G4LWW9_SCHMA Loading...

Robl_LC7 domain-containing protein

AlphaFold DB , UniProt , Accession G4LWW9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 147 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
1M46.3Very low89.4Confident244 Ų24483.7 Ų83.7100%1.20244%0.435SS*.  0119.90-75.6179.2-117.700107.1
2S78.7Confident90Very high120 Ų12077.8 Ų77.884%0.83940%0.403SS*.PPolyproline II helixtrans-74.9129173.449.40000109.1
3E89.5Confident90.4Very high63 Ų6373.4 Ų73.429%0.29438%0.38SS..PPolyproline II helixtrans-62.9136.4173.7176.8169.5-133.400110.8D7 Y8 R11E3-D7 HydrophobicContact CG-CB 3.97Å; E3-Y8 WeakPolarHBondContact OE2-CD2 3.39Å; E3-R11 IonicContact OE1-CZ 3.02Å; E3-R11 IonicContact OE1-NE 2.9Å; E3-R11 PolarHBondContact OE1-NE 3.32Å; E3-R11 IonicContact OE1-NH2 2.64Å; E3-R11 PolarHBondContact OE1-NH2 3.08Å; E3-R11 IonicContact OE2-CZ 3.26Å; E3-R11 VanDerWaalsContact OE2-CZ 3.26Å; E3-R11 IonicContact OE2-NE 3.77Å; E3-R11 IonicContact OE2-NH1 3.75Å; E3-R11 IonicContact OE2-NH2 2.9Å; E3-R11 PolarHBondContact OE2-NH2 3.17Å
4S94.6Very high90.7Very high51 Ų5175.7 Ų75.736%0.35741%0.406SS..PPolyproline II helixtrans-70.4154.7176.381.60000110.9C6 D7 Y8S4-C6 VanDerWaalsContact C-N 3.26Å; S4-C6 PolarHBondContact O-N 3.3Å; S4-D7 PolarHBondContact O-N 3.44Å; S4-D7 WeakPolarHBondContact OG-CB 3.31Å; S4-D7 PolarHBondContact OG-N 2.91Å; S4-D7 VanDerWaalsContact OG-N 3.07Å; S4-D7 PolarHBondContact OG-OD2 3.05Å; S4-Y8 PolarHBondContact O-N 3.4Å
5A96.5Very high90.9Very high21 Ų2178.3 Ų78.317%0.17442%0.415CS..Hα-helixtrans-57.9-40.6176.900000112.2Y8 L9 A33 L118 L122A5-Y8 PolarHBondContact O-N 3.09Å; A5-L9 WeakPolarHBondContact O-CG 3.42Å; A5-L9 PolarHBondContact O-N 3.25Å; A5-A33 HydrophobicContact CB-CB 3.69Å; A5-L118 HydrophobicContact CB-CD1 3.78Å; A5-L118 HydrophobicContact CB-CD2 4.49Å; A5-L122 HydrophobicContact CB-CD1 4.31Å; A5-L122 HydrophobicContact CB-CD2 4.08Å
6C97Very high91.1Very high48 Ų4874.4 Ų74.432%0.32440%0.395SS..Hα-helixtrans-66.6-40.4178.3-56.40000111.9S4 L9 K10 S34S4-C6 VanDerWaalsContact C-N 3.26Å; S4-C6 PolarHBondContact O-N 3.3Å; C6-L9 PolarHBondContact O-N 2.91Å; C6-K10 WeakPolarHBondContact O-CG 3.27Å; C6-K10 PolarHBondContact O-N 2.78Å; C6-S34 WeakPolarHBondContact CB-O 3.42Å; C6-S34 PolarHBondContact SG-O 2.91Å
7D95.7Very high91.3Very high68 Ų6879.1 Ų79.136%0.36442%0.42SS..Hα-helixtrans-68.8-36177.9-62.6-38.4000112.1E3 S4 L9 K10E3-D7 HydrophobicContact CG-CB 3.97Å; S4-D7 PolarHBondContact O-N 3.44Å; S4-D7 WeakPolarHBondContact OG-CB 3.31Å; S4-D7 PolarHBondContact OG-N 2.91Å; S4-D7 VanDerWaalsContact OG-N 3.07Å; S4-D7 PolarHBondContact OG-OD2 3.05Å; D7-L9 VanDerWaalsContact C-N 3.34Å; D7-K10 PolarHBondContact O-N 3Å; D7-K10 IonicContact OD1-NZ 2.85Å; D7-K10 PolarHBondContact OD1-NZ 3.32Å
8Y96.4Very high91.6Very high45 Ų4575.8 Ų75.818%0.17641%0.408CS..Hα-helixtrans-60.4-44.6171-171.5-85.4000111E3 S4 A5 F12 S114 L118E3-Y8 WeakPolarHBondContact OE2-CD2 3.39Å; S4-Y8 PolarHBondContact O-N 3.4Å; A5-Y8 PolarHBondContact O-N 3.09Å; Y8-F12 AromaticContact CD1-CE2 3.63Å; Y8-F12 HydrophobicContact CD1-CE2 3.63Å; Y8-F12 HydrophobicContact CD1-CZ 4.33Å; Y8-F12 AromaticContact CE1-CE2 3.4Å; Y8-F12 HydrophobicContact CE1-CE2 3.4Å; Y8-F12 AromaticContact CE1-CZ 3.65Å; Y8-F12 HydrophobicContact CE1-CZ 3.65Å; Y8-F12 WeakPolarHBondContact O-CD2 3.4Å; Y8-F12 WeakPolarHBondContact O-CE2 3.48Å; Y8-S114 PolarHBondContact OH-O 2.83Å; Y8-L118 HydrophobicContact CD1-CB 3.78Å; Y8-L118 HydrophobicContact CD1-CD2 3.85Å; Y8-L118 HydrophobicContact CD1-CG 4.28Å; Y8-L118 HydrophobicContact CE1-CB 3.8Å
9L97.5Very high91.9Very high0 Ų072.1 Ų72.10%039%0.388CS..Hα-helixtrans-65.5-36.2178.3-73179.1000113.4A5 C6 D7 R11 F12 I22 V24 A33 A35 I115 L118A5-L9 WeakPolarHBondContact O-CG 3.42Å; A5-L9 PolarHBondContact O-N 3.25Å; C6-L9 PolarHBondContact O-N 2.91Å; D7-L9 VanDerWaalsContact C-N 3.34Å; L9-R11 PolarHBondContact O-N 3.39Å; L9-R11 VanDerWaalsContact O-N 3.16Å; L9-F12 PolarHBondContact O-N 3.37Å; L9-F12 VanDerWaalsContact O-N 3.11Å; L9-I22 HydrophobicContact CD1-CG2 4.47Å; L9-I22 HydrophobicContact CD2-CG2 3.89Å; L9-V24 HydrophobicContact CD1-CG2 4.18Å; L9-A33 HydrophobicContact CD1-CB 3.82Å; L9-A35 HydrophobicContact CB-CB 3.69Å; L9-I115 HydrophobicContact CD2-CG2 4.08Å; L9-L118 HydrophobicContact CD1-CD2 4.21Å; L9-L118 HydrophobicContact CD2-CD2 3.55Å; L9-L118 HydrophobicContact CG-CD2 3.56Å
10K96.4Very high92.1Very high114 Ų11469.9 Ų69.950%0.49638%0.376SS..Hα-helixtrans-56.6-31.6-179.5-78.2173.7-169.7160.40113.4C6 D7 F12 L13 A35C6-K10 WeakPolarHBondContact O-CG 3.27Å; C6-K10 PolarHBondContact O-N 2.78Å; D7-K10 PolarHBondContact O-N 3Å; D7-K10 IonicContact OD1-NZ 2.85Å; D7-K10 PolarHBondContact OD1-NZ 3.32Å; K10-F12 PolarHBondContact O-N 3.19Å; K10-L13 WeakPolarHBondContact O-CB 3.47Å; K10-L13 PolarHBondContact O-N 3.28Å; K10-A35 HydrophobicContact CB-CB 4.4Å; K10-A35 HydrophobicContact CG-CB 3.78Å
11R94.7Very high92.3Very high147 Ų14766.6 Ų66.656%0.55536%0.358SS*.G310 helixtrans-59.9-32.4-179.8-60.3177.7-177-167.6-1.6112.5E3 L9 S14E3-R11 IonicContact OE1-CZ 3.02Å; E3-R11 IonicContact OE1-NE 2.9Å; E3-R11 PolarHBondContact OE1-NE 3.32Å; E3-R11 IonicContact OE1-NH2 2.64Å; E3-R11 PolarHBondContact OE1-NH2 3.08Å; E3-R11 IonicContact OE2-CZ 3.26Å; E3-R11 VanDerWaalsContact OE2-CZ 3.26Å; E3-R11 IonicContact OE2-NE 3.77Å; E3-R11 IonicContact OE2-NH1 3.75Å; E3-R11 IonicContact OE2-NH2 2.9Å; E3-R11 PolarHBondContact OE2-NH2 3.17Å; L9-R11 PolarHBondContact O-N 3.39Å; L9-R11 VanDerWaalsContact O-N 3.16Å; R11-S14 PolarHBondContact O-OG 2.83Å
12F96.2Very high94.8Very high12 Ų1255 Ų555%0.05330%0.301CS..G310 helixtrans-81.3-16.5-177.6-59-72.6000113.5Y8 L9 K10 S14 E15 I22 L111 I115Y8-F12 AromaticContact CD1-CE2 3.63Å; Y8-F12 HydrophobicContact CD1-CE2 3.63Å; Y8-F12 HydrophobicContact CD1-CZ 4.33Å; Y8-F12 AromaticContact CE1-CE2 3.4Å; Y8-F12 HydrophobicContact CE1-CE2 3.4Å; Y8-F12 AromaticContact CE1-CZ 3.65Å; Y8-F12 HydrophobicContact CE1-CZ 3.65Å; Y8-F12 WeakPolarHBondContact O-CD2 3.4Å; Y8-F12 WeakPolarHBondContact O-CE2 3.48Å; L9-F12 PolarHBondContact O-N 3.37Å; L9-F12 VanDerWaalsContact O-N 3.11Å; K10-F12 PolarHBondContact O-N 3.19Å; F12-S14 PolarHBondContact O-N 3.03Å; F12-E15 WeakPolarHBondContact CD1-OE2 3.43Å; F12-E15 PolarHBondContact O-N 3.03Å; F12-I22 HydrophobicContact CB-CD1 3.55Å; F12-L111 HydrophobicContact CB-CD1 4.23Å; F12-L111 HydrophobicContact CB-CD2 4.11Å; F12-L111 HydrophobicContact CB-CG 4.46Å; F12-L111 HydrophobicContact CD1-CD1 3.47Å; F12-L111 VanDerWaalsContact CD1-CD1 3.47Å; F12-L111 HydrophobicContact CD1-CG 4.04Å; F12-L111 HydrophobicContact CE1-CD1 4.26Å; F12-L111 HydrophobicContact CG-CD1 4.23Å; F12-I115 HydrophobicContact CD1-CG1 4.24Å; F12-I115 HydrophobicContact CD2-CD1 4.38Å; F12-I115 HydrophobicContact CD2-CG1 3.94Å; F12-I115 HydrophobicContact CE1-CG1 4.09Å; F12-I115 HydrophobicContact CE2-CG1 3.8Å; F12-I115 HydrophobicContact CG-CD1 4.37Å; F12-I115 HydrophobicContact CG-CG1 4.16Å; F12-I115 HydrophobicContact CZ-CG1 3.87Å
13L96.4Very high95.6Very high21 Ų2149.9 Ų49.911%0.1126%0.264CS..G310 helixtrans-60.9-30.3177.3-65.6179.9000112.3K10 I19 I22 A35 M37K10-L13 WeakPolarHBondContact O-CB 3.47Å; K10-L13 PolarHBondContact O-N 3.28Å; L13-I19 HydrophobicContact CD2-CG2 3.76Å; L13-I22 HydrophobicContact CD2-CD1 4.23Å; L13-I22 HydrophobicContact CD2-CG1 4.11Å; L13-A35 HydrophobicContact CD1-CB 3.95Å; L13-A35 HydrophobicContact CD2-CB 4.41Å; L13-A35 HydrophobicContact CG-CB 4.2Å; L13-M37 HydrophobicContact CB-SD 4.34Å; L13-M37 HydrophobicContact CD1-CG 4.43Å; L13-M37 HydrophobicContact CD1-SD 4.09Å
14S93.7Very high95.9Very high106 Ų10646.9 Ų46.974%0.74125%0.25SC*.G310 helixtrans-100.5-3.2178.953.60000114.3R11 F12R11-S14 PolarHBondContact O-OG 2.83Å; F12-S14 PolarHBondContact O-N 3.03Å
15E93.7Very high95.9Very high115 Ų11544.5 Ų44.554%0.53723%0.233SC..THydrogen-bonded Turntrans-78.1-30.4-175.9-170.8167.8161.800112F12 L111F12-E15 WeakPolarHBondContact CD1-OE2 3.43Å; F12-E15 PolarHBondContact O-N 3.03Å; E15-L111 HydrophobicContact CB-CD1 4.21Å; E15-L111 HydrophobicContact CG-CD1 4.08Å
16V94.2Very high95.7Very high15 Ų1544.2 Ų44.29%0.09123%0.228CC..SBendtrans-124.2124.9174-177.80000108.6G18 I19 A107 L111V16-G18 PolarHBondContact O-N 2.72Å; V16-I19 HydrophobicContact CB-CD1 3.65Å; V16-I19 HydrophobicContact CB-CG1 3.97Å; V16-I19 HydrophobicContact CG1-CD1 4.46Å; V16-I19 HydrophobicContact CG1-CG1 4.4Å; V16-I19 HydrophobicContact CG2-CD1 4.12Å; V16-I19 PolarHBondContact O-N 3.38Å; V16-A107 HydrophobicContact CB-CB 4.39Å; V16-A107 HydrophobicContact CG1-CB 3.63Å; V16-A107 HydrophobicContact CG2-CB 3.82Å; V16-L111 HydrophobicContact CG2-CD1 4.45Å
17D95Very high95.3Very high155 Ų15546 Ų4683%0.82923%0.231SC*.THydrogen-bonded Turntrans-60.8133.6177.7-172.335.8000111.2C103D17-C103 PolarHBondContact O-SG 3.04Å
18G96Very high94.8Very high19 Ų1947.6 Ų47.620%0.19624%0.239CC..THydrogen-bonded Turntrans882.3-178.900000116.5V16 L20 G99 S100 C103V16-G18 PolarHBondContact O-N 2.72Å; G18-L20 PolarHBondContact O-N 3.41Å; G18-G99 CarbonylContact O-C 3.54Å; G18-G99 WeakPolarHBondContact O-CA 3.33Å; G18-S100 PolarHBondContact O-N 2.91Å; G18-C103 VanDerWaalsContact C-SG 3.59Å
19I97.3Very high94.3Very high6 Ų645.7 Ų45.73%0.03123%0.233CC..EExtended strand (participates in β ladder)trans-68.2125.8170.3-68.7-177.7000110.1L13 V16 I22 V97 I108 L111L13-I19 HydrophobicContact CD2-CG2 3.76Å; V16-I19 HydrophobicContact CB-CD1 3.65Å; V16-I19 HydrophobicContact CB-CG1 3.97Å; V16-I19 HydrophobicContact CG1-CD1 4.46Å; V16-I19 HydrophobicContact CG1-CG1 4.4Å; V16-I19 HydrophobicContact CG2-CD1 4.12Å; V16-I19 PolarHBondContact O-N 3.38Å; I19-I22 HydrophobicContact CG2-CD1 4.35Å; I19-I22 HydrophobicContact CG2-CG1 4.07Å; I19-V97 HydrophobicContact CD1-CG1 4.05Å; I19-V97 HydrophobicContact CG1-CG1 4.23Å; I19-V97 HydrophobicContact CG2-CG1 4.26Å; I19-I108 HydrophobicContact CD1-CG1 4.34Å; I19-I108 HydrophobicContact CG1-CG1 4.3Å; I19-L111 HydrophobicContact CD1-CD2 3.71Å
