A0A023T778_MOUSE Loading...

Mago homolog B, exon junction complex core component

AlphaFold DB , UniProt , Accession A0A023T778, Species MOUSE (Mus musculus, Mouse), Gene Magohb, Length 148 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M38.8Very low75Confident242 Ų24279 Ų79100%1.19245%0.446SS*.  0101.90-60.7179.9-157.400105.7M3M1-M3 PolarHBondContact O-N 3.2Å
2S39.2Very low77Confident117 Ų11775 Ų7582%0.81842%0.419SS*.  trans-67.8117.7176.858.30000107.3G4S2-G4 PolarHBondContact O-N 3.21Å
3M45.2Very low78.6Confident193 Ų19370.6 Ų70.695%0.95140%0.395SS*.  trans-56.892.9158.8-78.2166.2139.900105.7M1 S5M1-M3 PolarHBondContact O-N 3.2Å; M3-S5 PolarHBondContact O-N 3.43Å
4G55Low79.9Confident53 Ų5365.9 Ų65.955%0.54637%0.37SS..PPolyproline II helixtrans-61.1126.7170.600000105.7S2 D6S2-G4 PolarHBondContact O-N 3.21Å; G4-D6 PolarHBondContact O-N 2.8Å; G4-D6 VanDerWaalsContact O-N 3.14Å
5S66.7Low80.9Confident67 Ų6764.8 Ų64.847%0.46936%0.361SS..PPolyproline II helixtrans-48.4124178.245.50000109.4M3 F7 K63M3-S5 PolarHBondContact O-N 3.43Å; S5-F7 PolarHBondContact O-N 3.14Å; S5-K63 PolarHBondContact OG-NZ 2.86Å; S5-K63 VanDerWaalsContact OG-NZ 3.14Å
6D88.2Confident81.4Confident111 Ų11171.2 Ų71.259%0.59438%0.383SS*.PPolyproline II helixtrans-56.3127178.2-79-23.6000107.8G4 V93 G95G4-D6 PolarHBondContact O-N 2.8Å; G4-D6 VanDerWaalsContact O-N 3.14Å; D6-V93 HydrophobicContact CB-CG1 4.35Å; D6-G95 PolarHBondContact O-N 3.24Å
7F96.8Very high81.5Confident6 Ų669 Ų693%0.02638%0.381CS..EExtended strand (participates in β ladder)trans-133.6123.7-179.7-178.8-94.5000110.4S5 L9 F28 P30 M59 L62 K63 I66 V93 I94S5-F7 PolarHBondContact O-N 3.14Å; F7-L9 HydrophobicContact CE1-CB 4.31Å; F7-L9 HydrophobicContact CZ-CB 4.13Å; F7-L9 HydrophobicContact CZ-CD1 4.5Å; F7-F28 HydrophobicContact CE1-CB 4.28Å; F7-P30 WeakPolarHBondContact O-CA 3.31Å; F7-P30 WeakPolarHBondContact O-CG 3.34Å; F7-M59 HydrophobicContact CD1-CE 3.36Å; F7-M59 HydrophobicContact CE1-CE 3.67Å; F7-L62 HydrophobicContact CE1-CB 4.36Å; F7-L62 HydrophobicContact CE1-CD1 4.43Å; F7-L62 HydrophobicContact CZ-CB 3.85Å; F7-K63 VanDerWaalsContact CB-CE 3.47Å; F7-K63 HydrophobicContact CD2-CD 4.16Å; F7-K63 HydrophobicContact CD2-CG 3.45Å; F7-K63 VanDerWaalsContact CD2-CG 3.45Å; F7-K63 HydrophobicContact CE2-CG 3.54Å; F7-K63 HydrophobicContact CG-CG 4.16Å; F7-K63 HydrophobicContact CZ-CG 4.34Å; F7-I66 HydrophobicContact CE2-CD1 3.62Å; F7-I66 HydrophobicContact CZ-CD1 3.87Å; F7-V93 CarbonylContact C-O 3.59Å; F7-V93 VanDerWaalsContact CA-O 3.27Å; F7-V93 WeakPolarHBondContact CA-O 2.96Å; F7-I94 HydrophobicContact CD2-CB 4.39Å; F7-I94 HydrophobicContact CD2-CD1 4.41Å; F7-I94 HydrophobicContact CD2-CG1 4.3Å; F7-I94 HydrophobicContact CE2-CD1 4.42Å
8Y98.4Very high81.5Confident45 Ų4576.1 Ų76.118%0.17641%0.408CS..EExtended strand (participates in β ladder)trans-140.6140.3175.1178.6-104.4000109R10 E27 E91 I92 V93Y8-R10 HydrophobicContact CE1-CB 3.82Å; Y8-R10 WeakPolarHBondContact OH-CB 3.37Å; Y8-R10 WeakPolarHBondContact OH-CD 3.43Å; Y8-E27 HydrophobicContact CE2-CG 3.62Å; Y8-E27 VanDerWaalsContact CE2-OE1 3.25Å; Y8-E27 WeakPolarHBondContact CE2-OE1 3.41Å; Y8-E27 PolarHBondContact OH-OE1 3.3Å; Y8-E91 HydrophobicContact CD1-CG 4.28Å; Y8-E91 HydrophobicContact CE1-CB 4.39Å; Y8-E91 HydrophobicContact CE1-CG 4Å; Y8-I92 CarbonylContact O-C 3.59Å; Y8-I92 VanDerWaalsContact O-CA 3.31Å; Y8-I92 WeakPolarHBondContact O-CA 3.17Å; Y8-V93 HydrophobicContact CD1-CG2 4.47Å; Y8-V93 PolarHBondContact N-O 3.32Å; Y8-V93 PolarHBondContact O-N 3.24Å
9L98.8Very high81.4Confident0 Ų079.9 Ų79.90%042%0.421CS..EExtended strand (participates in β ladder)trans-140.7129.1171.7-175.3159.4000108.9F7 F26 E27 F28 L62 I66 E91 I92 L131F7-L9 HydrophobicContact CE1-CB 4.31Å; F7-L9 HydrophobicContact CZ-CB 4.13Å; F7-L9 HydrophobicContact CZ-CD1 4.5Å; L9-F26 HydrophobicContact CD2-CD2 4.06Å; L9-F26 HydrophobicContact CD2-CE2 3.73Å; L9-E27 CarbonylContact O-C 3.51Å; L9-E27 VanDerWaalsContact O-CA 3.26Å; L9-E27 WeakPolarHBondContact O-CA 3.27Å; L9-F28 HydrophobicContact CB-CB 4.38Å; L9-F28 HydrophobicContact CD2-CD2 4.23Å; L9-F28 PolarHBondContact N-O 3.19Å; L9-F28 VanDerWaalsContact N-O 3.11Å; L9-F28 PolarHBondContact O-N 2.64Å; L9-L62 HydrophobicContact CD1-CD2 4.33Å; L9-I66 HydrophobicContact CD1-CD1 3.7Å; L9-I66 HydrophobicContact CD1-CG1 4.43Å; L9-E91 CarbonylContact C-O 3.59Å; L9-E91 WeakPolarHBondContact CA-O 3.28Å; L9-I92 HydrophobicContact CG-CG1 4.19Å; L9-L131 HydrophobicContact CD1-CD1 3.96Å; L9-L131 HydrophobicContact CD1-CD2 3.66Å; L9-L131 HydrophobicContact CD1-CG 4.47Å; L9-L131 HydrophobicContact CD2-CD1 4.43Å
10R98.9Very high81.6Confident35 Ų3577.7 Ų77.713%0.13242%0.418CS..EExtended strand (participates in β ladder)trans-132.3132.7167.4-174.1-176.766.286.14.3110.2Y8 E25 F26 E27 E89 L90 E91Y8-R10 HydrophobicContact CE1-CB 3.82Å; Y8-R10 WeakPolarHBondContact OH-CB 3.37Å; Y8-R10 WeakPolarHBondContact OH-CD 3.43Å; R10-E25 IonicContact NH1-OE1 2.67Å; R10-E25 PolarHBondContact NH1-OE1 2.93Å; R10-F26 WeakPolarHBondContact CA-O 3.32Å; R10-E27 HydrophobicContact CG-CB 4.41Å; R10-E89 IonicContact CZ-OE2 3.98Å; R10-E89 IonicContact NH1-OE2 2.74Å; R10-E89 PolarHBondContact NH1-OE2 3.06Å; R10-E89 IonicContact NH2-OE2 3.49Å; R10-E89 PolarHBondContact NH2-OE2 3.44Å; R10-L90 WeakPolarHBondContact O-CA 3.42Å; R10-E91 HydrophobicContact CB-CB 4.43Å; R10-E91 IonicContact CZ-OE2 3.64Å; R10-E91 PolarHBondContact N-O 3.45Å; R10-E91 IonicContact NE-OE2 3.17Å; R10-E91 PolarHBondContact NE-OE2 3.35Å; R10-E91 IonicContact NH2-OE2 3.92Å; R10-E91 PolarHBondContact NH2-OE2 3.4Å; R10-E91 PolarHBondContact O-N 3.43Å
11Y98.9Very high82.1Confident0 Ų077 Ų770%041%0.412CS..EExtended strand (participates in β ladder)trans-125.3133.8170.1173.4-99.5000110V13 E25 F26 Q88 E89 L90 V128 K132Y11-V13 HydrophobicContact CE1-CB 3.96Å; Y11-V13 HydrophobicContact CE1-CG1 3.61Å; Y11-V13 WeakPolarHBondContact OH-CB 3.4Å; Y11-E25 VanDerWaalsContact O-CA 3.27Å; Y11-E25 WeakPolarHBondContact O-CA 3.5Å; Y11-F26 HydrophobicContact CD1-CD1 4.16Å; Y11-F26 AromaticContact CD1-CE1 3.43Å; Y11-F26 HydrophobicContact CD1-CE1 3.43Å; Y11-F26 VanDerWaalsContact CD1-CE1 3.43Å; Y11-F26 HydrophobicContact CD1-CE2 4.48Å; Y11-F26 AromaticContact CD1-CZ 3.62Å; Y11-F26 HydrophobicContact CD1-CZ 3.62Å; Y11-F26 HydrophobicContact CE1-CE1 4.26Å; Y11-F26 HydrophobicContact CG-CE1 4.12Å; Y11-F26 HydrophobicContact CG-CE2 4.39Å; Y11-F26 AromaticContact CG-CZ 3.85Å; Y11-F26 HydrophobicContact CG-CZ 3.85Å; Y11-F26 PolarHBondContact N-O 3.04Å; Y11-F26 PolarHBondContact O-N 2.89Å; Y11-Q88 PolarHBondContact OH-NE2 2.84Å; Y11-E89 WeakPolarHBondContact CA-O 3.32Å; Y11-E89 WeakPolarHBondContact CD2-O 3.37Å; Y11-L90 HydrophobicContact CD2-CD1 4.35Å; Y11-V128 HydrophobicContact CD2-CG1 4.4Å; Y11-V128 HydrophobicContact CD2-CG2 3.96Å; Y11-V128 HydrophobicContact CE1-CG1 4.17Å; Y11-V128 HydrophobicContact CE2-CB 4.23Å; Y11-V128 HydrophobicContact CE2-CG1 3.57Å; Y11-V128 HydrophobicContact CE2-CG2 3.54Å; Y11-V128 VanDerWaalsContact CZ-CG1 3.41Å; Y11-V128 VanDerWaalsContact OH-CG1 3.24Å; Y11-V128 WeakPolarHBondContact OH-CG1 3.49Å; Y11-K132 WeakPolarHBondContact OH-CE 3.46Å; Y11-K132 PolarHBondContact OH-NZ 3.25Å
12Y98.7Very high84.7Confident31 Ų3167.7 Ų67.712%0.12237%0.365CS..EExtended strand (participates in β ladder)trans-127.3140173.2168-85.6000109.8H21 F23 L24 E25 R87 Q88 E89Y12-H21 AromaticContact CZ-NE2 3.98Å; Y12-H21 PolarHBondContact OH-NE2 2.77Å; Y12-F23 HydrophobicContact CD2-CB 4.46Å; Y12-F23 HydrophobicContact CD2-CD2 4.35Å; Y12-F23 HydrophobicContact CE2-CB 3.63Å; Y12-F23 AromaticContact CE2-CD2 3.98Å; Y12-F23 HydrophobicContact CE2-CD2 3.98Å; Y12-F23 AromaticContact CE2-CG 3.97Å; Y12-F23 HydrophobicContact CE2-CG 3.97Å; Y12-L24 WeakPolarHBondContact CA-O 3.29Å; Y12-E25 HydrophobicContact CD2-CB 4.15Å; Y12-E25 HydrophobicContact CD2-CG 4.41Å; Y12-R87 HydrophobicContact CE1-CB 4.37Å; Y12-R87 HydrophobicContact CE1-CG 4.48Å; Y12-Q88 CarbonylContact O-C 3.59Å; Y12-Q88 VanDerWaalsContact O-CA 3.27Å; Y12-Q88 WeakPolarHBondContact O-CA 3.25Å; Y12-E89 HydrophobicContact CD1-CG 4.16Å; Y12-E89 PolarHBondContact N-O 3.37Å; Y12-E89 PolarHBondContact O-N 2.88Å
13V98.1Very high87.4Confident18 Ų1863.7 Ų63.711%0.10933%0.333CS..EExtended strand (participates in β ladder)trans-139132.2163.557.50000109.5Y11 F23 L24 R87 Q88Y11-V13 HydrophobicContact CE1-CB 3.96Å; Y11-V13 HydrophobicContact CE1-CG1 3.61Å; Y11-V13 WeakPolarHBondContact OH-CB 3.4Å; V13-F23 CarbonylContact O-C 3.48Å; V13-F23 WeakPolarHBondContact O-CA 3.46Å; V13-F23 WeakPolarHBondContact O-CB 3.25Å; V13-L24 HydrophobicContact CG1-CB 3.88Å; V13-L24 HydrophobicContact CG1-CD2 4.34Å; V13-L24 HydrophobicContact CG1-CG 4.47Å; V13-L24 PolarHBondContact N-O 2.95Å; V13-L24 PolarHBondContact O-N 3.26Å; V13-R87 VanDerWaalsContact CA-O 3.32Å; V13-R87 WeakPolarHBondContact CA-O 3.47Å; V13-Q88 HydrophobicContact CB-CG 4.02Å; V13-Q88 HydrophobicContact CG2-CG 3.73Å
14G96.6Very high89.8Confident4 Ų455.3 Ų55.34%0.04129%0.292CS..EExtended strand (participates in β ladder)trans-166166.7177.700000113.5E22 G86 R87G14-E22 CarbonylContact C-O 3.57Å; G14-E22 WeakPolarHBondContact CA-O 3.09Å; G14-G86 CarbonylContact O-C 3.53Å; G14-G86 VanDerWaalsContact O-CA 3.32Å; G14-G86 WeakPolarHBondContact O-CA 3.36Å; G14-R87 PolarHBondContact N-O 3.45Å; G14-R87 PolarHBondContact O-N 2.98Å
15H94.6Very high91.9Very high50 Ų5055.6 Ų55.623%0.23128%0.279CS..EExtended strand (participates in β ladder)trans-150.5157.1177.272.5-63.4000110.2H21 E22 V85H15-H21 PolarHBondContact O-CD2 3.32Å; H15-E22 IonicContact CE1-OE2 3.92Å; H15-E22 PolarHBondContact CE1-OE2 3.12Å; H15-E22 PolarHBondContact N-O 2.96Å; H15-E22 IonicContact NE2-OE2 3.49Å; H15-E22 PolarHBondContact O-N 3.2Å; H15-V85 WeakPolarHBondContact CB-O 3.46Å
16K88.9Confident93.4Very high167 Ų16752.4 Ų52.473%0.72626%0.257SS*.EExtended strand (participates in β ladder)trans-106.297.6174-71.4-176.7178.6178.20108.5H21K16-H21 HydrophobicContact CG-CB 4.11Å
17G83.9Confident93.9Very high34 Ų3448.4 Ų48.435%0.35124%0.235SC..EExtended strand (participates in β ladder)trans-93.7-173.7178.500000112.9F19 G20G17-F19 PolarHBondContact O-N 3.03Å; G17-F19 VanDerWaalsContact O-N 3.16Å; G17-G20 PolarHBondContact N-O 3.04Å; G17-G20 PolarHBondContact O-N 3.14Å; G17-G20 VanDerWaalsContact O-N 3.16Å
18K81.9Confident94Very high196 Ų19648.1 Ų48.185%0.85223%0.233SC*.THydrogen-bonded Turntrans-56.8-28.9175.8-176.2178.8178.3-178.40113
19F78.9Confident94Very high149 Ų14950.9 Ų50.965%0.65424%0.244SC*.THydrogen-bonded Turntrans-9914.9-175.6-55.1-71.1000113.1G17 N41G17-F19 PolarHBondContact O-N 3.03Å; G17-F19 VanDerWaalsContact O-N 3.16Å; F19-N41 HydrophobicContact CB-CB 4.16Å; F19-N41 WeakPolarHBondContact O-CB 3.37Å; F19-N41 PolarHBondContact O-ND2 3.47Å
