A0A077ZQR5_TRITR Loading...

SSF domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZQR5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 166 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
1M43.6Very low50.4Low245 Ų245145 Ų145100%1.20773%0.73SS**  085.10-62.5177.3-164.900107.1N3M1-N3 PolarHBondContact O-N 3.35Å
2V47.9Very low51.7Low143 Ų143144.9 Ų144.987%0.86772%0.722SS**  trans-70.7125.9177.3175.90000106.8S4V2-S4 PolarHBondContact O-N 3.47Å
3N45.9Very low53.7Low95 Ų95144.2 Ų144.251%0.50872%0.715SS.*  trans-60.499.9-163.9-166.18.3000111.2M1 Q5 Q6M1-N3 PolarHBondContact O-N 3.35Å; N3-Q5 PolarHBondContact O-N 3.44Å; N3-Q5 VanDerWaalsContact OD1-CB 3.24Å; N3-Q5 WeakPolarHBondContact OD1-CB 3.01Å; N3-Q5 VanDerWaalsContact OD1-CG 3.27Å; N3-Q5 WeakPolarHBondContact OD1-CG 3.41Å; N3-Q5 PolarHBondContact OD1-N 3.26Å; N3-Q6 PolarHBondContact O-N 3.35Å
4S54Low55.8Low83 Ų83145.1 Ų145.158%0.5872%0.722SS**THydrogen-bonded Turntrans-60.2-9.4174.354.30000113V2V2-S4 PolarHBondContact O-N 3.47Å
5Q47.5Very low57.7Low128 Ų128138.8 Ų138.860%0.59870%0.701SS**THydrogen-bonded Turntrans-75.1-18.8176.2-57.5-66.5-58.300113.9N3 F7N3-Q5 PolarHBondContact O-N 3.44Å; N3-Q5 VanDerWaalsContact OD1-CB 3.24Å; N3-Q5 WeakPolarHBondContact OD1-CB 3.01Å; N3-Q5 VanDerWaalsContact OD1-CG 3.27Å; N3-Q5 WeakPolarHBondContact OD1-CG 3.41Å; N3-Q5 PolarHBondContact OD1-N 3.26Å; Q5-F7 VanDerWaalsContact C-N 3.34Å
6Q47.6Very low59.6Low165 Ų165134.8 Ų134.877%0.77168%0.682SS**THydrogen-bonded Turntrans-75.4-22.2179-74.9-147.9-4300113.7N3N3-Q6 PolarHBondContact O-N 3.35Å
7F50.7Low61.3Low175 Ų175135.1 Ų135.177%0.76867%0.674SS**THydrogen-bonded Turntrans-91.2-6-179.1-70.4-74.5000114.3Q5Q5-F7 VanDerWaalsContact C-N 3.34Å
8V51.6Low62.9Low108 Ų108130.1 Ų130.166%0.65566%0.657SS**THydrogen-bonded Turntrans-107.3-8.9-169.1-175.70000114.1K10V8-K10 PolarHBondContact O-N 3.12Å
9K49.4Very low64.3Low162 Ų162129.2 Ų129.270%0.70465%0.654SS**  trans-100.666169.4-69.7-167.5177.3-168.30111.8D11K9-D11 WeakPolarHBondContact CD-OD2 3.38Å; K9-D11 WeakPolarHBondContact CG-OD2 3.41Å; K9-D11 PolarHBondContact O-N 3.5Å
10K56.2Low65.6Low183 Ų183128.9 Ų128.980%0.79665%0.648SS**  trans-85.959146.9-91.1-176.2169.9169.70107.3V8 F12V8-K10 PolarHBondContact O-N 3.12Å; K10-F12 PolarHBondContact O-N 2.7Å
11D60.6Low67Low108 Ų108126.2 Ų126.258%0.57864%0.638SS**  trans-63.1128.8165.5-67.5-37.5000105.4K9 E13K9-D11 WeakPolarHBondContact CD-OD2 3.38Å; K9-D11 WeakPolarHBondContact CG-OD2 3.41Å; K9-D11 PolarHBondContact O-N 3.5Å; D11-E13 PolarHBondContact O-N 3.39Å
12F65.9Low69.4Low144 Ų144119.2 Ų119.263%0.63260%0.604SS**  trans-40.5118.9178.2-79.7-92.5000109.9K10 D16 Y17K10-F12 PolarHBondContact O-N 2.7Å; F12-D16 HydrophobicContact CB-CB 4.33Å; F12-D16 HydrophobicContact CD1-CB 3.75Å; F12-Y17 HydrophobicContact CB-CD2 4.06Å; F12-Y17 HydrophobicContact CB-CE2 3.37Å; F12-Y17 HydrophobicContact CG-CE2 4.4Å
13E77Confident71.5Confident136 Ų136115.3 Ų115.364%0.63658%0.583SS**  trans-67.6156.5-178.1-68-176.6178.600108.3D11 A15 D16 Y17D11-E13 PolarHBondContact O-N 3.39Å; E13-A15 HydrophobicContact CB-CB 4.32Å; E13-A15 PolarHBondContact O-N 2.94Å; E13-D16 PolarHBondContact N-OD2 2.94Å; E13-D16 PolarHBondContact O-N 3.32Å; E13-Y17 PolarHBondContact O-N 2.9Å
14I82.9Confident73.8Confident157 Ų157114.8 Ų114.881%0.80558%0.58SS**Hα-helixtrans-51.8-30.6173-64.3166.4000110.4A18I14-A18 WeakPolarHBondContact O-CB 3.22Å; I14-A18 PolarHBondContact O-N 3.26Å
15A85.5Confident75.8Confident50 Ų50115.7 Ų115.741%0.41358%0.577SS.*Hα-helixtrans-61.9-43.6173.500000113.8E13 Y17 A18 I19E13-A15 HydrophobicContact CB-CB 4.32Å; E13-A15 PolarHBondContact O-N 2.94Å; A15-Y17 PolarHBondContact O-N 3.4Å; A15-A18 PolarHBondContact O-N 3.26Å; A15-I19 VanDerWaalsContact O-CG1 3.28Å; A15-I19 WeakPolarHBondContact O-CG1 3.35Å; A15-I19 PolarHBondContact O-N 3.05Å
16D87.3Confident78Confident74 Ų74114.4 Ų114.440%0.39657%0.574SS.*Hα-helixtrans-63.2-44.8-179.2-66.8-66.8000111.3F12 E13 I19 F20F12-D16 HydrophobicContact CB-CB 4.33Å; F12-D16 HydrophobicContact CD1-CB 3.75Å; E13-D16 PolarHBondContact N-OD2 2.94Å; E13-D16 PolarHBondContact O-N 3.32Å; D16-I19 PolarHBondContact O-N 3.36Å; D16-F20 WeakPolarHBondContact O-CB 3.47Å; D16-F20 PolarHBondContact O-N 3Å
17Y88.5Confident80.1Confident140 Ų140110.1 Ų110.155%0.54956%0.56SS.*Hα-helixtrans-63.7-41.2175.2-70.2-72.5000111.8F12 E13 A15 F20 V21F12-Y17 HydrophobicContact CB-CD2 4.06Å; F12-Y17 HydrophobicContact CB-CE2 3.37Å; F12-Y17 HydrophobicContact CG-CE2 4.4Å; E13-Y17 PolarHBondContact O-N 2.9Å; A15-Y17 PolarHBondContact O-N 3.4Å; Y17-F20 PolarHBondContact O-N 3.22Å; Y17-V21 WeakPolarHBondContact O-CB 3.23Å; Y17-V21 VanDerWaalsContact O-CG2 3.29Å; Y17-V21 WeakPolarHBondContact O-CG2 3.44Å; Y17-V21 PolarHBondContact O-N 3.49Å
18A90Very high82.2Confident45 Ų45106.1 Ų106.137%0.37255%0.55SS.*Hα-helixtrans-62.3-47177.500000111.6I14 A15 F20 V21 I22I14-A18 WeakPolarHBondContact O-CB 3.22Å; I14-A18 PolarHBondContact O-N 3.26Å; A15-A18 PolarHBondContact O-N 3.26Å; A18-F20 VanDerWaalsContact C-N 3.33Å; A18-F20 PolarHBondContact O-N 2.88Å; A18-V21 PolarHBondContact O-N 3.19Å; A18-I22 WeakPolarHBondContact O-CB 3.47Å; A18-I22 WeakPolarHBondContact O-CD1 3.42Å; A18-I22 VanDerWaalsContact O-CG1 3.22Å; A18-I22 WeakPolarHBondContact O-CG1 3.18Å; A18-I22 PolarHBondContact O-N 2.87Å
19I90.7Very high84.1Confident114 Ų114103.6 Ų103.659%0.58554%0.54SS*.Hα-helixtrans-60.7-45.1176.9-68164.9000110.2A15 D16 I22 S23A15-I19 VanDerWaalsContact O-CG1 3.28Å; A15-I19 WeakPolarHBondContact O-CG1 3.35Å; A15-I19 PolarHBondContact O-N 3.05Å; D16-I19 PolarHBondContact O-N 3.36Å; I19-I22 PolarHBondContact O-N 3.21Å; I19-S23 VanDerWaalsContact O-CB 3.24Å; I19-S23 WeakPolarHBondContact O-CB 3.42Å; I19-S23 PolarHBondContact O-N 3.41Å; I19-S23 PolarHBondContact O-OG 3.41Å
20F89.6Confident86Confident122 Ų12299.4 Ų99.454%0.53553%0.528SS..Hα-helixtrans-58.6-51.1177.9179.5-108.4000111.7D16 Y17 A18 I22 S23 L24D16-F20 WeakPolarHBondContact O-CB 3.47Å; D16-F20 PolarHBondContact O-N 3Å; Y17-F20 PolarHBondContact O-N 3.22Å; A18-F20 VanDerWaalsContact C-N 3.33Å; A18-F20 PolarHBondContact O-N 2.88Å; F20-I22 PolarHBondContact O-N 3.09Å; F20-S23 PolarHBondContact O-N 3.29Å; F20-S23 PolarHBondContact O-OG 2.89Å; F20-L24 HydrophobicContact CD1-CD1 4.13Å; F20-L24 HydrophobicContact CE1-CD1 3.57Å; F20-L24 HydrophobicContact CE2-CD1 4.1Å; F20-L24 HydrophobicContact CE2-CG 4.48Å; F20-L24 HydrophobicContact CZ-CD1 3.56Å; F20-L24 HydrophobicContact CZ-CG 4.41Å; F20-L24 WeakPolarHBondContact O-CG 3.42Å; F20-L24 PolarHBondContact O-N 2.98Å; F20-L24 VanDerWaalsContact O-N 3.12Å
21V94.4Very high87.5Confident73 Ų7392.8 Ų92.844%0.44251%0.512SS..Hα-helixtrans-61.3-46.2179.31710000111.3Y17 A18 S23 L24 I25Y17-V21 WeakPolarHBondContact O-CB 3.23Å; Y17-V21 VanDerWaalsContact O-CG2 3.29Å; Y17-V21 WeakPolarHBondContact O-CG2 3.44Å; Y17-V21 PolarHBondContact O-N 3.49Å; A18-V21 PolarHBondContact O-N 3.19Å; V21-S23 VanDerWaalsContact C-N 3.34Å; V21-S23 PolarHBondContact O-N 2.91Å; V21-L24 PolarHBondContact O-N 3.36Å; V21-I25 HydrophobicContact CG1-CD1 3.61Å; V21-I25 HydrophobicContact CG1-CG1 4.29Å; V21-I25 VanDerWaalsContact O-CG1 3.31Å; V21-I25 WeakPolarHBondContact O-CG1 3.43Å; V21-I25 PolarHBondContact O-N 3.48Å
22I94.3Very high88.9Confident98 Ų9891.2 Ų91.250%0.50351%0.506SS..Hα-helixtrans-61.2-44.4177.8-68.7166.8000110.8A18 I19 F20 L24 I25 I26A18-I22 WeakPolarHBondContact O-CB 3.47Å; A18-I22 WeakPolarHBondContact O-CD1 3.42Å; A18-I22 VanDerWaalsContact O-CG1 3.22Å; A18-I22 WeakPolarHBondContact O-CG1 3.18Å; A18-I22 PolarHBondContact O-N 2.87Å; I19-I22 PolarHBondContact O-N 3.21Å; F20-I22 PolarHBondContact O-N 3.09Å; I22-L24 PolarHBondContact O-N 3.1Å; I22-I25 PolarHBondContact O-N 3.49Å; I22-I26 HydrophobicContact CG2-CD1 3.87Å; I22-I26 HydrophobicContact CG2-CG1 4.46Å; I22-I26 WeakPolarHBondContact O-CG1 3.33Å; I22-I26 PolarHBondContact O-N 3.47Å; I22-I26 VanDerWaalsContact O-N 3.14Å
23S91.9Very high89.9Confident61 Ų6191.6 Ų91.643%0.42750%0.504SS..Hα-helixtrans-63.7-24.8-179.876.40000113.5I19 F20 V21 P27I19-S23 VanDerWaalsContact O-CB 3.24Å; I19-S23 WeakPolarHBondContact O-CB 3.42Å; I19-S23 PolarHBondContact O-N 3.41Å; I19-S23 PolarHBondContact O-OG 3.41Å; F20-S23 PolarHBondContact O-N 3.29Å; F20-S23 PolarHBondContact O-OG 2.89Å; V21-S23 VanDerWaalsContact C-N 3.34Å; V21-S23 PolarHBondContact O-N 2.91Å; S23-P27 WeakPolarHBondContact O-CD 3.36Å; S23-P27 VanDerWaalsContact O-CG 3.24Å; S23-P27 WeakPolarHBondContact O-CG 3.41Å
24L93.8Very high90.1Very high85 Ų8592.5 Ų92.545%0.44550%0.503SS..Hα-helixtrans-85.4-39.6173.4-70.2178.2000112.5F20 V21 I22 I26 P27 V28F20-L24 HydrophobicContact CD1-CD1 4.13Å; F20-L24 HydrophobicContact CE1-CD1 3.57Å; F20-L24 HydrophobicContact CE2-CD1 4.1Å; F20-L24 HydrophobicContact CE2-CG 4.48Å; F20-L24 HydrophobicContact CZ-CD1 3.56Å; F20-L24 HydrophobicContact CZ-CG 4.41Å; F20-L24 WeakPolarHBondContact O-CG 3.42Å; F20-L24 PolarHBondContact O-N 2.98Å; F20-L24 VanDerWaalsContact O-N 3.12Å; V21-L24 PolarHBondContact O-N 3.36Å; I22-L24 PolarHBondContact O-N 3.1Å; L24-I26 VanDerWaalsContact C-N 3.33Å; L24-I26 PolarHBondContact O-N 2.63Å; L24-P27 VanDerWaalsContact O-CD 3.27Å; L24-P27 WeakPolarHBondContact O-CD 3.33Å; L24-P27 WeakPolarHBondContact O-CG 3.48Å; L24-V28 WeakPolarHBondContact O-CB 3.49Å; L24-V28 WeakPolarHBondContact O-CG2 3.26Å; L24-V28 PolarHBondContact O-N 2.82Å
25I96Very high89.9Confident101 Ų10188 Ų8852%0.51850%0.495SS..Hα-helixtrans-62.2-41.7-179.1-72.8171.4000110.8V21 I22 V28 A29V21-I25 HydrophobicContact CG1-CD1 3.61Å; V21-I25 HydrophobicContact CG1-CG1 4.29Å; V21-I25 VanDerWaalsContact O-CG1 3.31Å; V21-I25 WeakPolarHBondContact O-CG1 3.43Å; V21-I25 PolarHBondContact O-N 3.48Å; I22-I25 PolarHBondContact O-N 3.49Å; I25-V28 PolarHBondContact O-N 3.28Å; I25-A29 WeakPolarHBondContact O-CB 3.3Å; I25-A29 PolarHBondContact O-N 3.05Å
