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Mitochondrial import inner membrane translocase subunit TIM17

Essential component of the TIM23 complex, a complex that mediates the translocation of transit peptide-containing proteins across the mitochondrial inner membrane.

AlphaFold DB , UniProt , Accession A0A060W2R1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110527776, Length 167 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
1M32.4Very low57.2Low241 Ų241145 Ų145100%1.18772%0.723SS**  078.70-69.4-171.3-120.700108
2E35.1Very low59.5Low193 Ų193136 Ų13690%0.90267%0.674SS**  trans-107.238.6167-82.7-174.6112.800109.1Y4E2-Y4 PolarHBondContact O-N 3.12Å; E2-Y4 VanDerWaalsContact O-N 3.16Å
3E39.9Very low61.7Low189 Ų189128.4 Ų128.488%0.88364%0.637SS**THydrogen-bonded Turntrans-91.850.2-178.6-154.7162.8139.100109.6
4Y40.6Very low63.8Low228 Ų228125.5 Ų125.589%0.89463%0.629SS**THydrogen-bonded Turntrans-150.416.8177.7-136.4-90.1000114.1E2E2-Y4 PolarHBondContact O-N 3.12Å; E2-Y4 VanDerWaalsContact O-N 3.16Å
5A47.9Very low65.7Low99 Ų99123.6 Ų123.682%0.81862%0.622SS**SBendtrans-104.71.4-179.900000114.3
6R54Low67.3Low116 Ų116118.7 Ų118.744%0.43860%0.598SS.*SBendtrans-122.2113.5-176.3-148.6167.3172.686.9-5.8108.8R12 D77 E87R6-R12 VanDerWaalsContact NH1-NH2 3.15Å; R6-R12 VanDerWaalsContact NH2-CZ 3.26Å; R6-D77 IonicContact NH2-OD2 3.6Å; R6-D77 PolarHBondContact NH2-OD2 3.05Å; R6-E87 IonicContact NE-OE1 3.98Å; R6-E87 IonicContact NE-OE2 2.93Å
7E60Low68.8Low110 Ų110114 Ų11451%0.51458%0.578SS.*PPolyproline II helixtrans-49.4132.5174.8-70.6-90.4154.700110.2W11 R12E7-W11 HydrophobicContact CB-CB 4.5Å; E7-R12 HydrophobicContact CB-CB 4.22Å
8P72Confident70.2Confident96 Ų96109.6 Ų109.662%0.62357%0.566SS**PPolyproline II helixtrans-63.6141.2179.525.1-32.4000110.9W11P8-W11 PolarHBondContact O-N 3.41Å
9C79.6Confident71.5Confident72 Ų72105.5 Ų105.549%0.48655%0.553SS.*THydrogen-bonded Turntrans-61.8118.3166.9-49.20000107.1C78C9-C78 HydrophobicContact CB-CB 3.84Å; C9-C78 WeakPolarHBondContact CB-SG 3.42Å; C9-C78 WeakPolarHBondContact SG-CB 3.12Å; C9-C78 CovalentContact SG-SG 2.04Å; C9-C78 PolarHBondContact SG-SG 3.13Å
10P81.6Confident72.6Confident93 Ų93101.1 Ų101.160%0.60453%0.533SS*.THydrogen-bonded Turncis-107.8-5.936.238.3-35.9000116.7R12 I13 V14P10-R12 PolarHBondContact O-N 3.02Å; P10-I13 WeakPolarHBondContact O-CB 3.35Å; P10-I13 PolarHBondContact O-N 3.34Å; P10-V14 PolarHBondContact O-N 2.86Å
11W86.1Confident73.7Confident158 Ų158100.5 Ų100.560%0.59853%0.526SS*.Hα-helixtrans-59.5-40.3-174.1-118.2117.2000111.7E7 P8 I13 V14 D15E7-W11 HydrophobicContact CB-CB 4.5Å; P8-W11 PolarHBondContact O-N 3.41Å; W11-I13 VanDerWaalsContact C-N 3.27Å; W11-I13 PolarHBondContact O-N 3.03Å; W11-V14 HydrophobicContact CE3-CB 4.38Å; W11-V14 HydrophobicContact CZ3-CG1 4.35Å; W11-V14 WeakPolarHBondContact O-CB 3.39Å; W11-V14 PolarHBondContact O-N 2.82Å; W11-D15 PolarHBondContact O-N 3.43Å
12R84.8Confident76.8Confident37 Ų3792.4 Ų92.414%0.1449%0.49CS..Hα-helixtrans-56.9-34.9175.9-163.6-122.8179.677.38.2114.5R6 E7 P10 D16R6-R12 VanDerWaalsContact NH1-NH2 3.15Å; R6-R12 VanDerWaalsContact NH2-CZ 3.26Å; E7-R12 HydrophobicContact CB-CB 4.22Å; P10-R12 PolarHBondContact O-N 3.02Å; R12-D16 WeakPolarHBondContact CD-OD2 3.25Å; R12-D16 IonicContact CZ-OD2 3.88Å; R12-D16 IonicContact NE-OD2 3.04Å; R12-D16 PolarHBondContact NE-OD2 3.14Å; R12-D16 VanDerWaalsContact O-CB 3.27Å; R12-D16 WeakPolarHBondContact O-CB 3.33Å; R12-D16 VanDerWaalsContact O-CG 3.25Å; R12-D16 PolarHBondContact O-N 3.26Å
13I88.6Confident79.6Confident37 Ų3790.2 Ų90.219%0.1948%0.482CS..Hα-helixtrans-67.8-42.3177.2-61.6161.2000109.8P10 W11 C17 M75P10-I13 WeakPolarHBondContact O-CB 3.35Å; P10-I13 PolarHBondContact O-N 3.34Å; W11-I13 VanDerWaalsContact C-N 3.27Å; W11-I13 PolarHBondContact O-N 3.03Å; I13-C17 VanDerWaalsContact O-CB 3.28Å; I13-C17 WeakPolarHBondContact O-CB 3.45Å; I13-C17 PolarHBondContact O-N 3.39Å; I13-C17 PolarHBondContact O-SG 3.32Å; I13-M75 HydrophobicContact CD1-CG 3.82Å; I13-M75 HydrophobicContact CG1-CG 4.19Å; I13-M75 HydrophobicContact CG2-CG 3.89Å
14V91Very high82.2Confident88 Ų8881.3 Ų81.353%0.53344%0.441SS..Hα-helixtrans-67-43.3179.7-179.80000110.4P10 W11 C17 G18P10-V14 PolarHBondContact O-N 2.86Å; W11-V14 HydrophobicContact CE3-CB 4.38Å; W11-V14 HydrophobicContact CZ3-CG1 4.35Å; W11-V14 WeakPolarHBondContact O-CB 3.39Å; W11-V14 PolarHBondContact O-N 2.82Å; V14-C17 PolarHBondContact O-N 3.3Å; V14-G18 PolarHBondContact O-N 3.1Å
15D92Very high84.8Confident97 Ų9771.6 Ų71.652%0.51941%0.408SS..Hα-helixtrans-63.1-48.7177-167.861.6000111.5W11 C17 G18 G19W11-D15 PolarHBondContact O-N 3.43Å; D15-C17 PolarHBondContact O-N 3.15Å; D15-G18 PolarHBondContact O-N 3.05Å; D15-G19 PolarHBondContact O-N 3.41Å
16D91.4Very high87.1Confident45 Ų4571.9 Ų71.924%0.24139%0.394CS..Hα-helixtrans-64.2-38.2178-73.9-29.8000111.9R12 A20 S74R12-D16 WeakPolarHBondContact CD-OD2 3.25Å; R12-D16 IonicContact CZ-OD2 3.88Å; R12-D16 IonicContact NE-OD2 3.04Å; R12-D16 PolarHBondContact NE-OD2 3.14Å; R12-D16 VanDerWaalsContact O-CB 3.27Å; R12-D16 WeakPolarHBondContact O-CB 3.33Å; R12-D16 VanDerWaalsContact O-CG 3.25Å; R12-D16 PolarHBondContact O-N 3.26Å; D16-A20 WeakPolarHBondContact O-CB 3.39Å; D16-A20 PolarHBondContact O-N 2.86Å; D16-S74 WeakPolarHBondContact CB-OG 3.21Å; D16-S74 WeakPolarHBondContact OD2-CB 3.31Å; D16-S74 PolarHBondContact OD2-OG 2.87Å
17C92.7Very high89Confident39 Ų3968.2 Ų68.226%0.26439%0.393SS..Hα-helixtrans-60.3-50.5172.4-75.20000111.8I13 V14 D15 F21 G71I13-C17 VanDerWaalsContact O-CB 3.28Å; I13-C17 WeakPolarHBondContact O-CB 3.45Å; I13-C17 PolarHBondContact O-N 3.39Å; I13-C17 PolarHBondContact O-SG 3.32Å; V14-C17 PolarHBondContact O-N 3.3Å; D15-C17 PolarHBondContact O-N 3.15Å; C17-F21 WeakPolarHBondContact O-CB 3.49Å; C17-F21 PolarHBondContact O-N 2.88Å; C17-G71 WeakPolarHBondContact SG-CA 3.35Å
18G93.8Very high90.6Very high34 Ų3463 Ų6335%0.35137%0.369SS..Hα-helixtrans-69.5-41.8-175.900000112.4V14 D15 F21 T22V14-G18 PolarHBondContact O-N 3.1Å; D15-G18 PolarHBondContact O-N 3.05Å; G18-F21 PolarHBondContact O-N 3.21Å; G18-T22 WeakPolarHBondContact O-CB 3.46Å; G18-T22 PolarHBondContact O-N 3.2Å; G18-T22 PolarHBondContact O-OG1 3.03Å
19G94.2Very high91.7Very high32 Ų3259 Ų5933%0.3334%0.344SS..Hα-helixtrans-60-50.8173.400000111.1D15 F21 T22 M23D15-G19 PolarHBondContact O-N 3.41Å; G19-F21 PolarHBondContact O-N 3.31Å; G19-T22 PolarHBondContact O-N 3.5Å; G19-M23 WeakPolarHBondContact O-CG 3.41Å; G19-M23 PolarHBondContact O-N 2.93Å
20A94.6Very high92.5Very high17 Ų1760.8 Ų60.814%0.1435%0.348CS..Hα-helixtrans-63.3-40.4177.800000112.3D16 T22 M23 G24 F66D16-A20 WeakPolarHBondContact O-CB 3.39Å; D16-A20 PolarHBondContact O-N 2.86Å; A20-T22 VanDerWaalsContact C-N 3.34Å; A20-T22 PolarHBondContact O-N 3.12Å; A20-M23 PolarHBondContact O-N 3.36Å; A20-G24 PolarHBondContact O-N 3.26Å; A20-F66 HydrophobicContact CB-CB 4.33Å; A20-F66 VanDerWaalsContact CB-O 3.31Å; A20-F66 WeakPolarHBondContact CB-O 3.19Å; A20-F66 VanDerWaalsContact O-CB 3.29Å; A20-F66 WeakPolarHBondContact O-CB 3.39Å
21F96.4Very high93.1Very high89 Ų8962.2 Ų62.239%0.3935%0.345SS..Hα-helixtrans-56.7-49.3173.5179.5-98.2000111.4C17 G18 G19 G24 A25 G63 A67C17-F21 WeakPolarHBondContact O-CB 3.49Å; C17-F21 PolarHBondContact O-N 2.88Å; G18-F21 PolarHBondContact O-N 3.21Å; G19-F21 PolarHBondContact O-N 3.31Å; F21-G24 PolarHBondContact O-N 2.04Å; F21-A25 HydrophobicContact CE1-CB 4.29Å; F21-A25 VanDerWaalsContact O-CB 3.24Å; F21-A25 WeakPolarHBondContact O-CB 3.34Å; F21-A25 PolarHBondContact O-N 3.05Å; F21-G63 WeakPolarHBondContact CD2-O 3.4Å; F21-A67 HydrophobicContact CB-CB 3.84Å; F21-A67 HydrophobicContact CD2-CB 4.18Å
22T95.9Very high93.4Very high71 Ų7156.3 Ų56.344%0.43632%0.324SS..Hα-helixtrans-65.2-45-176.7-56.70000110.9G18 G19 A20 G24 A25 I26G18-T22 WeakPolarHBondContact O-CB 3.46Å; G18-T22 PolarHBondContact O-N 3.2Å; G18-T22 PolarHBondContact O-OG1 3.03Å; G19-T22 PolarHBondContact O-N 3.5Å; A20-T22 VanDerWaalsContact C-N 3.34Å; A20-T22 PolarHBondContact O-N 3.12Å; T22-G24 VanDerWaalsContact C-N 3.35Å; T22-G24 PolarHBondContact O-N 2.91Å; T22-A25 PolarHBondContact O-N 3.28Å; T22-I26 HydrophobicContact CG2-CD1 3.68Å; T22-I26 HydrophobicContact CG2-CG1 4.36Å; T22-I26 WeakPolarHBondContact O-CB 3.31Å; T22-I26 VanDerWaalsContact O-CG1 3.3Å; T22-I26 WeakPolarHBondContact O-CG1 3.26Å; T22-I26 PolarHBondContact O-N 2.91Å