20G86.5Confident93.9Very high35 Ų3555.1 Ų55.136%0.36127%0.271SS..EExtended strand (participates in β ladder)trans103.2-158.3179.700000113.1G17G17-G20 PolarHBondContact N-O 3.04Å; G17-G20 PolarHBondContact O-N 3.14Å; G17-G20 VanDerWaalsContact O-N 3.16Å
21H90.9Very high93.8Very high65 Ų6557.4 Ų57.430%0.30129%0.286SS..EExtended strand (participates in β ladder)trans-92.5115.1-176.9-175.8-167.1000110.3Y12 H15 K16 F23 N39 N41Y12-H21 AromaticContact CZ-NE2 3.98Å; Y12-H21 PolarHBondContact OH-NE2 2.77Å; H15-H21 PolarHBondContact O-CD2 3.32Å; K16-H21 HydrophobicContact CG-CB 4.11Å; H21-F23 AromaticContact CE1-CD1 3.85Å; H21-F23 AromaticContact NE2-CD1 3.82Å; H21-N39 PolarHBondContact O-ND2 2.63Å; H21-N41 PolarHBondContact O-ND2 3.28Å
22E93.2Very high93.7Very high45 Ų4557.7 Ų57.721%0.2129%0.289CS..EExtended strand (participates in β ladder)trans-108.2133.6173.1-63.7-173.5106.100109.6G14 H15 N39 N41G14-E22 CarbonylContact C-O 3.57Å; G14-E22 WeakPolarHBondContact CA-O 3.09Å; H15-E22 IonicContact CE1-OE2 3.92Å; H15-E22 PolarHBondContact CE1-OE2 3.12Å; H15-E22 PolarHBondContact N-O 2.96Å; H15-E22 IonicContact NE2-OE2 3.49Å; H15-E22 PolarHBondContact O-N 3.2Å; E22-N39 CarbonylContact C-O 3.54Å; E22-N39 WeakPolarHBondContact CA-O 3.29Å; E22-N41 HydrophobicContact CG-CB 4.16Å; E22-N41 PolarHBondContact OE1-N 3.41Å
23F95.4Very high93.7Very high33 Ų3357.9 Ų57.915%0.14529%0.29CS..EExtended strand (participates in β ladder)trans-156.2159.4-179.272.5-87.5000113.2Y12 V13 H21 E25 A37 N38 N39 M47Y12-F23 HydrophobicContact CD2-CB 4.46Å; Y12-F23 HydrophobicContact CD2-CD2 4.35Å; Y12-F23 HydrophobicContact CE2-CB 3.63Å; Y12-F23 AromaticContact CE2-CD2 3.98Å; Y12-F23 HydrophobicContact CE2-CD2 3.98Å; Y12-F23 AromaticContact CE2-CG 3.97Å; Y12-F23 HydrophobicContact CE2-CG 3.97Å; V13-F23 CarbonylContact O-C 3.48Å; V13-F23 WeakPolarHBondContact O-CA 3.46Å; V13-F23 WeakPolarHBondContact O-CB 3.25Å; H21-F23 AromaticContact CE1-CD1 3.85Å; H21-F23 AromaticContact NE2-CD1 3.82Å; F23-E25 HydrophobicContact CD2-CB 4.2Å; F23-E25 HydrophobicContact CE2-CB 4.32Å; F23-A37 HydrophobicContact CE2-CB 3.98Å; F23-N38 WeakPolarHBondContact O-CA 3.31Å; F23-N38 PolarHBondContact O-OD1 2.83Å; F23-N39 HydrophobicContact CD1-CB 3.72Å; F23-N39 HydrophobicContact CE1-CB 3.51Å; F23-N39 HydrophobicContact CG-CB 4.47Å; F23-N39 HydrophobicContact CZ-CB 4.13Å; F23-N39 PolarHBondContact N-O 3.16Å; F23-N39 PolarHBondContact O-N 3.33Å; F23-M47 HydrophobicContact CE1-CE 4.23Å; F23-M47 HydrophobicContact CE2-CE 4.07Å; F23-M47 HydrophobicContact CZ-CE 3.41Å; F23-M47 VanDerWaalsContact CZ-CE 3.41Å
24L97.1Very high93.7Very high17 Ų1757.1 Ų57.19%0.08929%0.286CS..EExtended strand (participates in β ladder)trans-127.1129.8167.8167.768.7000107.3Y12 V13 Y36 A37 N38 F136Y12-L24 WeakPolarHBondContact CA-O 3.29Å; V13-L24 HydrophobicContact CG1-CB 3.88Å; V13-L24 HydrophobicContact CG1-CD2 4.34Å; V13-L24 HydrophobicContact CG1-CG 4.47Å; V13-L24 PolarHBondContact N-O 2.95Å; V13-L24 PolarHBondContact O-N 3.26Å; L24-Y36 HydrophobicContact CD1-CD2 4.24Å; L24-Y36 HydrophobicContact CD1-CE2 3.41Å; L24-Y36 VanDerWaalsContact CD1-CE2 3.41Å; L24-A37 CarbonylContact C-O 3.56Å; L24-A37 WeakPolarHBondContact CA-O 3.33Å; L24-N38 HydrophobicContact CD1-CB 4.07Å; L24-F136 HydrophobicContact CD1-CE1 4.19Å; L24-F136 HydrophobicContact CD2-CE1 3.84Å; L24-F136 HydrophobicContact CD2-CZ 3.7Å
25E98.6Very high93.8Very high59 Ų5961.9 Ų61.928%0.27630%0.302SS..EExtended strand (participates in β ladder)trans-136.9138.2175-173.1170.5-133.600110.2R10 Y11 Y12 F23 A37R10-E25 IonicContact NH1-OE1 2.67Å; R10-E25 PolarHBondContact NH1-OE1 2.93Å; Y11-E25 VanDerWaalsContact O-CA 3.27Å; Y11-E25 WeakPolarHBondContact O-CA 3.5Å; Y12-E25 HydrophobicContact CD2-CB 4.15Å; Y12-E25 HydrophobicContact CD2-CG 4.41Å; F23-E25 HydrophobicContact CD2-CB 4.2Å; F23-E25 HydrophobicContact CE2-CB 4.32Å; E25-A37 PolarHBondContact N-O 3.05Å; E25-A37 PolarHBondContact O-N 2.82Å
26F98.8Very high94Very high1 Ų159.8 Ų59.80%0.00429%0.292CS..EExtended strand (participates in β ladder)trans-139.7149.7166.956.1-100.5000111.5L9 R10 Y11 F28 L34 R35 Y36 L131 K132 V135L9-F26 HydrophobicContact CD2-CD2 4.06Å; L9-F26 HydrophobicContact CD2-CE2 3.73Å; R10-F26 WeakPolarHBondContact CA-O 3.32Å; Y11-F26 HydrophobicContact CD1-CD1 4.16Å; Y11-F26 AromaticContact CD1-CE1 3.43Å; Y11-F26 HydrophobicContact CD1-CE1 3.43Å; Y11-F26 VanDerWaalsContact CD1-CE1 3.43Å; Y11-F26 HydrophobicContact CD1-CE2 4.48Å; Y11-F26 AromaticContact CD1-CZ 3.62Å; Y11-F26 HydrophobicContact CD1-CZ 3.62Å; Y11-F26 HydrophobicContact CE1-CE1 4.26Å; Y11-F26 HydrophobicContact CG-CE1 4.12Å; Y11-F26 HydrophobicContact CG-CE2 4.39Å; Y11-F26 AromaticContact CG-CZ 3.85Å; Y11-F26 HydrophobicContact CG-CZ 3.85Å; Y11-F26 PolarHBondContact N-O 3.04Å; Y11-F26 PolarHBondContact O-N 2.89Å; F26-F28 HydrophobicContact CD2-CE2 4.27Å; F26-L34 HydrophobicContact CB-CD1 4.37Å; F26-R35 CarbonylContact C-O 3.53Å; F26-R35 WeakPolarHBondContact CA-O 3.31Å; F26-Y36 HydrophobicContact CB-CD2 4.35Å; F26-L131 HydrophobicContact CE2-CB 4.19Å; F26-L131 HydrophobicContact CZ-CB 3.9Å; F26-K132 HydrophobicContact CE1-CG 4.09Å; F26-V135 HydrophobicContact CB-CG1 4.08Å; F26-V135 HydrophobicContact CB-CG2 4.49Å; F26-V135 HydrophobicContact CD1-CB 4.35Å; F26-V135 HydrophobicContact CD1-CG1 3.99Å; F26-V135 HydrophobicContact CD1-CG2 4.2Å; F26-V135 HydrophobicContact CD2-CG2 3.75Å; F26-V135 HydrophobicContact CE1-CG2 4.33Å; F26-V135 HydrophobicContact CE2-CG2 3.89Å; F26-V135 HydrophobicContact CG-CB 4.43Å; F26-V135 HydrophobicContact CG-CG1 4.02Å; F26-V135 HydrophobicContact CG-CG2 3.9Å; F26-V135 HydrophobicContact CZ-CG2 4.18Å
27E98.8Very high94.4Very high26 Ų2652.2 Ų52.212%0.12126%0.261CS..EExtended strand (participates in β ladder)trans-138.7131.2-175.7179.1-175.2-116.900109.6Y8 L9 R10 R29 L34 R35Y8-E27 HydrophobicContact CE2-CG 3.62Å; Y8-E27 VanDerWaalsContact CE2-OE1 3.25Å; Y8-E27 WeakPolarHBondContact CE2-OE1 3.41Å; Y8-E27 PolarHBondContact OH-OE1 3.3Å; L9-E27 CarbonylContact O-C 3.51Å; L9-E27 VanDerWaalsContact O-CA 3.26Å; L9-E27 WeakPolarHBondContact O-CA 3.27Å; R10-E27 HydrophobicContact CG-CB 4.41Å; E27-R29 HydrophobicContact CG-CG 4.08Å; E27-L34 CarbonylContact O-C 3.59Å; E27-L34 WeakPolarHBondContact O-CA 3.02Å; E27-R35 HydrophobicContact CB-CB 4.37Å; E27-R35 PolarHBondContact N-O 3.49Å; E27-R35 PolarHBondContact O-N 3.27Å; E27-R35 VanDerWaalsContact OE2-CD 3.3Å; E27-R35 WeakPolarHBondContact OE2-CD 3.49Å; E27-R35 IonicContact OE2-CZ 3.86Å; E27-R35 IonicContact OE2-NE 3.37Å; E27-R35 IonicContact OE2-NH1 2.87Å; E27-R35 PolarHBondContact OE2-NH1 2.83Å
28F98.7Very high95Very high0 Ų051.3 Ų51.30%025%0.248CC..EExtended strand (participates in β ladder)trans-108.6118.2166.1-69.2-93000108.9F7 L9 F26 L34 V54 M59 L62 V135 L138F7-F28 HydrophobicContact CE1-CB 4.28Å; L9-F28 HydrophobicContact CB-CB 4.38Å; L9-F28 HydrophobicContact CD2-CD2 4.23Å; L9-F28 PolarHBondContact N-O 3.19Å; L9-F28 VanDerWaalsContact N-O 3.11Å; L9-F28 PolarHBondContact O-N 2.64Å; F26-F28 HydrophobicContact CD2-CE2 4.27Å; F28-L34 HydrophobicContact CD1-CB 4.08Å; F28-L34 HydrophobicContact CD1-CD1 4.27Å; F28-L34 HydrophobicContact CD2-CD1 4.24Å; F28-L34 HydrophobicContact CE1-CB 3.87Å; F28-L34 HydrophobicContact CE1-CD1 3.86Å; F28-L34 HydrophobicContact CE1-CD2 4.15Å; F28-L34 HydrophobicContact CE1-CG 4.16Å; F28-L34 HydrophobicContact CE2-CD1 3.84Å; F28-L34 HydrophobicContact CG-CD1 4.46Å; F28-L34 HydrophobicContact CZ-CD1 3.64Å; F28-L34 HydrophobicContact CZ-CD2 4.16Å; F28-L34 HydrophobicContact CZ-CG 4.3Å; F28-V54 HydrophobicContact CD1-CG2 4.3Å; F28-V54 HydrophobicContact CE1-CG1 4.38Å; F28-V54 HydrophobicContact CE1-CG2 4.26Å; F28-M59 HydrophobicContact CB-CE 4.3Å; F28-M59 HydrophobicContact CD1-SD 3.97Å; F28-L62 HydrophobicContact CB-CD1 4.45Å; F28-L62 HydrophobicContact CD1-CD1 3.53Å; F28-L62 HydrophobicContact CD2-CD1 3.83Å; F28-L62 HydrophobicContact CE1-CD1 3.51Å; F28-L62 HydrophobicContact CE2-CD1 3.81Å; F28-L62 HydrophobicContact CE2-CD2 4.27Å; F28-L62 HydrophobicContact CG-CD1 3.68Å; F28-L62 HydrophobicContact CZ-CD1 3.64Å; F28-V135 HydrophobicContact CE2-CG2 3.62Å; F28-V135 HydrophobicContact CZ-CG2 3.83Å; F28-L138 HydrophobicContact CE1-CD1 4.36Å; F28-L138 HydrophobicContact CZ-CD1 4.18Å
29R98.2Very high95.5Very high104 Ų10443.4 Ų43.439%0.39222%0.215SC..  trans-90.6161.4178.5-64.1-176.775.3-150.48111.3E27 D31 G32 K33 M59E27-R29 HydrophobicContact CG-CG 4.08Å; R29-D31 WeakPolarHBondContact CB-OD1 3.49Å; R29-D31 IonicContact NH1-OD2 2.76Å; R29-D31 PolarHBondContact O-N 3.34Å; R29-D31 VanDerWaalsContact O-N 3.1Å; R29-G32 PolarHBondContact O-N 2.63Å; R29-K33 HydrophobicContact CB-CB 4.26Å; R29-K33 PolarHBondContact N-O 2.71Å; R29-M59 WeakPolarHBondContact O-CE 3.17Å
30P96.4Very high95.7Very high88 Ų8837.3 Ų37.357%0.57119%0.191SC*.THydrogen-bonded Turntrans-58.6-25.7-179.8-24.331.8000114.5F7 G32F7-P30 WeakPolarHBondContact O-CA 3.31Å; F7-P30 WeakPolarHBondContact O-CG 3.34Å; P30-G32 PolarHBondContact O-N 3.1Å
31D96.1Very high95.1Very high83 Ų8338 Ų3844%0.44419%0.187SC..THydrogen-bonded Turntrans-79.44.217763.8-3.5000113.7R29 K33R29-D31 WeakPolarHBondContact CB-OD1 3.49Å; R29-D31 IonicContact NH1-OD2 2.76Å; R29-D31 PolarHBondContact O-N 3.34Å; R29-D31 VanDerWaalsContact O-N 3.1Å; D31-K33 VanDerWaalsContact C-N 3.3Å; D31-K33 WeakPolarHBondContact OD1-CB 3.49Å; D31-K33 PolarHBondContact OD1-N 3.27Å
32G97.3Very high93.7Very high6 Ų642.5 Ų42.56%0.06220%0.202CC..SBendtrans79.79.4-176.900000113.7R29 P30 L34 Y53 V54R29-G32 PolarHBondContact O-N 2.63Å; P30-G32 PolarHBondContact O-N 3.1Å; G32-L34 PolarHBondContact O-N 2.87Å; G32-Y53 WeakPolarHBondContact O-CA 3.03Å; G32-V54 WeakPolarHBondContact O-CG2 3.42Å; G32-V54 PolarHBondContact O-N 2.92Å
33K98.4Very high92.3Very high36 Ų3648.3 Ų48.316%0.15723%0.227CC..EExtended strand (participates in β ladder)trans-74.8114.8175.4-167.4177.9-177.9-177.60110.5R29 D31 R35 E51 Y53R29-K33 HydrophobicContact CB-CB 4.26Å; R29-K33 PolarHBondContact N-O 2.71Å; D31-K33 VanDerWaalsContact C-N 3.3Å; D31-K33 WeakPolarHBondContact OD1-CB 3.49Å; D31-K33 PolarHBondContact OD1-N 3.27Å; K33-R35 HydrophobicContact CD-CG 4.31Å; K33-R35 HydrophobicContact CG-CG 4.19Å; K33-E51 VanDerWaalsContact CE-CD 3.45Å; K33-E51 WeakPolarHBondContact CE-OE2 3.4Å; K33-E51 IonicContact NZ-OE1 3.04Å; K33-E51 IonicContact NZ-OE2 3.67Å; K33-E51 PolarHBondContact NZ-OE2 2.82Å; K33-Y53 HydrophobicContact CB-CD1 4.04Å; K33-Y53 HydrophobicContact CB-CE1 3.73Å; K33-Y53 HydrophobicContact CD-CE1 4.5Å; K33-Y53 HydrophobicContact CG-CE1 4.2Å
