrophobicContact CD2-CG 3.86Å; F50-P62 HydrophobicContact CE2-CG 4.28Å; F50-I107 HydrophobicContact CE1-CG2 4.11Å; F50-I107 HydrophobicContact CE2-CG2 3.4Å; F50-I107 VanDerWaalsContact CE2-CG2 3.4Å; F50-I107 HydrophobicContact CZ-CG2 3.15Å; F50-A123 HydrophobicContact CD1-CB 4.14Å; F50-A123 HydrophobicContact CD2-CB 3.96Å; F50-A123 HydrophobicContact CE1-CB 3.92Å; F50-A123 HydrophobicContact CE2-CB 3.75Å; F50-A123 HydrophobicContact CG-CB 4.13Å; F50-A123 HydrophobicContact CZ-CB 3.69Å
51V88.3Confident86.7Confident84 Ų8447.4 Ų47.451%0.50930%0.302SS..Hα-helixtrans-66.4-39.2174.5170.30000111.2F47 I48 S53 V59F47-V51 HydrophobicContact CD1-CG2 4.39Å; F47-V51 HydrophobicContact CD2-CG2 4.15Å; F47-V51 HydrophobicContact CE1-CG2 4.02Å; F47-V51 HydrophobicContact CE2-CG2 3.77Å; F47-V51 HydrophobicContact CG-CG2 4.45Å; F47-V51 HydrophobicContact CZ-CG2 3.68Å; F47-V51 WeakPolarHBondContact O-CG2 3.3Å; F47-V51 PolarHBondContact O-N 3.49Å; I48-V51 PolarHBondContact O-N 3.1Å; V51-S53 PolarHBondContact O-N 2.89Å; V51-V59 HydrophobicContact CG2-CG1 3.86Å; V51-V59 HydrophobicContact CG2-CG2 3.98Å
52A87.3Confident86.6Confident79 Ų7945.3 Ų45.365%0.65328%0.284SS*.THydrogen-bonded Turntrans-76.9-3.9176.800000113.6I48 A119I48-A52 WeakPolarHBondContact O-CB 2.96Å; I48-A52 PolarHBondContact O-N 3.19Å; A52-A119 HydrophobicContact CB-CB 4.41Å
53S85.7Confident86.6Confident10 Ų1047.1 Ų47.17%0.0729%0.294CS..SBendtrans-108.6157.4-171.7174.80000112.6C49 F50 V51 A55 A56 D117 S120C49-S53 WeakPolarHBondContact O-CB 3.43Å; C49-S53 PolarHBondContact O-N 3.28Å; F50-S53 PolarHBondContact O-N 3.11Å; V51-S53 PolarHBondContact O-N 2.89Å; S53-A55 PolarHBondContact O-N 3.33Å; S53-A55 WeakPolarHBondContact OG-CB 3.39Å; S53-A55 PolarHBondContact OG-N 3Å; S53-A56 PolarHBondContact O-N 3.33Å; S53-D117 VanDerWaalsContact CB-OD2 3.28Å; S53-D117 WeakPolarHBondContact CB-OD2 3.32Å; S53-D117 PolarHBondContact OG-OD2 3.48Å; S53-S120 PolarHBondContact OG-OG 2.84Å
54T74.8Confident86.7Confident113 Ų11352 Ų5269%0.69332%0.319SS*.THydrogen-bonded Turntrans-65.9-13165.745.40000113.7A56 D117T54-A56 PolarHBondContact O-N 2.85Å; T54-D117 PolarHBondContact OG1-OD1 3.31Å
55A76.8Confident86.6Confident0 Ų049.4 Ų49.40%031%0.305CS..THydrogen-bonded Turntrans-80.526.1173.700000113.7F50 S53 A57 F58 F115 S120F50-A55 HydrophobicContact CD1-CB 3.76Å; F50-A55 HydrophobicContact CE1-CB 3.81Å; S53-A55 PolarHBondContact O-N 3.33Å; S53-A55 WeakPolarHBondContact OG-CB 3.39Å; S53-A55 PolarHBondContact OG-N 3Å; A55-A57 PolarHBondContact O-N 3.11Å; A55-F58 HydrophobicContact CB-CD2 4.35Å; A55-F58 PolarHBondContact O-N 3.3Å; A55-F115 VanDerWaalsContact CA-CE1 3.48Å; A55-F115 HydrophobicContact CB-CD1 3.75Å; A55-F115 HydrophobicContact CB-CD2 3.88Å; A55-F115 HydrophobicContact CB-CE1 3.56Å; A55-F115 HydrophobicContact CB-CE2 3.65Å; A55-F115 HydrophobicContact CB-CG 3.9Å; A55-F115 HydrophobicContact CB-CZ 3.49Å; A55-F115 VanDerWaalsContact CB-CZ 3.49Å; A55-S120 WeakPolarHBondContact CB-OG 3.22Å
56A75.6Confident86.5Confident53 Ų5347.9 Ų47.944%0.43830%0.296SS..G310 helixtrans-55.3-21.6-176.600000114.3S53 T54 F58 V59S53-A56 PolarHBondContact O-N 3.33Å; T54-A56 PolarHBondContact O-N 2.85Å; A56-F58 PolarHBondContact O-N 3.16Å; A56-F58 VanDerWaalsContact O-N 3.12Å; A56-V59 HydrophobicContact CB-CG2 4.36Å; A56-V59 VanDerWaalsContact O-CB 3.27Å; A56-V59 WeakPolarHBondContact O-CB 3.32Å; A56-V59 VanDerWaalsContact O-CG2 3.29Å; A56-V59 WeakPolarHBondContact O-CG2 3.37Å; A56-V59 PolarHBondContact O-N 3.29Å; A56-V59 VanDerWaalsContact O-N 3.09Å
57A82.2Confident86.6Confident89 Ų8952.3 Ų52.374%0.73632%0.319SS*.G310 helixtrans-57.2-24.1174.600000113.7A55A55-A57 PolarHBondContact O-N 3.11Å
58F85.1Confident86.4Confident56 Ų5651.5 Ų51.525%0.24632%0.321CS..G310 helixtrans-95.3-3.2-179.9-61.8-69.4000113.9F50 A55 A56 T60 A61 P62 I107 I110 F115F50-F58 HydrophobicContact CD1-CB 4.27Å; F50-F58 HydrophobicContact CE1-CB 4.2Å; F50-F58 HydrophobicContact CZ-CB 4.47Å; A55-F58 HydrophobicContact CB-CD2 4.35Å; A55-F58 PolarHBondContact O-N 3.3Å; A56-F58 PolarHBondContact O-N 3.16Å; A56-F58 VanDerWaalsContact O-N 3.12Å; F58-T60 VanDerWaalsContact C-N 3.26Å; F58-T60 PolarHBondContact O-N 2.92Å; F58-A61 PolarHBondContact O-N 3.29Å; F58-P62 WeakPolarHBondContact O-CD 3.34Å; F58-I107 HydrophobicContact CB-CD1 4.32Å; F58-I107 HydrophobicContact CB-CG1 4.47Å; F58-I107 HydrophobicContact CB-CG2 4.07Å; F58-I107 HydrophobicContact CD1-CD1 4.28Å; F58-I107 HydrophobicContact CD1-CG1 3.93Å; F58-I107 HydrophobicContact CG-CG1 4.39Å; F58-I107 HydrophobicContact CG-CG2 4.32Å; F58-I110 HydrophobicContact CE1-CD1 4.34Å; F58-I110 HydrophobicContact CE2-CG2 3.82Å; F58-I110 HydrophobicContact CZ-CD1 4.23Å; F58-I110 HydrophobicContact CZ-CG2 3.75Å; F58-F115 HydrophobicContact CD2-CE2 4.28Å; F58-F115 HydrophobicContact CD2-CZ 4.4Å; F58-F115 AromaticContact CE2-CE2 3.79Å; F58-F115 HydrophobicContact CE2-CE2 3.79Å; F58-F115 AromaticContact CE2-CZ 3.93Å; F58-F115 HydrophobicContact CE2-CZ 3.93Å
59V88.4Confident86.2Confident24 Ų2447 Ų4715%0.14530%0.297CS..THydrogen-bonded Turntrans-57.4-35-176165.70000113.4F47 F50 V51 A56 A61 P62 L63F47-V59 HydrophobicContact CD2-CG1 3.75Å; F47-V59 HydrophobicContact CE2-CG1 3.36Å; F47-V59 HydrophobicContact CZ-CG1 4.39Å; F50-V59 HydrophobicContact CB-CG2 3.57Å; V51-V59 HydrophobicContact CG2-CG1 3.86Å; V51-V59 HydrophobicContact CG2-CG2 3.98Å; A56-V59 HydrophobicContact CB-CG2 4.36Å; A56-V59 VanDerWaalsContact O-CB 3.27Å; A56-V59 WeakPolarHBondContact O-CB 3.32Å; A56-V59 VanDerWaalsContact O-CG2 3.29Å; A56-V59 WeakPolarHBondContact O-CG2 3.37Å; A56-V59 PolarHBondContact O-N 3.29Å; A56-V59 VanDerWaalsContact O-N 3.09Å; V59-A61 VanDerWaalsContact C-N 3.29Å; V59-A61 PolarHBondContact O-N 2.87Å; V59-P62 WeakPolarHBondContact O-CD 3Å; V59-L63 WeakPolarHBondContact O-CB 3.34Å; V59-L63 PolarHBondContact O-N 2.97Å; V59-L63 VanDerWaalsContact O-N 3.12Å
60T89Confident86.2Confident94 Ų9448.9 Ų48.958%0.57731%0.306SS*.Hα-helixtrans-61.6-37.5-176.5-500000112.1F58 L63 I64F58-T60 VanDerWaalsContact C-N 3.26Å; F58-T60 PolarHBondContact O-N 2.92Å; T60-L63 PolarHBondContact O-N 3.18Å; T60-I64 HydrophobicContact CG2-CG1 4.29Å; T60-I64 VanDerWaalsContact O-CG1 3.29Å; T60-I64 WeakPolarHBondContact O-CG1 3.46Å; T60-I64 PolarHBondContact O-N 3.29Å
61A88.9Confident86.1Confident31 Ų3155 Ų5526%0.25633%0.332SS..Hα-helixtrans-65.9-54.2-177.900000112.5F58 V59 L63 I64 E65 I103 I107F58-A61 PolarHBondContact O-N 3.29Å; V59-A61 VanDerWaalsContact C-N 3.29Å; V59-A61 PolarHBondContact O-N 2.87Å; A61-L63 PolarHBondContact O-N 3.41Å; A61-I64 PolarHBondContact O-N 3.29Å; A61-E65 PolarHBondContact O-N 3.28Å; A61-E65 VanDerWaalsContact O-N 3.08Å; A61-I103 HydrophobicContact CB-CG2 3.68Å; A61-I107 HydrophobicContact CB-CD1 3.56Å
62P88.1Confident85.8Confident0 Ų051.4 Ų51.40%031%0.311CS..Hα-helixtrans-59.9-32173.4-24.834000113.9T46 F47 F50 F58 V59 F66 F104T46-P62 HydrophobicContact CG2-CG 4.22Å; F47-P62 HydrophobicContact CB-CB 3.98Å; F50-P62 HydrophobicContact CD2-CG 3.86Å; F50-P62 HydrophobicContact CE2-CG 4.28Å; F58-P62 WeakPolarHBondContact O-CD 3.34Å; V59-P62 WeakPolarHBondContact O-CD 3Å; P62-F66 VanDerWaalsContact O-CB 3.24Å; P62-F66 WeakPolarHBondContact O-CB 3.29Å; P62-F66 PolarHBondContact O-N 2.95Å; P62-F104 HydrophobicContact CB-CE1 4.06Å; P62-F104 HydrophobicContact CB-CZ 3.9Å; P62-F104 HydrophobicContact CG-CE1 3.97Å; P62-F104 HydrophobicContact CG-CZ 4.16Å
63L90.5Very high85.6Confident60 Ų6049.5 Ų49.531%0.31429%0.289SS..Hα-helixtrans-66.3-48.3177.2179.460.4000112F47 V59 T60 A61 E65 F66 L67F47-L63 HydrophobicContact CD2-CB 3.8Å; F47-L63 HydrophobicContact CD2-CD1 4.27Å; F47-L63 HydrophobicContact CE2-CB 3.74Å; F47-L63 HydrophobicContact CE2-CD1 3.78Å; F47-L63 HydrophobicContact CE2-CD2 4.21Å; F47-L63 HydrophobicContact CE2-CG 4.11Å; F47-L63 HydrophobicContact CZ-CD1 4Å; V59-L63 WeakPolarHBondContact O-CB 3.34Å; V59-L63 PolarHBondContact O-N 2.97Å; V59-L63 VanDerWaalsContact O-N 3.12Å; T60-L63 PolarHBondContact O-N 3.18Å; A61-L63 PolarHBondContact O-N 3.41Å; L63-E65 VanDerWaalsContact C-N 3.27Å; L63-E65 PolarHBondContact O-N 2.98Å; L63-F66 PolarHBondContact O-N 2.94Å; L63-L67 HydrophobicContact CD1-CG 4.48Å; L63-L67 HydrophobicContact CG-CD1 4.44Å; L63-L67 WeakPolarHBondContact O-CG 3.48Å; L63-L67 PolarHBondContact O-N 3.47Å