20L96.6Very high93.9Very high28 Ų2849.8 Ų49.815%0.14726%0.258CS..EExtended strand (participates in β ladder)trans-99.9-29.6178.9-56.6178.2000112.3G18 M37 M40 V98G18-L20 PolarHBondContact O-N 3.41Å; L20-M37 WeakPolarHBondContact O-CB 3.49Å; L20-M37 PolarHBondContact O-N 3.43Å; L20-M40 HydrophobicContact CB-CB 4.21Å; L20-M40 HydrophobicContact CB-CG 4.16Å; L20-V98 HydrophobicContact CB-CG1 4.47Å; L20-V98 PolarHBondContact N-O 2.89Å
21G96.9Very high93.8Very high0 Ų047.6 Ų47.60%025%0.254CS..EExtended strand (participates in β ladder)trans-173.3157.8178.500000114.7A35 V98G21-A35 CarbonylContact C-O 3.59Å; G21-A35 VanDerWaalsContact CA-O 3.29Å; G21-A35 WeakPolarHBondContact CA-O 3.14Å; G21-V98 PolarHBondContact N-O 2.82Å; G21-V98 VanDerWaalsContact N-O 3.13Å; G21-V98 PolarHBondContact O-N 2.8Å
22I97.4Very high93.8Very high0 Ų042.5 Ų42.50%024%0.239CC..EExtended strand (participates in β ladder)trans-134.8131.7179.9-55.7172.7000108.5L9 F12 L13 I19 S34 A35 L95 T96 V97 L111L9-I22 HydrophobicContact CD1-CG2 4.47Å; L9-I22 HydrophobicContact CD2-CG2 3.89Å; F12-I22 HydrophobicContact CB-CD1 3.55Å; L13-I22 HydrophobicContact CD2-CD1 4.23Å; L13-I22 HydrophobicContact CD2-CG1 4.11Å; I19-I22 HydrophobicContact CG2-CD1 4.35Å; I19-I22 HydrophobicContact CG2-CG1 4.07Å; I22-S34 CarbonylContact O-C 3.55Å; I22-S34 VanDerWaalsContact O-CA 3.22Å; I22-S34 WeakPolarHBondContact O-CA 3.49Å; I22-A35 PolarHBondContact N-O 2.97Å; I22-A35 PolarHBondContact O-N 2.7Å; I22-L95 HydrophobicContact CG2-CD1 3.55Å; I22-T96 CarbonylContact C-O 3.46Å; I22-T96 WeakPolarHBondContact CA-O 3.5Å; I22-V97 HydrophobicContact CG1-CG1 4.25Å; I22-V97 HydrophobicContact CG1-CG2 4.34Å; I22-V97 HydrophobicContact CG2-CG2 4.34Å; I22-L111 HydrophobicContact CD1-CD2 4.47Å
23F95.5Very high93.8Very high14 Ų1442 Ų426%0.06124%0.238CC..EExtended strand (participates in β ladder)trans-131.5139.9-178.8-55-92.8000110.3V31 T36 M40 R45 L95 T96 V98F23-V31 HydrophobicContact CD1-CG1 4.37Å; F23-V31 HydrophobicContact CD1-CG2 4.43Å; F23-T36 HydrophobicContact CE1-CG2 3.78Å; F23-T36 HydrophobicContact CE2-CG2 4.18Å; F23-T36 HydrophobicContact CZ-CG2 3.32Å; F23-M40 HydrophobicContact CD2-CE 4.44Å; F23-M40 HydrophobicContact CE2-CE 3.25Å; F23-M40 HydrophobicContact CE2-SD 3.53Å; F23-M40 VanDerWaalsContact CE2-SD 3.53Å; F23-M40 HydrophobicContact CZ-CE 3.36Å; F23-M40 HydrophobicContact CZ-SD 3.34Å; F23-M40 WeakPolarHBondContact CZ-SD 3.37Å; F23-R45 HydrophobicContact CE1-CG 4.13Å; F23-R45 HydrophobicContact CZ-CG 3.79Å; F23-L95 CarbonylContact O-C 3.53Å; F23-L95 WeakPolarHBondContact O-CA 3.41Å; F23-T96 PolarHBondContact N-O 2.83Å; F23-T96 PolarHBondContact O-N 2.71Å; F23-V98 HydrophobicContact CE2-CG2 4.37Å
24V96.7Very high93.8Very high0 Ų043 Ų430%025%0.246CC..EExtended strand (participates in β ladder)trans-115119.6166.3-1780000106.9L9 V31 V32 A33 L93 F94 L95 L119 L122L9-V24 HydrophobicContact CD1-CG2 4.18Å; V24-V31 CarbonylContact O-C 3.56Å; V24-V32 PolarHBondContact O-N 3.36Å; V24-A33 HydrophobicContact CB-CB 4.44Å; V24-A33 PolarHBondContact N-O 2.9Å; V24-A33 PolarHBondContact O-N 3.32Å; V24-L93 HydrophobicContact CG1-CB 4.2Å; V24-L93 HydrophobicContact CG1-CD1 3.84Å; V24-L93 HydrophobicContact CG1-CD2 4.41Å; V24-L93 HydrophobicContact CG1-CG 4.39Å; V24-F94 WeakPolarHBondContact CA-O 3.47Å; V24-L95 HydrophobicContact CG2-CD1 4.09Å; V24-L119 HydrophobicContact CB-CD2 4.39Å; V24-L119 HydrophobicContact CG1-CD2 3.77Å; V24-L119 HydrophobicContact CG2-CD2 3.66Å; V24-L122 HydrophobicContact CB-CD1 4.39Å; V24-L122 HydrophobicContact CG1-CD1 4.1Å
25A95Very high93.9Very high1 Ų138.2 Ų38.21%0.00821%0.213CC..EExtended strand (participates in β ladder)trans-122.4157.3178.300000111.4V30 T50 L93 F94A25-V30 WeakPolarHBondContact CA-O 3.43Å; A25-T50 HydrophobicContact CB-CG2 3.97Å; A25-L93 WeakPolarHBondContact O-CA 3.34Å; A25-F94 PolarHBondContact N-O 3.48Å; A25-F94 PolarHBondContact O-N 3.06Å
26D92.3Very high94Very high14 Ų1435 Ų358%0.07520%0.201CC..  trans-85.3-175168.468.719.9000112.1D28 G29 V30 L93 F94 I130D26-D28 PolarHBondContact O-N 2.88Å; D26-D28 WeakPolarHBondContact OD1-CA 3.4Å; D26-D28 PolarHBondContact OD1-N 2.94Å; D26-G29 PolarHBondContact O-N 3.15Å; D26-G29 VanDerWaalsContact O-N 3.07Å; D26-G29 PolarHBondContact OD1-N 3.3Å; D26-V30 PolarHBondContact N-O 2.79Å; D26-V30 PolarHBondContact OD1-N 2.87Å; D26-L93 HydrophobicContact CB-CD2 4.48Å; D26-F94 WeakPolarHBondContact O-CD2 3.2Å; D26-I130 HydrophobicContact CB-CD1 4.08Å
27K87.4Confident94Very high86 Ų8638.5 Ų38.537%0.37422%0.218SC..THydrogen-bonded Turntrans-63.7-16.7-179.966165.6-170.760.50115.2I54 F94K27-I54 WeakPolarHBondContact O-CD1 3.36Å; K27-F94 VanDerWaalsContact CA-CE2 3.47Å; K27-F94 HydrophobicContact CB-CE2 3.97Å
28D84.9Confident93.8Very high101 Ų10138.8 Ų38.854%0.5422%0.219SC..THydrogen-bonded Turntrans-98.94.3179-59.3-41.6000110.7D26 V30D26-D28 PolarHBondContact O-N 2.88Å; D26-D28 WeakPolarHBondContact OD1-CA 3.4Å; D26-D28 PolarHBondContact OD1-N 2.94Å; D28-V30 VanDerWaalsContact C-N 3.28Å; D28-V30 HydrophobicContact CB-CG2 4.37Å
29G86.8Confident93.4Very high5 Ų544.5 Ų44.55%0.05225%0.245CC..  trans79.69-179.100000113.6D26 V31D26-G29 PolarHBondContact O-N 3.15Å; D26-G29 VanDerWaalsContact O-N 3.07Å; D26-G29 PolarHBondContact OD1-N 3.3Å; G29-V31 PolarHBondContact O-N 2.89Å
30V89.7Confident93.1Very high86 Ų8644.6 Ų44.652%0.52125%0.246SC..  trans-75.1122.9178.8-178.10000108.9A25 D26 D28 V32A25-V30 WeakPolarHBondContact CA-O 3.43Å; D26-V30 PolarHBondContact N-O 2.79Å; D26-V30 PolarHBondContact OD1-N 2.87Å; D28-V30 VanDerWaalsContact C-N 3.28Å; D28-V30 HydrophobicContact CB-CG2 4.37Å; V30-V32 PolarHBondContact O-N 3.25Å
31V93.3Very high92.8Very high69 Ų6945 Ų4542%0.41825%0.25SC..EExtended strand (participates in β ladder)trans-71.7119.2-180179.40000110F23 V24 G29 A33F23-V31 HydrophobicContact CD1-CG1 4.37Å; F23-V31 HydrophobicContact CD1-CG2 4.43Å; V24-V31 CarbonylContact O-C 3.56Å; G29-V31 PolarHBondContact O-N 2.89Å; V31-A33 WeakPolarHBondContact CG1-O 3.49Å
32V94.3Very high92.4Very high40 Ų4050.5 Ų50.524%0.24228%0.279CS..EExtended strand (participates in β ladder)trans-89.2-36.6177.4-175.50000111.1V24 V30 L93 L122 A126V24-V32 PolarHBondContact O-N 3.36Å; V30-V32 PolarHBondContact O-N 3.25Å; V32-L93 HydrophobicContact CG2-CD2 4.46Å; V32-L122 HydrophobicContact CG1-CB 4.45Å; V32-L122 HydrophobicContact CG1-CD1 4.3Å; V32-L122 HydrophobicContact CG1-CD2 4.12Å; V32-A126 HydrophobicContact CG2-CB 4.23Å
33A96.4Very high92Very high2 Ų257.2 Ų57.22%0.01731%0.311CS..EExtended strand (participates in β ladder)trans-153.5148.3175.900000110.2A5 L9 V24 V31 L122A5-A33 HydrophobicContact CB-CB 3.69Å; L9-A33 HydrophobicContact CD1-CB 3.82Å; V24-A33 HydrophobicContact CB-CB 4.44Å; V24-A33 PolarHBondContact N-O 2.9Å; V24-A33 PolarHBondContact O-N 3.32Å; V31-A33 WeakPolarHBondContact CG1-O 3.49Å; A33-L122 HydrophobicContact CB-CD1 3.98Å
34S96.4Very high91.7Very high42 Ų4256.7 Ų56.729%0.29431%0.309SS..EExtended strand (participates in β ladder)trans-151.4157.2175.361.20000112.5C6 I22C6-S34 WeakPolarHBondContact CB-O 3.42Å; C6-S34 PolarHBondContact SG-O 2.91Å; I22-S34 CarbonylContact O-C 3.55Å; I22-S34 VanDerWaalsContact O-CA 3.22Å; I22-S34 WeakPolarHBondContact O-CA 3.49Å
35A96.8Very high91.2Very high5 Ų561.1 Ų61.14%0.04133%0.326CS..EExtended strand (participates in β ladder)trans-142.4132.8166.600000108L9 K10 L13 G21 I22L9-A35 HydrophobicContact CB-CB 3.69Å; K10-A35 HydrophobicContact CB-CB 4.4Å; K10-A35 HydrophobicContact CG-CB 3.78Å; L13-A35 HydrophobicContact CD1-CB 3.95Å; L13-A35 HydrophobicContact CD2-CB 4.41Å; L13-A35 HydrophobicContact CG-CB 4.2Å; G21-A35 CarbonylContact C-O 3.59Å; G21-A35 VanDerWaalsContact CA-O 3.29Å; G21-A35 WeakPolarHBondContact CA-O 3.14Å; I22-A35 PolarHBondContact N-O 2.97Å; I22-A35 PolarHBondContact O-N 2.7Å
36T96.1Very high90.9Very high48 Ų4862.8 Ų62.829%0.29434%0.337SS..EExtended strand (participates in β ladder)trans-141.5147.8-175.561.70000111F23 M40 R45F23-T36 HydrophobicContact CE1-CG2 3.78Å; F23-T36 HydrophobicContact CE2-CG2 4.18Å; F23-T36 HydrophobicContact CZ-CG2 3.32Å; T36-M40 HydrophobicContact CG2-SD 3.59Å; T36-M40 VanDerWaalsContact CG2-SD 3.59Å; T36-R45 PolarHBondContact OG1-NH2 3.37Å; T36-R45 VanDerWaalsContact OG1-NH2 3.13Å
37M93.8Very high90.7Very high88 Ų8865.8 Ų65.843%0.43336%0.358SS..  trans-79.2160.8163.4-59.8-64.2-77.800109.8L13 L20 D39 M40L13-M37 HydrophobicContact CB-SD 4.34Å; L13-M37 HydrophobicContact CD1-CG 4.43Å; L13-M37 HydrophobicContact CD1-SD 4.09Å; L20-M37 WeakPolarHBondContact O-CB 3.49Å; L20-M37 PolarHBondContact O-N 3.43Å; M37-D39 VanDerWaalsContact C-N 3.25Å; M37-D39 PolarHBondContact O-N 3.42Å; M37-M40 WeakPolarHBondContact O-CB 3.17Å; M37-M40 PolarHBondContact O-N 3.44Å
38D90.1Very high90.9Very high161 Ų16170.7 Ų70.786%0.86138%0.375SS*.THydrogen-bonded Turntrans-65.6-30.8179.3-67.6-28000112.1M40D38-M40 PolarHBondContact O-N 3.14Å
39D87.9Confident91.2Very high138 Ų13867.2 Ų67.274%0.73836%0.358SS*.THydrogen-bonded Turntrans-79.25.4-177.4-60.4-34.2000114.3M37 P41M37-D39 VanDerWaalsContact C-N 3.25Å; M37-D39 PolarHBondContact O-N 3.42Å; D39-P41 WeakPolarHBondContact O-CD 3.46Å
40M90.8Very high91.4Very high9 Ų967.5 Ų67.54%0.04436%0.358CS..  trans-72.6128.1-175.5-172.5-175.3161.400112L20 F23 T36 M37 D38 D42 A44 R45 V98L20-M40 HydrophobicContact CB-CB 4.21Å; L20-M40 HydrophobicContact CB-CG 4.16Å; F23-M40 HydrophobicContact CD2-CE 4.44Å; F23-M40 HydrophobicContact CE2-CE 3.25Å; F23-M40 HydrophobicContact CE2-SD 3.53Å; F23-M40 VanDerWaalsContact CE2-SD 3.53Å; F23-M40 HydrophobicContact CZ-CE 3.36Å; F23-M40 HydrophobicContact CZ-SD 3.34Å; F23-M40 WeakPolarHBondContact CZ-SD 3.37Å; T36-M40 HydrophobicContact CG2-SD 3.59Å; T36-M40 VanDerWaalsContact CG2-SD 3.59Å; M37-M40 WeakPolarHBondContact O-CB 3.17Å; M37-M40 PolarHBondContact O-N 3.44Å; D38-M40 PolarHBondContact O-N 3.14Å; M40-D42 PolarHBondContact O-N 3.26Å; M40-A44 HydrophobicContact CE-CB 3.51Å; M40-R45 HydrophobicContact CE-CG 3.48Å; M40-R45 VanDerWaalsContact CE-CG 3.48Å; M40-R45 HydrophobicContact SD-CG 3.98Å; M40-V98 HydrophobicContact CE-CB 4.16Å; M40-V98 HydrophobicContact CE-CG1 4.36Å; M40-V98 HydrophobicContact CE-CG2 3.84Å