34L98.8Very high90.8Very high2 Ų254.1 Ų54.11%0.0126%0.259CS..EExtended strand (participates in β ladder)trans-85.2124.8164.8168.458.5000109.2F26 E27 F28 G32 E51 A52 V54 L138 I139F26-L34 HydrophobicContact CB-CD1 4.37Å; E27-L34 CarbonylContact O-C 3.59Å; E27-L34 WeakPolarHBondContact O-CA 3.02Å; F28-L34 HydrophobicContact CD1-CB 4.08Å; F28-L34 HydrophobicContact CD1-CD1 4.27Å; F28-L34 HydrophobicContact CD2-CD1 4.24Å; F28-L34 HydrophobicContact CE1-CB 3.87Å; F28-L34 HydrophobicContact CE1-CD1 3.86Å; F28-L34 HydrophobicContact CE1-CD2 4.15Å; F28-L34 HydrophobicContact CE1-CG 4.16Å; F28-L34 HydrophobicContact CE2-CD1 3.84Å; F28-L34 HydrophobicContact CG-CD1 4.46Å; F28-L34 HydrophobicContact CZ-CD1 3.64Å; F28-L34 HydrophobicContact CZ-CD2 4.16Å; F28-L34 HydrophobicContact CZ-CG 4.3Å; G32-L34 PolarHBondContact O-N 2.87Å; L34-E51 CarbonylContact O-C 3.59Å; L34-E51 VanDerWaalsContact O-CA 3.25Å; L34-E51 WeakPolarHBondContact O-CA 3.3Å; L34-A52 PolarHBondContact N-O 2.99Å; L34-A52 PolarHBondContact O-N 3.04Å; L34-V54 HydrophobicContact CB-CG1 4.15Å; L34-V54 HydrophobicContact CD2-CG1 4.42Å; L34-L138 HydrophobicContact CD2-CB 4.23Å; L34-L138 HydrophobicContact CD2-CD1 4.17Å; L34-I139 HydrophobicContact CD2-CD1 3.87Å; L34-I139 HydrophobicContact CD2-CG1 4.35Å; L34-I139 HydrophobicContact CG-CD1 4.39Å
35R98.8Very high89.4Confident103 Ų10357.7 Ų57.739%0.38928%0.279SS..EExtended strand (participates in β ladder)trans-116135.5169.9-60.1172.963.9-142.1-0.2108.7F26 E27 K33 E51F26-R35 CarbonylContact C-O 3.53Å; F26-R35 WeakPolarHBondContact CA-O 3.31Å; E27-R35 HydrophobicContact CB-CB 4.37Å; E27-R35 PolarHBondContact N-O 3.49Å; E27-R35 PolarHBondContact O-N 3.27Å; E27-R35 VanDerWaalsContact OE2-CD 3.3Å; E27-R35 WeakPolarHBondContact OE2-CD 3.49Å; E27-R35 IonicContact OE2-CZ 3.86Å; E27-R35 IonicContact OE2-NE 3.37Å; E27-R35 IonicContact OE2-NH1 2.87Å; E27-R35 PolarHBondContact OE2-NH1 2.83Å; K33-R35 HydrophobicContact CD-CG 4.31Å; K33-R35 HydrophobicContact CG-CG 4.19Å; R35-E51 HydrophobicContact CB-CG 4.4Å; R35-E51 HydrophobicContact CG-CG 3.98Å; R35-E51 WeakPolarHBondContact CG-OE1 3.47Å; R35-E51 IonicContact CZ-OE1 3.99Å; R35-E51 IonicContact NE-OE1 2.92Å; R35-E51 PolarHBondContact NE-OE1 3.42Å
36Y98.6Very high88.5Confident6 Ų660.5 Ų60.52%0.02430%0.299CS..EExtended strand (participates in β ladder)trans-135.5132.6-176172.3-83.6000109.7L24 F26 N38 I48 R49 K50 V135 F136 I139 P147L24-Y36 HydrophobicContact CD1-CD2 4.24Å; L24-Y36 HydrophobicContact CD1-CE2 3.41Å; L24-Y36 VanDerWaalsContact CD1-CE2 3.41Å; F26-Y36 HydrophobicContact CB-CD2 4.35Å; Y36-N38 HydrophobicContact CE1-CB 3.71Å; Y36-N38 WeakPolarHBondContact OH-CB 3.5Å; Y36-N38 PolarHBondContact OH-ND2 2.92Å; Y36-N38 VanDerWaalsContact OH-ND2 3.17Å; Y36-I48 HydrophobicContact CD1-CG2 4.22Å; Y36-I48 HydrophobicContact CE1-CB 4.33Å; Y36-I48 HydrophobicContact CE1-CG2 3.85Å; Y36-R49 WeakPolarHBondContact O-CA 3.44Å; Y36-K50 HydrophobicContact CD1-CB 4.41Å; Y36-K50 PolarHBondContact N-O 3.43Å; Y36-K50 PolarHBondContact O-N 3.2Å; Y36-V135 HydrophobicContact CD2-CG1 3.69Å; Y36-V135 HydrophobicContact CE2-CG1 4.15Å; Y36-F136 HydrophobicContact CE2-CD1 4.3Å; Y36-F136 HydrophobicContact CE2-CE1 4.16Å; Y36-I139 HydrophobicContact CD1-CG1 4.46Å; Y36-I139 HydrophobicContact CD1-CG2 4.33Å; Y36-I139 HydrophobicContact CD2-CG1 3.9Å; Y36-I139 HydrophobicContact CE1-CG2 4.44Å; Y36-I139 HydrophobicContact CE2-CG1 4.48Å; Y36-I139 HydrophobicContact CG-CD1 4.04Å; Y36-I139 HydrophobicContact CG-CG1 3.88Å; Y36-P147 PolarHBondContact OH-O 3.09Å
37A97.5Very high88Confident9 Ų962.9 Ų62.97%0.07431%0.311CS..EExtended strand (participates in β ladder)trans-135.7129.3175.300000110.2F23 L24 E25 M47 I48F23-A37 HydrophobicContact CE2-CB 3.98Å; L24-A37 CarbonylContact C-O 3.56Å; L24-A37 WeakPolarHBondContact CA-O 3.33Å; E25-A37 PolarHBondContact N-O 3.05Å; E25-A37 PolarHBondContact O-N 2.82Å; A37-M47 HydrophobicContact CB-CE 3.8Å; A37-I48 CarbonylContact C-O 3.49Å; A37-I48 VanDerWaalsContact CA-O 3.28Å; A37-I48 WeakPolarHBondContact CA-O 3.38Å
38N95.4Very high87.7Confident14 Ų1463.2 Ų63.28%0.07531%0.313CS..EExtended strand (participates in β ladder)trans-134.6124.8171.9-177.8-8.7000109.1F23 L24 Y36 I48 P147F23-N38 WeakPolarHBondContact O-CA 3.31Å; F23-N38 PolarHBondContact O-OD1 2.83Å; L24-N38 HydrophobicContact CD1-CB 4.07Å; Y36-N38 HydrophobicContact CE1-CB 3.71Å; Y36-N38 WeakPolarHBondContact OH-CB 3.5Å; Y36-N38 PolarHBondContact OH-ND2 2.92Å; Y36-N38 VanDerWaalsContact OH-ND2 3.17Å; N38-I48 HydrophobicContact CB-CB 4.44Å; N38-I48 PolarHBondContact N-O 3.1Å; N38-I48 PolarHBondContact O-N 3.36Å; N38-P147 PolarHBondContact ND2-O 3.42Å
39N92.3Very high87.6Confident30 Ų3071 Ų7116%0.1634%0.343CS..EExtended strand (participates in β ladder)trans-121.2106.5175.3-167.250.8000108.8H21 E22 F23 M47H21-N39 PolarHBondContact O-ND2 2.63Å; E22-N39 CarbonylContact C-O 3.54Å; E22-N39 WeakPolarHBondContact CA-O 3.29Å; F23-N39 HydrophobicContact CD1-CB 3.72Å; F23-N39 HydrophobicContact CE1-CB 3.51Å; F23-N39 HydrophobicContact CG-CB 4.47Å; F23-N39 HydrophobicContact CZ-CB 4.13Å; F23-N39 PolarHBondContact N-O 3.16Å; F23-N39 PolarHBondContact O-N 3.33Å; N39-M47 HydrophobicContact CB-CG 4.09Å
40S83.1Confident87.6Confident21 Ų2169.3 Ų69.315%0.14734%0.338CS..  trans-112.1131.8170.657.20000108.5Y42S40-Y42 VanDerWaalsContact C-N 3.29Å
41N74.1Confident87.7Confident51 Ų5169.8 Ų69.827%0.27333%0.333SS..  trans-95.77.2176.6-66.3-40.6000111.1F19 H21 E22 K43F19-N41 HydrophobicContact CB-CB 4.16Å; F19-N41 WeakPolarHBondContact O-CB 3.37Å; F19-N41 PolarHBondContact O-ND2 3.47Å; H21-N41 PolarHBondContact O-ND2 3.28Å; E22-N41 HydrophobicContact CG-CB 4.16Å; E22-N41 PolarHBondContact OE1-N 3.41Å; N41-K43 PolarHBondContact O-N 3.16Å
42Y61.4Low87.8Confident158 Ų15866.6 Ų66.662%0.6232%0.318SS*.G310 helixtrans-66117.6173.7-170.7-110.1000109.9S40 N44 D45S40-Y42 VanDerWaalsContact C-N 3.29Å; Y42-N44 VanDerWaalsContact C-N 3.34Å; Y42-N44 PolarHBondContact O-N 3.16Å; Y42-D45 PolarHBondContact O-N 2.92Å
43K64.6Low87.8Confident167 Ų16773.7 Ų73.773%0.72634%0.344SS*.G310 helixtrans61.229.4176.9-59-178.6173.3-179.10116.2N41 D45N41-K43 PolarHBondContact O-N 3.16Å; K43-D45 VanDerWaalsContact C-N 3.31Å
44N64.8Low87.9Confident155 Ų15573.1 Ų73.183%0.82934%0.343SS*.G310 helixtrans61.635.3-178.6-52-41.9000113.4Y42Y42-N44 VanDerWaalsContact C-N 3.34Å; Y42-N44 PolarHBondContact O-N 3.16Å
45D67.3Low87.8Confident93 Ų9379.5 Ų79.550%0.49737%0.373SS..PPolyproline II helixtrans-64.2150.8176.2-130-28.4000111.5Y42 K43Y42-D45 PolarHBondContact O-N 2.92Å; K43-D45 VanDerWaalsContact C-N 3.31Å
46V78.6Confident87.7Confident117 Ų11781.4 Ų81.471%0.70938%0.384SS*.PPolyproline II helixtrans-89133.7-178.8-178.90000108.7I48V46-I48 PolarHBondContact O-N 3.12Å; V46-I48 VanDerWaalsContact O-N 3.15Å
47M89.1Confident87.7Confident51 Ų5184.5 Ų84.525%0.25141%0.407SS..PPolyproline II helixtrans-48.8122.9175-173.5-178.2-177.400111.7F23 A37 N39 R49F23-M47 HydrophobicContact CE1-CE 4.23Å; F23-M47 HydrophobicContact CE2-CE 4.07Å; F23-M47 HydrophobicContact CZ-CE 3.41Å; F23-M47 VanDerWaalsContact CZ-CE 3.41Å; A37-M47 HydrophobicContact CB-CE 3.8Å; N39-M47 HydrophobicContact CB-CG 4.09Å; M47-R49 HydrophobicContact CE-CG 3.84Å; M47-R49 VanDerWaalsContact CE-NE 3.29Å; M47-R49 HydrophobicContact CG-CG 4.31Å; M47-R49 HydrophobicContact SD-CG 4.22Å; M47-R49 VanDerWaalsContact SD-CZ 3.52Å; M47-R49 PolarHBondContact SD-NE 3.43Å; M47-R49 PolarHBondContact SD-NH2 3Å
48I92.5Very high87.8Confident33 Ų3385.4 Ų85.417%0.16941%0.411CS..EExtended strand (participates in β ladder)trans-87.3124.3176.2-57.4174.7000108.2Y36 A37 N38 V46 K50 I145Y36-I48 HydrophobicContact CD1-CG2 4.22Å; Y36-I48 HydrophobicContact CE1-CB 4.33Å; Y36-I48 HydrophobicContact CE1-CG2 3.85Å; A37-I48 CarbonylContact C-O 3.49Å; A37-I48 VanDerWaalsContact CA-O 3.28Å; A37-I48 WeakPolarHBondContact CA-O 3.38Å; N38-I48 HydrophobicContact CB-CB 4.44Å; N38-I48 PolarHBondContact N-O 3.1Å; N38-I48 PolarHBondContact O-N 3.36Å; V46-I48 PolarHBondContact O-N 3.12Å; V46-I48 VanDerWaalsContact O-N 3.15Å; I48-K50 HydrophobicContact CG2-CG 3.97Å; I48-I145 HydrophobicContact CG2-CD1 3.82Å
49R96.4Very high87.9Confident165 Ų16585.5 Ų85.562%0.62341%0.411SS*.EExtended strand (participates in β ladder)trans-128.5125.4169.5-67.8-179.6-179.9-94.24.5109.4Y36 M47Y36-R49 WeakPolarHBondContact O-CA 3.44Å; M47-R49 HydrophobicContact CE-CG 3.84Å; M47-R49 VanDerWaalsContact CE-NE 3.29Å; M47-R49 HydrophobicContact CG-CG 4.31Å; M47-R49 HydrophobicContact SD-CG 4.22Å; M47-R49 VanDerWaalsContact SD-CZ 3.52Å; M47-R49 PolarHBondContact SD-NE 3.43Å; M47-R49 PolarHBondContact SD-NH2 3Å
50K97.8Very high88.2Confident68 Ų6888 Ų8830%0.29642%0.422SS..EExtended strand (participates in β ladder)trans-139.1142.7-177.8-65.1-60.9176.3-169.60110.5Y36 I48 I139 F143 I145Y36-K50 HydrophobicContact CD1-CB 4.41Å; Y36-K50 PolarHBondContact N-O 3.43Å; Y36-K50 PolarHBondContact O-N 3.2Å; I48-K50 HydrophobicContact CG2-CG 3.97Å; K50-I139 HydrophobicContact CB-CD1 4.14Å; K50-F143 HydrophobicContact CB-CD2 3.97Å; K50-F143 HydrophobicContact CB-CE2 3.56Å; K50-F143 HydrophobicContact CB-CZ 3.89Å; K50-F143 HydrophobicContact CD-CB 4.44Å; K50-F143 HydrophobicContact CD-CD1 3.73Å; K50-F143 HydrophobicContact CD-CD2 3.97Å; K50-F143 HydrophobicContact CD-CE1 3.85Å; K50-F143 HydrophobicContact CD-CE2 4.11Å; K50-F143 HydrophobicContact CD-CG 3.77Å; K50-F143 HydrophobicContact CD-CZ 4.03Å; K50-F143 HydrophobicContact CG-CD2 3.88Å; K50-F143 HydrophobicContact CG-CE2 3.99Å; K50-F143 HydrophobicContact CG-CG 4.16Å; K50-F143 HydrophobicContact CG-CZ 4.33Å; K50-I145 HydrophobicContact CG-CD1 4.16Å
51E98.4Very high88.9Confident98 Ų9890.6 Ų90.646%0.45843%0.432SS..EExtended strand (participates in β ladder)trans-136.7136.5174.9-56.1-167.8149.600109.1K33 L34 R35 F143K33-E51 VanDerWaalsContact CE-CD 3.45Å; K33-E51 WeakPolarHBondContact CE-OE2 3.4Å; K33-E51 IonicContact NZ-OE1 3.04Å; K33-E51 IonicContact NZ-OE2 3.67Å; K33-E51 PolarHBondContact NZ-OE2 2.82Å; L34-E51 CarbonylContact O-C 3.59Å; L34-E51 VanDerWaalsContact O-CA 3.25Å; L34-E51 WeakPolarHBondContact O-CA 3.3Å; R35-E51 HydrophobicContact CB-CG 4.4Å; R35-E51 HydrophobicContact CG-CG 3.98Å; R35-E51 WeakPolarHBondContact CG-OE1 3.47Å; R35-E51 IonicContact CZ-OE1 3.99Å; R35-E51 IonicContact NE-OE1 2.92Å; R35-E51 PolarHBondContact NE-OE1 3.42Å; E51-F143 WeakPolarHBondContact O-CZ 3.28Å
52A98.4Very high90Very high15 Ų1588.1 Ų88.112%0.12442%0.419CS..EExtended strand (participates in β ladder)trans-147.6153.617600000109.5L34 F143L34-A52 PolarHBondContact N-O 2.99Å; L34-A52 PolarHBondContact O-N 3.04Å; A52-F143 HydrophobicContact CB-CE2 4.36Å; A52-F143 HydrophobicContact CB-CZ 4.17Å
53Y98.6Very high91.8Very high156 Ų15681.7 Ų81.761%0.61239%0.394SS*.EExtended strand (participates in β ladder)trans-91.8128.9166.2-72.1-91.3000108.6G32 K33G32-Y53 WeakPolarHBondContact O-CA 3.03Å; K33-Y53 HydrophobicContact CB-CD1 4.04Å; K33-Y53 HydrophobicContact CB-CE1 3.73Å; K33-Y53 HydrophobicContact CD-CE1 4.5Å; K33-Y53 HydrophobicContact CG-CE1 4.2Å