64I90.6Very high85.5Confident101 Ų10155.3 Ų55.352%0.51831%0.313SS..Hα-helixtrans-61.8-41.5177.7-66.9-64000110T60 A61 L67 A68T60-I64 HydrophobicContact CG2-CG1 4.29Å; T60-I64 VanDerWaalsContact O-CG1 3.29Å; T60-I64 WeakPolarHBondContact O-CG1 3.46Å; T60-I64 PolarHBondContact O-N 3.29Å; A61-I64 PolarHBondContact O-N 3.29Å; I64-L67 PolarHBondContact O-N 3.48Å; I64-A68 WeakPolarHBondContact O-CB 3.5Å; I64-A68 PolarHBondContact O-N 2.93Å
65E90.1Very high85.8Confident13 Ų1350.5 Ų50.56%0.06129%0.285CS..Hα-helixtrans-67.1-40178.7-158.762.8-147.400112.6A61 L63 L67 A68 A69 R96 A100 F104 F134A61-E65 PolarHBondContact O-N 3.28Å; A61-E65 VanDerWaalsContact O-N 3.08Å; L63-E65 VanDerWaalsContact C-N 3.27Å; L63-E65 PolarHBondContact O-N 2.98Å; E65-L67 VanDerWaalsContact C-N 3.33Å; E65-L67 PolarHBondContact O-N 3.45Å; E65-A68 PolarHBondContact O-N 3.38Å; E65-A69 VanDerWaalsContact O-CB 3.29Å; E65-A69 WeakPolarHBondContact O-CB 3.4Å; E65-A69 PolarHBondContact O-N 2.94Å; E65-R96 WeakPolarHBondContact OE1-CD 3.46Å; E65-R96 VanDerWaalsContact OE1-CG 3.26Å; E65-R96 WeakPolarHBondContact OE1-CG 3.43Å; E65-R96 IonicContact OE1-CZ 3.44Å; E65-R96 IonicContact OE1-NE 3.66Å; E65-R96 IonicContact OE1-NH1 2.68Å; E65-R96 PolarHBondContact OE1-NH1 2.99Å; E65-A100 HydrophobicContact CG-CB 3.87Å; E65-A100 WeakPolarHBondContact OE1-CB 3.28Å; E65-A100 WeakPolarHBondContact OE2-CB 3.37Å; E65-F104 HydrophobicContact CB-CE2 3.81Å; E65-F104 HydrophobicContact CB-CZ 4.28Å; E65-F104 HydrophobicContact CG-CE2 3.83Å; E65-F134 HydrophobicContact CG-CE1 4.11Å; E65-F134 HydrophobicContact CG-CE2 4.22Å; E65-F134 HydrophobicContact CG-CZ 3.52Å
66F89.1Confident85.7Confident35 Ų3554.7 Ų54.715%0.15430%0.301CS..Hα-helixtrans-59.5-44.9173.9172.9-106.2000111.5V40 L44 P62 L63 A69 L70V40-F66 HydrophobicContact CG1-CD2 4.14Å; V40-F66 HydrophobicContact CG1-CE2 3.72Å; L44-F66 HydrophobicContact CB-CD2 3.86Å; L44-F66 HydrophobicContact CB-CE2 3.75Å; L44-F66 HydrophobicContact CD1-CD2 4.35Å; L44-F66 HydrophobicContact CD1-CE1 4.44Å; L44-F66 HydrophobicContact CD1-CE2 3.88Å; L44-F66 HydrophobicContact CD1-CZ 3.92Å; L44-F66 HydrophobicContact CD2-CE2 4.29Å; L44-F66 HydrophobicContact CG-CE2 4.18Å; P62-F66 VanDerWaalsContact O-CB 3.24Å; P62-F66 WeakPolarHBondContact O-CB 3.29Å; P62-F66 PolarHBondContact O-N 2.95Å; L63-F66 PolarHBondContact O-N 2.94Å; F66-A69 PolarHBondContact O-N 3.41Å; F66-L70 HydrophobicContact CD1-CD1 4.05Å; F66-L70 HydrophobicContact CD2-CG 4.42Å; F66-L70 HydrophobicContact CE1-CD1 3.39Å; F66-L70 HydrophobicContact CE1-CG 4.19Å; F66-L70 HydrophobicContact CE2-CD1 4.02Å; F66-L70 HydrophobicContact CE2-CD2 4.4Å; F66-L70 HydrophobicContact CE2-CG 4.03Å; F66-L70 HydrophobicContact CZ-CD1 3.38Å; F66-L70 HydrophobicContact CZ-CD2 4.4Å; F66-L70 HydrophobicContact CZ-CG 3.92Å; F66-L70 WeakPolarHBondContact O-CB 3.44Å; F66-L70 WeakPolarHBondContact O-CG 3.13Å; F66-L70 PolarHBondContact O-N 2.97Å
67L91.2Very high85.5Confident93 Ų9355.1 Ų55.149%0.48730%0.301SS..Hα-helixtrans-64.9-40.1176.7-69.7176000112.1L63 I64 E65 L70 F71L63-L67 HydrophobicContact CD1-CG 4.48Å; L63-L67 HydrophobicContact CG-CD1 4.44Å; L63-L67 WeakPolarHBondContact O-CG 3.48Å; L63-L67 PolarHBondContact O-N 3.47Å; I64-L67 PolarHBondContact O-N 3.48Å; E65-L67 VanDerWaalsContact C-N 3.33Å; E65-L67 PolarHBondContact O-N 3.45Å; L67-L70 PolarHBondContact O-N 3.43Å; L67-F71 WeakPolarHBondContact O-CB 3.42Å; L67-F71 PolarHBondContact O-N 2.71Å
68A87.6Confident85.1Confident28 Ų2853.8 Ų53.823%0.23128%0.284CS..Hα-helixtrans-66.5-45.1177.500000111.8I64 E65 L70 F71 L72 R96I64-A68 WeakPolarHBondContact O-CB 3.5Å; I64-A68 PolarHBondContact O-N 2.93Å; E65-A68 PolarHBondContact O-N 3.38Å; A68-L70 PolarHBondContact O-N 2.96Å; A68-F71 WeakPolarHBondContact O-CB 3.3Å; A68-F71 PolarHBondContact O-N 3.08Å; A68-L72 WeakPolarHBondContact O-CG 3.29Å; A68-L72 PolarHBondContact O-N 3.01Å; A68-R96 HydrophobicContact CB-CG 4.41Å
69A87.6Confident84.1Confident0 Ų057.9 Ų57.90%030%0.301CS..Hα-helixtrans-63.7-39.6175.700000111.6V40 E65 F66 L72 L73V40-A69 HydrophobicContact CG2-CB 3.58Å; E65-A69 VanDerWaalsContact O-CB 3.29Å; E65-A69 WeakPolarHBondContact O-CB 3.4Å; E65-A69 PolarHBondContact O-N 2.94Å; F66-A69 PolarHBondContact O-N 3.41Å; A69-L72 PolarHBondContact O-N 3.08Å; A69-L73 VanDerWaalsContact O-CB 3.3Å; A69-L73 WeakPolarHBondContact O-CB 3.26Å; A69-L73 PolarHBondContact O-N 3.25Å
70L86.3Confident82.8Confident63 Ų6362.4 Ų62.433%0.3332%0.319SS..Hα-helixtrans-63.4-42.9172.4-82.5-173.4000112.4V40 F66 L67 A68 L72 L73 F74V40-L70 HydrophobicContact CG1-CD2 3.72Å; V40-L70 HydrophobicContact CG1-CG 4.33Å; V40-L70 HydrophobicContact CG2-CD2 4.27Å; F66-L70 HydrophobicContact CD1-CD1 4.05Å; F66-L70 HydrophobicContact CD2-CG 4.42Å; F66-L70 HydrophobicContact CE1-CD1 3.39Å; F66-L70 HydrophobicContact CE1-CG 4.19Å; F66-L70 HydrophobicContact CE2-CD1 4.02Å; F66-L70 HydrophobicContact CE2-CD2 4.4Å; F66-L70 HydrophobicContact CE2-CG 4.03Å; F66-L70 HydrophobicContact CZ-CD1 3.38Å; F66-L70 HydrophobicContact CZ-CD2 4.4Å; F66-L70 HydrophobicContact CZ-CG 3.92Å; F66-L70 WeakPolarHBondContact O-CB 3.44Å; F66-L70 WeakPolarHBondContact O-CG 3.13Å; F66-L70 PolarHBondContact O-N 2.97Å; L67-L70 PolarHBondContact O-N 3.43Å; A68-L70 PolarHBondContact O-N 2.96Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.49Å; L70-L73 HydrophobicContact CD2-CD2 4.38Å; L70-L73 PolarHBondContact O-N 3.38Å; L70-F74 WeakPolarHBondContact O-CB 3.36Å; L70-F74 PolarHBondContact O-N 3.11Å
71F86Confident81.2Confident128 Ų12863.1 Ų63.156%0.56132%0.32SS*.Hα-helixtrans-61.6-42.6177.1178.1-96.8000111.2L67 A68 F74 A75L67-F71 WeakPolarHBondContact O-CB 3.42Å; L67-F71 PolarHBondContact O-N 2.71Å; A68-F71 WeakPolarHBondContact O-CB 3.3Å; A68-F71 PolarHBondContact O-N 3.08Å; F71-F74 PolarHBondContact O-N 3.05Å; F71-A75 WeakPolarHBondContact O-CB 3.28Å; F71-A75 PolarHBondContact O-N 3.21Å
72L81.9Confident79.8Confident10 Ų1068.1 Ų68.15%0.05234%0.338CS..Hα-helixtrans-68.3-41.1176.7-73.3163.3000112.7L36 A68 A69 L70 F74 A75 Y76 F89 D93 R96L36-L72 HydrophobicContact CD2-CB 3.81Å; A68-L72 WeakPolarHBondContact O-CG 3.29Å; A68-L72 PolarHBondContact O-N 3.01Å; A69-L72 PolarHBondContact O-N 3.08Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.49Å; L72-F74 VanDerWaalsContact C-N 3.27Å; L72-F74 PolarHBondContact O-N 3.34Å; L72-A75 PolarHBondContact O-N 2.92Å; L72-Y76 VanDerWaalsContact O-CB 3.26Å; L72-Y76 WeakPolarHBondContact O-CB 3.46Å; L72-Y76 PolarHBondContact O-N 3.47Å; L72-F89 HydrophobicContact CD2-CE1 3.6Å; L72-F89 HydrophobicContact CD2-CZ 3.76Å; L72-D93 WeakPolarHBondContact CD1-OD1 3.27Å; L72-D93 HydrophobicContact CD2-CB 4.45Å; L72-R96 VanDerWaalsContact CD1-CZ 3.41Å
73L83.3Confident78.2Confident39 Ų3978.3 Ų78.320%0.20438%0.376CS..Hα-helixtrans-56.7-44.6172.1-17479.9000110.5F27 L36 I37 A69 L70 S77F27-L73 HydrophobicContact CE1-CD1 4.22Å; L36-L73 HydrophobicContact CB-CD1 4.14Å; I37-L73 HydrophobicContact CG1-CD1 4.02Å; A69-L73 VanDerWaalsContact O-CB 3.3Å; A69-L73 WeakPolarHBondContact O-CB 3.26Å; A69-L73 PolarHBondContact O-N 3.25Å; L70-L73 HydrophobicContact CD2-CD2 4.38Å; L70-L73 PolarHBondContact O-N 3.38Å; L73-S77 VanDerWaalsContact O-CB 3.28Å; L73-S77 WeakPolarHBondContact O-CB 3.12Å; L73-S77 PolarHBondContact O-N 2.62Å; L73-S77 PolarHBondContact O-OG 3.31Å
74F82.5Confident76.6Confident132 Ų13282 Ų8258%0.57939%0.39SS*.Hα-helixtrans-67.8-44178-172.9-97.4000112.2L70 F71 L72 Y76 S77 T78L70-F74 WeakPolarHBondContact O-CB 3.36Å; L70-F74 PolarHBondContact O-N 3.11Å; F71-F74 PolarHBondContact O-N 3.05Å; L72-F74 VanDerWaalsContact C-N 3.27Å; L72-F74 PolarHBondContact O-N 3.34Å; F74-Y76 VanDerWaalsContact C-N 3.33Å; F74-Y76 PolarHBondContact O-N 3.39Å; F74-S77 PolarHBondContact O-N 2.83Å; F74-T78 HydrophobicContact CD1-CG2 4.09Å; F74-T78 HydrophobicContact CD2-CG2 4.21Å; F74-T78 HydrophobicContact CE1-CG2 3.68Å; F74-T78 HydrophobicContact CE2-CG2 3.81Å; F74-T78 HydrophobicContact CG-CG2 4.34Å; F74-T78 HydrophobicContact CZ-CG2 3.54Å; F74-T78 WeakPolarHBondContact O-CB 3.29Å; F74-T78 WeakPolarHBondContact O-CG2 3.24Å; F74-T78 PolarHBondContact O-N 2.88Å; F74-T78 PolarHBondContact O-OG1 3.28Å
75A80.6Confident74.6Confident11 Ų1186.6 Ų86.69%0.09141%0.406CS..Hα-helixtrans-62.3-40.6177.300000111.9F71 L72 F80 F89F71-A75 WeakPolarHBondContact O-CB 3.28Å; F71-A75 PolarHBondContact O-N 3.21Å; L72-A75 PolarHBondContact O-N 2.92Å; A75-F80 PolarHBondContact O-N 3.47Å; A75-F89 HydrophobicContact CB-CE1 4.47Å; A75-F89 HydrophobicContact CB-CZ 3.74Å
