A0A087WYI2_HUMAN Loading...

Ena/VASP-like protein

AlphaFold DB , UniProt , Accession A0A087WYI2, Species HUMAN (Homo sapiens, Human), Gene EVL, Length 283 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45.4Very low82.2Confident237 Ų23785.7 Ų85.7100%1.16748%0.483SS*.  0118.80-60.9-170.7-171.400106.9T3M1-T3 PolarHBondContact O-N 3.48Å
2A51.1Low83.5Confident99 Ų9988.3 Ų88.382%0.81848%0.479SS*.  trans-62.1119.6175.900000107.8S4A2-S4 PolarHBondContact O-N 3.37Å; A2-S4 VanDerWaalsContact O-N 3.15Å
3T63.9Low84.6Confident123 Ų12381.5 Ų81.576%0.75544%0.443SS*.  trans-60.8117.3175.948.50000107.6M1 E5M1-T3 PolarHBondContact O-N 3.48Å; T3-E5 PolarHBondContact O-N 3.29Å
4S80.7Confident85.5Confident60 Ų6077.1 Ų77.142%0.4242%0.421SS..SBendtrans-66.10.5-176-50.80000114.3A2 N43 T44A2-S4 PolarHBondContact O-N 3.37Å; A2-S4 VanDerWaalsContact O-N 3.15Å; S4-N43 WeakPolarHBondContact O-CA 3.4Å; S4-T44 PolarHBondContact O-N 3.44Å
5E87.3Confident86.2Confident71 Ų7172.3 Ų72.333%0.33240%0.395SS..EExtended strand (participates in β ladder)trans-102.6120.8-179.8-62.7-171.4146.900111.4T3 Y41 H42 N43 R50T3-E5 PolarHBondContact O-N 3.29Å; E5-Y41 HydrophobicContact CB-CD1 4.43Å; E5-H42 WeakPolarHBondContact CA-O 3.33Å; E5-N43 HydrophobicContact CG-CB 4.44Å; E5-R50 VanDerWaalsContact CD-CZ 3.46Å; E5-R50 IonicContact OE1-CZ 3.18Å; E5-R50 IonicContact OE1-NE 3.2Å; E5-R50 PolarHBondContact OE1-NE 3.34Å; E5-R50 IonicContact OE1-NH1 3.28Å; E5-R50 PolarHBondContact OE1-NH1 2.72Å; E5-R50 IonicContact OE1-NH2 3.18Å; E5-R50 PolarHBondContact OE1-NH2 3.36Å; E5-R50 IonicContact OE2-CZ 3.44Å; E5-R50 VanDerWaalsContact OE2-CZ 3.28Å; E5-R50 IonicContact OE2-NE 3.81Å; E5-R50 IonicContact OE2-NH2 2.6Å; E5-R50 PolarHBondContact OE2-NH2 3.37Å
6Q93.3Very high86.9Confident125 Ų12569.6 Ų69.658%0.58438%0.379SS*.EExtended strand (participates in β ladder)trans-116.4131.6178.3-179.2175.4-23.900109.9I8 Y41 H42Q6-I8 PolarHBondContact O-N 3.36Å; Q6-Y41 CarbonylContact O-C 3.55Å; Q6-Y41 WeakPolarHBondContact O-CA 3.03Å; Q6-H42 PolarHBondContact N-O 3.39Å; Q6-H42 PolarHBondContact O-N 3.23Å
7S94.8Very high87.4Confident48 Ų4866.7 Ų66.734%0.33636%0.364SS..EExtended strand (participates in β ladder)trans-73.6125.7170.2-174.10000109.5C9 I40S7-C9 PolarHBondContact OG-O 2.82Å; S7-C9 VanDerWaalsContact OG-O 3.12Å; S7-I40 WeakPolarHBondContact CA-O 3.46Å
8I95.7Very high87.9Confident53 Ų5366.3 Ų66.327%0.27236%0.357SS..EExtended strand (participates in β ladder)trans-100.3-17.617863.6162.6000112.5Q6 I40 H42 F49 A106 F109Q6-I8 PolarHBondContact O-N 3.36Å; I8-I40 HydrophobicContact CD1-CB 4.2Å; I8-I40 HydrophobicContact CD1-CG2 3.73Å; I8-I40 HydrophobicContact CG1-CB 3.81Å; I8-I40 HydrophobicContact CG1-CG2 3.77Å; I8-I40 WeakPolarHBondContact CG1-O 3.27Å; I8-I40 PolarHBondContact N-O 3.47Å; I8-H42 HydrophobicContact CG2-CB 3.79Å; I8-F49 HydrophobicContact CD1-CD1 4Å; I8-F49 HydrophobicContact CD1-CE1 3.93Å; I8-A106 HydrophobicContact CD1-CB 4.24Å; I8-F109 HydrophobicContact CD1-CD1 4.25Å
9C96.8Very high88.3Confident12 Ų1265.6 Ų65.68%0.08135%0.353CS..EExtended strand (participates in β ladder)trans-154.9158173.277.80000111.3S7 N39 I40 A106S7-C9 PolarHBondContact OG-O 2.82Å; S7-C9 VanDerWaalsContact OG-O 3.12Å; C9-N39 VanDerWaalsContact O-CA 3.29Å; C9-N39 WeakPolarHBondContact O-CA 3.18Å; C9-N39 PolarHBondContact O-OD1 3.33Å; C9-I40 PolarHBondContact O-N 3.35Å; C9-I40 VanDerWaalsContact SG-CD1 3.56Å; C9-I40 WeakPolarHBondContact SG-CG1 3.46Å; C9-A106 HydrophobicContact CB-CB 3.49Å; C9-A106 VanDerWaalsContact CB-CB 3.49Å
10Q97.1Very high88.5Confident112 Ų11266 Ų6652%0.52336%0.355SS..EExtended strand (participates in β ladder)trans-137.2135.7172.7-178.5169.5103.400109.6R37 I38 N39Q10-R37 HydrophobicContact CG-CG 3.94Å; Q10-I38 CarbonylContact C-O 3.46Å; Q10-I38 WeakPolarHBondContact CA-O 3.39Å; Q10-N39 WeakPolarHBondContact CB-OD1 3.36Å; Q10-N39 WeakPolarHBondContact CG-OD1 3.27Å; Q10-N39 PolarHBondContact NE2-OD1 2.97Å; Q10-N39 VanDerWaalsContact NE2-OD1 3.08Å
11A98.1Very high88.9Confident3 Ų369.1 Ų69.13%0.02538%0.377CS..EExtended strand (participates in β ladder)trans-146.5164.317700000110.2I38 F94 E99 F103A11-I38 PolarHBondContact N-O 2.94Å; A11-I38 PolarHBondContact O-N 2.99Å; A11-F94 HydrophobicContact CB-CD1 4.05Å; A11-F94 HydrophobicContact CB-CE1 3.9Å; A11-E99 HydrophobicContact CB-CB 4.12Å; A11-F103 HydrophobicContact CB-CB 4.21Å; A11-F103 HydrophobicContact CB-CD2 4.41Å
12R98.1Very high91.2Very high117 Ų11760 Ų6044%0.44234%0.336SS..EExtended strand (participates in β ladder)trans-108.7131.3169.6-65178.3-63.61595.8109.7S36 F94 A95 E99R12-S36 WeakPolarHBondContact CA-O 3.13Å; R12-F94 WeakPolarHBondContact O-CA 3.4Å; R12-A95 HydrophobicContact CB-CB 4.07Å; R12-A95 PolarHBondContact O-N 2.87Å; R12-E99 IonicContact CZ-OE1 2.95Å; R12-E99 IonicContact NE-OE1 2.79Å; R12-E99 PolarHBondContact NE-OE1 3.12Å; R12-E99 IonicContact NH2-OE1 3.3Å; R12-E99 PolarHBondContact NH2-OE1 2.72Å
13A97.9Very high93.3Very high0 Ų061.8 Ų61.80%033%0.325CS..EExtended strand (participates in β ladder)trans-154.7154.3176.500000112.1S36 I38 L92 N93 F94A13-S36 PolarHBondContact N-O 2.83Å; A13-S36 PolarHBondContact O-N 2.8Å; A13-I38 HydrophobicContact CB-CG1 3.89Å; A13-L92 HydrophobicContact CB-CB 4.05Å; A13-L92 HydrophobicContact CB-CD2 4.37Å; A13-N93 CarbonylContact C-O 3.57Å; A13-N93 WeakPolarHBondContact CA-O 3.34Å; A13-N93 WeakPolarHBondContact CB-O 3.18Å; A13-F94 HydrophobicContact CB-CD1 3.81Å; A13-F94 HydrophobicContact CB-CE1 4.08Å; A13-F94 HydrophobicContact CB-CG 4.19Å
14S96.9Very high94.8Very high20 Ų2061.5 Ų61.514%0.1431%0.314CS..EExtended strand (participates in β ladder)trans-83.1127.6163.1-175.90000109.3N93S14-N93 PolarHBondContact N-O 3.34Å; S14-N93 PolarHBondContact O-N 3.28Å
15V96.6Very high95.5Very high5 Ų562.4 Ų62.43%0.0331%0.308CS..EExtended strand (participates in β ladder)trans-88.1122.7179.1-171.70000109.7I28 I38 V62 I63 L92V15-I28 HydrophobicContact CB-CG2 4.05Å; V15-I28 HydrophobicContact CG1-CB 4.16Å; V15-I28 HydrophobicContact CG1-CD1 3.9Å; V15-I28 HydrophobicContact CG1-CG2 4.07Å; V15-I28 PolarHBondContact O-N 3.07Å; V15-I38 HydrophobicContact CG2-CD1 3.62Å; V15-V62 HydrophobicContact CB-CG2 4.45Å; V15-V62 HydrophobicContact CG2-CG2 3.9Å; V15-I63 HydrophobicContact CG1-CB 4.18Å; V15-I63 HydrophobicContact CG1-CD1 4.11Å; V15-I63 HydrophobicContact CG1-CG2 4.19Å; V15-I63 HydrophobicContact CG2-CG2 4.02Å; V15-L92 HydrophobicContact CB-CD2 4.3Å; V15-L92 HydrophobicContact CG1-CD2 4.25Å; V15-L92 HydrophobicContact CG2-CD2 3.83Å
16M96.4Very high95.9Very high29 Ų2960.8 Ų60.814%0.14330%0.303CS..EExtended strand (participates in β ladder)trans-122152.3-176.4-53.6-63.6-72.300109.9W25 V26 P27 G91M16-W25 HydrophobicContact CB-CE3 3.83Å; M16-W25 HydrophobicContact CB-CZ3 4.48Å; M16-W25 HydrophobicContact CE-CB 4.02Å; M16-V26 CarbonylContact C-O 3.57Å; M16-V26 WeakPolarHBondContact CA-O 3.45Å; M16-P27 HydrophobicContact CE-CG 4.33Å; M16-P27 HydrophobicContact SD-CB 4.45Å; M16-P27 HydrophobicContact SD-CG 4.39Å; M16-G91 PolarHBondContact N-O 2.78Å; M16-G91 PolarHBondContact O-N 3.31Å
17V95.8Very high95.9Very high20 Ų2056 Ų5612%0.12128%0.283CS..EExtended strand (participates in β ladder)trans-125.4140.4170.9-67.70000108.5V26 I28 Q88 V89 Y90V17-V26 HydrophobicContact CG2-CG2 3.61Å; V17-V26 PolarHBondContact N-O 3.26Å; V17-V26 WeakPolarHBondContact O-CG2 3.38Å; V17-V26 PolarHBondContact O-N 3.34Å; V17-I28 HydrophobicContact CG1-CB 4.14Å; V17-I28 HydrophobicContact CG1-CD1 3.97Å; V17-I28 HydrophobicContact CG1-CG1 3.87Å; V17-Q88 HydrophobicContact CG1-CG 4.31Å; V17-V89 WeakPolarHBondContact CA-O 3.14Å; V17-Y90 HydrophobicContact CG1-CD1 3.92Å; V17-Y90 HydrophobicContact CG1-CE1 4.08Å
18Y96.6Very high95.8Very high60 Ų6056 Ų5624%0.23528%0.279CS..EExtended strand (participates in β ladder)trans-81.3122.2174.3-166.7-105.7000109.2D20 K23 W25 Q88 V89Y18-D20 WeakPolarHBondContact CD1-OD1 3.31Å; Y18-D20 WeakPolarHBondContact CE1-OD1 3.37Å; Y18-K23 HydrophobicContact CE1-CD 4.46Å; Y18-K23 WeakPolarHBondContact OH-CA 3.37Å; Y18-K23 PolarHBondContact OH-O 3.07Å; Y18-W25 AromaticContact CD2-CD2 3.93Å; Y18-W25 HydrophobicContact CD2-CD2 3.93Å; Y18-W25 AromaticContact CD2-CE2 3.76Å; Y18-W25 HydrophobicContact CD2-CE3 4.45Å; Y18-W25 HydrophobicContact CD2-CG 4.19Å; Y18-W25 HydrophobicContact CD2-CZ2 4.17Å; Y18-W25 AromaticContact CD2-NE1 3.9Å; Y18-Q88 PolarHBondContact O-NE2 3.39Å; Y18-V89 PolarHBondContact N-O 2.9Å
19D94.9Very high95.3Very high53 Ų5356.6 Ų56.628%0.28328%0.279SS..EExtended strand (participates in β ladder)trans-90.5113.5170.8174.515.1000109.3T21 S22 K23 K24 V26D19-T21 PolarHBondContact O-N 2.55Å; D19-T21 WeakPolarHBondContact OD1-CB 3.29Å; D19-T21 PolarHBondContact OD1-N 3Å; D19-T21 PolarHBondContact OD1-OG1 3.49Å; D19-S22 VanDerWaalsContact CG-OG 3.3Å; D19-S22 WeakPolarHBondContact OD2-CB 3.2Å; D19-S22 PolarHBondContact OD2-N 3.42Å; D19-S22 PolarHBondContact OD2-OG 2.89Å; D19-K23 VanDerWaalsContact O-CA 3.31Å; D19-K23 WeakPolarHBondContact O-CA 3.5Å; D19-K23 PolarHBondContact O-N 3.21Å; D19-K24 PolarHBondContact N-O 2.86Å; D19-K24 PolarHBondContact O-N 2.96Å; D19-V26 HydrophobicContact CB-CG1 4.42Å; D19-V26 HydrophobicContact CB-CG2 4.19Å
20D93.6Very high94.6Very high73 Ų7362 Ų6239%0.3931%0.314SS..THydrogen-bonded Turntrans-68.3-21.3-179.9-80.4-36000113.3Y18 K23Y18-D20 WeakPolarHBondContact CD1-OD1 3.31Å; Y18-D20 WeakPolarHBondContact CE1-OD1 3.37Å; D20-K23 VanDerWaalsContact O-CD 3.31Å; D20-K23 WeakPolarHBondContact O-CD 3.37Å; D20-K23 WeakPolarHBondContact O-CE 3.42Å; D20-K23 PolarHBondContact O-NZ 2.81Å
21T95.4Very high93.7Very high132 Ų13260.6 Ų60.681%0.8133%0.33SS*.THydrogen-bonded Turntrans-76.4-50.7179.6-46.90000110.5D19D19-T21 PolarHBondContact O-N 2.55Å; D19-T21 WeakPolarHBondContact OD1-CB 3.29Å; D19-T21 PolarHBondContact OD1-N 3Å; D19-T21 PolarHBondContact OD1-OG1 3.49Å
22S94.8Very high92.6Very high46 Ų4664 Ų6432%0.32235%0.345SS..THydrogen-bonded Turntrans-92.61.4-179.164.80000114.1D19 K24D19-S22 VanDerWaalsContact CG-OG 3.3Å; D19-S22 WeakPolarHBondContact OD2-CB 3.2Å; D19-S22 PolarHBondContact OD2-N 3.42Å; D19-S22 PolarHBondContact OD2-OG 2.89Å; S22-K24 PolarHBondContact O-N 3.21Å; S22-K24 VanDerWaalsContact O-N 3.12Å; S22-K24 WeakPolarHBondContact OG-CD 3.34Å; S22-K24 WeakPolarHBondContact OG-CE 3.31Å; S22-K24 VanDerWaalsContact OG-CG 3.29Å; S22-K24 WeakPolarHBondContact OG-CG 3.34Å
23K95.3Very high92Very high136 Ų13665.3 Ų65.359%0.59136%0.356SS*.THydrogen-bonded Turntrans5231.3179.1-60.7-59.6-175.8-1530113.9Y18 D19 D20Y18-K23 HydrophobicContact CE1-CD 4.46Å; Y18-K23 WeakPolarHBondContact OH-CA 3.37Å; Y18-K23 PolarHBondContact OH-O 3.07Å; D19-K23 VanDerWaalsContact O-CA 3.31Å; D19-K23 WeakPolarHBondContact O-CA 3.5Å; D19-K23 PolarHBondContact O-N 3.21Å; D20-K23 VanDerWaalsContact O-CD 3.31Å; D20-K23 WeakPolarHBondContact O-CD 3.37Å; D20-K23 WeakPolarHBondContact O-CE 3.42Å; D20-K23 PolarHBondContact O-NZ 2.81Å