23M94.8Very high93.8Very high147 Ų14755.8 Ų55.872%0.72433%0.328SS*.Hα-helixtrans-59.1-45.6174.2-69.7-163-170.900111.7G19 A20 G27G19-M23 WeakPolarHBondContact O-CG 3.41Å; G19-M23 PolarHBondContact O-N 2.93Å; A20-M23 PolarHBondContact O-N 3.36Å; M23-G27 PolarHBondContact O-N 2.93Å
24G94.1Very high94Very high2 Ų257.9 Ų57.92%0.02134%0.342CS..Hα-helixtrans-67.4-36.9178.700000113.4A20 F21 T22 G28A20-G24 PolarHBondContact O-N 3.26Å; F21-G24 PolarHBondContact O-N 2.04Å; T22-G24 VanDerWaalsContact C-N 3.35Å; T22-G24 PolarHBondContact O-N 2.91Å; G24-G28 VanDerWaalsContact O-CA 3.29Å; G24-G28 WeakPolarHBondContact O-CA 3.19Å; G24-G28 PolarHBondContact O-N 3.48Å
25A95.8Very high94Very high25 Ų2559.2 Ų59.221%0.20734%0.341CS..Hα-helixtrans-71.8-43.1178.800000111.9F21 T22 G29F21-A25 HydrophobicContact CE1-CB 4.29Å; F21-A25 VanDerWaalsContact O-CB 3.24Å; F21-A25 WeakPolarHBondContact O-CB 3.34Å; F21-A25 PolarHBondContact O-N 3.05Å; T22-A25 PolarHBondContact O-N 3.28Å; A25-G29 WeakPolarHBondContact O-CA 3.12Å; A25-G29 PolarHBondContact O-N 2.87Å
26I95.8Very high93.9Very high104 Ų10455 Ų5553%0.53332%0.32SS..Hα-helixtrans-69.6-52.4177.5-65.5172.6000110T22 G28 G29 I30T22-I26 HydrophobicContact CG2-CD1 3.68Å; T22-I26 HydrophobicContact CG2-CG1 4.36Å; T22-I26 WeakPolarHBondContact O-CB 3.31Å; T22-I26 VanDerWaalsContact O-CG1 3.3Å; T22-I26 WeakPolarHBondContact O-CG1 3.26Å; T22-I26 PolarHBondContact O-N 2.91Å; I26-G28 PolarHBondContact O-N 3.29Å; I26-G29 PolarHBondContact O-N 3.09Å; I26-I30 HydrophobicContact CG2-CD1 4.03Å; I26-I30 WeakPolarHBondContact O-CG1 3.32Å; I26-I30 PolarHBondContact O-N 2.9Å
27G94.4Very high93.8Very high40 Ų4055.9 Ų55.941%0.41232%0.322SS..Hα-helixtrans-61.8-44179.400000112.1M23 I30 F31M23-G27 PolarHBondContact O-N 2.93Å; G27-I30 PolarHBondContact O-N 3.15Å; G27-F31 WeakPolarHBondContact O-CB 3.28Å; G27-F31 PolarHBondContact O-N 3.27Å
28G93.7Very high93.7Very high0 Ų063.5 Ų63.50%035%0.345CS..Hα-helixtrans-63.7-40173.800000112.9G24 I26 Q32G24-G28 VanDerWaalsContact O-CA 3.29Å; G24-G28 WeakPolarHBondContact O-CA 3.19Å; G24-G28 PolarHBondContact O-N 3.48Å; I26-G28 PolarHBondContact O-N 3.29Å; G28-Q32 WeakPolarHBondContact O-CB 3.5Å; G28-Q32 WeakPolarHBondContact O-CG 3.47Å; G28-Q32 PolarHBondContact O-N 3.05Å
29G95Very high93.5Very high11 Ų1168.6 Ų68.611%0.11336%0.364CS..Hα-helixtrans-59-51.1175.100000111.9A25 I26 Q32 A33A25-G29 WeakPolarHBondContact O-CA 3.12Å; A25-G29 PolarHBondContact O-N 2.87Å; I26-G29 PolarHBondContact O-N 3.09Å; G29-Q32 PolarHBondContact O-N 3.01Å; G29-A33 VanDerWaalsContact O-CB 3.24Å; G29-A33 WeakPolarHBondContact O-CB 3Å; G29-A33 PolarHBondContact O-N 3.05Å
30I95.4Very high93.3Very high111 Ų11168 Ų6857%0.56936%0.355SS*.Hα-helixtrans-62.3-48.7179-64.4166.2000110.7I26 G27 Q32 A33 V34I26-I30 HydrophobicContact CG2-CD1 4.03Å; I26-I30 WeakPolarHBondContact O-CG1 3.32Å; I26-I30 PolarHBondContact O-N 2.9Å; G27-I30 PolarHBondContact O-N 3.15Å; I30-Q32 VanDerWaalsContact C-N 3.34Å; I30-Q32 PolarHBondContact O-N 2.62Å; I30-A33 WeakPolarHBondContact O-CB 3.37Å; I30-A33 PolarHBondContact O-N 3.28Å; I30-V34 PolarHBondContact O-N 3.5Å; I30-V34 VanDerWaalsContact O-N 3.15Å
31F93.9Very high92.8Very high122 Ų12271.5 Ų71.554%0.53538%0.377SS..Hα-helixtrans-61.4-44-179.3-178.5-102.1000111.9G27 V34 K35G27-F31 WeakPolarHBondContact O-CB 3.28Å; G27-F31 PolarHBondContact O-N 3.27Å; F31-V34 PolarHBondContact O-N 3.07Å; F31-K35 HydrophobicContact CE1-CD 3.94Å; F31-K35 HydrophobicContact CZ-CD 4.33Å; F31-K35 VanDerWaalsContact O-CB 3.3Å; F31-K35 WeakPolarHBondContact O-CB 3.42Å; F31-K35 PolarHBondContact O-N 3.5Å
32Q94.3Very high92Very high34 Ų3471.5 Ų71.516%0.15939%0.393CS..Hα-helixtrans-74.7-26179.9-64.3-6610100112.5G28 G29 I30 G36 R58G28-Q32 WeakPolarHBondContact O-CB 3.5Å; G28-Q32 WeakPolarHBondContact O-CG 3.47Å; G28-Q32 PolarHBondContact O-N 3.05Å; G29-Q32 PolarHBondContact O-N 3.01Å; I30-Q32 VanDerWaalsContact C-N 3.34Å; I30-Q32 PolarHBondContact O-N 2.62Å; Q32-G36 WeakPolarHBondContact O-CA 3.44Å; Q32-G36 PolarHBondContact O-N 2.93Å; Q32-R58 HydrophobicContact CG-CB 3.87Å; Q32-R58 VanDerWaalsContact NE2-CB 3.27Å
33A92.5Very high91.4Very high26 Ų2669.7 Ų69.722%0.21539%0.388CS..Hα-helixtrans-62.1-50.7171.200000110.7G29 I30 F37 S51 I55G29-A33 VanDerWaalsContact O-CB 3.24Å; G29-A33 WeakPolarHBondContact O-CB 3Å; G29-A33 PolarHBondContact O-N 3.05Å; I30-A33 WeakPolarHBondContact O-CB 3.37Å; I30-A33 PolarHBondContact O-N 3.28Å; A33-F37 VanDerWaalsContact O-CB 3.3Å; A33-F37 WeakPolarHBondContact O-CB 3.46Å; A33-F37 PolarHBondContact O-N 3.46Å; A33-S51 VanDerWaalsContact CA-OG 3.29Å; A33-S51 WeakPolarHBondContact CA-OG 3.43Å; A33-S51 PolarHBondContact O-OG 3.22Å; A33-I55 HydrophobicContact CB-CD1 3.54Å; A33-I55 HydrophobicContact CB-CG1 3.87Å
34V92.8Very high91Very high82 Ų8268.8 Ų68.850%0.49738%0.384SS..Hα-helixtrans-65.7-48.9179176.40000110.7I30 F31 G36 F37 R38I30-V34 PolarHBondContact O-N 3.5Å; I30-V34 VanDerWaalsContact O-N 3.15Å; F31-V34 PolarHBondContact O-N 3.07Å; V34-G36 PolarHBondContact O-N 3.23Å; V34-F37 PolarHBondContact O-N 3.37Å; V34-R38 WeakPolarHBondContact O-CG 3.17Å; V34-R38 PolarHBondContact O-N 3.46Å
35K91.2Very high90.6Very high116 Ų11672.1 Ų72.150%0.50441%0.407SS..Hα-helixtrans-63-43.5179.6-172.7172.9-178167.70111.8F31 R38 N39F31-K35 HydrophobicContact CE1-CD 3.94Å; F31-K35 HydrophobicContact CZ-CD 4.33Å; F31-K35 VanDerWaalsContact O-CB 3.3Å; F31-K35 WeakPolarHBondContact O-CB 3.42Å; F31-K35 PolarHBondContact O-N 3.5Å; K35-R38 PolarHBondContact O-N 3.4Å; K35-N39 VanDerWaalsContact O-CB 3.26Å; K35-N39 WeakPolarHBondContact O-CB 3.12Å; K35-N39 PolarHBondContact O-N 2.9Å
36G89.4Confident90.2Very high8 Ų876.1 Ų76.18%0.08242%0.421CS..Hα-helixtrans-64.4-39.1177.400000112.5Q32 V34 S40Q32-G36 WeakPolarHBondContact O-CA 3.44Å; Q32-G36 PolarHBondContact O-N 2.93Å; V34-G36 PolarHBondContact O-N 3.23Å; G36-S40 VanDerWaalsContact O-CB 3.31Å; G36-S40 WeakPolarHBondContact O-CB 3.31Å; G36-S40 PolarHBondContact O-N 3Å; G36-S40 PolarHBondContact O-OG 2.66Å
37F89.9Confident89.9Confident63 Ų6375.4 Ų75.428%0.27641%0.411SS..Hα-helixtrans-66.6-42.1175.5-171.8-91.8000112.3A33 V34 M44 R47 L48A33-F37 VanDerWaalsContact O-CB 3.3Å; A33-F37 WeakPolarHBondContact O-CB 3.46Å; A33-F37 PolarHBondContact O-N 3.46Å; V34-F37 PolarHBondContact O-N 3.37Å; F37-M44 HydrophobicContact CE2-SD 3.9Å; F37-M44 HydrophobicContact CZ-SD 3.92Å; F37-R47 HydrophobicContact CD2-CB 3.62Å; F37-R47 HydrophobicContact CE2-CB 3.57Å; F37-R47 HydrophobicContact CE2-CG 4.49Å; F37-R47 HydrophobicContact CG-CB 4.25Å; F37-R47 HydrophobicContact CZ-CB 4.17Å; F37-L48 HydrophobicContact CD2-CD2 4.46Å; F37-L48 HydrophobicContact CE2-CD2 4.3Å
38R89.2Confident89.7Confident200 Ų20078.3 Ų78.376%0.75542%0.417SS*.Hα-helixtrans-71.1-35.8-179.8-71.5177.668.4170.81.8113.5V34 K35V34-R38 WeakPolarHBondContact O-CG 3.17Å; V34-R38 PolarHBondContact O-N 3.46Å; K35-R38 PolarHBondContact O-N 3.4Å
39N90.4Very high89.6Confident141 Ų14185.5 Ų85.575%0.75445%0.448SS*.Hα-helixtrans-89.6-3.3-175.4-159.859.9000113.8K35K35-N39 VanDerWaalsContact O-CB 3.26Å; K35-N39 WeakPolarHBondContact O-CB 3.12Å; K35-N39 PolarHBondContact O-N 2.9Å
40S89.4Confident89.3Confident18 Ų1886 Ų8613%0.12645%0.454CS..SBendtrans-86.7150-179.8-69.60000112.4G36 G50G36-S40 VanDerWaalsContact O-CB 3.31Å; G36-S40 WeakPolarHBondContact O-CB 3.31Å; G36-S40 PolarHBondContact O-N 3Å; G36-S40 PolarHBondContact O-OG 2.66Å; S40-G50 WeakPolarHBondContact OG-CA 3.42Å
41P84.3Confident89.2Confident92 Ų9281.3 Ų81.360%0.59743%0.431SS*.PPolyproline II helixtrans-57.5155.3-179.721.2-31000112.5G43 H46 R47P41-G43 PolarHBondContact O-N 3.39Å; P41-H46 HydrophobicContact CG-CB 4.31Å; P41-R47 WeakPolarHBondContact O-CG 3.48Å
42A79.8Confident89.1Confident89 Ų8981.6 Ų81.674%0.73644%0.435SS*.SBendtrans-58.5134.9-17600000111.6
43G83.7Confident89Confident33 Ų3384.1 Ų84.134%0.3445%0.453SS..SBendtrans127.5126.1-175.800000111.7P41 S45 H46 R47P41-G43 PolarHBondContact O-N 3.39Å; G43-S45 VanDerWaalsContact C-N 3.31Å; G43-S45 PolarHBondContact O-N 3.48Å; G43-H46 PolarHBondContact O-N 2.85Å; G43-R47 WeakPolarHBondContact O-CG 3.43Å; G43-R47 PolarHBondContact O-N 2.85Å
44M85.4Confident89Confident127 Ų12783.8 Ų83.863%0.62645%0.45SS*.Hα-helixtrans-59.2-41.6-174.9-170.163.37400112.2F37 R47 L48F37-M44 HydrophobicContact CE2-SD 3.9Å; F37-M44 HydrophobicContact CZ-SD 3.92Å; M44-R47 PolarHBondContact O-N 3.31Å; M44-L48 HydrophobicContact CG-CD1 4.1Å; M44-L48 WeakPolarHBondContact O-CB 3.28Å; M44-L48 VanDerWaalsContact O-CG 3.27Å; M44-L48 WeakPolarHBondContact O-CG 3.25Å; M44-L48 PolarHBondContact O-N 3.5Å