76Y74.6Confident72.7Confident89 Ų8989.9 Ų89.935%0.34944%0.444SS..Hα-helixtrans-68-40.8175-174.3-121.2000111.3F27 S30 L36 L72 F74F27-Y76 HydrophobicContact CD1-CD1 4.38Å; F27-Y76 HydrophobicContact CD1-CE1 4.31Å; F27-Y76 HydrophobicContact CD2-CE1 4.46Å; F27-Y76 AromaticContact CE1-CD1 3.3Å; F27-Y76 HydrophobicContact CE1-CD1 3.3Å; F27-Y76 AromaticContact CE1-CE1 3.6Å; F27-Y76 HydrophobicContact CE1-CE1 3.6Å; F27-Y76 HydrophobicContact CE1-CG 4.44Å; F27-Y76 AromaticContact CE2-CD1 3.83Å; F27-Y76 HydrophobicContact CE2-CD1 3.83Å; F27-Y76 AromaticContact CE2-CE1 3.76Å; F27-Y76 HydrophobicContact CE2-CE1 3.76Å; F27-Y76 AromaticContact CZ-CD1 2.96Å; F27-Y76 HydrophobicContact CZ-CD1 2.96Å; F27-Y76 AromaticContact CZ-CE1 3.3Å; F27-Y76 HydrophobicContact CZ-CE1 3.3Å; F27-Y76 AromaticContact CZ-CG 3.84Å; F27-Y76 HydrophobicContact CZ-CG 3.84Å; S30-Y76 PolarHBondContact OG-OH 3.45Å; L36-Y76 HydrophobicContact CD1-CD1 4.16Å; L36-Y76 HydrophobicContact CD1-CG 4.37Å; L72-Y76 VanDerWaalsContact O-CB 3.26Å; L72-Y76 WeakPolarHBondContact O-CB 3.46Å; L72-Y76 PolarHBondContact O-N 3.47Å; F74-Y76 VanDerWaalsContact C-N 3.33Å; F74-Y76 PolarHBondContact O-N 3.39Å
77S73Confident71.1Confident61 Ų6194.8 Ų94.843%0.42747%0.466SS..Hα-helixtrans-69.5-39.2-179.5-60.60000113.3F27 L73 F74 K79F27-S77 VanDerWaalsContact CZ-OG 3.24Å; F27-S77 WeakPolarHBondContact CZ-OG 3.45Å; L73-S77 VanDerWaalsContact O-CB 3.28Å; L73-S77 WeakPolarHBondContact O-CB 3.12Å; L73-S77 PolarHBondContact O-N 2.62Å; L73-S77 PolarHBondContact O-OG 3.31Å; F74-S77 PolarHBondContact O-N 2.83Å; S77-K79 PolarHBondContact O-N 2.7Å
78T72.2Confident69.9Low62 Ų6297 Ų9738%0.3847%0.473SS..THydrogen-bonded Turntrans-82.83.6-176.152.50000113.8F74 F80F74-T78 HydrophobicContact CD1-CG2 4.09Å; F74-T78 HydrophobicContact CD2-CG2 4.21Å; F74-T78 HydrophobicContact CE1-CG2 3.68Å; F74-T78 HydrophobicContact CE2-CG2 3.81Å; F74-T78 HydrophobicContact CG-CG2 4.34Å; F74-T78 HydrophobicContact CZ-CG2 3.54Å; F74-T78 WeakPolarHBondContact O-CB 3.29Å; F74-T78 WeakPolarHBondContact O-CG2 3.24Å; F74-T78 PolarHBondContact O-N 2.88Å; F74-T78 PolarHBondContact O-OG1 3.28Å; T78-F80 PolarHBondContact O-N 3.44Å
79K65.6Low69.1Low141 Ų14198.5 Ų98.561%0.61348%0.475SS*.THydrogen-bonded Turntrans49.827.4-172-65-168.2175.9-173.90113.3S77 N81 E82S77-K79 PolarHBondContact O-N 2.7Å; K79-N81 PolarHBondContact O-N 2.86Å; K79-E82 PolarHBondContact O-N 3.43Å
80F60.6Low68.5Low119 Ų119101.8 Ų101.852%0.52250%0.496SS..G310 helixtrans-59.4-19.5177.4-140.7-95.3000111.9A75 T78 E82 R83 F84A75-F80 PolarHBondContact O-N 3.47Å; T78-F80 PolarHBondContact O-N 3.44Å; F80-E82 VanDerWaalsContact C-N 3.25Å; F80-E82 PolarHBondContact O-N 2.97Å; F80-R83 PolarHBondContact O-N 3.46Å; F80-R83 VanDerWaalsContact O-N 3.15Å; F80-F84 AromaticContact CD1-CD2 3.98Å; F80-F84 HydrophobicContact CD1-CD2 3.98Å; F80-F84 HydrophobicContact CD1-CE2 4.25Å; F80-F84 AromaticContact CE1-CD2 3.71Å; F80-F84 HydrophobicContact CE1-CD2 3.71Å; F80-F84 AromaticContact CE1-CE2 3.51Å; F80-F84 HydrophobicContact CE1-CE2 3.51Å; F80-F84 HydrophobicContact CZ-CE2 4.24Å
81N55.2Low68.1Low109 Ų109101.5 Ų101.558%0.58349%0.494SS*.G310 helixtrans-52.5-33.2169.5-165.930.1000114.2K79 R83K79-N81 PolarHBondContact O-N 2.86Å; N81-R83 VanDerWaalsContact C-N 3.32Å; N81-R83 PolarHBondContact O-N 3.39Å
82E58.5Low67.8Low137 Ų13799.5 Ų99.564%0.6449%0.487SS*.G310 helixtrans-76.4-19.1-179.4-74.3-176.8128.800113.3K79 F80K79-E82 PolarHBondContact O-N 3.43Å; F80-E82 VanDerWaalsContact C-N 3.25Å; F80-E82 PolarHBondContact O-N 2.97Å
83R56.6Low67.9Low213 Ų213100.1 Ų100.180%0.80449%0.491SS*.THydrogen-bonded Turntrans-89.8-21.1-175.8-72.1-68.1-160.3169.83.8114F80 N81F80-R83 PolarHBondContact O-N 3.46Å; F80-R83 VanDerWaalsContact O-N 3.15Å; N81-R83 VanDerWaalsContact C-N 3.32Å; N81-R83 PolarHBondContact O-N 3.39Å
84F55.1Low68.1Low137 Ų137100.4 Ų100.460%0.60149%0.491SS*.  trans-12668.9-176.8-77.4-85.7000111.9F80 G86F80-F84 AromaticContact CD1-CD2 3.98Å; F80-F84 HydrophobicContact CD1-CD2 3.98Å; F80-F84 HydrophobicContact CD1-CE2 4.25Å; F80-F84 AromaticContact CE1-CD2 3.71Å; F80-F84 HydrophobicContact CE1-CD2 3.71Å; F80-F84 AromaticContact CE1-CE2 3.51Å; F80-F84 HydrophobicContact CE1-CE2 3.51Å; F80-F84 HydrophobicContact CZ-CE2 4.24Å; F84-G86 PolarHBondContact O-N 3.37Å; F84-G86 VanDerWaalsContact O-N 3.08Å
85K49.5Very low68.3Low198 Ų19899.5 Ų99.586%0.86149%0.491SS*.THydrogen-bonded Turntrans-67.90.9178.4-75.2-175.9175.8177.70115.7
86G50.4Low68.7Low83 Ų83100.2 Ų100.286%0.85649%0.492SS*.THydrogen-bonded Turntrans-110.8-5.7-173.900000115.9F84F84-G86 PolarHBondContact O-N 3.37Å; F84-G86 VanDerWaalsContact O-N 3.08Å
87F55Low69.5Low138 Ų13896 Ų9661%0.60548%0.475SS*.SBendtrans-100.9141-173.3-154.5-104000110.9F89 M92F87-F89 PolarHBondContact O-N 2.91Å; F87-M92 HydrophobicContact CE1-CE 4.2Å; F87-M92 HydrophobicContact CE1-SD 4.25Å
88H65.3Low70.4Confident138 Ų13895.1 Ų95.164%0.63947%0.467SS*.  trans-65.143.6176.5-81.9126.6000113.7P90 L91 M92H88-P90 VanDerWaalsContact C-CD 3.47Å; H88-L91 HydrophobicContact CB-CB 4.21Å; H88-L91 HydrophobicContact CB-CD1 4.33Å; H88-L91 WeakPolarHBondContact CD2-CD1 3.39Å; H88-L91 PolarHBondContact O-N 2.7Å; H88-L91 VanDerWaalsContact O-N 3.11Å; H88-M92 PolarHBondContact O-N 3.07Å
89F72.1Confident71.3Confident61 Ų6194.6 Ų94.627%0.26847%0.466SS..Hα-helixtrans-55-43.4-176.3-154.2-89.2000113L72 A75 F87 L91 M92 D93L72-F89 HydrophobicContact CD2-CE1 3.6Å; L72-F89 HydrophobicContact CD2-CZ 3.76Å; A75-F89 HydrophobicContact CB-CE1 4.47Å; A75-F89 HydrophobicContact CB-CZ 3.74Å; F87-F89 PolarHBondContact O-N 2.91Å; F89-L91 PolarHBondContact O-N 3.23Å; F89-M92 HydrophobicContact CD2-CE 4.11Å; F89-M92 HydrophobicContact CE2-CE 4.23Å; F89-M92 PolarHBondContact O-N 2.83Å; F89-D93 PolarHBondContact O-N 3.18Å; F89-D93 VanDerWaalsContact O-N 3.08Å
90P74.4Confident72.6Confident68 Ų6887.9 Ų87.944%0.44244%0.437SS..Hα-helixtrans-67.8-34.7177-18.232.1000113.5H88 F94 I141H88-P90 VanDerWaalsContact C-CD 3.47Å; P90-F94 WeakPolarHBondContact O-CB 3.3Å; P90-F94 PolarHBondContact O-N 3.5Å; P90-I141 WeakPolarHBondContact O-CG2 3.29Å
91L77Confident74.2Confident57 Ų5783 Ų8330%0.29842%0.417SS..Hα-helixtrans-71.3-39177.3-71.3-174.7000111.9H88 F89 D93 F94 L95 L145H88-L91 HydrophobicContact CB-CB 4.21Å; H88-L91 HydrophobicContact CB-CD1 4.33Å; H88-L91 WeakPolarHBondContact CD2-CD1 3.39Å; H88-L91 PolarHBondContact O-N 2.7Å; H88-L91 VanDerWaalsContact O-N 3.11Å; F89-L91 PolarHBondContact O-N 3.23Å; L91-D93 VanDerWaalsContact C-N 3.3Å; L91-F94 PolarHBondContact O-N 3.39Å; L91-L95 WeakPolarHBondContact O-CG 3.36Å; L91-L95 PolarHBondContact O-N 2.91Å; L91-L145 HydrophobicContact CD2-CD1 3.95Å; L91-L145 HydrophobicContact CD2-CD2 3.35Å; L91-L145 HydrophobicContact CD2-CG 4.29Å
92M81.2Confident76.1Confident86 Ų8682.2 Ų82.242%0.42441%0.412SS..Hα-helixtrans-62.6-41.4175.3-175.8170.963.100110.7F87 H88 F89 L95 R96F87-M92 HydrophobicContact CE1-CE 4.2Å; F87-M92 HydrophobicContact CE1-SD 4.25Å; H88-M92 PolarHBondContact O-N 3.07Å; F89-M92 HydrophobicContact CD2-CE 4.11Å; F89-M92 HydrophobicContact CE2-CE 4.23Å; F89-M92 PolarHBondContact O-N 2.83Å; M92-L95 PolarHBondContact O-N 3.25Å; M92-R96 WeakPolarHBondContact O-CB 3.32Å; M92-R96 PolarHBondContact O-N 3.47Å
93D83.8Confident77.7Confident24 Ų2479.1 Ų79.113%0.12840%0.4CS..Hα-helixtrans-67.1-41.6176.5-152.2-0000111.9L72 F89 L91 L95 R96 C97 I141L72-D93 WeakPolarHBondContact CD1-OD1 3.27Å; L72-D93 HydrophobicContact CD2-CB 4.45Å; F89-D93 PolarHBondContact O-N 3.18Å; F89-D93 VanDerWaalsContact O-N 3.08Å; L91-D93 VanDerWaalsContact C-N 3.3Å; D93-L95 PolarHBondContact O-N 3.23Å; D93-R96 WeakPolarHBondContact O-CB 3.49Å; D93-R96 PolarHBondContact O-N 3.04Å; D93-R96 IonicContact OD1-CZ 3.69Å; D93-R96 IonicContact OD1-NE 3.18Å; D93-R96 PolarHBondContact OD1-NE 2.91Å; D93-R96 IonicContact OD1-NH2 3.29Å; D93-R96 PolarHBondContact OD1-NH2 2.71Å; D93-C97 PolarHBondContact O-N 3.39Å; D93-C97 PolarHBondContact O-SG 2.89Å; D93-C97 VanDerWaalsContact O-SG 3.41Å; D93-I141 HydrophobicContact CB-CD1 4.23Å
94F86.8Confident79.4Confident44 Ų4469.1 Ų69.119%0.19336%0.362CS..Hα-helixtrans-56.8-51.2172.2169.1-95.5000112.5P90 L91 R96 C97 V98 F138 I141 F142P90-F94 WeakPolarHBondContact O-CB 3.3Å; P90-F94 PolarHBondContact O-N 3.5Å; L91-F94 PolarHBondContact O-N 3.39Å; F94-R96 VanDerWaalsContact C-N 3.29Å; F94-R96 PolarHBondContact O-N 2.85Å; F94-C97 PolarHBondContact O-N 3.33Å; F94-V98 HydrophobicContact CD2-CG2 4.31Å; F94-V98 HydrophobicContact CE1-CG2 4.16Å; F94-V98 HydrophobicContact CE2-CG2 3.98Å; F94-V98 HydrophobicContact CZ-CG2 3.88Å; F94-V98 WeakPolarHBondContact O-CG2 3.49Å; F94-V98 PolarHBondContact O-N 3.37Å; F94-F138 HydrophobicContact CD2-CB 4.33Å; F94-F138 HydrophobicContact CD2-CD2 4.08Å; F94-F138 AromaticContact CE2-CD2 3.53Å; F94-F138 HydrophobicContact CE2-CD2 3.53Å; F94-F138 HydrophobicContact CE2-CE2 4.23Å; F94-F138 HydrophobicContact CE2-CG 4.4Å; F94-F138 HydrophobicContact CZ-CD2 4.47Å; F94-I141 HydrophobicContact CB-CG2 3.79Å; F94-F142 HydrophobicContact CD2-CB 4.3Å; F94-F142 HydrophobicContact CE2-CB 4.04Å; F94-F142 HydrophobicContact CE2-CD2 4.07Å; F94-F142 HydrophobicContact CE2-CG 4.48Å