24K95.4Very high91.7Very high117 Ų11766.6 Ų66.651%0.50937%0.37SS..EExtended strand (participates in β ladder)trans-132.2153.1-174.980.3-160.7179.4-177.80111.5D19 S22 V26D19-K24 PolarHBondContact N-O 2.86Å; D19-K24 PolarHBondContact O-N 2.96Å; S22-K24 PolarHBondContact O-N 3.21Å; S22-K24 VanDerWaalsContact O-N 3.12Å; S22-K24 WeakPolarHBondContact OG-CD 3.34Å; S22-K24 WeakPolarHBondContact OG-CE 3.31Å; S22-K24 VanDerWaalsContact OG-CG 3.29Å; S22-K24 WeakPolarHBondContact OG-CG 3.34Å; K24-V26 HydrophobicContact CD-CG1 4.22Å; K24-V26 HydrophobicContact CG-CG1 3.68Å; K24-V26 PolarHBondContact O-N 3.45Å
25W95.4Very high91.6Very high78 Ų7870.5 Ų70.530%0.29538%0.384SS..EExtended strand (participates in β ladder)trans-73.5124.8168.1-6999.4000109.4M16 Y18 F80 Q82 V89M16-W25 HydrophobicContact CB-CE3 3.83Å; M16-W25 HydrophobicContact CB-CZ3 4.48Å; M16-W25 HydrophobicContact CE-CB 4.02Å; Y18-W25 AromaticContact CD2-CD2 3.93Å; Y18-W25 HydrophobicContact CD2-CD2 3.93Å; Y18-W25 AromaticContact CD2-CE2 3.76Å; Y18-W25 HydrophobicContact CD2-CE3 4.45Å; Y18-W25 HydrophobicContact CD2-CG 4.19Å; Y18-W25 HydrophobicContact CD2-CZ2 4.17Å; Y18-W25 AromaticContact CD2-NE1 3.9Å; W25-F80 HydrophobicContact CD2-CE1 4.43Å; W25-F80 AromaticContact CD2-CZ 3.73Å; W25-F80 HydrophobicContact CD2-CZ 3.73Å; W25-F80 AromaticContact CE2-CE1 3.78Å; W25-F80 AromaticContact CE2-CZ 3.54Å; W25-F80 AromaticContact CE3-CZ 3.98Å; W25-F80 HydrophobicContact CE3-CZ 3.98Å; W25-F80 HydrophobicContact CG-CZ 4.37Å; W25-F80 HydrophobicContact CH2-CE1 4.19Å; W25-F80 AromaticContact CH2-CZ 3.83Å; W25-F80 HydrophobicContact CH2-CZ 3.83Å; W25-F80 AromaticContact CZ2-CE1 3.66Å; W25-F80 HydrophobicContact CZ2-CE1 3.66Å; W25-F80 AromaticContact CZ2-CZ 3.61Å; W25-F80 HydrophobicContact CZ2-CZ 3.61Å; W25-F80 HydrophobicContact CZ3-CZ 4.02Å; W25-Q82 HydrophobicContact CH2-CB 4Å; W25-Q82 HydrophobicContact CZ2-CB 4.5Å; W25-Q82 VanDerWaalsContact CZ2-OE1 3.25Å; W25-V89 HydrophobicContact CH2-CB 4.5Å; W25-V89 HydrophobicContact CH2-CG1 3.8Å
26V95.2Very high91.6Very high37 Ų3770.4 Ų70.422%0.22438%0.384CS..EExtended strand (participates in β ladder)trans-118.6148.5175-60.80000109.8M16 V17 D19 K24M16-V26 CarbonylContact C-O 3.57Å; M16-V26 WeakPolarHBondContact CA-O 3.45Å; V17-V26 HydrophobicContact CG2-CG2 3.61Å; V17-V26 PolarHBondContact N-O 3.26Å; V17-V26 WeakPolarHBondContact O-CG2 3.38Å; V17-V26 PolarHBondContact O-N 3.34Å; D19-V26 HydrophobicContact CB-CG1 4.42Å; D19-V26 HydrophobicContact CB-CG2 4.19Å; K24-V26 HydrophobicContact CD-CG1 4.22Å; K24-V26 HydrophobicContact CG-CG1 3.68Å; K24-V26 PolarHBondContact O-N 3.45Å
27P94Very high91.7Very high26 Ų2674.7 Ų74.717%0.16940%0.398CS..EExtended strand (participates in β ladder)trans-57.2143.2171.2-21.132.5000110.3M16 K29 Q33M16-P27 HydrophobicContact CE-CG 4.33Å; M16-P27 HydrophobicContact SD-CB 4.45Å; M16-P27 HydrophobicContact SD-CG 4.39Å; P27-K29 PolarHBondContact O-N 3.01Å; P27-Q33 HydrophobicContact CB-CG 4.33Å; P27-Q33 HydrophobicContact CG-CG 3.61Å
28I91Very high91.8Very high48 Ų4873.8 Ų73.825%0.24639%0.393CS..SBendtrans-58-26.2-177.5-168156.5000113.6V15 V17 V62 I63 Y90V15-I28 HydrophobicContact CB-CG2 4.05Å; V15-I28 HydrophobicContact CG1-CB 4.16Å; V15-I28 HydrophobicContact CG1-CD1 3.9Å; V15-I28 HydrophobicContact CG1-CG2 4.07Å; V15-I28 PolarHBondContact O-N 3.07Å; V17-I28 HydrophobicContact CG1-CB 4.14Å; V17-I28 HydrophobicContact CG1-CD1 3.97Å; V17-I28 HydrophobicContact CG1-CG1 3.87Å; I28-V62 VanDerWaalsContact CD1-O 3.27Å; I28-V62 WeakPolarHBondContact CD1-O 3.48Å; I28-V62 HydrophobicContact CG2-CB 3.96Å; I28-I63 HydrophobicContact CD1-CB 4.29Å; I28-Y90 HydrophobicContact CD1-CD1 4.48Å; I28-Y90 HydrophobicContact CD1-CE1 4.19Å
29K84.9Confident91.9Very high65 Ų6571.4 Ų71.428%0.28338%0.384SS..SBendtrans-124.1127.8170.1-68.7-176.2-172.5174.60109.9P27 Q32 V61P27-K29 PolarHBondContact O-N 3.01Å; K29-Q32 HydrophobicContact CB-CB 3.89Å; K29-Q32 HydrophobicContact CB-CG 4.49Å; K29-Q32 PolarHBondContact O-N 3.23Å; K29-V61 PolarHBondContact NZ-O 2.83Å
30P82.4Confident92Very high125 Ų12568.9 Ų68.981%0.81237%0.37SS*.THydrogen-bonded Turntrans-62.1142177.825.6-32.7000110.8Q32P30-Q32 PolarHBondContact O-N 2.92Å
31G79.7Confident92.2Very high83 Ų8368.2 Ų68.286%0.85636%0.363SS*.THydrogen-bonded Turntrans74-1.1-177.900000115.2
32Q74.4Confident92.2Very high75 Ų7563.3 Ų63.335%0.3533%0.331SS..  trans-120.865.7-170.1-82.2-66.5-17.600110.7K29 P30 K55K29-Q32 HydrophobicContact CB-CB 3.89Å; K29-Q32 HydrophobicContact CB-CG 4.49Å; K29-Q32 PolarHBondContact O-N 3.23Å; P30-Q32 PolarHBondContact O-N 2.92Å; Q32-K55 VanDerWaalsContact C-NZ 3.26Å; Q32-K55 PolarHBondContact O-NZ 3.1Å
33Q84.1Confident92.2Very high144 Ų14462.8 Ų62.867%0.67332%0.324SS*.  trans-83.5143.8173.9-69.4-173.4-16.700111.7P27P27-Q33 HydrophobicContact CB-CG 4.33Å; P27-Q33 HydrophobicContact CG-CG 3.61Å
34G91.8Very high92Very high27 Ų2760.4 Ų60.428%0.27832%0.321SS..SBendtrans147.3171.4174.800000113.6
35F95.7Very high91.7Very high101 Ų10158.8 Ų58.844%0.44333%0.33SS..  trans-74.2139.7178.8-68.8-68.9000111.9L56 A95F35-L56 HydrophobicContact CB-CD1 3.86Å; F35-L56 PolarHBondContact O-N 3.27Å; F35-A95 HydrophobicContact CD1-CB 3.98Å; F35-A95 HydrophobicContact CE1-CB 3.53Å; F35-A95 HydrophobicContact CZ-CB 3.87Å
36S97.2Very high91.4Very high3 Ų357.9 Ų57.92%0.02134%0.335CS..EExtended strand (participates in β ladder)trans-116.2145.6170.7-56.60000108.9R12 A13 I38 V54 V62R12-S36 WeakPolarHBondContact CA-O 3.13Å; A13-S36 PolarHBondContact N-O 2.83Å; A13-S36 PolarHBondContact O-N 2.8Å; S36-I38 PolarHBondContact O-N 3.04Å; S36-V54 CarbonylContact C-O 3.58Å; S36-V54 VanDerWaalsContact CA-O 3.25Å; S36-V54 WeakPolarHBondContact CA-O 3.33Å; S36-V54 WeakPolarHBondContact CB-O 3.2Å; S36-V62 WeakPolarHBondContact OG-CG2 3.36Å
37R97.6Very high91.2Very high120 Ų12058.2 Ų58.245%0.45334%0.336SS..EExtended strand (participates in β ladder)trans-77.1112.6166.1-177.7-179.3-73.6157.51.1107.8Q10 G53 V54 L56Q10-R37 HydrophobicContact CG-CG 3.94Å; R37-G53 WeakPolarHBondContact O-CA 3.46Å; R37-V54 PolarHBondContact N-O 3Å; R37-V54 PolarHBondContact O-N 3.18Å; R37-L56 HydrophobicContact CB-CD2 3.97Å
38I98.2Very high91.2Very high0 Ų060.3 Ų60.30%035%0.348CS..EExtended strand (participates in β ladder)trans-97.9125.2177.8-46.9-54.7000108.2Q10 A11 A13 V15 S36 V51 V52 L92 F103Q10-I38 CarbonylContact C-O 3.46Å; Q10-I38 WeakPolarHBondContact CA-O 3.39Å; A11-I38 PolarHBondContact N-O 2.94Å; A11-I38 PolarHBondContact O-N 2.99Å; A13-I38 HydrophobicContact CB-CG1 3.89Å; V15-I38 HydrophobicContact CG2-CD1 3.62Å; S36-I38 PolarHBondContact O-N 3.04Å; I38-V51 HydrophobicContact CG2-CG1 3.6Å; I38-V52 WeakPolarHBondContact CA-O 3.38Å; I38-L92 HydrophobicContact CD1-CD2 4.27Å; I38-L92 HydrophobicContact CG1-CD2 4.35Å; I38-L92 HydrophobicContact CG2-CD1 4.21Å; I38-F103 HydrophobicContact CB-CE2 4.47Å; I38-F103 HydrophobicContact CG2-CD2 4.19Å; I38-F103 HydrophobicContact CG2-CE2 3.51Å; I38-F103 HydrophobicContact CG2-CZ 4.25Å
39N97.8Very high91.4Very high10 Ų1058.1 Ų58.15%0.05334%0.337CS..EExtended strand (participates in β ladder)trans-119.6146.1171.4-61.2-68.6000109.7C9 Q10 Y41 V52C9-N39 VanDerWaalsContact O-CA 3.29Å; C9-N39 WeakPolarHBondContact O-CA 3.18Å; C9-N39 PolarHBondContact O-OD1 3.33Å; Q10-N39 WeakPolarHBondContact CB-OD1 3.36Å; Q10-N39 WeakPolarHBondContact CG-OD1 3.27Å; Q10-N39 PolarHBondContact NE2-OD1 2.97Å; Q10-N39 VanDerWaalsContact NE2-OD1 3.08Å; N39-Y41 HydrophobicContact CB-CD2 4.12Å; N39-Y41 HydrophobicContact CB-CE2 3.6Å; N39-V52 PolarHBondContact N-O 3.42Å; N39-V52 PolarHBondContact O-N 3.27Å
40I97.8Very high92Very high0 Ų058.3 Ų58.30%034%0.336CS..EExtended strand (participates in β ladder)trans-100.8120.9162.5-59176.9000106.8S7 I8 C9 F49 R50 V51 I67 F103 A106 M107S7-I40 WeakPolarHBondContact CA-O 3.46Å; I8-I40 HydrophobicContact CD1-CB 4.2Å; I8-I40 HydrophobicContact CD1-CG2 3.73Å; I8-I40 HydrophobicContact CG1-CB 3.81Å; I8-I40 HydrophobicContact CG1-CG2 3.77Å; I8-I40 WeakPolarHBondContact CG1-O 3.27Å; I8-I40 PolarHBondContact N-O 3.47Å; C9-I40 PolarHBondContact O-N 3.35Å; C9-I40 VanDerWaalsContact SG-CD1 3.56Å; C9-I40 WeakPolarHBondContact SG-CG1 3.46Å; I40-F49 HydrophobicContact CG2-CD1 4.34Å; I40-R50 CarbonylContact C-O 3.59Å; I40-R50 WeakPolarHBondContact CA-O 3.39Å; I40-V51 HydrophobicContact CG1-CG2 4.31Å; I40-I67 HydrophobicContact CG2-CD1 4.18Å; I40-F103 HydrophobicContact CD1-CD2 4.13Å; I40-F103 HydrophobicContact CD1-CE2 3.71Å; I40-F103 HydrophobicContact CD1-CZ 3.94Å; I40-F103 HydrophobicContact CG1-CD2 4.28Å; I40-F103 HydrophobicContact CG1-CE2 3.65Å; I40-F103 HydrophobicContact CG1-CZ 4.16Å; I40-A106 HydrophobicContact CD1-CB 4.05Å; I40-M107 HydrophobicContact CD1-CB 4.17Å; I40-M107 HydrophobicContact CD1-SD 3.98Å
41Y97.3Very high92.7Very high60 Ų6052.3 Ų52.324%0.23530%0.297CS..EExtended strand (participates in β ladder)trans-99.7137174.3-69.4-84.9000110.2E5 Q6 N39 F49 R50 V52E5-Y41 HydrophobicContact CB-CD1 4.43Å; Q6-Y41 CarbonylContact O-C 3.55Å; Q6-Y41 WeakPolarHBondContact O-CA 3.03Å; N39-Y41 HydrophobicContact CB-CD2 4.12Å; N39-Y41 HydrophobicContact CB-CE2 3.6Å; Y41-F49 CarbonylContact O-C 3.6Å; Y41-F49 VanDerWaalsContact O-CA 3.28Å; Y41-F49 WeakPolarHBondContact O-CA 3.31Å; Y41-R50 PolarHBondContact N-O 3.23Å; Y41-R50 PolarHBondContact O-N 2.94Å; Y41-V52 HydrophobicContact CD2-CB 3.97Å; Y41-V52 HydrophobicContact CD2-CG2 3.75Å; Y41-V52 HydrophobicContact CE2-CB 3.86Å; Y41-V52 HydrophobicContact CE2-CG1 4.46Å; Y41-V52 HydrophobicContact CE2-CG2 4.07Å
42H95.9Very high93.6Very high29 Ų2949 Ų4913%0.13426%0.26CS..EExtended strand (participates in β ladder)trans-107.3124.6169.8179.7-147.9000108.9E5 Q6 I8 N47 F49E5-H42 WeakPolarHBondContact CA-O 3.33Å; Q6-H42 PolarHBondContact N-O 3.39Å; Q6-H42 PolarHBondContact O-N 3.23Å; I8-H42 HydrophobicContact CG2-CB 3.79Å; H42-N47 PolarHBondContact NE2-OD1 3.05Å; H42-F49 HydrophobicContact CB-CD1 3.75Å; H42-F49 HydrophobicContact CB-CE1 3.55Å; H42-F49 HydrophobicContact CB-CZ 4.37Å; H42-F49 AromaticContact CD2-CD1 3.83Å; H42-F49 AromaticContact CD2-CE1 3.36Å; H42-F49 WeakPolarHBondContact CD2-CE1 3.41Å; H42-F49 AromaticContact CD2-CE2 3.71Å; H42-F49 AromaticContact CD2-CZ 3.28Å; H42-F49 WeakPolarHBondContact CD2-CZ 3.14Å; H42-F49 AromaticContact CG-CD1 4Å; H42-F49 AromaticContact CG-CE1 3.43Å; H42-F49 VanDerWaalsContact CG-CE1 3.43Å; H42-F49 AromaticContact CG-CZ 3.76Å; H42-F49 AromaticContact NE2-CE2 3.93Å; H42-F49 AromaticContact NE2-CZ 3.53Å
43N94.7Very high94.7Very high35 Ų3545.4 Ų45.419%0.18724%0.243CC..EExtended strand (participates in β ladder)trans-93.3110.6167.6-175.1-32.9000108.2S4 E5 A45 S46 N47 T48S4-N43 WeakPolarHBondContact O-CA 3.4Å; E5-N43 HydrophobicContact CG-CB 4.44Å; N43-A45 VanDerWaalsContact C-N 3.32Å; N43-A45 PolarHBondContact O-N 2.94Å; N43-A45 WeakPolarHBondContact OD1-CB 3.34Å; N43-A45 PolarHBondContact OD1-N 2.8Å; N43-S46 WeakPolarHBondContact CB-OG 3.39Å; N43-S46 PolarHBondContact ND2-OG 2.81Å; N43-S46 PolarHBondContact OD1-N 3.29Å; N43-S46 PolarHBondContact OD1-OG 2.79Å; N43-N47 CarbonylContact O-C 3.58Å; N43-N47 WeakPolarHBondContact O-CA 3.41Å; N43-N47 PolarHBondContact O-N 2.82Å; N43-T48 PolarHBondContact N-O 2.88Å; N43-T48 PolarHBondContact O-N 2.8Å