54V98.5Very high93.4Very high24 Ų2479.3 Ų79.315%0.14538%0.38CS..PPolyproline II helixtrans-95.3153174.3-59.90000110.4F28 G32 L34 V58 M59 L138F28-V54 HydrophobicContact CD1-CG2 4.3Å; F28-V54 HydrophobicContact CE1-CG1 4.38Å; F28-V54 HydrophobicContact CE1-CG2 4.26Å; G32-V54 WeakPolarHBondContact O-CG2 3.42Å; G32-V54 PolarHBondContact O-N 2.92Å; L34-V54 HydrophobicContact CB-CG1 4.15Å; L34-V54 HydrophobicContact CD2-CG1 4.42Å; V54-V58 HydrophobicContact CB-CB 3.92Å; V54-V58 HydrophobicContact CB-CG1 4.02Å; V54-V58 HydrophobicContact CB-CG2 4.2Å; V54-V58 HydrophobicContact CG1-CG1 4.28Å; V54-V58 HydrophobicContact CG2-CB 3.98Å; V54-V58 HydrophobicContact CG2-CG1 4Å; V54-M59 HydrophobicContact CG2-CG 3.98Å; V54-M59 HydrophobicContact CG2-SD 3.52Å; V54-M59 VanDerWaalsContact CG2-SD 3.52Å; V54-L138 HydrophobicContact CG1-CD1 4.35Å
55H98.3Very high95Very high136 Ų13673.1 Ų73.163%0.6335%0.347SS*.PPolyproline II helixtrans-68.6153.1174.8-176.1-103.7000110.7S57 V58H55-S57 WeakPolarHBondContact ND1-CB 3.49Å; H55-S57 PolarHBondContact ND1-N 3.4Å; H55-S57 VanDerWaalsContact ND1-N 3.17Å; H55-S57 PolarHBondContact ND1-OG 3.05Å; H55-S57 PolarHBondContact O-N 3.24Å; H55-S57 VanDerWaalsContact O-N 3.08Å; H55-V58 WeakPolarHBondContact O-CB 3.47Å; H55-V58 PolarHBondContact O-N 3.29Å
56K96.9Very high96.5Very high142 Ų14268.7 Ų68.762%0.61732%0.323SS*.Hα-helixtrans-50.9-36.8178.5-177.3-179.1176.2-175.20112.8V58 M59 E60K56-V58 PolarHBondContact O-N 2.71Å; K56-M59 WeakPolarHBondContact O-CA 3.27Å; K56-M59 WeakPolarHBondContact O-CB 3.3Å; K56-M59 PolarHBondContact O-N 3.26Å; K56-E60 WeakPolarHBondContact CE-OE1 3.12Å; K56-E60 HydrophobicContact CG-CG 4.16Å; K56-E60 IonicContact NZ-OE1 2.85Å; K56-E60 WeakPolarHBondContact O-CG 3.5Å; K56-E60 PolarHBondContact O-N 3.3Å
57S98.2Very high97.4Very high72 Ų7267.3 Ų67.350%0.50331%0.312SS..Hα-helixtrans-59.4-31.4177.959.70000113.7H55 E61H55-S57 WeakPolarHBondContact ND1-CB 3.49Å; H55-S57 PolarHBondContact ND1-N 3.4Å; H55-S57 VanDerWaalsContact ND1-N 3.17Å; H55-S57 PolarHBondContact ND1-OG 3.05Å; H55-S57 PolarHBondContact O-N 3.24Å; H55-S57 VanDerWaalsContact O-N 3.08Å; S57-E61 WeakPolarHBondContact O-CB 3.37Å; S57-E61 PolarHBondContact O-N 3.49Å; S57-E61 VanDerWaalsContact O-N 3.09Å
58V98.4Very high97.9Very high28 Ų2870 Ų7017%0.1733%0.327CS..Hα-helixtrans-70.5-38.3174.1179.60000110.3V54 H55 K56 E61 L62 L138V54-V58 HydrophobicContact CB-CB 3.92Å; V54-V58 HydrophobicContact CB-CG1 4.02Å; V54-V58 HydrophobicContact CB-CG2 4.2Å; V54-V58 HydrophobicContact CG1-CG1 4.28Å; V54-V58 HydrophobicContact CG2-CB 3.98Å; V54-V58 HydrophobicContact CG2-CG1 4Å; H55-V58 WeakPolarHBondContact O-CB 3.47Å; H55-V58 PolarHBondContact O-N 3.29Å; K56-V58 PolarHBondContact O-N 2.71Å; V58-E61 PolarHBondContact O-N 2.74Å; V58-L62 PolarHBondContact O-N 2.96Å; V58-L138 HydrophobicContact CG1-CD1 3.92Å
59M98.2Very high98.1Very high15 Ų1569.7 Ų69.77%0.07433%0.328CS..Hα-helixtrans-66.1-42.1176.3-57.9-61.1-71.300111.7F7 F28 R29 V54 K56 E61 L62 K63F7-M59 HydrophobicContact CD1-CE 3.36Å; F7-M59 HydrophobicContact CE1-CE 3.67Å; F28-M59 HydrophobicContact CB-CE 4.3Å; F28-M59 HydrophobicContact CD1-SD 3.97Å; R29-M59 WeakPolarHBondContact O-CE 3.17Å; V54-M59 HydrophobicContact CG2-CG 3.98Å; V54-M59 HydrophobicContact CG2-SD 3.52Å; V54-M59 VanDerWaalsContact CG2-SD 3.52Å; K56-M59 WeakPolarHBondContact O-CA 3.27Å; K56-M59 WeakPolarHBondContact O-CB 3.3Å; K56-M59 PolarHBondContact O-N 3.26Å; M59-E61 VanDerWaalsContact C-N 3.34Å; M59-L62 PolarHBondContact O-N 3.02Å; M59-L62 HydrophobicContact SD-CD1 4.39Å; M59-K63 WeakPolarHBondContact O-CG 3.32Å; M59-K63 PolarHBondContact O-N 2.85Å; M59-K63 VanDerWaalsContact O-N 3.09Å
60E97.8Very high98.2Very high84 Ų8466.6 Ų66.639%0.39332%0.32SS..Hα-helixtrans-66.6-35.7175.9-60-55.1145.400112K56 K63 R64K56-E60 WeakPolarHBondContact CE-OE1 3.12Å; K56-E60 HydrophobicContact CG-CG 4.16Å; K56-E60 IonicContact NZ-OE1 2.85Å; K56-E60 WeakPolarHBondContact O-CG 3.5Å; K56-E60 PolarHBondContact O-N 3.3Å; E60-K63 WeakPolarHBondContact O-CB 3.26Å; E60-K63 PolarHBondContact O-N 2.93Å; E60-K63 IonicContact OE1-NZ 3.59Å; E60-R64 PolarHBondContact O-N 2.96Å
61E98.5Very high98.3Very high74 Ų7463.3 Ų63.335%0.34631%0.306SS..Hα-helixtrans-68.7-37.2175.2-179.762.4-178.700112.4S57 V58 M59 K63 R64 I65S57-E61 WeakPolarHBondContact O-CB 3.37Å; S57-E61 PolarHBondContact O-N 3.49Å; S57-E61 VanDerWaalsContact O-N 3.09Å; V58-E61 PolarHBondContact O-N 2.74Å; M59-E61 VanDerWaalsContact C-N 3.34Å; E61-K63 VanDerWaalsContact C-N 3.35Å; E61-R64 PolarHBondContact O-N 3.24Å; E61-R64 IonicContact OE1-CZ 3.36Å; E61-R64 IonicContact OE1-NE 2.71Å; E61-R64 PolarHBondContact OE1-NE 2.91Å; E61-R64 IonicContact OE1-NH2 3.67Å; E61-R64 PolarHBondContact OE1-NH2 2.75Å; E61-R64 IonicContact OE2-CZ 3.46Å; E61-R64 IonicContact OE2-NE 3.27Å; E61-R64 PolarHBondContact OE2-NE 2.98Å; E61-R64 IonicContact OE2-NH2 2.68Å; E61-I65 HydrophobicContact CG-CD1 4.17Å; E61-I65 VanDerWaalsContact O-CG1 3.31Å; E61-I65 WeakPolarHBondContact O-CG1 3.32Å; E61-I65 PolarHBondContact O-N 3.17Å
62L98.2Very high98.3Very high0 Ų060 Ų600%029%0.292CS..Hα-helixtrans-60.3-44.4171.5-82.9164.6000111.9F7 L9 F28 V58 M59 I65 I66 L131 L134F7-L62 HydrophobicContact CE1-CB 4.36Å; F7-L62 HydrophobicContact CE1-CD1 4.43Å; F7-L62 HydrophobicContact CZ-CB 3.85Å; L9-L62 HydrophobicContact CD1-CD2 4.33Å; F28-L62 HydrophobicContact CB-CD1 4.45Å; F28-L62 HydrophobicContact CD1-CD1 3.53Å; F28-L62 HydrophobicContact CD2-CD1 3.83Å; F28-L62 HydrophobicContact CE1-CD1 3.51Å; F28-L62 HydrophobicContact CE2-CD1 3.81Å; F28-L62 HydrophobicContact CE2-CD2 4.27Å; F28-L62 HydrophobicContact CG-CD1 3.68Å; F28-L62 HydrophobicContact CZ-CD1 3.64Å; V58-L62 PolarHBondContact O-N 2.96Å; M59-L62 PolarHBondContact O-N 3.02Å; M59-L62 HydrophobicContact SD-CD1 4.39Å; L62-I65 PolarHBondContact O-N 2.93Å; L62-I66 VanDerWaalsContact O-CG1 3.31Å; L62-I66 WeakPolarHBondContact O-CG1 3.44Å; L62-I66 PolarHBondContact O-N 2.97Å; L62-L131 HydrophobicContact CD2-CD2 3.59Å; L62-L134 HydrophobicContact CD2-CD2 3.56Å; L62-L134 HydrophobicContact CG-CD2 3.77Å
63K98.1Very high98.2Very high23 Ų2366 Ų6610%0.132%0.316CS..Hα-helixtrans-58.9-48.2174.3-70173.7-178.4-177.30110.8S5 F7 M59 E60 E61 I65 I66 D67 I94S5-K63 PolarHBondContact OG-NZ 2.86Å; S5-K63 VanDerWaalsContact OG-NZ 3.14Å; F7-K63 VanDerWaalsContact CB-CE 3.47Å; F7-K63 HydrophobicContact CD2-CD 4.16Å; F7-K63 HydrophobicContact CD2-CG 3.45Å; F7-K63 VanDerWaalsContact CD2-CG 3.45Å; F7-K63 HydrophobicContact CE2-CG 3.54Å; F7-K63 HydrophobicContact CG-CG 4.16Å; F7-K63 HydrophobicContact CZ-CG 4.34Å; M59-K63 WeakPolarHBondContact O-CG 3.32Å; M59-K63 PolarHBondContact O-N 2.85Å; M59-K63 VanDerWaalsContact O-N 3.09Å; E60-K63 WeakPolarHBondContact O-CB 3.26Å; E60-K63 PolarHBondContact O-N 2.93Å; E60-K63 IonicContact OE1-NZ 3.59Å; E61-K63 VanDerWaalsContact C-N 3.35Å; K63-I65 VanDerWaalsContact C-N 3.34Å; K63-I65 PolarHBondContact O-N 3.11Å; K63-I66 WeakPolarHBondContact O-CB 3.47Å; K63-I66 PolarHBondContact O-N 2.79Å; K63-I66 VanDerWaalsContact O-N 3.1Å; K63-D67 WeakPolarHBondContact O-CB 3.4Å; K63-D67 VanDerWaalsContact O-CG 3.25Å; K63-D67 PolarHBondContact O-N 2.82Å; K63-I94 HydrophobicContact CB-CD1 3.95Å; K63-I94 HydrophobicContact CG-CD1 3.91Å
64R98.4Very high98.2Very high116 Ų11660.9 Ų60.944%0.43830%0.298SS..Hα-helixtrans-56.4-45.6177.1-168.7-16968.877.3-1112.4E60 E61 I66 D67 D68E60-R64 PolarHBondContact O-N 2.96Å; E61-R64 PolarHBondContact O-N 3.24Å; E61-R64 IonicContact OE1-CZ 3.36Å; E61-R64 IonicContact OE1-NE 2.71Å; E61-R64 PolarHBondContact OE1-NE 2.91Å; E61-R64 IonicContact OE1-NH2 3.67Å; E61-R64 PolarHBondContact OE1-NH2 2.75Å; E61-R64 IonicContact OE2-CZ 3.46Å; E61-R64 IonicContact OE2-NE 3.27Å; E61-R64 PolarHBondContact OE2-NE 2.98Å; E61-R64 IonicContact OE2-NH2 2.68Å; R64-I66 VanDerWaalsContact C-N 3.33Å; R64-I66 PolarHBondContact O-N 2.87Å; R64-D67 PolarHBondContact O-N 3.09Å; R64-D68 IonicContact CZ-OD2 3.6Å; R64-D68 IonicContact NH1-OD2 3.65Å; R64-D68 PolarHBondContact NH1-OD2 3Å; R64-D68 VanDerWaalsContact O-CB 3.28Å; R64-D68 WeakPolarHBondContact O-CB 3.48Å; R64-D68 PolarHBondContact O-N 2.87Å
65I98.7Very high98.2Very high26 Ų2664.5 Ų64.513%0.13332%0.316CS..Hα-helixtrans-61.9-41.3177.6-69.3165.4000111.2E61 L62 K63 S69 L127 D130 L134E61-I65 HydrophobicContact CG-CD1 4.17Å; E61-I65 VanDerWaalsContact O-CG1 3.31Å; E61-I65 WeakPolarHBondContact O-CG1 3.32Å; E61-I65 PolarHBondContact O-N 3.17Å; L62-I65 PolarHBondContact O-N 2.93Å; K63-I65 VanDerWaalsContact C-N 3.34Å; K63-I65 PolarHBondContact O-N 3.11Å; I65-S69 WeakPolarHBondContact O-CB 3.41Å; I65-S69 PolarHBondContact O-N 2.96Å; I65-S69 VanDerWaalsContact O-N 3.16Å; I65-L127 HydrophobicContact CG2-CD1 3.74Å; I65-D130 HydrophobicContact CG2-CB 4.2Å; I65-L134 HydrophobicContact CD1-CD2 4.33Å
66I98.3Very high98.2Very high0 Ų060.1 Ų60.10%030%0.297CS..Hα-helixtrans-65.7-49.8177.2-70.3166.7000110.7F7 L9 L62 K63 R64 D68 S69 E70 I71 I92 I94F7-I66 HydrophobicContact CE2-CD1 3.62Å; F7-I66 HydrophobicContact CZ-CD1 3.87Å; L9-I66 HydrophobicContact CD1-CD1 3.7Å; L9-I66 HydrophobicContact CD1-CG1 4.43Å; L62-I66 VanDerWaalsContact O-CG1 3.31Å; L62-I66 WeakPolarHBondContact O-CG1 3.44Å; L62-I66 PolarHBondContact O-N 2.97Å; K63-I66 WeakPolarHBondContact O-CB 3.47Å; K63-I66 PolarHBondContact O-N 2.79Å; K63-I66 VanDerWaalsContact O-N 3.1Å; R64-I66 VanDerWaalsContact C-N 3.33Å; R64-I66 PolarHBondContact O-N 2.87Å; I66-D68 PolarHBondContact O-N 3.38Å; I66-S69 PolarHBondContact O-N 3Å; I66-S69 VanDerWaalsContact O-N 3.16Å; I66-S69 PolarHBondContact O-OG 3.03Å; I66-E70 PolarHBondContact O-N 3.09Å; I66-I71 HydrophobicContact CG2-CG2 3.84Å; I66-I92 HydrophobicContact CD1-CD1 3.96Å; I66-I92 HydrophobicContact CD1-CG1 4.4Å; I66-I92 HydrophobicContact CD1-CG2 3.94Å; I66-I92 HydrophobicContact CG1-CD1 4.08Å; I66-I92 HydrophobicContact CG2-CD1 4.31Å; I66-I92 HydrophobicContact CG2-CG2 4.28Å; I66-I94 HydrophobicContact CG2-CD1 4.22Å
67D97.9Very high98.3Very high87 Ų8757.1 Ų57.147%0.46530%0.299SS..Hα-helixtrans-59.8-47.4-179.2-67.2-22.9000111K63 R64 S69 E70 I94K63-D67 WeakPolarHBondContact O-CB 3.4Å; K63-D67 VanDerWaalsContact O-CG 3.25Å; K63-D67 PolarHBondContact O-N 2.82Å; R64-D67 PolarHBondContact O-N 3.09Å; D67-S69 PolarHBondContact O-N 2.91Å; D67-E70 PolarHBondContact O-N 3.4Å; D67-E70 VanDerWaalsContact O-N 3.12Å; D67-I94 VanDerWaalsContact OD1-CD1 3.31Å; D67-I94 WeakPolarHBondContact OD1-CD1 3.22Å
68D98.5Very high98.3Very high108 Ų10858.4 Ų58.458%0.57830%0.3SS*.Hα-helixtrans-64.7-26.3179.3-72.6-13000112.6R64 I66 E70R64-D68 IonicContact CZ-OD2 3.6Å; R64-D68 IonicContact NH1-OD2 3.65Å; R64-D68 PolarHBondContact NH1-OD2 3Å; R64-D68 VanDerWaalsContact O-CB 3.28Å; R64-D68 WeakPolarHBondContact O-CB 3.48Å; R64-D68 PolarHBondContact O-N 2.87Å; I66-D68 PolarHBondContact O-N 3.38Å; D68-E70 VanDerWaalsContact C-N 3.31Å