95L86.8Confident81.3Confident113 Ų11366.8 Ų66.859%0.59235%0.352SS*.Hα-helixtrans-63.6-37.9-179.8-74.1178.8000111.6L91 M92 D93 S99L91-L95 WeakPolarHBondContact O-CG 3.36Å; L91-L95 PolarHBondContact O-N 2.91Å; M92-L95 PolarHBondContact O-N 3.25Å; D93-L95 PolarHBondContact O-N 3.23Å; L95-S99 WeakPolarHBondContact O-CB 3.26Å; L95-S99 PolarHBondContact O-N 3.01Å; L95-S99 PolarHBondContact O-OG 2.83Å
96R89.8Confident83.4Confident26 Ų2661.5 Ų61.510%0.09833%0.332CS..Hα-helixtrans-58.9-56172.2-174.7-15766109.7-8.8110.7E39 E65 A68 L72 M92 D93 F94 V98 S99 A100E39-R96 IonicContact OE2-CZ 3.55Å; E39-R96 IonicContact OE2-NH1 3.5Å; E39-R96 PolarHBondContact OE2-NH1 3.32Å; E39-R96 IonicContact OE2-NH2 2.71Å; E39-R96 PolarHBondContact OE2-NH2 2.88Å; E65-R96 WeakPolarHBondContact OE1-CD 3.46Å; E65-R96 VanDerWaalsContact OE1-CG 3.26Å; E65-R96 WeakPolarHBondContact OE1-CG 3.43Å; E65-R96 IonicContact OE1-CZ 3.44Å; E65-R96 IonicContact OE1-NE 3.66Å; E65-R96 IonicContact OE1-NH1 2.68Å; E65-R96 PolarHBondContact OE1-NH1 2.99Å; A68-R96 HydrophobicContact CB-CG 4.41Å; L72-R96 VanDerWaalsContact CD1-CZ 3.41Å; M92-R96 WeakPolarHBondContact O-CB 3.32Å; M92-R96 PolarHBondContact O-N 3.47Å; D93-R96 WeakPolarHBondContact O-CB 3.49Å; D93-R96 PolarHBondContact O-N 3.04Å; D93-R96 IonicContact OD1-CZ 3.69Å; D93-R96 IonicContact OD1-NE 3.18Å; D93-R96 PolarHBondContact OD1-NE 2.91Å; D93-R96 IonicContact OD1-NH2 3.29Å; D93-R96 PolarHBondContact OD1-NH2 2.71Å; F94-R96 VanDerWaalsContact C-N 3.29Å; F94-R96 PolarHBondContact O-N 2.85Å; R96-V98 VanDerWaalsContact C-N 3.32Å; R96-V98 PolarHBondContact O-N 3.31Å; R96-S99 PolarHBondContact O-N 3.3Å; R96-S99 PolarHBondContact O-OG 2.82Å; R96-A100 VanDerWaalsContact O-CB 3.24Å; R96-A100 WeakPolarHBondContact O-CB 3.35Å; R96-A100 PolarHBondContact O-N 3.37Å
97C90.4Very high85.4Confident0 Ų058.1 Ų58.10%029%0.294CS..Hα-helixtrans-60-39-178.7-67.50000112.9D93 F94 S101 F134 D137 F138D93-C97 PolarHBondContact O-N 3.39Å; D93-C97 PolarHBondContact O-SG 2.89Å; D93-C97 VanDerWaalsContact O-SG 3.41Å; F94-C97 PolarHBondContact O-N 3.33Å; C97-S101 VanDerWaalsContact O-CB 3.3Å; C97-S101 WeakPolarHBondContact O-CB 3.45Å; C97-S101 PolarHBondContact O-N 3.05Å; C97-F134 HydrophobicContact CB-CD1 4.3Å; C97-D137 PolarHBondContact SG-OD2 2.94Å; C97-F138 HydrophobicContact CB-CB 4Å
98V91.6Very high87.2Confident43 Ų4351.9 Ų51.926%0.26127%0.268SS..Hα-helixtrans-65.1-49.4176.3172.50000111.2F94 R96 S101 I102 F138F94-V98 HydrophobicContact CD2-CG2 4.31Å; F94-V98 HydrophobicContact CE1-CG2 4.16Å; F94-V98 HydrophobicContact CE2-CG2 3.98Å; F94-V98 HydrophobicContact CZ-CG2 3.88Å; F94-V98 WeakPolarHBondContact O-CG2 3.49Å; F94-V98 PolarHBondContact O-N 3.37Å; R96-V98 VanDerWaalsContact C-N 3.32Å; R96-V98 PolarHBondContact O-N 3.31Å; V98-S101 PolarHBondContact O-N 3.3Å; V98-I102 HydrophobicContact CG1-CD1 4.09Å; V98-I102 WeakPolarHBondContact O-CG1 3.34Å; V98-I102 PolarHBondContact O-N 2.94Å; V98-I102 VanDerWaalsContact O-N 3.16Å; V98-F138 HydrophobicContact CG2-CB 3.94Å; V98-F138 HydrophobicContact CG2-CD1 4.36Å; V98-F138 HydrophobicContact CG2-CD2 4.15Å; V98-F138 HydrophobicContact CG2-CG 3.89Å
99S91.9Very high88.6Confident51 Ų5149.5 Ų49.536%0.35726%0.259SS..Hα-helixtrans-62.6-43.4178.8620000111.9L95 R96 S101 I102 I103L95-S99 WeakPolarHBondContact O-CB 3.26Å; L95-S99 PolarHBondContact O-N 3.01Å; L95-S99 PolarHBondContact O-OG 2.83Å; R96-S99 PolarHBondContact O-N 3.3Å; R96-S99 PolarHBondContact O-OG 2.82Å; S99-S101 PolarHBondContact O-N 3.01Å; S99-I102 PolarHBondContact O-N 2.86Å; S99-I103 WeakPolarHBondContact O-CB 3.48Å; S99-I103 WeakPolarHBondContact O-CD1 3.24Å; S99-I103 VanDerWaalsContact O-CG1 3.23Å; S99-I103 WeakPolarHBondContact O-CG1 3.42Å; S99-I103 PolarHBondContact O-N 2.94Å
100A92.5Very high89.5Confident0 Ų048.8 Ų48.80%026%0.257CS..Hα-helixtrans-56.8-50.4174.300000111.4E65 R96 I102 I103 F104 F134E65-A100 HydrophobicContact CG-CB 3.87Å; E65-A100 WeakPolarHBondContact OE1-CB 3.28Å; E65-A100 WeakPolarHBondContact OE2-CB 3.37Å; R96-A100 VanDerWaalsContact O-CB 3.24Å; R96-A100 WeakPolarHBondContact O-CB 3.35Å; R96-A100 PolarHBondContact O-N 3.37Å; A100-I102 VanDerWaalsContact C-N 3.3Å; A100-I102 PolarHBondContact O-N 3.17Å; A100-I103 PolarHBondContact O-N 3.49Å; A100-I103 VanDerWaalsContact O-N 3.17Å; A100-F104 WeakPolarHBondContact O-CB 3.33Å; A100-F104 VanDerWaalsContact O-CD2 3.32Å; A100-F104 WeakPolarHBondContact O-CD2 3.23Å; A100-F104 PolarHBondContact O-N 2.82Å; A100-F134 HydrophobicContact CB-CD1 3.88Å; A100-F134 HydrophobicContact CB-CD2 4.22Å; A100-F134 HydrophobicContact CB-CE1 3.9Å; A100-F134 HydrophobicContact CB-CE2 4.27Å; A100-F134 HydrophobicContact CB-CG 4.06Å; A100-F134 HydrophobicContact CB-CZ 4.12Å
101S94.4Very high90.3Very high17 Ų1745.6 Ų45.612%0.11924%0.236CC..Hα-helixtrans-55.1-46.1179.9-171.80000111.6C97 V98 S99 F105 T131C97-S101 VanDerWaalsContact O-CB 3.3Å; C97-S101 WeakPolarHBondContact O-CB 3.45Å; C97-S101 PolarHBondContact O-N 3.05Å; V98-S101 PolarHBondContact O-N 3.3Å; S99-S101 PolarHBondContact O-N 3.01Å; S101-F105 VanDerWaalsContact O-CB 3.24Å; S101-F105 WeakPolarHBondContact O-CB 3.49Å; S101-F105 PolarHBondContact O-N 3.2Å; S101-T131 PolarHBondContact O-OG1 2.95Å; S101-T131 WeakPolarHBondContact OG-CG2 3.45Å; S101-T131 PolarHBondContact OG-O 3.46Å; S101-T131 VanDerWaalsContact OG-O 3.11Å
102I94.3Very high90.8Very high93 Ų9346 Ų4648%0.47724%0.241SC..Hα-helixtrans-65.8-46178.2-64.5166.9000111.3V98 S99 A100 F105 I106V98-I102 HydrophobicContact CG1-CD1 4.09Å; V98-I102 WeakPolarHBondContact O-CG1 3.34Å; V98-I102 PolarHBondContact O-N 2.94Å; V98-I102 VanDerWaalsContact O-N 3.16Å; S99-I102 PolarHBondContact O-N 2.86Å; A100-I102 VanDerWaalsContact C-N 3.3Å; A100-I102 PolarHBondContact O-N 3.17Å; I102-F105 WeakPolarHBondContact O-CB 3.49Å; I102-F105 PolarHBondContact O-N 2.68Å; I102-I106 HydrophobicContact CG2-CD1 3.85Å; I102-I106 WeakPolarHBondContact O-CG1 3.24Å; I102-I106 PolarHBondContact O-N 2.76Å
103I92.8Very high91.3Very high72 Ų7245.9 Ų45.937%0.36925%0.248SC..Hα-helixtrans-62.7-49.8-178.8-70.9166.1000110.6A61 S99 A100 F105 I106 I107A61-I103 HydrophobicContact CB-CG2 3.68Å; S99-I103 WeakPolarHBondContact O-CB 3.48Å; S99-I103 WeakPolarHBondContact O-CD1 3.24Å; S99-I103 VanDerWaalsContact O-CG1 3.23Å; S99-I103 WeakPolarHBondContact O-CG1 3.42Å; S99-I103 PolarHBondContact O-N 2.94Å; A100-I103 PolarHBondContact O-N 3.49Å; A100-I103 VanDerWaalsContact O-N 3.17Å; I103-F105 VanDerWaalsContact C-N 3.27Å; I103-F105 PolarHBondContact O-N 3.15Å; I103-I106 PolarHBondContact O-N 3.12Å; I103-I107 HydrophobicContact CG2-CD1 3.54Å; I103-I107 HydrophobicContact CG2-CG1 4.39Å; I103-I107 WeakPolarHBondContact O-CB 3.38Å; I103-I107 VanDerWaalsContact O-CG1 3.28Å; I103-I107 WeakPolarHBondContact O-CG1 3.26Å; I103-I107 PolarHBondContact O-N 3.34Å
104F92.3Very high91.4Very high2 Ų252.6 Ų52.61%0.00928%0.277CS..Hα-helixtrans-62.3-35177.3-85.7-78.4000112.2T46 P62 E65 A100 S108 A130 F134T46-F104 HydrophobicContact CG2-CD1 4.14Å; T46-F104 HydrophobicContact CG2-CE1 3.66Å; P62-F104 HydrophobicContact CB-CE1 4.06Å; P62-F104 HydrophobicContact CB-CZ 3.9Å; P62-F104 HydrophobicContact CG-CE1 3.97Å; P62-F104 HydrophobicContact CG-CZ 4.16Å; E65-F104 HydrophobicContact CB-CE2 3.81Å; E65-F104 HydrophobicContact CB-CZ 4.28Å; E65-F104 HydrophobicContact CG-CE2 3.83Å; A100-F104 WeakPolarHBondContact O-CB 3.33Å; A100-F104 VanDerWaalsContact O-CD2 3.32Å; A100-F104 WeakPolarHBondContact O-CD2 3.23Å; A100-F104 PolarHBondContact O-N 2.82Å; F104-S108 WeakPolarHBondContact O-CB 3.14Å; F104-S108 PolarHBondContact O-N 2.86Å; F104-A130 HydrophobicContact CD1-CB 4.19Å; F104-A130 HydrophobicContact CG-CB 4.29Å; F104-F134 HydrophobicContact CD2-CD2 4.24Å; F104-F134 AromaticContact CD2-CE2 3.91Å; F104-F134 HydrophobicContact CD2-CE2 3.91Å; F104-F134 AromaticContact CE2-CE2 3.86Å; F104-F134 HydrophobicContact CE2-CE2 3.86Å; F104-F134 HydrophobicContact CE2-CZ 4.48Å