44T90.8Very high95.2Very high86 Ų8640.4 Ų40.453%0.52822%0.222SC..THydrogen-bonded Turntrans-73.2-24-176.953.50000113S4S4-T44 PolarHBondContact O-N 3.44Å
45A90.1Very high95.4Very high83 Ų8339.5 Ų39.569%0.68621%0.211SC*.THydrogen-bonded Turntrans-74.5-42.3179.800000112N43N43-A45 VanDerWaalsContact C-N 3.32Å; N43-A45 PolarHBondContact O-N 2.94Å; N43-A45 WeakPolarHBondContact OD1-CB 3.34Å; N43-A45 PolarHBondContact OD1-N 2.8Å
46S89.3Confident95.3Very high59 Ų5938.4 Ų38.441%0.41321%0.209SC..THydrogen-bonded Turntrans-96.7-6.8176.555.40000113.6N43 T48N43-S46 WeakPolarHBondContact CB-OG 3.39Å; N43-S46 PolarHBondContact ND2-OG 2.81Å; N43-S46 PolarHBondContact OD1-N 3.29Å; N43-S46 PolarHBondContact OD1-OG 2.79Å; S46-T48 PolarHBondContact O-N 3.38Å; S46-T48 PolarHBondContact OG-OG1 3.43Å
47N90.7Very high94.9Very high43 Ų4345.7 Ų45.723%0.2324%0.243CC..THydrogen-bonded Turntrans50.138.9-170.7-160.620000113.5H42 N43H42-N47 PolarHBondContact NE2-OD1 3.05Å; N43-N47 CarbonylContact O-C 3.58Å; N43-N47 WeakPolarHBondContact O-CA 3.41Å; N43-N47 PolarHBondContact O-N 2.82Å
48T93.4Very high94.6Very high70 Ų7043.5 Ų43.543%0.42924%0.24SC..EExtended strand (participates in β ladder)trans-106.8148.218055.50000110.9N43 S46N43-T48 PolarHBondContact N-O 2.88Å; N43-T48 PolarHBondContact O-N 2.8Å; S46-T48 PolarHBondContact O-N 3.38Å; S46-T48 PolarHBondContact OG-OG1 3.43Å
49F96.6Very high94.4Very high3 Ų351.2 Ų51.21%0.01328%0.276CS..EExtended strand (participates in β ladder)trans-114.9146.2176.3-61.5-97.2000111.3I8 I40 Y41 H42 I67 A110 I113 M114I8-F49 HydrophobicContact CD1-CD1 4Å; I8-F49 HydrophobicContact CD1-CE1 3.93Å; I40-F49 HydrophobicContact CG2-CD1 4.34Å; Y41-F49 CarbonylContact O-C 3.6Å; Y41-F49 VanDerWaalsContact O-CA 3.28Å; Y41-F49 WeakPolarHBondContact O-CA 3.31Å; H42-F49 HydrophobicContact CB-CD1 3.75Å; H42-F49 HydrophobicContact CB-CE1 3.55Å; H42-F49 HydrophobicContact CB-CZ 4.37Å; H42-F49 AromaticContact CD2-CD1 3.83Å; H42-F49 AromaticContact CD2-CE1 3.36Å; H42-F49 WeakPolarHBondContact CD2-CE1 3.41Å; H42-F49 AromaticContact CD2-CE2 3.71Å; H42-F49 AromaticContact CD2-CZ 3.28Å; H42-F49 WeakPolarHBondContact CD2-CZ 3.14Å; H42-F49 AromaticContact CG-CD1 4Å; H42-F49 AromaticContact CG-CE1 3.43Å; H42-F49 VanDerWaalsContact CG-CE1 3.43Å; H42-F49 AromaticContact CG-CZ 3.76Å; H42-F49 AromaticContact NE2-CE2 3.93Å; H42-F49 AromaticContact NE2-CZ 3.53Å; F49-I67 HydrophobicContact CB-CB 4.21Å; F49-I67 HydrophobicContact CB-CD1 3.83Å; F49-I67 HydrophobicContact CB-CG1 4.36Å; F49-I67 PolarHBondContact O-N 2.81Å; F49-A110 HydrophobicContact CB-CB 4.05Å; F49-A110 HydrophobicContact CD1-CB 3.57Å; F49-A110 HydrophobicContact CD2-CB 3.94Å; F49-A110 HydrophobicContact CE1-CB 3.91Å; F49-A110 HydrophobicContact CE2-CB 4.27Å; F49-A110 HydrophobicContact CG-CB 3.58Å; F49-A110 HydrophobicContact CZ-CB 4.25Å; F49-I113 HydrophobicContact CE2-CB 4.09Å; F49-I113 HydrophobicContact CE2-CG2 3.91Å; F49-I113 HydrophobicContact CZ-CB 4.21Å; F49-I113 HydrophobicContact CZ-CD1 3.93Å; F49-I113 HydrophobicContact CZ-CG2 4.15Å; F49-M114 HydrophobicContact CB-SD 4.4Å; F49-M114 HydrophobicContact CD2-CG 3.68Å; F49-M114 HydrophobicContact CD2-SD 3.83Å; F49-M114 HydrophobicContact CE2-CG 4Å
50R96.8Very high94.2Very high68 Ų6854.3 Ų54.326%0.25729%0.29SS..EExtended strand (participates in β ladder)trans-140.5141.4176.564.6-179.1-165.5165.36.1111.8E5 I40 Y41 V52 Y65E5-R50 VanDerWaalsContact CD-CZ 3.46Å; E5-R50 IonicContact OE1-CZ 3.18Å; E5-R50 IonicContact OE1-NE 3.2Å; E5-R50 PolarHBondContact OE1-NE 3.34Å; E5-R50 IonicContact OE1-NH1 3.28Å; E5-R50 PolarHBondContact OE1-NH1 2.72Å; E5-R50 IonicContact OE1-NH2 3.18Å; E5-R50 PolarHBondContact OE1-NH2 3.36Å; E5-R50 IonicContact OE2-CZ 3.44Å; E5-R50 VanDerWaalsContact OE2-CZ 3.28Å; E5-R50 IonicContact OE2-NE 3.81Å; E5-R50 IonicContact OE2-NH2 2.6Å; E5-R50 PolarHBondContact OE2-NH2 3.37Å; I40-R50 CarbonylContact C-O 3.59Å; I40-R50 WeakPolarHBondContact CA-O 3.39Å; Y41-R50 PolarHBondContact N-O 3.23Å; Y41-R50 PolarHBondContact O-N 2.94Å; R50-V52 HydrophobicContact CG-CG2 4.08Å; R50-Y65 CarbonylContact C-O 3.58Å; R50-Y65 VanDerWaalsContact CA-O 3.23Å; R50-Y65 WeakPolarHBondContact CA-O 2.96Å
51V97.7Very high94.1Very high0 Ų058 Ų580%031%0.312CS..EExtended strand (participates in β ladder)trans-93.6120.7171-173.40000108I38 I40 N64 Y65 I67 W83 F103 M107I38-V51 HydrophobicContact CG2-CG1 3.6Å; I40-V51 HydrophobicContact CG1-CG2 4.31Å; V51-N64 WeakPolarHBondContact O-CA 3.25Å; V51-Y65 PolarHBondContact N-O 2.91Å; V51-Y65 PolarHBondContact O-N 2.9Å; V51-I67 HydrophobicContact CG2-CD1 3.81Å; V51-I67 HydrophobicContact CG2-CG1 3.88Å; V51-W83 HydrophobicContact CG1-CH2 4.49Å; V51-F103 HydrophobicContact CG1-CE2 4.25Å; V51-F103 HydrophobicContact CG1-CZ 4.1Å; V51-F103 HydrophobicContact CG2-CZ 4.37Å; V51-M107 HydrophobicContact CG2-SD 4.27Å
52V97.4Very high93.9Very high13 Ų1355.6 Ų55.68%0.07930%0.304CS..EExtended strand (participates in β ladder)trans-121.3123.7176.6-178.70000108.8I38 N39 Y41 R50 V54 V61 I63I38-V52 WeakPolarHBondContact CA-O 3.38Å; N39-V52 PolarHBondContact N-O 3.42Å; N39-V52 PolarHBondContact O-N 3.27Å; Y41-V52 HydrophobicContact CD2-CB 3.97Å; Y41-V52 HydrophobicContact CD2-CG2 3.75Å; Y41-V52 HydrophobicContact CE2-CB 3.86Å; Y41-V52 HydrophobicContact CE2-CG1 4.46Å; Y41-V52 HydrophobicContact CE2-CG2 4.07Å; R50-V52 HydrophobicContact CG-CG2 4.08Å; V52-V54 HydrophobicContact CG1-CG2 4.2Å; V52-V61 HydrophobicContact CG1-CG1 4.38Å; V52-I63 WeakPolarHBondContact CA-O 3.41Å
53G97.2Very high93.9Very high0 Ų054.6 Ų54.60%030%0.3CS..EExtended strand (participates in β ladder)trans-113.5124.6175.800000110.8R37 V61 V62 I63R37-G53 WeakPolarHBondContact O-CA 3.46Å; G53-V61 WeakPolarHBondContact O-CA 3.23Å; G53-V62 VanDerWaalsContact O-CG2 3.27Å; G53-V62 WeakPolarHBondContact O-CG2 3.4Å; G53-V62 PolarHBondContact O-N 3.38Å; G53-I63 VanDerWaalsContact N-CG2 3.35Å; G53-I63 PolarHBondContact N-O 2.85Å; G53-I63 PolarHBondContact O-N 3.48Å
54V96.4Very high94Very high38 Ų3857.7 Ų57.723%0.2332%0.316CS..EExtended strand (participates in β ladder)trans-117125.4178.6-176.10000108.8S36 R37 V52 Q59 Q60 V61S36-V54 CarbonylContact C-O 3.58Å; S36-V54 VanDerWaalsContact CA-O 3.25Å; S36-V54 WeakPolarHBondContact CA-O 3.33Å; S36-V54 WeakPolarHBondContact CB-O 3.2Å; R37-V54 PolarHBondContact N-O 3Å; R37-V54 PolarHBondContact O-N 3.18Å; V52-V54 HydrophobicContact CG1-CG2 4.2Å; V54-Q59 VanDerWaalsContact CG1-C 3.41Å; V54-Q59 HydrophobicContact CG1-CB 4.22Å; V54-Q59 VanDerWaalsContact CG1-O 3.27Å; V54-Q59 WeakPolarHBondContact CG1-O 3.27Å; V54-Q60 CarbonylContact C-O 3.44Å; V54-Q60 WeakPolarHBondContact CA-O 2.96Å; V54-V61 HydrophobicContact CG2-CG2 4.3Å
55K94.3Very high94.3Very high8 Ų854.3 Ų54.34%0.03529%0.294CS..EExtended strand (participates in β ladder)trans-61140.9177.3-96.4170.2175.1-91.30111.2Q32 Q57 D58 Q59 Q60 V62Q32-K55 VanDerWaalsContact C-NZ 3.26Å; Q32-K55 PolarHBondContact O-NZ 3.1Å; K55-Q57 VanDerWaalsContact C-N 3.34Å; K55-D58 WeakPolarHBondContact CB-OD1 3.35Å; K55-D58 WeakPolarHBondContact CD-OD1 3.19Å; K55-Q59 WeakPolarHBondContact O-CA 3.41Å; K55-Q59 PolarHBondContact O-N 2.85Å; K55-Q59 VanDerWaalsContact O-N 3.15Å; K55-Q60 PolarHBondContact N-O 3.15Å; K55-V62 HydrophobicContact CB-CG1 4.44Å; K55-V62 HydrophobicContact CD-CG1 3.5Å; K55-V62 HydrophobicContact CG-CG1 3.6Å
56L93.5Very high94.5Very high78 Ų7854.1 Ų54.141%0.40829%0.288SS..THydrogen-bonded Turntrans-73.9-25.6179.9-67.8174.4000113.3F35 R37F35-L56 HydrophobicContact CB-CD1 3.86Å; F35-L56 PolarHBondContact O-N 3.27Å; R37-L56 HydrophobicContact CB-CD2 3.97Å
57Q90.6Very high94.8Very high157 Ų15751.7 Ų51.773%0.73427%0.27SS*.THydrogen-bonded Turntrans-80.7-49.1-174.3-71.1174.6-13.700113.1K55K55-Q57 VanDerWaalsContact C-N 3.34Å
58D91Very high95Very high73 Ų7353 Ų5339%0.3928%0.279SS..THydrogen-bonded Turntrans-117.23.2-171.461-8000112.9K55 Q60K55-D58 WeakPolarHBondContact CB-OD1 3.35Å; K55-D58 WeakPolarHBondContact CD-OD1 3.19Å; D58-Q60 VanDerWaalsContact CG-CB 3.49Å; D58-Q60 PolarHBondContact O-N 2.85Å; D58-Q60 VanDerWaalsContact O-N 3.1Å; D58-Q60 WeakPolarHBondContact OD1-CB 3.21Å; D58-Q60 PolarHBondContact OD1-N 3.14Å; D58-Q60 VanDerWaalsContact OD1-N 3.14Å; D58-Q60 WeakPolarHBondContact OD2-CB 3.48Å
59Q93.3Very high94.9Very high163 Ų16353.8 Ų53.876%0.76228%0.277SS*.  trans54.425.1-174.4-62.1-176.273.900113.7V54 K55V54-Q59 VanDerWaalsContact CG1-C 3.41Å; V54-Q59 HydrophobicContact CG1-CB 4.22Å; V54-Q59 VanDerWaalsContact CG1-O 3.27Å; V54-Q59 WeakPolarHBondContact CG1-O 3.27Å; K55-Q59 WeakPolarHBondContact O-CA 3.41Å; K55-Q59 PolarHBondContact O-N 2.85Å; K55-Q59 VanDerWaalsContact O-N 3.15Å
60Q93.5Very high94.6Very high75 Ų7556.4 Ų56.435%0.3531%0.305SS..  trans-78.9135.2179.6-170-172.86800111.1V54 K55 D58 V62V54-Q60 CarbonylContact C-O 3.44Å; V54-Q60 WeakPolarHBondContact CA-O 2.96Å; K55-Q60 PolarHBondContact N-O 3.15Å; D58-Q60 VanDerWaalsContact CG-CB 3.49Å; D58-Q60 PolarHBondContact O-N 2.85Å; D58-Q60 VanDerWaalsContact O-N 3.1Å; D58-Q60 WeakPolarHBondContact OD1-CB 3.21Å; D58-Q60 PolarHBondContact OD1-N 3.14Å; D58-Q60 VanDerWaalsContact OD1-N 3.14Å; D58-Q60 WeakPolarHBondContact OD2-CB 3.48Å; Q60-V62 PolarHBondContact O-N 2.77Å
61V94.8Very high94.5Very high76 Ų7653.9 Ų53.946%0.46130%0.296SS..EExtended strand (participates in β ladder)trans-68.4119.2169.2-176.30000109.2K29 V52 G53 V54 N64K29-V61 PolarHBondContact NZ-O 2.83Å; V52-V61 HydrophobicContact CG1-CG1 4.38Å; G53-V61 WeakPolarHBondContact O-CA 3.23Å; V54-V61 HydrophobicContact CG2-CG2 4.3Å; V61-N64 HydrophobicContact CG1-CB 4.24Å
62V94.6Very high94.4Very high10 Ų1062 Ų626%0.06133%0.332CS..EExtended strand (participates in β ladder)trans-104.5-24.7179.3-70.10000113V15 I28 S36 G53 K55 Q60V15-V62 HydrophobicContact CB-CG2 4.45Å; V15-V62 HydrophobicContact CG2-CG2 3.9Å; I28-V62 VanDerWaalsContact CD1-O 3.27Å; I28-V62 WeakPolarHBondContact CD1-O 3.48Å; I28-V62 HydrophobicContact CG2-CB 3.96Å; S36-V62 WeakPolarHBondContact OG-CG2 3.36Å; G53-V62 VanDerWaalsContact O-CG2 3.27Å; G53-V62 WeakPolarHBondContact O-CG2 3.4Å; G53-V62 PolarHBondContact O-N 3.38Å; K55-V62 HydrophobicContact CB-CG1 4.44Å; K55-V62 HydrophobicContact CD-CG1 3.5Å; K55-V62 HydrophobicContact CG-CG1 3.6Å; Q60-V62 PolarHBondContact O-N 2.77Å
63I95.4Very high94.3Very high9 Ų962.9 Ų62.95%0.04633%0.334CS..EExtended strand (participates in β ladder)trans-144.9135.9173.8-172.9168.7000109.2V15 I28 V52 G53 W83 Y90V15-I63 HydrophobicContact CG1-CB 4.18Å; V15-I63 HydrophobicContact CG1-CD1 4.11Å; V15-I63 HydrophobicContact CG1-CG2 4.19Å; V15-I63 HydrophobicContact CG2-CG2 4.02Å; I28-I63 HydrophobicContact CD1-CB 4.29Å; V52-I63 WeakPolarHBondContact CA-O 3.41Å; G53-I63 VanDerWaalsContact N-CG2 3.35Å; G53-I63 PolarHBondContact N-O 2.85Å; G53-I63 PolarHBondContact O-N 3.48Å; I63-W83 HydrophobicContact CD1-CZ2 3.96Å; I63-Y90 HydrophobicContact CD1-CD1 3.79Å; I63-Y90 HydrophobicContact CD1-CE1 4.13Å; I63-Y90 HydrophobicContact CD1-CG 4.36Å
64N96.2Very high94.4Very high99 Ų9966.9 Ų66.953%0.52936%0.355SS..EExtended strand (participates in β ladder)trans-137.690.1169.2-176.11.2000106.8V51 V61V51-N64 WeakPolarHBondContact O-CA 3.25Å; V61-N64 HydrophobicContact CG1-CB 4.24Å