26I94.2Very high89.7Confident101 Ų10194.3 Ų94.352%0.51851%0.514SS..Hα-helixtrans-57.2-58.5-178.3-65.6165.9000112.6I22 L24 V28 A29 V30I22-I26 HydrophobicContact CG2-CD1 3.87Å; I22-I26 HydrophobicContact CG2-CG1 4.46Å; I22-I26 WeakPolarHBondContact O-CG1 3.33Å; I22-I26 PolarHBondContact O-N 3.47Å; I22-I26 VanDerWaalsContact O-N 3.14Å; L24-I26 VanDerWaalsContact C-N 3.33Å; L24-I26 PolarHBondContact O-N 2.63Å; I26-V28 VanDerWaalsContact C-N 3.32Å; I26-V28 PolarHBondContact O-N 3.43Å; I26-A29 PolarHBondContact O-N 3.41Å; I26-V30 VanDerWaalsContact O-CG2 3.32Å; I26-V30 WeakPolarHBondContact O-CG2 3.35Å; I26-V30 PolarHBondContact O-N 3.44Å
27P91.9Very high88.9Confident76 Ų7694 Ų9449%0.49452%0.521SS..Hα-helixtrans-66.4-32.6-179.625.6-34.5000112.5S23 L24 V30 G31S23-P27 WeakPolarHBondContact O-CD 3.36Å; S23-P27 VanDerWaalsContact O-CG 3.24Å; S23-P27 WeakPolarHBondContact O-CG 3.41Å; L24-P27 VanDerWaalsContact O-CD 3.27Å; L24-P27 WeakPolarHBondContact O-CD 3.33Å; L24-P27 WeakPolarHBondContact O-CG 3.48Å; P27-V30 PolarHBondContact O-N 2.89Å; P27-G31 PolarHBondContact O-N 3.28Å
28V94Very high87.6Confident91 Ų9188.9 Ų88.955%0.55251%0.511SS*.Hα-helixtrans-65.1-46.9174.3171.50000110.5L24 I25 I26 V30 G31 V32L24-V28 WeakPolarHBondContact O-CB 3.49Å; L24-V28 WeakPolarHBondContact O-CG2 3.26Å; L24-V28 PolarHBondContact O-N 2.82Å; I25-V28 PolarHBondContact O-N 3.28Å; I26-V28 VanDerWaalsContact C-N 3.32Å; I26-V28 PolarHBondContact O-N 3.43Å; V28-V30 VanDerWaalsContact C-N 3.33Å; V28-V30 PolarHBondContact O-N 3.31Å; V28-G31 PolarHBondContact O-N 2.85Å; V28-V32 HydrophobicContact CG1-CG2 4.21Å; V28-V32 WeakPolarHBondContact O-CB 3.44Å; V28-V32 VanDerWaalsContact O-CG2 3.24Å; V28-V32 WeakPolarHBondContact O-CG2 2.96Å; V28-V32 PolarHBondContact O-N 3.23Å
29A92.8Very high86.3Confident54 Ų5494 Ų9445%0.44653%0.527SS..Hα-helixtrans-61.2-42.3177.600000111.5I25 I26 Y33I25-A29 WeakPolarHBondContact O-CB 3.3Å; I25-A29 PolarHBondContact O-N 3.05Å; I26-A29 PolarHBondContact O-N 3.41Å; A29-Y33 WeakPolarHBondContact O-CB 3.21Å; A29-Y33 PolarHBondContact O-N 3.31Å
30V88.6Confident85Confident74 Ų7498.8 Ų98.845%0.44854%0.544SS..Hα-helixtrans-63-45.8174.5172.90000111I26 P27 V28 Y33 Y34I26-V30 VanDerWaalsContact O-CG2 3.32Å; I26-V30 WeakPolarHBondContact O-CG2 3.35Å; I26-V30 PolarHBondContact O-N 3.44Å; P27-V30 PolarHBondContact O-N 2.89Å; V28-V30 VanDerWaalsContact C-N 3.33Å; V28-V30 PolarHBondContact O-N 3.31Å; V30-Y33 PolarHBondContact O-N 3.42Å; V30-Y34 HydrophobicContact CG1-CD2 3.7Å; V30-Y34 HydrophobicContact CG1-CE2 3.75Å; V30-Y34 VanDerWaalsContact O-CD2 3.24Å; V30-Y34 WeakPolarHBondContact O-CD2 3.43Å; V30-Y34 PolarHBondContact O-N 3.25Å
31G87.4Confident83.9Confident45 Ų4598.4 Ų98.446%0.46454%0.539SS..Hα-helixtrans-62.7-43.117800000113P27 V28 G35P27-G31 PolarHBondContact O-N 3.28Å; V28-G31 PolarHBondContact O-N 2.85Å; G31-G35 PolarHBondContact O-N 2.88Å
32V89.4Confident82.7Confident74 Ų7498.4 Ų98.445%0.44854%0.542SS..Hα-helixtrans-65.6-46.2175.3169.70000110.3V28 Y34 G35 F36V28-V32 HydrophobicContact CG1-CG2 4.21Å; V28-V32 WeakPolarHBondContact O-CB 3.44Å; V28-V32 VanDerWaalsContact O-CG2 3.24Å; V28-V32 WeakPolarHBondContact O-CG2 2.96Å; V28-V32 PolarHBondContact O-N 3.23Å; V32-Y34 PolarHBondContact O-N 3.32Å; V32-G35 PolarHBondContact O-N 3.36Å; V32-G35 VanDerWaalsContact O-N 3.14Å; V32-F36 HydrophobicContact CG1-CD2 3.65Å; V32-F36 HydrophobicContact CG1-CE2 3.89Å; V32-F36 WeakPolarHBondContact O-CD2 3.46Å; V32-F36 PolarHBondContact O-N 3.44Å
33Y87.6Confident81.6Confident152 Ų15298 Ų9860%0.59655%0.548SS*.Hα-helixtrans-57.2-50.2177.7179.3-97.1000111.5A29 V30 G35 A37A29-Y33 WeakPolarHBondContact O-CB 3.21Å; A29-Y33 PolarHBondContact O-N 3.31Å; V30-Y33 PolarHBondContact O-N 3.42Å; Y33-G35 VanDerWaalsContact C-N 3.32Å; Y33-G35 PolarHBondContact O-N 2.91Å; Y33-A37 HydrophobicContact CD2-CB 4.3Å; Y33-A37 HydrophobicContact CE2-CB 4.1Å; Y33-A37 WeakPolarHBondContact O-CA 3.49Å; Y33-A37 WeakPolarHBondContact O-CB 3.39Å; Y33-A37 PolarHBondContact O-N 3.21Å
34Y80.1Confident80.6Confident156 Ų156102.1 Ų102.161%0.61255%0.554SS**Hα-helixtrans-71.3-25.4177.3-76.2-67.3000113.6V30 V32 G38V30-Y34 HydrophobicContact CG1-CD2 3.7Å; V30-Y34 HydrophobicContact CG1-CE2 3.75Å; V30-Y34 VanDerWaalsContact O-CD2 3.24Å; V30-Y34 WeakPolarHBondContact O-CD2 3.43Å; V30-Y34 PolarHBondContact O-N 3.25Å; V32-Y34 PolarHBondContact O-N 3.32Å; Y34-G38 VanDerWaalsContact O-CA 3.29Å; Y34-G38 WeakPolarHBondContact O-CA 3.48Å; Y34-G38 PolarHBondContact O-N 3.34Å
35G80.1Confident79.7Confident62 Ų62101.6 Ų101.664%0.63955%0.549SS*.Hα-helixtrans-70.8-40.3174.700000113.6G31 V32 Y33G31-G35 PolarHBondContact O-N 2.88Å; V32-G35 PolarHBondContact O-N 3.36Å; V32-G35 VanDerWaalsContact O-N 3.14Å; Y33-G35 VanDerWaalsContact C-N 3.32Å; Y33-G35 PolarHBondContact O-N 2.91Å
36F81.3Confident78.6Confident183 Ų183102 Ų10280%0.80355%0.551SS**Hα-helixtrans-94.5-42.5-178.6-76.1-83.2000113.7V32V32-F36 HydrophobicContact CG1-CD2 3.65Å; V32-F36 HydrophobicContact CG1-CE2 3.89Å; V32-F36 WeakPolarHBondContact O-CD2 3.46Å; V32-F36 PolarHBondContact O-N 3.44Å
37A69.8Low77.5Confident67 Ų67103.1 Ų103.155%0.55456%0.558SS**Hα-helixtrans-89-11.9-177.800000112.9Y33 Q39Y33-A37 HydrophobicContact CD2-CB 4.3Å; Y33-A37 HydrophobicContact CE2-CB 4.1Å; Y33-A37 WeakPolarHBondContact O-CA 3.49Å; Y33-A37 WeakPolarHBondContact O-CB 3.39Å; Y33-A37 PolarHBondContact O-N 3.21Å; A37-Q39 PolarHBondContact O-N 3.16Å
38G61.4Low76.4Confident32 Ų32103.1 Ų103.133%0.3355%0.553SS.*SBendtrans-66.8128178.100000111.9Y34 K40Y34-G38 VanDerWaalsContact O-CA 3.29Å; Y34-G38 WeakPolarHBondContact O-CA 3.48Å; Y34-G38 PolarHBondContact O-N 3.34Å; G38-K40 PolarHBondContact O-N 3.37Å
39Q63.7Low75Confident152 Ų15299.7 Ų99.771%0.7154%0.536SS*.  trans-49137.2162.6-170.3173.6600108.7A37 R41A37-Q39 PolarHBondContact O-N 3.16Å; Q39-R41 PolarHBondContact O-N 3.28Å
40K62.9Low73.5Confident215 Ų21598.1 Ų98.194%0.93552%0.522SS*.  trans-60.373.2-180-62.8-177.4-177.2-177.60111.3G38G38-K40 PolarHBondContact O-N 3.37Å
41R65.5Low72.3Confident114 Ų114101.2 Ų101.243%0.4355%0.547SS..  trans-75.6142.3171.7-69.2-175.2-173.6133.44.9107.4Q39 S43 E45 I46Q39-R41 PolarHBondContact O-N 3.28Å; R41-S43 PolarHBondContact O-N 3.03Å; R41-E45 HydrophobicContact CB-CB 4.4Å; R41-I46 HydrophobicContact CB-CD1 4.04Å; R41-I46 HydrophobicContact CB-CG1 3.68Å
42S70.5Confident71.3Confident74 Ų74109.3 Ų109.352%0.51756%0.563SS.*  trans-57.1141.5171.1176.20000108.7R44 E45 I46S42-R44 PolarHBondContact O-N 3.3Å; S42-R44 PolarHBondContact OG-N 3.11Å; S42-E45 WeakPolarHBondContact O-CA 3.33Å; S42-E45 WeakPolarHBondContact O-CB 3.48Å; S42-E45 PolarHBondContact O-N 3.24Å; S42-I46 PolarHBondContact O-N 3.25Å; S42-I46 VanDerWaalsContact O-N 3.1Å
43S71.3Confident70.5Confident88 Ų88110.3 Ų110.362%0.61557%0.565SS**Hα-helixtrans-51.7-34.8176.1-47.40000111.4R41 E45 I46 L47R41-S43 PolarHBondContact O-N 3.03Å; S43-E45 PolarHBondContact O-N 3.31Å; S43-I46 PolarHBondContact O-N 2.91Å; S43-L47 WeakPolarHBondContact O-CB 3.46Å; S43-L47 WeakPolarHBondContact O-CG 3.39Å; S43-L47 PolarHBondContact O-N 3.43Å
44R70.4Confident70.2Confident148 Ų148105 Ų10556%0.55856%0.557SS**Hα-helixtrans-64.9-37175.8-168.1177.8-173.7-177.53.6113S42 L48S42-R44 PolarHBondContact O-N 3.3Å; S42-R44 PolarHBondContact OG-N 3.11Å; R44-L48 HydrophobicContact CG-CD1 3.65Å; R44-L48 HydrophobicContact CG-CG 4.12Å; R44-L48 VanDerWaalsContact O-CB 3.3Å; R44-L48 WeakPolarHBondContact O-CB 3.39Å; R44-L48 WeakPolarHBondContact O-CG 3.28Å; R44-L48 PolarHBondContact O-N 2.94Å
45E74.5Confident70.4Confident75 Ų75104.8 Ų104.835%0.3557%0.565SS.*Hα-helixtrans-71.4-34.9177.7-172.9-176.2-179.100111.8R41 S42 S43 G49 S50R41-E45 HydrophobicContact CB-CB 4.4Å; S42-E45 WeakPolarHBondContact O-CA 3.33Å; S42-E45 WeakPolarHBondContact O-CB 3.48Å; S42-E45 PolarHBondContact O-N 3.24Å; S43-E45 PolarHBondContact O-N 3.31Å; E45-G49 CarbonylContact O-C 3.25Å; E45-G49 VanDerWaalsContact O-C 3.25Å; E45-G49 WeakPolarHBondContact O-CA 3.36Å; E45-G49 PolarHBondContact O-N 2.93Å; E45-S50 PolarHBondContact O-N 3.33Å
46I73.2Confident70.8Confident109 Ų109109 Ų10956%0.55957%0.566SS**Hα-helixtrans-68.5-44.1173.5-62.4171.8000110.3R41 S42 S43R41-I46 HydrophobicContact CB-CD1 4.04Å; R41-I46 HydrophobicContact CB-CG1 3.68Å; S42-I46 PolarHBondContact O-N 3.25Å; S42-I46 VanDerWaalsContact O-N 3.1Å; S43-I46 PolarHBondContact O-N 2.91Å
47L70.8Confident71.1Confident124 Ų124103.7 Ų103.765%0.64955%0.55SS*.Hα-helixtrans-73.6-43.7-175.9-70.2173.7000113.8S43 G49 T114S43-L47 WeakPolarHBondContact O-CB 3.46Å; S43-L47 WeakPolarHBondContact O-CG 3.39Å; S43-L47 PolarHBondContact O-N 3.43Å; L47-G49 PolarHBondContact O-N 3.22Å; L47-T114 HydrophobicContact CD1-CG2 4.42Å
48L68.7Low71.8Confident77 Ų77103.5 Ų103.540%0.40354%0.541SS..Hα-helixtrans-76.5-13.4178.5-65.2179.6000112.3R44R44-L48 HydrophobicContact CG-CD1 3.65Å; R44-L48 HydrophobicContact CG-CG 4.12Å; R44-L48 VanDerWaalsContact O-CB 3.3Å; R44-L48 WeakPolarHBondContact O-CB 3.39Å; R44-L48 WeakPolarHBondContact O-CG 3.28Å; R44-L48 PolarHBondContact O-N 2.94Å
49G65.3Low73.1Confident18 Ų18103.6 Ų103.619%0.18654%0.539CS..  trans67.2123.2-158.200000109.7E45 L47 S51E45-G49 CarbonylContact O-C 3.25Å; E45-G49 VanDerWaalsContact O-C 3.25Å; E45-G49 WeakPolarHBondContact O-CA 3.36Å; E45-G49 PolarHBondContact O-N 2.93Å; L47-G49 PolarHBondContact O-N 3.22Å; G49-S51 PolarHBondContact O-N 2.93Å
50S60.6Low74.4Confident21 Ų21100.4 Ų100.415%0.14753%0.525CS..  trans-52.1149.7162.571.20000107.9E45 R52 L53E45-S50 PolarHBondContact O-N 3.33Å; S50-R52 PolarHBondContact O-N 3.26Å; S50-R52 WeakPolarHBondContact OG-CB 3.43Å; S50-R52 PolarHBondContact OG-N 3.12Å; S50-L53 PolarHBondContact O-N 2.97Å
51S62.9Low75.5Confident139 Ų13992.7 Ų92.797%0.97250%0.502SS*.THydrogen-bonded Turntrans-56-0.6173.1-49.50000114.2G49G49-S51 PolarHBondContact O-N 2.93Å