105F95Very high91.4Very high89 Ų8952.6 Ų52.639%0.3928%0.277SS..Hα-helixtrans-65-48.1176.9-179.3-117.4000111.6S101 I102 I103 S108 I109 F128 T131S101-F105 VanDerWaalsContact O-CB 3.24Å; S101-F105 WeakPolarHBondContact O-CB 3.49Å; S101-F105 PolarHBondContact O-N 3.2Å; I102-F105 WeakPolarHBondContact O-CB 3.49Å; I102-F105 PolarHBondContact O-N 2.68Å; I103-F105 VanDerWaalsContact C-N 3.27Å; I103-F105 PolarHBondContact O-N 3.15Å; F105-S108 WeakPolarHBondContact O-CB 3.48Å; F105-S108 PolarHBondContact O-N 3.48Å; F105-I109 HydrophobicContact CD1-CD1 4.24Å; F105-I109 HydrophobicContact CD2-CD1 4.44Å; F105-I109 HydrophobicContact CE1-CD1 3.74Å; F105-I109 HydrophobicContact CE2-CD1 3.96Å; F105-I109 HydrophobicContact CE2-CG1 4.5Å; F105-I109 HydrophobicContact CZ-CD1 3.59Å; F105-I109 WeakPolarHBondContact O-CG1 3.38Å; F105-I109 PolarHBondContact O-N 2.67Å; F105-I109 VanDerWaalsContact O-N 3.07Å; F105-F128 HydrophobicContact CD2-CD2 4.23Å; F105-F128 HydrophobicContact CD2-CE2 4.16Å; F105-F128 HydrophobicContact CE2-CD2 4.39Å; F105-F128 AromaticContact CE2-CE2 3.96Å; F105-F128 HydrophobicContact CE2-CE2 3.96Å; F105-T131 WeakPolarHBondContact CA-OG1 3.34Å; F105-T131 HydrophobicContact CB-CG2 3.85Å; F105-T131 HydrophobicContact CD2-CG2 4.24Å; F105-T131 HydrophobicContact CG-CG2 4.37Å; F105-T131 PolarHBondContact N-OG1 3.23Å
106I94.4Very high91.4Very high87 Ų8753.7 Ų53.745%0.44629%0.288SS..Hα-helixtrans-63.2-48.1178.5-66.8167.9000110.5I102 I103 S108 I109 I110I102-I106 HydrophobicContact CG2-CD1 3.85Å; I102-I106 WeakPolarHBondContact O-CG1 3.24Å; I102-I106 PolarHBondContact O-N 2.76Å; I103-I106 PolarHBondContact O-N 3.12Å; I106-S108 VanDerWaalsContact C-N 3.27Å; I106-S108 PolarHBondContact O-N 3.3Å; I106-I109 PolarHBondContact O-N 2.71Å; I106-I110 HydrophobicContact CG2-CD1 3.69Å; I106-I110 HydrophobicContact CG2-CG1 4.39Å; I106-I110 VanDerWaalsContact O-CG1 3.31Å; I106-I110 WeakPolarHBondContact O-CG1 3.25Å; I106-I110 PolarHBondContact O-N 2.62Å
107I92.2Very high91.3Very high11 Ų1154.1 Ų54.16%0.05629%0.293CS..Hα-helixtrans-63.2-36179.6-69.8173.3000111F50 F58 A61 I103 I110 S111F50-I107 HydrophobicContact CE1-CG2 4.11Å; F50-I107 HydrophobicContact CE2-CG2 3.4Å; F50-I107 VanDerWaalsContact CE2-CG2 3.4Å; F50-I107 HydrophobicContact CZ-CG2 3.15Å; F58-I107 HydrophobicContact CB-CD1 4.32Å; F58-I107 HydrophobicContact CB-CG1 4.47Å; F58-I107 HydrophobicContact CB-CG2 4.07Å; F58-I107 HydrophobicContact CD1-CD1 4.28Å; F58-I107 HydrophobicContact CD1-CG1 3.93Å; F58-I107 HydrophobicContact CG-CG1 4.39Å; F58-I107 HydrophobicContact CG-CG2 4.32Å; A61-I107 HydrophobicContact CB-CD1 3.56Å; I103-I107 HydrophobicContact CG2-CD1 3.54Å; I103-I107 HydrophobicContact CG2-CG1 4.39Å; I103-I107 WeakPolarHBondContact O-CB 3.38Å; I103-I107 VanDerWaalsContact O-CG1 3.28Å; I103-I107 WeakPolarHBondContact O-CG1 3.26Å; I103-I107 PolarHBondContact O-N 3.34Å; I107-I110 PolarHBondContact O-N 2.95Å; I107-S111 VanDerWaalsContact O-CB 3.27Å; I107-S111 WeakPolarHBondContact O-CB 3.33Å; I107-S111 PolarHBondContact O-N 3.49Å; I107-S111 PolarHBondContact O-OG 3.02Å
108S92.8Very high91.2Very high8 Ų856.9 Ų56.96%0.05632%0.321CS..Hα-helixtrans-60.9-49.6173.81760000111.5F104 F105 I106 I110 S111 V112 G124 F128F104-S108 WeakPolarHBondContact O-CB 3.14Å; F104-S108 PolarHBondContact O-N 2.86Å; F105-S108 WeakPolarHBondContact O-CB 3.48Å; F105-S108 PolarHBondContact O-N 3.48Å; I106-S108 VanDerWaalsContact C-N 3.27Å; I106-S108 PolarHBondContact O-N 3.3Å; S108-I110 VanDerWaalsContact C-N 3.34Å; S108-I110 PolarHBondContact O-N 3.03Å; S108-S111 WeakPolarHBondContact CA-OG 3.16Å; S108-S111 PolarHBondContact O-N 3.37Å; S108-S111 PolarHBondContact O-OG 3.24Å; S108-V112 WeakPolarHBondContact O-CB 3.32Å; S108-V112 WeakPolarHBondContact O-CG2 3.48Å; S108-V112 PolarHBondContact O-N 2.78Å; S108-G124 WeakPolarHBondContact CB-O 3.31Å; S108-G124 PolarHBondContact OG-O 3.42Å; S108-F128 WeakPolarHBondContact OG-CB 3.21Å
109I93.6Very high91.1Very high88 Ų8856.2 Ų56.245%0.45132%0.32SS..Hα-helixtrans-61.3-44177.7-65.7170.9000110.9F105 I106 S113F105-I109 HydrophobicContact CD1-CD1 4.24Å; F105-I109 HydrophobicContact CD2-CD1 4.44Å; F105-I109 HydrophobicContact CE1-CD1 3.74Å; F105-I109 HydrophobicContact CE2-CD1 3.96Å; F105-I109 HydrophobicContact CE2-CG1 4.5Å; F105-I109 HydrophobicContact CZ-CD1 3.59Å; F105-I109 WeakPolarHBondContact O-CG1 3.38Å; F105-I109 PolarHBondContact O-N 2.67Å; F105-I109 VanDerWaalsContact O-N 3.07Å; I106-I109 PolarHBondContact O-N 2.71Å; I109-S113 WeakPolarHBondContact O-CB 3Å; I109-S113 PolarHBondContact O-N 3.13Å; I109-S113 PolarHBondContact O-OG 2.87Å
110I92.1Very high90.9Very high46 Ų4653.8 Ų53.824%0.23630%0.303CS..Hα-helixtrans-65.6-46.2-179.6-65.2170.7000111F58 I106 I107 S108 V112 S113 K114 F115F58-I110 HydrophobicContact CE1-CD1 4.34Å; F58-I110 HydrophobicContact CE2-CG2 3.82Å; F58-I110 HydrophobicContact CZ-CD1 4.23Å; F58-I110 HydrophobicContact CZ-CG2 3.75Å; I106-I110 HydrophobicContact CG2-CD1 3.69Å; I106-I110 HydrophobicContact CG2-CG1 4.39Å; I106-I110 VanDerWaalsContact O-CG1 3.31Å; I106-I110 WeakPolarHBondContact O-CG1 3.25Å; I106-I110 PolarHBondContact O-N 2.62Å; I107-I110 PolarHBondContact O-N 2.95Å; S108-I110 VanDerWaalsContact C-N 3.34Å; S108-I110 PolarHBondContact O-N 3.03Å; I110-V112 PolarHBondContact O-N 2.9Å; I110-S113 PolarHBondContact O-N 3.25Å; I110-S113 PolarHBondContact O-OG 3.43Å; I110-K114 HydrophobicContact CG2-CB 4.48Å; I110-K114 HydrophobicContact CG2-CD 4.25Å; I110-K114 HydrophobicContact CG2-CG 4.17Å; I110-K114 WeakPolarHBondContact O-CB 3.11Å; I110-K114 PolarHBondContact O-N 2.83Å; I110-F115 HydrophobicContact CG2-CE2 4.11Å
111S89.9Confident90.8Very high0 Ų057.2 Ų57.20%032%0.318CS..Hα-helixtrans-62.6-41.8179.759.70000112.3I107 S108 S120 G124I107-S111 VanDerWaalsContact O-CB 3.27Å; I107-S111 WeakPolarHBondContact O-CB 3.33Å; I107-S111 PolarHBondContact O-N 3.49Å; I107-S111 PolarHBondContact O-OG 3.02Å; S108-S111 WeakPolarHBondContact CA-OG 3.16Å; S108-S111 PolarHBondContact O-N 3.37Å; S108-S111 PolarHBondContact O-OG 3.24Å; S111-S120 WeakPolarHBondContact CB-O 3.27Å; S111-G124 WeakPolarHBondContact OG-CA 3.43Å; S111-G124 PolarHBondContact OG-N 3.39Å
112V89.2Confident90.7Very high67 Ų6758 Ų5841%0.40633%0.326SS..Hα-helixtrans-75.1-25.7177179.90000112.6S108 I110 K121S108-V112 WeakPolarHBondContact O-CB 3.32Å; S108-V112 WeakPolarHBondContact O-CG2 3.48Å; S108-V112 PolarHBondContact O-N 2.78Å; I110-V112 PolarHBondContact O-N 2.9Å; V112-K121 PolarHBondContact O-NZ 3.48Å
113S89.8Confident90.5Very high82 Ų8253.6 Ų53.657%0.57330%0.303SS*.Hα-helixtrans-94.7-38.4-177.860.50000114.3I109 I110I109-S113 WeakPolarHBondContact O-CB 3Å; I109-S113 PolarHBondContact O-N 3.13Å; I109-S113 PolarHBondContact O-OG 2.87Å; I110-S113 PolarHBondContact O-N 3.25Å; I110-S113 PolarHBondContact O-OG 3.43Å
114K87.3Confident90.5Very high165 Ų16550.2 Ų50.272%0.71729%0.285SS*.Hα-helixtrans-98.9-28.3-170.1-59.5-150.686.980.50114.7I110I110-K114 HydrophobicContact CG2-CB 4.48Å; I110-K114 HydrophobicContact CG2-CD 4.25Å; I110-K114 HydrophobicContact CG2-CG 4.17Å; I110-K114 WeakPolarHBondContact O-CB 3.11Å; I110-K114 PolarHBondContact O-N 2.83Å
115F87.1Confident90.6Very high44 Ų4454 Ų5419%0.19331%0.309CS..  trans-105.7142-173.7-61.8-90.4000111.3A55 F58 I110 D117 S120 K121A55-F115 VanDerWaalsContact CA-CE1 3.48Å; A55-F115 HydrophobicContact CB-CD1 3.75Å; A55-F115 HydrophobicContact CB-CD2 3.88Å; A55-F115 HydrophobicContact CB-CE1 3.56Å; A55-F115 HydrophobicContact CB-CE2 3.65Å; A55-F115 HydrophobicContact CB-CG 3.9Å; A55-F115 HydrophobicContact CB-CZ 3.49Å; A55-F115 VanDerWaalsContact CB-CZ 3.49Å; F58-F115 HydrophobicContact CD2-CE2 4.28Å; F58-F115 HydrophobicContact CD2-CZ 4.4Å; F58-F115 AromaticContact CE2-CE2 3.79Å; F58-F115 HydrophobicContact CE2-CE2 3.79Å; F58-F115 AromaticContact CE2-CZ 3.93Å; F58-F115 HydrophobicContact CE2-CZ 3.93Å; I110-F115 HydrophobicContact CG2-CE2 4.11Å; F115-D117 WeakPolarHBondContact CB-OD1 3.47Å; F115-S120 VanDerWaalsContact CB-CB 3.42Å; F115-S120 WeakPolarHBondContact CB-OG 3.29Å; F115-S120 WeakPolarHBondContact CG-OG 3.36Å; F115-K121 WeakPolarHBondContact O-CE 3.34Å; F115-K121 PolarHBondContact O-NZ 2.98Å
116T85.3Confident90.5Very high137 Ų13753.3 Ų53.384%0.8431%0.305SS*.  trans-105.1-8.7-176.852.90000113.2