41P89.8Confident91.5Very high35 Ų3565.4 Ų65.423%0.22735%0.35CS..  trans-59.9130.5175.5-23.633.2000112.8D39 Q43 A44 M78D39-P41 WeakPolarHBondContact O-CD 3.46Å; P41-Q43 PolarHBondContact O-N 2.9Å; P41-A44 WeakPolarHBondContact O-CB 3.5Å; P41-A44 PolarHBondContact O-N 2.94Å; P41-A44 VanDerWaalsContact O-N 3.09Å; P41-M78 HydrophobicContact CB-SD 4.37Å; P41-M78 HydrophobicContact CG-SD 4.18Å
42D89Confident91.5Very high117 Ų11764.8 Ų64.863%0.62635%0.352SS*.G310 helixtrans-60.8-32.6-179.2-78.2-30.6000112.8M40 A44 R45M40-D42 PolarHBondContact O-N 3.26Å; D42-A44 PolarHBondContact O-N 2.95Å; D42-R45 WeakPolarHBondContact O-CB 3.48Å; D42-R45 PolarHBondContact O-N 3.03Å; D42-R45 VanDerWaalsContact O-N 3.08Å; D42-R45 IonicContact OD1-NH1 3.45Å; D42-R45 PolarHBondContact OD1-NH1 2.96Å
43Q89.4Confident91.5Very high140 Ų14062.9 Ų62.965%0.65434%0.34SS*.G310 helixtrans-61.5-33.6178.7-58.785.3-6.800111.7P41 R45 S46 V49P41-Q43 PolarHBondContact O-N 2.9Å; Q43-R45 PolarHBondContact O-N 2.87Å; Q43-S46 WeakPolarHBondContact O-CB 3.23Å; Q43-S46 PolarHBondContact O-N 3.44Å; Q43-S46 VanDerWaalsContact O-N 3.17Å; Q43-V49 WeakPolarHBondContact O-CG2 3.44Å
44A89.8Confident91.3Very high4 Ų464.1 Ų64.13%0.03335%0.347CS..G310 helixtrans-72.2-16.6-18000000112.9M40 P41 D42 S46 M78 V98M40-A44 HydrophobicContact CE-CB 3.51Å; P41-A44 WeakPolarHBondContact O-CB 3.5Å; P41-A44 PolarHBondContact O-N 2.94Å; P41-A44 VanDerWaalsContact O-N 3.09Å; D42-A44 PolarHBondContact O-N 2.95Å; A44-S46 VanDerWaalsContact C-N 3.34Å; A44-M78 HydrophobicContact CB-CE 4.3Å; A44-M78 HydrophobicContact CB-SD 3.84Å; A44-V98 HydrophobicContact CB-CG1 4Å; A44-V98 HydrophobicContact CB-CG2 4.06Å
45R86Confident91.2Very high92 Ų9266 Ų6635%0.34736%0.356SS..G310 helixtrans-85-8.7173.5-58.4-175.9174156.1-6.1113.2F23 T36 M40 D42 Q43F23-R45 HydrophobicContact CE1-CG 4.13Å; F23-R45 HydrophobicContact CZ-CG 3.79Å; T36-R45 PolarHBondContact OG1-NH2 3.37Å; T36-R45 VanDerWaalsContact OG1-NH2 3.13Å; M40-R45 HydrophobicContact CE-CG 3.48Å; M40-R45 VanDerWaalsContact CE-CG 3.48Å; M40-R45 HydrophobicContact SD-CG 3.98Å; D42-R45 WeakPolarHBondContact O-CB 3.48Å; D42-R45 PolarHBondContact O-N 3.03Å; D42-R45 VanDerWaalsContact O-N 3.08Å; D42-R45 IonicContact OD1-NH1 3.45Å; D42-R45 PolarHBondContact OD1-NH1 2.96Å; Q43-R45 PolarHBondContact O-N 2.87Å
46S88.8Confident91Very high36 Ų3667.8 Ų67.825%0.25237%0.368SS..  trans-64.4133.7-173-171.40000111.2Q43 A44 Y48 V49Q43-S46 WeakPolarHBondContact O-CB 3.23Å; Q43-S46 PolarHBondContact O-N 3.44Å; Q43-S46 VanDerWaalsContact O-N 3.17Å; A44-S46 VanDerWaalsContact C-N 3.34Å; S46-Y48 PolarHBondContact O-N 3.5Å; S46-Y48 VanDerWaalsContact OG-CD2 3.23Å; S46-Y48 WeakPolarHBondContact OG-CD2 3.32Å; S46-V49 WeakPolarHBondContact O-CB 3.34Å; S46-V49 PolarHBondContact O-N 2.94Å
47P88Confident90.8Very high77 Ų7766 Ų6650%0.536%0.356SS..Hα-helixtrans-54.8-25.1173.8-26.334.6000113.4V49 T50 A51P47-V49 PolarHBondContact O-N 3.43Å; P47-T50 PolarHBondContact O-N 3.18Å; P47-A51 PolarHBondContact O-N 3.28Å
48Y90Very high90.7Very high190 Ų19067.2 Ų67.275%0.74536%0.361SS*.Hα-helixtrans-61.6-28174.9-63.6-60.9000113.3S46 A51 A52S46-Y48 PolarHBondContact O-N 3.5Å; S46-Y48 VanDerWaalsContact OG-CD2 3.23Å; S46-Y48 WeakPolarHBondContact OG-CD2 3.32Å; Y48-A51 PolarHBondContact O-N 3.47Å; Y48-A52 VanDerWaalsContact O-CB 3.25Å; Y48-A52 WeakPolarHBondContact O-CB 3.37Å; Y48-A52 PolarHBondContact O-N 3.33Å
49V91.3Very high90.8Very high28 Ų2864.1 Ų64.117%0.1734%0.342CS..Hα-helixtrans-66-45.4176.1178.40000110.4Q43 S46 P47 F53 V80 Q82Q43-V49 WeakPolarHBondContact O-CG2 3.44Å; S46-V49 WeakPolarHBondContact O-CB 3.34Å; S46-V49 PolarHBondContact O-N 2.94Å; P47-V49 PolarHBondContact O-N 3.43Å; V49-F53 PolarHBondContact O-N 3.28Å; V49-V80 HydrophobicContact CG1-CG1 4.06Å; V49-Q82 PolarHBondContact O-NE2 2.93Å
50T91.3Very high91Very high11 Ų1159.4 Ų59.47%0.06732%0.318CS..Hα-helixtrans-67-43174.5-52.80000111.1A25 P47 A52 F53 I54 F94A25-T50 HydrophobicContact CB-CG2 3.97Å; P47-T50 PolarHBondContact O-N 3.18Å; T50-A52 VanDerWaalsContact C-N 3.35Å; T50-A52 PolarHBondContact O-N 2.91Å; T50-F53 WeakPolarHBondContact O-CB 3.14Å; T50-F53 PolarHBondContact O-N 3.35Å; T50-I54 HydrophobicContact CG2-CD1 4.1Å; T50-I54 WeakPolarHBondContact O-CG1 3.5Å; T50-I54 PolarHBondContact O-N 3.39Å; T50-F94 HydrophobicContact CG2-CB 3.92Å; T50-F94 HydrophobicContact CG2-CD2 4.5Å; T50-F94 HydrophobicContact CG2-CG 4.22Å
51A92.5Very high90.9Very high42 Ų4262.6 Ų62.635%0.34734%0.335SS..Hα-helixtrans-61.3-41.8178.600000112.4P47 Y48 F53 I54 V55P47-A51 PolarHBondContact O-N 3.28Å; Y48-A51 PolarHBondContact O-N 3.47Å; A51-F53 VanDerWaalsContact C-N 3.31Å; A51-F53 PolarHBondContact O-N 2.82Å; A51-I54 PolarHBondContact O-N 2.73Å; A51-V55 WeakPolarHBondContact O-CG2 3.2Å; A51-V55 PolarHBondContact O-N 3.1Å
52A92.8Very high91Very high55 Ų5567.8 Ų67.846%0.45535%0.354SS..Hα-helixtrans-61.4-39.5176.400000112Y48 T50 V55 S56Y48-A52 VanDerWaalsContact O-CB 3.25Å; Y48-A52 WeakPolarHBondContact O-CB 3.37Å; Y48-A52 PolarHBondContact O-N 3.33Å; T50-A52 VanDerWaalsContact C-N 3.35Å; T50-A52 PolarHBondContact O-N 2.91Å; A52-V55 PolarHBondContact O-N 3.48Å; A52-S56 WeakPolarHBondContact O-CB 3.26Å; A52-S56 PolarHBondContact O-N 2.96Å; A52-S56 PolarHBondContact O-OG 3Å
53F93.9Very high91.3Very high1 Ų167.5 Ų67.50%0.00435%0.352CS..Hα-helixtrans-63-45.4173.9179.5-131.5000112.4V49 T50 A51 V55 S56 L57 L68 M71 Q82 H84 F94V49-F53 PolarHBondContact O-N 3.28Å; T50-F53 WeakPolarHBondContact O-CB 3.14Å; T50-F53 PolarHBondContact O-N 3.35Å; A51-F53 VanDerWaalsContact C-N 3.31Å; A51-F53 PolarHBondContact O-N 2.82Å; F53-V55 PolarHBondContact O-N 3.43Å; F53-S56 CarbonylContact O-C 3.59Å; F53-S56 WeakPolarHBondContact O-CB 3.44Å; F53-S56 PolarHBondContact O-N 3.47Å; F53-S56 VanDerWaalsContact O-N 3.1Å; F53-L57 HydrophobicContact CD1-CD1 3.95Å; F53-L57 HydrophobicContact CD2-CD1 4.32Å; F53-L57 HydrophobicContact CD2-CG 4.21Å; F53-L57 HydrophobicContact CE1-CD1 3.67Å; F53-L57 HydrophobicContact CE1-CG 4.41Å; F53-L57 HydrophobicContact CE2-CD1 4.02Å; F53-L57 HydrophobicContact CE2-CD2 4.12Å; F53-L57 HydrophobicContact CE2-CG 3.84Å; F53-L57 HydrophobicContact CG-CD1 4.28Å; F53-L57 HydrophobicContact CZ-CD1 3.7Å; F53-L57 HydrophobicContact CZ-CD2 4.08Å; F53-L57 HydrophobicContact CZ-CG 3.97Å; F53-L57 WeakPolarHBondContact O-CG 3.37Å; F53-L57 PolarHBondContact O-N 3.25Å; F53-L68 HydrophobicContact CE2-CD2 4.41Å; F53-M71 HydrophobicContact CD2-CB 3.87Å; F53-M71 HydrophobicContact CD2-CE 4.49Å; F53-M71 HydrophobicContact CD2-SD 4.08Å; F53-M71 HydrophobicContact CE2-CB 3.48Å; F53-M71 VanDerWaalsContact CE2-CB 3.48Å; F53-Q82 HydrophobicContact CB-CB 4.47Å; F53-Q82 HydrophobicContact CD1-CB 3.62Å; F53-Q82 HydrophobicContact CD1-CG 4.47Å; F53-Q82 HydrophobicContact CD2-CB 3.84Å; F53-Q82 HydrophobicContact CE1-CB 3.64Å; F53-Q82 HydrophobicContact CE2-CB 3.91Å; F53-Q82 HydrophobicContact CG-CB 3.72Å; F53-Q82 HydrophobicContact CG-CG 4.34Å; F53-Q82 HydrophobicContact CZ-CB 3.8Å; F53-Q82 WeakPolarHBondContact CZ-O 3.45Å; F53-H84 HydrophobicContact CE1-CB 4.39Å; F53-H84 HydrophobicContact CZ-CB 4.25Å; F53-F94 AromaticContact CD1-CD1 3.78Å; F53-F94 HydrophobicContact CD1-CD1 3.78Å; F53-F94 AromaticContact CE1-CD1 3.75Å; F53-F94 HydrophobicContact CE1-CD1 3.75Å
54I93Very high91.4Very high28 Ų2868.2 Ų68.214%0.14436%0.36CS..Hα-helixtrans-60.9-44.1178.2-66.5170.3000111.4K27 T50 A51 S56 L57 Q58 F94K27-I54 WeakPolarHBondContact O-CD1 3.36Å; T50-I54 HydrophobicContact CG2-CD1 4.1Å; T50-I54 WeakPolarHBondContact O-CG1 3.5Å; T50-I54 PolarHBondContact O-N 3.39Å; A51-I54 PolarHBondContact O-N 2.73Å; I54-S56 VanDerWaalsContact C-N 3.3Å; I54-S56 PolarHBondContact O-N 3.44Å; I54-L57 WeakPolarHBondContact O-CB 3.34Å; I54-L57 PolarHBondContact O-N 2.82Å; I54-Q58 WeakPolarHBondContact O-CG 3.38Å; I54-Q58 PolarHBondContact O-N 3.19Å; I54-F94 HydrophobicContact CD1-CD1 4.48Å; I54-F94 HydrophobicContact CD1-CD2 4.03Å; I54-F94 HydrophobicContact CD1-CE1 4.24Å; I54-F94 HydrophobicContact CD1-CE2 3.79Å; I54-F94 HydrophobicContact CD1-CG 4.38Å; I54-F94 HydrophobicContact CD1-CZ 3.88Å; I54-F94 HydrophobicContact CG1-CD1 3.94Å; I54-F94 HydrophobicContact CG1-CD2 4.36Å; I54-F94 HydrophobicContact CG1-CE1 3.6Å; I54-F94 HydrophobicContact CG1-CE2 4.08Å; I54-F94 HydrophobicContact CG1-CG 4.31Å; I54-F94 HydrophobicContact CG1-CZ 3.67Å
55V93.3Very high91.5Very high80 Ų8075 Ų7549%0.48540%0.395SS..Hα-helixtrans-62.2-41.9174.7173.30000110.5A51 A52 F53 Q58 Q59A51-V55 WeakPolarHBondContact O-CG2 3.2Å; A51-V55 PolarHBondContact O-N 3.1Å; A52-V55 PolarHBondContact O-N 3.48Å; F53-V55 PolarHBondContact O-N 3.43Å; V55-Q58 WeakPolarHBondContact O-CB 3.49Å; V55-Q58 PolarHBondContact O-N 3.42Å; V55-Q59 WeakPolarHBondContact O-CG 3.49Å; V55-Q59 PolarHBondContact O-N 3.45Å; V55-Q59 VanDerWaalsContact O-N 3.17Å
56S93.5Very high91.7Very high43 Ų4373 Ų7330%0.30140%0.403SS..Hα-helixtrans-64.9-42.3179.6-56.80000112A52 F53 I54 Q58 Q59 V60A52-S56 WeakPolarHBondContact O-CB 3.26Å; A52-S56 PolarHBondContact O-N 2.96Å; A52-S56 PolarHBondContact O-OG 3Å; F53-S56 CarbonylContact O-C 3.59Å; F53-S56 WeakPolarHBondContact O-CB 3.44Å; F53-S56 PolarHBondContact O-N 3.47Å; F53-S56 VanDerWaalsContact O-N 3.1Å; I54-S56 VanDerWaalsContact C-N 3.3Å; I54-S56 PolarHBondContact O-N 3.44Å; S56-Q58 VanDerWaalsContact C-N 3.31Å; S56-Q58 PolarHBondContact O-N 3.49Å; S56-Q59 PolarHBondContact O-N 3.31Å; S56-Q59 VanDerWaalsContact O-N 3.08Å; S56-V60 WeakPolarHBondContact O-CB 3.18Å; S56-V60 WeakPolarHBondContact O-CG2 3.46Å; S56-V60 PolarHBondContact O-N 3.49Å