45S86.6Confident89.1Confident72 Ų7282.3 Ų82.350%0.50344%0.439SS..Hα-helixtrans-63.9-42177.755.90000112.9G43 K49G43-S45 VanDerWaalsContact C-N 3.31Å; G43-S45 PolarHBondContact O-N 3.48Å; S45-K49 WeakPolarHBondContact O-CB 3.24Å; S45-K49 WeakPolarHBondContact O-CG 3.22Å; S45-K49 PolarHBondContact O-N 2.94Å; S45-K49 VanDerWaalsContact O-N 3.08Å
46H87.3Confident89.2Confident109 Ų10984.9 Ų84.951%0.50545%0.45SS..Hα-helixtrans-70.4-38.5177.8-71.3-82.8000111.9P41 G43 K49 G50P41-H46 HydrophobicContact CG-CB 4.31Å; G43-H46 PolarHBondContact O-N 2.85Å; H46-K49 PolarHBondContact O-N 3.49Å; H46-G50 PolarHBondContact O-N 3.3Å
47R89.7Confident89.4Confident89 Ų8987.8 Ų87.834%0.33647%0.466SS..Hα-helixtrans-65.9-42.3175.9-71.6-175166167.6-3.9113.1F37 P41 G43 M44 S51F37-R47 HydrophobicContact CD2-CB 3.62Å; F37-R47 HydrophobicContact CE2-CB 3.57Å; F37-R47 HydrophobicContact CE2-CG 4.49Å; F37-R47 HydrophobicContact CG-CB 4.25Å; F37-R47 HydrophobicContact CZ-CB 4.17Å; P41-R47 WeakPolarHBondContact O-CG 3.48Å; G43-R47 WeakPolarHBondContact O-CG 3.43Å; G43-R47 PolarHBondContact O-N 2.85Å; M44-R47 PolarHBondContact O-N 3.31Å; R47-S51 WeakPolarHBondContact O-CB 3.36Å; R47-S51 PolarHBondContact O-N 3Å
48L90.1Very high89.5Confident101 Ų10191.2 Ų91.253%0.52948%0.477SS..Hα-helixtrans-66.5-43.3176-70.1173.6000111.5F37 M44 S51 M52F37-L48 HydrophobicContact CD2-CD2 4.46Å; F37-L48 HydrophobicContact CE2-CD2 4.3Å; M44-L48 HydrophobicContact CG-CD1 4.1Å; M44-L48 WeakPolarHBondContact O-CB 3.28Å; M44-L48 VanDerWaalsContact O-CG 3.27Å; M44-L48 WeakPolarHBondContact O-CG 3.25Å; M44-L48 PolarHBondContact O-N 3.5Å; L48-S51 PolarHBondContact O-N 2.67Å; L48-M52 WeakPolarHBondContact O-CB 3.19Å; L48-M52 PolarHBondContact O-N 3.44Å
49K90.8Very high89.7Confident151 Ų15182.1 Ų82.166%0.65745%0.445SS*.Hα-helixtrans-63.3-42.8175.4-76.6179.5179.2-178.10112.6S45 H46 M52 T53S45-K49 WeakPolarHBondContact O-CB 3.24Å; S45-K49 WeakPolarHBondContact O-CG 3.22Å; S45-K49 PolarHBondContact O-N 2.94Å; S45-K49 VanDerWaalsContact O-N 3.08Å; H46-K49 PolarHBondContact O-N 3.49Å; K49-M52 PolarHBondContact O-N 2.8Å; K49-T53 WeakPolarHBondContact O-CB 3.33Å; K49-T53 PolarHBondContact O-N 3.49Å; K49-T53 PolarHBondContact O-OG1 3.49Å
50G89.9Confident89.8Confident22 Ų2278.5 Ų78.523%0.22743%0.429CS..Hα-helixtrans-67.4-39.9177.300000112.5S40 H46 T53 A54S40-G50 WeakPolarHBondContact OG-CA 3.42Å; H46-G50 PolarHBondContact O-N 3.3Å; G50-T53 PolarHBondContact O-N 2.97Å; G50-A54 WeakPolarHBondContact O-CB 3.44Å; G50-A54 PolarHBondContact O-N 3Å
51S91.7Very high90.1Very high13 Ų1382.7 Ų82.79%0.09145%0.447CS..Hα-helixtrans-60.6-50.3172-175.30000111.8A33 R47 L48 T53 A54 I55A33-S51 VanDerWaalsContact CA-OG 3.29Å; A33-S51 WeakPolarHBondContact CA-OG 3.43Å; A33-S51 PolarHBondContact O-OG 3.22Å; R47-S51 WeakPolarHBondContact O-CB 3.36Å; R47-S51 PolarHBondContact O-N 3Å; L48-S51 PolarHBondContact O-N 2.67Å; S51-T53 VanDerWaalsContact C-N 3.31Å; S51-T53 PolarHBondContact O-N 3.28Å; S51-A54 WeakPolarHBondContact O-CB 3.33Å; S51-A54 PolarHBondContact O-N 3.4Å; S51-A54 VanDerWaalsContact O-N 3.12Å; S51-I55 VanDerWaalsContact O-CG1 3.29Å; S51-I55 WeakPolarHBondContact O-CG1 3.34Å; S51-I55 PolarHBondContact O-N 3.01Å
52M92.4Very high90.6Very high128 Ų12881.6 Ų81.663%0.63144%0.436SS*.Hα-helixtrans-59.6-41.2178.1-171.966.697.900112.2L48 K49 I55 K56L48-M52 WeakPolarHBondContact O-CB 3.19Å; L48-M52 PolarHBondContact O-N 3.44Å; K49-M52 PolarHBondContact O-N 2.8Å; M52-I55 PolarHBondContact O-N 3.48Å; M52-K56 WeakPolarHBondContact O-CB 2.94Å; M52-K56 PolarHBondContact O-N 2.94Å
53T92.6Very high91.3Very high86 Ų8677.3 Ų77.353%0.52840%0.401SS..Hα-helixtrans-65.9-40.9176.7-55.30000111.3K49 G50 S51 K56 T57K49-T53 WeakPolarHBondContact O-CB 3.33Å; K49-T53 PolarHBondContact O-N 3.49Å; K49-T53 PolarHBondContact O-OG1 3.49Å; G50-T53 PolarHBondContact O-N 2.97Å; S51-T53 VanDerWaalsContact C-N 3.31Å; S51-T53 PolarHBondContact O-N 3.28Å; T53-K56 PolarHBondContact O-N 3.09Å; T53-T57 HydrophobicContact CG2-CG2 4.48Å; T53-T57 WeakPolarHBondContact O-CB 3.5Å; T53-T57 WeakPolarHBondContact O-CG2 3.35Å; T53-T57 PolarHBondContact O-N 3.47Å; T53-T57 PolarHBondContact O-OG1 2.87Å
54A92.5Very high91.9Very high19 Ų1977.1 Ų77.116%0.15740%0.399CS..Hα-helixtrans-64.9-43177.200000112.1G50 S51 T57 R58G50-A54 WeakPolarHBondContact O-CB 3.44Å; G50-A54 PolarHBondContact O-N 3Å; S51-A54 WeakPolarHBondContact O-CB 3.33Å; S51-A54 PolarHBondContact O-N 3.4Å; S51-A54 VanDerWaalsContact O-N 3.12Å; A54-T57 PolarHBondContact O-OG1 2.98Å; A54-R58 VanDerWaalsContact O-CB 3.24Å; A54-R58 WeakPolarHBondContact O-CB 3.28Å; A54-R58 WeakPolarHBondContact O-CG 3.17Å; A54-R58 PolarHBondContact O-N 3.37Å
55I94.8Very high92.3Very high51 Ų5174.7 Ų74.726%0.26239%0.394SS..Hα-helixtrans-60-54.4174.8-63.9164000109.4A33 S51 M52 T57 R58 A59A33-I55 HydrophobicContact CB-CD1 3.54Å; A33-I55 HydrophobicContact CB-CG1 3.87Å; S51-I55 VanDerWaalsContact O-CG1 3.29Å; S51-I55 WeakPolarHBondContact O-CG1 3.34Å; S51-I55 PolarHBondContact O-N 3.01Å; M52-I55 PolarHBondContact O-N 3.48Å; I55-T57 VanDerWaalsContact C-N 3.27Å; I55-T57 PolarHBondContact O-N 3.38Å; I55-R58 PolarHBondContact O-N 2.81Å; I55-A59 HydrophobicContact CG2-CB 4.23Å; I55-A59 WeakPolarHBondContact O-CB 3.27Å; I55-A59 PolarHBondContact O-N 3.36Å
56K92.9Very high92.7Very high171 Ų17175.7 Ų75.774%0.74339%0.39SS*.Hα-helixtrans-60.7-35.2-174.1-168.3173.9-176.9-179.60113.3M52 T53 P60M52-K56 WeakPolarHBondContact O-CB 2.94Å; M52-K56 PolarHBondContact O-N 2.94Å; T53-K56 PolarHBondContact O-N 3.09Å; K56-P60 WeakPolarHBondContact O-CD 3.29Å; K56-P60 WeakPolarHBondContact O-CG 3.1Å
57T93.1Very high93.1Very high68 Ų6871.4 Ų71.442%0.41737%0.373SS..Hα-helixtrans-88.3-30.8-177.353.60000113.6T53 A54 I55 Q61T53-T57 HydrophobicContact CG2-CG2 4.48Å; T53-T57 WeakPolarHBondContact O-CB 3.5Å; T53-T57 WeakPolarHBondContact O-CG2 3.35Å; T53-T57 PolarHBondContact O-N 3.47Å; T53-T57 PolarHBondContact O-OG1 2.87Å; A54-T57 PolarHBondContact O-OG1 2.98Å; I55-T57 VanDerWaalsContact C-N 3.27Å; I55-T57 PolarHBondContact O-N 3.38Å; T57-Q61 VanDerWaalsContact O-CD 3.26Å; T57-Q61 WeakPolarHBondContact O-CG 3.33Å
58R93.2Very high93.4Very high135 Ų13571.3 Ų71.351%0.50938%0.382SS..Hα-helixtrans-110.3-30.2-169.6-57.6-62.2-165.3166.43.7114.4Q32 A54 I55 Q61 L62Q32-R58 HydrophobicContact CG-CB 3.87Å; Q32-R58 VanDerWaalsContact NE2-CB 3.27Å; A54-R58 VanDerWaalsContact O-CB 3.24Å; A54-R58 WeakPolarHBondContact O-CB 3.28Å; A54-R58 WeakPolarHBondContact O-CG 3.17Å; A54-R58 PolarHBondContact O-N 3.37Å; I55-R58 PolarHBondContact O-N 2.81Å; R58-Q61 VanDerWaalsContact CD-OE1 3.24Å; R58-Q61 VanDerWaalsContact NH1-OE1 3.08Å; R58-Q61 PolarHBondContact O-N 2.98Å; R58-L62 PolarHBondContact O-N 2.83Å
59A93.1Very high93.6Very high9 Ų970.8 Ų70.87%0.07437%0.373CS..Hα-helixtrans-58.7-47176.700000113.1I55 Q61 L62 G63I55-A59 HydrophobicContact CG2-CB 4.23Å; I55-A59 WeakPolarHBondContact O-CB 3.27Å; I55-A59 PolarHBondContact O-N 3.36Å; A59-Q61 VanDerWaalsContact C-N 3.33Å; A59-Q61 PolarHBondContact O-N 2.85Å; A59-L62 PolarHBondContact O-N 3.45Å; A59-G63 PolarHBondContact O-N 2.99Å
60P93.4Very high93.7Very high65 Ų6563.8 Ų63.842%0.42234%0.344SS..Hα-helixtrans-69.6-29.2177.526.8-34.9000113K56 G64K56-P60 WeakPolarHBondContact O-CD 3.29Å; K56-P60 WeakPolarHBondContact O-CG 3.1Å; P60-G64 PolarHBondContact O-N 3.05Å
61Q94.4Very high93.9Very high107 Ų10762.9 Ų62.950%0.533%0.334SS..Hα-helixtrans-64.8-42.9174.3-68.7-178.2-18.100111.3T57 R58 A59 S65T57-Q61 VanDerWaalsContact O-CD 3.26Å; T57-Q61 WeakPolarHBondContact O-CG 3.33Å; R58-Q61 VanDerWaalsContact CD-OE1 3.24Å; R58-Q61 VanDerWaalsContact NH1-OE1 3.08Å; R58-Q61 PolarHBondContact O-N 2.98Å; A59-Q61 VanDerWaalsContact C-N 3.33Å; A59-Q61 PolarHBondContact O-N 2.85Å; Q61-S65 PolarHBondContact O-N 3.45Å; Q61-S65 VanDerWaalsContact O-N 3.13Å; Q61-S65 PolarHBondContact O-OG 2.93Å
62L94.5Very high94Very high68 Ų6863.6 Ų63.636%0.35634%0.337SS..Hα-helixtrans-68.5-47.4176.2-166.467.3000110.9R58 A59 G64 S65 F66R58-L62 PolarHBondContact O-N 2.83Å; A59-L62 PolarHBondContact O-N 3.45Å; L62-G64 VanDerWaalsContact C-N 3.32Å; L62-G64 PolarHBondContact O-N 3.4Å; L62-S65 WeakPolarHBondContact O-CB 3.39Å; L62-S65 PolarHBondContact O-N 2.91Å; L62-F66 HydrophobicContact CD1-CD2 4.28Å; L62-F66 HydrophobicContact CD1-CE2 3.93Å; L62-F66 HydrophobicContact CD2-CE2 4.2Å; L62-F66 HydrophobicContact CG-CD2 3.95Å; L62-F66 HydrophobicContact CG-CE2 3.81Å; L62-F66 WeakPolarHBondContact O-CD2 3.36Å; L62-F66 PolarHBondContact O-N 2.98Å