117D89.6Confident90.4Very high35 Ų3549.2 Ų49.219%0.18729%0.285CS..SBendtrans-72.4142.1177.763.1-71.3000111.6S53 T54 F115 A119 S120 K121S53-D117 VanDerWaalsContact CB-OD2 3.28Å; S53-D117 WeakPolarHBondContact CB-OD2 3.32Å; S53-D117 PolarHBondContact OG-OD2 3.48Å; T54-D117 PolarHBondContact OG1-OD1 3.31Å; F115-D117 WeakPolarHBondContact CB-OD1 3.47Å; D117-A119 PolarHBondContact O-N 3.03Å; D117-S120 WeakPolarHBondContact O-CB 3.47Å; D117-S120 PolarHBondContact O-N 2.95Å; D117-S120 VanDerWaalsContact OD1-CB 3.24Å; D117-S120 WeakPolarHBondContact OD1-CB 3.19Å; D117-S120 PolarHBondContact OD1-OG 2.74Å; D117-S120 WeakPolarHBondContact OD2-CB 3.48Å; D117-S120 PolarHBondContact OD2-N 3.02Å; D117-S120 PolarHBondContact OD2-OG 3.47Å; D117-K121 PolarHBondContact O-N 3.33Å
118G87.3Confident90.5Very high58 Ų5853.3 Ų53.360%0.59830%0.302SS*.Hα-helixtrans-60.8-33.7-177.200000113K121 A122G118-K121 PolarHBondContact O-N 2.97Å; G118-A122 WeakPolarHBondContact O-CB 3.24Å; G118-A122 PolarHBondContact O-N 3.41Å
119A89.1Confident90.6Very high28 Ų2856.3 Ų56.323%0.23132%0.317CS..Hα-helixtrans-65.2-44.317700000111.9A52 D117 K121 A122 A123A52-A119 HydrophobicContact CB-CB 4.41Å; D117-A119 PolarHBondContact O-N 3.03Å; A119-K121 PolarHBondContact O-N 2.66Å; A119-A122 PolarHBondContact O-N 2.91Å; A119-A123 WeakPolarHBondContact O-CB 3.39Å; A119-A123 PolarHBondContact O-N 3.38Å
120S88.1Confident90.5Very high0 Ų052.1 Ų52.10%030%0.296CS..Hα-helixtrans-57.9-46.5171.9-77.60000112.4S53 A55 S111 F115 D117 A122 A123 G124S53-S120 PolarHBondContact OG-OG 2.84Å; A55-S120 WeakPolarHBondContact CB-OG 3.22Å; S111-S120 WeakPolarHBondContact CB-O 3.27Å; F115-S120 VanDerWaalsContact CB-CB 3.42Å; F115-S120 WeakPolarHBondContact CB-OG 3.29Å; F115-S120 WeakPolarHBondContact CG-OG 3.36Å; D117-S120 WeakPolarHBondContact O-CB 3.47Å; D117-S120 PolarHBondContact O-N 2.95Å; D117-S120 VanDerWaalsContact OD1-CB 3.24Å; D117-S120 WeakPolarHBondContact OD1-CB 3.19Å; D117-S120 PolarHBondContact OD1-OG 2.74Å; D117-S120 WeakPolarHBondContact OD2-CB 3.48Å; D117-S120 PolarHBondContact OD2-N 3.02Å; D117-S120 PolarHBondContact OD2-OG 3.47Å; S120-A122 VanDerWaalsContact C-N 3.34Å; S120-A122 PolarHBondContact O-N 2.86Å; S120-A123 WeakPolarHBondContact O-CB 3.41Å; S120-A123 PolarHBondContact O-N 2.84Å; S120-G124 PolarHBondContact O-N 3.33Å
121K90.9Very high90.6Very high73 Ų7350.7 Ų50.732%0.31729%0.289SS..Hα-helixtrans-63.5-43.5-179.3-63.8-56.2-161.7-158.60111V112 F115 D117 G118 A119 G124 V125V112-K121 PolarHBondContact O-NZ 3.48Å; F115-K121 WeakPolarHBondContact O-CE 3.34Å; F115-K121 PolarHBondContact O-NZ 2.98Å; D117-K121 PolarHBondContact O-N 3.33Å; G118-K121 PolarHBondContact O-N 2.97Å; A119-K121 PolarHBondContact O-N 2.66Å; K121-G124 PolarHBondContact O-N 3.28Å; K121-V125 WeakPolarHBondContact O-CG2 3.49Å; K121-V125 PolarHBondContact O-N 2.92Å
122A92.3Very high90.8Very high34 Ų3454.7 Ų54.728%0.28131%0.31SS..Hα-helixtrans-61.7-47.1174.700000111.3G118 A119 S120 G124 V125 F126G118-A122 WeakPolarHBondContact O-CB 3.24Å; G118-A122 PolarHBondContact O-N 3.41Å; A119-A122 PolarHBondContact O-N 2.91Å; S120-A122 VanDerWaalsContact C-N 3.34Å; S120-A122 PolarHBondContact O-N 2.86Å; A122-G124 PolarHBondContact O-N 3.38Å; A122-V125 PolarHBondContact O-N 2.88Å; A122-V125 VanDerWaalsContact O-N 3.13Å; A122-F126 HydrophobicContact CB-CD2 4.38Å; A122-F126 HydrophobicContact CB-CE2 4.34Å; A122-F126 WeakPolarHBondContact O-CD2 3.33Å; A122-F126 PolarHBondContact O-N 2.88Å
123A90.6Very high90.9Very high0 Ų052.7 Ų52.70%030%0.297CS..Hα-helixtrans-54.8-39.9174.600000111.5C49 F50 A119 S120 G127C49-A123 HydrophobicContact CB-CB 3.52Å; F50-A123 HydrophobicContact CD1-CB 4.14Å; F50-A123 HydrophobicContact CD2-CB 3.96Å; F50-A123 HydrophobicContact CE1-CB 3.92Å; F50-A123 HydrophobicContact CE2-CB 3.75Å; F50-A123 HydrophobicContact CG-CB 4.13Å; F50-A123 HydrophobicContact CZ-CB 3.69Å; A119-A123 WeakPolarHBondContact O-CB 3.39Å; A119-A123 PolarHBondContact O-N 3.38Å; S120-A123 WeakPolarHBondContact O-CB 3.41Å; S120-A123 PolarHBondContact O-N 2.84Å; A123-G127 WeakPolarHBondContact O-CA 3.43Å; A123-G127 PolarHBondContact O-N 3.48Å
124G91.3Very high91Very high0 Ų048.8 Ų48.80%027%0.27CS..Hα-helixtrans-65.4-45.5176.300000113.7S108 S111 S120 K121 A122 G127 F128S108-G124 WeakPolarHBondContact CB-O 3.31Å; S108-G124 PolarHBondContact OG-O 3.42Å; S111-G124 WeakPolarHBondContact OG-CA 3.43Å; S111-G124 PolarHBondContact OG-N 3.39Å; S120-G124 PolarHBondContact O-N 3.33Å; K121-G124 PolarHBondContact O-N 3.28Å; A122-G124 PolarHBondContact O-N 3.38Å; G124-G127 PolarHBondContact O-N 3.5Å; G124-F128 PolarHBondContact O-N 2.9Å
125V94.3Very high91.2Very high83 Ų8342.4 Ų42.450%0.50325%0.248SC..Hα-helixtrans-63.9-47.2176.6175.70000110.9K121 A122 G127 F128 I129K121-V125 WeakPolarHBondContact O-CG2 3.49Å; K121-V125 PolarHBondContact O-N 2.92Å; A122-V125 PolarHBondContact O-N 2.88Å; A122-V125 VanDerWaalsContact O-N 3.13Å; V125-G127 VanDerWaalsContact C-N 3.33Å; V125-G127 PolarHBondContact O-N 3.33Å; V125-F128 WeakPolarHBondContact O-CB 3.44Å; V125-F128 PolarHBondContact O-N 3.49Å; V125-I129 HydrophobicContact CG1-CD1 4.23Å; V125-I129 WeakPolarHBondContact O-CG1 3.42Å; V125-I129 PolarHBondContact O-N 2.97Å
126F93.3Very high91.4Very high73 Ų7344.4 Ų44.432%0.3226%0.26SS..Hα-helixtrans-64.8-37.7176.9-72.2-63.2000112.3L42 I45 A122 F128 I129 A130L42-F126 HydrophobicContact CD2-CD1 4.49Å; I45-F126 HydrophobicContact CG2-CB 4.24Å; I45-F126 HydrophobicContact CG2-CD1 4.02Å; I45-F126 HydrophobicContact CG2-CD2 3.66Å; I45-F126 HydrophobicContact CG2-CE1 4.29Å; I45-F126 HydrophobicContact CG2-CE2 3.96Å; I45-F126 HydrophobicContact CG2-CG 3.71Å; I45-F126 HydrophobicContact CG2-CZ 4.27Å; A122-F126 HydrophobicContact CB-CD2 4.38Å; A122-F126 HydrophobicContact CB-CE2 4.34Å; A122-F126 WeakPolarHBondContact O-CD2 3.33Å; A122-F126 PolarHBondContact O-N 2.88Å; F126-F128 VanDerWaalsContact C-N 3.33Å; F126-F128 PolarHBondContact O-N 3.47Å; F126-I129 HydrophobicContact CD1-CD1 4.39Å; F126-I129 PolarHBondContact O-N 3.08Å; F126-A130 WeakPolarHBondContact O-CB 3.38Å; F126-A130 PolarHBondContact O-N 3.3Å
127G92.2Very high91.6Very high1 Ų138.3 Ų38.31%0.0122%0.222CC..Hα-helixtrans-62.9-37.2173.200000112.7A123 G124 V125 A130 T131A123-G127 WeakPolarHBondContact O-CA 3.43Å; A123-G127 PolarHBondContact O-N 3.48Å; G124-G127 PolarHBondContact O-N 3.5Å; V125-G127 VanDerWaalsContact C-N 3.33Å; V125-G127 PolarHBondContact O-N 3.33Å; G127-A130 WeakPolarHBondContact O-CB 3.47Å; G127-A130 PolarHBondContact O-N 2.83Å; G127-T131 PolarHBondContact O-N 2.9Å; G127-T131 PolarHBondContact O-OG1 2.9Å
128F94.2Very high91.5Very high97 Ų9739.9 Ų39.943%0.42523%0.228SC..Hα-helixtrans-67-41.8174.3-170.4-104.2000112.1F105 S108 G124 V125 F126 A130 T131 I132F105-F128 HydrophobicContact CD2-CD2 4.23Å; F105-F128 HydrophobicContact CD2-CE2 4.16Å; F105-F128 HydrophobicContact CE2-CD2 4.39Å; F105-F128 AromaticContact CE2-CE2 3.96Å; F105-F128 HydrophobicContact CE2-CE2 3.96Å; S108-F128 WeakPolarHBondContact OG-CB 3.21Å; G124-F128 PolarHBondContact O-N 2.9Å; V125-F128 WeakPolarHBondContact O-CB 3.44Å; V125-F128 PolarHBondContact O-N 3.49Å; F126-F128 VanDerWaalsContact C-N 3.33Å; F126-F128 PolarHBondContact O-N 3.47Å; F128-A130 VanDerWaalsContact C-N 3.3Å; F128-A130 PolarHBondContact O-N 3.4Å; F128-T131 WeakPolarHBondContact O-CB 3.42Å; F128-T131 PolarHBondContact O-N 2.73Å; F128-I132 HydrophobicContact CD1-CD1 4.21Å; F128-I132 HydrophobicContact CE1-CD1 3.9Å; F128-I132 PolarHBondContact O-N 3.32Å
129I94.6Very high91.6Very high72 Ų7243.5 Ų43.537%0.36922%0.224SC..Hα-helixtrans-61.6-43.1173.5-63.6166.3000109.8L42 V125 F126 T131 I132 V133L42-I129 HydrophobicContact CD1-CG2 4.09Å; L42-I129 HydrophobicContact CD2-CB 4.38Å; L42-I129 HydrophobicContact CD2-CG2 3.92Å; V125-I129 HydrophobicContact CG1-CD1 4.23Å; V125-I129 WeakPolarHBondContact O-CG1 3.42Å; V125-I129 PolarHBondContact O-N 2.97Å; F126-I129 HydrophobicContact CD1-CD1 4.39Å; F126-I129 PolarHBondContact O-N 3.08Å; I129-T131 VanDerWaalsContact C-N 3.33Å; I129-T131 PolarHBondContact O-N 3.45Å; I129-I132 PolarHBondContact O-N 3.32Å; I129-I132 VanDerWaalsContact O-N 3.14Å; I129-V133 PolarHBondContact O-N 3.18Å
130A92.4Very high91.5Very high0 Ų045.3 Ų45.30%023%0.227CC..Hα-helixtrans-57.5-44.817500000111.6L42 F104 F126 G127 F128 I132 V133 F134L42-A130 HydrophobicContact CB-CB 4Å; F104-A130 HydrophobicContact CD1-CB 4.19Å; F104-A130 HydrophobicContact CG-CB 4.29Å; F126-A130 WeakPolarHBondContact O-CB 3.38Å; F126-A130 PolarHBondContact O-N 3.3Å; G127-A130 WeakPolarHBondContact O-CB 3.47Å; G127-A130 PolarHBondContact O-N 2.83Å; F128-A130 VanDerWaalsContact C-N 3.3Å; F128-A130 PolarHBondContact O-N 3.4Å; A130-I132 VanDerWaalsContact C-N 3.27Å; A130-I132 PolarHBondContact O-N 3.22Å; A130-V133 PolarHBondContact O-N 3.28Å; A130-V133 VanDerWaalsContact O-N 3.1Å; A130-F134 HydrophobicContact CB-CD2 4.28Å; A130-F134 HydrophobicContact CB-CE2 4.3Å; A130-F134 WeakPolarHBondContact O-CD2 3.45Å; A130-F134 PolarHBondContact O-N 3.28Å