52R67.3Low76.6Confident216 Ų21692.8 Ų92.882%0.81551%0.51SS*.THydrogen-bonded Turntrans-88.3-15174-49.6-178.7178.3-177.3-0.4113.7S50 G54S50-R52 PolarHBondContact O-N 3.26Å; S50-R52 WeakPolarHBondContact OG-CB 3.43Å; S50-R52 PolarHBondContact OG-N 3.12Å; R52-G54 PolarHBondContact O-N 2.9Å
53L73.4Confident77.5Confident94 Ų9493.3 Ų93.349%0.49251%0.506SS..SBendtrans-72.7123.9172.7-70.8-175.6000108.8S50 V58S50-L53 PolarHBondContact O-N 2.97Å; L53-V58 HydrophobicContact CB-CG2 4.16Å; L53-V58 HydrophobicContact CD1-CG2 4.48Å
54G80.9Confident78.3Confident40 Ų4092.4 Ų92.441%0.41251%0.505SS..  trans-61.6153.1173.400000111.4R52 F56 P57R52-G54 PolarHBondContact O-N 2.9Å; G54-F56 PolarHBondContact O-N 3.44Å; G54-P57 VanDerWaalsContact O-CD 3.32Å; G54-P57 WeakPolarHBondContact O-CD 3.32Å
55I84Confident79.1Confident153 Ų15391.3 Ų91.379%0.78551%0.514SS*.Hα-helixtrans-59.5-33.7177.2-62.9161.5000110.9V58 A59I55-V58 PolarHBondContact O-N 3.4Å; I55-A59 WeakPolarHBondContact O-CB 3.36Å; I55-A59 PolarHBondContact O-N 3.03Å
56F89.1Confident79.6Confident149 Ų14995 Ų9565%0.65453%0.526SS*.Hα-helixtrans-66-53.1-175.5-175.9-94.3000113.7G54 V58 A59 M60G54-F56 PolarHBondContact O-N 3.44Å; F56-V58 VanDerWaalsContact C-N 3.28Å; F56-V58 PolarHBondContact O-N 3.5Å; F56-A59 PolarHBondContact O-N 2.9Å; F56-M60 HydrophobicContact CD1-CG 4.3Å; F56-M60 HydrophobicContact CE1-CG 3.94Å; F56-M60 HydrophobicContact CE2-CE 4.27Å; F56-M60 HydrophobicContact CE2-CG 4.46Å; F56-M60 HydrophobicContact CZ-CE 4.49Å; F56-M60 HydrophobicContact CZ-CG 4.03Å; F56-M60 HydrophobicContact CZ-SD 4.27Å; F56-M60 WeakPolarHBondContact O-CG 3.16Å; F56-M60 PolarHBondContact O-N 3.21Å
57P86.7Confident80.2Confident73 Ų7395.4 Ų95.447%0.47453%0.527SS..Hα-helixtrans-55.6-39.9172.7-27.832.4000114.1G54 M60 A61G54-P57 VanDerWaalsContact O-CD 3.32Å; G54-P57 WeakPolarHBondContact O-CD 3.32Å; P57-M60 PolarHBondContact O-N 3.4Å; P57-A61 WeakPolarHBondContact O-CB 3.29Å; P57-A61 PolarHBondContact O-N 3.37Å
58V84.4Confident80.8Confident62 Ų6291.2 Ų91.238%0.37651%0.508SS..Hα-helixtrans-65.3-45.9179.1177.30000110.5L53 I55 F56 M60 A61 L62L53-V58 HydrophobicContact CB-CG2 4.16Å; L53-V58 HydrophobicContact CD1-CG2 4.48Å; I55-V58 PolarHBondContact O-N 3.4Å; F56-V58 VanDerWaalsContact C-N 3.28Å; F56-V58 PolarHBondContact O-N 3.5Å; V58-M60 PolarHBondContact O-N 2.91Å; V58-A61 PolarHBondContact O-N 3.3Å; V58-L62 HydrophobicContact CG1-CD1 4.14Å; V58-L62 WeakPolarHBondContact O-CG 3.15Å; V58-L62 PolarHBondContact O-N 3.49Å
59A89.2Confident81.1Confident34 Ų3490.9 Ų90.928%0.28152%0.517SS..Hα-helixtrans-61.6-43.8176.400000111.9I55 F56 A61 L62 I63I55-A59 WeakPolarHBondContact O-CB 3.36Å; I55-A59 PolarHBondContact O-N 3.03Å; F56-A59 PolarHBondContact O-N 2.9Å; A59-A61 PolarHBondContact O-N 3Å; A59-L62 PolarHBondContact O-N 2.98Å; A59-I63 VanDerWaalsContact O-CG1 3.3Å; A59-I63 WeakPolarHBondContact O-CG1 3.48Å; A59-I63 PolarHBondContact O-N 2.95Å
60M89.9Confident81.4Confident85 Ų8591.5 Ų91.542%0.41952%0.516SS..Hα-helixtrans-61.7-43.1176.6-71.8-60.710400112.1F56 P57 V58 L62 I63 A64F56-M60 HydrophobicContact CD1-CG 4.3Å; F56-M60 HydrophobicContact CE1-CG 3.94Å; F56-M60 HydrophobicContact CE2-CE 4.27Å; F56-M60 HydrophobicContact CE2-CG 4.46Å; F56-M60 HydrophobicContact CZ-CE 4.49Å; F56-M60 HydrophobicContact CZ-CG 4.03Å; F56-M60 HydrophobicContact CZ-SD 4.27Å; F56-M60 WeakPolarHBondContact O-CG 3.16Å; F56-M60 PolarHBondContact O-N 3.21Å; P57-M60 PolarHBondContact O-N 3.4Å; V58-M60 PolarHBondContact O-N 2.91Å; M60-L62 VanDerWaalsContact C-N 3.35Å; M60-L62 PolarHBondContact O-N 3.48Å; M60-I63 HydrophobicContact CE-CD1 3.73Å; M60-I63 PolarHBondContact O-N 3.48Å; M60-A64 VanDerWaalsContact O-CB 3.27Å; M60-A64 WeakPolarHBondContact O-CB 3.31Å; M60-A64 PolarHBondContact O-N 2.81Å
61A88Confident82.2Confident54 Ų5491.5 Ų91.545%0.44652%0.516SS..Hα-helixtrans-64.1-39.5176.900000112.3P57 V58 A59 T65P57-A61 WeakPolarHBondContact O-CB 3.29Å; P57-A61 PolarHBondContact O-N 3.37Å; V58-A61 PolarHBondContact O-N 3.3Å; A59-A61 PolarHBondContact O-N 3Å; A61-T65 WeakPolarHBondContact O-CB 3.31Å; A61-T65 PolarHBondContact O-N 3.45Å; A61-T65 PolarHBondContact O-OG1 2.9Å
62L87.5Confident82.9Confident116 Ų11689.2 Ų89.261%0.60750%0.496SS*.Hα-helixtrans-65.6-44.5175.5-72.1172.6000111.6V58 A59 M60 T65 Y66V58-L62 HydrophobicContact CG1-CD1 4.14Å; V58-L62 WeakPolarHBondContact O-CG 3.15Å; V58-L62 PolarHBondContact O-N 3.49Å; A59-L62 PolarHBondContact O-N 2.98Å; M60-L62 VanDerWaalsContact C-N 3.35Å; M60-L62 PolarHBondContact O-N 3.48Å; L62-T65 PolarHBondContact O-N 3.14Å; L62-Y66 VanDerWaalsContact O-CB 3.27Å; L62-Y66 WeakPolarHBondContact O-CB 3.29Å; L62-Y66 PolarHBondContact O-N 3.33Å
63I90Very high83.2Confident84 Ų8484.3 Ų84.343%0.43148%0.484SS..Hα-helixtrans-63-46.4176.2-68.5168.1000110.4A59 M60 T65 Y66 M67A59-I63 VanDerWaalsContact O-CG1 3.3Å; A59-I63 WeakPolarHBondContact O-CG1 3.48Å; A59-I63 PolarHBondContact O-N 2.95Å; M60-I63 HydrophobicContact CE-CD1 3.73Å; M60-I63 PolarHBondContact O-N 3.48Å; I63-T65 VanDerWaalsContact C-N 3.28Å; I63-T65 PolarHBondContact O-N 3.44Å; I63-Y66 PolarHBondContact O-N 3.42Å; I63-M67 HydrophobicContact CG2-CG 3.98Å; I63-M67 VanDerWaalsContact O-CB 3.32Å; I63-M67 WeakPolarHBondContact O-CB 3.38Å; I63-M67 VanDerWaalsContact O-CG 3.23Å; I63-M67 WeakPolarHBondContact O-CG 3.21Å; I63-M67 PolarHBondContact O-N 2.87Å
64A88.3Confident83.3Confident70 Ų7080.2 Ų80.258%0.57947%0.465SS*.Hα-helixtrans-60.6-37.8178.700000112.2M60M60-A64 VanDerWaalsContact O-CB 3.27Å; M60-A64 WeakPolarHBondContact O-CB 3.31Å; M60-A64 PolarHBondContact O-N 2.81Å
65T87.4Confident83.2Confident124 Ų12483 Ų8376%0.76146%0.463SS*.Hα-helixtrans-74.6-32.9177.9-54.60000112.2A61 L62 I63A61-T65 WeakPolarHBondContact O-CB 3.31Å; A61-T65 PolarHBondContact O-N 3.45Å; A61-T65 PolarHBondContact O-OG1 2.9Å; L62-T65 PolarHBondContact O-N 3.14Å; I63-T65 VanDerWaalsContact C-N 3.28Å; I63-T65 PolarHBondContact O-N 3.44Å
66Y84.9Confident82.7Confident152 Ų15278.6 Ų78.660%0.59645%0.445SS*.Hα-helixtrans-78.7-33.3-179.9-172.8-107.1000112.7L62 I63 S68 Y93L62-Y66 VanDerWaalsContact O-CB 3.27Å; L62-Y66 WeakPolarHBondContact O-CB 3.29Å; L62-Y66 PolarHBondContact O-N 3.33Å; I63-Y66 PolarHBondContact O-N 3.42Å; Y66-S68 PolarHBondContact O-N 3.41Å; Y66-Y93 PolarHBondContact OH-OH 3.33Å
67M85.3Confident82Confident119 Ų11972.8 Ų72.859%0.58642%0.423SS*.  trans-79.9116-179.1-70.4-68.1-175.900111I63I63-M67 HydrophobicContact CG2-CG 3.98Å; I63-M67 VanDerWaalsContact O-CB 3.32Å; I63-M67 WeakPolarHBondContact O-CB 3.38Å; I63-M67 VanDerWaalsContact O-CG 3.23Å; I63-M67 WeakPolarHBondContact O-CG 3.21Å; I63-M67 PolarHBondContact O-N 2.87Å
68S83Confident81.5Confident36 Ų3671.1 Ų71.125%0.25241%0.409SS..  trans-99.4136.6174.1176.40000111.3Y66 V70 S71 V72Y66-S68 PolarHBondContact O-N 3.41Å; S68-V70 PolarHBondContact O-N 3.35Å; S68-V70 VanDerWaalsContact O-N 3.15Å; S68-V70 PolarHBondContact OG-N 3.26Å; S68-S71 WeakPolarHBondContact O-CB 3.44Å; S68-S71 PolarHBondContact O-N 3.02Å; S68-V72 PolarHBondContact O-N 3.08Å
69A75.5Confident81.2Confident70 Ų7071.3 Ų71.358%0.57941%0.407SS*.Hα-helixtrans-52.8-36.3175.400000112.6S71 V72 M73A69-S71 VanDerWaalsContact C-N 3.32Å; A69-S71 PolarHBondContact O-N 3.47Å; A69-V72 PolarHBondContact O-N 3.47Å; A69-M73 PolarHBondContact O-N 3.5Å
70V71.7Confident80.4Confident30 Ų3079.2 Ų79.218%0.18243%0.431CS..Hα-helixtrans-65.9-35.8179.6-165.90000111.3S68 G74 L147 L151S68-V70 PolarHBondContact O-N 3.35Å; S68-V70 VanDerWaalsContact O-N 3.15Å; S68-V70 PolarHBondContact OG-N 3.26Å; V70-G74 WeakPolarHBondContact O-CA 3.41Å; V70-G74 PolarHBondContact O-N 2.86Å; V70-L147 HydrophobicContact CB-CD2 3.65Å; V70-L147 HydrophobicContact CB-CG 4.12Å; V70-L147 HydrophobicContact CG1-CB 4.34Å; V70-L147 HydrophobicContact CG1-CD2 3.62Å; V70-L147 HydrophobicContact CG1-CG 3.5Å; V70-L147 VanDerWaalsContact CG1-CG 3.5Å; V70-L151 HydrophobicContact CG1-CB 4.27Å; V70-L151 HydrophobicContact CG1-CD2 4.3Å
71S77.3Confident79.6Confident21 Ų2179 Ų7915%0.14743%0.428CS..Hα-helixtrans-71.4-39.3176.6-58.80000112S68 A69 M73 G74 Y75S68-S71 WeakPolarHBondContact O-CB 3.44Å; S68-S71 PolarHBondContact O-N 3.02Å; A69-S71 VanDerWaalsContact C-N 3.32Å; A69-S71 PolarHBondContact O-N 3.47Å; S71-M73 VanDerWaalsContact C-N 3.3Å; S71-M73 PolarHBondContact O-N 3.3Å; S71-G74 PolarHBondContact O-N 2.9Å; S71-Y75 WeakPolarHBondContact O-CD2 3.3Å; S71-Y75 PolarHBondContact O-N 3.28Å
72V77.5Confident79Confident91 Ų9183.2 Ų83.255%0.55244%0.437SS*.Hα-helixtrans-61.5-38.9180176.80000111.6S68 A69 P76S68-V72 PolarHBondContact O-N 3.08Å; A69-V72 PolarHBondContact O-N 3.47Å; V72-P76 WeakPolarHBondContact O-CD 3.39Å; V72-P76 WeakPolarHBondContact O-CG 3.4Å
73M74.2Confident78.6Confident113 Ų11379.2 Ų79.256%0.55742%0.424SS*.Hα-helixtrans-85.6-33.2176-67.5-176.9-77.300113.2A69 S71 L151A69-M73 PolarHBondContact O-N 3.5Å; S71-M73 VanDerWaalsContact C-N 3.3Å; S71-M73 PolarHBondContact O-N 3.3Å; M73-L151 HydrophobicContact CB-CD1 3.85Å
74G74.4Confident78.1Confident8 Ų877.1 Ų77.18%0.08242%0.423CS..Hα-helixtrans-68.7-43.1-176.900000113.6V70 S71 S77 E78V70-G74 WeakPolarHBondContact O-CA 3.41Å; V70-G74 PolarHBondContact O-N 2.86Å; S71-G74 PolarHBondContact O-N 2.9Å; G74-S77 PolarHBondContact O-N 3.21Å; G74-E78 PolarHBondContact O-N 2.94Å
75Y78.1Confident77.8Confident98 Ų9880.4 Ų80.438%0.38443%0.428SS..Hα-helixtrans-64.9-45.5-175.2-63.3-43000114.1S71 S77 E78 I79 M86S71-Y75 WeakPolarHBondContact O-CD2 3.3Å; S71-Y75 PolarHBondContact O-N 3.28Å; Y75-S77 VanDerWaalsContact C-N 3.34Å; Y75-S77 PolarHBondContact O-N 3.5Å; Y75-E78 PolarHBondContact O-N 3.43Å; Y75-I79 WeakPolarHBondContact O-CG1 3.21Å; Y75-I79 PolarHBondContact O-N 3.48Å; Y75-M86 HydrophobicContact CD1-CE 3.9Å; Y75-M86 HydrophobicContact CD1-SD 3.87Å; Y75-M86 HydrophobicContact CE1-CE 3.99Å; Y75-M86 HydrophobicContact CE1-SD 4.05Å