69S98.5Very high98.3Very high26 Ų2657.7 Ų57.718%0.18229%0.294CS..Hα-helixtrans-76.4-18.9177.675.10000113.3I65 I66 D67 I71 V123I65-S69 WeakPolarHBondContact O-CB 3.41Å; I65-S69 PolarHBondContact O-N 2.96Å; I65-S69 VanDerWaalsContact O-N 3.16Å; I66-S69 PolarHBondContact O-N 3Å; I66-S69 VanDerWaalsContact O-N 3.16Å; I66-S69 PolarHBondContact O-OG 3.03Å; D67-S69 PolarHBondContact O-N 2.91Å; S69-I71 PolarHBondContact O-N 3.47Å; S69-I71 VanDerWaalsContact O-N 3.16Å; S69-I71 WeakPolarHBondContact OG-CB 3.27Å; S69-I71 WeakPolarHBondContact OG-CG2 3.38Å; S69-I71 PolarHBondContact OG-N 3.36Å; S69-V123 WeakPolarHBondContact O-CG1 3.24Å
70E98.4Very high98.3Very high100 Ų10059.6 Ų59.647%0.46731%0.307SS..THydrogen-bonded Turntrans58.218.1-172.7-50.2-163.2122.900114.7I66 D67 D68 T72 K73I66-E70 PolarHBondContact O-N 3.09Å; D67-E70 PolarHBondContact O-N 3.4Å; D67-E70 VanDerWaalsContact O-N 3.12Å; D68-E70 VanDerWaalsContact C-N 3.31Å; E70-T72 PolarHBondContact O-N 2.95Å; E70-K73 HydrophobicContact CB-CD 4.11Å; E70-K73 VanDerWaalsContact CD-NZ 3.35Å; E70-K73 WeakPolarHBondContact O-CB 3.4Å; E70-K73 PolarHBondContact O-N 3.36Å; E70-K73 IonicContact OE1-NZ 3.43Å; E70-K73 PolarHBondContact OE1-NZ 2.82Å; E70-K73 IonicContact OE2-NZ 2.64Å
71I98.6Very high98.3Very high0 Ų060.3 Ų60.30%032%0.319CS..G310 helixtrans-56.6-26.6-176.5-170.463.4000114.1I66 S69 K73 E74 L90 I92 I99 F101 V123 F124 L127I66-I71 HydrophobicContact CG2-CG2 3.84Å; S69-I71 PolarHBondContact O-N 3.47Å; S69-I71 VanDerWaalsContact O-N 3.16Å; S69-I71 WeakPolarHBondContact OG-CB 3.27Å; S69-I71 WeakPolarHBondContact OG-CG2 3.38Å; S69-I71 PolarHBondContact OG-N 3.36Å; I71-K73 PolarHBondContact O-N 2.94Å; I71-E74 HydrophobicContact CD1-CB 4.43Å; I71-E74 HydrophobicContact CD1-CG 4.32Å; I71-E74 PolarHBondContact O-N 3.31Å; I71-L90 HydrophobicContact CG1-CD2 4.28Å; I71-I92 HydrophobicContact CG2-CD1 4.22Å; I71-I99 HydrophobicContact CG1-CD1 4.04Å; I71-I99 HydrophobicContact CG2-CD1 4.13Å; I71-F101 HydrophobicContact CD1-CD2 4.36Å; I71-F101 HydrophobicContact CD1-CE2 3.7Å; I71-F101 HydrophobicContact CG1-CE2 3.77Å; I71-V123 HydrophobicContact CB-CG1 4.19Å; I71-V123 HydrophobicContact CD1-CG1 3.89Å; I71-F124 HydrophobicContact CD1-CB 4.15Å; I71-F124 HydrophobicContact CD1-CD2 4.41Å; I71-L127 HydrophobicContact CB-CD2 3.64Å; I71-L127 HydrophobicContact CD1-CD2 4.25Å; I71-L127 HydrophobicContact CG1-CD2 3.59Å; I71-L127 HydrophobicContact CG2-CD2 3.62Å
72T97.9Very high98.2Very high27 Ų2759.3 Ų59.317%0.16632%0.319CS..G310 helixtrans-69-13.9178.155.80000113.1E70 I94 E97 I99E70-T72 PolarHBondContact O-N 2.95Å; T72-I94 HydrophobicContact CG2-CG2 4.03Å; T72-E97 HydrophobicContact CG2-CB 4.37Å; T72-E97 PolarHBondContact OG1-OE1 3.12Å; T72-E97 PolarHBondContact OG1-OE2 2.94Å; T72-I99 HydrophobicContact CG2-CD1 4.29Å
73K97.9Very high98Very high143 Ų14363.5 Ų63.562%0.62234%0.342SS*.G310 helixtrans-89-9.2175.8-54.6-177.1-171.11710113.3E70 I71E70-K73 HydrophobicContact CB-CD 4.11Å; E70-K73 VanDerWaalsContact CD-NZ 3.35Å; E70-K73 WeakPolarHBondContact O-CB 3.4Å; E70-K73 PolarHBondContact O-N 3.36Å; E70-K73 IonicContact OE1-NZ 3.43Å; E70-K73 PolarHBondContact OE1-NZ 2.82Å; E70-K73 IonicContact OE2-NZ 2.64Å; I71-K73 PolarHBondContact O-N 2.94Å
74E98.5Very high97.6Very high48 Ų4873.8 Ų73.822%0.22438%0.38CS..  trans-89.5161.6-177.4-55.9-57.6161.500112.3I71 W79 F101 G120 V123I71-E74 HydrophobicContact CD1-CB 4.43Å; I71-E74 HydrophobicContact CD1-CG 4.32Å; I71-E74 PolarHBondContact O-N 3.31Å; E74-W79 HydrophobicContact CB-CZ2 4.25Å; E74-F101 HydrophobicContact CB-CZ 4.22Å; E74-F101 WeakPolarHBondContact O-CE1 3.48Å; E74-F101 VanDerWaalsContact O-CZ 3.29Å; E74-F101 WeakPolarHBondContact O-CZ 3.36Å; E74-G120 VanDerWaalsContact CD-CA 3.47Å; E74-G120 WeakPolarHBondContact OE2-CA 3.44Å; E74-V123 HydrophobicContact CG-CB 4.28Å; E74-V123 HydrophobicContact CG-CG1 4.25Å
75D98.1Very high97.3Very high100 Ų10072.7 Ų72.754%0.53539%0.386SS..  trans-141.2137.4179.3-176.4-86.2000110.8A77 W79D75-A77 WeakPolarHBondContact OD1-CB 3.34Å; D75-A77 PolarHBondContact OD1-N 2.7Å; D75-W79 PolarHBondContact O-NE1 3.42Å
76D98.4Very high97.1Very high44 Ų4471.5 Ų71.524%0.23538%0.38CS..G310 helixtrans-89.54.6-173.875.2-17.9000114.6L78 W79 F101 T102D76-L78 PolarHBondContact O-N 3.21Å; D76-W79 HydrophobicContact CB-CB 4.26Å; D76-W79 HydrophobicContact CB-CD2 3.64Å; D76-W79 HydrophobicContact CB-CE3 3.47Å; D76-W79 VanDerWaalsContact CB-CE3 3.47Å; D76-W79 HydrophobicContact CB-CG 4Å; D76-W79 HydrophobicContact CB-CZ3 4.03Å; D76-W79 WeakPolarHBondContact O-CB 3.27Å; D76-W79 PolarHBondContact O-N 3.18Å; D76-F101 HydrophobicContact CB-CB 4.15Å; D76-F101 HydrophobicContact CB-CD1 3.8Å; D76-F101 HydrophobicContact CB-CG 4.23Å; D76-F101 VanDerWaalsContact OD2-CA 3.32Å; D76-F101 WeakPolarHBondContact OD2-CA 3.32Å; D76-T102 PolarHBondContact OD2-N 3.14Å
77A98.3Very high97.1Very high79 Ų7976.3 Ų76.365%0.65340%0.398SS*.G310 helixtrans-59.4-25.3-175.800000113.9D75D75-A77 WeakPolarHBondContact OD1-CB 3.34Å; D75-A77 PolarHBondContact OD1-N 2.7Å
78L98.3Very high97.1Very high99 Ų9972.6 Ų72.652%0.51838%0.378SS..G310 helixtrans-102-2.2178.1-63.8-177.4000113.6D76 K116 D117D76-L78 PolarHBondContact O-N 3.21Å; L78-K116 HydrophobicContact CB-CB 4.1Å; L78-D117 HydrophobicContact CB-CB 3.96Å; L78-D117 HydrophobicContact CD1-CB 4.49Å
79W98.4Very high97.2Very high13 Ų1368.7 Ų68.75%0.04936%0.357CS..SBendtrans-76.4152.5-177.2-63.55.4000111E74 D75 D76 F101 T103 D117 L121 F124E74-W79 HydrophobicContact CB-CZ2 4.25Å; D75-W79 PolarHBondContact O-NE1 3.42Å; D76-W79 HydrophobicContact CB-CB 4.26Å; D76-W79 HydrophobicContact CB-CD2 3.64Å; D76-W79 HydrophobicContact CB-CE3 3.47Å; D76-W79 VanDerWaalsContact CB-CE3 3.47Å; D76-W79 HydrophobicContact CB-CG 4Å; D76-W79 HydrophobicContact CB-CZ3 4.03Å; D76-W79 WeakPolarHBondContact O-CB 3.27Å; D76-W79 PolarHBondContact O-N 3.18Å; W79-F101 HydrophobicContact CE3-CB 4.38Å; W79-F101 HydrophobicContact CH2-CB 4.45Å; W79-F101 AromaticContact CH2-CD2 3.62Å; W79-F101 HydrophobicContact CH2-CD2 3.62Å; W79-F101 AromaticContact CH2-CE2 3.87Å; W79-F101 HydrophobicContact CH2-CE2 3.87Å; W79-F101 AromaticContact CH2-CG 3.98Å; W79-F101 HydrophobicContact CH2-CG 3.98Å; W79-F101 HydrophobicContact CH2-CZ 4.47Å; W79-F101 HydrophobicContact CZ3-CB 3.72Å; W79-F101 HydrophobicContact CZ3-CD1 4.47Å; W79-F101 AromaticContact CZ3-CD2 3.73Å; W79-F101 HydrophobicContact CZ3-CD2 3.73Å; W79-F101 HydrophobicContact CZ3-CE2 4.43Å; W79-F101 AromaticContact CZ3-CG 3.75Å; W79-F101 HydrophobicContact CZ3-CG 3.75Å; W79-T103 HydrophobicContact CE3-CG2 4.14Å; W79-D117 PolarHBondContact NE1-OD2 3.34Å; W79-L121 HydrophobicContact CB-CD2 4.08Å; W79-L121 HydrophobicContact CB-CG 4.44Å; W79-L121 HydrophobicContact CD2-CD2 3.31Å; W79-L121 HydrophobicContact CD2-CG 3.9Å; W79-L121 HydrophobicContact CE3-CD2 3.65Å; W79-L121 HydrophobicContact CG-CD1 4.31Å; W79-L121 HydrophobicContact CG-CD2 3.51Å; W79-L121 HydrophobicContact CG-CG 3.75Å; W79-L121 HydrophobicContact CZ2-CD2 4.32Å; W79-L121 HydrophobicContact CZ3-CD2 4.27Å; W79-F124 HydrophobicContact CH2-CB 3.59Å; W79-F124 AromaticContact CH2-CD2 3.72Å; W79-F124 HydrophobicContact CH2-CD2 3.72Å; W79-F124 AromaticContact CH2-CG 3.8Å; W79-F124 HydrophobicContact CH2-CG 3.8Å; W79-F124 HydrophobicContact CZ2-CB 4.21Å; W79-F124 HydrophobicContact CZ3-CB 4.02Å; W79-F124 HydrophobicContact CZ3-CD1 4.35Å; W79-F124 AromaticContact CZ3-CD2 3.53Å; W79-F124 HydrophobicContact CZ3-CD2 3.53Å; W79-F124 AromaticContact CZ3-CE2 4Å; W79-F124 HydrophobicContact CZ3-CE2 4Å; W79-F124 AromaticContact CZ3-CG 3.72Å; W79-F124 HydrophobicContact CZ3-CG 3.72Å
80P97.9Very high97.2Very high54 Ų5467.4 Ų67.435%0.35135%0.348SS..PPolyproline II helixtrans-58.5126.6175.9-24.433.4000111.1T103 S104 L121P80-T103 CarbonylContact O-C 3.51Å; P80-T103 VanDerWaalsContact O-CA 3.29Å; P80-T103 WeakPolarHBondContact O-CA 2.99Å; P80-T103 PolarHBondContact O-OG1 2.84Å; P80-S104 PolarHBondContact O-N 3.31Å; P80-L121 HydrophobicContact CG-CD1 4.46Å
81P97.7Very high97.2Very high99 Ų9964.8 Ų64.864%0.64334%0.336SS*.PPolyproline II helixtrans-68.5155.5178.429.5-35.6000110.9S104P81-S104 WeakPolarHBondContact O-CB 3.26Å
82P97.4Very high97.2Very high53 Ų5364.9 Ų64.934%0.34434%0.336SS..PPolyproline II helixtrans-53.3141.2175.6-25.633.6000113.1R87 T102P82-R87 HydrophobicContact CB-CB 3.98Å; P82-R87 HydrophobicContact CB-CG 3.87Å; P82-R87 HydrophobicContact CG-CB 4.45Å; P82-R87 HydrophobicContact CG-CG 3.82Å; P82-T102 HydrophobicContact CG-CG2 3.27Å
83D93.9Very high97.2Very high88 Ų8865.3 Ų65.347%0.47134%0.338SS..  trans-137.3-163.4-176.565.232.2000112V85 G86 S104D83-V85 VanDerWaalsContact C-N 3.33Å; D83-V85 VanDerWaalsContact OD1-CA 3.29Å; D83-V85 WeakPolarHBondContact OD1-CA 3.31Å; D83-V85 WeakPolarHBondContact OD1-CB 3.29Å; D83-V85 PolarHBondContact OD1-N 2.8Å; D83-G86 PolarHBondContact N-O 2.96Å; D83-G86 PolarHBondContact OD1-N 3Å; D83-G86 VanDerWaalsContact OD1-N 3.14Å; D83-S104 PolarHBondContact OD1-OG 3.3Å; D83-S104 PolarHBondContact OD2-OG 2.87Å
84R89.9Confident97.1Very high239 Ų23959.2 Ų59.290%0.90231%0.312SS*.SBendtrans-71.4-26178.6-65.6-178178.8174.10.2113.4
85V91.1Very high96.8Very high93 Ų9358.3 Ų58.356%0.56432%0.316SS*.SBendtrans-71.2-36.8177.6-177.20000110H15 D83H15-V85 WeakPolarHBondContact CB-O 3.46Å; D83-V85 VanDerWaalsContact C-N 3.33Å; D83-V85 VanDerWaalsContact OD1-CA 3.29Å; D83-V85 WeakPolarHBondContact OD1-CA 3.31Å; D83-V85 WeakPolarHBondContact OD1-CB 3.29Å; D83-V85 PolarHBondContact OD1-N 2.8Å
86G95.9Very high96.6Very high2 Ų262.1 Ų62.12%0.02134%0.336CS..  trans162.7-171167.100000115G14 D83G14-G86 CarbonylContact O-C 3.53Å; G14-G86 VanDerWaalsContact O-CA 3.32Å; G14-G86 WeakPolarHBondContact O-CA 3.36Å; D83-G86 PolarHBondContact N-O 2.96Å; D83-G86 PolarHBondContact OD1-N 3Å; D83-G86 VanDerWaalsContact OD1-N 3.14Å
87R97.8Very high96.4Very high100 Ų10064.3 Ų64.338%0.37735%0.345SS..EExtended strand (participates in β ladder)trans-137.2140.4-179.7-177.9172.9-166.9-163.64.9109.7Y12 V13 G14 P82 E89 T103Y12-R87 HydrophobicContact CE1-CB 4.37Å; Y12-R87 HydrophobicContact CE1-CG 4.48Å; V13-R87 VanDerWaalsContact CA-O 3.32Å; V13-R87 WeakPolarHBondContact CA-O 3.47Å; G14-R87 PolarHBondContact N-O 3.45Å; G14-R87 PolarHBondContact O-N 2.98Å; P82-R87 HydrophobicContact CB-CB 3.98Å; P82-R87 HydrophobicContact CB-CG 3.87Å; P82-R87 HydrophobicContact CG-CB 4.45Å; P82-R87 HydrophobicContact CG-CG 3.82Å; R87-E89 WeakPolarHBondContact CD-OE1 3.4Å; R87-E89 HydrophobicContact CG-CG 4.22Å; R87-E89 IonicContact CZ-OE1 3.69Å; R87-E89 IonicContact NE-OE1 3.91Å; R87-E89 PolarHBondContact NE-OE1 3.3Å; R87-E89 IonicContact NH1-OE1 2.96Å; R87-E89 PolarHBondContact NH1-OE1 3.35Å; R87-E89 IonicContact NH2-OE1 2.75Å; R87-E89 PolarHBondContact NH2-OE1 3.12Å; R87-T103 CarbonylContact C-O 3.57Å; R87-T103 WeakPolarHBondContact CA-O 3.16Å