65Y96.6Very high94.4Very high16 Ų1669.7 Ų69.76%0.06337%0.366CS..EExtended strand (participates in β ladder)trans-112120.5-171.9-179.9-100.8000110.4R50 V51 I67 L71 W83 D85 Y90R50-Y65 CarbonylContact C-O 3.58Å; R50-Y65 VanDerWaalsContact CA-O 3.23Å; R50-Y65 WeakPolarHBondContact CA-O 2.96Å; V51-Y65 PolarHBondContact N-O 2.91Å; V51-Y65 PolarHBondContact O-N 2.9Å; Y65-I67 HydrophobicContact CD1-CG1 4.47Å; Y65-I67 PolarHBondContact O-N 3.23Å; Y65-L71 HydrophobicContact CE1-CD1 3.75Å; Y65-L71 WeakPolarHBondContact OH-CD1 3.34Å; Y65-W83 AromaticContact CD1-NE1 3.69Å; Y65-W83 AromaticContact CE1-NE1 3.6Å; Y65-W83 AromaticContact CZ-NE1 3.95Å; Y65-D85 HydrophobicContact CE2-CB 4.26Å; Y65-Y90 HydrophobicContact CD2-CE2 4.06Å; Y65-Y90 HydrophobicContact CE2-CE2 4.16Å
66S96Very high94.5Very high79 Ų7971.6 Ų71.655%0.55238%0.383SS*.EExtended strand (participates in β ladder)trans-76.8119.7172-60.50000109.5V68S66-V68 PolarHBondContact O-N 2.75Å
67I95.3Very high94.7Very high7 Ų771 Ų714%0.03638%0.382CS..  trans-68.8128.3176.8-59176.2000107.4I40 F49 V51 Y65 L71 M107 A110 L111 M114I40-I67 HydrophobicContact CG2-CD1 4.18Å; F49-I67 HydrophobicContact CB-CB 4.21Å; F49-I67 HydrophobicContact CB-CD1 3.83Å; F49-I67 HydrophobicContact CB-CG1 4.36Å; F49-I67 PolarHBondContact O-N 2.81Å; V51-I67 HydrophobicContact CG2-CD1 3.81Å; V51-I67 HydrophobicContact CG2-CG1 3.88Å; Y65-I67 HydrophobicContact CD1-CG1 4.47Å; Y65-I67 PolarHBondContact O-N 3.23Å; I67-L71 HydrophobicContact CG2-CD2 4.43Å; I67-M107 HydrophobicContact CD1-CE 3.75Å; I67-M107 HydrophobicContact CD1-SD 3.55Å; I67-M107 VanDerWaalsContact CD1-SD 3.55Å; I67-M107 HydrophobicContact CG1-CE 3.95Å; I67-M107 HydrophobicContact CG1-SD 4.37Å; I67-M107 HydrophobicContact CG2-CE 4.15Å; I67-A110 HydrophobicContact CD1-CB 4.38Å; I67-L111 HydrophobicContact CG2-CD2 3.61Å; I67-M114 HydrophobicContact CB-SD 4.12Å; I67-M114 HydrophobicContact CG2-CE 4.42Å; I67-M114 HydrophobicContact CG2-SD 3.69Å; I67-M114 WeakPolarHBondContact O-CE 3.39Å
68V94.1Very high95.1Very high70 Ų7067.6 Ų67.642%0.42437%0.374SS..  trans-104.9154.3177.9-640000111.1S66 L71S66-V68 PolarHBondContact O-N 2.75Å; V68-L71 HydrophobicContact CG2-CB 4.3Å; V68-L71 HydrophobicContact CG2-CD1 4.23Å; V68-L71 WeakPolarHBondContact O-CB 3.33Å; V68-L71 PolarHBondContact O-N 2.97Å
69K91.8Very high95.4Very high87 Ų8766.4 Ų66.438%0.37837%0.37SS..THydrogen-bonded Turntrans-59.9143.1172.8-63-168.8-173.2-163.80109.8L71 M114 E118K69-L71 PolarHBondContact O-N 2.9Å; K69-M114 WeakPolarHBondContact CD-O 3.43Å; K69-M114 WeakPolarHBondContact CE-O 3.34Å; K69-M114 HydrophobicContact CG-CB 4.19Å; K69-M114 HydrophobicContact CG-CE 4.13Å; K69-M114 PolarHBondContact NZ-O 2.79Å; K69-E118 IonicContact NZ-OE2 2.72Å; K69-E118 PolarHBondContact NZ-OE2 3.03Å
70G90.3Very high95.7Very high59 Ų5960.1 Ų60.161%0.60834%0.34SS*.THydrogen-bonded Turntrans69.910.6-179.400000115.1K72G70-K72 PolarHBondContact O-N 3.42Å
71L94.6Very high95.9Very high14 Ų1456.6 Ų56.67%0.07332%0.324CS..  trans-54.7129.3170.2-176.597.5000110.2Y65 I67 V68 K69 Y73 W83 M107 L111Y65-L71 HydrophobicContact CE1-CD1 3.75Å; Y65-L71 WeakPolarHBondContact OH-CD1 3.34Å; I67-L71 HydrophobicContact CG2-CD2 4.43Å; V68-L71 HydrophobicContact CG2-CB 4.3Å; V68-L71 HydrophobicContact CG2-CD1 4.23Å; V68-L71 WeakPolarHBondContact O-CB 3.33Å; V68-L71 PolarHBondContact O-N 2.97Å; K69-L71 PolarHBondContact O-N 2.9Å; L71-Y73 PolarHBondContact O-N 2.79Å; L71-W83 HydrophobicContact CD1-CB 4.24Å; L71-W83 HydrophobicContact CD1-CG 4.22Å; L71-W83 HydrophobicContact CD2-CB 3.97Å; L71-W83 HydrophobicContact CD2-CG 4.13Å; L71-W83 HydrophobicContact CG-CB 4.14Å; L71-W83 HydrophobicContact CG-CG 4.5Å; L71-M107 HydrophobicContact CD2-CE 3.08Å; L71-L111 HydrophobicContact CB-CD2 3.78Å; L71-L111 HydrophobicContact CD2-CD2 4.27Å
72K94.5Very high96Very high171 Ų17155.3 Ų55.374%0.74331%0.312SS*.EExtended strand (participates in β ladder)trans-89.8100.3175.9-65.2-173.4177.8-178.70110.2G70 W83G70-K72 PolarHBondContact O-N 3.42Å; K72-W83 WeakPolarHBondContact O-CA 3.33Å; K72-W83 WeakPolarHBondContact O-CB 3.4Å
73Y97.3Very high96.2Very high32 Ų3254.9 Ų54.913%0.12531%0.31CS..EExtended strand (participates in β ladder)trans-86.8130.1171.8-175.9-107.1000110.8L71 Q75 H81 W83 F103 S104 M107 L108L71-Y73 PolarHBondContact O-N 2.79Å; Y73-Q75 HydrophobicContact CD1-CG 4.27Å; Y73-Q75 HydrophobicContact CE1-CG 3.56Å; Y73-H81 HydrophobicContact CE2-CB 3.93Å; Y73-H81 AromaticContact CZ-CG 3.99Å; Y73-H81 AromaticContact CZ-ND1 3.79Å; Y73-H81 WeakPolarHBondContact OH-CB 3.45Å; Y73-H81 VanDerWaalsContact OH-CG 3.27Å; Y73-H81 PolarHBondContact OH-ND1 3.48Å; Y73-W83 HydrophobicContact CD2-CE3 4.23Å; Y73-W83 HydrophobicContact CE2-CE3 4.27Å; Y73-F103 HydrophobicContact CE2-CD1 4.48Å; Y73-F103 HydrophobicContact CE2-CE1 4.12Å; Y73-S104 WeakPolarHBondContact OH-CA 3.39Å; Y73-S104 WeakPolarHBondContact OH-CB 3.45Å; Y73-M107 HydrophobicContact CD1-CG 4.49Å; Y73-M107 HydrophobicContact CD2-CE 4.47Å; Y73-M107 HydrophobicContact CD2-CG 3.74Å; Y73-M107 HydrophobicContact CE2-CB 4.38Å; Y73-M107 HydrophobicContact CE2-CG 3.91Å; Y73-M107 HydrophobicContact CG-CG 4.02Å; Y73-L108 HydrophobicContact CD1-CD2 4.27Å
74N97.7Very high96.2Very high84 Ų8460.8 Ų60.845%0.44933%0.331SS..EExtended strand (participates in β ladder)trans-129.3126.5-179.5-178.723.1000111.1A76 H81 Q82N74-A76 PolarHBondContact O-N 3.26Å; N74-H81 CarbonylContact O-C 3.56Å; N74-H81 WeakPolarHBondContact O-CA 3.43Å; N74-Q82 HydrophobicContact CB-CG 3.96Å; N74-Q82 PolarHBondContact N-O 3.33Å; N74-Q82 PolarHBondContact O-N 3.36Å
75Q97.8Very high95.9Very high96 Ų9659 Ų5945%0.44932%0.322SS..EExtended strand (participates in β ladder)trans-92.682.6174.7-62.5178.582.500108.7Y73 T77 S104Y73-Q75 HydrophobicContact CD1-CG 4.27Å; Y73-Q75 HydrophobicContact CE1-CG 3.56Å; Q75-T77 VanDerWaalsContact C-N 3.35Å; Q75-T77 PolarHBondContact O-N 3.28Å; Q75-S104 PolarHBondContact OE1-OG 2.89Å
76A96.7Very high95.3Very high49 Ų4962.3 Ų62.341%0.40535%0.353SS..EExtended strand (participates in β ladder)trans-65.3-37.4-17400000112.5N74 F80N74-A76 PolarHBondContact O-N 3.26Å; A76-F80 HydrophobicContact CB-CD1 3.97Å; A76-F80 PolarHBondContact N-O 3Å
77T97.6Very high94.9Very high64 Ų6469 Ų6939%0.39337%0.366SS..EExtended strand (participates in β ladder)trans-139.2169168.382.20000109.5Q75 T79 F80 H81Q75-T77 VanDerWaalsContact C-N 3.35Å; Q75-T77 PolarHBondContact O-N 3.28Å; T77-T79 PolarHBondContact O-N 3.17Å; T77-T79 PolarHBondContact OG1-N 3.28Å; T77-F80 HydrophobicContact CG2-CB 4.24Å; T77-F80 PolarHBondContact N-O 3.28Å; T77-F80 PolarHBondContact O-N 3.27Å; T77-F80 WeakPolarHBondContact OG1-CB 3.27Å; T77-F80 PolarHBondContact OG1-N 3.18Å; T77-H81 PolarHBondContact O-CD2 2.86Å; T77-H81 VanDerWaalsContact O-CD2 3.27Å; T77-H81 PolarHBondContact O-NE2 2.87Å
78P97.8Very high94.8Very high86 Ų8671.7 Ų71.756%0.55838%0.378SS*.THydrogen-bonded Turntrans-58.9-15.1177.7-25.635.5000115.5K97 A100P78-K97 HydrophobicContact CB-CD 4.33Å; P78-K97 HydrophobicContact CB-CG 4.17Å; P78-A100 WeakPolarHBondContact O-CB 3.23Å
79T97.9Very high94.9Very high49 Ų4969 Ų6930%0.30136%0.362SS..THydrogen-bonded Turntrans-127.10.6178.657.10000112.7T77 N93 F94 K97T77-T79 PolarHBondContact O-N 3.17Å; T77-T79 PolarHBondContact OG1-N 3.28Å; T79-N93 CarbonylContact O-C 3.56Å; T79-F94 WeakPolarHBondContact O-CD2 3.36Å; T79-F94 PolarHBondContact O-N 2.84Å; T79-K97 HydrophobicContact CG2-CB 4.29Å
80F98.3Very high95.2Very high30 Ų3067 Ų6713%0.13235%0.352CS..EExtended strand (participates in β ladder)trans-128.4108.5-179.7-172.4-106.7000110.5W25 A76 T77 L92 N93W25-F80 HydrophobicContact CD2-CE1 4.43Å; W25-F80 AromaticContact CD2-CZ 3.73Å; W25-F80 HydrophobicContact CD2-CZ 3.73Å; W25-F80 AromaticContact CE2-CE1 3.78Å; W25-F80 AromaticContact CE2-CZ 3.54Å; W25-F80 AromaticContact CE3-CZ 3.98Å; W25-F80 HydrophobicContact CE3-CZ 3.98Å; W25-F80 HydrophobicContact CG-CZ 4.37Å; W25-F80 HydrophobicContact CH2-CE1 4.19Å; W25-F80 AromaticContact CH2-CZ 3.83Å; W25-F80 HydrophobicContact CH2-CZ 3.83Å; W25-F80 AromaticContact CZ2-CE1 3.66Å; W25-F80 HydrophobicContact CZ2-CE1 3.66Å; W25-F80 AromaticContact CZ2-CZ 3.61Å; W25-F80 HydrophobicContact CZ2-CZ 3.61Å; W25-F80 HydrophobicContact CZ3-CZ 4.02Å; A76-F80 HydrophobicContact CB-CD1 3.97Å; A76-F80 PolarHBondContact N-O 3Å; T77-F80 HydrophobicContact CG2-CB 4.24Å; T77-F80 PolarHBondContact N-O 3.28Å; T77-F80 PolarHBondContact O-N 3.27Å; T77-F80 WeakPolarHBondContact OG1-CB 3.27Å; T77-F80 PolarHBondContact OG1-N 3.18Å; F80-L92 WeakPolarHBondContact CA-O 3.36Å; F80-L92 WeakPolarHBondContact CD2-O 3.46Å; F80-N93 HydrophobicContact CD2-CB 3.92Å; F80-N93 HydrophobicContact CE2-CB 4.38Å
81H98.4Very high95.5Very high2 Ų264.1 Ų64.11%0.00932%0.323CS..EExtended strand (participates in β ladder)trans-116149.5179.3-52.2162000110.2Y73 N74 T77 G91 L92 F94 A100Y73-H81 HydrophobicContact CE2-CB 3.93Å; Y73-H81 AromaticContact CZ-CG 3.99Å; Y73-H81 AromaticContact CZ-ND1 3.79Å; Y73-H81 WeakPolarHBondContact OH-CB 3.45Å; Y73-H81 VanDerWaalsContact OH-CG 3.27Å; Y73-H81 PolarHBondContact OH-ND1 3.48Å; N74-H81 CarbonylContact O-C 3.56Å; N74-H81 WeakPolarHBondContact O-CA 3.43Å; T77-H81 PolarHBondContact O-CD2 2.86Å; T77-H81 VanDerWaalsContact O-CD2 3.27Å; T77-H81 PolarHBondContact O-NE2 2.87Å; H81-G91 CarbonylContact O-C 3.45Å; H81-G91 WeakPolarHBondContact O-CA 3.28Å; H81-L92 PolarHBondContact N-O 3.38Å; H81-L92 PolarHBondContact O-N 3.3Å; H81-F94 HydrophobicContact CB-CE2 3.88Å; H81-F94 AromaticContact CG-CE2 3.64Å; H81-F94 AromaticContact ND1-CD2 4Å; H81-F94 AromaticContact ND1-CE2 3.31Å; H81-F94 VanDerWaalsContact ND1-CE2 3.31Å; H81-F94 WeakPolarHBondContact ND1-CE2 3.29Å; H81-A100 PolarHBondContact CE1-O 3.38Å; H81-A100 VanDerWaalsContact CE1-O 3.23Å
82Q97.7Very high95.7Very high48 Ų4863.5 Ų63.522%0.22432%0.32CS..EExtended strand (participates in β ladder)trans-143.7156.7-175.665.8-17952.300111.7W25 N74 Y90W25-Q82 HydrophobicContact CH2-CB 4Å; W25-Q82 HydrophobicContact CZ2-CB 4.5Å; W25-Q82 VanDerWaalsContact CZ2-OE1 3.25Å; N74-Q82 HydrophobicContact CB-CG 3.96Å; N74-Q82 PolarHBondContact N-O 3.33Å; N74-Q82 PolarHBondContact O-N 3.36Å; Q82-Y90 CarbonylContact C-O 3.54Å; Q82-Y90 WeakPolarHBondContact CA-O 3.41Å; Q82-Y90 WeakPolarHBondContact CB-O 3.47Å
83W97.6Very high95.9Very high2 Ų258.8 Ų58.81%0.00830%0.303CS..EExtended strand (participates in β ladder)trans-142.1155.2168.659.691000110.2V51 I63 Y65 L71 K72 Y73 V89 Y90 L92 F103V51-W83 HydrophobicContact CG1-CH2 4.49Å; I63-W83 HydrophobicContact CD1-CZ2 3.96Å; Y65-W83 AromaticContact CD1-NE1 3.69Å; Y65-W83 AromaticContact CE1-NE1 3.6Å; Y65-W83 AromaticContact CZ-NE1 3.95Å; L71-W83 HydrophobicContact CD1-CB 4.24Å; L71-W83 HydrophobicContact CD1-CG 4.22Å; L71-W83 HydrophobicContact CD2-CB 3.97Å; L71-W83 HydrophobicContact CD2-CG 4.13Å; L71-W83 HydrophobicContact CG-CB 4.14Å; L71-W83 HydrophobicContact CG-CG 4.5Å; K72-W83 WeakPolarHBondContact O-CA 3.33Å; K72-W83 WeakPolarHBondContact O-CB 3.4Å; Y73-W83 HydrophobicContact CD2-CE3 4.23Å; Y73-W83 HydrophobicContact CE2-CE3 4.27Å; W83-V89 WeakPolarHBondContact O-CG1 3.46Å; W83-Y90 AromaticContact CD1-CD2 3.9Å; W83-Y90 HydrophobicContact CZ2-CG 4.25Å; W83-Y90 PolarHBondContact N-O 2.69Å; W83-Y90 AromaticContact NE1-CD2 3.41Å; W83-Y90 AromaticContact NE1-CG 3.76Å; W83-Y90 PolarHBondContact O-N 3.26Å; W83-L92 HydrophobicContact CH2-CD1 3.63Å; W83-L92 HydrophobicContact CH2-CD2 4.22Å; W83-L92 HydrophobicContact CH2-CG 3.67Å; W83-L92 HydrophobicContact CZ3-CD1 3.61Å; W83-L92 HydrophobicContact CZ3-CG 3.68Å; W83-F103 HydrophobicContact CZ3-CE1 4.39Å