76P75.2Confident77.4Confident61 Ų6175.5 Ų75.540%0.39640%0.397SS..Hα-helixtrans-58.9-46.6175.7-25.135.2000111.6V72 E78 I79 Y80V72-P76 WeakPolarHBondContact O-CD 3.39Å; V72-P76 WeakPolarHBondContact O-CG 3.4Å; P76-E78 VanDerWaalsContact C-N 3.28Å; P76-E78 PolarHBondContact O-N 3.32Å; P76-I79 PolarHBondContact O-N 2.88Å; P76-Y80 HydrophobicContact CB-CE2 4.44Å; P76-Y80 WeakPolarHBondContact O-CD2 3.32Å; P76-Y80 PolarHBondContact O-N 2.89Å
77S74.3Confident77.3Confident27 Ų2772.9 Ų72.919%0.18939%0.393CS..Hα-helixtrans-58-42.2178.6-179.20000111.8G74 Y75 Y80 H81 G154G74-S77 PolarHBondContact O-N 3.21Å; Y75-S77 VanDerWaalsContact C-N 3.34Å; Y75-S77 PolarHBondContact O-N 3.5Å; S77-Y80 PolarHBondContact O-N 3.46Å; S77-H81 PolarHBondContact O-CD2 3.36Å; S77-H81 PolarHBondContact O-N 3.35Å; S77-G154 WeakPolarHBondContact OG-CA 3.43Å
78E75Confident77.4Confident39 Ų3975.2 Ų75.218%0.18240%0.396CS..Hα-helixtrans-67.7-38.5178.5-164.5157.5172.200112.7G74 Y75 P76 H81 F82 M86 K150G74-E78 PolarHBondContact O-N 2.94Å; Y75-E78 PolarHBondContact O-N 3.43Å; P76-E78 VanDerWaalsContact C-N 3.28Å; P76-E78 PolarHBondContact O-N 3.32Å; E78-H81 PolarHBondContact O-N 3.35Å; E78-F82 HydrophobicContact CG-CD2 3.81Å; E78-F82 WeakPolarHBondContact O-CB 3.41Å; E78-F82 PolarHBondContact O-N 3.44Å; E78-M86 HydrophobicContact CB-CG 4.3Å; E78-M86 HydrophobicContact CG-CE 4.09Å; E78-M86 HydrophobicContact CG-CG 3.94Å; E78-M86 VanDerWaalsContact OE1-CE 3.26Å; E78-M86 WeakPolarHBondContact OE1-CE 3.24Å; E78-M86 WeakPolarHBondContact OE2-CE 3.15Å; E78-K150 IonicContact OE1-NZ 2.72Å; E78-K150 PolarHBondContact OE1-NZ 2.82Å; E78-K150 WeakPolarHBondContact OE2-CD 3.37Å; E78-K150 WeakPolarHBondContact OE2-CE 3.38Å; E78-K150 IonicContact OE2-NZ 2.73Å; E78-K150 PolarHBondContact OE2-NZ 3.38Å
79I78.3Confident77.5Confident66 Ų6679.8 Ų79.834%0.33841%0.409SS..Hα-helixtrans-66.9-38.8176.7-67.3168000111.5Y75 P76 H81 G83 M86Y75-I79 WeakPolarHBondContact O-CG1 3.21Å; Y75-I79 PolarHBondContact O-N 3.48Å; P76-I79 PolarHBondContact O-N 2.88Å; I79-H81 VanDerWaalsContact C-N 3.33Å; I79-H81 PolarHBondContact O-N 3.25Å; I79-G83 WeakPolarHBondContact CA-O 3.05Å; I79-G83 CarbonylContact O-C 3.47Å; I79-G83 WeakPolarHBondContact O-CA 3.35Å; I79-G83 PolarHBondContact O-N 2.97Å; I79-G83 VanDerWaalsContact O-N 3.08Å; I79-M86 HydrophobicContact CD1-CB 4.44Å; I79-M86 HydrophobicContact CG1-CB 3.89Å
80Y73.1Confident78.1Confident200 Ų20082.1 Ų82.178%0.78441%0.411SS*.Hα-helixtrans-64.8-35.8177.3-81.5-69.7000112.7P76 S77P76-Y80 HydrophobicContact CB-CE2 4.44Å; P76-Y80 WeakPolarHBondContact O-CD2 3.32Å; P76-Y80 PolarHBondContact O-N 2.89Å; S77-Y80 PolarHBondContact O-N 3.46Å
81H72.1Confident79.1Confident79 Ų7984.4 Ų84.437%0.36643%0.425SS..Hα-helixtrans-95.3-43.7-175-67.5-57.4000114.6S77 E78 I79 Y157S77-H81 PolarHBondContact O-CD2 3.36Å; S77-H81 PolarHBondContact O-N 3.35Å; E78-H81 PolarHBondContact O-N 3.35Å; I79-H81 VanDerWaalsContact C-N 3.33Å; I79-H81 PolarHBondContact O-N 3.25Å; H81-Y157 VanDerWaalsContact CE1-CB 3.43Å; H81-Y157 WeakPolarHBondContact CE1-CB 3.16Å; H81-Y157 WeakPolarHBondContact NE2-CB 3.43Å
82F75.8Confident79.8Confident144 Ų14485.7 Ų85.763%0.63244%0.437SS*.Hα-helixtrans-99.4-0.7-177.3-62.6-84.3000112.8E78E78-F82 HydrophobicContact CG-CD2 3.81Å; E78-F82 WeakPolarHBondContact O-CB 3.41Å; E78-F82 PolarHBondContact O-N 3.44Å
83G79.1Confident80.4Confident32 Ų3284.8 Ų84.833%0.3342%0.424SS..  trans78.3-168.5-177.600000113.5I79 M85I79-G83 WeakPolarHBondContact CA-O 3.05Å; I79-G83 CarbonylContact O-C 3.47Å; I79-G83 WeakPolarHBondContact O-CA 3.35Å; I79-G83 PolarHBondContact O-N 2.97Å; I79-G83 VanDerWaalsContact O-N 3.08Å; G83-M85 PolarHBondContact O-N 2.86Å
84G79.3Confident81.4Confident40 Ų4085.2 Ų85.241%0.41243%0.428SS..G310 helixtrans-71.612.7-173.700000116.3M86 L87G84-M86 PolarHBondContact O-N 2.85Å; G84-L87 WeakPolarHBondContact O-CB 3.41Å; G84-L87 WeakPolarHBondContact O-CG 3.26Å; G84-L87 PolarHBondContact O-N 3.19Å
85M81.9Confident82.3Confident139 Ų13991.7 Ų91.769%0.68545%0.454SS*.G310 helixtrans-61-31.6-179.6-170.5179.1-176.800111.8G83 L87 Y88G83-M85 PolarHBondContact O-N 2.86Å; M85-L87 PolarHBondContact O-N 2.92Å; M85-L87 VanDerWaalsContact O-N 3.12Å; M85-Y88 HydrophobicContact CB-CD2 4.44Å; M85-Y88 HydrophobicContact CB-CE2 4.47Å; M85-Y88 HydrophobicContact CG-CD2 3.73Å; M85-Y88 HydrophobicContact CG-CE2 3.87Å; M85-Y88 WeakPolarHBondContact O-CB 3.38Å; M85-Y88 WeakPolarHBondContact O-CD2 3.3Å; M85-Y88 PolarHBondContact O-N 3.22Å; M85-Y88 VanDerWaalsContact O-N 3.09Å
86M79.7Confident83.1Confident21 Ų2190.2 Ų90.210%0.10346%0.455CS..G310 helixtrans-58.8-21.7172.3-92.6-77.4-173.200113.5Y75 E78 I79 G84 Y88 Y89Y75-M86 HydrophobicContact CD1-CE 3.9Å; Y75-M86 HydrophobicContact CD1-SD 3.87Å; Y75-M86 HydrophobicContact CE1-CE 3.99Å; Y75-M86 HydrophobicContact CE1-SD 4.05Å; E78-M86 HydrophobicContact CB-CG 4.3Å; E78-M86 HydrophobicContact CG-CE 4.09Å; E78-M86 HydrophobicContact CG-CG 3.94Å; E78-M86 VanDerWaalsContact OE1-CE 3.26Å; E78-M86 WeakPolarHBondContact OE1-CE 3.24Å; E78-M86 WeakPolarHBondContact OE2-CE 3.15Å; I79-M86 HydrophobicContact CD1-CB 4.44Å; I79-M86 HydrophobicContact CG1-CB 3.89Å; G84-M86 PolarHBondContact O-N 2.85Å; M86-Y88 PolarHBondContact O-N 3.38Å; M86-Y89 HydrophobicContact CE-CE2 4.14Å; M86-Y89 WeakPolarHBondContact O-CB 3.27Å; M86-Y89 WeakPolarHBondContact O-CD2 3.32Å; M86-Y89 PolarHBondContact O-N 2.98Å; M86-Y89 VanDerWaalsContact O-N 3.08Å; M86-Y89 HydrophobicContact SD-CD2 3.44Å; M86-Y89 WeakPolarHBondContact SD-CD2 3.37Å; M86-Y89 HydrophobicContact SD-CE2 3.46Å; M86-Y89 WeakPolarHBondContact SD-CE2 3.28Å
87L82.8Confident84Confident97 Ų9793.5 Ų93.551%0.50846%0.463SS..G310 helixtrans-66.6-16.6176.6-59.9173.8000112.8G84 M85 Y89 L90 V91G84-L87 WeakPolarHBondContact O-CB 3.41Å; G84-L87 WeakPolarHBondContact O-CG 3.26Å; G84-L87 PolarHBondContact O-N 3.19Å; M85-L87 PolarHBondContact O-N 2.92Å; M85-L87 VanDerWaalsContact O-N 3.12Å; L87-Y89 PolarHBondContact O-N 2.75Å; L87-L90 VanDerWaalsContact O-CB 3.25Å; L87-L90 WeakPolarHBondContact O-CB 3.27Å; L87-L90 PolarHBondContact O-N 2.84Å; L87-V91 PolarHBondContact O-N 3.44Å
88Y86.7Confident85Confident168 Ų16895 Ų9566%0.65947%0.472SS*.Hα-helixtrans-60.9-27.4170.9-68.7-63.5000112.3M85 M86 L90 V91 A92M85-Y88 HydrophobicContact CB-CD2 4.44Å; M85-Y88 HydrophobicContact CB-CE2 4.47Å; M85-Y88 HydrophobicContact CG-CD2 3.73Å; M85-Y88 HydrophobicContact CG-CE2 3.87Å; M85-Y88 WeakPolarHBondContact O-CB 3.38Å; M85-Y88 WeakPolarHBondContact O-CD2 3.3Å; M85-Y88 PolarHBondContact O-N 3.22Å; M85-Y88 VanDerWaalsContact O-N 3.09Å; M86-Y88 PolarHBondContact O-N 3.38Å; Y88-L90 VanDerWaalsContact C-N 3.29Å; Y88-L90 PolarHBondContact O-N 3.49Å; Y88-V91 PolarHBondContact O-N 2.84Å; Y88-A92 PolarHBondContact O-N 2.96Å; Y88-A92 VanDerWaalsContact O-N 3.08Å
89Y86.2Confident85.9Confident132 Ų13297.2 Ų97.252%0.51849%0.485SS..Hα-helixtrans-64.7-34.3171.9-72.1-78.1000112M86 L87 V91 A92 Y93M86-Y89 HydrophobicContact CE-CE2 4.14Å; M86-Y89 WeakPolarHBondContact O-CB 3.27Å; M86-Y89 WeakPolarHBondContact O-CD2 3.32Å; M86-Y89 PolarHBondContact O-N 2.98Å; M86-Y89 VanDerWaalsContact O-N 3.08Å; M86-Y89 HydrophobicContact SD-CD2 3.44Å; M86-Y89 WeakPolarHBondContact SD-CD2 3.37Å; M86-Y89 HydrophobicContact SD-CE2 3.46Å; M86-Y89 WeakPolarHBondContact SD-CE2 3.28Å; L87-Y89 PolarHBondContact O-N 2.75Å; Y89-V91 VanDerWaalsContact C-N 3.34Å; Y89-V91 PolarHBondContact O-N 2.81Å; Y89-A92 PolarHBondContact O-N 3.24Å; Y89-Y93 WeakPolarHBondContact O-CD2 3.23Å; Y89-Y93 PolarHBondContact O-N 3.45Å
90L88.5Confident86.6Confident118 Ų11897.3 Ų97.362%0.61849%0.488SS*.Hα-helixtrans-63.6-42.3176.4-177.864.3000111.2L87 Y88 A92 Y93 L94L87-L90 VanDerWaalsContact O-CB 3.25Å; L87-L90 WeakPolarHBondContact O-CB 3.27Å; L87-L90 PolarHBondContact O-N 2.84Å; Y88-L90 VanDerWaalsContact C-N 3.29Å; Y88-L90 PolarHBondContact O-N 3.49Å; L90-A92 VanDerWaalsContact C-N 3.35Å; L90-Y93 PolarHBondContact O-N 3.08Å; L90-L94 PolarHBondContact O-N 3.31Å
91V91Very high87.5Confident79 Ų7990.1 Ų90.148%0.47947%0.47SS..Hα-helixtrans-62.2-44.3175.5-178.80000110.3L87 Y88 Y89 Y93 L94 F95L87-V91 PolarHBondContact O-N 3.44Å; Y88-V91 PolarHBondContact O-N 2.84Å; Y89-V91 VanDerWaalsContact C-N 3.34Å; Y89-V91 PolarHBondContact O-N 2.81Å; V91-Y93 PolarHBondContact O-N 3.2Å; V91-L94 WeakPolarHBondContact O-CB 3.37Å; V91-L94 PolarHBondContact O-N 2.89Å; V91-F95 HydrophobicContact CG1-CD2 4.35Å; V91-F95 HydrophobicContact CG1-CE2 3.85Å; V91-F95 WeakPolarHBondContact O-CD2 3.48Å
92A92Very high88.5Confident48 Ų4895.3 Ų95.340%0.39749%0.488SS..Hα-helixtrans-60.5-44.5175.500000112.2Y88 Y89 L90 L94 F95 V96Y88-A92 PolarHBondContact O-N 2.96Å; Y88-A92 VanDerWaalsContact O-N 3.08Å; Y89-A92 PolarHBondContact O-N 3.24Å; L90-A92 VanDerWaalsContact C-N 3.35Å; A92-L94 VanDerWaalsContact C-N 3.28Å; A92-L94 PolarHBondContact O-N 3.47Å; A92-F95 PolarHBondContact O-N 3.22Å; A92-F95 VanDerWaalsContact O-N 3.12Å; A92-V96 VanDerWaalsContact O-CG2 3.31Å; A92-V96 WeakPolarHBondContact O-CG2 3.17Å; A92-V96 PolarHBondContact O-N 3.41Å
93Y91.7Very high89.3Confident71 Ų7192.1 Ų92.128%0.27848%0.48SS..Hα-helixtrans-61.9-34.5177.4-74.9-52.4000113.1Y66 Y89 L90 V91 F95 V96 F97Y66-Y93 PolarHBondContact OH-OH 3.33Å; Y89-Y93 WeakPolarHBondContact O-CD2 3.23Å; Y89-Y93 PolarHBondContact O-N 3.45Å; L90-Y93 PolarHBondContact O-N 3.08Å; V91-Y93 PolarHBondContact O-N 3.2Å; Y93-F95 PolarHBondContact O-N 2.87Å; Y93-V96 PolarHBondContact O-N 3.34Å; Y93-F97 HydrophobicContact CD1-CE2 4.34Å; Y93-F97 HydrophobicContact CD1-CZ 4.13Å; Y93-F97 HydrophobicContact CG-CE2 4.27Å; Y93-F97 HydrophobicContact CG-CZ 4.45Å; Y93-F97 WeakPolarHBondContact O-CD2 3.24Å; Y93-F97 WeakPolarHBondContact O-CG 3.32Å; Y93-F97 PolarHBondContact O-N 3.09Å