57L92.1Very high91.6Very high10 Ų1078.3 Ų78.35%0.05243%0.429CS..Hα-helixtrans-53-47.8172.2-78.6164.5000111.5F53 I54 Q59 V60 N61 L68 H84 F94F53-L57 HydrophobicContact CD1-CD1 3.95Å; F53-L57 HydrophobicContact CD2-CD1 4.32Å; F53-L57 HydrophobicContact CD2-CG 4.21Å; F53-L57 HydrophobicContact CE1-CD1 3.67Å; F53-L57 HydrophobicContact CE1-CG 4.41Å; F53-L57 HydrophobicContact CE2-CD1 4.02Å; F53-L57 HydrophobicContact CE2-CD2 4.12Å; F53-L57 HydrophobicContact CE2-CG 3.84Å; F53-L57 HydrophobicContact CG-CD1 4.28Å; F53-L57 HydrophobicContact CZ-CD1 3.7Å; F53-L57 HydrophobicContact CZ-CD2 4.08Å; F53-L57 HydrophobicContact CZ-CG 3.97Å; F53-L57 WeakPolarHBondContact O-CG 3.37Å; F53-L57 PolarHBondContact O-N 3.25Å; I54-L57 WeakPolarHBondContact O-CB 3.34Å; I54-L57 PolarHBondContact O-N 2.82Å; L57-Q59 VanDerWaalsContact C-N 3.27Å; L57-Q59 PolarHBondContact O-N 2.99Å; L57-V60 PolarHBondContact O-N 3.27Å; L57-N61 VanDerWaalsContact O-CG 3.25Å; L57-N61 PolarHBondContact O-N 3Å; L57-N61 VanDerWaalsContact O-N 3.09Å; L57-N61 PolarHBondContact O-OD1 3.21Å; L57-L68 HydrophobicContact CD2-CB 3.77Å; L57-L68 HydrophobicContact CD2-CD2 3.59Å; L57-L68 HydrophobicContact CD2-CG 3.9Å; L57-L68 HydrophobicContact CG-CD2 4.29Å; L57-H84 HydrophobicContact CD1-CB 4.07Å; L57-H84 HydrophobicContact CD2-CB 4.08Å; L57-F94 HydrophobicContact CD1-CD1 4.13Å; L57-F94 HydrophobicContact CD1-CE1 3.61Å
58Q90.6Very high91.7Very high115 Ų11576.4 Ų76.454%0.53741%0.414SS..Hα-helixtrans-63.9-30178.9-68.1174.1-7.200113.4I54 V55 S56 K62I54-Q58 WeakPolarHBondContact O-CG 3.38Å; I54-Q58 PolarHBondContact O-N 3.19Å; V55-Q58 WeakPolarHBondContact O-CB 3.49Å; V55-Q58 PolarHBondContact O-N 3.42Å; S56-Q58 VanDerWaalsContact C-N 3.31Å; S56-Q58 PolarHBondContact O-N 3.49Å; Q58-K62 WeakPolarHBondContact O-CE 3.44Å
59Q93.6Very high91.6Very high96 Ų9673.7 Ų73.745%0.44941%0.408SS..Hα-helixtrans-82.4-41.7176.2-58.8-49.8-39.200112V55 S56 L57 N61 K62V55-Q59 WeakPolarHBondContact O-CG 3.49Å; V55-Q59 PolarHBondContact O-N 3.45Å; V55-Q59 VanDerWaalsContact O-N 3.17Å; S56-Q59 PolarHBondContact O-N 3.31Å; S56-Q59 VanDerWaalsContact O-N 3.08Å; L57-Q59 VanDerWaalsContact C-N 3.27Å; L57-Q59 PolarHBondContact O-N 2.99Å; Q59-N61 VanDerWaalsContact C-N 3.3Å; Q59-N61 PolarHBondContact O-N 3.22Å; Q59-K62 VanDerWaalsContact O-CB 3.31Å; Q59-K62 WeakPolarHBondContact O-CB 3.45Å; Q59-K62 PolarHBondContact O-N 3.06Å
60V92.3Very high91.8Very high39 Ų3977.1 Ų77.124%0.23642%0.418CS..Hα-helixtrans-63-37.9-179.1170.20000111.2S56 L57 K62 L63 L68 M71S56-V60 WeakPolarHBondContact O-CB 3.18Å; S56-V60 WeakPolarHBondContact O-CG2 3.46Å; S56-V60 PolarHBondContact O-N 3.49Å; L57-V60 PolarHBondContact O-N 3.27Å; V60-K62 PolarHBondContact O-N 3.4Å; V60-L63 VanDerWaalsContact O-CB 3.27Å; V60-L63 WeakPolarHBondContact O-CB 3.38Å; V60-L63 WeakPolarHBondContact O-CG 3.45Å; V60-L63 PolarHBondContact O-N 3.19Å; V60-L68 HydrophobicContact CB-CD2 4.25Å; V60-L68 HydrophobicContact CG1-CB 4.12Å; V60-L68 HydrophobicContact CG1-CD1 4.36Å; V60-L68 HydrophobicContact CG1-CD2 4.14Å; V60-L68 HydrophobicContact CG1-CG 4.45Å; V60-L68 HydrophobicContact CG2-CD2 4.31Å; V60-M71 HydrophobicContact CG2-CE 4.25Å
61N87.5Confident92Very high75 Ų7578.5 Ų78.540%0.40142%0.424SS..G310 helixtrans-62.2-13176.6-70.7-2.2000113.5L57 Q59 L63L57-N61 VanDerWaalsContact O-CG 3.25Å; L57-N61 PolarHBondContact O-N 3Å; L57-N61 VanDerWaalsContact O-N 3.09Å; L57-N61 PolarHBondContact O-OD1 3.21Å; Q59-N61 VanDerWaalsContact C-N 3.3Å; Q59-N61 PolarHBondContact O-N 3.22Å; N61-L63 VanDerWaalsContact C-N 3.33Å
62K93.3Very high92.2Very high144 Ų14479 Ų7963%0.62642%0.421SS*.G310 helixtrans-84.6-6.4174-56.9174.7-175.5170.20113.5Q58 Q59 V60 D64Q58-K62 WeakPolarHBondContact O-CE 3.44Å; Q59-K62 VanDerWaalsContact O-CB 3.31Å; Q59-K62 WeakPolarHBondContact O-CB 3.45Å; Q59-K62 PolarHBondContact O-N 3.06Å; V60-K62 PolarHBondContact O-N 3.4Å; K62-D64 VanDerWaalsContact C-N 3.29Å
63L93.5Very high92.3Very high111 Ų11178.4 Ų78.458%0.58141%0.411SS*.G310 helixtrans-84-3-179.3-59.4178.2000113.3V60 N61 L65V60-L63 VanDerWaalsContact O-CB 3.27Å; V60-L63 WeakPolarHBondContact O-CB 3.38Å; V60-L63 WeakPolarHBondContact O-CG 3.45Å; V60-L63 PolarHBondContact O-N 3.19Å; N61-L63 VanDerWaalsContact C-N 3.33Å; L63-L65 HydrophobicContact CB-CD1 4.09Å; L63-L65 HydrophobicContact CB-CG 4.01Å; L63-L65 HydrophobicContact CD1-CD1 4.41Å; L63-L65 PolarHBondContact O-N 2.95Å
64D92Very high92.3Very high156 Ų15682.2 Ų82.283%0.83444%0.438SS*.SBendtrans57.134.6-179.1-157.433.6000113.4K62K62-D64 VanDerWaalsContact C-N 3.29Å
65L92.6Very high92.4Very high147 Ų14786.9 Ų86.977%0.7746%0.455SS*.SBendtrans-100.39.4178.6-61.7179.5000113.3L63L63-L65 HydrophobicContact CB-CD1 4.09Å; L63-L65 HydrophobicContact CB-CG 4.01Å; L63-L65 HydrophobicContact CD1-CD1 4.41Å; L63-L65 PolarHBondContact O-N 2.95Å
66G89.5Confident92.4Very high50 Ų5091.4 Ų91.452%0.51547%0.471SS..  trans87-170.6-170.400000113.2
67D86.8Confident92.3Very high147 Ų14796.4 Ų96.479%0.78649%0.489SS*.  trans-79130.8-178.2-66.7-46.9000111.3E69D67-E69 PolarHBondContact O-N 3.18Å
68L89.6Confident92.5Very high37 Ų3797.2 Ų97.219%0.19449%0.493CS..  trans-74.9114.2174.5-17767.5000110.6F53 L57 V60 W70 M71F53-L68 HydrophobicContact CE2-CD2 4.41Å; L57-L68 HydrophobicContact CD2-CB 3.77Å; L57-L68 HydrophobicContact CD2-CD2 3.59Å; L57-L68 HydrophobicContact CD2-CG 3.9Å; L57-L68 HydrophobicContact CG-CD2 4.29Å; V60-L68 HydrophobicContact CB-CD2 4.25Å; V60-L68 HydrophobicContact CG1-CB 4.12Å; V60-L68 HydrophobicContact CG1-CD1 4.36Å; V60-L68 HydrophobicContact CG1-CD2 4.14Å; V60-L68 HydrophobicContact CG1-CG 4.45Å; V60-L68 HydrophobicContact CG2-CD2 4.31Å; L68-W70 WeakPolarHBondContact CD1-O 3.46Å; L68-M71 HydrophobicContact CD2-CB 4.36Å; L68-M71 HydrophobicContact CD2-CE 3.59Å
69E88.5Confident92.8Very high133 Ų13391.9 Ų91.962%0.62147%0.469SS*.  trans-78.9-42.8176.5-62.7-171.2166.600112.2D67 H84D67-E69 PolarHBondContact O-N 3.18Å; E69-H84 PolarHBondContact O-N 3.08Å
70W94.9Very high92.9Very high99 Ų9987.4 Ų87.438%0.37545%0.448SS..EExtended strand (participates in β ladder)trans-153.7156.6-176.752.8-96.1000112.7L68 I72 Q82 F83 I109L68-W70 WeakPolarHBondContact CD1-O 3.46Å; W70-I72 HydrophobicContact CE3-CD1 3.95Å; W70-I72 HydrophobicContact CE3-CG1 3.88Å; W70-I72 HydrophobicContact CH2-CD1 4.21Å; W70-I72 HydrophobicContact CZ3-CD1 3.39Å; W70-I72 HydrophobicContact CZ3-CG1 3.81Å; W70-Q82 CarbonylContact C-O 3.55Å; W70-Q82 WeakPolarHBondContact CA-O 3.4Å; W70-Q82 WeakPolarHBondContact CB-O 3.36Å; W70-F83 HydrophobicContact CB-CD1 3.45Å; W70-F83 VanDerWaalsContact CB-CD1 3.45Å; W70-F83 HydrophobicContact CB-CE1 3.8Å; W70-F83 HydrophobicContact CB-CG 4.09Å; W70-F83 HydrophobicContact CG-CD1 4.1Å; W70-F83 HydrophobicContact CG-CE1 4.09Å; W70-I109 HydrophobicContact CD2-CD1 4.47Å; W70-I109 HydrophobicContact CE3-CD1 4.43Å; W70-I109 HydrophobicContact CH2-CD1 3.92Å; W70-I109 HydrophobicContact CZ2-CD1 3.95Å; W70-I109 HydrophobicContact CZ3-CD1 4.19Å
71M95.4Very high93.1Very high40 Ų4085.6 Ų85.620%0.19744%0.437CS..EExtended strand (participates in β ladder)trans-132.4140.1177.1-178.8175.1-66.600109.6F53 V60 L68 Q82F53-M71 HydrophobicContact CD2-CB 3.87Å; F53-M71 HydrophobicContact CD2-CE 4.49Å; F53-M71 HydrophobicContact CD2-SD 4.08Å; F53-M71 HydrophobicContact CE2-CB 3.48Å; F53-M71 VanDerWaalsContact CE2-CB 3.48Å; V60-M71 HydrophobicContact CG2-CE 4.25Å; L68-M71 HydrophobicContact CD2-CB 4.36Å; L68-M71 HydrophobicContact CD2-CE 3.59Å; M71-Q82 PolarHBondContact N-O 3.41Å; M71-Q82 PolarHBondContact O-N 3.48Å
72I96.6Very high93.6Very high53 Ų5382.4 Ų82.427%0.27242%0.42SS..EExtended strand (participates in β ladder)trans-114.8132.7173.8-56.8157.6000108.5W70 V80 I105 I109W70-I72 HydrophobicContact CE3-CD1 3.95Å; W70-I72 HydrophobicContact CE3-CG1 3.88Å; W70-I72 HydrophobicContact CH2-CD1 4.21Å; W70-I72 HydrophobicContact CZ3-CD1 3.39Å; W70-I72 HydrophobicContact CZ3-CG1 3.81Å; I72-V80 WeakPolarHBondContact CA-O 3.36Å; I72-I105 HydrophobicContact CD1-CG2 3.35Å; I72-I105 HydrophobicContact CG1-CG2 4.15Å; I72-I105 HydrophobicContact CG2-CD1 4.28Å; I72-I109 HydrophobicContact CD1-CD1 4.24Å
73T95.3Very high93.8Very high42 Ų4275.9 Ų75.926%0.25839%0.391SS..EExtended strand (participates in β ladder)trans-119.5114.5168.1-51.20000109.2Y75 V80T73-Y75 HydrophobicContact CG2-CD2 4.17Å; T73-Y75 HydrophobicContact CG2-CE1 4.25Å; T73-Y75 HydrophobicContact CG2-CE2 3.46Å; T73-Y75 VanDerWaalsContact CG2-CE2 3.46Å; T73-V80 PolarHBondContact N-O 3.01Å; T73-V80 PolarHBondContact O-N 2.95Å
74S94.9Very high93.9Very high82 Ų8273.5 Ų73.557%0.57338%0.377SS*.EExtended strand (participates in β ladder)trans-93.7124.7175.5-600000110.1
75Y94Very high94.1Very high125 Ų12566.8 Ų66.849%0.4934%0.34SS..  trans-107.5-179.8170.4-61.4-87.8000109.6T73 E77 M78 V80T73-Y75 HydrophobicContact CG2-CD2 4.17Å; T73-Y75 HydrophobicContact CG2-CE1 4.25Å; T73-Y75 HydrophobicContact CG2-CE2 3.46Å; T73-Y75 VanDerWaalsContact CG2-CE2 3.46Å; Y75-E77 PolarHBondContact O-N 3.3Å; Y75-M78 WeakPolarHBondContact CA-O 3.49Å; Y75-M78 WeakPolarHBondContact CB-O 3.43Å; Y75-M78 HydrophobicContact CD2-CE 3.61Å; Y75-M78 HydrophobicContact CD2-CG 3.94Å; Y75-M78 HydrophobicContact CE2-CE 3.86Å; Y75-M78 HydrophobicContact CG-CE 4.01Å; Y75-M78 HydrophobicContact CG-CG 4.3Å; Y75-M78 PolarHBondContact N-O 2.89Å; Y75-V80 HydrophobicContact CD2-CG2 4.21Å; Y75-V80 HydrophobicContact CE2-CG2 3.92Å
76Q93.5Very high94.1Very high176 Ų17664.3 Ų64.382%0.82233%0.332SS*.SBendtrans-62.9-39.8179.8-176.1173.7-8.600113S101Q76-S101 WeakPolarHBondContact O-CB 3.45Å
77E92.9Very high94Very high147 Ų14764 Ų6469%0.68732%0.321SS*.SBendtrans-115.1-7.2-172-63-179.7173.700113.5Y75 S101Y75-E77 PolarHBondContact O-N 3.3Å; E77-S101 PolarHBondContact O-N 3.19Å; E77-S101 VanDerWaalsContact O-N 3.17Å