84R95.4Very high95.9Very high132 Ų13257.6 Ų57.650%0.49830%0.298SS..EExtended strand (participates in β ladder)trans-107133.4178.1179170.6-105.4-84.72109.9V89R84-V89 HydrophobicContact CB-CG2 4.42Å; R84-V89 HydrophobicContact CG-CG2 4.23Å
85D91.3Very high95.9Very high61 Ų6155.5 Ų55.533%0.32629%0.293SS..  trans-107.9179.5166.2-168.920.5000109.9Y65 R87 Q88 Y90Y65-D85 HydrophobicContact CE2-CB 4.26Å; D85-R87 PolarHBondContact O-N 2.94Å; D85-Q88 PolarHBondContact N-O 3.11Å; D85-Y90 HydrophobicContact CB-CE2 4.12Å
86A84.2Confident95.9Very high87 Ų8752.4 Ų52.472%0.71928%0.282SS*.SBendtrans-47.9-37.7-17300000114.2
87R86.8Confident96Very high219 Ų21955.8 Ų55.883%0.82629%0.287SS*.SBendtrans-135.3-12.7178.3-62.5-174.3-177.6-164.90.3114.9D85D85-R87 PolarHBondContact O-N 2.94Å
88Q93.5Very high96Very high63 Ų6358.6 Ų58.629%0.29430%0.296SS..  trans-116.4136.9-173.9-168.55967.200110V17 Y18 D85 Y90V17-Q88 HydrophobicContact CG1-CG 4.31Å; Y18-Q88 PolarHBondContact O-NE2 3.39Å; D85-Q88 PolarHBondContact N-O 3.11Å; Q88-Y90 HydrophobicContact CB-CE2 3.93Å; Q88-Y90 HydrophobicContact CG-CD1 4.36Å; Q88-Y90 HydrophobicContact CG-CD2 4.3Å; Q88-Y90 HydrophobicContact CG-CE1 3.93Å; Q88-Y90 HydrophobicContact CG-CE2 3.88Å
89V96.6Very high96Very high13 Ų1356.1 Ų56.18%0.07928%0.277CS..EExtended strand (participates in β ladder)trans-102.9123.2165.7-168.40000107.7V17 Y18 W25 W83 R84V17-V89 WeakPolarHBondContact CA-O 3.14Å; Y18-V89 PolarHBondContact N-O 2.9Å; W25-V89 HydrophobicContact CH2-CB 4.5Å; W25-V89 HydrophobicContact CH2-CG1 3.8Å; W83-V89 WeakPolarHBondContact O-CG1 3.46Å; R84-V89 HydrophobicContact CB-CG2 4.42Å; R84-V89 HydrophobicContact CG-CG2 4.23Å
90Y97.4Very high96Very high45 Ų4553.8 Ų53.818%0.17626%0.262CS..EExtended strand (participates in β ladder)trans-98.9144.3176.3-65.1-81.2000109.6V17 I28 I63 Y65 Q82 W83 D85 Q88V17-Y90 HydrophobicContact CG1-CD1 3.92Å; V17-Y90 HydrophobicContact CG1-CE1 4.08Å; I28-Y90 HydrophobicContact CD1-CD1 4.48Å; I28-Y90 HydrophobicContact CD1-CE1 4.19Å; I63-Y90 HydrophobicContact CD1-CD1 3.79Å; I63-Y90 HydrophobicContact CD1-CE1 4.13Å; I63-Y90 HydrophobicContact CD1-CG 4.36Å; Y65-Y90 HydrophobicContact CD2-CE2 4.06Å; Y65-Y90 HydrophobicContact CE2-CE2 4.16Å; Q82-Y90 CarbonylContact C-O 3.54Å; Q82-Y90 WeakPolarHBondContact CA-O 3.41Å; Q82-Y90 WeakPolarHBondContact CB-O 3.47Å; W83-Y90 AromaticContact CD1-CD2 3.9Å; W83-Y90 HydrophobicContact CZ2-CG 4.25Å; W83-Y90 PolarHBondContact N-O 2.69Å; W83-Y90 AromaticContact NE1-CD2 3.41Å; W83-Y90 AromaticContact NE1-CG 3.76Å; W83-Y90 PolarHBondContact O-N 3.26Å; D85-Y90 HydrophobicContact CB-CE2 4.12Å; Q88-Y90 HydrophobicContact CB-CE2 3.93Å; Q88-Y90 HydrophobicContact CG-CD1 4.36Å; Q88-Y90 HydrophobicContact CG-CD2 4.3Å; Q88-Y90 HydrophobicContact CG-CE1 3.93Å; Q88-Y90 HydrophobicContact CG-CE2 3.88Å
91G97.5Very high96Very high0 Ų055.1 Ų55.10%027%0.273CS..EExtended strand (participates in β ladder)trans-134.3143.3176.800000110.6M16 H81M16-G91 PolarHBondContact N-O 2.78Å; M16-G91 PolarHBondContact O-N 3.31Å; H81-G91 CarbonylContact O-C 3.45Å; H81-G91 WeakPolarHBondContact O-CA 3.28Å
92L98.2Very high96Very high0 Ų058.6 Ų58.60%030%0.295CS..EExtended strand (participates in β ladder)trans-120.3120.4172.5-65.1-177.6000108.4A13 V15 I38 F80 H81 W83 F94 F103A13-L92 HydrophobicContact CB-CB 4.05Å; A13-L92 HydrophobicContact CB-CD2 4.37Å; V15-L92 HydrophobicContact CB-CD2 4.3Å; V15-L92 HydrophobicContact CG1-CD2 4.25Å; V15-L92 HydrophobicContact CG2-CD2 3.83Å; I38-L92 HydrophobicContact CD1-CD2 4.27Å; I38-L92 HydrophobicContact CG1-CD2 4.35Å; I38-L92 HydrophobicContact CG2-CD1 4.21Å; F80-L92 WeakPolarHBondContact CA-O 3.36Å; F80-L92 WeakPolarHBondContact CD2-O 3.46Å; H81-L92 PolarHBondContact N-O 3.38Å; H81-L92 PolarHBondContact O-N 3.3Å; W83-L92 HydrophobicContact CH2-CD1 3.63Å; W83-L92 HydrophobicContact CH2-CD2 4.22Å; W83-L92 HydrophobicContact CH2-CG 3.67Å; W83-L92 HydrophobicContact CZ3-CD1 3.61Å; W83-L92 HydrophobicContact CZ3-CG 3.68Å; L92-F94 HydrophobicContact CB-CD2 4.39Å; L92-F94 HydrophobicContact CB-CE1 4.47Å; L92-F94 HydrophobicContact CB-CE2 3.71Å; L92-F94 HydrophobicContact CB-CZ 3.76Å; L92-F94 HydrophobicContact CD1-CE1 4.28Å; L92-F94 HydrophobicContact CD1-CE2 4.44Å; L92-F94 HydrophobicContact CD1-CZ 3.7Å; L92-F94 HydrophobicContact CG-CZ 4.41Å; L92-F103 HydrophobicContact CD1-CD1 4.32Å; L92-F103 HydrophobicContact CD1-CE1 3.69Å; L92-F103 HydrophobicContact CD1-CE2 4.07Å; L92-F103 HydrophobicContact CD1-CZ 3.55Å
93N97.7Very high96Very high73 Ų7356.3 Ų56.339%0.3928%0.284SS..EExtended strand (participates in β ladder)trans-99.899.6171.2-171.84.2000109.2A13 S14 T79 F80A13-N93 CarbonylContact C-O 3.57Å; A13-N93 WeakPolarHBondContact CA-O 3.34Å; A13-N93 WeakPolarHBondContact CB-O 3.18Å; S14-N93 PolarHBondContact N-O 3.34Å; S14-N93 PolarHBondContact O-N 3.28Å; T79-N93 CarbonylContact O-C 3.56Å; F80-N93 HydrophobicContact CD2-CB 3.92Å; F80-N93 HydrophobicContact CE2-CB 4.38Å
94F98.5Very high96Very high6 Ų656.4 Ų56.43%0.02629%0.285CS..EExtended strand (participates in β ladder)trans-71.1149.5-173.9-67-83.6000112.3A11 R12 A13 T79 H81 L92 S96 E99 A100 F103A11-F94 HydrophobicContact CB-CD1 4.05Å; A11-F94 HydrophobicContact CB-CE1 3.9Å; R12-F94 WeakPolarHBondContact O-CA 3.4Å; A13-F94 HydrophobicContact CB-CD1 3.81Å; A13-F94 HydrophobicContact CB-CE1 4.08Å; A13-F94 HydrophobicContact CB-CG 4.19Å; T79-F94 WeakPolarHBondContact O-CD2 3.36Å; T79-F94 PolarHBondContact O-N 2.84Å; H81-F94 HydrophobicContact CB-CE2 3.88Å; H81-F94 AromaticContact CG-CE2 3.64Å; H81-F94 AromaticContact ND1-CD2 4Å; H81-F94 AromaticContact ND1-CE2 3.31Å; H81-F94 VanDerWaalsContact ND1-CE2 3.31Å; H81-F94 WeakPolarHBondContact ND1-CE2 3.29Å; L92-F94 HydrophobicContact CB-CD2 4.39Å; L92-F94 HydrophobicContact CB-CE1 4.47Å; L92-F94 HydrophobicContact CB-CE2 3.71Å; L92-F94 HydrophobicContact CB-CZ 3.76Å; L92-F94 HydrophobicContact CD1-CE1 4.28Å; L92-F94 HydrophobicContact CD1-CE2 4.44Å; L92-F94 HydrophobicContact CD1-CZ 3.7Å; L92-F94 HydrophobicContact CG-CZ 4.41Å; F94-S96 VanDerWaalsContact C-N 3.29Å; F94-S96 WeakPolarHBondContact CB-O 3.36Å; F94-E99 HydrophobicContact CD1-CB 4.42Å; F94-A100 HydrophobicContact CB-CB 3.81Å; F94-A100 HydrophobicContact CD1-CB 4.31Å; F94-A100 HydrophobicContact CD2-CB 3.49Å; F94-A100 VanDerWaalsContact CD2-CB 3.49Å; F94-A100 HydrophobicContact CE2-CB 4.17Å; F94-A100 HydrophobicContact CG-CB 3.59Å; F94-F103 HydrophobicContact CE1-CB 3.56Å; F94-F103 HydrophobicContact CE1-CD1 4.07Å; F94-F103 HydrophobicContact CE1-CD2 4.13Å; F94-F103 AromaticContact CE1-CG 3.64Å; F94-F103 HydrophobicContact CE1-CG 3.64Å; F94-F103 HydrophobicContact CE2-CD1 4.42Å; F94-F103 HydrophobicContact CZ-CB 3.7Å; F94-F103 AromaticContact CZ-CD1 3.44Å; F94-F103 HydrophobicContact CZ-CD1 3.44Å; F94-F103 VanDerWaalsContact CZ-CD1 3.44Å; F94-F103 HydrophobicContact CZ-CD2 4.28Å; F94-F103 HydrophobicContact CZ-CE1 4.11Å; F94-F103 AromaticContact CZ-CG 3.52Å; F94-F103 HydrophobicContact CZ-CG 3.52Å
95A97.8Very high96.2Very high41 Ų4154.9 Ų54.934%0.33929%0.287SS..SBendtrans-72.6-25.7177.800000111.9R12 F35 E99R12-A95 HydrophobicContact CB-CB 4.07Å; R12-A95 PolarHBondContact O-N 2.87Å; F35-A95 HydrophobicContact CD1-CB 3.98Å; F35-A95 HydrophobicContact CE1-CB 3.53Å; F35-A95 HydrophobicContact CZ-CB 3.87Å; A95-E99 VanDerWaalsContact CB-OE2 3.23Å; A95-E99 WeakPolarHBondContact CB-OE2 3.38Å; A95-E99 PolarHBondContact N-OE2 2.83Å
96S98Very high96.5Very high30 Ų3052.6 Ų52.621%0.2128%0.277CS..SBendtrans-145.4165171.893.40000113.3F94 E98 E99 A100F94-S96 VanDerWaalsContact C-N 3.29Å; F94-S96 WeakPolarHBondContact CB-O 3.36Å; S96-E98 VanDerWaalsContact C-N 3.3Å; S96-E98 WeakPolarHBondContact CB-OE2 3.05Å; S96-E98 PolarHBondContact OG-N 3.3Å; S96-E98 PolarHBondContact OG-OE2 3.46Å; S96-E99 PolarHBondContact N-OE2 3.26Å; S96-E99 PolarHBondContact OG-N 3.08Å; S96-A100 PolarHBondContact O-N 3.37Å; S96-A100 VanDerWaalsContact O-N 3.11Å
97K98Very high97.1Very high121 Ų12148.5 Ų48.553%0.52624%0.242SC..Hα-helixtrans-66.2-34.8176.2179.4-175.5173-171.10111.5P78 T79 A100 T101P78-K97 HydrophobicContact CB-CD 4.33Å; P78-K97 HydrophobicContact CB-CG 4.17Å; T79-K97 HydrophobicContact CG2-CB 4.29Å; K97-A100 WeakPolarHBondContact O-CB 3.45Å; K97-A100 PolarHBondContact O-N 3.3Å; K97-T101 WeakPolarHBondContact O-CB 3.4Å; K97-T101 PolarHBondContact O-N 3.41Å; K97-T101 PolarHBondContact O-OG1 2.92Å
98E98.1Very high97.5Very high123 Ų12342 Ų4258%0.57522%0.224SC*.Hα-helixtrans-66.2-43.5-179.7-58.867.1-141.200110.2S96 T101 T102S96-E98 VanDerWaalsContact C-N 3.3Å; S96-E98 WeakPolarHBondContact CB-OE2 3.05Å; S96-E98 PolarHBondContact OG-N 3.3Å; S96-E98 PolarHBondContact OG-OE2 3.46Å; E98-T101 PolarHBondContact O-N 2.99Å; E98-T102 WeakPolarHBondContact O-CB 3.23Å; E98-T102 PolarHBondContact O-N 3.04Å; E98-T102 PolarHBondContact O-OG1 3.32Å
99E98.1Very high97.6Very high33 Ų3344.2 Ų44.215%0.15423%0.232CC..Hα-helixtrans-63.9-42.1173.8-70.4177.8151.500111.3A11 R12 F94 A95 S96 T101 T102 F103A11-E99 HydrophobicContact CB-CB 4.12Å; R12-E99 IonicContact CZ-OE1 2.95Å; R12-E99 IonicContact NE-OE1 2.79Å; R12-E99 PolarHBondContact NE-OE1 3.12Å; R12-E99 IonicContact NH2-OE1 3.3Å; R12-E99 PolarHBondContact NH2-OE1 2.72Å; F94-E99 HydrophobicContact CD1-CB 4.42Å; A95-E99 VanDerWaalsContact CB-OE2 3.23Å; A95-E99 WeakPolarHBondContact CB-OE2 3.38Å; A95-E99 PolarHBondContact N-OE2 2.83Å; S96-E99 PolarHBondContact N-OE2 3.26Å; S96-E99 PolarHBondContact OG-N 3.08Å; E99-T101 PolarHBondContact O-N 3.45Å; E99-T102 PolarHBondContact O-N 2.89Å; E99-F103 WeakPolarHBondContact O-CB 3.48Å; E99-F103 PolarHBondContact O-N 3.12Å
100A97.9Very high97.6Very high0 Ų043.6 Ų43.60%023%0.229CC..Hα-helixtrans-60.8-44.2176.100000111.9P78 H81 F94 S96 K97 F103 S104P78-A100 WeakPolarHBondContact O-CB 3.23Å; H81-A100 PolarHBondContact CE1-O 3.38Å; H81-A100 VanDerWaalsContact CE1-O 3.23Å; F94-A100 HydrophobicContact CB-CB 3.81Å; F94-A100 HydrophobicContact CD1-CB 4.31Å; F94-A100 HydrophobicContact CD2-CB 3.49Å; F94-A100 VanDerWaalsContact CD2-CB 3.49Å; F94-A100 HydrophobicContact CE2-CB 4.17Å; F94-A100 HydrophobicContact CG-CB 3.59Å; S96-A100 PolarHBondContact O-N 3.37Å; S96-A100 VanDerWaalsContact O-N 3.11Å; K97-A100 WeakPolarHBondContact O-CB 3.45Å; K97-A100 PolarHBondContact O-N 3.3Å; A100-F103 PolarHBondContact O-N 2.99Å; A100-S104 PolarHBondContact O-N 3.49Å; A100-S104 PolarHBondContact O-OG 3.45Å