94L94Very high89.8Confident122 Ų12295.3 Ų95.364%0.63949%0.485SS*.Hα-helixtrans-59.6-31.6175.7-173.763.5000112.6L90 V91 A92 P98L90-L94 PolarHBondContact O-N 3.31Å; V91-L94 WeakPolarHBondContact O-CB 3.37Å; V91-L94 PolarHBondContact O-N 2.89Å; A92-L94 VanDerWaalsContact C-N 3.28Å; A92-L94 PolarHBondContact O-N 3.47Å; L94-P98 WeakPolarHBondContact O-CD 3.18Å; L94-P98 WeakPolarHBondContact O-CG 3.42Å
95F94.3Very high90.2Very high144 Ų14498.2 Ų98.263%0.63249%0.491SS*.Hα-helixtrans-90.2-37.1175.7-66-73.6000113V91 A92 Y93 P98 L99V91-F95 HydrophobicContact CG1-CD2 4.35Å; V91-F95 HydrophobicContact CG1-CE2 3.85Å; V91-F95 WeakPolarHBondContact O-CD2 3.48Å; A92-F95 PolarHBondContact O-N 3.22Å; A92-F95 VanDerWaalsContact O-N 3.12Å; Y93-F95 PolarHBondContact O-N 2.87Å; F95-P98 WeakPolarHBondContact O-CD 3.5Å; F95-L99 WeakPolarHBondContact O-CB 3.43Å; F95-L99 PolarHBondContact O-N 3.27Å
96V94.5Very high90.5Very high68 Ų6895 Ų9541%0.41248%0.481SS..Hα-helixtrans-66.9-40.8-178.6171.80000111.5A92 Y93 L99 V100A92-V96 VanDerWaalsContact O-CG2 3.31Å; A92-V96 WeakPolarHBondContact O-CG2 3.17Å; A92-V96 PolarHBondContact O-N 3.41Å; Y93-V96 PolarHBondContact O-N 3.34Å; V96-L99 WeakPolarHBondContact O-CB 3.46Å; V96-L99 PolarHBondContact O-N 3.43Å; V96-V100 HydrophobicContact CG1-CG2 4.11Å; V96-V100 VanDerWaalsContact O-CG2 3.31Å; V96-V100 WeakPolarHBondContact O-CG2 3.25Å; V96-V100 PolarHBondContact O-N 3.3Å
97F93.2Very high90.9Very high129 Ų12997.2 Ų97.257%0.56650%0.495SS*.Hα-helixtrans-63.2-49.5-178.5-70.9-45.2000113.6Y93 L99 V100 A101Y93-F97 HydrophobicContact CD1-CE2 4.34Å; Y93-F97 HydrophobicContact CD1-CZ 4.13Å; Y93-F97 HydrophobicContact CG-CE2 4.27Å; Y93-F97 HydrophobicContact CG-CZ 4.45Å; Y93-F97 WeakPolarHBondContact O-CD2 3.24Å; Y93-F97 WeakPolarHBondContact O-CG 3.32Å; Y93-F97 PolarHBondContact O-N 3.09Å; F97-L99 VanDerWaalsContact C-N 3.31Å; F97-L99 PolarHBondContact O-N 2.97Å; F97-V100 PolarHBondContact O-N 3.41Å; F97-A101 WeakPolarHBondContact O-CB 3.46Å; F97-A101 PolarHBondContact O-N 3.14Å
98P95.6Very high90.9Very high58 Ų5895.1 Ų95.138%0.37748%0.483SS..Hα-helixtrans-59.4-40.9172.9-25.234.6000112.7L94 F95 V100 A101 Y102L94-P98 WeakPolarHBondContact O-CD 3.18Å; L94-P98 WeakPolarHBondContact O-CG 3.42Å; F95-P98 WeakPolarHBondContact O-CD 3.5Å; P98-V100 VanDerWaalsContact C-N 3.34Å; P98-V100 PolarHBondContact O-N 3.42Å; P98-A101 PolarHBondContact O-N 2.89Å; P98-Y102 HydrophobicContact CB-CD2 4.12Å; P98-Y102 HydrophobicContact CB-CE2 4.35Å; P98-Y102 WeakPolarHBondContact O-CB 3.38Å; P98-Y102 WeakPolarHBondContact O-CD2 3.27Å; P98-Y102 PolarHBondContact O-N 2.92Å
99L94.8Very high90.7Very high87 Ų8794 Ų9446%0.45548%0.483SS..Hα-helixtrans-59.5-46.2177.3-176.573000111.1F95 V96 F97 V103 F104F95-L99 WeakPolarHBondContact O-CB 3.43Å; F95-L99 PolarHBondContact O-N 3.27Å; V96-L99 WeakPolarHBondContact O-CB 3.46Å; V96-L99 PolarHBondContact O-N 3.43Å; F97-L99 VanDerWaalsContact C-N 3.31Å; F97-L99 PolarHBondContact O-N 2.97Å; L99-V103 HydrophobicContact CD1-CB 4.26Å; L99-V103 HydrophobicContact CD1-CG2 3.84Å; L99-V103 WeakPolarHBondContact O-CA 2.91Å; L99-V103 VanDerWaalsContact O-CB 3.23Å; L99-V103 WeakPolarHBondContact O-CB 3.36Å; L99-V103 PolarHBondContact O-N 3.24Å; L99-F104 HydrophobicContact CD2-CE2 3.92Å; L99-F104 HydrophobicContact CG-CD2 4.25Å; L99-F104 HydrophobicContact CG-CE2 3.89Å; L99-F104 PolarHBondContact O-N 3.4Å
100V92.3Very high90.5Very high67 Ų6792 Ų9241%0.40649%0.487SS..Iπ-helixtrans-63.3-45.4176.5174.40000111.2V96 F97 P98 F104 L105V96-V100 HydrophobicContact CG1-CG2 4.11Å; V96-V100 VanDerWaalsContact O-CG2 3.31Å; V96-V100 WeakPolarHBondContact O-CG2 3.25Å; V96-V100 PolarHBondContact O-N 3.3Å; F97-V100 PolarHBondContact O-N 3.41Å; P98-V100 VanDerWaalsContact C-N 3.34Å; P98-V100 PolarHBondContact O-N 3.42Å; V100-F104 HydrophobicContact CG2-CD2 4.26Å; V100-F104 PolarHBondContact O-N 2.8Å; V100-L105 WeakPolarHBondContact O-CB 3.42Å; V100-L105 PolarHBondContact O-N 3.12Å
101A92.1Very high90.1Very high49 Ų4990 Ų9041%0.40548%0.476SS..Iπ-helixtrans-67.1-41.1-177.800000113.6F97 P98 L105 P106F97-A101 WeakPolarHBondContact O-CB 3.46Å; F97-A101 PolarHBondContact O-N 3.14Å; P98-A101 PolarHBondContact O-N 2.89Å; A101-L105 WeakPolarHBondContact O-CB 3.21Å; A101-P106 WeakPolarHBondContact O-CD 3.26Å
102Y93.9Very high89.4Confident188 Ų18892.9 Ų92.974%0.73748%0.483SS*.Iπ-helixtrans-100.3-17-172.4-66.2-66.8000114.7P98 P106P98-Y102 HydrophobicContact CB-CD2 4.12Å; P98-Y102 HydrophobicContact CB-CE2 4.35Å; P98-Y102 WeakPolarHBondContact O-CB 3.38Å; P98-Y102 WeakPolarHBondContact O-CD2 3.27Å; P98-Y102 PolarHBondContact O-N 2.92Å; Y102-P106 WeakPolarHBondContact O-CG 3.38Å
103V92.3Very high88.7Confident78 Ų7892.1 Ų92.147%0.47347%0.472SS..Iπ-helixtrans-114.5-53.8-178.9-175.40000111.2L99 P106 V107L99-V103 HydrophobicContact CD1-CB 4.26Å; L99-V103 HydrophobicContact CD1-CG2 3.84Å; L99-V103 WeakPolarHBondContact O-CA 2.91Å; L99-V103 VanDerWaalsContact O-CB 3.23Å; L99-V103 WeakPolarHBondContact O-CB 3.36Å; L99-V103 PolarHBondContact O-N 3.24Å; V103-P106 WeakPolarHBondContact O-CG 3.24Å; V103-V107 WeakPolarHBondContact O-CG2 3.46Å
104F88.7Confident88.2Confident98 Ų9892.7 Ų92.743%0.4348%0.482SS..Iπ-helixtrans-77.2-43.7-174.7-70.1-82.7000112.8L99 V100 V107 M108L99-F104 HydrophobicContact CD2-CE2 3.92Å; L99-F104 HydrophobicContact CG-CD2 4.25Å; L99-F104 HydrophobicContact CG-CE2 3.89Å; L99-F104 PolarHBondContact O-N 3.4Å; V100-F104 HydrophobicContact CG2-CD2 4.26Å; V100-F104 PolarHBondContact O-N 2.8Å; F104-V107 PolarHBondContact O-N 2.98Å; F104-M108 HydrophobicContact CB-CE 4.49Å; F104-M108 HydrophobicContact CD1-CE 4.29Å; F104-M108 WeakPolarHBondContact O-CG 3.2Å; F104-M108 PolarHBondContact O-N 2.91Å
105L87.9Confident87.8Confident102 Ų10289.3 Ų89.353%0.53447%0.469SS..Hα-helixtrans-61.6-46.1-178.9-165.365.4000113.8V100 A101 V107 M108 H109V100-L105 WeakPolarHBondContact O-CB 3.42Å; V100-L105 PolarHBondContact O-N 3.12Å; A101-L105 WeakPolarHBondContact O-CB 3.21Å; L105-V107 PolarHBondContact O-N 2.89Å; L105-M108 PolarHBondContact O-N 2.97Å; L105-H109 VanDerWaalsContact O-CB 3.26Å; L105-H109 WeakPolarHBondContact O-CB 3.01Å; L105-H109 PolarHBondContact O-N 3.25Å
106P88.5Confident87.5Confident72 Ų7286.1 Ų86.147%0.46846%0.461SS..Hα-helixtrans-66.2-23.2178.124.3-33.6000113.4A101 Y102 V103 P110A101-P106 WeakPolarHBondContact O-CD 3.26Å; Y102-P106 WeakPolarHBondContact O-CG 3.38Å; V103-P106 WeakPolarHBondContact O-CG 3.24Å; P106-P110 WeakPolarHBondContact O-CD 3.44Å; P106-P110 WeakPolarHBondContact O-CG 3.32Å
107V87.2Confident87.2Confident66 Ų6686.4 Ų86.440%0.446%0.455SS..Hα-helixtrans-76.8-40.3173.7173.80000111.1V103 F104 L105 L111 Y119V103-V107 WeakPolarHBondContact O-CG2 3.46Å; F104-V107 PolarHBondContact O-N 2.98Å; L105-V107 PolarHBondContact O-N 2.89Å; V107-L111 WeakPolarHBondContact O-CD1 3.37Å; V107-Y119 HydrophobicContact CG1-CE2 4.06Å
108M84Confident86.9Confident53 Ų5383.7 Ų83.726%0.26144%0.444SS..Hα-helixtrans-82.9-34.9-175.7-66-173.3-168.200114F104 L105 L111 K112 V116F104-M108 HydrophobicContact CB-CE 4.49Å; F104-M108 HydrophobicContact CD1-CE 4.29Å; F104-M108 WeakPolarHBondContact O-CG 3.2Å; F104-M108 PolarHBondContact O-N 2.91Å; L105-M108 PolarHBondContact O-N 2.97Å; M108-L111 PolarHBondContact O-N 2.77Å; M108-K112 PolarHBondContact O-N 3.4Å; M108-V116 HydrophobicContact CE-CB 4.32Å; M108-V116 HydrophobicContact CE-CG1 3.71Å; M108-V116 HydrophobicContact CE-CG2 3.83Å; M108-V116 HydrophobicContact SD-CG2 3.86Å
109H81.9Confident86.5Confident144 Ų14484.3 Ų84.367%0.66744%0.44SS*.THydrogen-bonded Turntrans-56.3-48.3-177-174.5-96.1000114.5L105 L111 K112L105-H109 VanDerWaalsContact O-CB 3.26Å; L105-H109 WeakPolarHBondContact O-CB 3.01Å; L105-H109 PolarHBondContact O-N 3.25Å; H109-L111 VanDerWaalsContact C-N 3.28Å; H109-L111 PolarHBondContact O-N 3.24Å; H109-K112 PolarHBondContact O-N 2.97Å
110P81.5Confident86.2Confident91 Ų9182.2 Ų82.259%0.59143%0.429SS*.THydrogen-bonded Turntrans-68.5-26.9-179.226.8-34.7000113.1P106 K112P106-P110 WeakPolarHBondContact O-CD 3.44Å; P106-P110 WeakPolarHBondContact O-CG 3.32Å; P110-K112 VanDerWaalsContact C-N 3.3Å; P110-K112 PolarHBondContact O-N 3.35Å
111L80.2Confident86.1Confident76 Ų7681.5 Ų81.540%0.39842%0.421SS..THydrogen-bonded Turntrans-77.8-14.7-178.3-63.1170.7000112.9V107 M108 H109 L113 Y119 M122V107-L111 WeakPolarHBondContact O-CD1 3.37Å; M108-L111 PolarHBondContact O-N 2.77Å; H109-L111 VanDerWaalsContact C-N 3.28Å; H109-L111 PolarHBondContact O-N 3.24Å; L111-L113 HydrophobicContact CB-CD1 3.84Å; L111-L113 HydrophobicContact CB-CD2 4.17Å; L111-L113 HydrophobicContact CB-CG 3.63Å; L111-L113 HydrophobicContact CD1-CD1 4.04Å; L111-L113 PolarHBondContact O-N 3.15Å; L111-L113 VanDerWaalsContact O-N 3.12Å; L111-Y119 HydrophobicContact CD1-CD2 3.63Å; L111-Y119 HydrophobicContact CD1-CE2 3.81Å; L111-M122 HydrophobicContact CD1-CE 4.25Å
112K76.4Confident85.9Confident140 Ų14084 Ų8461%0.60943%0.426SS*.THydrogen-bonded Turntrans45.943.2179.1-62.6-176.6178.3179.30113.3M108 H109 P110M108-K112 PolarHBondContact O-N 3.4Å; H109-K112 PolarHBondContact O-N 2.97Å; P110-K112 VanDerWaalsContact C-N 3.3Å; P110-K112 PolarHBondContact O-N 3.35Å
113L78.5Confident85.6Confident32 Ų3283.4 Ų83.417%0.16842%0.422CS..  trans-78.8150-179-56.7172.5000110.6L111 E118 Y119 M122L111-L113 HydrophobicContact CB-CD1 3.84Å; L111-L113 HydrophobicContact CB-CD2 4.17Å; L111-L113 HydrophobicContact CB-CG 3.63Å; L111-L113 HydrophobicContact CD1-CD1 4.04Å; L111-L113 PolarHBondContact O-N 3.15Å; L111-L113 VanDerWaalsContact O-N 3.12Å; L113-E118 HydrophobicContact CB-CB 4.48Å; L113-E118 HydrophobicContact CD2-CB 4.45Å; L113-E118 HydrophobicContact CD2-CG 4.01Å; L113-Y119 HydrophobicContact CD1-CD2 4.17Å; L113-Y119 HydrophobicContact CD1-CG 4.34Å; L113-M122 HydrophobicContact CD1-CE 3.43Å; L113-M122 VanDerWaalsContact CD1-CE 3.43Å; L113-M122 HydrophobicContact CD2-CE 3.35Å; L113-M122 HydrophobicContact CD2-SD 4Å; L113-M122 HydrophobicContact CG-CE 3.97Å