88Q98.6Very high96.4Very high9 Ų966.2 Ų66.24%0.04234%0.34CS..EExtended strand (participates in β ladder)trans-119.8142.4163.9-65.1-175.5-123.700109.7Y11 Y12 V13 T102 T103 F124Y11-Q88 PolarHBondContact OH-NE2 2.84Å; Y12-Q88 CarbonylContact O-C 3.59Å; Y12-Q88 VanDerWaalsContact O-CA 3.27Å; Y12-Q88 WeakPolarHBondContact O-CA 3.25Å; V13-Q88 HydrophobicContact CB-CG 4.02Å; V13-Q88 HydrophobicContact CG2-CG 3.73Å; Q88-T102 WeakPolarHBondContact O-CA 3.4Å; Q88-T103 HydrophobicContact CB-CG2 3.97Å; Q88-T103 PolarHBondContact N-O 2.77Å; Q88-T103 PolarHBondContact O-N 2.66Å; Q88-F124 HydrophobicContact CB-CE1 4.41Å; Q88-F124 HydrophobicContact CB-CZ 4.1Å
89E98.8Very high96.4Very high26 Ų2662.5 Ų62.512%0.12132%0.321CS..EExtended strand (participates in β ladder)trans-131.5137.7171.4-55170.5-164.800108.4R10 Y11 Y12 R87 F101R10-E89 IonicContact CZ-OE2 3.98Å; R10-E89 IonicContact NH1-OE2 2.74Å; R10-E89 PolarHBondContact NH1-OE2 3.06Å; R10-E89 IonicContact NH2-OE2 3.49Å; R10-E89 PolarHBondContact NH2-OE2 3.44Å; Y11-E89 WeakPolarHBondContact CA-O 3.32Å; Y11-E89 WeakPolarHBondContact CD2-O 3.37Å; Y12-E89 HydrophobicContact CD1-CG 4.16Å; Y12-E89 PolarHBondContact N-O 3.37Å; Y12-E89 PolarHBondContact O-N 2.88Å; R87-E89 WeakPolarHBondContact CD-OE1 3.4Å; R87-E89 HydrophobicContact CG-CG 4.22Å; R87-E89 IonicContact CZ-OE1 3.69Å; R87-E89 IonicContact NE-OE1 3.91Å; R87-E89 PolarHBondContact NE-OE1 3.3Å; R87-E89 IonicContact NH1-OE1 2.96Å; R87-E89 PolarHBondContact NH1-OE1 3.35Å; R87-E89 IonicContact NH2-OE1 2.75Å; R87-E89 PolarHBondContact NH2-OE1 3.12Å; E89-F101 VanDerWaalsContact CA-O 3.3Å; E89-F101 WeakPolarHBondContact CA-O 3.34Å
90L98.9Very high96.4Very high0 Ų065 Ų650%034%0.341CS..EExtended strand (participates in β ladder)trans-133.1127.8170.7179.866.3000108R10 Y11 I71 I92 S100 F101 F124 L127 L131R10-L90 WeakPolarHBondContact O-CA 3.42Å; Y11-L90 HydrophobicContact CD2-CD1 4.35Å; I71-L90 HydrophobicContact CG1-CD2 4.28Å; L90-I92 HydrophobicContact CD1-CD1 4.07Å; L90-I92 HydrophobicContact CD1-CG1 4.14Å; L90-I92 HydrophobicContact CD2-CD1 3.97Å; L90-I92 HydrophobicContact CG-CD1 4.03Å; L90-I92 HydrophobicContact CG-CG1 4.18Å; L90-S100 CarbonylContact O-C 3.47Å; L90-S100 WeakPolarHBondContact O-CA 3.19Å; L90-F101 HydrophobicContact CD2-CD2 4.44Å; L90-F101 PolarHBondContact N-O 2.96Å; L90-F101 VanDerWaalsContact N-O 3.09Å; L90-F101 PolarHBondContact O-N 3.29Å; L90-F124 HydrophobicContact CB-CE2 3.67Å; L90-F124 HydrophobicContact CB-CZ 4.49Å; L90-F124 HydrophobicContact CD2-CD2 3.97Å; L90-F124 HydrophobicContact CD2-CE2 3.88Å; L90-F124 HydrophobicContact CG-CE2 4.44Å; L90-L127 HydrophobicContact CD2-CD2 4.02Å; L90-L131 HydrophobicContact CD1-CD1 4.23Å
91E98.9Very high96.4Very high45 Ų4562.8 Ų62.821%0.2133%0.325CS..EExtended strand (participates in β ladder)trans-130.6125.5178.2-176.7175.1-168.500108.5Y8 L9 R10 H98 I99Y8-E91 HydrophobicContact CD1-CG 4.28Å; Y8-E91 HydrophobicContact CE1-CB 4.39Å; Y8-E91 HydrophobicContact CE1-CG 4Å; L9-E91 CarbonylContact C-O 3.59Å; L9-E91 WeakPolarHBondContact CA-O 3.28Å; R10-E91 HydrophobicContact CB-CB 4.43Å; R10-E91 IonicContact CZ-OE2 3.64Å; R10-E91 PolarHBondContact N-O 3.45Å; R10-E91 IonicContact NE-OE2 3.17Å; R10-E91 PolarHBondContact NE-OE2 3.35Å; R10-E91 IonicContact NH2-OE2 3.92Å; R10-E91 PolarHBondContact NH2-OE2 3.4Å; R10-E91 PolarHBondContact O-N 3.43Å; E91-H98 IonicContact OE1-NE2 3.42Å; E91-H98 PolarHBondContact OE1-NE2 3.47Å; E91-I99 WeakPolarHBondContact CA-O 3.47Å
92I98.6Very high96.5Very high1 Ų160 Ų601%0.00531%0.307CS..EExtended strand (participates in β ladder)trans-134.3130-177.4-62.6171.6000108.7Y8 L9 I66 I71 L90 I94 H98 I99 L127Y8-I92 CarbonylContact O-C 3.59Å; Y8-I92 VanDerWaalsContact O-CA 3.31Å; Y8-I92 WeakPolarHBondContact O-CA 3.17Å; L9-I92 HydrophobicContact CG-CG1 4.19Å; I66-I92 HydrophobicContact CD1-CD1 3.96Å; I66-I92 HydrophobicContact CD1-CG1 4.4Å; I66-I92 HydrophobicContact CD1-CG2 3.94Å; I66-I92 HydrophobicContact CG1-CD1 4.08Å; I66-I92 HydrophobicContact CG2-CD1 4.31Å; I66-I92 HydrophobicContact CG2-CG2 4.28Å; I71-I92 HydrophobicContact CG2-CD1 4.22Å; L90-I92 HydrophobicContact CD1-CD1 4.07Å; L90-I92 HydrophobicContact CD1-CG1 4.14Å; L90-I92 HydrophobicContact CD2-CD1 3.97Å; L90-I92 HydrophobicContact CG-CD1 4.03Å; L90-I92 HydrophobicContact CG-CG1 4.18Å; I92-I94 HydrophobicContact CG2-CB 4.24Å; I92-I94 HydrophobicContact CG2-CG2 4.1Å; I92-H98 WeakPolarHBondContact O-CA 3.38Å; I92-H98 PolarHBondContact O-CD2 3.31Å; I92-I99 HydrophobicContact CB-CD1 4.19Å; I92-I99 HydrophobicContact CB-CG1 3.83Å; I92-I99 HydrophobicContact CD1-CD1 4.21Å; I92-I99 PolarHBondContact N-O 2.67Å; I92-I99 PolarHBondContact O-N 3.11Å; I92-L127 HydrophobicContact CD1-CD2 4.4Å
93V98.3Very high96.5Very high36 Ų3657.6 Ų57.622%0.21829%0.291CS..EExtended strand (participates in β ladder)trans-113.1125.3162.4-177.10000106.7D6 F7 Y8 E97 H98D6-V93 HydrophobicContact CB-CG1 4.35Å; F7-V93 CarbonylContact C-O 3.59Å; F7-V93 VanDerWaalsContact CA-O 3.27Å; F7-V93 WeakPolarHBondContact CA-O 2.96Å; Y8-V93 HydrophobicContact CD1-CG2 4.47Å; Y8-V93 PolarHBondContact N-O 3.32Å; Y8-V93 PolarHBondContact O-N 3.24Å; V93-E97 WeakPolarHBondContact CA-O 3.39Å; V93-H98 HydrophobicContact CG2-CB 4.44Å
94I95.7Very high96.7Very high15 Ų1553.8 Ų53.88%0.07727%0.271CS..EExtended strand (participates in β ladder)trans-143.3107.4177.4-173.7164.7000109.8F7 K63 I66 D67 T72 I92 D96 E97F7-I94 HydrophobicContact CD2-CB 4.39Å; F7-I94 HydrophobicContact CD2-CD1 4.41Å; F7-I94 HydrophobicContact CD2-CG1 4.3Å; F7-I94 HydrophobicContact CE2-CD1 4.42Å; K63-I94 HydrophobicContact CB-CD1 3.95Å; K63-I94 HydrophobicContact CG-CD1 3.91Å; I66-I94 HydrophobicContact CG2-CD1 4.22Å; D67-I94 VanDerWaalsContact OD1-CD1 3.31Å; D67-I94 WeakPolarHBondContact OD1-CD1 3.22Å; T72-I94 HydrophobicContact CG2-CG2 4.03Å; I92-I94 HydrophobicContact CG2-CB 4.24Å; I92-I94 HydrophobicContact CG2-CG2 4.1Å; I94-D96 PolarHBondContact O-N 3.48Å; I94-E97 HydrophobicContact CG2-CB 4.2Å; I94-E97 PolarHBondContact N-O 3.07Å; I94-E97 PolarHBondContact O-N 3.46Å; I94-E97 VanDerWaalsContact O-N 3.12Å
95G92.3Very high97Very high29 Ų2946.8 Ų46.830%0.29925%0.247SC..THydrogen-bonded Turntrans63.7-120.3-172.600000110.7D6D6-G95 PolarHBondContact O-N 3.24Å
96D93.1Very high97.2Very high180 Ų18043.6 Ų43.696%0.96323%0.227SC*.THydrogen-bonded Turntrans-95.6-2.2179.1-61.5-41.6000113I94I94-D96 PolarHBondContact O-N 3.48Å
97E94.9Very high96.9Very high91 Ų9146.4 Ų46.443%0.42526%0.256SS..EExtended strand (participates in β ladder)trans-91.5134.3179.8-61.3-173.9114.200111T72 V93 I94T72-E97 HydrophobicContact CG2-CB 4.37Å; T72-E97 PolarHBondContact OG1-OE1 3.12Å; T72-E97 PolarHBondContact OG1-OE2 2.94Å; V93-E97 WeakPolarHBondContact CA-O 3.39Å; I94-E97 HydrophobicContact CG2-CB 4.2Å; I94-E97 PolarHBondContact N-O 3.07Å; I94-E97 PolarHBondContact O-N 3.46Å; I94-E97 VanDerWaalsContact O-N 3.12Å
98H97.6Very high96.7Very high118 Ų11843.6 Ų43.655%0.54625%0.251SS..EExtended strand (participates in β ladder)trans-133.2119.9172.7-179.4-159000109.7E91 I92 V93E91-H98 IonicContact OE1-NE2 3.42Å; E91-H98 PolarHBondContact OE1-NE2 3.47Å; I92-H98 WeakPolarHBondContact O-CA 3.38Å; I92-H98 PolarHBondContact O-CD2 3.31Å; V93-H98 HydrophobicContact CG2-CB 4.44Å
99I98.2Very high96.6Very high21 Ų2146 Ų4611%0.10826%0.264CS..EExtended strand (participates in β ladder)trans-120.114817462.4175.5000110.5I71 T72 E91 I92 F101I71-I99 HydrophobicContact CG1-CD1 4.04Å; I71-I99 HydrophobicContact CG2-CD1 4.13Å; T72-I99 HydrophobicContact CG2-CD1 4.29Å; E91-I99 WeakPolarHBondContact CA-O 3.47Å; I92-I99 HydrophobicContact CB-CD1 4.19Å; I92-I99 HydrophobicContact CB-CG1 3.83Å; I92-I99 HydrophobicContact CD1-CD1 4.21Å; I92-I99 PolarHBondContact N-O 2.67Å; I92-I99 PolarHBondContact O-N 3.11Å; I99-F101 HydrophobicContact CB-CE1 4.21Å; I99-F101 HydrophobicContact CB-CZ 4.05Å; I99-F101 HydrophobicContact CD1-CD2 4.39Å; I99-F101 HydrophobicContact CD1-CE2 3.66Å; I99-F101 HydrophobicContact CD1-CZ 3.86Å; I99-F101 HydrophobicContact CG1-CE2 4.48Å; I99-F101 HydrophobicContact CG1-CZ 4.46Å; I99-F101 HydrophobicContact CG2-CZ 4.32Å
100S98.5Very high96.5Very high67 Ų6749.8 Ų49.847%0.46928%0.284SS..EExtended strand (participates in β ladder)trans-144.7107.6174.3-167.90000109L90L90-S100 CarbonylContact O-C 3.47Å; L90-S100 WeakPolarHBondContact O-CA 3.19Å
101F98.8Very high96.4Very high7 Ų753.2 Ų53.23%0.03130%0.303CS..EExtended strand (participates in β ladder)trans-105.6144.9-179.5-56.7-37.6000111.5I71 E74 D76 W79 E89 L90 I99 F124I71-F101 HydrophobicContact CD1-CD2 4.36Å; I71-F101 HydrophobicContact CD1-CE2 3.7Å; I71-F101 HydrophobicContact CG1-CE2 3.77Å; E74-F101 HydrophobicContact CB-CZ 4.22Å; E74-F101 WeakPolarHBondContact O-CE1 3.48Å; E74-F101 VanDerWaalsContact O-CZ 3.29Å; E74-F101 WeakPolarHBondContact O-CZ 3.36Å; D76-F101 HydrophobicContact CB-CB 4.15Å; D76-F101 HydrophobicContact CB-CD1 3.8Å; D76-F101 HydrophobicContact CB-CG 4.23Å; D76-F101 VanDerWaalsContact OD2-CA 3.32Å; D76-F101 WeakPolarHBondContact OD2-CA 3.32Å; W79-F101 HydrophobicContact CE3-CB 4.38Å; W79-F101 HydrophobicContact CH2-CB 4.45Å; W79-F101 AromaticContact CH2-CD2 3.62Å; W79-F101 HydrophobicContact CH2-CD2 3.62Å; W79-F101 AromaticContact CH2-CE2 3.87Å; W79-F101 HydrophobicContact CH2-CE2 3.87Å; W79-F101 AromaticContact CH2-CG 3.98Å; W79-F101 HydrophobicContact CH2-CG 3.98Å; W79-F101 HydrophobicContact CH2-CZ 4.47Å; W79-F101 HydrophobicContact CZ3-CB 3.72Å; W79-F101 HydrophobicContact CZ3-CD1 4.47Å; W79-F101 AromaticContact CZ3-CD2 3.73Å; W79-F101 HydrophobicContact CZ3-CD2 3.73Å; W79-F101 HydrophobicContact CZ3-CE2 4.43Å; W79-F101 AromaticContact CZ3-CG 3.75Å; W79-F101 HydrophobicContact CZ3-CG 3.75Å; E89-F101 VanDerWaalsContact CA-O 3.3Å; E89-F101 WeakPolarHBondContact CA-O 3.34Å; L90-F101 HydrophobicContact CD2-CD2 4.44Å; L90-F101 PolarHBondContact N-O 2.96Å; L90-F101 VanDerWaalsContact N-O 3.09Å; L90-F101 PolarHBondContact O-N 3.29Å; I99-F101 HydrophobicContact CB-CE1 4.21Å; I99-F101 HydrophobicContact CB-CZ 4.05Å; I99-F101 HydrophobicContact CD1-CD2 4.39Å; I99-F101 HydrophobicContact CD1-CE2 3.66Å; I99-F101 HydrophobicContact CD1-CZ 3.86Å; I99-F101 HydrophobicContact CG1-CE2 4.48Å; I99-F101 HydrophobicContact CG1-CZ 4.46Å; I99-F101 HydrophobicContact CG2-CZ 4.32Å; F101-F124 HydrophobicContact CD2-CD2 4.21Å; F101-F124 HydrophobicContact CD2-CE2 4.49Å
102T98.7Very high96.3Very high41 Ų4151.1 Ų51.125%0.25229%0.293SS..EExtended strand (participates in β ladder)trans-137.2118.3173.9-71.60000110.2D76 P82 Q88D76-T102 PolarHBondContact OD2-N 3.14Å; P82-T102 HydrophobicContact CG-CG2 3.27Å; Q88-T102 WeakPolarHBondContact O-CA 3.4Å