63G95.1Very high94.1Very high0 Ų059 Ų590%031%0.313CS..Hα-helixtrans-53.1-47174.300000112.5F21 A59 S65 F66 A67F21-G63 WeakPolarHBondContact CD2-O 3.4Å; A59-G63 PolarHBondContact O-N 2.99Å; G63-S65 VanDerWaalsContact C-N 3.32Å; G63-S65 PolarHBondContact O-N 2.52Å; G63-F66 PolarHBondContact O-N 3.04Å; G63-A67 WeakPolarHBondContact O-CB 3.38Å; G63-A67 PolarHBondContact O-N 2.93Å
64G95.5Very high94Very high29 Ų2954.9 Ų54.930%0.29929%0.288SS..Hα-helixtrans-61.9-37.3176.200000113.3P60 L62 A67 V68P60-G64 PolarHBondContact O-N 3.05Å; L62-G64 VanDerWaalsContact C-N 3.32Å; L62-G64 PolarHBondContact O-N 3.4Å; G64-A67 PolarHBondContact O-N 2.93Å; G64-V68 WeakPolarHBondContact O-CG2 3.25Å; G64-V68 PolarHBondContact O-N 3.23Å
65S94.6Very high94Very high76 Ų7658.8 Ų58.853%0.53130%0.304SS..Hα-helixtrans-65.7-41.4176.6-56.10000111.7Q61 L62 G63 W69Q61-S65 PolarHBondContact O-N 3.45Å; Q61-S65 VanDerWaalsContact O-N 3.13Å; Q61-S65 PolarHBondContact O-OG 2.93Å; L62-S65 WeakPolarHBondContact O-CB 3.39Å; L62-S65 PolarHBondContact O-N 2.91Å; G63-S65 VanDerWaalsContact C-N 3.32Å; G63-S65 PolarHBondContact O-N 2.52Å; S65-W69 PolarHBondContact O-N 3.16Å; S65-W69 VanDerWaalsContact O-N 3.09Å
66F94.6Very high93.9Very high93 Ų9357.3 Ų57.341%0.40830%0.297SS..Hα-helixtrans-67.2-38.8173.9-85-83.3000112.3A20 L62 G63 W69 G70A20-F66 HydrophobicContact CB-CB 4.33Å; A20-F66 VanDerWaalsContact CB-O 3.31Å; A20-F66 WeakPolarHBondContact CB-O 3.19Å; A20-F66 VanDerWaalsContact O-CB 3.29Å; A20-F66 WeakPolarHBondContact O-CB 3.39Å; L62-F66 HydrophobicContact CD1-CD2 4.28Å; L62-F66 HydrophobicContact CD1-CE2 3.93Å; L62-F66 HydrophobicContact CD2-CE2 4.2Å; L62-F66 HydrophobicContact CG-CD2 3.95Å; L62-F66 HydrophobicContact CG-CE2 3.81Å; L62-F66 WeakPolarHBondContact O-CD2 3.36Å; L62-F66 PolarHBondContact O-N 2.98Å; G63-F66 PolarHBondContact O-N 3.04Å; F66-W69 PolarHBondContact O-N 3.02Å; F66-G70 PolarHBondContact O-N 2.91Å
67A95.8Very high93.7Very high18 Ų1849.4 Ų49.415%0.14926%0.263CS..Hα-helixtrans-60.6-46.1176.200000111.9F21 G63 G64 W69 G70 G71F21-A67 HydrophobicContact CB-CB 3.84Å; F21-A67 HydrophobicContact CD2-CB 4.18Å; G63-A67 WeakPolarHBondContact O-CB 3.38Å; G63-A67 PolarHBondContact O-N 2.93Å; G64-A67 PolarHBondContact O-N 2.93Å; A67-W69 VanDerWaalsContact C-N 3.33Å; A67-W69 PolarHBondContact O-N 3.43Å; A67-G70 PolarHBondContact O-N 3.06Å; A67-G71 PolarHBondContact O-N 3.04Å
68V95.9Very high93.5Very high87 Ų8746.9 Ų46.953%0.52725%0.248SC..Hα-helixtrans-63.5-41.4177171.30000110.9G64 L72 L103G64-V68 WeakPolarHBondContact O-CG2 3.25Å; G64-V68 PolarHBondContact O-N 3.23Å; V68-L72 WeakPolarHBondContact O-CB 3.42Å; V68-L72 PolarHBondContact O-N 3.41Å; V68-L103 HydrophobicContact CG1-CD2 3.67Å
69W94.2Very high93.2Very high91 Ų9142 Ų4235%0.34524%0.24SC..Hα-helixtrans-63.8-51.3176.8-177.188.4000112S65 F66 A67 L72 F73 T99 L103 L123S65-W69 PolarHBondContact O-N 3.16Å; S65-W69 VanDerWaalsContact O-N 3.09Å; F66-W69 PolarHBondContact O-N 3.02Å; A67-W69 VanDerWaalsContact C-N 3.33Å; A67-W69 PolarHBondContact O-N 3.43Å; W69-L72 PolarHBondContact O-N 3.4Å; W69-F73 WeakPolarHBondContact O-CB 3.36Å; W69-F73 PolarHBondContact O-N 2.9Å; W69-T99 HydrophobicContact CG-CG2 4.18Å; W69-L103 HydrophobicContact CB-CD1 4.18Å; W69-L103 HydrophobicContact CG-CD1 4.32Å; W69-L123 HydrophobicContact CH2-CD2 4.41Å
70G93.3Very high92.9Very high4 Ų443.3 Ų43.34%0.04125%0.245CC..Hα-helixtrans-62.7-44.4179.600000112.4F66 A67 L72 F73 S74F66-G70 PolarHBondContact O-N 2.91Å; A67-G70 PolarHBondContact O-N 3.06Å; G70-L72 PolarHBondContact O-N 2.88Å; G70-F73 PolarHBondContact O-N 3.43Å; G70-S74 PolarHBondContact O-N 3.47Å; G70-S74 PolarHBondContact O-OG 2.94Å
71G94Very high92.5Very high3 Ų341.8 Ų41.83%0.03124%0.235CC..Hα-helixtrans-62.5-43.8176.700000113.7C17 A67 S74 M75C17-G71 WeakPolarHBondContact SG-CA 3.35Å; A67-G71 PolarHBondContact O-N 3.04Å; G71-S74 PolarHBondContact O-N 3.07Å; G71-M75 WeakPolarHBondContact O-CB 3.26Å; G71-M75 VanDerWaalsContact O-CG 3.28Å; G71-M75 WeakPolarHBondContact O-CG 3.11Å; G71-M75 PolarHBondContact O-N 2.91Å
72L94.2Very high91.9Very high28 Ų2845.8 Ų45.815%0.14725%0.25CS..Hα-helixtrans-67.4-41178.5-177.860.6000111.8V68 W69 G70 M75 I76 T99 I102 L103V68-L72 WeakPolarHBondContact O-CB 3.42Å; V68-L72 PolarHBondContact O-N 3.41Å; W69-L72 PolarHBondContact O-N 3.4Å; G70-L72 PolarHBondContact O-N 2.88Å; L72-M75 HydrophobicContact CB-CE 4.39Å; L72-M75 HydrophobicContact CD1-CE 4.1Å; L72-M75 PolarHBondContact O-N 3.49Å; L72-I76 HydrophobicContact CD1-CD1 3.89Å; L72-I76 HydrophobicContact CD1-CG1 4.29Å; L72-I76 HydrophobicContact CG-CD1 3.87Å; L72-I76 WeakPolarHBondContact O-CD1 3.4Å; L72-I76 VanDerWaalsContact O-CG1 3.26Å; L72-I76 WeakPolarHBondContact O-CG1 3.37Å; L72-I76 PolarHBondContact O-N 3.16Å; L72-T99 HydrophobicContact CB-CG2 4.08Å; L72-T99 HydrophobicContact CD2-CG2 3.97Å; L72-T99 HydrophobicContact CG-CG2 4.03Å; L72-I102 HydrophobicContact CD1-CD1 4.32Å; L72-I102 HydrophobicContact CD2-CB 3.89Å; L72-I102 HydrophobicContact CD2-CD1 4.42Å; L72-I102 HydrophobicContact CD2-CG2 3.62Å; L72-L103 HydrophobicContact CD2-CD2 3.87Å; L72-L103 HydrophobicContact CD2-CG 3.93Å
73F93.9Very high91.4Very high30 Ų3048.5 Ų48.513%0.13227%0.27CS..Hα-helixtrans-55.2-52.3173171.8-99000111.4W69 G70 M75 I76 D77 S95 T99 L123W69-F73 WeakPolarHBondContact O-CB 3.36Å; W69-F73 PolarHBondContact O-N 2.9Å; G70-F73 PolarHBondContact O-N 3.43Å; F73-M75 PolarHBondContact O-N 2.87Å; F73-I76 PolarHBondContact O-N 3.44Å; F73-D77 PolarHBondContact O-N 3.28Å; F73-S95 WeakPolarHBondContact CD2-OG 3.37Å; F73-S95 WeakPolarHBondContact CE2-OG 3.43Å; F73-T99 VanDerWaalsContact CA-OG1 3.25Å; F73-T99 WeakPolarHBondContact CA-OG1 3.3Å; F73-T99 HydrophobicContact CB-CG2 4.41Å; F73-T99 PolarHBondContact N-OG1 2.89Å; F73-L123 HydrophobicContact CD2-CD1 3.73Å; F73-L123 HydrophobicContact CE2-CD1 3.1Å; F73-L123 HydrophobicContact CZ-CD1 3.81Å
74S91.6Very high90.7Very high0 Ų054.1 Ų54.10%029%0.291CS..Hα-helixtrans-69.1-33.8-177.6-52.40000113D16 G70 G71 I76 C78D16-S74 WeakPolarHBondContact CB-OG 3.21Å; D16-S74 WeakPolarHBondContact OD2-CB 3.31Å; D16-S74 PolarHBondContact OD2-OG 2.87Å; G70-S74 PolarHBondContact O-N 3.47Å; G70-S74 PolarHBondContact O-OG 2.94Å; G71-S74 PolarHBondContact O-N 3.07Å; S74-I76 VanDerWaalsContact C-N 3.34Å; S74-C78 WeakPolarHBondContact O-CB 3.29Å; S74-C78 PolarHBondContact O-N 3.42Å; S74-C78 PolarHBondContact O-SG 2.91Å; S74-C78 VanDerWaalsContact O-SG 3.36Å
75M91.3Very high89.7Confident101 Ų10156 Ų5650%0.49831%0.31SS..Hα-helixtrans-61.2-43.3171.8-79.3-171.9-67.600111.7I13 G71 L72 F73 G79I13-M75 HydrophobicContact CD1-CG 3.82Å; I13-M75 HydrophobicContact CG1-CG 4.19Å; I13-M75 HydrophobicContact CG2-CG 3.89Å; G71-M75 WeakPolarHBondContact O-CB 3.26Å; G71-M75 VanDerWaalsContact O-CG 3.28Å; G71-M75 WeakPolarHBondContact O-CG 3.11Å; G71-M75 PolarHBondContact O-N 2.91Å; L72-M75 HydrophobicContact CB-CE 4.39Å; L72-M75 HydrophobicContact CD1-CE 4.1Å; L72-M75 PolarHBondContact O-N 3.49Å; F73-M75 PolarHBondContact O-N 2.87Å; M75-G79 PolarHBondContact O-N 3.5Å
76I92.3Very high88.9Confident21 Ų2158.8 Ų58.811%0.10831%0.313CS..Hα-helixtrans-72-42.8180-63.5161.7000110.5L72 F73 S74 G79 L80 M98 T99 I102L72-I76 HydrophobicContact CD1-CD1 3.89Å; L72-I76 HydrophobicContact CD1-CG1 4.29Å; L72-I76 HydrophobicContact CG-CD1 3.87Å; L72-I76 WeakPolarHBondContact O-CD1 3.4Å; L72-I76 VanDerWaalsContact O-CG1 3.26Å; L72-I76 WeakPolarHBondContact O-CG1 3.37Å; L72-I76 PolarHBondContact O-N 3.16Å; F73-I76 PolarHBondContact O-N 3.44Å; S74-I76 VanDerWaalsContact C-N 3.34Å; I76-G79 PolarHBondContact O-N 3.12Å; I76-L80 HydrophobicContact CG2-CD1 4.07Å; I76-L80 HydrophobicContact CG2-CG 4.31Å; I76-L80 WeakPolarHBondContact O-CG 3.39Å; I76-L80 PolarHBondContact O-N 3.02Å; I76-M98 HydrophobicContact CD1-CB 3.89Å; I76-M98 HydrophobicContact CD1-CE 4.46Å; I76-M98 HydrophobicContact CG1-CE 4.43Å; I76-M98 HydrophobicContact CG2-CB 4.21Å; I76-M98 HydrophobicContact CG2-CE 3.8Å; I76-M98 HydrophobicContact CG2-SD 3.77Å; I76-T99 WeakPolarHBondContact CD1-OG1 3.48Å; I76-I102 HydrophobicContact CD1-CD1 3.8Å
77D90.5Very high87.9Confident4 Ų460.2 Ų60.22%0.02132%0.321CS..Hα-helixtrans-60.4-51.4177.3-168.551.9000111.3R6 F73 G79 L80 V81 N91R6-D77 IonicContact NH2-OD2 3.6Å; R6-D77 PolarHBondContact NH2-OD2 3.05Å; F73-D77 PolarHBondContact O-N 3.28Å; D77-G79 VanDerWaalsContact C-N 3.26Å; D77-G79 PolarHBondContact O-N 3.39Å; D77-L80 PolarHBondContact O-N 3.35Å; D77-L80 VanDerWaalsContact O-N 3.12Å; D77-V81 WeakPolarHBondContact O-CG2 3.45Å; D77-V81 PolarHBondContact O-N 3.44Å; D77-N91 WeakPolarHBondContact OD1-CB 3.35Å