78M94.8Very high93.8Very high27 Ų2766.5 Ų66.513%0.13333%0.328CS..EExtended strand (participates in β ladder)trans-150.3156.7-175.868.1-177.1-175.700112.1P41 A44 Y75 V80 V98 G99P41-M78 HydrophobicContact CB-SD 4.37Å; P41-M78 HydrophobicContact CG-SD 4.18Å; A44-M78 HydrophobicContact CB-CE 4.3Å; A44-M78 HydrophobicContact CB-SD 3.84Å; Y75-M78 WeakPolarHBondContact CA-O 3.49Å; Y75-M78 WeakPolarHBondContact CB-O 3.43Å; Y75-M78 HydrophobicContact CD2-CE 3.61Å; Y75-M78 HydrophobicContact CD2-CG 3.94Å; Y75-M78 HydrophobicContact CE2-CE 3.86Å; Y75-M78 HydrophobicContact CG-CE 4.01Å; Y75-M78 HydrophobicContact CG-CG 4.3Å; Y75-M78 PolarHBondContact N-O 2.89Å; M78-V80 HydrophobicContact CE-CG2 4.24Å; M78-V80 HydrophobicContact SD-CG2 4.42Å; M78-V98 HydrophobicContact CB-CG1 4.44Å; M78-V98 HydrophobicContact SD-CG1 4.4Å; M78-G99 CarbonylContact C-O 3.5Å; M78-G99 VanDerWaalsContact CA-O 3.23Å; M78-G99 WeakPolarHBondContact CA-O 3.43Å; M78-G99 WeakPolarHBondContact CB-O 3.42Å
79V96.5Very high93.6Very high4 Ų470.3 Ų70.32%0.02436%0.358CS..EExtended strand (participates in β ladder)trans-116.6137.1166.8-60.40000109V98 G99 C103 I105 I108V79-V98 WeakPolarHBondContact O-CA 3.32Å; V79-G99 PolarHBondContact N-O 3.05Å; V79-G99 PolarHBondContact O-N 3.04Å; V79-C103 HydrophobicContact CG2-CB 4.35Å; V79-I105 HydrophobicContact CG1-CD1 4.31Å; V79-I105 HydrophobicContact CG1-CG1 4.5Å; V79-I105 HydrophobicContact CG2-CG1 4.35Å; V79-I108 HydrophobicContact CG2-CD1 4.24Å
80V96.6Very high93.7Very high2 Ų265 Ų651%0.01234%0.337CS..EExtended strand (participates in β ladder)trans-116.5111.5177.3-174.70000107.7V49 I72 T73 Y75 M78 Q82 T96 V98V49-V80 HydrophobicContact CG1-CG1 4.06Å; I72-V80 WeakPolarHBondContact CA-O 3.36Å; T73-V80 PolarHBondContact N-O 3.01Å; T73-V80 PolarHBondContact O-N 2.95Å; Y75-V80 HydrophobicContact CD2-CG2 4.21Å; Y75-V80 HydrophobicContact CE2-CG2 3.92Å; M78-V80 HydrophobicContact CE-CG2 4.24Å; M78-V80 HydrophobicContact SD-CG2 4.42Å; V80-Q82 HydrophobicContact CG1-CG 3.8Å; V80-T96 HydrophobicContact CG1-CG2 3.68Å; V80-V98 HydrophobicContact CG2-CG2 4.48Å
81C97.3Very high93.6Very high1 Ų163 Ų631%0.00733%0.333CS..EExtended strand (participates in β ladder)trans-103.9117.6176.7-59.10000108.8F83 T96 V97 I108C81-F83 HydrophobicContact CB-CE2 3.84Å; C81-F83 HydrophobicContact CB-CZ 4.16Å; C81-T96 WeakPolarHBondContact O-CA 3.48Å; C81-V97 HydrophobicContact CB-CB 4.46Å; C81-V97 PolarHBondContact N-O 2.83Å; C81-V97 PolarHBondContact O-N 3.2Å; C81-I108 HydrophobicContact CB-CG2 3.66Å
82Q97.2Very high93.5Very high8 Ų862.8 Ų62.84%0.03733%0.334CS..EExtended strand (participates in β ladder)trans-118132.5-176-56.5-178.2-86.600109.8V49 F53 W70 M71 V80 L95 T96V49-Q82 PolarHBondContact O-NE2 2.93Å; F53-Q82 HydrophobicContact CB-CB 4.47Å; F53-Q82 HydrophobicContact CD1-CB 3.62Å; F53-Q82 HydrophobicContact CD1-CG 4.47Å; F53-Q82 HydrophobicContact CD2-CB 3.84Å; F53-Q82 HydrophobicContact CE1-CB 3.64Å; F53-Q82 HydrophobicContact CE2-CB 3.91Å; F53-Q82 HydrophobicContact CG-CB 3.72Å; F53-Q82 HydrophobicContact CG-CG 4.34Å; F53-Q82 HydrophobicContact CZ-CB 3.8Å; F53-Q82 WeakPolarHBondContact CZ-O 3.45Å; W70-Q82 CarbonylContact C-O 3.55Å; W70-Q82 WeakPolarHBondContact CA-O 3.4Å; W70-Q82 WeakPolarHBondContact CB-O 3.36Å; M71-Q82 PolarHBondContact N-O 3.41Å; M71-Q82 PolarHBondContact O-N 3.48Å; V80-Q82 HydrophobicContact CG1-CG 3.8Å; Q82-L95 CarbonylContact C-O 3.46Å; Q82-L95 VanDerWaalsContact CA-O 3.27Å; Q82-L95 WeakPolarHBondContact CA-O 3.38Å; Q82-T96 HydrophobicContact CG-CG2 4.06Å; Q82-T96 PolarHBondContact NE2-OG1 2.8Å
83F97.2Very high93.5Very high7 Ų760.3 Ų60.33%0.03132%0.322CS..EExtended strand (participates in β ladder)trans-120.8135.8-176.2-53.4-100.9000109.2W70 C81 F94 L95 V97 I108 I109 E112W70-F83 HydrophobicContact CB-CD1 3.45Å; W70-F83 VanDerWaalsContact CB-CD1 3.45Å; W70-F83 HydrophobicContact CB-CE1 3.8Å; W70-F83 HydrophobicContact CB-CG 4.09Å; W70-F83 HydrophobicContact CG-CD1 4.1Å; W70-F83 HydrophobicContact CG-CE1 4.09Å; C81-F83 HydrophobicContact CB-CE2 3.84Å; C81-F83 HydrophobicContact CB-CZ 4.16Å; F83-F94 WeakPolarHBondContact O-CA 3.43Å; F83-L95 HydrophobicContact CB-CB 4.21Å; F83-L95 HydrophobicContact CD2-CB 4.41Å; F83-L95 HydrophobicContact CD2-CD2 3.93Å; F83-L95 HydrophobicContact CD2-CG 4.09Å; F83-L95 HydrophobicContact CG-CD2 4.37Å; F83-L95 PolarHBondContact N-O 3.25Å; F83-L95 PolarHBondContact O-N 3.4Å; F83-V97 HydrophobicContact CE2-CG2 4.19Å; F83-I108 HydrophobicContact CE2-CG2 4.25Å; F83-I108 HydrophobicContact CZ-CG2 4.18Å; F83-I109 HydrophobicContact CE1-CG1 4.36Å; F83-I109 HydrophobicContact CZ-CG1 4.33Å; F83-E112 HydrophobicContact CB-CG 4.13Å; F83-E112 HydrophobicContact CD1-CB 3.84Å; F83-E112 HydrophobicContact CD1-CG 3.61Å; F83-E112 HydrophobicContact CD2-CG 4.43Å; F83-E112 HydrophobicContact CE1-CB 3.78Å; F83-E112 HydrophobicContact CE1-CG 4.1Å; F83-E112 HydrophobicContact CG-CB 4.3Å; F83-E112 HydrophobicContact CG-CG 3.81Å; F83-E112 HydrophobicContact CZ-CB 4.17Å
84H95.3Very high93.5Very high60 Ų6058.6 Ų58.628%0.27831%0.311SS..EExtended strand (participates in β ladder)trans-95.2110.2175.5178.5-146.2000109.2F53 L57 E69 T86 P92 F94F53-H84 HydrophobicContact CE1-CB 4.39Å; F53-H84 HydrophobicContact CZ-CB 4.25Å; L57-H84 HydrophobicContact CD1-CB 4.07Å; L57-H84 HydrophobicContact CD2-CB 4.08Å; E69-H84 PolarHBondContact O-N 3.08Å; H84-T86 WeakPolarHBondContact NE2-CG2 3.27Å; H84-P92 WeakPolarHBondContact NE2-CB 3.47Å; H84-F94 AromaticContact CD2-CE1 3.63Å
85F95.7Very high93.6Very high15 Ų1554.8 Ų54.87%0.06628%0.284CS..EExtended strand (participates in β ladder)trans-103.9119.2-179.2-179.4-95000111.2C87 P92 L93 R116 L119 A123F85-C87 HydrophobicContact CE1-CB 4.11Å; F85-P92 CarbonylContact O-C 3.58Å; F85-P92 VanDerWaalsContact O-CA 3.23Å; F85-P92 WeakPolarHBondContact O-CA 3.43Å; F85-P92 WeakPolarHBondContact O-CB 3.42Å; F85-L93 WeakPolarHBondContact CB-O 3.46Å; F85-L93 HydrophobicContact CD1-CB 4.45Å; F85-L93 PolarHBondContact N-O 2.87Å; F85-L93 PolarHBondContact O-N 3Å; F85-R116 HydrophobicContact CD2-CG 4.41Å; F85-R116 HydrophobicContact CE2-CB 4.35Å; F85-R116 HydrophobicContact CE2-CG 4.07Å; F85-L119 HydrophobicContact CB-CD1 3.86Å; F85-L119 HydrophobicContact CD1-CB 3.65Å; F85-L119 HydrophobicContact CD1-CD1 4.29Å; F85-L119 HydrophobicContact CD2-CB 4.08Å; F85-L119 HydrophobicContact CD2-CD1 3.69Å; F85-L119 HydrophobicContact CE1-CB 3.62Å; F85-L119 HydrophobicContact CE2-CB 4.07Å; F85-L119 HydrophobicContact CE2-CD1 4.34Å; F85-L119 HydrophobicContact CG-CB 3.88Å; F85-L119 HydrophobicContact CG-CD1 3.67Å; F85-L119 HydrophobicContact CG-CG 4.39Å; F85-L119 HydrophobicContact CZ-CB 3.84Å; F85-A123 HydrophobicContact CE1-CB 4.39Å
86T92.7Very high93.8Very high96 Ų9648.9 Ų48.959%0.58926%0.261SS*.EExtended strand (participates in β ladder)trans-113.4141.4176.359.60000111.3H84 P92H84-T86 WeakPolarHBondContact NE2-CG2 3.27Å; T86-P92 HydrophobicContact CG2-CB 4.31Å
87C87.9Confident93.9Very high42 Ų4240.6 Ų40.628%0.28422%0.222SC..EExtended strand (participates in β ladder)trans-129.9143.4170.9177.40000109.4F85 S89 A90F85-C87 HydrophobicContact CE1-CB 4.11Å; C87-S89 PolarHBondContact O-N 3.3Å; C87-A90 HydrophobicContact CB-CB 4.45Å; C87-A90 PolarHBondContact O-N 3.01Å
88Q82.6Confident94.1Very high201 Ų20133.6 Ų33.694%0.93919%0.189SC*.THydrogen-bonded Turntrans-56.1-19.7-167.9-71.2-178.1-7.900115.6
89S85Confident94.2Very high117 Ų11732.3 Ų32.382%0.81818%0.183SC*.THydrogen-bonded Turntrans-132.120.2-173.9-53.70000113.7C87C87-S89 PolarHBondContact O-N 3.3Å
90A91.8Very high94.2Very high22 Ų2233.7 Ų33.718%0.18219%0.193CC..EExtended strand (participates in β ladder)trans-140.7154.2-178.800000111.1C87 A123 S127C87-A90 HydrophobicContact CB-CB 4.45Å; C87-A90 PolarHBondContact O-N 3.01Å; A90-A123 HydrophobicContact CB-CB 3.75Å; A90-S127 WeakPolarHBondContact CA-OG 3.47Å; A90-S127 WeakPolarHBondContact CB-OG 3.49Å
91L92.6Very high94.2Very high57 Ų5735.9 Ų35.930%0.29821%0.208SC..EExtended strand (participates in β ladder)trans-58.1146.7165.2-65.3176.1000109.7S127 I130L91-S127 WeakPolarHBondContact CB-OG 3.19Å; L91-S127 PolarHBondContact N-OG 3.17Å; L91-I130 HydrophobicContact CD1-CB 4.08Å; L91-I130 HydrophobicContact CD1-CD1 3.68Å; L91-I130 HydrophobicContact CD1-CG1 4.49Å; L91-I130 HydrophobicContact CD1-CG2 3.88Å
92P93.8Very high94Very high34 Ų3443.7 Ų43.722%0.22125%0.245CC..EExtended strand (participates in β ladder)trans-64.9152.6-179.427.7-35.1000111.7H84 F85 T86 F94H84-P92 WeakPolarHBondContact NE2-CB 3.47Å; F85-P92 CarbonylContact O-C 3.58Å; F85-P92 VanDerWaalsContact O-CA 3.23Å; F85-P92 WeakPolarHBondContact O-CA 3.43Å; F85-P92 WeakPolarHBondContact O-CB 3.42Å; T86-P92 HydrophobicContact CG2-CB 4.31Å; P92-F94 HydrophobicContact CB-CE2 4.44Å; P92-F94 HydrophobicContact CB-CZ 4.28Å; P92-F94 HydrophobicContact CG-CE2 4.29Å; P92-F94 HydrophobicContact CG-CZ 4.12Å
93L95.9Very high94Very high1 Ų143.7 Ų43.71%0.00525%0.246CC..EExtended strand (participates in β ladder)trans-112.8153.2168.4-67.1-179.9000109.8V24 A25 D26 V32 F85 L119 L122 A123 A126V24-L93 HydrophobicContact CG1-CB 4.2Å; V24-L93 HydrophobicContact CG1-CD1 3.84Å; V24-L93 HydrophobicContact CG1-CD2 4.41Å; V24-L93 HydrophobicContact CG1-CG 4.39Å; A25-L93 WeakPolarHBondContact O-CA 3.34Å; D26-L93 HydrophobicContact CB-CD2 4.48Å; V32-L93 HydrophobicContact CG2-CD2 4.46Å; F85-L93 WeakPolarHBondContact CB-O 3.46Å; F85-L93 HydrophobicContact CD1-CB 4.45Å; F85-L93 PolarHBondContact N-O 2.87Å; F85-L93 PolarHBondContact O-N 3Å; L93-L119 HydrophobicContact CD1-CD2 4.46Å; L93-L122 HydrophobicContact CD1-CB 3.75Å; L93-A123 HydrophobicContact CD1-CB 3.77Å; L93-A123 HydrophobicContact CG-CB 3.98Å; L93-A126 HydrophobicContact CD2-CB 4.01Å