103T98.6Very high96.2Very high1 Ų155.5 Ų55.51%0.00632%0.316CS..EExtended strand (participates in β ladder)trans-139.6169.8-178.3-173.50000112.2W79 P80 R87 Q88 F124W79-T103 HydrophobicContact CE3-CG2 4.14Å; P80-T103 CarbonylContact O-C 3.51Å; P80-T103 VanDerWaalsContact O-CA 3.29Å; P80-T103 WeakPolarHBondContact O-CA 2.99Å; P80-T103 PolarHBondContact O-OG1 2.84Å; R87-T103 CarbonylContact C-O 3.57Å; R87-T103 WeakPolarHBondContact CA-O 3.16Å; Q88-T103 HydrophobicContact CB-CG2 3.97Å; Q88-T103 PolarHBondContact N-O 2.77Å; Q88-T103 PolarHBondContact O-N 2.66Å; T103-F124 HydrophobicContact CG2-CD1 4.48Å; T103-F124 HydrophobicContact CG2-CE1 3.73Å; T103-F124 HydrophobicContact CG2-CZ 3.89Å
104S97.7Very high96.2Very high9 Ų961.1 Ų61.16%0.06334%0.34CS..PPolyproline II helixtrans-66.5169.3170-167.30000111.5P80 P81 D83 I106P80-S104 PolarHBondContact O-N 3.31Å; P81-S104 WeakPolarHBondContact O-CB 3.26Å; D83-S104 PolarHBondContact OD1-OG 3.3Å; D83-S104 PolarHBondContact OD2-OG 2.87Å; S104-I106 PolarHBondContact O-N 2.88Å
105K95.7Very high96.2Very high92 Ų9261.5 Ų61.540%0.434%0.344SS..PPolyproline II helixtrans-70.6120.8173.9-176179.1179.4-177.30109.9
106I95.4Very high96.5Very high26 Ų2668.3 Ų68.313%0.13337%0.365CS..PPolyproline II helixtrans-89.1120.1176.9-53.5169000108.5S104 D111 V112 L121 F124 Y125S104-I106 PolarHBondContact O-N 2.88Å; I106-D111 HydrophobicContact CG2-CB 4.34Å; I106-V112 HydrophobicContact CG2-CG2 3.74Å; I106-L121 HydrophobicContact CD1-CD2 3.86Å; I106-F124 HydrophobicContact CD1-CD1 3.67Å; I106-F124 HydrophobicContact CD1-CE1 3.84Å; I106-Y125 HydrophobicContact CB-CD2 4.43Å; I106-Y125 HydrophobicContact CG2-CD2 3.76Å; I106-Y125 HydrophobicContact CG2-CE2 4.21Å
107G90.7Very high96.8Very high61 Ų6161.2 Ų61.263%0.62933%0.328SS*.  trans-89.6-37-178.600000112.9D111G107-D111 VanDerWaalsContact CA-OD2 3.29Å; G107-D111 WeakPolarHBondContact CA-OD2 3.48Å; G107-D111 PolarHBondContact N-OD2 2.91Å
108S93.9Very high96.9Very high40 Ų4058.8 Ų58.828%0.2832%0.319SS..SBendtrans-158.1172.8-175.569.40000112.9I110 D111 V112S108-I110 PolarHBondContact O-N 3.08Å; S108-I110 WeakPolarHBondContact OG-CB 3.25Å; S108-I110 PolarHBondContact OG-N 2.88Å; S108-D111 PolarHBondContact N-OD2 3.41Å; S108-D111 WeakPolarHBondContact O-CB 3.45Å; S108-D111 PolarHBondContact O-N 3.17Å; S108-D111 VanDerWaalsContact O-N 3.14Å; S108-V112 PolarHBondContact O-N 2.86Å
109L95.3Very high97Very high61 Ų6158.8 Ų58.832%0.31932%0.32SS..Hα-helixtrans-62.5-18.2170.8-71173.5000113.5D111 V112 N113 Y125 Y126L109-D111 VanDerWaalsContact C-N 3.34Å; L109-V112 PolarHBondContact O-N 2.82Å; L109-N113 WeakPolarHBondContact O-CB 3.39Å; L109-N113 PolarHBondContact O-N 3.25Å; L109-N113 PolarHBondContact O-ND2 3.47Å; L109-N113 VanDerWaalsContact O-ND2 3.16Å; L109-Y125 HydrophobicContact CD2-CD1 3.55Å; L109-Y125 HydrophobicContact CD2-CE1 3.58Å; L109-Y125 HydrophobicContact CD2-CG 4.44Å; L109-Y125 HydrophobicContact CG-CD1 4.3Å; L109-Y125 HydrophobicContact CG-CE1 3.81Å; L109-Y126 HydrophobicContact CD2-CE2 4.39Å
110I97.1Very high97Very high105 Ų10557.8 Ų57.854%0.53831%0.314SS..Hα-helixtrans-64.7-44.5173.8-61.2175.2000109.5S108 V112 N113 Q114S108-I110 PolarHBondContact O-N 3.08Å; S108-I110 WeakPolarHBondContact OG-CB 3.25Å; S108-I110 PolarHBondContact OG-N 2.88Å; I110-V112 VanDerWaalsContact C-N 3.3Å; I110-V112 PolarHBondContact O-N 2.81Å; I110-N113 PolarHBondContact O-N 3.06Å; I110-Q114 HydrophobicContact CG2-CG 4.49Å; I110-Q114 WeakPolarHBondContact O-CB 3.48Å; I110-Q114 WeakPolarHBondContact O-CG 3.38Å; I110-Q114 PolarHBondContact O-N 3.46Å
111D95.8Very high97Very high72 Ų7254.7 Ų54.739%0.38529%0.293SS..Hα-helixtrans-63.7-39.7179.3-51.2-43.3000110.9I106 G107 S108 L109 S115I106-D111 HydrophobicContact CG2-CB 4.34Å; G107-D111 VanDerWaalsContact CA-OD2 3.29Å; G107-D111 WeakPolarHBondContact CA-OD2 3.48Å; G107-D111 PolarHBondContact N-OD2 2.91Å; S108-D111 PolarHBondContact N-OD2 3.41Å; S108-D111 WeakPolarHBondContact O-CB 3.45Å; S108-D111 PolarHBondContact O-N 3.17Å; S108-D111 VanDerWaalsContact O-N 3.14Å; L109-D111 VanDerWaalsContact C-N 3.34Å; D111-S115 PolarHBondContact O-N 2.83Å
112V97.6Very high97Very high0 Ų057.4 Ų57.40%030%0.303CS..Hα-helixtrans-61.3-52.3175175.70000110.7I106 S108 L109 I110 Q114 S115 P118 L121 R122 Y125I106-V112 HydrophobicContact CG2-CG2 3.74Å; S108-V112 PolarHBondContact O-N 2.86Å; L109-V112 PolarHBondContact O-N 2.82Å; I110-V112 VanDerWaalsContact C-N 3.3Å; I110-V112 PolarHBondContact O-N 2.81Å; V112-Q114 PolarHBondContact O-N 2.9Å; V112-S115 VanDerWaalsContact O-CB 3.27Å; V112-S115 WeakPolarHBondContact O-CB 3.29Å; V112-S115 PolarHBondContact O-N 2.84Å; V112-S115 VanDerWaalsContact O-N 3.11Å; V112-S115 PolarHBondContact O-OG 2.93Å; V112-P118 WeakPolarHBondContact CG1-O 3.17Å; V112-P118 WeakPolarHBondContact O-CA 3.11Å; V112-P118 WeakPolarHBondContact O-CB 3.38Å; V112-L121 HydrophobicContact CG1-CB 3.94Å; V112-L121 HydrophobicContact CG2-CB 4.47Å; V112-R122 HydrophobicContact CG1-CB 3.87Å; V112-Y125 HydrophobicContact CG2-CD2 4.49Å; V112-Y125 HydrophobicContact CG2-CG 4.29Å
113N97.3Very high97Very high94 Ų9457.1 Ų57.150%0.50330%0.301SS..Hα-helixtrans-67.1-22.4-175.9-69.7-23.9000113.5L109 I110 R122L109-N113 WeakPolarHBondContact O-CB 3.39Å; L109-N113 PolarHBondContact O-N 3.25Å; L109-N113 PolarHBondContact O-ND2 3.47Å; L109-N113 VanDerWaalsContact O-ND2 3.16Å; I110-N113 PolarHBondContact O-N 3.06Å; N113-R122 PolarHBondContact OD1-NH2 3.37Å; N113-R122 VanDerWaalsContact OD1-NH2 3.12Å
114Q96.7Very high97Very high154 Ų15457.1 Ų57.172%0.7230%0.301SS*.THydrogen-bonded Turntrans-91.8-1.8177.2-69.4180-5.100113.5I110 V112I110-Q114 HydrophobicContact CG2-CG 4.49Å; I110-Q114 WeakPolarHBondContact O-CB 3.48Å; I110-Q114 WeakPolarHBondContact O-CG 3.38Å; I110-Q114 PolarHBondContact O-N 3.46Å; V112-Q114 PolarHBondContact O-N 2.9Å
115S97.4Very high97Very high22 Ų2259 Ų5915%0.15431%0.307CS..SBendtrans-76.8173.2179.877.20000112.8D111 V112 D117 P118 L121D111-S115 PolarHBondContact O-N 2.83Å; V112-S115 VanDerWaalsContact O-CB 3.27Å; V112-S115 WeakPolarHBondContact O-CB 3.29Å; V112-S115 PolarHBondContact O-N 2.84Å; V112-S115 VanDerWaalsContact O-N 3.11Å; V112-S115 PolarHBondContact O-OG 2.93Å; S115-D117 VanDerWaalsContact C-N 3.29Å; S115-D117 PolarHBondContact OG-N 3.02Å; S115-D117 PolarHBondContact OG-O 3.27Å; S115-P118 WeakPolarHBondContact OG-CA 3.45Å; S115-L121 VanDerWaalsContact CB-CD1 3.45Å; S115-L121 WeakPolarHBondContact OG-CD1 3.32Å
116K98.2Very high97.1Very high173 Ų17359.9 Ų59.975%0.75231%0.308SS*.SBendtrans-80-13174.6-64.7-179.7-179.8177.20113.4L78L78-K116 HydrophobicContact CB-CB 4.1Å
117D98.4Very high97.3Very high31 Ų3158.8 Ų58.817%0.16630%0.303CS..  trans-140.776.2177.4174.631.6000109.7L78 W79 S115 E119 G120 L121L78-D117 HydrophobicContact CB-CB 3.96Å; L78-D117 HydrophobicContact CD1-CB 4.49Å; W79-D117 PolarHBondContact NE1-OD2 3.34Å; S115-D117 VanDerWaalsContact C-N 3.29Å; S115-D117 PolarHBondContact OG-N 3.02Å; S115-D117 PolarHBondContact OG-O 3.27Å; D117-E119 VanDerWaalsContact C-N 3.26Å; D117-E119 PolarHBondContact O-N 2.68Å; D117-G120 PolarHBondContact OD1-N 2.97Å; D117-G120 WeakPolarHBondContact OD2-CA 3.11Å; D117-L121 WeakPolarHBondContact O-CB 3.4Å; D117-L121 PolarHBondContact O-N 3.14Å
118P98.2Very high97.7Very high39 Ų3956.1 Ų56.125%0.25327%0.274SS..Hα-helixtrans-70.8-20.9-176.328.7-35.8000113.3V112 S115 R122V112-P118 WeakPolarHBondContact CG1-O 3.17Å; V112-P118 WeakPolarHBondContact O-CA 3.11Å; V112-P118 WeakPolarHBondContact O-CB 3.38Å; S115-P118 WeakPolarHBondContact OG-CA 3.45Å; P118-R122 WeakPolarHBondContact O-CB 3.26Å; P118-R122 PolarHBondContact O-N 3.16Å; P118-R122 PolarHBondContact O-NH1 2.9Å; P118-R122 PolarHBondContact O-NH2 3.27Å
119E98.3Very high97.9Very high118 Ų11857.7 Ų57.755%0.55128%0.277SS*.Hα-helixtrans-77.6-54.9179.2-60.9-53119.800110.3D117 L121 R122 V123D117-E119 VanDerWaalsContact C-N 3.26Å; D117-E119 PolarHBondContact O-N 2.68Å; E119-L121 PolarHBondContact O-N 3.2Å; E119-R122 WeakPolarHBondContact O-CB 3.32Å; E119-R122 PolarHBondContact O-N 2.99Å; E119-R122 IonicContact OE1-CZ 3.42Å; E119-R122 IonicContact OE1-NH1 2.66Å; E119-R122 PolarHBondContact OE1-NH1 3.48Å; E119-R122 IonicContact OE1-NH2 3.75Å; E119-R122 PolarHBondContact OE1-NH2 3.19Å; E119-R122 IonicContact OE2-NH1 2.82Å; E119-R122 PolarHBondContact OE2-NH1 3.01Å; E119-V123 PolarHBondContact O-N 2.9Å; E119-V123 VanDerWaalsContact O-N 3.12Å
120G98.4Very high98Very high0 Ų059 Ų590%029%0.285CS..Hα-helixtrans-64.2-40.6179.800000113E74 D117 R122 V123 F124E74-G120 VanDerWaalsContact CD-CA 3.47Å; E74-G120 WeakPolarHBondContact OE2-CA 3.44Å; D117-G120 PolarHBondContact OD1-N 2.97Å; D117-G120 WeakPolarHBondContact OD2-CA 3.11Å; G120-R122 PolarHBondContact O-N 2.92Å; G120-V123 WeakPolarHBondContact O-CB 3.49Å; G120-V123 PolarHBondContact O-N 3.01Å; G120-F124 PolarHBondContact O-N 2.88Å
121L98.3Very high98.1Very high3 Ų354 Ų542%0.01626%0.259CS..Hα-helixtrans-65.5-26.9174-82.3-178.9000113.6W79 P80 I106 V112 S115 D117 E119 Y125W79-L121 HydrophobicContact CB-CD2 4.08Å; W79-L121 HydrophobicContact CB-CG 4.44Å; W79-L121 HydrophobicContact CD2-CD2 3.31Å; W79-L121 HydrophobicContact CD2-CG 3.9Å; W79-L121 HydrophobicContact CE3-CD2 3.65Å; W79-L121 HydrophobicContact CG-CD1 4.31Å; W79-L121 HydrophobicContact CG-CD2 3.51Å; W79-L121 HydrophobicContact CG-CG 3.75Å; W79-L121 HydrophobicContact CZ2-CD2 4.32Å; W79-L121 HydrophobicContact CZ3-CD2 4.27Å; P80-L121 HydrophobicContact CG-CD1 4.46Å; I106-L121 HydrophobicContact CD1-CD2 3.86Å; V112-L121 HydrophobicContact CG1-CB 3.94Å; V112-L121 HydrophobicContact CG2-CB 4.47Å; S115-L121 VanDerWaalsContact CB-CD1 3.45Å; S115-L121 WeakPolarHBondContact OG-CD1 3.32Å; D117-L121 WeakPolarHBondContact O-CB 3.4Å; D117-L121 PolarHBondContact O-N 3.14Å; E119-L121 PolarHBondContact O-N 3.2Å; L121-Y125 WeakPolarHBondContact O-CB 3.5Å; L121-Y125 PolarHBondContact O-N 3.24Å
122R98.6Very high98.2Very high63 Ų6353 Ų5324%0.23825%0.251CS..Hα-helixtrans-71.6-42175.5-172.6178-54.3108.23.6110.9V112 N113 P118 E119 G120 Y125 Y126V112-R122 HydrophobicContact CG1-CB 3.87Å; N113-R122 PolarHBondContact OD1-NH2 3.37Å; N113-R122 VanDerWaalsContact OD1-NH2 3.12Å; P118-R122 WeakPolarHBondContact O-CB 3.26Å; P118-R122 PolarHBondContact O-N 3.16Å; P118-R122 PolarHBondContact O-NH1 2.9Å; P118-R122 PolarHBondContact O-NH2 3.27Å; E119-R122 WeakPolarHBondContact O-CB 3.32Å; E119-R122 PolarHBondContact O-N 2.99Å; E119-R122 IonicContact OE1-CZ 3.42Å; E119-R122 IonicContact OE1-NH1 2.66Å; E119-R122 PolarHBondContact OE1-NH1 3.48Å; E119-R122 IonicContact OE1-NH2 3.75Å; E119-R122 PolarHBondContact OE1-NH2 3.19Å; E119-R122 IonicContact OE2-NH1 2.82Å; E119-R122 PolarHBondContact OE2-NH1 3.01Å; G120-R122 PolarHBondContact O-N 2.92Å; R122-Y125 PolarHBondContact O-N 2.82Å; R122-Y126 HydrophobicContact CG-CD2 3.7Å; R122-Y126 HydrophobicContact CG-CE2 3.44Å; R122-Y126 VanDerWaalsContact CG-CE2 3.44Å; R122-Y126 VanDerWaalsContact O-CD2 3.22Å; R122-Y126 WeakPolarHBondContact O-CD2 3.5Å; R122-Y126 PolarHBondContact O-N 3.21Å