78C88.4Confident87.2Confident15 Ų1562.4 Ų62.410%0.10133%0.33CS..Hα-helixtrans-55.2-40.8173.6-81.10000112.4C9 S74 K82C9-C78 HydrophobicContact CB-CB 3.84Å; C9-C78 WeakPolarHBondContact CB-SG 3.42Å; C9-C78 WeakPolarHBondContact SG-CB 3.12Å; C9-C78 CovalentContact SG-SG 2.04Å; C9-C78 PolarHBondContact SG-SG 3.13Å; S74-C78 WeakPolarHBondContact O-CB 3.29Å; S74-C78 PolarHBondContact O-N 3.42Å; S74-C78 PolarHBondContact O-SG 2.91Å; S74-C78 VanDerWaalsContact O-SG 3.36Å; C78-K82 WeakPolarHBondContact O-CB 3.38Å; C78-K82 PolarHBondContact O-N 3.47Å
79G86.4Confident86.6Confident34 Ų3460.8 Ų60.835%0.35132%0.321SS..Hα-helixtrans-64.5-44.7176.500000112.6M75 I76 D77 K82 V83M75-G79 PolarHBondContact O-N 3.5Å; I76-G79 PolarHBondContact O-N 3.12Å; D77-G79 VanDerWaalsContact C-N 3.26Å; D77-G79 PolarHBondContact O-N 3.39Å; G79-K82 PolarHBondContact O-N 3.35Å; G79-V83 WeakPolarHBondContact O-CG2 3.44Å; G79-V83 PolarHBondContact O-N 2.85Å
80L85.9Confident86.2Confident36 Ų3664.4 Ų64.419%0.18834%0.335CS..Hα-helixtrans-65.4-42.2178.4-72.1175.8000111.8I76 D77 K82 V83 R84 T94I76-L80 HydrophobicContact CG2-CD1 4.07Å; I76-L80 HydrophobicContact CG2-CG 4.31Å; I76-L80 WeakPolarHBondContact O-CG 3.39Å; I76-L80 PolarHBondContact O-N 3.02Å; D77-L80 PolarHBondContact O-N 3.35Å; D77-L80 VanDerWaalsContact O-N 3.12Å; L80-K82 VanDerWaalsContact C-N 3.34Å; L80-K82 PolarHBondContact O-N 2.87Å; L80-V83 PolarHBondContact O-N 2.83Å; L80-R84 WeakPolarHBondContact O-CB 3.22Å; L80-R84 PolarHBondContact O-N 2.9Å; L80-T94 HydrophobicContact CD1-CG2 4.24Å
81V85.2Confident86Confident33 Ų3364.3 Ų64.320%0.233%0.333CS..Hα-helixtrans-61.4-441751740000110.6D77 V83 G85 E87D77-V81 WeakPolarHBondContact O-CG2 3.45Å; D77-V81 PolarHBondContact O-N 3.44Å; V81-V83 VanDerWaalsContact C-N 3.34Å; V81-V83 PolarHBondContact O-N 2.69Å; V81-G85 WeakPolarHBondContact O-CA 3.46Å; V81-G85 PolarHBondContact O-N 3.25Å; V81-E87 HydrophobicContact CG1-CG 4Å; V81-E87 HydrophobicContact CG2-CG 4.02Å
82K82.5Confident85.6Confident190 Ų19064.7 Ų64.783%0.82634%0.336SS*.Hα-helixtrans-63.3-36.7177.6-175.6168.1-176.4161.50113.3C78 G79 L80C78-K82 WeakPolarHBondContact O-CB 3.38Å; C78-K82 PolarHBondContact O-N 3.47Å; G79-K82 PolarHBondContact O-N 3.35Å; L80-K82 VanDerWaalsContact C-N 3.34Å; L80-K82 PolarHBondContact O-N 2.87Å
83V83.7Confident85.5Confident126 Ų12665.1 Ų65.176%0.76434%0.338SS*.Hα-helixtrans-79.2-40.6-179.71720000112G79 L80 V81G79-V83 WeakPolarHBondContact O-CG2 3.44Å; G79-V83 PolarHBondContact O-N 2.85Å; L80-V83 PolarHBondContact O-N 2.83Å; V81-V83 VanDerWaalsContact C-N 3.34Å; V81-V83 PolarHBondContact O-N 2.69Å
84R80.8Confident85.4Confident118 Ų11866 Ų6645%0.44535%0.346SS..Hα-helixtrans-93.1-20.4-172.7-67177.459.7157.5-6113.8L80 K86 D88L80-R84 WeakPolarHBondContact O-CB 3.22Å; L80-R84 PolarHBondContact O-N 2.9Å; R84-K86 PolarHBondContact O-N 3.44Å; R84-K86 VanDerWaalsContact O-N 3.1Å; R84-D88 IonicContact NH2-OD2 3.67Å
85G75.1Confident85.4Confident68 Ų6866 Ų6670%0.70135%0.346SS*.SBendtrans59.118.6-176.100000113.8V81V81-G85 WeakPolarHBondContact O-CA 3.46Å; V81-G85 PolarHBondContact O-N 3.25Å
86K76.8Confident85.4Confident135 Ų13561.2 Ų61.259%0.58732%0.322SS*.  trans-136.1138.4179.6-64.9-167.3-179.6750109.3R84 N91R84-K86 PolarHBondContact O-N 3.44Å; R84-K86 VanDerWaalsContact O-N 3.1Å; K86-N91 PolarHBondContact O-ND2 2.95Å
87E74.3Confident85.6Confident122 Ų12261.4 Ų61.457%0.5733%0.327SS*.  trans-103.396.3174.5-59.3-158.8149.300109.1R6 V81R6-E87 IonicContact NE-OE1 3.98Å; R6-E87 IonicContact NE-OE2 2.93Å; V81-E87 HydrophobicContact CG1-CG 4Å; V81-E87 HydrophobicContact CG2-CG 4.02Å
88D81.8Confident85.7Confident64 Ų6464.9 Ų64.934%0.34234%0.344SS..  trans-114.3154.2177.4-62.9-51.1000109.9R84 W90 N91R84-D88 IonicContact NH2-OD2 3.67Å; D88-W90 HydrophobicContact CB-CB 4.33Å; D88-W90 PolarHBondContact O-N 3.41Å; D88-N91 WeakPolarHBondContact O-CB 3.36Å; D88-N91 PolarHBondContact O-N 2.96Å
89P83.2Confident86Confident54 Ų5464.2 Ų64.235%0.35134%0.339SS..Hα-helixtrans-54-24171.9-26.634.6000113.6N91 S92 I93 E127 I131P89-N91 PolarHBondContact O-N 2.82Å; P89-S92 PolarHBondContact O-N 3.22Å; P89-I93 WeakPolarHBondContact O-CG1 3.38Å; P89-I93 PolarHBondContact O-N 3.01Å; P89-I93 VanDerWaalsContact O-N 3.12Å; P89-E127 HydrophobicContact CB-CB 4.34Å; P89-I131 HydrophobicContact CG-CD1 4.19Å
90W84.8Confident86.4Confident166 Ų16663 Ų6363%0.62933%0.327SS*.Hα-helixtrans-61.9-28.3172.8-84.1104.2000113.9D88 T94D88-W90 HydrophobicContact CB-CB 4.33Å; D88-W90 PolarHBondContact O-N 3.41Å; W90-T94 WeakPolarHBondContact O-CB 3.46Å; W90-T94 PolarHBondContact O-N 3Å; W90-T94 PolarHBondContact O-OG1 3.44Å
91N88.8Confident86.8Confident2 Ų262.2 Ų62.21%0.01133%0.326CS..Hα-helixtrans-66.8-50176.4-67.2-9.1000109.9D77 K86 D88 P89 I93 T94 S95D77-N91 WeakPolarHBondContact OD1-CB 3.35Å; K86-N91 PolarHBondContact O-ND2 2.95Å; D88-N91 WeakPolarHBondContact O-CB 3.36Å; D88-N91 PolarHBondContact O-N 2.96Å; P89-N91 PolarHBondContact O-N 2.82Å; N91-I93 PolarHBondContact O-N 3.34Å; N91-T94 PolarHBondContact O-N 3.42Å; N91-S95 VanDerWaalsContact O-CB 3.29Å; N91-S95 WeakPolarHBondContact O-CB 3.24Å; N91-S95 PolarHBondContact O-N 3.04Å; N91-S95 PolarHBondContact O-OG 2.9Å
92S86.5Confident87.3Confident12 Ų1264.7 Ų64.78%0.08434%0.337CS..Hα-helixtrans-57.6-45.6174.7-60.30000112.4P89 T94 S95 G96 L123 E127P89-S92 PolarHBondContact O-N 3.22Å; S92-T94 PolarHBondContact O-N 3.31Å; S92-S95 WeakPolarHBondContact CA-OG 3.36Å; S92-S95 PolarHBondContact O-OG 3.43Å; S92-G96 PolarHBondContact O-N 2.74Å; S92-L123 VanDerWaalsContact O-CD1 3.26Å; S92-L123 WeakPolarHBondContact O-CD1 3.21Å; S92-E127 WeakPolarHBondContact CB-OE1 3.48Å; S92-E127 PolarHBondContact OG-OE1 2.77Å
93I91.4Very high87.8Confident37 Ų3758.8 Ų58.819%0.1931%0.314CS..Hα-helixtrans-64-45.5179.9-64.2168.3000110.8P89 N91 G96 A97 A124P89-I93 WeakPolarHBondContact O-CG1 3.38Å; P89-I93 PolarHBondContact O-N 3.01Å; P89-I93 VanDerWaalsContact O-N 3.12Å; N91-I93 PolarHBondContact O-N 3.34Å; I93-G96 PolarHBondContact O-N 3.07Å; I93-A97 PolarHBondContact O-N 2.92Å; I93-A124 HydrophobicContact CD1-CB 3.89Å; I93-A124 HydrophobicContact CG1-CB 4.01Å; I93-A124 HydrophobicContact CG2-CB 4.48Å
94T91.5Very high88.3Confident48 Ų4853.1 Ų53.129%0.29428%0.281SS..Hα-helixtrans-68.8-41.6-178.5-540000111.1L80 W90 N91 S92 G96 A97 M98L80-T94 HydrophobicContact CD1-CG2 4.24Å; W90-T94 WeakPolarHBondContact O-CB 3.46Å; W90-T94 PolarHBondContact O-N 3Å; W90-T94 PolarHBondContact O-OG1 3.44Å; N91-T94 PolarHBondContact O-N 3.42Å; S92-T94 PolarHBondContact O-N 3.31Å; T94-G96 VanDerWaalsContact C-N 3.34Å; T94-G96 PolarHBondContact O-N 3.23Å; T94-A97 PolarHBondContact O-N 3.02Å; T94-M98 HydrophobicContact CG2-CG 4.36Å; T94-M98 HydrophobicContact CG2-SD 4.12Å; T94-M98 WeakPolarHBondContact O-CB 3.08Å; T94-M98 VanDerWaalsContact O-CG 3.31Å; T94-M98 WeakPolarHBondContact O-CG 3.24Å; T94-M98 PolarHBondContact O-N 3.02Å
95S92Very high88.9Confident0 Ų049.9 Ų49.90%028%0.279CS..Hα-helixtrans-66-37177.159.40000111.5F73 N91 S92 M98 T99F73-S95 WeakPolarHBondContact CD2-OG 3.37Å; F73-S95 WeakPolarHBondContact CE2-OG 3.43Å; N91-S95 VanDerWaalsContact O-CB 3.29Å; N91-S95 WeakPolarHBondContact O-CB 3.24Å; N91-S95 PolarHBondContact O-N 3.04Å; N91-S95 PolarHBondContact O-OG 2.9Å; S92-S95 WeakPolarHBondContact CA-OG 3.36Å; S92-S95 PolarHBondContact O-OG 3.43Å; S95-M98 PolarHBondContact O-N 2.91Å; S95-T99 VanDerWaalsContact O-CB 3.24Å; S95-T99 WeakPolarHBondContact O-CB 3.38Å; S95-T99 PolarHBondContact O-N 3.33Å; S95-T99 PolarHBondContact O-OG1 3.2Å
96G92.4Very high89.8Confident0 Ų057.3 Ų57.30%029%0.286CS..Hα-helixtrans-61.7-46.8170.900000113.2S92 I93 T94 T99 G100S92-G96 PolarHBondContact O-N 2.74Å; I93-G96 PolarHBondContact O-N 3.07Å; T94-G96 VanDerWaalsContact C-N 3.34Å; T94-G96 PolarHBondContact O-N 3.23Å; G96-T99 PolarHBondContact O-N 3.25Å; G96-G100 PolarHBondContact O-N 3.47Å
97A94.8Very high90.6Very high26 Ų2656 Ų5622%0.21529%0.285CS..Hα-helixtrans-63.3-45176.700000111.9I93 T94 G100 A101 A116I93-A97 PolarHBondContact O-N 2.92Å; T94-A97 PolarHBondContact O-N 3.02Å; A97-G100 PolarHBondContact O-N 3.37Å; A97-A101 WeakPolarHBondContact O-CB 3.41Å; A97-A101 PolarHBondContact O-N 2.9Å; A97-A116 WeakPolarHBondContact CA-O 3.47Å; A97-A116 WeakPolarHBondContact O-CA 3.35Å; A97-A116 WeakPolarHBondContact O-CB 3.42Å