94F95.8Very high94Very high7 Ų748.1 Ų48.13%0.03127%0.27CS..EExtended strand (participates in β ladder)trans-117.4113.8180-56.6-86.4000108V24 A25 D26 K27 T50 F53 I54 L57 F83 H84 P92V24-F94 WeakPolarHBondContact CA-O 3.47Å; A25-F94 PolarHBondContact N-O 3.48Å; A25-F94 PolarHBondContact O-N 3.06Å; D26-F94 WeakPolarHBondContact O-CD2 3.2Å; K27-F94 VanDerWaalsContact CA-CE2 3.47Å; K27-F94 HydrophobicContact CB-CE2 3.97Å; T50-F94 HydrophobicContact CG2-CB 3.92Å; T50-F94 HydrophobicContact CG2-CD2 4.5Å; T50-F94 HydrophobicContact CG2-CG 4.22Å; F53-F94 AromaticContact CD1-CD1 3.78Å; F53-F94 HydrophobicContact CD1-CD1 3.78Å; F53-F94 AromaticContact CE1-CD1 3.75Å; F53-F94 HydrophobicContact CE1-CD1 3.75Å; I54-F94 HydrophobicContact CD1-CD1 4.48Å; I54-F94 HydrophobicContact CD1-CD2 4.03Å; I54-F94 HydrophobicContact CD1-CE1 4.24Å; I54-F94 HydrophobicContact CD1-CE2 3.79Å; I54-F94 HydrophobicContact CD1-CG 4.38Å; I54-F94 HydrophobicContact CD1-CZ 3.88Å; I54-F94 HydrophobicContact CG1-CD1 3.94Å; I54-F94 HydrophobicContact CG1-CD2 4.36Å; I54-F94 HydrophobicContact CG1-CE1 3.6Å; I54-F94 HydrophobicContact CG1-CE2 4.08Å; I54-F94 HydrophobicContact CG1-CG 4.31Å; I54-F94 HydrophobicContact CG1-CZ 3.67Å; L57-F94 HydrophobicContact CD1-CD1 4.13Å; L57-F94 HydrophobicContact CD1-CE1 3.61Å; F83-F94 WeakPolarHBondContact O-CA 3.43Å; H84-F94 AromaticContact CD2-CE1 3.63Å; P92-F94 HydrophobicContact CB-CE2 4.44Å; P92-F94 HydrophobicContact CB-CZ 4.28Å; P92-F94 HydrophobicContact CG-CE2 4.29Å; P92-F94 HydrophobicContact CG-CZ 4.12Å
95L97.1Very high94.1Very high1 Ų147.7 Ų47.71%0.00527%0.269CS..EExtended strand (participates in β ladder)trans-92.9124.1175.1170.670.2000108.1I22 F23 V24 Q82 F83 V97 E112 I115I22-L95 HydrophobicContact CG2-CD1 3.55Å; F23-L95 CarbonylContact O-C 3.53Å; F23-L95 WeakPolarHBondContact O-CA 3.41Å; V24-L95 HydrophobicContact CG2-CD1 4.09Å; Q82-L95 CarbonylContact C-O 3.46Å; Q82-L95 VanDerWaalsContact CA-O 3.27Å; Q82-L95 WeakPolarHBondContact CA-O 3.38Å; F83-L95 HydrophobicContact CB-CB 4.21Å; F83-L95 HydrophobicContact CD2-CB 4.41Å; F83-L95 HydrophobicContact CD2-CD2 3.93Å; F83-L95 HydrophobicContact CD2-CG 4.09Å; F83-L95 HydrophobicContact CG-CD2 4.37Å; F83-L95 PolarHBondContact N-O 3.25Å; F83-L95 PolarHBondContact O-N 3.4Å; L95-V97 HydrophobicContact CD1-CG2 4.45Å; L95-V97 HydrophobicContact CG-CG2 4.3Å; L95-E112 HydrophobicContact CD2-CB 4.4Å; L95-E112 HydrophobicContact CD2-CG 3.91Å; L95-I115 HydrophobicContact CD1-CD1 4.44Å; L95-I115 HydrophobicContact CD1-CG2 4.3Å; L95-I115 HydrophobicContact CD2-CB 4.45Å; L95-I115 HydrophobicContact CD2-CD1 4.07Å; L95-I115 HydrophobicContact CD2-CG2 4.25Å
96T96.8Very high94.2Very high2 Ų249.1 Ų49.11%0.01229%0.287CS..EExtended strand (participates in β ladder)trans-116.3122174.4-61.30000108.7I22 F23 V80 C81 Q82 V98I22-T96 CarbonylContact C-O 3.46Å; I22-T96 WeakPolarHBondContact CA-O 3.5Å; F23-T96 PolarHBondContact N-O 2.83Å; F23-T96 PolarHBondContact O-N 2.71Å; V80-T96 HydrophobicContact CG1-CG2 3.68Å; C81-T96 WeakPolarHBondContact O-CA 3.48Å; Q82-T96 HydrophobicContact CG-CG2 4.06Å; Q82-T96 PolarHBondContact NE2-OG1 2.8Å; T96-V98 HydrophobicContact CG2-CG2 4.03Å
97V97.2Very high94.4Very high1 Ų146 Ų461%0.00627%0.272CS..EExtended strand (participates in β ladder)trans-110.9125.7171.5-1760000108.3I19 I22 C81 F83 L95 I108I19-V97 HydrophobicContact CD1-CG1 4.05Å; I19-V97 HydrophobicContact CG1-CG1 4.23Å; I19-V97 HydrophobicContact CG2-CG1 4.26Å; I22-V97 HydrophobicContact CG1-CG1 4.25Å; I22-V97 HydrophobicContact CG1-CG2 4.34Å; I22-V97 HydrophobicContact CG2-CG2 4.34Å; C81-V97 HydrophobicContact CB-CB 4.46Å; C81-V97 PolarHBondContact N-O 2.83Å; C81-V97 PolarHBondContact O-N 3.2Å; F83-V97 HydrophobicContact CE2-CG2 4.19Å; L95-V97 HydrophobicContact CD1-CG2 4.45Å; L95-V97 HydrophobicContact CG-CG2 4.3Å; V97-I108 HydrophobicContact CB-CG2 3.71Å; V97-I108 HydrophobicContact CG1-CD1 4.24Å; V97-I108 HydrophobicContact CG1-CG1 4.21Å; V97-I108 HydrophobicContact CG1-CG2 3.67Å; V97-I108 HydrophobicContact CG2-CG2 4.13Å
98V97.2Very high94.8Very high0 Ų044 Ų440%026%0.258CS..EExtended strand (participates in β ladder)trans-109.8121.6178.7-175.60000107.7L20 G21 F23 M40 A44 M78 V79 V80 T96L20-V98 HydrophobicContact CB-CG1 4.47Å; L20-V98 PolarHBondContact N-O 2.89Å; G21-V98 PolarHBondContact N-O 2.82Å; G21-V98 VanDerWaalsContact N-O 3.13Å; G21-V98 PolarHBondContact O-N 2.8Å; F23-V98 HydrophobicContact CE2-CG2 4.37Å; M40-V98 HydrophobicContact CE-CB 4.16Å; M40-V98 HydrophobicContact CE-CG1 4.36Å; M40-V98 HydrophobicContact CE-CG2 3.84Å; A44-V98 HydrophobicContact CB-CG1 4Å; A44-V98 HydrophobicContact CB-CG2 4.06Å; M78-V98 HydrophobicContact CB-CG1 4.44Å; M78-V98 HydrophobicContact SD-CG1 4.4Å; V79-V98 WeakPolarHBondContact O-CA 3.32Å; V80-V98 HydrophobicContact CG2-CG2 4.48Å; T96-V98 HydrophobicContact CG2-CG2 4.03Å
99G97Very high95.5Very high0 Ų036.7 Ų36.70%023%0.225CC..EExtended strand (participates in β ladder)trans-117.5165.4173.200000111.4G18 M78 V79G18-G99 CarbonylContact O-C 3.54Å; G18-G99 WeakPolarHBondContact O-CA 3.33Å; M78-G99 CarbonylContact C-O 3.5Å; M78-G99 VanDerWaalsContact CA-O 3.23Å; M78-G99 WeakPolarHBondContact CA-O 3.43Å; M78-G99 WeakPolarHBondContact CB-O 3.42Å; V79-G99 PolarHBondContact N-O 3.05Å; V79-G99 PolarHBondContact O-N 3.04Å
100S96.3Very high96.1Very high33 Ų3334.4 Ų34.423%0.23121%0.213CC..EExtended strand (participates in β ladder)trans-62.1165.4166.165.20000111.4G18 E102 C103G18-S100 PolarHBondContact O-N 2.91Å; S100-E102 PolarHBondContact O-N 2.94Å; S100-E102 VanDerWaalsContact O-N 3.15Å; S100-C103 VanDerWaalsContact O-CB 3.24Å; S100-C103 WeakPolarHBondContact O-CB 3.4Å; S100-C103 PolarHBondContact O-N 2.86Å; S100-C103 PolarHBondContact OG-N 3.2Å
101S95Very high96.3Very high48 Ų4833.6 Ų33.634%0.33621%0.206SC..THydrogen-bonded Turntrans-55.6-30.1177.461.60000113.8Q76 E77Q76-S101 WeakPolarHBondContact O-CB 3.45Å; E77-S101 PolarHBondContact O-N 3.19Å; E77-S101 VanDerWaalsContact O-N 3.17Å
102E94.8Very high96.4Very high166 Ų16631.6 Ų31.678%0.77620%0.195SC*.THydrogen-bonded Turntrans-94.5-0.4-178.9-52.7-49.713000113.4S100S100-E102 PolarHBondContact O-N 2.94Å; S100-E102 VanDerWaalsContact O-N 3.15Å
103C96.2Very high96.5Very high8 Ų833.4 Ų33.45%0.05421%0.207CC..SBendtrans-64.4139.3-178.2-171.30000110.9D17 G18 V79 S100 I105 I108D17-C103 PolarHBondContact O-SG 3.04Å; G18-C103 VanDerWaalsContact C-SG 3.59Å; V79-C103 HydrophobicContact CG2-CB 4.35Å; S100-C103 VanDerWaalsContact O-CB 3.24Å; S100-C103 WeakPolarHBondContact O-CB 3.4Å; S100-C103 PolarHBondContact O-N 2.86Å; S100-C103 PolarHBondContact OG-N 3.2Å; C103-I105 PolarHBondContact O-N 3.42Å; C103-I108 HydrophobicContact CB-CD1 4.45Å
104N97.1Very high96.5Very high100 Ų10035.9 Ų35.954%0.53522%0.224SC..  trans-7299.2-178.7-172.5-36000111G106 A107 I108N104-G106 VanDerWaalsContact C-N 3.28Å; N104-G106 PolarHBondContact O-N 3.07Å; N104-G106 WeakPolarHBondContact OD1-CA 3.44Å; N104-G106 PolarHBondContact OD1-N 3.23Å; N104-A107 HydrophobicContact CB-CB 3.94Å; N104-A107 WeakPolarHBondContact O-CB 3.14Å; N104-A107 PolarHBondContact O-N 3.2Å; N104-A107 VanDerWaalsContact O-N 3.08Å; N104-A107 PolarHBondContact OD1-N 2.87Å; N104-I108 PolarHBondContact O-N 3.26Å
105I97.3Very high96.6Very high51 Ų5135.5 Ų35.526%0.26222%0.222SC..Hα-helixtrans-54.9-41.7178.3-64.8171.9000112.1I72 V79 C103 A107 I108 I109I72-I105 HydrophobicContact CD1-CG2 3.35Å; I72-I105 HydrophobicContact CG1-CG2 4.15Å; I72-I105 HydrophobicContact CG2-CD1 4.28Å; V79-I105 HydrophobicContact CG1-CD1 4.31Å; V79-I105 HydrophobicContact CG1-CG1 4.5Å; V79-I105 HydrophobicContact CG2-CG1 4.35Å; C103-I105 PolarHBondContact O-N 3.42Å; I105-A107 VanDerWaalsContact C-N 3.29Å; I105-A107 PolarHBondContact O-N 3.04Å; I105-I108 WeakPolarHBondContact O-CB 3.25Å; I105-I108 PolarHBondContact O-N 3.21Å; I105-I108 VanDerWaalsContact O-N 3.17Å; I105-I109 HydrophobicContact CG2-CD1 4.07Å; I105-I109 WeakPolarHBondContact O-CG1 3.45Å; I105-I109 PolarHBondContact O-N 2.97Å
106G97.5Very high96.6Very high44 Ų4440.7 Ų40.745%0.45424%0.242SC..Hα-helixtrans-63.3-37.2179.200000112.3N104 I109 A110N104-G106 VanDerWaalsContact C-N 3.28Å; N104-G106 PolarHBondContact O-N 3.07Å; N104-G106 WeakPolarHBondContact OD1-CA 3.44Å; N104-G106 PolarHBondContact OD1-N 3.23Å; G106-I109 PolarHBondContact O-N 3.25Å; G106-A110 WeakPolarHBondContact O-CB 3.42Å; G106-A110 PolarHBondContact O-N 3.43Å
107A97.3Very high96.5Very high31 Ų3143.8 Ų43.826%0.25626%0.262SS..Hα-helixtrans-69.2-37.6173.700000112V16 N104 I105 A110 L111V16-A107 HydrophobicContact CB-CB 4.39Å; V16-A107 HydrophobicContact CG1-CB 3.63Å; V16-A107 HydrophobicContact CG2-CB 3.82Å; N104-A107 HydrophobicContact CB-CB 3.94Å; N104-A107 WeakPolarHBondContact O-CB 3.14Å; N104-A107 PolarHBondContact O-N 3.2Å; N104-A107 VanDerWaalsContact O-N 3.08Å; N104-A107 PolarHBondContact OD1-N 2.87Å; I105-A107 VanDerWaalsContact C-N 3.29Å; I105-A107 PolarHBondContact O-N 3.04Å; A107-A110 PolarHBondContact O-N 2.86Å; A107-L111 PolarHBondContact O-N 2.96Å
108I97.2Very high96.4Very high0 Ų043.8 Ų43.80%026%0.262CS..Hα-helixtrans-60.4-44.4171.5-66.4171.5000111.1I19 V79 C81 F83 V97 C103 N104 I105 A110 L111I19-I108 HydrophobicContact CD1-CG1 4.34Å; I19-I108 HydrophobicContact CG1-CG1 4.3Å; V79-I108 HydrophobicContact CG2-CD1 4.24Å; C81-I108 HydrophobicContact CB-CG2 3.66Å; F83-I108 HydrophobicContact CE2-CG2 4.25Å; F83-I108 HydrophobicContact CZ-CG2 4.18Å; V97-I108 HydrophobicContact CB-CG2 3.71Å; V97-I108 HydrophobicContact CG1-CD1 4.24Å; V97-I108 HydrophobicContact CG1-CG1 4.21Å; V97-I108 HydrophobicContact CG1-CG2 3.67Å; V97-I108 HydrophobicContact CG2-CG2 4.13Å; C103-I108 HydrophobicContact CB-CD1 4.45Å; N104-I108 PolarHBondContact O-N 3.26Å; I105-I108 WeakPolarHBondContact O-CB 3.25Å; I105-I108 PolarHBondContact O-N 3.21Å; I105-I108 VanDerWaalsContact O-N 3.17Å; I108-A110 VanDerWaalsContact C-N 3.34Å; I108-A110 PolarHBondContact O-N 3.45Å; I108-L111 WeakPolarHBondContact O-CB 3.17Å; I108-L111 PolarHBondContact O-N 3.02Å
109I97Very high96.4Very high47 Ų4743.8 Ų43.824%0.24126%0.262CS..Hα-helixtrans-62.9-43.6177.4-66.7164.1000110.6W70 I72 F83 I105 G106 L111 E112W70-I109 HydrophobicContact CD2-CD1 4.47Å; W70-I109 HydrophobicContact CE3-CD1 4.43Å; W70-I109 HydrophobicContact CH2-CD1 3.92Å; W70-I109 HydrophobicContact CZ2-CD1 3.95Å; W70-I109 HydrophobicContact CZ3-CD1 4.19Å; I72-I109 HydrophobicContact CD1-CD1 4.24Å; F83-I109 HydrophobicContact CE1-CG1 4.36Å; F83-I109 HydrophobicContact CZ-CG1 4.33Å; I105-I109 HydrophobicContact CG2-CD1 4.07Å; I105-I109 WeakPolarHBondContact O-CG1 3.45Å; I105-I109 PolarHBondContact O-N 2.97Å; G106-I109 PolarHBondContact O-N 3.25Å; I109-L111 PolarHBondContact O-N 2.83Å; I109-E112 PolarHBondContact O-N 2.82Å