114T80.7Confident85.4Confident82 Ų8286 Ų8650%0.50343%0.427SS..SBendtrans-84.6-24.6179.8-45.90000111L47 E118L47-T114 HydrophobicContact CD1-CG2 4.42Å; T114-E118 PolarHBondContact N-OE2 3.43Å; T114-E118 VanDerWaalsContact N-OE2 3.09Å
115S85.2Confident85.4Confident52 Ų5284.9 Ų84.936%0.36443%0.426SS..  trans-147.7152.4179.669.70000112.3Y117 E118S115-Y117 PolarHBondContact O-N 3.32Å; S115-E118 VanDerWaalsContact O-CB 3.28Å; S115-E118 WeakPolarHBondContact O-CB 3.42Å; S115-E118 PolarHBondContact O-N 3.19Å; S115-E118 VanDerWaalsContact O-N 3.11Å; S115-E118 PolarHBondContact OG-N 3.05Å
116V87.5Confident85.6Confident77 Ų7786.5 Ų86.547%0.46743%0.428SS..Hα-helixtrans-60.8-30.4173.1-177.30000111.7M108 E118 Y119 L120M108-V116 HydrophobicContact CE-CB 4.32Å; M108-V116 HydrophobicContact CE-CG1 3.71Å; M108-V116 HydrophobicContact CE-CG2 3.83Å; M108-V116 HydrophobicContact SD-CG2 3.86Å; V116-E118 VanDerWaalsContact C-N 3.27Å; V116-E118 PolarHBondContact O-N 3.42Å; V116-Y119 WeakPolarHBondContact O-CB 3.11Å; V116-Y119 PolarHBondContact O-N 2.97Å; V116-Y119 VanDerWaalsContact O-N 3.16Å; V116-L120 PolarHBondContact O-N 3.24Å
117Y89Confident85.7Confident73 Ų7387.5 Ų87.529%0.28643%0.433SS..Hα-helixtrans-64.5-31176.6-60.9-65.4000112.8S115 Y119 L120 Q121 R129 A132 A133 F136S115-Y117 PolarHBondContact O-N 3.32Å; Y117-Y119 VanDerWaalsContact C-N 3.33Å; Y117-L120 HydrophobicContact CD1-CD1 4.36Å; Y117-L120 PolarHBondContact O-N 2.73Å; Y117-Q121 PolarHBondContact O-N 3.3Å; Y117-R129 WeakPolarHBondContact O-CG 2.91Å; Y117-A132 HydrophobicContact CD1-CB 4.22Å; Y117-A132 HydrophobicContact CE1-CB 4.15Å; Y117-A133 HydrophobicContact CD1-CB 4.42Å; Y117-A133 HydrophobicContact CE1-CB 4.3Å; Y117-F136 VanDerWaalsContact OH-CB 3.26Å; Y117-F136 WeakPolarHBondContact OH-CB 3.43Å; Y117-F136 WeakPolarHBondContact OH-CD1 3.29Å; Y117-F136 WeakPolarHBondContact OH-CG 3.32Å
118E86.7Confident85.9Confident72 Ų7286.7 Ų86.734%0.33643%0.429SS..Hα-helixtrans-65.3-39.2174.3-164.2175.8-177.900111.1L113 T114 S115 V116 L120 Q121 M122L113-E118 HydrophobicContact CB-CB 4.48Å; L113-E118 HydrophobicContact CD2-CB 4.45Å; L113-E118 HydrophobicContact CD2-CG 4.01Å; T114-E118 PolarHBondContact N-OE2 3.43Å; T114-E118 VanDerWaalsContact N-OE2 3.09Å; S115-E118 VanDerWaalsContact O-CB 3.28Å; S115-E118 WeakPolarHBondContact O-CB 3.42Å; S115-E118 PolarHBondContact O-N 3.19Å; S115-E118 VanDerWaalsContact O-N 3.11Å; S115-E118 PolarHBondContact OG-N 3.05Å; V116-E118 VanDerWaalsContact C-N 3.27Å; V116-E118 PolarHBondContact O-N 3.42Å; E118-L120 PolarHBondContact O-N 3.34Å; E118-Q121 WeakPolarHBondContact O-CB 3.12Å; E118-Q121 PolarHBondContact O-N 3.38Å; E118-M122 WeakPolarHBondContact O-CG 3.4Å; E118-M122 PolarHBondContact O-N 3.21Å
119Y88.3Confident86.3Confident72 Ų7288.5 Ų88.528%0.28243%0.432SS..Hα-helixtrans-60.7-45.4173.3179-108.6000111.7V107 L111 L113 V116 Y117 Q121 M122 R123V107-Y119 HydrophobicContact CG1-CE2 4.06Å; L111-Y119 HydrophobicContact CD1-CD2 3.63Å; L111-Y119 HydrophobicContact CD1-CE2 3.81Å; L113-Y119 HydrophobicContact CD1-CD2 4.17Å; L113-Y119 HydrophobicContact CD1-CG 4.34Å; V116-Y119 WeakPolarHBondContact O-CB 3.11Å; V116-Y119 PolarHBondContact O-N 2.97Å; V116-Y119 VanDerWaalsContact O-N 3.16Å; Y117-Y119 VanDerWaalsContact C-N 3.33Å; Y119-Q121 VanDerWaalsContact C-N 3.27Å; Y119-Q121 PolarHBondContact O-N 3.15Å; Y119-M122 HydrophobicContact CD2-CE 4.37Å; Y119-M122 PolarHBondContact O-N 3.44Å; Y119-R123 WeakPolarHBondContact O-CB 3.43Å; Y119-R123 PolarHBondContact O-N 2.95Å
120L87.3Confident86.8Confident42 Ų4287.3 Ų87.322%0.2243%0.427CS..Hα-helixtrans-60.4-38176.6-70.1175.7000112.1V116 Y117 E118 F124 A132V116-L120 PolarHBondContact O-N 3.24Å; Y117-L120 HydrophobicContact CD1-CD1 4.36Å; Y117-L120 PolarHBondContact O-N 2.73Å; E118-L120 PolarHBondContact O-N 3.34Å; L120-F124 HydrophobicContact CD2-CD2 4.25Å; L120-F124 HydrophobicContact CD2-CE2 4.19Å; L120-F124 WeakPolarHBondContact O-CB 3.24Å; L120-F124 PolarHBondContact O-N 3.24Å; L120-A132 HydrophobicContact CD1-CB 3.74Å
121Q90.1Very high87.4Confident52 Ų5288.1 Ų88.124%0.24343%0.426CS..Hα-helixtrans-65.9-43.3175.7-178-176.2-36.400112.7Y117 E118 Y119 F124 N125 K126 R129Y117-Q121 PolarHBondContact O-N 3.3Å; E118-Q121 WeakPolarHBondContact O-CB 3.12Å; E118-Q121 PolarHBondContact O-N 3.38Å; Y119-Q121 VanDerWaalsContact C-N 3.27Å; Y119-Q121 PolarHBondContact O-N 3.15Å; Q121-F124 CarbonylContact O-C 3.55Å; Q121-N125 WeakPolarHBondContact CA-O 3.48Å; Q121-N125 WeakPolarHBondContact O-CA 3.31Å; Q121-N125 PolarHBondContact O-N 3.23Å; Q121-K126 HydrophobicContact CG-CG 3.83Å; Q121-R129 HydrophobicContact CB-CB 4.07Å; Q121-R129 HydrophobicContact CB-CG 4.39Å; Q121-R129 VanDerWaalsContact OE1-CD 3.26Å; Q121-R129 VanDerWaalsContact OE1-CZ 3.3Å
122M87.5Confident88Confident103 Ų10385.7 Ų85.751%0.50742%0.417SS..Hα-helixtrans-68.8-39180-68.9-169.4-54.400112.1L111 L113 E118 Y119L111-M122 HydrophobicContact CD1-CE 4.25Å; L113-M122 HydrophobicContact CD1-CE 3.43Å; L113-M122 VanDerWaalsContact CD1-CE 3.43Å; L113-M122 HydrophobicContact CD2-CE 3.35Å; L113-M122 HydrophobicContact CD2-SD 4Å; L113-M122 HydrophobicContact CG-CE 3.97Å; E118-M122 WeakPolarHBondContact O-CG 3.4Å; E118-M122 PolarHBondContact O-N 3.21Å; Y119-M122 HydrophobicContact CD2-CE 4.37Å; Y119-M122 PolarHBondContact O-N 3.44Å
123R87.5Confident88.8Confident175 Ų17580.6 Ų80.666%0.6640%0.401SS*.Hα-helixtrans-77.4-36.9-178.718056.9-179.9168.9-0.4112.8Y119Y119-R123 WeakPolarHBondContact O-CB 3.43Å; Y119-R123 PolarHBondContact O-N 2.95Å
124F88.2Confident89.6Confident133 Ų13385.9 Ų85.958%0.58342%0.423SS*.THydrogen-bonded Turntrans-113.9-95.1-180-59.2-80.4000109.7L120 Q121 V128L120-F124 HydrophobicContact CD2-CD2 4.25Å; L120-F124 HydrophobicContact CD2-CE2 4.19Å; L120-F124 WeakPolarHBondContact O-CB 3.24Å; L120-F124 PolarHBondContact O-N 3.24Å; Q121-F124 CarbonylContact O-C 3.55Å; F124-V128 HydrophobicContact CB-CB 3.98Å; F124-V128 HydrophobicContact CB-CG1 4.27Å; F124-V128 HydrophobicContact CB-CG2 3.84Å; F124-V128 HydrophobicContact CD2-CG1 4.17Å; F124-V128 HydrophobicContact CG-CG1 4.38Å; F124-V128 HydrophobicContact CG-CG2 4.36Å
125N90.2Very high90.2Very high74 Ų7486.3 Ų86.340%0.39642%0.421SS..  trans-164.6177.1179.861.513.8000111.1Q121 T127 V128 R129Q121-N125 WeakPolarHBondContact CA-O 3.48Å; Q121-N125 WeakPolarHBondContact O-CA 3.31Å; Q121-N125 PolarHBondContact O-N 3.23Å; N125-T127 PolarHBondContact O-N 3.12Å; N125-T127 WeakPolarHBondContact OD1-CB 3.46Å; N125-T127 PolarHBondContact OD1-N 2.85Å; N125-V128 PolarHBondContact O-N 3.45Å; N125-V128 WeakPolarHBondContact OD1-CG2 3.14Å; N125-V128 PolarHBondContact OD1-N 3.08Å; N125-R129 PolarHBondContact O-N 3.27Å
126K90.9Very high90.6Very high135 Ų13589.2 Ų89.259%0.58743%0.427SS*.Hα-helixtrans-61.5-29.9176.5-66.5-178.4-177.4178.30113.1Q121 R129 Q130Q121-K126 HydrophobicContact CG-CG 3.83Å; K126-R129 WeakPolarHBondContact O-CB 3.42Å; K126-R129 PolarHBondContact O-N 3.42Å; K126-Q130 WeakPolarHBondContact O-CG 3.37Å; K126-Q130 PolarHBondContact O-N 3Å
127T91.7Very high90.9Very high93 Ų9388.9 Ų88.957%0.57143%0.428SS*.Hα-helixtrans-66.8-47.2179.8-48.80000111.7N125 R129 Q130 L131N125-T127 PolarHBondContact O-N 3.12Å; N125-T127 WeakPolarHBondContact OD1-CB 3.46Å; N125-T127 PolarHBondContact OD1-N 2.85Å; T127-R129 VanDerWaalsContact C-N 3.28Å; T127-R129 PolarHBondContact O-N 3.47Å; T127-Q130 PolarHBondContact O-N 2.86Å; T127-L131 WeakPolarHBondContact O-CB 3.47Å; T127-L131 PolarHBondContact O-N 3.41Å
128V91Very high91.2Very high50 Ų5091.4 Ų91.430%0.30344%0.441SS..Hα-helixtrans-62-38.9176174.20000110.7F124 N125 Q130 L131 A132F124-V128 HydrophobicContact CB-CB 3.98Å; F124-V128 HydrophobicContact CB-CG1 4.27Å; F124-V128 HydrophobicContact CB-CG2 3.84Å; F124-V128 HydrophobicContact CD2-CG1 4.17Å; F124-V128 HydrophobicContact CG-CG1 4.38Å; F124-V128 HydrophobicContact CG-CG2 4.36Å; N125-V128 PolarHBondContact O-N 3.45Å; N125-V128 WeakPolarHBondContact OD1-CG2 3.14Å; N125-V128 PolarHBondContact OD1-N 3.08Å; V128-Q130 PolarHBondContact O-N 2.72Å; V128-L131 PolarHBondContact O-N 2.73Å; V128-A132 VanDerWaalsContact O-CB 3.29Å; V128-A132 WeakPolarHBondContact O-CB 3.06Å; V128-A132 PolarHBondContact O-N 2.97Å
129R91.6Very high91.4Very high90 Ų9092.5 Ų92.534%0.3445%0.446SS..Hα-helixtrans-56.7-51.4173.4-173.9-17073.9174.612.9111.8Y117 Q121 N125 K126 T127 A132 A133Y117-R129 WeakPolarHBondContact O-CG 2.91Å; Q121-R129 HydrophobicContact CB-CB 4.07Å; Q121-R129 HydrophobicContact CB-CG 4.39Å; Q121-R129 VanDerWaalsContact OE1-CD 3.26Å; Q121-R129 VanDerWaalsContact OE1-CZ 3.3Å; N125-R129 PolarHBondContact O-N 3.27Å; K126-R129 WeakPolarHBondContact O-CB 3.42Å; K126-R129 PolarHBondContact O-N 3.42Å; T127-R129 VanDerWaalsContact C-N 3.28Å; T127-R129 PolarHBondContact O-N 3.47Å; R129-A132 PolarHBondContact O-N 3.45Å; R129-A133 WeakPolarHBondContact O-CB 3.26Å; R129-A133 PolarHBondContact O-N 3.18Å
130Q92.4Very high91.5Very high120 Ų12091.5 Ų91.556%0.56145%0.447SS*.Hα-helixtrans-65.2-42-178.2-74.1174-31.700111.7K126 T127 V128 A133 F134K126-Q130 WeakPolarHBondContact O-CG 3.37Å; K126-Q130 PolarHBondContact O-N 3Å; T127-Q130 PolarHBondContact O-N 2.86Å; V128-Q130 PolarHBondContact O-N 2.72Å; Q130-A133 PolarHBondContact O-N 2.92Å; Q130-F134 VanDerWaalsContact O-CB 3.3Å; Q130-F134 WeakPolarHBondContact O-CB 3.47Å; Q130-F134 PolarHBondContact O-N 3.31Å
131L93.9Very high91.7Very high107 Ų10794.6 Ų94.656%0.5647%0.467SS*.Hα-helixtrans-62.5-46.9176.7-169.979.6000111.4T127 V128 A133 F134 I135T127-L131 WeakPolarHBondContact O-CB 3.47Å; T127-L131 PolarHBondContact O-N 3.41Å; V128-L131 PolarHBondContact O-N 2.73Å; L131-A133 PolarHBondContact O-N 3.32Å; L131-F134 PolarHBondContact O-N 3.27Å; L131-I135 HydrophobicContact CD2-CD1 4.31Å; L131-I135 HydrophobicContact CG-CD1 3.97Å; L131-I135 VanDerWaalsContact O-CG1 3.28Å; L131-I135 WeakPolarHBondContact O-CG1 3.45Å; L131-I135 PolarHBondContact O-N 3.02Å