101T98Very high97.4Very high59 Ų5942.1 Ų42.136%0.36222%0.224SC..Hα-helixtrans-65.6-43178.6-56.10000111.3K97 E98 E99 F103 S104 N105K97-T101 WeakPolarHBondContact O-CB 3.4Å; K97-T101 PolarHBondContact O-N 3.41Å; K97-T101 PolarHBondContact O-OG1 2.92Å; E98-T101 PolarHBondContact O-N 2.99Å; E99-T101 PolarHBondContact O-N 3.45Å; T101-F103 VanDerWaalsContact C-N 3.31Å; T101-F103 PolarHBondContact O-N 3.4Å; T101-S104 WeakPolarHBondContact CA-OG 3.47Å; T101-S104 PolarHBondContact O-N 3.3Å; T101-S104 PolarHBondContact O-OG 3.34Å; T101-N105 VanDerWaalsContact O-CG 3.22Å; T101-N105 PolarHBondContact O-N 3.48Å; T101-N105 PolarHBondContact O-ND2 3.35Å
102T97.8Very high97.3Very high74 Ų7447.3 Ų47.345%0.45425%0.251SS..Hα-helixtrans-61.2-44.1176.3-57.80000110.7E98 E99 A106E98-T102 WeakPolarHBondContact O-CB 3.23Å; E98-T102 PolarHBondContact O-N 3.04Å; E98-T102 PolarHBondContact O-OG1 3.32Å; E99-T102 PolarHBondContact O-N 2.89Å; T102-A106 PolarHBondContact O-N 3.47Å
103F98.4Very high97Very high0 Ų048.9 Ų48.90%026%0.26CS..Hα-helixtrans-66.1-43.6177.8-174.1-88.9000112.3A11 I38 I40 V51 Y73 W83 L92 F94 E99 A100 T101 N105 A106 M107A11-F103 HydrophobicContact CB-CB 4.21Å; A11-F103 HydrophobicContact CB-CD2 4.41Å; I38-F103 HydrophobicContact CB-CE2 4.47Å; I38-F103 HydrophobicContact CG2-CD2 4.19Å; I38-F103 HydrophobicContact CG2-CE2 3.51Å; I38-F103 HydrophobicContact CG2-CZ 4.25Å; I40-F103 HydrophobicContact CD1-CD2 4.13Å; I40-F103 HydrophobicContact CD1-CE2 3.71Å; I40-F103 HydrophobicContact CD1-CZ 3.94Å; I40-F103 HydrophobicContact CG1-CD2 4.28Å; I40-F103 HydrophobicContact CG1-CE2 3.65Å; I40-F103 HydrophobicContact CG1-CZ 4.16Å; V51-F103 HydrophobicContact CG1-CE2 4.25Å; V51-F103 HydrophobicContact CG1-CZ 4.1Å; V51-F103 HydrophobicContact CG2-CZ 4.37Å; Y73-F103 HydrophobicContact CE2-CD1 4.48Å; Y73-F103 HydrophobicContact CE2-CE1 4.12Å; W83-F103 HydrophobicContact CZ3-CE1 4.39Å; L92-F103 HydrophobicContact CD1-CD1 4.32Å; L92-F103 HydrophobicContact CD1-CE1 3.69Å; L92-F103 HydrophobicContact CD1-CE2 4.07Å; L92-F103 HydrophobicContact CD1-CZ 3.55Å; F94-F103 HydrophobicContact CE1-CB 3.56Å; F94-F103 HydrophobicContact CE1-CD1 4.07Å; F94-F103 HydrophobicContact CE1-CD2 4.13Å; F94-F103 AromaticContact CE1-CG 3.64Å; F94-F103 HydrophobicContact CE1-CG 3.64Å; F94-F103 HydrophobicContact CE2-CD1 4.42Å; F94-F103 HydrophobicContact CZ-CB 3.7Å; F94-F103 AromaticContact CZ-CD1 3.44Å; F94-F103 HydrophobicContact CZ-CD1 3.44Å; F94-F103 VanDerWaalsContact CZ-CD1 3.44Å; F94-F103 HydrophobicContact CZ-CD2 4.28Å; F94-F103 HydrophobicContact CZ-CE1 4.11Å; F94-F103 AromaticContact CZ-CG 3.52Å; F94-F103 HydrophobicContact CZ-CG 3.52Å; E99-F103 WeakPolarHBondContact O-CB 3.48Å; E99-F103 PolarHBondContact O-N 3.12Å; A100-F103 PolarHBondContact O-N 2.99Å; T101-F103 VanDerWaalsContact C-N 3.31Å; T101-F103 PolarHBondContact O-N 3.4Å; F103-N105 PolarHBondContact O-N 3.32Å; F103-A106 PolarHBondContact O-N 2.97Å; F103-M107 HydrophobicContact CE1-CB 4.37Å; F103-M107 HydrophobicContact CE1-SD 4.39Å; F103-M107 HydrophobicContact CZ-SD 4.43Å; F103-M107 WeakPolarHBondContact O-CB 3.46Å; F103-M107 PolarHBondContact O-N 3.22Å
104S97.9Very high96.6Very high4 Ų446.2 Ų46.23%0.02825%0.245CC..Hα-helixtrans-64.4-41-179.860.80000112.1Y73 Q75 A100 T101 A106 M107 L108Y73-S104 WeakPolarHBondContact OH-CA 3.39Å; Y73-S104 WeakPolarHBondContact OH-CB 3.45Å; Q75-S104 PolarHBondContact OE1-OG 2.89Å; A100-S104 PolarHBondContact O-N 3.49Å; A100-S104 PolarHBondContact O-OG 3.45Å; T101-S104 WeakPolarHBondContact CA-OG 3.47Å; T101-S104 PolarHBondContact O-N 3.3Å; T101-S104 PolarHBondContact O-OG 3.34Å; S104-A106 PolarHBondContact O-N 2.96Å; S104-M107 PolarHBondContact O-N 3Å; S104-L108 WeakPolarHBondContact O-CB 3.39Å; S104-L108 VanDerWaalsContact O-CG 3.27Å; S104-L108 WeakPolarHBondContact O-CG 3.34Å; S104-L108 PolarHBondContact O-N 3.47Å
105N97.8Very high96.2Very high101 Ų10149.9 Ų49.954%0.5427%0.265SS..Hα-helixtrans-58.9-47.1175.3-70.4-22.4000111.8T101 F103 F109T101-N105 VanDerWaalsContact O-CG 3.22Å; T101-N105 PolarHBondContact O-N 3.48Å; T101-N105 PolarHBondContact O-ND2 3.35Å; F103-N105 PolarHBondContact O-N 3.32Å; N105-F109 VanDerWaalsContact O-CB 3.29Å; N105-F109 WeakPolarHBondContact O-CB 3.29Å; N105-F109 PolarHBondContact O-N 3.26Å
106A97.5Very high95.5Very high13 Ų1351.4 Ų51.411%0.10727%0.273CS..Hα-helixtrans-66.5-38.6178.200000112.6I8 C9 I40 T102 F103 S104 F109 A110I8-A106 HydrophobicContact CD1-CB 4.24Å; C9-A106 HydrophobicContact CB-CB 3.49Å; C9-A106 VanDerWaalsContact CB-CB 3.49Å; I40-A106 HydrophobicContact CD1-CB 4.05Å; T102-A106 PolarHBondContact O-N 3.47Å; F103-A106 PolarHBondContact O-N 2.97Å; S104-A106 PolarHBondContact O-N 2.96Å; A106-F109 PolarHBondContact O-N 2.93Å; A106-A110 WeakPolarHBondContact O-CB 3.06Å; A106-A110 PolarHBondContact O-N 3.05Å
107M97.4Very high94.3Very high0 Ų053.9 Ų53.90%028%0.282CS..Hα-helixtrans-63.9-47.5177.4-168.170.8-176.700111.6I40 V51 I67 L71 Y73 F103 S104 F109 A110 L111I40-M107 HydrophobicContact CD1-CB 4.17Å; I40-M107 HydrophobicContact CD1-SD 3.98Å; V51-M107 HydrophobicContact CG2-SD 4.27Å; I67-M107 HydrophobicContact CD1-CE 3.75Å; I67-M107 HydrophobicContact CD1-SD 3.55Å; I67-M107 VanDerWaalsContact CD1-SD 3.55Å; I67-M107 HydrophobicContact CG1-CE 3.95Å; I67-M107 HydrophobicContact CG1-SD 4.37Å; I67-M107 HydrophobicContact CG2-CE 4.15Å; L71-M107 HydrophobicContact CD2-CE 3.08Å; Y73-M107 HydrophobicContact CD1-CG 4.49Å; Y73-M107 HydrophobicContact CD2-CE 4.47Å; Y73-M107 HydrophobicContact CD2-CG 3.74Å; Y73-M107 HydrophobicContact CE2-CB 4.38Å; Y73-M107 HydrophobicContact CE2-CG 3.91Å; Y73-M107 HydrophobicContact CG-CG 4.02Å; F103-M107 HydrophobicContact CE1-CB 4.37Å; F103-M107 HydrophobicContact CE1-SD 4.39Å; F103-M107 HydrophobicContact CZ-SD 4.43Å; F103-M107 WeakPolarHBondContact O-CB 3.46Å; F103-M107 PolarHBondContact O-N 3.22Å; S104-M107 PolarHBondContact O-N 3Å; M107-F109 VanDerWaalsContact C-N 3.33Å; M107-F109 PolarHBondContact O-N 2.93Å; M107-A110 PolarHBondContact O-N 3.45Å; M107-L111 WeakPolarHBondContact O-CG 3.28Å; M107-L111 PolarHBondContact O-N 3.25Å
108L96Very high92.4Very high83 Ų8354.8 Ų54.844%0.43529%0.287SS..Hα-helixtrans-64.8-39.4177.9-67.8175.4000111.7Y73 S104 L111 N112Y73-L108 HydrophobicContact CD1-CD2 4.27Å; S104-L108 WeakPolarHBondContact O-CB 3.39Å; S104-L108 VanDerWaalsContact O-CG 3.27Å; S104-L108 WeakPolarHBondContact O-CG 3.34Å; S104-L108 PolarHBondContact O-N 3.47Å; L108-L111 PolarHBondContact O-N 3.4Å; L108-N112 WeakPolarHBondContact O-CB 3.36Å; L108-N112 PolarHBondContact O-N 3.2Å
109F95.4Very high90.4Very high109 Ų10951.8 Ų51.848%0.47829%0.29SS..Hα-helixtrans-58.4-48.3173.4171-103.7000112.1I8 N105 A106 M107 L111 N112 I113I8-F109 HydrophobicContact CD1-CD1 4.25Å; N105-F109 VanDerWaalsContact O-CB 3.29Å; N105-F109 WeakPolarHBondContact O-CB 3.29Å; N105-F109 PolarHBondContact O-N 3.26Å; A106-F109 PolarHBondContact O-N 2.93Å; M107-F109 VanDerWaalsContact C-N 3.33Å; M107-F109 PolarHBondContact O-N 2.93Å; F109-L111 PolarHBondContact O-N 2.6Å; F109-N112 PolarHBondContact O-N 3.18Å; F109-I113 HydrophobicContact CD1-CD1 4.05Å; F109-I113 HydrophobicContact CD2-CD1 4.23Å; F109-I113 HydrophobicContact CE1-CD1 3.42Å; F109-I113 VanDerWaalsContact CE1-CD1 3.42Å; F109-I113 HydrophobicContact CE2-CD1 3.63Å; F109-I113 HydrophobicContact CE2-CG1 4.3Å; F109-I113 HydrophobicContact CG-CD1 4.43Å; F109-I113 HydrophobicContact CZ-CD1 3.2Å; F109-I113 HydrophobicContact CZ-CG1 4.31Å; F109-I113 PolarHBondContact O-N 3.41Å
110A95.6Very high88.2Confident0 Ų054.3 Ų54.30%032%0.316CS..Hα-helixtrans-58.3-46.8176.500000111.7F49 I67 A106 M107 N112 I113 M114F49-A110 HydrophobicContact CB-CB 4.05Å; F49-A110 HydrophobicContact CD1-CB 3.57Å; F49-A110 HydrophobicContact CD2-CB 3.94Å; F49-A110 HydrophobicContact CE1-CB 3.91Å; F49-A110 HydrophobicContact CE2-CB 4.27Å; F49-A110 HydrophobicContact CG-CB 3.58Å; F49-A110 HydrophobicContact CZ-CB 4.25Å; I67-A110 HydrophobicContact CD1-CB 4.38Å; A106-A110 WeakPolarHBondContact O-CB 3.06Å; A106-A110 PolarHBondContact O-N 3.05Å; M107-A110 PolarHBondContact O-N 3.45Å; A110-N112 VanDerWaalsContact C-N 3.32Å; A110-N112 PolarHBondContact O-N 2.85Å; A110-I113 PolarHBondContact O-N 2.93Å; A110-M114 WeakPolarHBondContact O-CB 3.33Å; A110-M114 VanDerWaalsContact O-CG 3.23Å; A110-M114 WeakPolarHBondContact O-CG 3.4Å; A110-M114 PolarHBondContact O-N 3.24Å
111L94.9Very high85.9Confident15 Ų1564.7 Ų64.78%0.07936%0.355CS..Hα-helixtrans-61.6-39.5177.6-66.5173.4000112.2I67 L71 M107 L108 F109 M114 N115I67-L111 HydrophobicContact CG2-CD2 3.61Å; L71-L111 HydrophobicContact CB-CD2 3.78Å; L71-L111 HydrophobicContact CD2-CD2 4.27Å; M107-L111 WeakPolarHBondContact O-CG 3.28Å; M107-L111 PolarHBondContact O-N 3.25Å; L108-L111 PolarHBondContact O-N 3.4Å; F109-L111 PolarHBondContact O-N 2.6Å; L111-M114 PolarHBondContact O-N 2.87Å; L111-N115 WeakPolarHBondContact O-CB 3.41Å; L111-N115 PolarHBondContact O-N 2.81Å; L111-N115 PolarHBondContact O-ND2 3.47Å; L111-N115 VanDerWaalsContact O-ND2 3.17Å
112N94Very high83.3Confident108 Ų10871.1 Ų71.158%0.57838%0.378SS*.Hα-helixtrans-64.1-44.5177.6-172.865.2000112.3L108 F109 A110 M114 N115 S116L108-N112 WeakPolarHBondContact O-CB 3.36Å; L108-N112 PolarHBondContact O-N 3.2Å; F109-N112 PolarHBondContact O-N 3.18Å; A110-N112 VanDerWaalsContact C-N 3.32Å; A110-N112 PolarHBondContact O-N 2.85Å; N112-M114 VanDerWaalsContact C-N 3.35Å; N112-N115 PolarHBondContact O-N 2.81Å; N112-S116 PolarHBondContact O-N 3.28Å; N112-S116 PolarHBondContact O-OG 2.78Å
113I92.1Very high80.8Confident34 Ų3473.4 Ų73.417%0.17439%0.392CS..Hα-helixtrans-62.5-44176.1-69.9176.5000111.1F49 F109 A110 N115 S116 Q117F49-I113 HydrophobicContact CE2-CB 4.09Å; F49-I113 HydrophobicContact CE2-CG2 3.91Å; F49-I113 HydrophobicContact CZ-CB 4.21Å; F49-I113 HydrophobicContact CZ-CD1 3.93Å; F49-I113 HydrophobicContact CZ-CG2 4.15Å; F109-I113 HydrophobicContact CD1-CD1 4.05Å; F109-I113 HydrophobicContact CD2-CD1 4.23Å; F109-I113 HydrophobicContact CE1-CD1 3.42Å; F109-I113 VanDerWaalsContact CE1-CD1 3.42Å; F109-I113 HydrophobicContact CE2-CD1 3.63Å; F109-I113 HydrophobicContact CE2-CG1 4.3Å; F109-I113 HydrophobicContact CG-CD1 4.43Å; F109-I113 HydrophobicContact CZ-CD1 3.2Å; F109-I113 HydrophobicContact CZ-CG1 4.31Å; F109-I113 PolarHBondContact O-N 3.41Å; A110-I113 PolarHBondContact O-N 2.93Å; I113-N115 VanDerWaalsContact C-N 3.25Å; I113-N115 PolarHBondContact O-N 2.86Å; I113-S116 PolarHBondContact O-N 3.35Å; I113-S116 PolarHBondContact O-OG 2.85Å; I113-Q117 PolarHBondContact O-N 3.16Å
114M90.1Very high78.2Confident17 Ų1781.8 Ų81.88%0.08443%0.431CS..Hα-helixtrans-64.4-32.7179.6-72.3-179.77300112.3F49 I67 K69 A110 L111 N112F49-M114 HydrophobicContact CB-SD 4.4Å; F49-M114 HydrophobicContact CD2-CG 3.68Å; F49-M114 HydrophobicContact CD2-SD 3.83Å; F49-M114 HydrophobicContact CE2-CG 4Å; I67-M114 HydrophobicContact CB-SD 4.12Å; I67-M114 HydrophobicContact CG2-CE 4.42Å; I67-M114 HydrophobicContact CG2-SD 3.69Å; I67-M114 WeakPolarHBondContact O-CE 3.39Å; K69-M114 WeakPolarHBondContact CD-O 3.43Å; K69-M114 WeakPolarHBondContact CE-O 3.34Å; K69-M114 HydrophobicContact CG-CB 4.19Å; K69-M114 HydrophobicContact CG-CE 4.13Å; K69-M114 PolarHBondContact NZ-O 2.79Å; A110-M114 WeakPolarHBondContact O-CB 3.33Å; A110-M114 VanDerWaalsContact O-CG 3.23Å; A110-M114 WeakPolarHBondContact O-CG 3.4Å; A110-M114 PolarHBondContact O-N 3.24Å; L111-M114 PolarHBondContact O-N 2.87Å; N112-M114 VanDerWaalsContact C-N 3.35Å