110A96.5Very high96.4Very high70 Ų7047.5 Ų47.558%0.57928%0.282SS*.Hα-helixtrans-65.8-17.8178.500000113.8G106 A107 I108 P113G106-A110 WeakPolarHBondContact O-CB 3.42Å; G106-A110 PolarHBondContact O-N 3.43Å; A107-A110 PolarHBondContact O-N 2.86Å; I108-A110 VanDerWaalsContact C-N 3.34Å; I108-A110 PolarHBondContact O-N 3.45Å; A110-P113 WeakPolarHBondContact O-CD 3.46Å
111L95.8Very high96.3Very high4 Ų451.4 Ų51.42%0.02129%0.292CS..Hα-helixtrans-75.2-33.3176.8-166.271.5000112.9F12 E15 V16 I19 I22 A107 I108 I109 S114 I115F12-L111 HydrophobicContact CB-CD1 4.23Å; F12-L111 HydrophobicContact CB-CD2 4.11Å; F12-L111 HydrophobicContact CB-CG 4.46Å; F12-L111 HydrophobicContact CD1-CD1 3.47Å; F12-L111 VanDerWaalsContact CD1-CD1 3.47Å; F12-L111 HydrophobicContact CD1-CG 4.04Å; F12-L111 HydrophobicContact CE1-CD1 4.26Å; F12-L111 HydrophobicContact CG-CD1 4.23Å; E15-L111 HydrophobicContact CB-CD1 4.21Å; E15-L111 HydrophobicContact CG-CD1 4.08Å; V16-L111 HydrophobicContact CG2-CD1 4.45Å; I19-L111 HydrophobicContact CD1-CD2 3.71Å; I22-L111 HydrophobicContact CD1-CD2 4.47Å; A107-L111 PolarHBondContact O-N 2.96Å; I108-L111 WeakPolarHBondContact O-CB 3.17Å; I108-L111 PolarHBondContact O-N 3.02Å; I109-L111 PolarHBondContact O-N 2.83Å; L111-S114 WeakPolarHBondContact O-CB 3.42Å; L111-S114 PolarHBondContact O-N 3.34Å; L111-I115 HydrophobicContact CD2-CD1 4.03Å; L111-I115 HydrophobicContact CG-CD1 3.97Å; L111-I115 HydrophobicContact CG-CG1 4.48Å; L111-I115 PolarHBondContact O-N 2.95Å
112E95.7Very high96.3Very high16 Ų1649.5 Ų49.58%0.07528%0.278CS..Hα-helixtrans-54.2-45.5-173.1-176.6-79.4148.700113.2F83 L95 I109 S114 I115 R116F83-E112 HydrophobicContact CB-CG 4.13Å; F83-E112 HydrophobicContact CD1-CB 3.84Å; F83-E112 HydrophobicContact CD1-CG 3.61Å; F83-E112 HydrophobicContact CD2-CG 4.43Å; F83-E112 HydrophobicContact CE1-CB 3.78Å; F83-E112 HydrophobicContact CE1-CG 4.1Å; F83-E112 HydrophobicContact CG-CB 4.3Å; F83-E112 HydrophobicContact CG-CG 3.81Å; F83-E112 HydrophobicContact CZ-CB 4.17Å; L95-E112 HydrophobicContact CD2-CB 4.4Å; L95-E112 HydrophobicContact CD2-CG 3.91Å; I109-E112 PolarHBondContact O-N 2.82Å; E112-S114 PolarHBondContact O-N 2.83Å; E112-I115 PolarHBondContact O-N 3.33Å; E112-R116 VanDerWaalsContact CD-NE 3.27Å; E112-R116 PolarHBondContact O-N 2.75Å; E112-R116 WeakPolarHBondContact OE1-CG 3.36Å; E112-R116 IonicContact OE1-CZ 3.65Å; E112-R116 IonicContact OE1-NE 2.88Å; E112-R116 PolarHBondContact OE1-NE 3.3Å; E112-R116 IonicContact OE1-NH2 3.62Å; E112-R116 IonicContact OE2-CZ 3.27Å; E112-R116 VanDerWaalsContact OE2-CZ 3.27Å; E112-R116 IonicContact OE2-NE 2.87Å; E112-R116 PolarHBondContact OE2-NE 2.9Å; E112-R116 IonicContact OE2-NH2 2.79Å; E112-R116 PolarHBondContact OE2-NH2 3.02Å
113P96Very high96.3Very high72 Ų7241.6 Ų41.647%0.46824%0.241SC..Hα-helixtrans-55.5-35.3176.3-28.636.7000114.1A110 I115 R116A110-P113 WeakPolarHBondContact O-CD 3.46Å; P113-I115 VanDerWaalsContact C-N 3.28Å; P113-I115 PolarHBondContact O-N 2.83Å; P113-R116 WeakPolarHBondContact O-CB 3.4Å; P113-R116 PolarHBondContact O-N 3.41Å
114S96.6Very high96.2Very high52 Ų5244.3 Ų44.336%0.36426%0.258SS..Hα-helixtrans-71.8-21.9178.2-59.60000113.1Y8 L111 E112 P117Y8-S114 PolarHBondContact OH-O 2.83Å; L111-S114 WeakPolarHBondContact O-CB 3.42Å; L111-S114 PolarHBondContact O-N 3.34Å; E112-S114 PolarHBondContact O-N 2.83Å; S114-P117 WeakPolarHBondContact O-CD 3.5Å
115I96.9Very high96Very high0 Ų043.9 Ų43.90%025%0.253CS..Hα-helixtrans-87.6-24.4177.9-61.1171.5000111.3L9 F12 L95 L111 E112 P113 P117 L118 L119L9-I115 HydrophobicContact CD2-CG2 4.08Å; F12-I115 HydrophobicContact CD1-CG1 4.24Å; F12-I115 HydrophobicContact CD2-CD1 4.38Å; F12-I115 HydrophobicContact CD2-CG1 3.94Å; F12-I115 HydrophobicContact CE1-CG1 4.09Å; F12-I115 HydrophobicContact CE2-CG1 3.8Å; F12-I115 HydrophobicContact CG-CD1 4.37Å; F12-I115 HydrophobicContact CG-CG1 4.16Å; F12-I115 HydrophobicContact CZ-CG1 3.87Å; L95-I115 HydrophobicContact CD1-CD1 4.44Å; L95-I115 HydrophobicContact CD1-CG2 4.3Å; L95-I115 HydrophobicContact CD2-CB 4.45Å; L95-I115 HydrophobicContact CD2-CD1 4.07Å; L95-I115 HydrophobicContact CD2-CG2 4.25Å; L111-I115 HydrophobicContact CD2-CD1 4.03Å; L111-I115 HydrophobicContact CG-CD1 3.97Å; L111-I115 HydrophobicContact CG-CG1 4.48Å; L111-I115 PolarHBondContact O-N 2.95Å; E112-I115 PolarHBondContact O-N 3.33Å; P113-I115 VanDerWaalsContact C-N 3.28Å; P113-I115 PolarHBondContact O-N 2.83Å; I115-P117 VanDerWaalsContact C-N 3.32Å; I115-P117 VanDerWaalsContact O-N 3.11Å; I115-L118 WeakPolarHBondContact O-CB 3.42Å; I115-L118 PolarHBondContact O-N 2.9Å; I115-L119 HydrophobicContact CG2-CD1 4.41Å; I115-L119 HydrophobicContact CG2-CD2 4.31Å; I115-L119 HydrophobicContact CG2-CG 4.12Å; I115-L119 PolarHBondContact O-N 2.64Å
116R96.1Very high95.8Very high109 Ų10941.8 Ų41.841%0.41124%0.243SC..Hα-helixtrans-48.7-37.4-180-68.3-176.4-178.6-156.70.9115.8F85 E112 P113 L118 L119 N120F85-R116 HydrophobicContact CD2-CG 4.41Å; F85-R116 HydrophobicContact CE2-CB 4.35Å; F85-R116 HydrophobicContact CE2-CG 4.07Å; E112-R116 VanDerWaalsContact CD-NE 3.27Å; E112-R116 PolarHBondContact O-N 2.75Å; E112-R116 WeakPolarHBondContact OE1-CG 3.36Å; E112-R116 IonicContact OE1-CZ 3.65Å; E112-R116 IonicContact OE1-NE 2.88Å; E112-R116 PolarHBondContact OE1-NE 3.3Å; E112-R116 IonicContact OE1-NH2 3.62Å; E112-R116 IonicContact OE2-CZ 3.27Å; E112-R116 VanDerWaalsContact OE2-CZ 3.27Å; E112-R116 IonicContact OE2-NE 2.87Å; E112-R116 PolarHBondContact OE2-NE 2.9Å; E112-R116 IonicContact OE2-NH2 2.79Å; E112-R116 PolarHBondContact OE2-NH2 3.02Å; P113-R116 WeakPolarHBondContact O-CB 3.4Å; P113-R116 PolarHBondContact O-N 3.41Å; R116-L118 PolarHBondContact O-N 3.42Å; R116-L119 PolarHBondContact O-N 2.86Å; R116-L119 VanDerWaalsContact O-N 3.15Å; R116-N120 WeakPolarHBondContact O-CB 3.45Å; R116-N120 PolarHBondContact O-N 3.24Å; R116-N120 PolarHBondContact O-ND2 3.18Å
117P95.4Very high95.6Very high68 Ų6840 Ų4044%0.44222%0.224SC..Hα-helixtrans-58-35.2175.1-26.736.4000113.2S114 I115 R121S114-P117 WeakPolarHBondContact O-CD 3.5Å; I115-P117 VanDerWaalsContact C-N 3.32Å; I115-P117 VanDerWaalsContact O-N 3.11Å; P117-R121 WeakPolarHBondContact O-CG 3.29Å
118L96.1Very high95.3Very high0 Ų040.8 Ų40.80%023%0.228CC..Hα-helixtrans-70.5-46.3172.8175.865.7000111.1A5 Y8 L9 I115 R116 N120 R121 L122A5-L118 HydrophobicContact CB-CD1 3.78Å; A5-L118 HydrophobicContact CB-CD2 4.49Å; Y8-L118 HydrophobicContact CD1-CB 3.78Å; Y8-L118 HydrophobicContact CD1-CD2 3.85Å; Y8-L118 HydrophobicContact CD1-CG 4.28Å; Y8-L118 HydrophobicContact CE1-CB 3.8Å; L9-L118 HydrophobicContact CD1-CD2 4.21Å; L9-L118 HydrophobicContact CD2-CD2 3.55Å; L9-L118 HydrophobicContact CG-CD2 3.56Å; I115-L118 WeakPolarHBondContact O-CB 3.42Å; I115-L118 PolarHBondContact O-N 2.9Å; R116-L118 PolarHBondContact O-N 3.42Å; L118-N120 VanDerWaalsContact C-N 3.3Å; L118-N120 PolarHBondContact O-N 3.25Å; L118-R121 WeakPolarHBondContact O-CB 3.37Å; L118-R121 PolarHBondContact O-N 3.25Å; L118-L122 HydrophobicContact CD1-CD1 3.9Å; L118-L122 HydrophobicContact CD1-CD2 4.41Å; L118-L122 HydrophobicContact CD1-CG 3.91Å; L118-L122 HydrophobicContact CD2-CD1 4.18Å; L118-L122 HydrophobicContact CG-CD1 3.76Å; L118-L122 HydrophobicContact CG-CG 4.14Å; L118-L122 WeakPolarHBondContact O-CG 3.35Å; L118-L122 PolarHBondContact O-N 3.11Å
119L96.8Very high95Very high0 Ų047.7 Ų47.70%025%0.253CS..Hα-helixtrans-60.8-39.5-178.6-56.5179.7000112.2V24 F85 L93 I115 R116 R121 L122 A123V24-L119 HydrophobicContact CB-CD2 4.39Å; V24-L119 HydrophobicContact CG1-CD2 3.77Å; V24-L119 HydrophobicContact CG2-CD2 3.66Å; F85-L119 HydrophobicContact CB-CD1 3.86Å; F85-L119 HydrophobicContact CD1-CB 3.65Å; F85-L119 HydrophobicContact CD1-CD1 4.29Å; F85-L119 HydrophobicContact CD2-CB 4.08Å; F85-L119 HydrophobicContact CD2-CD1 3.69Å; F85-L119 HydrophobicContact CE1-CB 3.62Å; F85-L119 HydrophobicContact CE2-CB 4.07Å; F85-L119 HydrophobicContact CE2-CD1 4.34Å; F85-L119 HydrophobicContact CG-CB 3.88Å; F85-L119 HydrophobicContact CG-CD1 3.67Å; F85-L119 HydrophobicContact CG-CG 4.39Å; F85-L119 HydrophobicContact CZ-CB 3.84Å; L93-L119 HydrophobicContact CD1-CD2 4.46Å; I115-L119 HydrophobicContact CG2-CD1 4.41Å; I115-L119 HydrophobicContact CG2-CD2 4.31Å; I115-L119 HydrophobicContact CG2-CG 4.12Å; I115-L119 PolarHBondContact O-N 2.64Å; R116-L119 PolarHBondContact O-N 2.86Å; R116-L119 VanDerWaalsContact O-N 3.15Å; L119-R121 PolarHBondContact O-N 2.9Å; L119-L122 PolarHBondContact O-N 3.38Å; L119-A123 WeakPolarHBondContact O-CB 3.44Å; L119-A123 PolarHBondContact O-N 3.21Å
120N95.9Very high94.6Very high79 Ų7946.7 Ų46.742%0.42225%0.248SC..Hα-helixtrans-61.2-31.3174.2-81.4-60.7000113.2R116 L118 P124R116-N120 WeakPolarHBondContact O-CB 3.45Å; R116-N120 PolarHBondContact O-N 3.24Å; R116-N120 PolarHBondContact O-ND2 3.18Å; L118-N120 VanDerWaalsContact C-N 3.3Å; L118-N120 PolarHBondContact O-N 3.25Å; N120-P124 WeakPolarHBondContact O-CD 3.38Å
121R94.5Very high94.2Very high114 Ų11449 Ų4943%0.4325%0.248SC..Hα-helixtrans-78-42.1174.1-67.2-171.9-59.2127.2-9.3111.9P117 L118 L119P117-R121 WeakPolarHBondContact O-CG 3.29Å; L118-R121 WeakPolarHBondContact O-CB 3.37Å; L118-R121 PolarHBondContact O-N 3.25Å; L119-R121 PolarHBondContact O-N 2.9Å
122L95.6Very high93.9Very high8 Ų853.2 Ų53.24%0.04227%0.27CS..Hα-helixtrans-74.2-33.7-175.6-67.9-179000113.3A5 V24 V32 A33 L93 L118 L119 E125 A126A5-L122 HydrophobicContact CB-CD1 4.31Å; A5-L122 HydrophobicContact CB-CD2 4.08Å; V24-L122 HydrophobicContact CB-CD1 4.39Å; V24-L122 HydrophobicContact CG1-CD1 4.1Å; V32-L122 HydrophobicContact CG1-CB 4.45Å; V32-L122 HydrophobicContact CG1-CD1 4.3Å; V32-L122 HydrophobicContact CG1-CD2 4.12Å; A33-L122 HydrophobicContact CB-CD1 3.98Å; L93-L122 HydrophobicContact CD1-CB 3.75Å; L118-L122 HydrophobicContact CD1-CD1 3.9Å; L118-L122 HydrophobicContact CD1-CD2 4.41Å; L118-L122 HydrophobicContact CD1-CG 3.91Å; L118-L122 HydrophobicContact CD2-CD1 4.18Å; L118-L122 HydrophobicContact CG-CD1 3.76Å; L118-L122 HydrophobicContact CG-CG 4.14Å; L118-L122 WeakPolarHBondContact O-CG 3.35Å; L118-L122 PolarHBondContact O-N 3.11Å; L119-L122 PolarHBondContact O-N 3.38Å; L122-E125 PolarHBondContact O-N 3.31Å; L122-A126 WeakPolarHBondContact O-CB 3.22Å; L122-A126 PolarHBondContact O-N 2.98Å