98M94.1Very high91.6Very high77 Ų7751.4 Ų51.438%0.37927%0.27SS..Hα-helixtrans-64.6-43.2177.5-74.9-178.557.900112.1I76 T94 S95 G100 A101 I102I76-M98 HydrophobicContact CD1-CB 3.89Å; I76-M98 HydrophobicContact CD1-CE 4.46Å; I76-M98 HydrophobicContact CG1-CE 4.43Å; I76-M98 HydrophobicContact CG2-CB 4.21Å; I76-M98 HydrophobicContact CG2-CE 3.8Å; I76-M98 HydrophobicContact CG2-SD 3.77Å; T94-M98 HydrophobicContact CG2-CG 4.36Å; T94-M98 HydrophobicContact CG2-SD 4.12Å; T94-M98 WeakPolarHBondContact O-CB 3.08Å; T94-M98 VanDerWaalsContact O-CG 3.31Å; T94-M98 WeakPolarHBondContact O-CG 3.24Å; T94-M98 PolarHBondContact O-N 3.02Å; S95-M98 PolarHBondContact O-N 2.91Å; M98-G100 VanDerWaalsContact C-N 3.33Å; M98-G100 PolarHBondContact O-N 2.93Å; M98-A101 PolarHBondContact O-N 3.39Å; M98-I102 WeakPolarHBondContact O-CB 3.48Å; M98-I102 WeakPolarHBondContact O-CD1 3.29Å; M98-I102 VanDerWaalsContact O-CG1 3.25Å; M98-I102 WeakPolarHBondContact O-CG1 3.34Å; M98-I102 PolarHBondContact O-N 2.79Å
99T94.6Very high92.1Very high0 Ų053.2 Ų53.20%029%0.286CS..Hα-helixtrans-58-48.2175.6-60.50000110.4W69 L72 F73 I76 S95 G96 A101 I102 L103W69-T99 HydrophobicContact CG-CG2 4.18Å; L72-T99 HydrophobicContact CB-CG2 4.08Å; L72-T99 HydrophobicContact CD2-CG2 3.97Å; L72-T99 HydrophobicContact CG-CG2 4.03Å; F73-T99 VanDerWaalsContact CA-OG1 3.25Å; F73-T99 WeakPolarHBondContact CA-OG1 3.3Å; F73-T99 HydrophobicContact CB-CG2 4.41Å; F73-T99 PolarHBondContact N-OG1 2.89Å; I76-T99 WeakPolarHBondContact CD1-OG1 3.48Å; S95-T99 VanDerWaalsContact O-CB 3.24Å; S95-T99 WeakPolarHBondContact O-CB 3.38Å; S95-T99 PolarHBondContact O-N 3.33Å; S95-T99 PolarHBondContact O-OG1 3.2Å; G96-T99 PolarHBondContact O-N 3.25Å; T99-A101 PolarHBondContact O-N 3.34Å; T99-I102 PolarHBondContact O-N 2.83Å; T99-L103 HydrophobicContact CG2-CD1 3.99Å; T99-L103 VanDerWaalsContact O-CG 3.28Å; T99-L103 WeakPolarHBondContact O-CG 3.06Å; T99-L103 PolarHBondContact O-N 2.9Å
100G93.5Very high92.7Very high9 Ų956.8 Ų56.89%0.09331%0.306CS..Hα-helixtrans-57.2-48.3175.500000112.2G96 A97 M98 I102 A104 S115G96-G100 PolarHBondContact O-N 3.47Å; A97-G100 PolarHBondContact O-N 3.37Å; M98-G100 VanDerWaalsContact C-N 3.33Å; M98-G100 PolarHBondContact O-N 2.93Å; G100-I102 PolarHBondContact O-N 3.29Å; G100-A104 PolarHBondContact O-N 2.92Å; G100-S115 VanDerWaalsContact O-CB 3.31Å; G100-S115 WeakPolarHBondContact O-CB 3.43Å; G100-S115 PolarHBondContact O-OG 3.19Å
101A95.3Very high93.2Very high20 Ų2050.6 Ų50.617%0.16529%0.29CS..Hα-helixtrans-59-48.8179.400000112A97 M98 T99 L103 A104 A105 A116A97-A101 WeakPolarHBondContact O-CB 3.41Å; A97-A101 PolarHBondContact O-N 2.9Å; M98-A101 PolarHBondContact O-N 3.39Å; T99-A101 PolarHBondContact O-N 3.34Å; A101-L103 PolarHBondContact O-N 3.47Å; A101-A104 CarbonylContact O-C 3.54Å; A101-A104 PolarHBondContact O-N 3.45Å; A101-A105 PolarHBondContact O-N 3.21Å; A101-A116 HydrophobicContact CB-CB 3.98Å
102I95.5Very high93.5Very high84 Ų8453.6 Ų53.643%0.43131%0.305SS..Hα-helixtrans-64.3-43.8-176.4-69.7163.2000110.8L72 I76 M98 T99 G100 A104 A105L72-I102 HydrophobicContact CD1-CD1 4.32Å; L72-I102 HydrophobicContact CD2-CB 3.89Å; L72-I102 HydrophobicContact CD2-CD1 4.42Å; L72-I102 HydrophobicContact CD2-CG2 3.62Å; I76-I102 HydrophobicContact CD1-CD1 3.8Å; M98-I102 WeakPolarHBondContact O-CB 3.48Å; M98-I102 WeakPolarHBondContact O-CD1 3.29Å; M98-I102 VanDerWaalsContact O-CG1 3.25Å; M98-I102 WeakPolarHBondContact O-CG1 3.34Å; M98-I102 PolarHBondContact O-N 2.79Å; T99-I102 PolarHBondContact O-N 2.83Å; G100-I102 PolarHBondContact O-N 3.29Å; I102-A104 VanDerWaalsContact C-N 3.25Å; I102-A104 PolarHBondContact O-N 2.91Å; I102-A105 WeakPolarHBondContact O-CB 3.14Å; I102-A105 PolarHBondContact O-N 3.45Å; I102-A105 VanDerWaalsContact O-N 3.15Å
103L93.9Very high93.9Very high67 Ų6757.9 Ų57.935%0.35133%0.331SS..Hα-helixtrans-67.3-27.6-179.7-65.4176.2000113.1V68 W69 L72 T99 A101V68-L103 HydrophobicContact CG1-CD2 3.67Å; W69-L103 HydrophobicContact CB-CD1 4.18Å; W69-L103 HydrophobicContact CG-CD1 4.32Å; L72-L103 HydrophobicContact CD2-CD2 3.87Å; L72-L103 HydrophobicContact CD2-CG 3.93Å; T99-L103 HydrophobicContact CG2-CD1 3.99Å; T99-L103 VanDerWaalsContact O-CG 3.28Å; T99-L103 WeakPolarHBondContact O-CG 3.06Å; T99-L103 PolarHBondContact O-N 2.9Å; A101-L103 PolarHBondContact O-N 3.47Å
104A94.3Very high94.1Very high7 Ų758.2 Ų58.26%0.05834%0.343CS..THydrogen-bonded Turntrans-93.20.9176.100000113.7G100 A101 I102 R106 N107 A111 S115G100-A104 PolarHBondContact O-N 2.92Å; A101-A104 CarbonylContact O-C 3.54Å; A101-A104 PolarHBondContact O-N 3.45Å; I102-A104 VanDerWaalsContact C-N 3.25Å; I102-A104 PolarHBondContact O-N 2.91Å; A104-R106 PolarHBondContact O-N 2.91Å; A104-R106 VanDerWaalsContact O-N 3.14Å; A104-N107 WeakPolarHBondContact O-CB 3.29Å; A104-N107 PolarHBondContact O-N 3.47Å; A104-A111 HydrophobicContact CB-CB 4.37Å; A104-S115 WeakPolarHBondContact CB-OG 3.24Å
105A93.4Very high94.3Very high49 Ų4957 Ų5741%0.40534%0.337SS..G310 helixtrans-53.4-39.9-175.100000113.3A101 I102 N107 G108 M112A101-A105 PolarHBondContact O-N 3.21Å; I102-A105 WeakPolarHBondContact O-CB 3.14Å; I102-A105 PolarHBondContact O-N 3.45Å; I102-A105 VanDerWaalsContact O-N 3.15Å; A105-N107 PolarHBondContact O-N 3.33Å; A105-G108 PolarHBondContact O-N 2.77Å; A105-M112 HydrophobicContact CB-CE 4.24Å; A105-M112 HydrophobicContact CB-CG 4.42Å; A105-M112 HydrophobicContact CB-SD 4.19Å
106R93.4Very high94.4Very high224 Ų22458.1 Ų58.185%0.84535%0.345SS*.G310 helixtrans-70.3-16.4178.670.7179-176.2-174.5-2114.8A104 G108A104-R106 PolarHBondContact O-N 2.91Å; A104-R106 VanDerWaalsContact O-N 3.14Å; R106-G108 VanDerWaalsContact C-N 3.33Å
107N93.3Very high94.5Very high108 Ų10860.5 Ų60.558%0.57837%0.366SS*.G310 helixtrans-92.42.6-177.9-58.6-36.8000112.2A104 A105 A111A104-N107 WeakPolarHBondContact O-CB 3.29Å; A104-N107 PolarHBondContact O-N 3.47Å; A105-N107 PolarHBondContact O-N 3.33Å; N107-A111 HydrophobicContact CB-CB 3.55Å
108G94.4Very high94.5Very high25 Ų2565.2 Ų65.226%0.25838%0.384SS..  trans95.5168.1176.900000114.5A105 R106 V110 A111 M112A105-G108 PolarHBondContact O-N 2.77Å; R106-G108 VanDerWaalsContact C-N 3.33Å; G108-V110 VanDerWaalsContact C-N 3.34Å; G108-V110 PolarHBondContact O-N 3.47Å; G108-A111 PolarHBondContact O-N 2.98Å; G108-A111 VanDerWaalsContact O-N 3.15Å; G108-M112 WeakPolarHBondContact O-CG 3.39Å; G108-M112 PolarHBondContact O-N 3.26Å; G108-M112 VanDerWaalsContact O-N 3.09Å
109P93.8Very high94.3Very high103 Ų10362 Ų6267%0.66937%0.371SS*.Hα-helixtrans-61.5-36.8-169-24.834.2000114.3M112 V113P109-M112 WeakPolarHBondContact O-CB 3.37Å; P109-M112 PolarHBondContact O-N 3.12Å; P109-V113 WeakPolarHBondContact O-CG2 3.3Å; P109-V113 PolarHBondContact O-N 2.91Å
110V95.4Very high94.2Very high129 Ų12962.4 Ų62.478%0.78238%0.376SS*.Hα-helixtrans-65.4-42179179.40000110.9G108 M112 V113 G114G108-V110 VanDerWaalsContact C-N 3.34Å; G108-V110 PolarHBondContact O-N 3.47Å; V110-M112 VanDerWaalsContact C-N 3.33Å; V110-V113 PolarHBondContact O-N 3.33Å; V110-G114 PolarHBondContact O-N 2.87Å
111A94.4Very high94.3Very high35 Ų3567 Ų6729%0.28940%0.397SS..Hα-helixtrans-66.2-37.1176.800000111.6A104 N107 G108 G114 S115A104-A111 HydrophobicContact CB-CB 4.37Å; N107-A111 HydrophobicContact CB-CB 3.55Å; G108-A111 PolarHBondContact O-N 2.98Å; G108-A111 VanDerWaalsContact O-N 3.15Å; A111-G114 PolarHBondContact O-N 3.45Å; A111-S115 WeakPolarHBondContact O-CB 3.41Å; A111-S115 PolarHBondContact O-N 2.96Å; A111-S115 PolarHBondContact O-OG 2.86Å; A111-S115 VanDerWaalsContact O-OG 3.06Å
112M95.6Very high94.1Very high65 Ų6570.6 Ų70.632%0.3241%0.413SS..Hα-helixtrans-60.9-47.8174.5-66.3175.269.100112.5A105 G108 P109 V110 S115 A116A105-M112 HydrophobicContact CB-CE 4.24Å; A105-M112 HydrophobicContact CB-CG 4.42Å; A105-M112 HydrophobicContact CB-SD 4.19Å; G108-M112 WeakPolarHBondContact O-CG 3.39Å; G108-M112 PolarHBondContact O-N 3.26Å; G108-M112 VanDerWaalsContact O-N 3.09Å; P109-M112 WeakPolarHBondContact O-CB 3.37Å; P109-M112 PolarHBondContact O-N 3.12Å; V110-M112 VanDerWaalsContact C-N 3.33Å; M112-S115 PolarHBondContact O-OG 2.86Å; M112-A116 WeakPolarHBondContact O-CB 3.22Å; M112-A116 PolarHBondContact O-N 3.08Å
113V95.7Very high94Very high103 Ų10367.2 Ų67.262%0.62440%0.396SS*.Hα-helixtrans-66.1-42.5179.7175.30000110.3P109 V110 A116 A117P109-V113 WeakPolarHBondContact O-CG2 3.3Å; P109-V113 PolarHBondContact O-N 2.91Å; V110-V113 PolarHBondContact O-N 3.33Å; V113-A116 PolarHBondContact O-N 3.42Å; V113-A117 WeakPolarHBondContact O-CB 3.39Å; V113-A117 PolarHBondContact O-N 3.46Å
114G94.9Very high93.9Very high43 Ų4365.9 Ų65.944%0.44339%0.394SS..Hα-helixtrans-61.4-45.3177.200000113.1V110 A111 M118V110-G114 PolarHBondContact O-N 2.87Å; A111-G114 PolarHBondContact O-N 3.45Å; G114-M118 PolarHBondContact O-N 2.98Å