115N88.6Confident75.6Confident82 Ų8287.3 Ų87.344%0.43947%0.467SS..Hα-helixtrans-78.8-33.7176.9-67.7-20.7000112.8L111 N112 I113 Q117L111-N115 WeakPolarHBondContact O-CB 3.41Å; L111-N115 PolarHBondContact O-N 2.81Å; L111-N115 PolarHBondContact O-ND2 3.47Å; L111-N115 VanDerWaalsContact O-ND2 3.17Å; N112-N115 PolarHBondContact O-N 2.81Å; I113-N115 VanDerWaalsContact C-N 3.25Å; I113-N115 PolarHBondContact O-N 2.86Å; N115-Q117 VanDerWaalsContact C-N 3.31Å; N115-Q117 PolarHBondContact O-N 3.49Å
116S84.8Confident72.7Confident74 Ų7491.3 Ų91.352%0.51748%0.483SS..Hα-helixtrans-71.3-22.7-177.466.70000114.1N112 I113 E118 G119N112-S116 PolarHBondContact O-N 3.28Å; N112-S116 PolarHBondContact O-OG 2.78Å; I113-S116 PolarHBondContact O-N 3.35Å; I113-S116 PolarHBondContact O-OG 2.85Å; S116-E118 PolarHBondContact O-N 3.4Å; S116-E118 VanDerWaalsContact O-N 3.16Å; S116-G119 PolarHBondContact O-N 3.35Å
117Q71.6Confident70Confident82 Ų82100 Ų10038%0.38351%0.512SS..THydrogen-bonded Turntrans-65.2-17179.7-153.1-172.736.600114I113 N115I113-Q117 PolarHBondContact O-N 3.16Å; N115-Q117 VanDerWaalsContact C-N 3.31Å; N115-Q117 PolarHBondContact O-N 3.49Å
118E59.1Low67.7Low139 Ų139108.8 Ų108.865%0.6555%0.554SS**THydrogen-bonded Turntrans-76.4-26.2179-148.579.3-144.300112.5K69 S116K69-E118 IonicContact NZ-OE2 2.72Å; K69-E118 PolarHBondContact NZ-OE2 3.03Å; S116-E118 PolarHBondContact O-N 3.4Å; S116-E118 VanDerWaalsContact O-N 3.16Å
119G54.9Low65.1Low60 Ų60111.5 Ų111.562%0.61956%0.564SS**THydrogen-bonded Turntrans-84.6-19.8-174.500000115.1S116S116-G119 PolarHBondContact O-N 3.35Å
120A52.8Low62.9Low86 Ų86112.2 Ų112.271%0.71158%0.577SS**THydrogen-bonded Turntrans-94.5-0.4-171.500000114.8
121R49.1Very low60Low218 Ų218118.2 Ų118.282%0.82362%0.618SS**THydrogen-bonded Turntrans-103.912.8178.8-83.8-175.4176.5173.4-0.7114.7
122K44.4Very low56.9Low195 Ų195122.6 Ų122.685%0.84865%0.645SS**SBendtrans-117.618.2178.3-78.6-167.6177.5-174.90115.7
123T43.6Very low53.9Low121 Ų121128.4 Ų128.474%0.74266%0.659SS**  trans-120.975.4169.7-39.40000108.8
124E45.5Very low52.2Low177 Ų177131.8 Ų131.883%0.82768%0.683SS**  trans-58.3128.7149.7-85.3179105.100106.9Q126E124-Q126 VanDerWaalsContact C-N 3.34Å; E124-Q126 PolarHBondContact O-N 3.26Å
125P42.7Very low50Low120 Ų120140.7 Ų140.778%0.77972%0.722SS**  trans-66.8103.1166.327.2-27.1000105.8R127P125-R127 PolarHBondContact O-N 3.15Å
126Q37.6Very low48Very low185 Ų185142.6 Ų142.686%0.86474%0.739SS**  trans-58.698.8160.6-78.2-168.3-54.800105.9E124 E128E124-Q126 VanDerWaalsContact C-N 3.34Å; E124-Q126 PolarHBondContact O-N 3.26Å; Q126-E128 PolarHBondContact O-N 3.06Å
127R40.3Very low46.5Very low194 Ų194146.3 Ų146.373%0.73275%0.752SS**  trans-48.2107.8159.4-175-179.2-162.1-103-1.4105.3P125 E129P125-R127 PolarHBondContact O-N 3.15Å; R127-E129 HydrophobicContact CG-CG 4.39Å; R127-E129 IonicContact NH1-OE1 2.88Å; R127-E129 PolarHBondContact NH1-OE1 3.48Å; R127-E129 PolarHBondContact O-N 3.21Å
128E48.9Very low45.8Very low186 Ų186148.4 Ų148.487%0.86977%0.773SS**  trans-61.987.7171.4-67.7178.9150.200107.1Q126 V130Q126-E128 PolarHBondContact O-N 3.06Å; E128-V130 VanDerWaalsContact C-N 3.31Å; E128-V130 PolarHBondContact O-N 3.2Å
129E41.6Very low45.1Very low140 Ų140147.7 Ų147.765%0.65477%0.773SS**  trans-71.196.6165.6-69.1-150.4125.100107.3R127 C131R127-E129 HydrophobicContact CG-CG 4.39Å; R127-E129 IonicContact NH1-OE1 2.88Å; R127-E129 PolarHBondContact NH1-OE1 3.48Å; R127-E129 PolarHBondContact O-N 3.21Å; E129-C131 PolarHBondContact O-N 2.98Å
130V48.3Very low44.8Very low123 Ų123152.8 Ų152.875%0.74578%0.783SS**  trans-41.5109161.1164.70000109.1E128E128-V130 VanDerWaalsContact C-N 3.31Å; E128-V130 PolarHBondContact O-N 3.2Å
131C34.5Very low44.3Very low126 Ų126153.4 Ų153.485%0.85178%0.778SS**  trans-99.8110.1165.3-77.90000109.1E129E129-C131 PolarHBondContact O-N 2.98Å
132T29.5Very low44.2Very low108 Ų108151.3 Ų151.366%0.66378%0.777SS**  trans-78.9124.2177.23.60000111.5
133W33Very low44.2Very low229 Ų229146.9 Ų146.987%0.86777%0.771SS**  trans72.5159.5152.5-64.1122.8000121.3
134P54.4Low44.1Very low105 Ų105144.2 Ų144.268%0.68277%0.768SS**  -121.2170.3-81.118.84.3000113.2
135K44.8Very low44.4Very low205 Ų205147 Ų14789%0.89177%0.771SS**  trans-131.3145.3157.7-87.5176.51791590111.6
136P45.7Very low44.4Very low122 Ų122151 Ų15179%0.79278%0.779SS**  trans-83.9148.7-161.4-3.323.2000112.8
137L54Low44.6Very low151 Ų151147 Ų14779%0.79178%0.777SS**  trans-61.3152.5166.5-123.581.9000111.3D139L137-D139 HydrophobicContact CD2-CB 4.3Å
138P57.5Low44.9Very low127 Ų127149 Ų14983%0.82579%0.785SS**  trans-108.4122.8133.629.1-24.2000110.4
139D44.2Very low44.3Very low124 Ų124146.5 Ų146.566%0.66378%0.775SS**  trans-87.5133.1167-178.821.8000109.7L137L137-D139 HydrophobicContact CD2-CB 4.3Å
140M48.7Very low44.3Very low167 Ų167149.1 Ų149.182%0.82378%0.778SS**  trans175102.8139.8-103170.165.600107.2
141T43Very low43.7Very low98 Ų98149.2 Ų149.260%0.60178%0.779SS**  65.7115.492.3-59.10000110.3
142Q45.6Very low43.5Very low174 Ų174148.2 Ų148.281%0.81377%0.773SS**  -172.2142.956.1-150.3157.1-0.900110.8
143S43.9Very low43.8Very low102 Ų102148.3 Ų148.371%0.71378%0.778SS**  trans39.8109.6139-175.80000117.5
144G42.8Very low43.9Very low66 Ų66143 Ų14368%0.6878%0.775SS**  95.812958.600000110.5
145R50.9Low43.2Very low236 Ų236143.7 Ų143.789%0.89178%0.783SS**  trans103.191.2164.1-58.1177.2171.5163-1.1116.5A147R145-A147 PolarHBondContact O-N 2.89Å
146E43.1Very low43.3Very low204 Ų204139.7 Ų139.795%0.95378%0.778SS**  trans-12.2115.3136.4-78.1167.496.300114.2
147A43Very low43.1Very low99 Ų99139.8 Ų139.882%0.81878%0.779SS**  trans-108.1113.1159.400000109.1R145R145-A147 PolarHBondContact O-N 2.89Å
148R45.5Very low42.7Very low238 Ų238139 Ų13990%0.89878%0.78SS**  trans83.384.5137.8-157.4165-177.1169.90118
149M36.1Very low42.1Very low132 Ų132139.1 Ų139.165%0.6578%0.781SS**  11.1140.2116.2-99.9176.3-168.600119.2
150R41.1Very low41.6Very low195 Ų195137 Ų13774%0.73679%0.788SS**  trans85.4103.1137.7-73.7171.2-173.7150.22115.7
151T36.2Very low40.8Very low125 Ų125134 Ų13477%0.76778%0.783SS**  60.3112.994.360.60000113.5
152C30.1Very low40.5Very low105 Ų105134.9 Ų134.971%0.70979%0.788SS**  trans153.3117.9133.361.60000108.4
153S37Very low39.9Very low111 Ų111133.5 Ų133.578%0.77679%0.792SS**  41.5104.594.7420000113.9
154S33.7Very low39.3Very low116 Ų116132 Ų13281%0.81179%0.791SS**  trans174.394.4137.536.80000110.8
155S40.9Very low38.8Very low121 Ų121133.6 Ų133.685%0.84680%0.798SS**PPolyproline II helixtrans-80139.1156.7-58.40000108.8
156P45.9Very low38Very low120 Ų120126.9 Ų126.978%0.77979%0.794SS**PPolyproline II helixtrans-84.7164.9175.533-31.5000112.7
157P42.5Very low37.3Very low125 Ų125128.3 Ų128.381%0.81279%0.79SS**PPolyproline II helixtrans-96.1162.4-156.136.7-33.8000116.1
158V44.2Very low36.9Very low134 Ų134126.9 Ų126.981%0.81278%0.775SS**PPolyproline II helixtrans-65171.5169.6-79.80000114.1
159P46.9Very low36.7Very low130 Ų130120.6 Ų120.684%0.84477%0.767SS**  -142.7153.3117.335.9-21.1000116.4
160G32.5Very low36.5Very low78 Ų78125.1 Ų125.180%0.80478%0.777SS**  trans102.3125.3157.300000114.3
161S32.6Very low36Very low105 Ų105124.4 Ų124.473%0.73478%0.779SS**  cis-165.3131.18-1520000109.7
162V35.8Very low35.9Very low117 Ų117123.9 Ų123.971%0.70978%0.781SS**  trans57.3114.1139.9-550000123.4
163V33.8Very low36Very low145 Ų145123.7 Ų123.788%0.87979%0.786SS**  54.1137.9128.4-46.70000120.3
164G30.2Very low35.7Very low69 Ų69124.2 Ų124.271%0.71179%0.789SS**  cis161.5152.73.700000110.9
165A32.4Very low36.2Very low100 Ų100124.9 Ų124.983%0.82679%0.791SS**  trans65.5108.3161.500000118.3
166A34.1Very low35.7Very low96 Ų96122.8 Ų122.879%0.79379%0.788SS**  68.2117.274.900000113.6
167W29.3Very low35.4Very low233 Ų233122 Ų12288%0.88379%0.792SS**  -173.7152124.1-168.3-110.9000112.8
168S33.5Very low35.1Very low70 Ų70120 Ų12049%0.4979%0.793SS.*  trans-44.5160.5174.5-39.70000119.5
169S41.6Very low34.8Very low106 Ų106120.5 Ų120.574%0.74179%0.791SS**  trans11.3118.9142.7-72.20000119.1
170R31.6Very low34.2Very low227 Ų227125.3 Ų125.386%0.85779%0.792SS**  176144.3118.7-97.5174.1-131.5-1002.4112.4
171K30.8Very low34.3Very low180 Ų180132.2 Ų132.278%0.78379%0.794SS**  trans40.2129.4143.7-59.1-165.1177.8-166.30122.3
172S34.4Very low34.4Very low114 Ų114132.8 Ų132.880%0.79779%0.793SS**  trans60.9119.4134.967.20000121.7
173A31.3Very low34.3Very low100 Ų100132.2 Ų132.283%0.82679%0.793SS**  143.4133.4118.400000112.8
174C32.3Very low34.5Very low123 Ų123132 Ų13283%0.83179%0.791SS**  trans-67.6168.5176.9-44.70000112
175P42.6Very low34.9Very low130 Ų130134.2 Ų134.284%0.84479%0.791SS**  -146.1150.873.933.6-13.4000116.4
176G31.8Very low35.3Very low76 Ų76138.1 Ų138.178%0.78480%0.797SS**  trans81.195.6136.600000119.4
177A39.8Very low35.4Very low105 Ų105138.8 Ų138.887%0.86880%0.796SS**  -175.4103.1123.900000111.2
178G35Very low35.8Very low81 Ų81137.7 Ų137.784%0.83580%0.798SS**  trans5484.2141.600000120
179L39.4Very low36.4Very low146 Ų146139.8 Ų139.876%0.76481%0.812SS**  trans-63.7136.4145.6-79.1142.6000109.8
180R34.2Very low37Very low230 Ų230140.2 Ų140.287%0.86881%0.813SS**  trans-146102.5135.7-68.2-159116.2-127.8-0.7111.1
181W34.5Very low38Very low223 Ų223134.9 Ų134.985%0.84581%0.808SS**  trans-77.8130.4154.4-6885.6000107.8
182V34.6Very low39.2Very low118 Ų118132.5 Ų132.572%0.71581%0.811SS**  trans-94.4104.3169.8177.80000107.8V184V182-V184 HydrophobicContact CG1-CG2 4.32Å
183C33.3Very low39.6Very low105 Ų105132.8 Ų132.871%0.70981%0.813SS**  trans-76.6120.4161.3-55.30000107.7T185C183-T185 PolarHBondContact O-N 2.95Å
184V37Very low40.1Very low139 Ų139133.2 Ų133.284%0.84282%0.816SS**  trans-88.395.6165.3-178.30000107V182V182-V184 HydrophobicContact CG1-CG2 4.32Å
185T38.3Very low40.4Very low117 Ų117131 Ų13172%0.71881%0.814SS**  trans-96.9123.4165.250.20000109.7C183 S187C183-T185 PolarHBondContact O-N 2.95Å; T185-S187 PolarHBondContact O-N 2.95Å
186L41.2Very low40Very low181 Ų181128.7 Ų128.795%0.94881%0.814SS**  trans-35117.1164.6-15777.7000112.3
187S37.7Very low40.3Very low111 Ų111134.4 Ų134.478%0.77682%0.823SS**  trans-117.8129.4170.955.40000111T185T185-S187 PolarHBondContact O-N 2.95Å
188K37Very low40.7Very low209 Ų209136.2 Ų136.291%0.90982%0.823SS**PPolyproline II helixtrans-81.5120.7-173.7-170.2166.1176.2178.80108.5
189S45.4Very low41.5Very low114 Ų114137.9 Ų137.980%0.79782%0.819SS**PPolyproline II helixtrans-68.4135.1179.3-45.70000112
190P54.4Low41.6Very low116 Ų116140.5 Ų140.575%0.75383%0.827SS**PPolyproline II helixtrans-88.3159165.332.5-29.6000112.4
191P53Low41.7Very low115 Ų115134.3 Ų134.375%0.74783%0.825SS**PPolyproline II helixtrans-80.2157.7-174.633.3-35.2000113
192P56.1Low41.8Very low130 Ų130135.9 Ų135.984%0.84483%0.831SS**PPolyproline II helixtrans-77128.6176.629.3-31.8000112.5