131T94.4Very high91.5Very high15 Ų1546.2 Ų46.29%0.09223%0.232CC..Hα-helixtrans-53.1-44.3174.9-66.10000112.1S101 F105 G127 F128 I129 A135S101-T131 PolarHBondContact O-OG1 2.95Å; S101-T131 WeakPolarHBondContact OG-CG2 3.45Å; S101-T131 PolarHBondContact OG-O 3.46Å; S101-T131 VanDerWaalsContact OG-O 3.11Å; F105-T131 WeakPolarHBondContact CA-OG1 3.34Å; F105-T131 HydrophobicContact CB-CG2 3.85Å; F105-T131 HydrophobicContact CD2-CG2 4.24Å; F105-T131 HydrophobicContact CG-CG2 4.37Å; F105-T131 PolarHBondContact N-OG1 3.23Å; G127-T131 PolarHBondContact O-N 2.9Å; G127-T131 PolarHBondContact O-OG1 2.9Å; F128-T131 WeakPolarHBondContact O-CB 3.42Å; F128-T131 PolarHBondContact O-N 2.73Å; I129-T131 VanDerWaalsContact C-N 3.33Å; I129-T131 PolarHBondContact O-N 3.45Å; T131-A135 WeakPolarHBondContact O-CB 3.36Å; T131-A135 PolarHBondContact O-N 3.31Å
132I93.9Very high91.3Very high85 Ų8547.7 Ų47.744%0.43624%0.238SC..Hα-helixtrans-65.9-44178.6-61.8170.2000110.5F128 I129 A130 A135 L136F128-I132 HydrophobicContact CD1-CD1 4.21Å; F128-I132 HydrophobicContact CE1-CD1 3.9Å; F128-I132 PolarHBondContact O-N 3.32Å; I129-I132 PolarHBondContact O-N 3.32Å; I129-I132 VanDerWaalsContact O-N 3.14Å; A130-I132 VanDerWaalsContact C-N 3.27Å; A130-I132 PolarHBondContact O-N 3.22Å; I132-A135 WeakPolarHBondContact O-CB 3.24Å; I132-A135 PolarHBondContact O-N 3.48Å; I132-L136 HydrophobicContact CG2-CD1 4.45Å; I132-L136 WeakPolarHBondContact O-CG 3.42Å; I132-L136 PolarHBondContact O-N 3.48Å
133V91.8Very high91.1Very high24 Ų2449.5 Ų49.515%0.14524%0.243CC..Hα-helixtrans-63.9-47.9179.5174.50000111.3L35 A38 E39 L42 I129 A130 A135 L136 D137L35-V133 HydrophobicContact CD2-CG1 4.28Å; A38-V133 HydrophobicContact CB-CG1 4.02Å; E39-V133 HydrophobicContact CG-CG1 3.98Å; L42-V133 HydrophobicContact CD1-CB 3.94Å; L42-V133 HydrophobicContact CD1-CG1 4.31Å; L42-V133 HydrophobicContact CD1-CG2 3.54Å; I129-V133 PolarHBondContact O-N 3.18Å; A130-V133 PolarHBondContact O-N 3.28Å; A130-V133 VanDerWaalsContact O-N 3.1Å; V133-A135 PolarHBondContact O-N 2.96Å; V133-L136 WeakPolarHBondContact O-CB 3.48Å; V133-L136 PolarHBondContact O-N 3.22Å; V133-L136 VanDerWaalsContact O-N 3.13Å; V133-D137 PolarHBondContact O-N 3.47Å
134F90.7Very high90.8Very high0 Ų052.1 Ų52.10%026%0.257CS..Hα-helixtrans-61-33.5173.3-79-66.5000112.3E39 E65 C97 A100 F104 A130 D137 F138E39-F134 HydrophobicContact CB-CE1 3.96Å; E39-F134 HydrophobicContact CB-CZ 3.94Å; E39-F134 HydrophobicContact CG-CD1 3.86Å; E39-F134 HydrophobicContact CG-CE1 3.58Å; E39-F134 HydrophobicContact CG-CE2 4.5Å; E39-F134 HydrophobicContact CG-CG 4.43Å; E39-F134 HydrophobicContact CG-CZ 3.91Å; E39-F134 WeakPolarHBondContact OE1-CD1 3.45Å; E39-F134 WeakPolarHBondContact OE1-CE1 3.39Å; E39-F134 VanDerWaalsContact OE2-CE1 3.27Å; E39-F134 WeakPolarHBondContact OE2-CE1 3.24Å; E65-F134 HydrophobicContact CG-CE1 4.11Å; E65-F134 HydrophobicContact CG-CE2 4.22Å; E65-F134 HydrophobicContact CG-CZ 3.52Å; C97-F134 HydrophobicContact CB-CD1 4.3Å; A100-F134 HydrophobicContact CB-CD1 3.88Å; A100-F134 HydrophobicContact CB-CD2 4.22Å; A100-F134 HydrophobicContact CB-CE1 3.9Å; A100-F134 HydrophobicContact CB-CE2 4.27Å; A100-F134 HydrophobicContact CB-CG 4.06Å; A100-F134 HydrophobicContact CB-CZ 4.12Å; F104-F134 HydrophobicContact CD2-CD2 4.24Å; F104-F134 AromaticContact CD2-CE2 3.91Å; F104-F134 HydrophobicContact CD2-CE2 3.91Å; F104-F134 AromaticContact CE2-CE2 3.86Å; F104-F134 HydrophobicContact CE2-CE2 3.86Å; F104-F134 HydrophobicContact CE2-CZ 4.48Å; A130-F134 HydrophobicContact CB-CD2 4.28Å; A130-F134 HydrophobicContact CB-CE2 4.3Å; A130-F134 WeakPolarHBondContact O-CD2 3.45Å; A130-F134 PolarHBondContact O-N 3.28Å; F134-D137 PolarHBondContact O-N 3.13Å; F134-F138 PolarHBondContact O-N 3.37Å
135A92.3Very high90.5Very high31 Ų3153.9 Ų53.926%0.25627%0.266SS..Hα-helixtrans-65-41.5175.400000112T131 I132 V133 F138 Y139T131-A135 WeakPolarHBondContact O-CB 3.36Å; T131-A135 PolarHBondContact O-N 3.31Å; I132-A135 WeakPolarHBondContact O-CB 3.24Å; I132-A135 PolarHBondContact O-N 3.48Å; V133-A135 PolarHBondContact O-N 2.96Å; A135-F138 HydrophobicContact CB-CD1 4.49Å; A135-F138 HydrophobicContact CB-CE1 4.47Å; A135-F138 WeakPolarHBondContact O-CD1 3.33Å; A135-F138 WeakPolarHBondContact O-CE1 3.48Å; A135-Y139 PolarHBondContact O-N 3.17Å
136L90.8Very high90.1Very high87 Ų8751.6 Ų51.646%0.45526%0.257SS..Hα-helixtrans-67.4-42174.9-66.9173.9000111.4L35 I132 V133 Y139 F140L35-L136 HydrophobicContact CD2-CB 4.36Å; I132-L136 HydrophobicContact CG2-CD1 4.45Å; I132-L136 WeakPolarHBondContact O-CG 3.42Å; I132-L136 PolarHBondContact O-N 3.48Å; V133-L136 WeakPolarHBondContact O-CB 3.48Å; V133-L136 PolarHBondContact O-N 3.22Å; V133-L136 VanDerWaalsContact O-N 3.13Å; L136-Y139 WeakPolarHBondContact O-CB 3.37Å; L136-Y139 PolarHBondContact O-N 2.81Å; L136-F140 VanDerWaalsContact O-CD2 3.24Å; L136-F140 WeakPolarHBondContact O-CD2 3.12Å; L136-F140 PolarHBondContact O-N 2.95Å
137D88.7Confident89.7Confident8 Ų851.7 Ų51.74%0.04326%0.261CS..Hα-helixtrans-63.5-45.5-179.7-164.456000111.9L35 E39 C97 V133 F134 Y139 F140 I141L35-D137 WeakPolarHBondContact CB-OD1 3.32Å; L35-D137 HydrophobicContact CD2-CB 4.41Å; E39-D137 WeakPolarHBondContact OE1-CB 3.48Å; E39-D137 VanDerWaalsContact OE1-CG 3.26Å; C97-D137 PolarHBondContact SG-OD2 2.94Å; V133-D137 PolarHBondContact O-N 3.47Å; F134-D137 PolarHBondContact O-N 3.13Å; D137-Y139 VanDerWaalsContact C-N 3.29Å; D137-Y139 PolarHBondContact O-N 3.26Å; D137-F140 PolarHBondContact O-N 3.37Å; D137-I141 WeakPolarHBondContact O-CG1 3.33Å; D137-I141 PolarHBondContact O-N 3.38Å; D137-I141 WeakPolarHBondContact OD2-CD1 3.24Å
138F88.7Confident89.2Confident68 Ų6857.3 Ų57.330%0.29829%0.285SS..Hα-helixtrans-59.9-40.5173.3107.1-109.5000111.4F94 C97 V98 F134 A135 F140 I141 F142F94-F138 HydrophobicContact CD2-CB 4.33Å; F94-F138 HydrophobicContact CD2-CD2 4.08Å; F94-F138 AromaticContact CE2-CD2 3.53Å; F94-F138 HydrophobicContact CE2-CD2 3.53Å; F94-F138 HydrophobicContact CE2-CE2 4.23Å; F94-F138 HydrophobicContact CE2-CG 4.4Å; F94-F138 HydrophobicContact CZ-CD2 4.47Å; C97-F138 HydrophobicContact CB-CB 4Å; V98-F138 HydrophobicContact CG2-CB 3.94Å; V98-F138 HydrophobicContact CG2-CD1 4.36Å; V98-F138 HydrophobicContact CG2-CD2 4.15Å; V98-F138 HydrophobicContact CG2-CG 3.89Å; F134-F138 PolarHBondContact O-N 3.37Å; A135-F138 HydrophobicContact CB-CD1 4.49Å; A135-F138 HydrophobicContact CB-CE1 4.47Å; A135-F138 WeakPolarHBondContact O-CD1 3.33Å; A135-F138 WeakPolarHBondContact O-CE1 3.48Å; F138-F140 VanDerWaalsContact C-N 3.31Å; F138-F140 PolarHBondContact O-N 3.28Å; F138-I141 PolarHBondContact O-N 2.85Å; F138-F142 HydrophobicContact CD2-CB 4.34Å; F138-F142 VanDerWaalsContact O-CB 3.24Å; F138-F142 WeakPolarHBondContact O-CB 3.36Å; F138-F142 PolarHBondContact O-N 2.88Å
139Y89.9Confident88.6Confident135 Ų13558.4 Ų58.453%0.52929%0.294SS..Hα-helixtrans-61.1-41.7179.6174-97.6000111.4A135 L136 D137 N143A135-Y139 PolarHBondContact O-N 3.17Å; L136-Y139 WeakPolarHBondContact O-CB 3.37Å; L136-Y139 PolarHBondContact O-N 2.81Å; D137-Y139 VanDerWaalsContact C-N 3.29Å; D137-Y139 PolarHBondContact O-N 3.26Å; Y139-N143 WeakPolarHBondContact O-CB 3.28Å; Y139-N143 PolarHBondContact O-N 3.21Å
140F86.8Confident88.1Confident65 Ų6563 Ų6329%0.28531%0.312SS..Hα-helixtrans-64.7-46.8174.8-84.7-72.9000112.1L35 L136 D137 F138 F142 N143 D144L35-F140 HydrophobicContact CD1-CD2 3.69Å; L35-F140 HydrophobicContact CD1-CE2 4.17Å; L35-F140 HydrophobicContact CD1-CG 4.35Å; L136-F140 VanDerWaalsContact O-CD2 3.24Å; L136-F140 WeakPolarHBondContact O-CD2 3.12Å; L136-F140 PolarHBondContact O-N 2.95Å; D137-F140 PolarHBondContact O-N 3.37Å; F138-F140 VanDerWaalsContact C-N 3.31Å; F138-F140 PolarHBondContact O-N 3.28Å; F140-F142 VanDerWaalsContact C-N 3.32Å; F140-F142 PolarHBondContact O-N 2.93Å; F140-N143 PolarHBondContact O-N 3.12Å; F140-D144 WeakPolarHBondContact O-CB 2.9Å; F140-D144 PolarHBondContact O-N 3.42Å
141I86.9Confident87.4Confident19 Ų1969.5 Ų69.510%0.09734%0.342CS..Hα-helixtrans-61.6-42.4178-64.3165.7000110.7P90 D93 F94 D137 F138 D144 L145P90-I141 WeakPolarHBondContact O-CG2 3.29Å; D93-I141 HydrophobicContact CB-CD1 4.23Å; F94-I141 HydrophobicContact CB-CG2 3.79Å; D137-I141 WeakPolarHBondContact O-CG1 3.33Å; D137-I141 PolarHBondContact O-N 3.38Å; D137-I141 WeakPolarHBondContact OD2-CD1 3.24Å; F138-I141 PolarHBondContact O-N 2.85Å; I141-D144 PolarHBondContact O-N 3.32Å; I141-L145 WeakPolarHBondContact O-CB 3.37Å; I141-L145 PolarHBondContact O-N 2.66Å