115S94.8Very high93.7Very high24 Ų2471.1 Ų71.117%0.16842%0.421CS..Hα-helixtrans-70.9-36178.264.60000112.6G100 A104 A111 M112 M118 G119G100-S115 VanDerWaalsContact O-CB 3.31Å; G100-S115 WeakPolarHBondContact O-CB 3.43Å; G100-S115 PolarHBondContact O-OG 3.19Å; A104-S115 WeakPolarHBondContact CB-OG 3.24Å; A111-S115 WeakPolarHBondContact O-CB 3.41Å; A111-S115 PolarHBondContact O-N 2.96Å; A111-S115 PolarHBondContact O-OG 2.86Å; A111-S115 VanDerWaalsContact O-OG 3.06Å; M112-S115 PolarHBondContact O-OG 2.86Å; S115-M118 PolarHBondContact O-N 3.11Å; S115-G119 PolarHBondContact O-N 3.37Å
116A94.3Very high93.6Very high22 Ų2274 Ų7418%0.18243%0.428CS..Hα-helixtrans-62.8-45.8174.800000111.4A97 A101 M112 V113 G119 G120A97-A116 WeakPolarHBondContact CA-O 3.47Å; A97-A116 WeakPolarHBondContact O-CA 3.35Å; A97-A116 WeakPolarHBondContact O-CB 3.42Å; A101-A116 HydrophobicContact CB-CB 3.98Å; M112-A116 WeakPolarHBondContact O-CB 3.22Å; M112-A116 PolarHBondContact O-N 3.08Å; V113-A116 PolarHBondContact O-N 3.42Å; A116-G119 PolarHBondContact O-N 2.93Å; A116-G120 PolarHBondContact O-N 2.82Å
117A95.4Very high93.3Very high51 Ų5166.3 Ų66.342%0.42140%0.402SS..Hα-helixtrans-60.6-47.5176.300000111.1V113 G119 G120 I121V113-A117 WeakPolarHBondContact O-CB 3.39Å; V113-A117 PolarHBondContact O-N 3.46Å; A117-G119 PolarHBondContact O-N 3.46Å; A117-G120 PolarHBondContact O-N 3.47Å; A117-I121 WeakPolarHBondContact O-CB 3.47Å; A117-I121 WeakPolarHBondContact O-CD1 3.31Å; A117-I121 WeakPolarHBondContact O-CG1 3.17Å; A117-I121 PolarHBondContact O-N 2.92Å
118M93.8Very high93Very high124 Ų12463 Ų6361%0.61139%0.393SS*.Hα-helixtrans-62.7-44.4178.5-169.916271.400112.1G114 S115 L122G114-M118 PolarHBondContact O-N 2.98Å; S115-M118 PolarHBondContact O-N 3.11Å; M118-L122 HydrophobicContact CG-CD1 4.02Å; M118-L122 HydrophobicContact CG-CG 4.49Å; M118-L122 WeakPolarHBondContact O-CB 3.39Å; M118-L122 VanDerWaalsContact O-CG 3.22Å; M118-L122 WeakPolarHBondContact O-CG 3.45Å; M118-L122 PolarHBondContact O-N 2.95Å
119G91.3Very high92.7Very high9 Ų964 Ų649%0.09340%0.399CS..Hα-helixtrans-62.4-45.3176.900000113S115 A116 A117 L123S115-G119 PolarHBondContact O-N 3.37Å; A116-G119 PolarHBondContact O-N 2.93Å; A117-G119 PolarHBondContact O-N 3.46Å; G119-L123 PolarHBondContact O-N 3.33Å; G119-L123 VanDerWaalsContact O-N 3.16Å
120G92.5Very high92.3Very high10 Ų1060.6 Ų60.610%0.10338%0.382CS..Hα-helixtrans-64.8-44177.600000112.9A116 A117 L123 A124A116-G120 PolarHBondContact O-N 2.82Å; A117-G120 PolarHBondContact O-N 3.47Å; G120-L123 PolarHBondContact O-N 3.47Å; G120-A124 VanDerWaalsContact O-CB 3.25Å; G120-A124 WeakPolarHBondContact O-CB 3.32Å; G120-A124 PolarHBondContact O-N 2.87Å
121I94.2Very high91.9Very high104 Ų10458.7 Ų58.753%0.53337%0.367SS..Hα-helixtrans-63.5-46.1177.9-69165.3000110.8A117 L123 A124 L125A117-I121 WeakPolarHBondContact O-CB 3.47Å; A117-I121 WeakPolarHBondContact O-CD1 3.31Å; A117-I121 WeakPolarHBondContact O-CG1 3.17Å; A117-I121 PolarHBondContact O-N 2.92Å; I121-L123 PolarHBondContact O-N 3.01Å; I121-A124 PolarHBondContact O-N 2.95Å; I121-L125 HydrophobicContact CG2-CD1 4.21Å; I121-L125 WeakPolarHBondContact O-CG 3.43Å; I121-L125 PolarHBondContact O-N 2.88Å
122L92.8Very high91.4Very high96 Ų9662.9 Ų62.950%0.50338%0.384SS..Hα-helixtrans-60.4-44.9-179.4-74.8171.6000111.8M118 L125 I126M118-L122 HydrophobicContact CG-CD1 4.02Å; M118-L122 HydrophobicContact CG-CG 4.49Å; M118-L122 WeakPolarHBondContact O-CB 3.39Å; M118-L122 VanDerWaalsContact O-CG 3.22Å; M118-L122 WeakPolarHBondContact O-CG 3.45Å; M118-L122 PolarHBondContact O-N 2.95Å; L122-L125 PolarHBondContact O-N 2.98Å; L122-I126 WeakPolarHBondContact O-CG1 3.26Å; L122-I126 PolarHBondContact O-N 3.25Å
123L91.9Very high91Very high14 Ų1465.6 Ų65.67%0.07340%0.399CS..Hα-helixtrans-75.4-30.1179.4-63.2-155.7000112.9W69 F73 S92 G119 G120 I121 L125 I126 E127W69-L123 HydrophobicContact CH2-CD2 4.41Å; F73-L123 HydrophobicContact CD2-CD1 3.73Å; F73-L123 HydrophobicContact CE2-CD1 3.1Å; F73-L123 HydrophobicContact CZ-CD1 3.81Å; S92-L123 VanDerWaalsContact O-CD1 3.26Å; S92-L123 WeakPolarHBondContact O-CD1 3.21Å; G119-L123 PolarHBondContact O-N 3.33Å; G119-L123 VanDerWaalsContact O-N 3.16Å; G120-L123 PolarHBondContact O-N 3.47Å; I121-L123 PolarHBondContact O-N 3.01Å; L123-L125 VanDerWaalsContact C-N 3.27Å; L123-L125 PolarHBondContact O-N 3.49Å; L123-I126 HydrophobicContact CD2-CD1 3.67Å; L123-I126 PolarHBondContact O-N 2.88Å; L123-E127 WeakPolarHBondContact O-CB 3.3Å; L123-E127 WeakPolarHBondContact O-CG 3.29Å; L123-E127 PolarHBondContact O-N 2.62Å
124A91.9Very high90.4Very high39 Ų3965.4 Ų65.432%0.32240%0.398SS..Hα-helixtrans-61-38.7170.300000111.8I93 G120 I121 G128I93-A124 HydrophobicContact CD1-CB 3.89Å; I93-A124 HydrophobicContact CG1-CB 4.01Å; I93-A124 HydrophobicContact CG2-CB 4.48Å; G120-A124 VanDerWaalsContact O-CB 3.25Å; G120-A124 WeakPolarHBondContact O-CB 3.32Å; G120-A124 PolarHBondContact O-N 2.87Å; I121-A124 PolarHBondContact O-N 2.95Å; A124-G128 WeakPolarHBondContact O-CA 3.36Å; A124-G128 PolarHBondContact O-N 3.37Å
125L91.5Very high89.8Confident117 Ų11772 Ų7261%0.61341%0.41SS*.Hα-helixtrans-68.9-40.4174.5-69.1174000112.2I121 L122 L123 A129I121-L125 HydrophobicContact CG2-CD1 4.21Å; I121-L125 WeakPolarHBondContact O-CG 3.43Å; I121-L125 PolarHBondContact O-N 2.88Å; L122-L125 PolarHBondContact O-N 2.98Å; L123-L125 VanDerWaalsContact C-N 3.27Å; L123-L125 PolarHBondContact O-N 3.49Å; L125-A129 WeakPolarHBondContact O-CB 3.41Å; L125-A129 PolarHBondContact O-N 2.78Å
126I90.4Very high89.1Confident109 Ų10977 Ų7756%0.55943%0.429SS*.Hα-helixtrans-65.7-49.7179.1-71.2164.8000111L122 L123 A129 G130L122-I126 WeakPolarHBondContact O-CG1 3.26Å; L122-I126 PolarHBondContact O-N 3.25Å; L123-I126 HydrophobicContact CD2-CD1 3.67Å; L123-I126 PolarHBondContact O-N 2.88Å; I126-A129 PolarHBondContact O-N 3.49Å; I126-G130 PolarHBondContact O-N 3.43Å
127E88Confident88.4Confident62 Ų6278.4 Ų78.429%0.2944%0.44SS..Hα-helixtrans-65.2-41177.1-67.1-66.6167.300111.4P89 S92 L123 A129 G130 I131P89-E127 HydrophobicContact CB-CB 4.34Å; S92-E127 WeakPolarHBondContact CB-OE1 3.48Å; S92-E127 PolarHBondContact OG-OE1 2.77Å; L123-E127 WeakPolarHBondContact O-CB 3.3Å; L123-E127 WeakPolarHBondContact O-CG 3.29Å; L123-E127 PolarHBondContact O-N 2.62Å; E127-A129 PolarHBondContact O-N 3.43Å; E127-G130 PolarHBondContact O-N 3.34Å; E127-I131 WeakPolarHBondContact O-CG1 3.3Å; E127-I131 PolarHBondContact O-N 2.95Å
128G86.6Confident87.2Confident38 Ų3879.2 Ų79.239%0.39244%0.443SS..Hα-helixtrans-61.7-42.117600000112.9A124 L132A124-G128 WeakPolarHBondContact O-CA 3.36Å; A124-G128 PolarHBondContact O-N 3.37Å; G128-L132 PolarHBondContact O-N 2.82Å; G128-L132 VanDerWaalsContact O-N 3.08Å
129A88Confident85.7Confident47 Ų4776.8 Ų76.839%0.38844%0.438SS..Hα-helixtrans-66.8-39173.500000111.7L125 I126 E127 L132 L133L125-A129 WeakPolarHBondContact O-CB 3.41Å; L125-A129 PolarHBondContact O-N 2.78Å; I126-A129 PolarHBondContact O-N 3.49Å; E127-A129 PolarHBondContact O-N 3.43Å; A129-L132 PolarHBondContact O-N 3.49Å; A129-L133 WeakPolarHBondContact O-CB 3.35Å; A129-L133 VanDerWaalsContact O-CG 3.3Å; A129-L133 WeakPolarHBondContact O-CG 3.44Å; A129-L133 PolarHBondContact O-N 2.92Å
130G85.8Confident84.3Confident31 Ų3182.3 Ų82.332%0.3246%0.461SS..Hα-helixtrans-57.8-48.9174.300000112.1I126 E127 L132 L133 T134I126-G130 PolarHBondContact O-N 3.43Å; E127-G130 PolarHBondContact O-N 3.34Å; G130-L132 VanDerWaalsContact C-N 3.33Å; G130-L132 PolarHBondContact O-N 3.25Å; G130-L133 PolarHBondContact O-N 3.45Å; G130-T134 WeakPolarHBondContact O-CB 3.48Å; G130-T134 PolarHBondContact O-N 3.15Å; G130-T134 PolarHBondContact O-OG1 2.8Å; G130-T134 VanDerWaalsContact O-OG1 3.11Å
131I86.3Confident82.5Confident90 Ų9089.6 Ų89.646%0.46249%0.491SS..Hα-helixtrans-60.1-44.4176.2-65.5166.2000110.8P89 E127 T134 R135P89-I131 HydrophobicContact CG-CD1 4.19Å; E127-I131 WeakPolarHBondContact O-CG1 3.3Å; E127-I131 PolarHBondContact O-N 2.95Å; I131-T134 PolarHBondContact O-N 3.42Å; I131-R135 HydrophobicContact CG2-CG 4.35Å; I131-R135 WeakPolarHBondContact O-CB 3.34Å; I131-R135 WeakPolarHBondContact O-CG 3.43Å; I131-R135 PolarHBondContact O-N 2.89Å
132L84.4Confident80.6Confident123 Ų12390.2 Ų90.264%0.64450%0.502SS*.Hα-helixtrans-64.4-44.1-179.8-177.263.3000112.3G128 A129 G130 R135 F136G128-L132 PolarHBondContact O-N 2.82Å; G128-L132 VanDerWaalsContact O-N 3.08Å; A129-L132 PolarHBondContact O-N 3.49Å; G130-L132 VanDerWaalsContact C-N 3.33Å; G130-L132 PolarHBondContact O-N 3.25Å; L132-R135 PolarHBondContact O-N 2.83Å; L132-F136 WeakPolarHBondContact O-CB 3.27Å; L132-F136 PolarHBondContact O-N 3.11Å