123A95.5Very high93.4Very high0 Ų057.9 Ų57.90%029%0.292CS..Hα-helixtrans-62-45.8-17300000113.1F85 A90 L93 L119 E125 S127F85-A123 HydrophobicContact CE1-CB 4.39Å; A90-A123 HydrophobicContact CB-CB 3.75Å; L93-A123 HydrophobicContact CD1-CB 3.77Å; L93-A123 HydrophobicContact CG-CB 3.98Å; L119-A123 WeakPolarHBondContact O-CB 3.44Å; L119-A123 PolarHBondContact O-N 3.21Å; A123-E125 PolarHBondContact O-N 3.16Å; A123-S127 WeakPolarHBondContact O-CB 3.24Å; A123-S127 PolarHBondContact O-N 3.04Å; A123-S127 PolarHBondContact O-OG 3.23Å
124P93.8Very high92.9Very high65 Ų6557 Ų5742%0.42229%0.29SS..Hα-helixtrans-62.5-40.1173.7-2334.3000113.1N120 S127 S128N120-P124 WeakPolarHBondContact O-CD 3.38Å; P124-S127 PolarHBondContact O-N 3.43Å; P124-S128 WeakPolarHBondContact O-CB 3.39Å; P124-S128 PolarHBondContact O-N 3.34Å
125E92.6Very high92.4Very high92 Ų9260.2 Ų60.243%0.4330%0.301SS..Hα-helixtrans-63.2-50.6178.9-67.5-178.7-167.900111.3L122 A123 S127 S128 R129L122-E125 PolarHBondContact O-N 3.31Å; A123-E125 PolarHBondContact O-N 3.16Å; E125-S127 VanDerWaalsContact C-N 3.32Å; E125-S127 PolarHBondContact O-N 3.01Å; E125-S128 PolarHBondContact O-N 3.14Å; E125-S128 PolarHBondContact O-OG 3.48Å; E125-R129 WeakPolarHBondContact O-CG 3.34Å; E125-R129 PolarHBondContact O-N 3.43Å
126A92.8Very high91.8Very high6 Ų667.2 Ų67.25%0.0534%0.338CS..Hα-helixtrans-59.7-43176.700000111.6V32 L93 L122 S128 R129 I130V32-A126 HydrophobicContact CG2-CB 4.23Å; L93-A126 HydrophobicContact CD2-CB 4.01Å; L122-A126 WeakPolarHBondContact O-CB 3.22Å; L122-A126 PolarHBondContact O-N 2.98Å; A126-S128 PolarHBondContact O-N 3.43Å; A126-R129 PolarHBondContact O-N 3.04Å; A126-I130 WeakPolarHBondContact O-CG1 3.42Å; A126-I130 PolarHBondContact O-N 3.26Å
127S92.9Very high90.9Very high6 Ų668.1 Ų68.14%0.04235%0.351CS..Hα-helixtrans-60.5-44.4177-59.20000112.5A90 L91 A123 P124 E125 R129 I130 Q131A90-S127 WeakPolarHBondContact CA-OG 3.47Å; A90-S127 WeakPolarHBondContact CB-OG 3.49Å; L91-S127 WeakPolarHBondContact CB-OG 3.19Å; L91-S127 PolarHBondContact N-OG 3.17Å; A123-S127 WeakPolarHBondContact O-CB 3.24Å; A123-S127 PolarHBondContact O-N 3.04Å; A123-S127 PolarHBondContact O-OG 3.23Å; P124-S127 PolarHBondContact O-N 3.43Å; E125-S127 VanDerWaalsContact C-N 3.32Å; E125-S127 PolarHBondContact O-N 3.01Å; S127-R129 VanDerWaalsContact C-N 3.33Å; S127-R129 PolarHBondContact O-N 3.15Å; S127-I130 PolarHBondContact O-N 3.07Å; S127-Q131 WeakPolarHBondContact O-CB 3.43Å; S127-Q131 VanDerWaalsContact O-CG 3.26Å; S127-Q131 WeakPolarHBondContact O-CG 3.44Å; S127-Q131 PolarHBondContact O-N 2.92Å
128S92.1Very high89.5Confident49 Ų4973.9 Ų73.934%0.34336%0.363SS..Hα-helixtrans-64.1-38.2178.574.80000111.9P124 E125 A126 Q131 N132P124-S128 WeakPolarHBondContact O-CB 3.39Å; P124-S128 PolarHBondContact O-N 3.34Å; E125-S128 PolarHBondContact O-N 3.14Å; E125-S128 PolarHBondContact O-OG 3.48Å; A126-S128 PolarHBondContact O-N 3.43Å; S128-Q131 PolarHBondContact O-N 3.36Å; S128-N132 WeakPolarHBondContact O-CB 3.23Å; S128-N132 PolarHBondContact O-N 2.8Å; S128-N132 PolarHBondContact O-ND2 2.92Å; S128-N132 VanDerWaalsContact O-ND2 3.14Å
129R90.1Very high88Confident144 Ų14478.9 Ų78.954%0.54339%0.394SS..Hα-helixtrans-62.9-50.4176.2-70.9177.7-174.9-172.84.3111.1E125 A126 S127 Q131 N132 E133E125-R129 WeakPolarHBondContact O-CG 3.34Å; E125-R129 PolarHBondContact O-N 3.43Å; A126-R129 PolarHBondContact O-N 3.04Å; S127-R129 VanDerWaalsContact C-N 3.33Å; S127-R129 PolarHBondContact O-N 3.15Å; R129-Q131 VanDerWaalsContact C-N 3.31Å; R129-Q131 PolarHBondContact O-N 2.77Å; R129-N132 PolarHBondContact O-N 2.82Å; R129-E133 WeakPolarHBondContact O-CG 3.4Å; R129-E133 PolarHBondContact O-N 2.84Å
130I88.7Confident86.2Confident26 Ų2685.7 Ų85.713%0.13344%0.436CS..Hα-helixtrans-59.6-42.6178.1-67.3166.3000110.9D26 L91 A126 S127 E133 A134D26-I130 HydrophobicContact CB-CD1 4.08Å; L91-I130 HydrophobicContact CD1-CB 4.08Å; L91-I130 HydrophobicContact CD1-CD1 3.68Å; L91-I130 HydrophobicContact CD1-CG1 4.49Å; L91-I130 HydrophobicContact CD1-CG2 3.88Å; A126-I130 WeakPolarHBondContact O-CG1 3.42Å; A126-I130 PolarHBondContact O-N 3.26Å; S127-I130 PolarHBondContact O-N 3.07Å; I130-E133 PolarHBondContact O-N 3.39Å; I130-A134 WeakPolarHBondContact O-CB 3.44Å; I130-A134 PolarHBondContact O-N 2.87Å
131Q88.2Confident84.4Confident120 Ų12088.2 Ų88.256%0.56145%0.45SS*.Hα-helixtrans-64.8-42.8177.3-73.7174.1-100112.2S127 S128 R129 A134 M135S127-Q131 WeakPolarHBondContact O-CB 3.43Å; S127-Q131 VanDerWaalsContact O-CG 3.26Å; S127-Q131 WeakPolarHBondContact O-CG 3.44Å; S127-Q131 PolarHBondContact O-N 2.92Å; S128-Q131 PolarHBondContact O-N 3.36Å; R129-Q131 VanDerWaalsContact C-N 3.31Å; R129-Q131 PolarHBondContact O-N 2.77Å; Q131-A134 PolarHBondContact O-N 3.13Å; Q131-M135 WeakPolarHBondContact O-CG 3.45Å; Q131-M135 PolarHBondContact O-N 3.17Å
132N89.1Confident82.5Confident91 Ų9185 Ų8549%0.48745%0.452SS..Hα-helixtrans-64.1-43.5177.4-72-24.5000111.5S128 R129 M135 L136S128-N132 WeakPolarHBondContact O-CB 3.23Å; S128-N132 PolarHBondContact O-N 2.8Å; S128-N132 PolarHBondContact O-ND2 2.92Å; S128-N132 VanDerWaalsContact O-ND2 3.14Å; R129-N132 PolarHBondContact O-N 2.82Å; N132-M135 WeakPolarHBondContact O-CB 3.49Å; N132-M135 PolarHBondContact O-N 3.08Å; N132-L136 VanDerWaalsContact O-CG 3.32Å; N132-L136 WeakPolarHBondContact O-CG 3.21Å; N132-L136 PolarHBondContact O-N 3.34Å
133E86.8Confident80.3Confident115 Ų11590.6 Ų90.654%0.53749%0.489SS..Hα-helixtrans-61.7-43.7174.7-72.6172.9-175.300111.6R129 I130 M135 L136 N137R129-E133 WeakPolarHBondContact O-CG 3.4Å; R129-E133 PolarHBondContact O-N 2.84Å; I130-E133 PolarHBondContact O-N 3.39Å; E133-M135 VanDerWaalsContact C-N 3.29Å; E133-M135 PolarHBondContact O-N 3.17Å; E133-L136 PolarHBondContact O-N 2.64Å; E133-N137 WeakPolarHBondContact O-CB 3.23Å; E133-N137 PolarHBondContact O-N 3.47Å; E133-N137 PolarHBondContact O-ND2 2.85Å
134A85.3Confident78.4Confident53 Ų53100.9 Ų100.944%0.43853%0.529SS..Hα-helixtrans-62-36.9174.700000112.1I130 Q131 R138I130-A134 WeakPolarHBondContact O-CB 3.44Å; I130-A134 PolarHBondContact O-N 2.87Å; Q131-A134 PolarHBondContact O-N 3.13Å; A134-R138 WeakPolarHBondContact O-CG 3.46Å; A134-R138 PolarHBondContact O-N 3.28Å
135M85.7Confident76.8Confident120 Ų120107.5 Ų107.559%0.59155%0.552SS**Hα-helixtrans-68.1-40.9175.2-76.3-172.4169.600112.7Q131 N132 E133 N137 R138Q131-M135 WeakPolarHBondContact O-CG 3.45Å; Q131-M135 PolarHBondContact O-N 3.17Å; N132-M135 WeakPolarHBondContact O-CB 3.49Å; N132-M135 PolarHBondContact O-N 3.08Å; E133-M135 VanDerWaalsContact C-N 3.29Å; E133-M135 PolarHBondContact O-N 3.17Å; M135-N137 VanDerWaalsContact C-N 3.32Å; M135-R138 WeakPolarHBondContact O-CB 3.5Å; M135-R138 PolarHBondContact O-N 2.8Å
136L83.8Confident74.9Confident147 Ų147114.6 Ų114.677%0.7757%0.574SS**Hα-helixtrans-66.6-35177.1-69.3168.1000112N132 E133 R138N132-L136 VanDerWaalsContact O-CG 3.32Å; N132-L136 WeakPolarHBondContact O-CG 3.21Å; N132-L136 PolarHBondContact O-N 3.34Å; E133-L136 PolarHBondContact O-N 2.64Å; L136-R138 VanDerWaalsContact C-N 3.31Å; L136-R138 PolarHBondContact O-N 3.43Å
137N78.1Confident73.4Confident127 Ų127124.4 Ų124.468%0.67963%0.633SS**THydrogen-bonded Turntrans-82.5-3178.9-69.6-27.9000114E133 M135 T139E133-N137 WeakPolarHBondContact O-CB 3.23Å; E133-N137 PolarHBondContact O-N 3.47Å; E133-N137 PolarHBondContact O-ND2 2.85Å; M135-N137 VanDerWaalsContact C-N 3.32Å; N137-T139 VanDerWaalsContact C-N 3.27Å; N137-T139 PolarHBondContact O-N 3.4Å
138R65.3Low72.4Confident189 Ų189130.3 Ų130.371%0.71366%0.663SS**  trans-67.490170.1-79175.4-174.8-168.70.8109A134 M135 L136 T140A134-R138 WeakPolarHBondContact O-CG 3.46Å; A134-R138 PolarHBondContact O-N 3.28Å; M135-R138 WeakPolarHBondContact O-CB 3.5Å; M135-R138 PolarHBondContact O-N 2.8Å; L136-R138 VanDerWaalsContact C-N 3.31Å; L136-R138 PolarHBondContact O-N 3.43Å; R138-T140 PolarHBondContact O-N 3.22Å
139T63.6Low71.4Confident105 Ų105134.6 Ų134.664%0.64468%0.679SS**  trans-62.3135.4162.362.60000108.1N137 N141N137-T139 VanDerWaalsContact C-N 3.27Å; N137-T139 PolarHBondContact O-N 3.4Å; T139-N141 PolarHBondContact O-N 3.13Å
140T59.4Low70.4Confident143 Ų143134.1 Ų134.188%0.87769%0.687SS**SBendtrans-69.69.2171.845.20000112.7R138 G142R138-T140 PolarHBondContact O-N 3.22Å; T140-G142 VanDerWaalsContact C-N 3.34Å; T140-G142 PolarHBondContact O-N 3.4Å
141N58.1Low69.3Low133 Ų133140.4 Ų140.471%0.71172%0.719SS**  trans-82.582177.2-64.5-21.6000108.9T139T139-N141 PolarHBondContact O-N 3.13Å
142G55.4Low68.1Low46 Ų46141.7 Ų141.747%0.47473%0.729SS.*  trans-53.7179.5162.100000112.7T140 Y144T140-G142 VanDerWaalsContact C-N 3.34Å; T140-G142 PolarHBondContact O-N 3.4Å; G142-Y144 VanDerWaalsContact C-N 3.25Å; G142-Y144 PolarHBondContact O-N 3.24Å
143P49.6Very low66.7Low126 Ų126145.1 Ų145.182%0.81875%0.746SS**SBendtrans-76.855.2-15235.2-38.9000114.9
144Y55.8Low65.3Low215 Ų215147.2 Ų147.284%0.84376%0.76SS**  trans-112.284.8172.5-62.7-75.4000109.8G142 R146G142-Y144 VanDerWaalsContact C-N 3.25Å; G142-Y144 PolarHBondContact O-N 3.24Å; Y144-R146 PolarHBondContact O-N 3.09Å
145F59.5Low63.7Low205 Ų205154.5 Ų154.590%0.89979%0.785SS**  trans-73.4108.2148.7-71.9-86.2000106.3V147F145-V147 PolarHBondContact O-N 3.45Å
146R52.1Low61.9Low241 Ų241157.3 Ų157.391%0.90980%0.801SS**  trans-73.2116.9159.7-83.2-171.1179.3-172.30.6106.7Y144Y144-R146 PolarHBondContact O-N 3.09Å
147V62.5Low59.9Low211 Ų211158.3 Ų158.3100%1.27980%0.804SS**  trans-62.50157.1-174.80000108.5F145F145-V147 PolarHBondContact O-N 3.45Å

Retrieved 147 of 147 residues in 92.3 ms (Link to these results)

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