193S41.7Very low41.6Very low120 Ų120133.7 Ų133.784%0.83983%0.832SS**PPolyproline II helixtrans-68.9137.7167-81.30000111.7G195S193-G195 PolarHBondContact O-N 3.47Å
194A43.2Very low41.8Very low109 Ų109134.2 Ų134.290%0.90184%0.837SS**PPolyproline II helixtrans-62.1123.9166.200000110.9
195G37.9Very low41.8Very low76 Ų76132.8 Ų132.878%0.78483%0.833SS**  trans-119.3120.8168.100000108.8S193S193-G195 PolarHBondContact O-N 3.47Å
196G33.5Very low42.1Very low82 Ų82136 Ų13685%0.84584%0.84SS**  trans-76.2156.3-174.400000114.7
197M39.8Very low41.8Very low196 Ų196134.2 Ų134.297%0.96683%0.832SS**  trans-130.8130.9161.4-84.1165.117000108.7
198T48.1Very low42Very low142 Ų142135.8 Ų135.887%0.87184%0.837SS**  trans-79.3170.6179.128.60000112.4
199P50.7Low41.8Very low117 Ų117133.9 Ų133.976%0.7683%0.828SS**  trans-98.4154.1-151.337.4-32.8000114.3
200Q41.1Very low41.4Very low201 Ų201136.2 Ų136.294%0.93983%0.828SS**  trans-141136.5150.4-86.2-162.66.400111.4
201A37.9Very low41.2Very low100 Ų100136.4 Ų136.483%0.82683%0.83SS**  trans-94.7142.7-174.900000112
202R34.8Very low40.4Very low255 Ų255134.4 Ų134.496%0.96283%0.83SS**  trans-177128.8133.5-120-179.7-174.5-169.11.6112.1
203G32.3Very low39.3Very low72 Ų72132.6 Ų132.674%0.74283%0.826SS**  trans113.2102135.600000119.1
204S36.8Very low39.1Very low116 Ų116138.4 Ų138.481%0.81183%0.83SS**  trans57.4107.4139.6-62.70000120
205S36.8Very low38.6Very low109 Ų109143.9 Ų143.976%0.76283%0.829SS**  78.898.386.5-168.10000113.9
206H43.8Very low38.7Very low185 Ų185145.1 Ų145.186%0.85682%0.821SS**  -164.7137.2125.739.5-82.9000110.8
207D35.1Very low38.9Very low144 Ų144145.4 Ų145.477%0.7782%0.815SS**  trans-79.7127.3-176.5-166.4-61000110.1
208T41.6Very low38.8Very low144 Ų144145.2 Ų145.288%0.88381%0.809SS**  trans-154.8134.5137.9-29.30000112
209K32.9Very low38.4Very low169 Ų169149.9 Ų149.974%0.73581%0.811SS**  trans-82.8126.1-167.3178.5-177.8177.1-1770113.9
210M37.6Very low37.7Very low162 Ų162149 Ų14980%0.79881%0.813SS**  trans69168.4135.8-58.9-70.1-17500120.9
211P49.9Very low38Very low120 Ų120145.2 Ų145.278%0.77980%0.804SS**  cis-132.6168.4-43.434.8-18.6000112.3
212G36.2Very low38.3Very low74 Ų74146.5 Ų146.576%0.76380%0.804SS**  trans167.467.1168.500000114.7
213A33.3Very low38.6Very low91 Ų91142.9 Ų142.975%0.75280%0.797SS**  trans-74.1123.6173.700000111.4
214W38.3Very low39Very low243 Ų243143.3 Ų143.392%0.9279%0.794SS**  trans-137.288.5147.3-68.590.7000107.6
215Y31.3Very low39.3Very low224 Ų224142.1 Ų142.188%0.87879%0.791SS**  trans-78.1114.6162.9-113.9-92.1000107.2
216V41.1Very low40.1Very low102 Ų102142.6 Ų142.662%0.61879%0.791SS**  trans-106.495.6163.2-168.40000106.9F218V216-F218 HydrophobicContact CB-CE2 4.42Å; V216-F218 HydrophobicContact CG1-CD2 4.09Å; V216-F218 HydrophobicContact CG1-CE2 3.61Å; V216-F218 HydrophobicContact CG1-CZ 3.97Å; V216-F218 PolarHBondContact O-N 3.18Å
217A37.9Very low39.8Very low87 Ų87141.8 Ų141.872%0.71979%0.792SS**  trans-78.2106172.400000109R219A217-R219 PolarHBondContact O-N 2.76Å
218F37.9Very low39.9Very low193 Ų193144.3 Ų144.385%0.84680%0.797SS**  trans-81.2101.1164.9-75.5-79.8000109.1V216 A220V216-F218 HydrophobicContact CB-CE2 4.42Å; V216-F218 HydrophobicContact CG1-CD2 4.09Å; V216-F218 HydrophobicContact CG1-CE2 3.61Å; V216-F218 HydrophobicContact CG1-CZ 3.97Å; V216-F218 PolarHBondContact O-N 3.18Å; F218-A220 PolarHBondContact O-N 2.78Å
219R38.3Very low40Very low239 Ų239142.8 Ų142.890%0.90279%0.787SS**  trans-73.4106.9164.5-126.3-177.5-176.1-164.11.6107.5A217 V221A217-R219 PolarHBondContact O-N 2.76Å; R219-V221 PolarHBondContact O-N 2.96Å
220A37.6Very low40.5Very low99 Ų99140.3 Ų140.382%0.81879%0.789SS**  trans-75.2112.6169.100000109.1F218F218-A220 PolarHBondContact O-N 2.78Å
221V47.6Very low40.6Very low121 Ų121138.7 Ų138.773%0.73379%0.788SS**  trans-90.5120.8168.8177.10000107.7R219 H223R219-V221 PolarHBondContact O-N 2.96Å; V221-H223 PolarHBondContact O-N 2.88Å
222P43.5Very low40.1Very low127 Ų127138.3 Ų138.383%0.82579%0.788SS**  trans-81.4106.9171.729.9-28.4000109.1
223H40.4Very low40.3Very low180 Ų180140.6 Ų140.683%0.83379%0.792SS**PPolyproline II helixtrans-86116.7168.5-162.8-94.6000109.2V221V221-H223 PolarHBondContact O-N 2.88Å
224A40.4Very low40.5Very low81 Ų81140.6 Ų140.667%0.66979%0.787SS**PPolyproline II helixtrans-62.5133.1174.300000110.7
225A44.5Very low40.4Very low91 Ų91138.3 Ų138.375%0.75278%0.784SS**PPolyproline II helixtrans-88.5130169.300000109.2
226P52.1Low41.3Very low118 Ų118133 Ų13377%0.76678%0.776SS**PPolyproline II helixtrans-78.7131.9173.528.6-29.2000111F228P226-F228 PolarHBondContact O-N 3.03Å
227L38.7Very low41.2Very low168 Ų168135.4 Ų135.488%0.8879%0.785SS**PPolyproline II helixtrans-65.9119.5167.9-65.5166.2000108.8
228F36.5Very low41.2Very low197 Ų197139.4 Ų139.486%0.86480%0.795SS**  trans-97.8110.5169.3-133.8-96.2000108.8P226P226-F228 PolarHBondContact O-N 3.03Å
229V43.3Very low41.3Very low113 Ų113138.1 Ų138.169%0.68579%0.791SS**  trans-101.4124169.7-175.70000106.7
230P43.8Very low41.2Very low117 Ų117132.8 Ų132.876%0.7679%0.789SS**  trans-95.4112.8160.628.9-22.6000109.8
231T39.5Very low41.2Very low127 Ų127139.4 Ų139.478%0.77979%0.793SS**  trans-72.8149.5163.932.80000111.7
232S39.2Very low40.6Very low112 Ų112138.7 Ų138.778%0.78379%0.793SS**  trans-49.8149.9177.156.90000116.6
233S41.1Very low40.4Very low122 Ų122137.2 Ų137.285%0.85379%0.786SS**  trans-162.3135.8130.357.40000113.2
234S38.1Very low40.3Very low91 Ų91137 Ų13764%0.63679%0.785SS**  trans-59.8169.3-176.6-52.60000119.5
235F36.1Very low40Very low196 Ų196140.1 Ų140.186%0.8679%0.79SS**  trans103.5151.2149.1-56.7-67.7000118.2
236P50.9Low39.9Very low111 Ų111144.1 Ų144.172%0.72180%0.799SS**  cis-132.4176.1-48.436.2-19.9000113.8
237L38.2Very low39.3Very low153 Ų153145.8 Ų145.880%0.80180%0.8SS**  trans-20.4132.3165.4-73.8136.5000117.5
238N38.1Very low39Very low172 Ų172147.1 Ų147.192%0.9280%0.802SS**  trans-131.4126.2143.1-108.9-26.7000111.1
239H39.8Very low38.9Very low165 Ų165143.1 Ų143.176%0.76480%0.798SS**  trans-97.1120.3-175.1-152.8-64.6000107
240C35.8Very low38.4Very low128 Ų128142.7 Ų142.787%0.86580%0.8SS**  trans-153.883.9165.7-98.10000107.8
241R37.1Very low38.1Very low237 Ų237142.6 Ų142.689%0.89480%0.801SS**  76.294.995.4-155.3177.9-170.9-134.62.3112.5
242S36.5Very low38.1Very low106 Ų106144.8 Ų144.874%0.74180%0.802SS**  trans-73.2136.3156.8176.90000109.6
243S37.6Very low37.8Very low96 Ų96150.9 Ų150.967%0.67181%0.808SS**  141.8139.8128.9-690000114
244Q39.8Very low37.6Very low175 Ų175152.4 Ų152.482%0.81881%0.806SS**  trans106.8106.5149.2-51.2-161.82.400118.2
245N33.7Very low38.1Very low147 Ų147153.7 Ų153.779%0.78681%0.812SS**  40.1122.8124.7-69.7-60.5000118.6
246L42.1Very low38.4Very low176 Ų176151.8 Ų151.892%0.92181%0.81SS**  -162.6137.9116.2-101.7159.8000111.3
247L39Very low38Very low153 Ų153153.9 Ų153.980%0.80181%0.814SS**  trans-63.5142.5167.6-120.675.4000109.8
248E33Very low38.1Very low195 Ų195154.4 Ų154.491%0.91181%0.813SS**  -170140.3121-107.4-173.6115.200112.8
249S34.8Very low38Very low113 Ų113154.9 Ų154.979%0.7981%0.809SS**  trans-61.4147.8178.5-56.80000113.2
250S33.2Very low37.8Very low104 Ų104151.9 Ų151.973%0.72781%0.807SS**  -174.6118.2117.7-159.70000111H252S250-H252 PolarHBondContact O-N 3.03Å
251C37.4Very low38.3Very low115 Ų115156.6 Ų156.678%0.77781%0.806SS**  trans-62.5124.7164.4-61.70000109.2
252H37.9Very low38.3Very low174 Ų174150.1 Ų150.181%0.80680%0.804SS**  trans-164.6128.2145-84.1-42.4000112.7S250S250-H252 PolarHBondContact O-N 3.03Å
253R33.8Very low38.6Very low240 Ų240152.4 Ų152.491%0.90681%0.806SS**  trans70.8110.1145.9-99.6176.7-159.4-140.83.7120.9
254L36.8Very low38.8Very low154 Ų154153.5 Ų153.581%0.80681%0.809SS**  trans-55.2157.2143.5-70.4163.7000110.9
255P49.3Very low38.8Very low118 Ų118149.6 Ų149.677%0.76681%0.807SS**  -133.7147.581.625.4-5.9000115.5
256L40.8Very low39.2Very low156 Ų156150.4 Ų150.482%0.81781%0.81SS**  trans-20.9123.5153.5-77.4149.3000114.9
257L43.6Very low39Very low154 Ų154151 Ų15181%0.80681%0.808SS**  trans-107.9114.8154.7-123.1119.7000109.5
258Q39.8Very low38.8Very low165 Ų165148.2 Ų148.277%0.77181%0.807SS**  trans-88.5103.7177.4177.3150.4-23.900107.9S260Q258-S260 PolarHBondContact O-N 3.08Å; Q258-S260 VanDerWaalsContact O-N 3.08Å
259E36Very low39.1Very low181 Ų181150.5 Ų150.585%0.84681%0.807SS**  trans-78.494175.1-70.8-93.4106.400108.9
260S36.3Very low39.9Very low102 Ų102150.7 Ų150.771%0.71381%0.806SS**  trans-83.8120.217451.50000111.4Q258Q258-S260 PolarHBondContact O-N 3.08Å; Q258-S260 VanDerWaalsContact O-N 3.08Å
261R45.4Very low40Very low228 Ų228155 Ų15586%0.8681%0.814SS**  trans1.1112.4151.5-64.5167.180.9174.24.2116
262A37.5Very low40.4Very low101 Ų101153.8 Ų153.884%0.83581%0.813SS**  trans-86.2109.9153.800000109.4
263L43Very low40.4Very low153 Ų153153.5 Ų153.580%0.80182%0.818SS**  trans-78.3114.6162.1-102.7156.8000107.4A265L263-A265 PolarHBondContact O-N 3.5Å
264V42.8Very low41.1Very low119 Ų119144.7 Ų144.772%0.72180%0.801SS**  trans-87.7102.6164.81760000107.2L266V264-L266 HydrophobicContact CG1-CD1 4.43Å
265A39.5Very low41.4Very low93 Ų93144.4 Ų144.477%0.76981%0.806SS**  trans-85117.1162.600000108L263L263-A265 PolarHBondContact O-N 3.5Å
266L42.3Very low41.1Very low164 Ų164149.2 Ų149.286%0.85981%0.809SS**  trans-99.799164.9-100.3152.6000107.1V264V264-L266 HydrophobicContact CG1-CD1 4.43Å
267E37.7Very low41.8Very low190 Ų190146.4 Ų146.489%0.88880%0.8SS**  trans-87.2127.1165.7-173158.2108.500108.3
268A34.7Very low41.9Very low94 Ų94146.8 Ų146.878%0.77780%0.797SS**  trans-145.1109.5168.500000109.9
269R39.4Very low42.2Very low242 Ų242144.3 Ų144.391%0.91380%0.798SS**  trans-147.2163.9154.7-86.1-163.4172.9-167.8-1.6106.1
270P50Low42.4Very low117 Ų117138.5 Ų138.576%0.7679%0.787SS**  cis-136.31727.336.4-18000114.4
271Q35.3Very low43.1Very low194 Ų194139.1 Ų139.191%0.90779%0.791SS**  -160.2137.4128.8-141.1176.8-3500112
272A46.3Very low43.2Very low91 Ų91135.7 Ų135.775%0.75279%0.785SS**  trans-77.6149.3176.800000111.7
273D38.8Very low43.7Very low168 Ų168143.7 Ų143.790%0.89880%0.802SS**  trans-147.5136.1133.8-150.8-4.9000109.8
274G48Very low43.7Very low54 Ų54143.3 Ų143.356%0.55780%0.802SS**  trans-100.2142.9-170.600000111.8
275T42Very low43.8Very low148 Ų148144.5 Ų144.591%0.90881%0.806SS**  trans-160.1110144.4-16.80000110.2
276R43.6Very low44Very low219 Ų219147.4 Ų147.483%0.82681%0.808SS**  trans-98.6157.6147.4-133.3-159.6171.4-161.1-1105
277P55.1Low44.1Very low97 Ų97146.4 Ų146.463%0.6381%0.805SS**  -156.6174.96343.7-23.1000117.6
278H45.9Very low44.5Very low162 Ų162143.7 Ų143.775%0.7580%0.8SS**  trans56146.9156.2-70-72.2000118.8
279S46.4Very low45.1Very low114 Ų114147 Ų14780%0.79780%0.801SS**  cis-158.8146.122.1-157.90000105.4
280G40Very low45.6Very low59 Ų59140.2 Ų140.261%0.60879%0.793SS**  93.511473.500000111.3
281S50.8Low45.2Very low115 Ų115142 Ų14280%0.80480%0.796SS**  trans57.9148.5154.672.90000118.6
282E47.5Very low46Very low156 Ų156137.7 Ų137.773%0.72979%0.787SS**  cis-158.8159.636.6-68.4179.187.200111.4
283F47.9Very low46Very low269 Ų269141.9 Ų141.9100%1.1879%0.79SS**  trans64.50163.7-69.2-75000120.8

Retrieved 283 of 283 residues in 1142.2 ms (Link to these results)