132A92.8Very high91.6Very high26 Ų26100.4 Ų100.422%0.21549%0.487CS..Hα-helixtrans-62.4-44.2178.600000111.8Y117 L120 V128 R129 F134 I135 F136Y117-A132 HydrophobicContact CD1-CB 4.22Å; Y117-A132 HydrophobicContact CE1-CB 4.15Å; L120-A132 HydrophobicContact CD1-CB 3.74Å; V128-A132 VanDerWaalsContact O-CB 3.29Å; V128-A132 WeakPolarHBondContact O-CB 3.06Å; V128-A132 PolarHBondContact O-N 2.97Å; R129-A132 PolarHBondContact O-N 3.45Å; A132-F134 VanDerWaalsContact C-N 3.32Å; A132-F134 PolarHBondContact O-N 3.4Å; A132-I135 PolarHBondContact O-N 3.16Å; A132-F136 WeakPolarHBondContact O-CB 3.5Å; A132-F136 PolarHBondContact O-N 3.33Å
133A93.7Very high91.6Very high33 Ų3399 Ų9927%0.27349%0.485SS..Hα-helixtrans-61.4-41.5174.500000111.6Y117 R129 Q130 L131 F136 C137Y117-A133 HydrophobicContact CD1-CB 4.42Å; Y117-A133 HydrophobicContact CE1-CB 4.3Å; R129-A133 WeakPolarHBondContact O-CB 3.26Å; R129-A133 PolarHBondContact O-N 3.18Å; Q130-A133 PolarHBondContact O-N 2.92Å; L131-A133 PolarHBondContact O-N 3.32Å; A133-F136 PolarHBondContact O-N 2.88Å; A133-C137 PolarHBondContact O-N 3.13Å; A133-C137 PolarHBondContact O-SG 2.89Å
134F95.3Very high91.5Very high143 Ų14397.2 Ų97.263%0.62748%0.479SS*.Hα-helixtrans-65.9-44.6178.1-173.1-97.8000112.5Q130 L131 A132 F136 C137 F138Q130-F134 VanDerWaalsContact O-CB 3.3Å; Q130-F134 WeakPolarHBondContact O-CB 3.47Å; Q130-F134 PolarHBondContact O-N 3.31Å; L131-F134 PolarHBondContact O-N 3.27Å; A132-F134 VanDerWaalsContact C-N 3.32Å; A132-F134 PolarHBondContact O-N 3.4Å; F134-F136 VanDerWaalsContact C-N 3.29Å; F134-F136 PolarHBondContact O-N 3.15Å; F134-C137 PolarHBondContact O-N 2.95Å; F134-F138 WeakPolarHBondContact O-CB 3.49Å; F134-F138 PolarHBondContact O-N 3.42Å
135I94.4Very high91.3Very high90 Ų9094.6 Ų94.646%0.46248%0.475SS..Hα-helixtrans-59.1-44174.3-68.7165.4000110L131 A132 F138 Q139L131-I135 HydrophobicContact CD2-CD1 4.31Å; L131-I135 HydrophobicContact CG-CD1 3.97Å; L131-I135 VanDerWaalsContact O-CG1 3.28Å; L131-I135 WeakPolarHBondContact O-CG1 3.45Å; L131-I135 PolarHBondContact O-N 3.02Å; A132-I135 PolarHBondContact O-N 3.16Å; I135-F138 PolarHBondContact O-N 3.45Å; I135-Q139 HydrophobicContact CG2-CG 4.3Å; I135-Q139 WeakPolarHBondContact O-CB 3.22Å; I135-Q139 WeakPolarHBondContact O-CG 3.29Å; I135-Q139 PolarHBondContact O-N 2.92Å
136F92.7Very high90.9Very high113 Ų11396.8 Ų96.850%0.49648%0.481SS..Hα-helixtrans-61.9-46.9176.7177.9-101.4000112Y117 A132 A133 F134 F138 Q139 V140Y117-F136 VanDerWaalsContact OH-CB 3.26Å; Y117-F136 WeakPolarHBondContact OH-CB 3.43Å; Y117-F136 WeakPolarHBondContact OH-CD1 3.29Å; Y117-F136 WeakPolarHBondContact OH-CG 3.32Å; A132-F136 WeakPolarHBondContact O-CB 3.5Å; A132-F136 PolarHBondContact O-N 3.33Å; A133-F136 PolarHBondContact O-N 2.88Å; F134-F136 VanDerWaalsContact C-N 3.29Å; F134-F136 PolarHBondContact O-N 3.15Å; F136-F138 VanDerWaalsContact C-N 3.32Å; F136-F138 PolarHBondContact O-N 2.89Å; F136-Q139 WeakPolarHBondContact O-CB 3.41Å; F136-Q139 PolarHBondContact O-N 3.37Å; F136-V140 HydrophobicContact CD1-CG2 4.23Å; F136-V140 HydrophobicContact CD2-CG2 4.41Å; F136-V140 HydrophobicContact CE1-CG2 3.77Å; F136-V140 HydrophobicContact CE2-CG2 3.97Å; F136-V140 HydrophobicContact CZ-CG2 3.63Å; F136-V140 WeakPolarHBondContact O-CG2 2.88Å; F136-V140 PolarHBondContact O-N 3.37Å
137C94.1Very high90.3Very high71 Ų7192 Ų9248%0.4846%0.462SS..Hα-helixtrans-57.8-45.7175.4-70.70000111.6A133 F134 Q139 V140 V141A133-C137 PolarHBondContact O-N 3.13Å; A133-C137 PolarHBondContact O-SG 2.89Å; F134-C137 PolarHBondContact O-N 2.95Å; C137-Q139 VanDerWaalsContact C-N 3.34Å; C137-Q139 PolarHBondContact O-N 3.46Å; C137-V140 PolarHBondContact O-N 2.94Å; C137-V141 WeakPolarHBondContact O-CB 3.44Å; C137-V141 VanDerWaalsContact O-CG2 3.26Å; C137-V141 WeakPolarHBondContact O-CG2 3.28Å; C137-V141 PolarHBondContact O-N 3Å
138F94.8Very high89.6Confident126 Ų12690.2 Ų90.255%0.55345%0.451SS*.Hα-helixtrans-61.7-42.8177.5-175.9-98.8000112.1F134 I135 F136 V141 R142F134-F138 WeakPolarHBondContact O-CB 3.49Å; F134-F138 PolarHBondContact O-N 3.42Å; I135-F138 PolarHBondContact O-N 3.45Å; F136-F138 VanDerWaalsContact C-N 3.32Å; F136-F138 PolarHBondContact O-N 2.89Å; F138-V141 PolarHBondContact O-N 3.23Å; F138-R142 WeakPolarHBondContact O-CB 3.17Å; F138-R142 PolarHBondContact O-N 3.07Å
139Q91.9Very high89Confident95 Ų9590.7 Ų90.744%0.44446%0.457SS..Hα-helixtrans-60.3-49.8174.9-71.5-78.364.100110.9I135 F136 C137 V141 R142 T143I135-Q139 HydrophobicContact CG2-CG 4.3Å; I135-Q139 WeakPolarHBondContact O-CB 3.22Å; I135-Q139 WeakPolarHBondContact O-CG 3.29Å; I135-Q139 PolarHBondContact O-N 2.92Å; F136-Q139 WeakPolarHBondContact O-CB 3.41Å; F136-Q139 PolarHBondContact O-N 3.37Å; C137-Q139 VanDerWaalsContact C-N 3.34Å; C137-Q139 PolarHBondContact O-N 3.46Å; Q139-V141 VanDerWaalsContact C-N 3.35Å; Q139-V141 PolarHBondContact O-N 3.47Å; Q139-R142 PolarHBondContact O-N 2.93Å; Q139-R142 VanDerWaalsContact O-N 3.15Å; Q139-T143 VanDerWaalsContact O-CB 3.29Å; Q139-T143 WeakPolarHBondContact O-CB 3.4Å; Q139-T143 PolarHBondContact O-N 3.46Å; Q139-T143 PolarHBondContact O-OG1 3.4Å
140V90.4Very high88Confident51 Ų5188.9 Ų88.931%0.30945%0.451SS..Hα-helixtrans-58.8-46.2178.4172.30000111.4F136 C137 R142 T143 Y144F136-V140 HydrophobicContact CD1-CG2 4.23Å; F136-V140 HydrophobicContact CD2-CG2 4.41Å; F136-V140 HydrophobicContact CE1-CG2 3.77Å; F136-V140 HydrophobicContact CE2-CG2 3.97Å; F136-V140 HydrophobicContact CZ-CG2 3.63Å; F136-V140 WeakPolarHBondContact O-CG2 2.88Å; F136-V140 PolarHBondContact O-N 3.37Å; C137-V140 PolarHBondContact O-N 2.94Å; V140-R142 VanDerWaalsContact C-N 3.28Å; V140-R142 PolarHBondContact O-N 2.82Å; V140-T143 PolarHBondContact O-N 3.34Å; V140-Y144 HydrophobicContact CG1-CD2 3.77Å; V140-Y144 HydrophobicContact CG1-CE2 4Å; V140-Y144 PolarHBondContact O-N 3.47Å
141V91.6Very high87.2Confident106 Ų10685.9 Ų85.964%0.64244%0.438SS*.Hα-helixtrans-61.6-35.6178.61700000111.8C137 F138 Q139 P145C137-V141 WeakPolarHBondContact O-CB 3.44Å; C137-V141 VanDerWaalsContact O-CG2 3.26Å; C137-V141 WeakPolarHBondContact O-CG2 3.28Å; C137-V141 PolarHBondContact O-N 3Å; F138-V141 PolarHBondContact O-N 3.23Å; Q139-V141 VanDerWaalsContact C-N 3.35Å; Q139-V141 PolarHBondContact O-N 3.47Å; V141-P145 WeakPolarHBondContact O-CD 3.48Å; V141-P145 VanDerWaalsContact O-CG 3.32Å; V141-P145 WeakPolarHBondContact O-CG 3.34Å
142R88.1Confident86.2Confident175 Ų17586.4 Ų86.466%0.6644%0.438SS*.Hα-helixtrans-76.8-39.6175.1177.5-176.3151.3159-3.7112.5F138 Q139 V140F138-R142 WeakPolarHBondContact O-CB 3.17Å; F138-R142 PolarHBondContact O-N 3.07Å; Q139-R142 PolarHBondContact O-N 2.93Å; Q139-R142 VanDerWaalsContact O-N 3.15Å; V140-R142 VanDerWaalsContact C-N 3.28Å; V140-R142 PolarHBondContact O-N 2.82Å
143T86Confident85.2Confident74 Ų7487 Ų8745%0.45444%0.442SS..Hα-helixtrans-72.2-37.9-174.1-620000111.9Q139 V140 F146 L147Q139-T143 VanDerWaalsContact O-CB 3.29Å; Q139-T143 WeakPolarHBondContact O-CB 3.4Å; Q139-T143 PolarHBondContact O-N 3.46Å; Q139-T143 PolarHBondContact O-OG1 3.4Å; V140-T143 PolarHBondContact O-N 3.34Å; T143-F146 PolarHBondContact O-N 2.87Å; T143-L147 WeakPolarHBondContact O-CB 2.97Å; T143-L147 PolarHBondContact O-N 2.96Å
144Y85Confident84.1Confident137 Ų13785.7 Ų85.754%0.53743%0.433SS..Hα-helixtrans-59.3-54.2-179-105.8-94.3000113.2V140 F146 L147 T148V140-Y144 HydrophobicContact CG1-CD2 3.77Å; V140-Y144 HydrophobicContact CG1-CE2 4Å; V140-Y144 PolarHBondContact O-N 3.47Å; Y144-F146 VanDerWaalsContact C-N 3.27Å; Y144-F146 PolarHBondContact O-N 3.34Å; Y144-L147 PolarHBondContact O-N 2.85Å; Y144-L147 VanDerWaalsContact O-N 3.16Å; Y144-T148 PolarHBondContact O-N 2.76Å; Y144-T148 PolarHBondContact O-OG1 3.23Å
145P83.9Confident83Confident78 Ų7884.8 Ų84.851%0.50643%0.429SS..Hα-helixtrans-60.9-35.5177.2-24.634.9000113.2V141 T148 S149V141-P145 WeakPolarHBondContact O-CD 3.48Å; V141-P145 VanDerWaalsContact O-CG 3.32Å; V141-P145 WeakPolarHBondContact O-CG 3.34Å; P145-T148 PolarHBondContact O-N 3.34Å; P145-S149 PolarHBondContact O-N 3.41Å; P145-S149 PolarHBondContact O-OG 3.48Å
146F82.8Confident82Confident119 Ų11984.4 Ų84.452%0.52243%0.43SS..Hα-helixtrans-65.2-39.7176177.7-101.8000112.2T143 Y144 S149 K150T143-F146 PolarHBondContact O-N 2.87Å; Y144-F146 VanDerWaalsContact C-N 3.27Å; Y144-F146 PolarHBondContact O-N 3.34Å; F146-S149 PolarHBondContact O-OG 2.85Å; F146-K150 HydrophobicContact CD1-CD 4.42Å; F146-K150 HydrophobicContact CE1-CD 3.92Å; F146-K150 HydrophobicContact CZ-CD 4.27Å; F146-K150 VanDerWaalsContact CZ-CE 3.42Å; F146-K150 WeakPolarHBondContact O-CG 3.44Å; F146-K150 PolarHBondContact O-N 3.37Å; F146-K150 VanDerWaalsContact O-N 3.13Å
147L77.5Confident80.8Confident36 Ų3683.6 Ų83.619%0.18843%0.425CS..Hα-helixtrans-70.7-37.8176.1-167.167.6000111.2V70 T143 Y144 K150 L151V70-L147 HydrophobicContact CB-CD2 3.65Å; V70-L147 HydrophobicContact CB-CG 4.12Å; V70-L147 HydrophobicContact CG1-CB 4.34Å; V70-L147 HydrophobicContact CG1-CD2 3.62Å; V70-L147 HydrophobicContact CG1-CG 3.5Å; V70-L147 VanDerWaalsContact CG1-CG 3.5Å; T143-L147 WeakPolarHBondContact O-CB 2.97Å; T143-L147 PolarHBondContact O-N 2.96Å; Y144-L147 PolarHBondContact O-N 2.85Å; Y144-L147 VanDerWaalsContact O-N 3.16Å; L147-K150 WeakPolarHBondContact O-CB 3.45Å; L147-K150 PolarHBondContact O-N 2.99Å; L147-L151 PolarHBondContact O-N 3.17Å
148T78.2Confident79.5Confident54 Ų5486 Ų8633%0.33143%0.427SS..Hα-helixtrans-64.1-41.6173.9-61.10000111.8Y144 P145 K150 L151 H152Y144-T148 PolarHBondContact O-N 2.76Å; Y144-T148 PolarHBondContact O-OG1 3.23Å; P145-T148 PolarHBondContact O-N 3.34Å; T148-K150 VanDerWaalsContact C-N 3.32Å; T148-K150 PolarHBondContact O-N 3.45Å; T148-L151 WeakPolarHBondContact O-CB 2.83Å; T148-L151 PolarHBondContact O-N 2.98Å; T148-L151 VanDerWaalsContact O-N 3.17Å; T148-H152 WeakPolarHBondContact CG2-CE1 2.91Å; T148-H152 PolarHBondContact O-N 2.86Å; T148-H152 PolarHBondContact O-ND1 3.37Å