133L85.8Confident78.7Confident122 Ų12292.2 Ų92.264%0.63952%0.518SS*.Hα-helixtrans-64.5-43.7177.8-73.1172.3000111.3A129 G130 R135 F136 A137A129-L133 WeakPolarHBondContact O-CB 3.35Å; A129-L133 VanDerWaalsContact O-CG 3.3Å; A129-L133 WeakPolarHBondContact O-CG 3.44Å; A129-L133 PolarHBondContact O-N 2.92Å; G130-L133 PolarHBondContact O-N 3.45Å; L133-R135 VanDerWaalsContact C-N 3.33Å; L133-R135 PolarHBondContact O-N 2.63Å; L133-F136 PolarHBondContact O-N 3.27Å; L133-A137 WeakPolarHBondContact O-CB 3.44Å; L133-A137 PolarHBondContact O-N 3.44Å
134T84.3Confident76.6Confident98 Ų9894.3 Ų94.360%0.60154%0.543SS*.Hα-helixtrans-62.6-41.1175.5-62.50000111.2G130 I131 A137 S138G130-T134 WeakPolarHBondContact O-CB 3.48Å; G130-T134 PolarHBondContact O-N 3.15Å; G130-T134 PolarHBondContact O-OG1 2.8Å; G130-T134 VanDerWaalsContact O-OG1 3.11Å; I131-T134 PolarHBondContact O-N 3.42Å; T134-A137 PolarHBondContact O-N 3.08Å; T134-S138 WeakPolarHBondContact O-CB 3.35Å; T134-S138 PolarHBondContact O-N 2.9Å; T134-S138 PolarHBondContact O-OG 3.29Å
135R81.6Confident74.5Confident182 Ų18297.4 Ų97.469%0.68756%0.559SS**Hα-helixtrans-62.3-45.5174.8-73.2-74.7-175.9176.30.1111.7I131 L132 L133 S138 S139I131-R135 HydrophobicContact CG2-CG 4.35Å; I131-R135 WeakPolarHBondContact O-CB 3.34Å; I131-R135 WeakPolarHBondContact O-CG 3.43Å; I131-R135 PolarHBondContact O-N 2.89Å; L132-R135 PolarHBondContact O-N 2.83Å; L133-R135 VanDerWaalsContact C-N 3.33Å; L133-R135 PolarHBondContact O-N 2.63Å; R135-S138 WeakPolarHBondContact CA-OG 3.36Å; R135-S138 PolarHBondContact O-N 3.05Å; R135-S138 PolarHBondContact O-OG 3.38Å; R135-S139 PolarHBondContact O-N 2.73Å
136F80.6Confident72.4Confident129 Ų129101.2 Ų101.257%0.56657%0.574SS**Hα-helixtrans-64.4-45.8177.4-171-99.8000111.8L132 L133 S138 S139 Q140L132-F136 WeakPolarHBondContact O-CB 3.27Å; L132-F136 PolarHBondContact O-N 3.11Å; L133-F136 PolarHBondContact O-N 3.27Å; F136-S138 VanDerWaalsContact C-N 3.33Å; F136-S138 PolarHBondContact O-N 3.08Å; F136-S139 PolarHBondContact O-N 3.41Å; F136-S139 VanDerWaalsContact O-N 3.08Å; F136-S139 PolarHBondContact O-OG 3.09Å; F136-Q140 HydrophobicContact CD1-CG 4.44Å; F136-Q140 HydrophobicContact CE1-CG 4.18Å; F136-Q140 WeakPolarHBondContact O-CG 3.46Å; F136-Q140 PolarHBondContact O-N 3.46Å
137A80.3Confident69.9Low52 Ų52104.7 Ų104.743%0.4359%0.586SS.*Hα-helixtrans-60.3-41.7175.600000112.1L133 T134 S139 Q140 F141L133-A137 WeakPolarHBondContact O-CB 3.44Å; L133-A137 PolarHBondContact O-N 3.44Å; T134-A137 PolarHBondContact O-N 3.08Å; A137-S139 VanDerWaalsContact C-N 3.26Å; A137-S139 PolarHBondContact O-N 3.38Å; A137-Q140 PolarHBondContact O-N 3.29Å; A137-Q140 VanDerWaalsContact O-N 3.11Å; A137-F141 PolarHBondContact O-N 3.34Å
138S68.4Low67.4Low67 Ų67106.4 Ų106.447%0.46961%0.61SS.*Hα-helixtrans-65.4-27175.671.80000113.3T134 R135 F136 Q140 F141T134-S138 WeakPolarHBondContact O-CB 3.35Å; T134-S138 PolarHBondContact O-N 2.9Å; T134-S138 PolarHBondContact O-OG 3.29Å; R135-S138 WeakPolarHBondContact CA-OG 3.36Å; R135-S138 PolarHBondContact O-N 3.05Å; R135-S138 PolarHBondContact O-OG 3.38Å; F136-S138 VanDerWaalsContact C-N 3.33Å; F136-S138 PolarHBondContact O-N 3.08Å; S138-Q140 VanDerWaalsContact C-N 3.32Å; S138-F141 CarbonylContact O-C 3.57Å; S138-F141 VanDerWaalsContact O-O 3.08Å
139S63.1Low65.2Low74 Ų74112.8 Ų112.852%0.51763%0.63SS.*Hα-helixtrans-77.1-18.1174.674.20000113.6R135 F136 A137R135-S139 PolarHBondContact O-N 2.73Å; F136-S139 PolarHBondContact O-N 3.41Å; F136-S139 VanDerWaalsContact O-N 3.08Å; F136-S139 PolarHBondContact O-OG 3.09Å; A137-S139 VanDerWaalsContact C-N 3.26Å; A137-S139 PolarHBondContact O-N 3.38Å
140Q61.4Low62.8Low124 Ų124118.7 Ų118.758%0.57965%0.65SS**Hα-helixtrans-87.6-20.5177.5-63.4-74.3-94.200112.4F136 A137 S138F136-Q140 HydrophobicContact CD1-CG 4.44Å; F136-Q140 HydrophobicContact CE1-CG 4.18Å; F136-Q140 WeakPolarHBondContact O-CG 3.46Å; F136-Q140 PolarHBondContact O-N 3.46Å; A137-Q140 PolarHBondContact O-N 3.29Å; A137-Q140 VanDerWaalsContact O-N 3.11Å; S138-Q140 VanDerWaalsContact C-N 3.32Å
141F56.1Low60.6Low164 Ų164123 Ų12372%0.71967%0.671SS**SBendtrans-124.493.9173.8-61.5-77.8000110.3A137 S138 T143A137-F141 PolarHBondContact O-N 3.34Å; S138-F141 CarbonylContact O-C 3.57Å; S138-F141 VanDerWaalsContact O-O 3.08Å; F141-T143 PolarHBondContact O-N 3.22Å
142P52.7Low58.2Low117 Ų117122.7 Ų122.776%0.7668%0.683SS**  trans-60.2112.5170-14.827.7000108.3G144P142-G144 PolarHBondContact O-N 3Å; P142-G144 VanDerWaalsContact O-N 3.09Å
143T54Low56.4Low138 Ų138123.1 Ų123.185%0.84769%0.693SS**PPolyproline II helixtrans-56.1116.816844.50000107.9F141F141-T143 PolarHBondContact O-N 3.22Å
144G48.1Very low54.2Low58 Ų58125.6 Ų125.660%0.59870%0.704SS**PPolyproline II helixtrans-56.1159.4171.300000111.5P142P142-G144 PolarHBondContact O-N 3Å; P142-G144 VanDerWaalsContact O-N 3.09Å
145P46.9Very low52.2Low103 Ų103127 Ų12767%0.66971%0.714SS**PPolyproline II helixtrans-63139.1-162.625-34.1000113.4F147P145-F147 HydrophobicContact CB-CD2 4.04Å; P145-F147 HydrophobicContact CB-CE2 3.6Å; P145-F147 HydrophobicContact CB-CZ 4.29Å; P145-F147 HydrophobicContact CG-CD2 4.04Å; P145-F147 HydrophobicContact CG-CE2 3.5Å; P145-F147 HydrophobicContact CG-CZ 4.45Å; P145-F147 PolarHBondContact O-N 2.92Å
146Q47.4Very low50.2Low198 Ų198122.7 Ų122.793%0.92572%0.718SS**  trans-68.9111.9167.9-59.4-167.8-65.600109.7
147F38.7Very low47.9Very low182 Ų182122.4 Ų122.480%0.79873%0.729SS**  trans-131.5131.9161.4-61.7-80.2000105.4P145P145-F147 HydrophobicContact CB-CD2 4.04Å; P145-F147 HydrophobicContact CB-CE2 3.6Å; P145-F147 HydrophobicContact CB-CZ 4.29Å; P145-F147 HydrophobicContact CG-CD2 4.04Å; P145-F147 HydrophobicContact CG-CE2 3.5Å; P145-F147 HydrophobicContact CG-CZ 4.45Å; P145-F147 PolarHBondContact O-N 2.92Å
148A34.8Very low46.2Very low98 Ų98125.6 Ų125.681%0.8175%0.748SS**  cis-160.4159.5-3.200000106.1
149E41.4Very low44.4Very low172 Ų172133.4 Ų133.480%0.80477%0.769SS**  trans-70.5145175.3-159.6118.879.500112.5
150E36.9Very low43.1Very low171 Ų171133.7 Ų133.780%0.79978%0.783SS**  trans77.2149.2150.9-122.6136.184.100120.5
151P38.9Very low41.7Very low120 Ų120131.2 Ų131.278%0.77979%0.791SS**  cis-140.2172.424.939.8-17.2000120.3
152A36.7Very low40.8Very low85 Ų85129.8 Ų129.870%0.70279%0.791SS**  trans-2.5150.1166.700000122.3
153P47.2Very low40.2Very low132 Ų132135.2 Ų135.286%0.85780%0.798SS**PPolyproline II helixtrans-79130.4-167.532.5-33.3000113.2
154M38Very low39.3Very low174 Ų174138.6 Ų138.686%0.85780%0.795SS**PPolyproline II helixtrans-100.1142.7165.9-71.3-125.3-70.600110.6A156M154-A156 PolarHBondContact O-N 3.43Å
155P44.1Very low38.7Very low126 Ų126143.7 Ų143.782%0.81880%0.803SS**PPolyproline II helixtrans-76.6123.7-168.630.9-32.3000110.7
156A38.8Very low38.1Very low93 Ų93149.3 Ų149.377%0.76981%0.813SS**PPolyproline II helixtrans-77.9143.2172.800000110.8M154M154-A156 PolarHBondContact O-N 3.43Å
157P32.8Very low37.7Very low123 Ų123152.7 Ų152.780%0.79983%0.829SS**PPolyproline II helixtrans-73.1145.3-171.50.215000112.1Y159P157-Y159 PolarHBondContact O-N 3.32Å
158S43.9Very low37.6Very low119 Ų119151.3 Ų151.383%0.83283%0.83SS**PPolyproline II helixtrans-51.9116167.9480000112.3
159Y31.1Very low37.8Very low231 Ų231154.1 Ų154.191%0.90683%0.831SS**  trans-130.1123151.6-148.3-94.4000108.9P157P157-Y159 PolarHBondContact O-N 3.32Å
160G35.7Very low37.6Very low79 Ų79153.1 Ų153.181%0.81483%0.833SS**  trans-65.1147.4-161.400000115
161G32Very low37.6Very low73 Ų73152 Ų15275%0.75384%0.835SS**  trans-168.766.7172.100000107.6Y163G161-Y163 PolarHBondContact O-N 2.98Å; G161-Y163 VanDerWaalsContact O-N 3.12Å
162D36.9Very low37.5Very low133 Ų133154 Ų15471%0.71184%0.838SS**  trans-56.5104.2178.1-136.6-31.1000110.7
163Y40.3Very low37.6Very low232 Ų232158.6 Ų158.691%0.9185%0.847SS**  trans-141.663.4147.5-69.5-70.7000108.2G161G161-Y163 PolarHBondContact O-N 2.98Å; G161-Y163 VanDerWaalsContact O-N 3.12Å
164R34.5Very low36.9Very low209 Ų209160.5 Ų160.579%0.78985%0.847SS**  trans-54.4147.7154.7-146.4-177.7-178165.80.5108.4
165Q34.9Very low36.8Very low164 Ų164159.5 Ų159.577%0.76685%0.846SS**  trans11290.1138.3-148.9174.4-12.300117.2
166Y33.9Very low36.2Very low221 Ų221162.3 Ų162.387%0.86785%0.848SS**  trans35112.7131.2-68.3-86.1000119.4
167Q39.7Very low36Very low270 Ų270168.5 Ų168.5100%1.26286%0.855SS**  -161.70114.3-114.8173.7-400111.2

Retrieved 167 of 167 residues in 454 ms (Link to these results)