142F87.8Confident85.9Confident104 Ų10471.5 Ų71.546%0.45637%0.366SS..Hα-helixtrans-63.1-44.8177.5178.6-97.6000111.9F94 F138 F140 D144 L145 A146F94-F142 HydrophobicContact CD2-CB 4.3Å; F94-F142 HydrophobicContact CE2-CB 4.04Å; F94-F142 HydrophobicContact CE2-CD2 4.07Å; F94-F142 HydrophobicContact CE2-CG 4.48Å; F138-F142 HydrophobicContact CD2-CB 4.34Å; F138-F142 VanDerWaalsContact O-CB 3.24Å; F138-F142 WeakPolarHBondContact O-CB 3.36Å; F138-F142 PolarHBondContact O-N 2.88Å; F140-F142 VanDerWaalsContact C-N 3.32Å; F140-F142 PolarHBondContact O-N 2.93Å; F142-D144 VanDerWaalsContact C-N 3.31Å; F142-D144 PolarHBondContact O-N 3.12Å; F142-L145 PolarHBondContact O-N 3.34Å; F142-A146 VanDerWaalsContact O-CB 3.27Å; F142-A146 WeakPolarHBondContact O-CB 3.5Å; F142-A146 PolarHBondContact O-N 3.27Å
143N87.6Confident84.1Confident73 Ų7370.1 Ų70.139%0.3937%0.373SS..Hα-helixtrans-63.9-38.8177.9-173.762.1000111.7Y139 F140 N147Y139-N143 WeakPolarHBondContact O-CB 3.28Å; Y139-N143 PolarHBondContact O-N 3.21Å; F140-N143 PolarHBondContact O-N 3.12Å; N143-N147 WeakPolarHBondContact O-CB 3.44Å; N143-N147 PolarHBondContact O-N 3.09Å; N143-N147 PolarHBondContact O-ND2 2.96Å
144D84.7Confident82.4Confident54 Ų5475.9 Ų75.929%0.28940%0.403SS..Hα-helixtrans-63.2-49.4174.7-153.731.9000110.7K32 F140 I141 F142 A146 N147 F148K32-D144 IonicContact NZ-OD2 2.67Å; K32-D144 PolarHBondContact NZ-OD2 3.06Å; F140-D144 WeakPolarHBondContact O-CB 2.9Å; F140-D144 PolarHBondContact O-N 3.42Å; I141-D144 PolarHBondContact O-N 3.32Å; F142-D144 VanDerWaalsContact C-N 3.31Å; F142-D144 PolarHBondContact O-N 3.12Å; D144-A146 PolarHBondContact O-N 2.99Å; D144-N147 WeakPolarHBondContact O-CB 3.29Å; D144-N147 PolarHBondContact O-N 3.4Å; D144-F148 HydrophobicContact CB-CE2 4.36Å; D144-F148 VanDerWaalsContact CG-CE2 3.48Å; D144-F148 WeakPolarHBondContact O-CD2 3.45Å; D144-F148 PolarHBondContact O-N 2.98Å
145L83.9Confident80.4Confident37 Ų3781.3 Ų81.319%0.19444%0.44CS..Hα-helixtrans-59.2-45.2176.2179.771.2000112.6L91 I141 F142 N147 F148 L149L91-L145 HydrophobicContact CD2-CD1 3.95Å; L91-L145 HydrophobicContact CD2-CD2 3.35Å; L91-L145 HydrophobicContact CD2-CG 4.29Å; I141-L145 WeakPolarHBondContact O-CB 3.37Å; I141-L145 PolarHBondContact O-N 2.66Å; F142-L145 PolarHBondContact O-N 3.34Å; L145-N147 VanDerWaalsContact C-N 3.28Å; L145-N147 PolarHBondContact O-N 2.87Å; L145-F148 PolarHBondContact O-N 3.01Å; L145-L149 HydrophobicContact CD1-CG 4.47Å; L145-L149 HydrophobicContact CG-CD1 4.1Å; L145-L149 HydrophobicContact CG-CG 4.43Å; L145-L149 WeakPolarHBondContact O-CG 3.13Å; L145-L149 PolarHBondContact O-N 3.29Å
146A86.5Confident78.5Confident36 Ų3682.5 Ų82.530%0.29846%0.456SS..Hα-helixtrans-60.9-39.6178.100000111.3F142 D144 K150F142-A146 VanDerWaalsContact O-CB 3.27Å; F142-A146 WeakPolarHBondContact O-CB 3.5Å; F142-A146 PolarHBondContact O-N 3.27Å; D144-A146 PolarHBondContact O-N 2.99Å; A146-K150 WeakPolarHBondContact O-CB 3.27Å; A146-K150 PolarHBondContact O-N 2.98Å
147N84.9Confident76.5Confident75 Ų7585.6 Ų85.640%0.40147%0.473SS..Hα-helixtrans-66.4-40.6174.4-70.7-31000112.2N143 D144 L145 K150 Q151N143-N147 WeakPolarHBondContact O-CB 3.44Å; N143-N147 PolarHBondContact O-N 3.09Å; N143-N147 PolarHBondContact O-ND2 2.96Å; D144-N147 WeakPolarHBondContact O-CB 3.29Å; D144-N147 PolarHBondContact O-N 3.4Å; L145-N147 VanDerWaalsContact C-N 3.28Å; L145-N147 PolarHBondContact O-N 2.87Å; N147-K150 PolarHBondContact O-N 3.31Å; N147-Q151 PolarHBondContact O-N 2.59Å
148F81.6Confident74.4Confident118 Ų11892.8 Ų92.852%0.51851%0.511SS..Hα-helixtrans-63.4-44.5174.6-73.5-61.7000112.5D144 L145 K150 Q151 G152D144-F148 HydrophobicContact CB-CE2 4.36Å; D144-F148 VanDerWaalsContact CG-CE2 3.48Å; D144-F148 WeakPolarHBondContact O-CD2 3.45Å; D144-F148 PolarHBondContact O-N 2.98Å; L145-F148 PolarHBondContact O-N 3.01Å; F148-K150 VanDerWaalsContact C-N 3.27Å; F148-K150 PolarHBondContact O-N 2.98Å; F148-Q151 PolarHBondContact O-N 3.28Å; F148-G152 PolarHBondContact O-N 2.64Å
149L81.8Confident72.5Confident120 Ų12094.3 Ų94.363%0.62853%0.528SS*.Hα-helixtrans-62.3-38.1176.4-69.9172.6000111.3L145 G152 G153L145-L149 HydrophobicContact CD1-CG 4.47Å; L145-L149 HydrophobicContact CG-CD1 4.1Å; L145-L149 HydrophobicContact CG-CG 4.43Å; L145-L149 WeakPolarHBondContact O-CG 3.13Å; L145-L149 PolarHBondContact O-N 3.29Å; L149-G152 PolarHBondContact O-N 3.26Å; L149-G153 PolarHBondContact O-N 3.35Å; L149-G153 VanDerWaalsContact O-N 3.16Å
150K83.8Confident70.2Confident169 Ų16993.8 Ų93.874%0.73554%0.541SS*.Hα-helixtrans-65.9-38.1176.1-168.4176.1178.9-176.40112.7A146 N147 F148A146-K150 WeakPolarHBondContact O-CB 3.27Å; A146-K150 PolarHBondContact O-N 2.98Å; N147-K150 PolarHBondContact O-N 3.31Å; F148-K150 VanDerWaalsContact C-N 3.27Å; F148-K150 PolarHBondContact O-N 2.98Å
151Q77.2Confident68.1Low136 Ų136102 Ų10264%0.63657%0.57SS**Hα-helixtrans-74.3-36.8175.5-76.1177.18.200112.8N147 F148 G153 D154N147-Q151 PolarHBondContact O-N 2.59Å; F148-Q151 PolarHBondContact O-N 3.28Å; Q151-G153 PolarHBondContact O-N 3.17Å; Q151-D154 PolarHBondContact O-N 3.49Å
152G63.2Low66.3Low58 Ų58107 Ų10760%0.59860%0.602SS**Hα-helixtrans-67.2-22.7176.500000113.9F148 L149F148-G152 PolarHBondContact O-N 2.64Å; L149-G152 PolarHBondContact O-N 3.26Å
153G56.8Low64.1Low56 Ų56107 Ų10758%0.57762%0.615SS**THydrogen-bonded Turntrans-81.2-16173.900000115.2L149 Q151L149-G153 PolarHBondContact O-N 3.35Å; L149-G153 VanDerWaalsContact O-N 3.16Å; Q151-G153 PolarHBondContact O-N 3.17Å
154D55Low62.1Low145 Ų145111 Ų11178%0.77563%0.631SS**THydrogen-bonded Turntrans-93.6-10-177.9-157.553.4000112.6Q151 G156Q151-D154 PolarHBondContact O-N 3.49Å; D154-G156 VanDerWaalsContact C-N 3.32Å
155S50.3Low60.3Low113 Ų113117.8 Ų117.879%0.7965%0.654SS**SBendtrans-9213.2178.3-51.50000113.5
156G51.8Low58.3Low56 Ų56122.8 Ų122.858%0.57768%0.681SS**SBendtrans-110.6-12.5-168.700000117.2D154D154-G156 VanDerWaalsContact C-N 3.32Å
157D47.6Very low56.6Low152 Ų152127 Ų12781%0.81370%0.699SS**  trans-128.763.7-172.7-72.5-36000112.4
158D45.7Very low55Low159 Ų159128.4 Ų128.485%0.8571%0.714SS**  trans-94.6108.6148-93.4-39.2000107.3
159P47.9Very low53.7Low100 Ų100129.9 Ų129.965%0.64973%0.728SS**  trans-61.7142.9170.524.9-30.6000108.8R161P159-R161 PolarHBondContact O-N 2.96Å
160P43.3Very low52.6Low125 Ų125129.9 Ų129.981%0.81274%0.738SS**  trans-60112.6171.4-4.215.6000107T162P160-T162 PolarHBondContact O-N 3.03Å
161R41.5Very low51.6Low237 Ų237129.3 Ų129.389%0.89474%0.743SS**  trans-52.2115.1165.4-85.7-177.9145.2112.9-3.3106.9P159 S163P159-R161 PolarHBondContact O-N 2.96Å; R161-S163 PolarHBondContact O-N 3.02Å
162T49.1Very low50.6Low123 Ų123128.1 Ų128.176%0.75575%0.749SS**  trans-49.3101.4165.621.10000109.3P160P160-T162 PolarHBondContact O-N 3.03Å
163S43Very low49.8Very low104 Ų104136.7 Ų136.773%0.72778%0.782SS**  trans-95.382.4146.157.80000105.8R161 Y165R161-S163 PolarHBondContact O-N 3.02Å; S163-Y165 PolarHBondContact O-N 3.3Å; S163-Y165 VanDerWaalsContact O-N 3.13Å
164E44.8Very low49.4Very low159 Ų159140.8 Ų140.874%0.74379%0.792SS**  trans-51116.9162.8-98.6169.695.100108N166E164-N166 PolarHBondContact O-N 3.03Å
165Y47.2Very low49.1Very low196 Ų196140.5 Ų140.577%0.76979%0.793SS**  trans-51.2117.8153.5-91.5-103000107.9S163S163-Y165 PolarHBondContact O-N 3.3Å; S163-Y165 VanDerWaalsContact O-N 3.13Å
166N40.8Very low49Very low141 Ų141142.1 Ų142.175%0.75479%0.793SS**  trans-125.487.7148.7-106.7-14.3000106.8E164 S168E164-N166 PolarHBondContact O-N 3.03Å; N166-S168 PolarHBondContact O-N 3.39Å
167D51.2Low48.9Very low125 Ų125147.1 Ų147.167%0.66881%0.805SS**  trans-55.1123.1149.2-73.1-51.4000107.4
168S51.9Low49Very low104 Ų104146.8 Ų146.873%0.72781%0.805SS**  trans-138.289.5162.4-74.40000106.6N166 S170N166-S168 PolarHBondContact O-N 3.39Å; S168-S170 PolarHBondContact O-N 3.49Å
169D54.7Low49.2Very low150 Ų150146 Ų14680%0.80280%0.802SS**  trans-48.8128.6159-67.1-44.5000109.3
170S58Low49.3Very low120 Ų120149.3 Ų149.384%0.83981%0.813SS**  trans-151.188.6157.7-82.90000108.5S168S168-S170 PolarHBondContact O-N 3.49Å
171D62.1Low49.7Very low157 Ų157151.2 Ų151.284%0.8481%0.813SS**  trans-57.3135.9149.7-72.7-41.4000109.2
172S57Low50.4Low111 Ų111144 Ų14478%0.77681%0.806SS**  trans176.8117.3139-92.50000111.3
173D45.3Very low50.5Low238 Ų238145.9 Ų145.9100%1.27381%0.811SS**  trans60.90152.6-55.2-20000122.1

Retrieved 173 of 173 residues in 329 ms (Link to these results)