149S76.9Confident78.2Confident61 Ų6183.3 Ų83.343%0.42742%0.419SS..Hα-helixtrans-65.9-35.4176.766.50000112P145 F146 H152 A153P145-S149 PolarHBondContact O-N 3.41Å; P145-S149 PolarHBondContact O-OG 3.48Å; F146-S149 PolarHBondContact O-OG 2.85Å; S149-H152 PolarHBondContact O-N 3.04Å; S149-A153 WeakPolarHBondContact O-CB 3.49Å; S149-A153 PolarHBondContact O-N 2.88Å
150K72.4Confident77.1Confident51 Ų5182.3 Ų82.322%0.22242%0.416CS..Hα-helixtrans-61.3-41.6169.4-76.6-175.8162.1-157.60112.7E78 F146 L147 T148 A153 G154E78-K150 IonicContact OE1-NZ 2.72Å; E78-K150 PolarHBondContact OE1-NZ 2.82Å; E78-K150 WeakPolarHBondContact OE2-CD 3.37Å; E78-K150 WeakPolarHBondContact OE2-CE 3.38Å; E78-K150 IonicContact OE2-NZ 2.73Å; E78-K150 PolarHBondContact OE2-NZ 3.38Å; F146-K150 HydrophobicContact CD1-CD 4.42Å; F146-K150 HydrophobicContact CE1-CD 3.92Å; F146-K150 HydrophobicContact CZ-CD 4.27Å; F146-K150 VanDerWaalsContact CZ-CE 3.42Å; F146-K150 WeakPolarHBondContact O-CG 3.44Å; F146-K150 PolarHBondContact O-N 3.37Å; F146-K150 VanDerWaalsContact O-N 3.13Å; L147-K150 WeakPolarHBondContact O-CB 3.45Å; L147-K150 PolarHBondContact O-N 2.99Å; T148-K150 VanDerWaalsContact C-N 3.32Å; T148-K150 PolarHBondContact O-N 3.45Å; K150-A153 PolarHBondContact O-N 3.19Å; K150-G154 PolarHBondContact O-N 2.9Å
151L75.7Confident75.9Confident57 Ų5785 Ų8530%0.29842%0.424SS..Hα-helixtrans-63.1-43.1175.6-173.472000111.4V70 M73 L147 T148 G154 F155V70-L151 HydrophobicContact CG1-CB 4.27Å; V70-L151 HydrophobicContact CG1-CD2 4.3Å; M73-L151 HydrophobicContact CB-CD1 3.85Å; L147-L151 PolarHBondContact O-N 3.17Å; T148-L151 WeakPolarHBondContact O-CB 2.83Å; T148-L151 PolarHBondContact O-N 2.98Å; T148-L151 VanDerWaalsContact O-N 3.17Å; L151-G154 PolarHBondContact O-N 3.47Å; L151-F155 WeakPolarHBondContact O-CB 3.43Å; L151-F155 PolarHBondContact O-N 3.29Å
152H72.9Confident74.8Confident118 Ų11884.7 Ų84.755%0.54642%0.422SS..Hα-helixtrans-63.3-45.6175.7-73.688.9000111.6T148 S149 G154 F155 V156T148-H152 WeakPolarHBondContact CG2-CE1 2.91Å; T148-H152 PolarHBondContact O-N 2.86Å; T148-H152 PolarHBondContact O-ND1 3.37Å; S149-H152 PolarHBondContact O-N 3.04Å; H152-G154 VanDerWaalsContact C-N 3.32Å; H152-G154 PolarHBondContact O-N 2.76Å; H152-F155 PolarHBondContact O-N 3.24Å; H152-V156 VanDerWaalsContact O-CG2 3.29Å; H152-V156 WeakPolarHBondContact O-CG2 3.38Å; H152-V156 PolarHBondContact O-N 2.86Å
153A70.6Confident73.7Confident38 Ų3883.3 Ų83.331%0.31442%0.423SS..Hα-helixtrans-58.8-46.9175.200000110.4S149 K150 F155 V156 Y157S149-A153 WeakPolarHBondContact O-CB 3.49Å; S149-A153 PolarHBondContact O-N 2.88Å; K150-A153 PolarHBondContact O-N 3.19Å; A153-F155 VanDerWaalsContact C-N 3.33Å; A153-F155 PolarHBondContact O-N 2.93Å; A153-V156 PolarHBondContact O-N 3.25Å; A153-Y157 VanDerWaalsContact C-CD2 3.45Å; A153-Y157 HydrophobicContact CB-CD2 4.26Å; A153-Y157 HydrophobicContact CB-CE2 3.89Å; A153-Y157 WeakPolarHBondContact O-CB 3.39Å; A153-Y157 WeakPolarHBondContact O-CD2 3.33Å; A153-Y157 VanDerWaalsContact O-CG 3.3Å; A153-Y157 PolarHBondContact O-N 3.34Å
154G71.6Confident72.8Confident7 Ų786.9 Ų86.97%0.07243%0.429CS..Hα-helixtrans-59-40.417600000113.7S77 K150 L151 H152 F158S77-G154 WeakPolarHBondContact OG-CA 3.43Å; K150-G154 PolarHBondContact O-N 2.9Å; L151-G154 PolarHBondContact O-N 3.47Å; H152-G154 VanDerWaalsContact C-N 3.32Å; H152-G154 PolarHBondContact O-N 2.76Å; G154-F158 WeakPolarHBondContact O-CB 3.29Å; G154-F158 PolarHBondContact O-N 2.88Å
155F71.5Confident71.6Confident123 Ų12383.4 Ų83.454%0.53944%0.435SS..Hα-helixtrans-67.4-43.6174.8-162.8-101.2000111.8L151 H152 A153 F158 N159L151-F155 WeakPolarHBondContact O-CB 3.43Å; L151-F155 PolarHBondContact O-N 3.29Å; H152-F155 PolarHBondContact O-N 3.24Å; A153-F155 VanDerWaalsContact C-N 3.33Å; A153-F155 PolarHBondContact O-N 2.93Å; F155-F158 PolarHBondContact O-N 3.43Å; F155-N159 WeakPolarHBondContact CD1-ND2 3Å; F155-N159 WeakPolarHBondContact CE1-ND2 3.31Å; F155-N159 PolarHBondContact O-N 3.49Å; F155-N159 PolarHBondContact O-ND2 2.85Å
156V72.7Confident70.2Confident82 Ų8290 Ų9050%0.49746%0.456SS..Hα-helixtrans-60.2-47.2175.5170.10000110.2H152 A153 F158 N159 L160H152-V156 VanDerWaalsContact O-CG2 3.29Å; H152-V156 WeakPolarHBondContact O-CG2 3.38Å; H152-V156 PolarHBondContact O-N 2.86Å; A153-V156 PolarHBondContact O-N 3.25Å; V156-F158 PolarHBondContact O-N 3.32Å; V156-N159 PolarHBondContact O-N 3.49Å; V156-L160 HydrophobicContact CG1-CD1 3.97Å; V156-L160 HydrophobicContact CG1-CG 4.4Å; V156-L160 VanDerWaalsContact O-CG 3.31Å; V156-L160 WeakPolarHBondContact O-CG 3.47Å; V156-L160 PolarHBondContact O-N 2.81Å
157Y67.3Low69.6Low97 Ų9788.6 Ų88.638%0.3845%0.453SS..Hα-helixtrans-65.1-37.9178.5-66.2-56.4000112.6H81 A153 L160 F161H81-Y157 VanDerWaalsContact CE1-CB 3.43Å; H81-Y157 WeakPolarHBondContact CE1-CB 3.16Å; H81-Y157 WeakPolarHBondContact NE2-CB 3.43Å; A153-Y157 VanDerWaalsContact C-CD2 3.45Å; A153-Y157 HydrophobicContact CB-CD2 4.26Å; A153-Y157 HydrophobicContact CB-CE2 3.89Å; A153-Y157 WeakPolarHBondContact O-CB 3.39Å; A153-Y157 WeakPolarHBondContact O-CD2 3.33Å; A153-Y157 VanDerWaalsContact O-CG 3.3Å; A153-Y157 PolarHBondContact O-N 3.34Å; Y157-L160 HydrophobicContact CD1-CD1 4.38Å; Y157-L160 PolarHBondContact O-N 3.41Å; Y157-F161 WeakPolarHBondContact O-CB 3.48Å; Y157-F161 PolarHBondContact O-N 3.37Å
158F67.6Low69.2Low121 Ų12191.3 Ų91.353%0.53147%0.467SS..Hα-helixtrans-63.5-41.8173.3-178-99.5000112.2G154 F155 V156 F161 V162G154-F158 WeakPolarHBondContact O-CB 3.29Å; G154-F158 PolarHBondContact O-N 2.88Å; F155-F158 PolarHBondContact O-N 3.43Å; V156-F158 PolarHBondContact O-N 3.32Å; F158-F161 WeakPolarHBondContact O-CB 3.49Å; F158-F161 PolarHBondContact O-N 2.9Å; F158-V162 HydrophobicContact CD1-CG2 4.36Å; F158-V162 HydrophobicContact CE1-CG2 3.95Å; F158-V162 HydrophobicContact CE2-CG2 4.5Å; F158-V162 HydrophobicContact CZ-CG2 4.02Å; F158-V162 WeakPolarHBondContact O-CG2 3.1Å; F158-V162 PolarHBondContact O-N 3.35Å
159N67.8Low68.7Low70 Ų7093.4 Ų93.437%0.37447%0.474SS..Hα-helixtrans-66.5-40.5175.7-79.1-84.3000111.8F155 V156 F161 V162 Q163F155-N159 WeakPolarHBondContact CD1-ND2 3Å; F155-N159 WeakPolarHBondContact CE1-ND2 3.31Å; F155-N159 PolarHBondContact O-N 3.49Å; F155-N159 PolarHBondContact O-ND2 2.85Å; V156-N159 PolarHBondContact O-N 3.49Å; N159-F161 VanDerWaalsContact C-N 3.3Å; N159-F161 PolarHBondContact O-N 3.05Å; N159-V162 PolarHBondContact O-N 3.46Å; N159-Q163 WeakPolarHBondContact O-CB 3.15Å; N159-Q163 PolarHBondContact O-N 3.17Å
160L68.7Low68.2Low73 Ų7395.3 Ų95.338%0.38248%0.477SS..Hα-helixtrans-61.4-40.8173.4-71.1171.6000110.8V156 Y157 Q163 Y164V156-L160 HydrophobicContact CG1-CD1 3.97Å; V156-L160 HydrophobicContact CG1-CG 4.4Å; V156-L160 VanDerWaalsContact O-CG 3.31Å; V156-L160 WeakPolarHBondContact O-CG 3.47Å; V156-L160 PolarHBondContact O-N 2.81Å; Y157-L160 HydrophobicContact CD1-CD1 4.38Å; Y157-L160 PolarHBondContact O-N 3.41Å; L160-Q163 PolarHBondContact O-N 2.98Å; L160-Y164 HydrophobicContact CB-CD2 4.32Å; L160-Y164 HydrophobicContact CD2-CD2 3.94Å; L160-Y164 HydrophobicContact CD2-CE2 3.58Å; L160-Y164 VanDerWaalsContact O-CB 3.32Å; L160-Y164 WeakPolarHBondContact O-CB 3.32Å; L160-Y164 VanDerWaalsContact O-CD2 3.28Å; L160-Y164 WeakPolarHBondContact O-CD2 3.27Å; L160-Y164 PolarHBondContact O-N 2.88Å
161F64.9Low67.9Low108 Ų10898.1 Ų98.147%0.47449%0.493SS..Hα-helixtrans-61.1-47.3175.4179-95.4000112Y157 F158 N159 Q163 Y164 G165 F166Y157-F161 WeakPolarHBondContact O-CB 3.48Å; Y157-F161 PolarHBondContact O-N 3.37Å; F158-F161 WeakPolarHBondContact O-CB 3.49Å; F158-F161 PolarHBondContact O-N 2.9Å; N159-F161 VanDerWaalsContact C-N 3.3Å; N159-F161 PolarHBondContact O-N 3.05Å; F161-Q163 VanDerWaalsContact C-N 3.33Å; F161-Q163 PolarHBondContact O-N 3.4Å; F161-Y164 PolarHBondContact O-N 3.31Å; F161-G165 PolarHBondContact O-N 2.97Å; F161-F166 WeakPolarHBondContact CE2-O 3.28Å; F161-F166 WeakPolarHBondContact CZ-O 3.24Å
162V68.5Low67.4Low99 Ų99100.8 Ų100.860%0.651%0.506SS*.Hα-helixtrans-64.4-35.9176.8173.70000112.1F158 N159F158-V162 HydrophobicContact CD1-CG2 4.36Å; F158-V162 HydrophobicContact CE1-CG2 3.95Å; F158-V162 HydrophobicContact CE2-CG2 4.5Å; F158-V162 HydrophobicContact CZ-CG2 4.02Å; F158-V162 WeakPolarHBondContact O-CG2 3.1Å; F158-V162 PolarHBondContact O-N 3.35Å; N159-V162 PolarHBondContact O-N 3.46Å
163Q66.1Low67Low147 Ų14799.6 Ų99.669%0.68750%0.503SS*.Hα-helixtrans-75.8-40.5177.3-95.1-144.1-46.100113.9N159 L160 F161N159-Q163 WeakPolarHBondContact O-CB 3.15Å; N159-Q163 PolarHBondContact O-N 3.17Å; L160-Q163 PolarHBondContact O-N 2.98Å; F161-Q163 VanDerWaalsContact C-N 3.33Å; F161-Q163 PolarHBondContact O-N 3.4Å
164Y67Low66.8Low149 Ų149104.3 Ų104.358%0.58452%0.518SS*.Hα-helixtrans-98.4-6.3-171.5-70.5-77.4000113.9L160 F161 F166L160-Y164 HydrophobicContact CB-CD2 4.32Å; L160-Y164 HydrophobicContact CD2-CD2 3.94Å; L160-Y164 HydrophobicContact CD2-CE2 3.58Å; L160-Y164 VanDerWaalsContact O-CB 3.32Å; L160-Y164 WeakPolarHBondContact O-CB 3.32Å; L160-Y164 VanDerWaalsContact O-CD2 3.28Å; L160-Y164 WeakPolarHBondContact O-CD2 3.27Å; L160-Y164 PolarHBondContact O-N 2.88Å; F161-Y164 PolarHBondContact O-N 3.31Å; Y164-F166 PolarHBondContact O-N 3.38Å
165G59Low66.4Low64 Ų64112.4 Ų112.466%0.6656%0.555SS**  trans59.843.7163.100000115F161F161-G165 PolarHBondContact O-N 2.97Å
166F55.3Low65.9Low216 Ų216111.5 Ų111.595%0.94756%0.556SS**  trans-86.40165.8-66.7-70.2000111.7F161 Y164F161-F166 WeakPolarHBondContact CE2-O 3.28Å; F161-F166 WeakPolarHBondContact CZ-O 3.24Å; Y164-F166 PolarHBondContact O-N 3.38Å

Retrieved 166 of 166 residues in 42.8 ms (Link to these results)