123V98.7Very high98.3Very high35 Ų3556.6 Ų56.621%0.21228%0.276CS..Hα-helixtrans-56.8-52.2172.4174.50000109.9S69 I71 E74 E119 G120 Y125 Y126 L127S69-V123 WeakPolarHBondContact O-CG1 3.24Å; I71-V123 HydrophobicContact CB-CG1 4.19Å; I71-V123 HydrophobicContact CD1-CG1 3.89Å; E74-V123 HydrophobicContact CG-CB 4.28Å; E74-V123 HydrophobicContact CG-CG1 4.25Å; E119-V123 PolarHBondContact O-N 2.9Å; E119-V123 VanDerWaalsContact O-N 3.12Å; G120-V123 WeakPolarHBondContact O-CB 3.49Å; G120-V123 PolarHBondContact O-N 3.01Å; V123-Y125 PolarHBondContact O-N 2.91Å; V123-Y126 PolarHBondContact O-N 2.83Å; V123-L127 WeakPolarHBondContact O-CB 3.29Å; V123-L127 PolarHBondContact O-N 2.92Å
124F98.7Very high98.3Very high1 Ų154.1 Ų54.10%0.00426%0.262CS..Hα-helixtrans-56.6-45.7176.1179.2-96.2000112.9I71 W79 Q88 L90 F101 T103 I106 G120 Y126 V128I71-F124 HydrophobicContact CD1-CB 4.15Å; I71-F124 HydrophobicContact CD1-CD2 4.41Å; W79-F124 HydrophobicContact CH2-CB 3.59Å; W79-F124 AromaticContact CH2-CD2 3.72Å; W79-F124 HydrophobicContact CH2-CD2 3.72Å; W79-F124 AromaticContact CH2-CG 3.8Å; W79-F124 HydrophobicContact CH2-CG 3.8Å; W79-F124 HydrophobicContact CZ2-CB 4.21Å; W79-F124 HydrophobicContact CZ3-CB 4.02Å; W79-F124 HydrophobicContact CZ3-CD1 4.35Å; W79-F124 AromaticContact CZ3-CD2 3.53Å; W79-F124 HydrophobicContact CZ3-CD2 3.53Å; W79-F124 AromaticContact CZ3-CE2 4Å; W79-F124 HydrophobicContact CZ3-CE2 4Å; W79-F124 AromaticContact CZ3-CG 3.72Å; W79-F124 HydrophobicContact CZ3-CG 3.72Å; Q88-F124 HydrophobicContact CB-CE1 4.41Å; Q88-F124 HydrophobicContact CB-CZ 4.1Å; L90-F124 HydrophobicContact CB-CE2 3.67Å; L90-F124 HydrophobicContact CB-CZ 4.49Å; L90-F124 HydrophobicContact CD2-CD2 3.97Å; L90-F124 HydrophobicContact CD2-CE2 3.88Å; L90-F124 HydrophobicContact CG-CE2 4.44Å; F101-F124 HydrophobicContact CD2-CD2 4.21Å; F101-F124 HydrophobicContact CD2-CE2 4.49Å; T103-F124 HydrophobicContact CG2-CD1 4.48Å; T103-F124 HydrophobicContact CG2-CE1 3.73Å; T103-F124 HydrophobicContact CG2-CZ 3.89Å; I106-F124 HydrophobicContact CD1-CD1 3.67Å; I106-F124 HydrophobicContact CD1-CE1 3.84Å; G120-F124 PolarHBondContact O-N 2.88Å; F124-Y126 PolarHBondContact O-N 2.82Å; F124-V128 HydrophobicContact CD1-CG2 4.3Å; F124-V128 HydrophobicContact CD2-CG2 4.35Å; F124-V128 HydrophobicContact CE1-CG2 4.02Å; F124-V128 HydrophobicContact CE2-CG2 4.08Å; F124-V128 HydrophobicContact CG-CG2 4.46Å; F124-V128 HydrophobicContact CZ-CG2 3.9Å; F124-V128 WeakPolarHBondContact O-CB 3.4Å; F124-V128 VanDerWaalsContact O-CG2 3.25Å; F124-V128 WeakPolarHBondContact O-CG2 3.38Å; F124-V128 PolarHBondContact O-N 2.94Å
125Y98.5Very high98.4Very high50 Ų5046.8 Ų46.820%0.19623%0.228CC..Hα-helixtrans-62-41-178.2176.1-102.3000113I106 L109 V112 L121 R122 V123 Q129I106-Y125 HydrophobicContact CB-CD2 4.43Å; I106-Y125 HydrophobicContact CG2-CD2 3.76Å; I106-Y125 HydrophobicContact CG2-CE2 4.21Å; L109-Y125 HydrophobicContact CD2-CD1 3.55Å; L109-Y125 HydrophobicContact CD2-CE1 3.58Å; L109-Y125 HydrophobicContact CD2-CG 4.44Å; L109-Y125 HydrophobicContact CG-CD1 4.3Å; L109-Y125 HydrophobicContact CG-CE1 3.81Å; V112-Y125 HydrophobicContact CG2-CD2 4.49Å; V112-Y125 HydrophobicContact CG2-CG 4.29Å; L121-Y125 WeakPolarHBondContact O-CB 3.5Å; L121-Y125 PolarHBondContact O-N 3.24Å; R122-Y125 PolarHBondContact O-N 2.82Å; V123-Y125 PolarHBondContact O-N 2.91Å; Y125-Q129 PolarHBondContact O-N 2.99Å; Y125-Q129 PolarHBondContact O-NE2 2.58Å
126Y98.6Very high98.4Very high109 Ų10947.9 Ų47.943%0.42723%0.23SC..Hα-helixtrans-76.7-43.9178.1-73.4-59.7000112.3L109 R122 V123 F124 V128 Q129 D130L109-Y126 HydrophobicContact CD2-CE2 4.39Å; R122-Y126 HydrophobicContact CG-CD2 3.7Å; R122-Y126 HydrophobicContact CG-CE2 3.44Å; R122-Y126 VanDerWaalsContact CG-CE2 3.44Å; R122-Y126 VanDerWaalsContact O-CD2 3.22Å; R122-Y126 WeakPolarHBondContact O-CD2 3.5Å; R122-Y126 PolarHBondContact O-N 3.21Å; V123-Y126 PolarHBondContact O-N 2.83Å; F124-Y126 PolarHBondContact O-N 2.82Å; Y126-V128 VanDerWaalsContact C-N 3.3Å; Y126-V128 PolarHBondContact O-N 3.16Å; Y126-Q129 WeakPolarHBondContact O-CA 3.46Å; Y126-Q129 WeakPolarHBondContact O-CB 3.28Å; Y126-Q129 PolarHBondContact O-N 3Å; Y126-D130 PolarHBondContact O-N 2.82Å
127L98.8Very high98.4Very high3 Ų342.9 Ų42.92%0.01622%0.217CC..Hα-helixtrans-55.9-46.1176.1175.564.4000111.5I65 I71 L90 I92 V123 Q129 D130 L131I65-L127 HydrophobicContact CG2-CD1 3.74Å; I71-L127 HydrophobicContact CB-CD2 3.64Å; I71-L127 HydrophobicContact CD1-CD2 4.25Å; I71-L127 HydrophobicContact CG1-CD2 3.59Å; I71-L127 HydrophobicContact CG2-CD2 3.62Å; L90-L127 HydrophobicContact CD2-CD2 4.02Å; I92-L127 HydrophobicContact CD1-CD2 4.4Å; V123-L127 WeakPolarHBondContact O-CB 3.29Å; V123-L127 PolarHBondContact O-N 2.92Å; L127-Q129 PolarHBondContact O-N 2.84Å; L127-D130 PolarHBondContact O-N 3.38Å; L127-L131 HydrophobicContact CD1-CD1 4.14Å; L127-L131 HydrophobicContact CD1-CD2 4.43Å; L127-L131 HydrophobicContact CD1-CG 4.03Å; L127-L131 HydrophobicContact CD2-CD1 4.49Å; L127-L131 HydrophobicContact CG-CD1 3.93Å; L127-L131 HydrophobicContact CG-CG 4.25Å; L127-L131 WeakPolarHBondContact O-CB 3.21Å; L127-L131 VanDerWaalsContact O-CG 3.26Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.47Å
128V98.5Very high98.4Very high5 Ų543.4 Ų43.43%0.0322%0.22CC..Hα-helixtrans-59.6-35.11781650000112.1Y11 F124 Y126 K132Y11-V128 HydrophobicContact CD2-CG1 4.4Å; Y11-V128 HydrophobicContact CD2-CG2 3.96Å; Y11-V128 HydrophobicContact CE1-CG1 4.17Å; Y11-V128 HydrophobicContact CE2-CB 4.23Å; Y11-V128 HydrophobicContact CE2-CG1 3.57Å; Y11-V128 HydrophobicContact CE2-CG2 3.54Å; Y11-V128 VanDerWaalsContact CZ-CG1 3.41Å; Y11-V128 VanDerWaalsContact OH-CG1 3.24Å; Y11-V128 WeakPolarHBondContact OH-CG1 3.49Å; F124-V128 HydrophobicContact CD1-CG2 4.3Å; F124-V128 HydrophobicContact CD2-CG2 4.35Å; F124-V128 HydrophobicContact CE1-CG2 4.02Å; F124-V128 HydrophobicContact CE2-CG2 4.08Å; F124-V128 HydrophobicContact CG-CG2 4.46Å; F124-V128 HydrophobicContact CZ-CG2 3.9Å; F124-V128 WeakPolarHBondContact O-CB 3.4Å; F124-V128 VanDerWaalsContact O-CG2 3.25Å; F124-V128 WeakPolarHBondContact O-CG2 3.38Å; F124-V128 PolarHBondContact O-N 2.94Å; Y126-V128 VanDerWaalsContact C-N 3.3Å; Y126-V128 PolarHBondContact O-N 3.16Å; V128-K132 HydrophobicContact CG1-CD 4.15Å; V128-K132 WeakPolarHBondContact O-CB 3.44Å; V128-K132 VanDerWaalsContact O-CG 3.26Å; V128-K132 WeakPolarHBondContact O-CG 3.16Å; V128-K132 PolarHBondContact O-N 2.96Å
129Q98.3Very high98.4Very high74 Ų7441.6 Ų41.635%0.34621%0.208SC..Hα-helixtrans-69.5-45176-77.8172.982.700111.8Y125 Y126 L127 L131 K132 C133Y125-Q129 PolarHBondContact O-N 2.99Å; Y125-Q129 PolarHBondContact O-NE2 2.58Å; Y126-Q129 WeakPolarHBondContact O-CA 3.46Å; Y126-Q129 WeakPolarHBondContact O-CB 3.28Å; Y126-Q129 PolarHBondContact O-N 3Å; L127-Q129 PolarHBondContact O-N 2.84Å; Q129-L131 VanDerWaalsContact C-N 3.34Å; Q129-L131 PolarHBondContact O-N 2.89Å; Q129-K132 PolarHBondContact O-N 3.41Å; Q129-C133 WeakPolarHBondContact O-CB 3.32Å; Q129-C133 PolarHBondContact O-N 3.16Å; Q129-C133 PolarHBondContact O-SG 3.45Å
130D98.7Very high98.4Very high89 Ų8936.9 Ų36.948%0.47619%0.19SC..Hα-helixtrans-61.2-44.4178.1-69.1-28.1000111.3I65 Y126 L127 K132 C133 L134I65-D130 HydrophobicContact CG2-CB 4.2Å; Y126-D130 PolarHBondContact O-N 2.82Å; L127-D130 PolarHBondContact O-N 3.38Å; D130-K132 PolarHBondContact O-N 2.95Å; D130-C133 WeakPolarHBondContact O-CB 3.43Å; D130-C133 PolarHBondContact O-N 3.17Å; D130-L134 PolarHBondContact O-N 2.83Å
131L98.7Very high98.3Very high0 Ų043.8 Ų43.80%023%0.227CC..Hα-helixtrans-60.5-45.6175.3-67.1175.5000112L9 F26 L62 L90 L127 Q129 L134 V135L9-L131 HydrophobicContact CD1-CD1 3.96Å; L9-L131 HydrophobicContact CD1-CD2 3.66Å; L9-L131 HydrophobicContact CD1-CG 4.47Å; L9-L131 HydrophobicContact CD2-CD1 4.43Å; F26-L131 HydrophobicContact CE2-CB 4.19Å; F26-L131 HydrophobicContact CZ-CB 3.9Å; L62-L131 HydrophobicContact CD2-CD2 3.59Å; L90-L131 HydrophobicContact CD1-CD1 4.23Å; L127-L131 HydrophobicContact CD1-CD1 4.14Å; L127-L131 HydrophobicContact CD1-CD2 4.43Å; L127-L131 HydrophobicContact CD1-CG 4.03Å; L127-L131 HydrophobicContact CD2-CD1 4.49Å; L127-L131 HydrophobicContact CG-CD1 3.93Å; L127-L131 HydrophobicContact CG-CG 4.25Å; L127-L131 WeakPolarHBondContact O-CB 3.21Å; L127-L131 VanDerWaalsContact O-CG 3.26Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.47Å; Q129-L131 VanDerWaalsContact C-N 3.34Å; Q129-L131 PolarHBondContact O-N 2.89Å; L131-L134 PolarHBondContact O-N 3.26Å; L131-V135 WeakPolarHBondContact O-CB 3.49Å; L131-V135 VanDerWaalsContact O-CG2 3.29Å; L131-V135 WeakPolarHBondContact O-CG2 3.38Å; L131-V135 PolarHBondContact O-N 3.43Å
132K98.3Very high98.3Very high49 Ų4949.8 Ų49.821%0.21325%0.254CS..Hα-helixtrans-61-45176-79.5174.5-177.21720111.6Y11 F26 V128 Q129 D130 L134 V135 F136Y11-K132 WeakPolarHBondContact OH-CE 3.46Å; Y11-K132 PolarHBondContact OH-NZ 3.25Å; F26-K132 HydrophobicContact CE1-CG 4.09Å; V128-K132 HydrophobicContact CG1-CD 4.15Å; V128-K132 WeakPolarHBondContact O-CB 3.44Å; V128-K132 VanDerWaalsContact O-CG 3.26Å; V128-K132 WeakPolarHBondContact O-CG 3.16Å; V128-K132 PolarHBondContact O-N 2.96Å; Q129-K132 PolarHBondContact O-N 3.41Å; D130-K132 PolarHBondContact O-N 2.95Å; K132-L134 VanDerWaalsContact C-N 3.33Å; K132-L134 PolarHBondContact O-N 3.35Å; K132-V135 PolarHBondContact O-N 2.81Å; K132-F136 HydrophobicContact CB-CD2 4.37Å; K132-F136 HydrophobicContact CB-CE2 4Å; K132-F136 HydrophobicContact CB-CZ 4.21Å; K132-F136 HydrophobicContact CG-CE2 4.46Å; K132-F136 HydrophobicContact CG-CZ 4.25Å; K132-F136 VanDerWaalsContact O-CB 3.25Å; K132-F136 WeakPolarHBondContact O-CB 3.16Å; K132-F136 WeakPolarHBondContact O-CD2 3.25Å; K132-F136 WeakPolarHBondContact O-CG 3.09Å; K132-F136 PolarHBondContact O-N 3.15Å
133C98.3Very high98.2Very high77 Ų7749.5 Ų49.552%0.5226%0.255SS..Hα-helixtrans-57.9-45.5178.2-75.60000111.7Q129 D130 S137Q129-C133 WeakPolarHBondContact O-CB 3.32Å; Q129-C133 PolarHBondContact O-N 3.16Å; Q129-C133 PolarHBondContact O-SG 3.45Å; D130-C133 WeakPolarHBondContact O-CB 3.43Å; D130-C133 PolarHBondContact O-N 3.17Å; C133-S137 WeakPolarHBondContact O-CB 3.41Å; C133-S137 PolarHBondContact O-N 3.02Å; C133-S137 VanDerWaalsContact O-N 3.1Å; C133-S137 PolarHBondContact O-OG 3.36Å
134L98.5Very high98.1Very high41 Ų4156.9 Ų56.922%0.21528%0.284CS..Hα-helixtrans-63.8-50.7177.1178.559.4000111.4L62 I65 D130 L131 K132 F136 S137 L138L62-L134 HydrophobicContact CD2-CD2 3.56Å; L62-L134 HydrophobicContact CG-CD2 3.77Å; I65-L134 HydrophobicContact CD1-CD2 4.33Å; D130-L134 PolarHBondContact O-N 2.83Å; L131-L134 PolarHBondContact O-N 3.26Å; K132-L134 VanDerWaalsContact C-N 3.33Å; K132-L134 PolarHBondContact O-N 3.35Å; L134-F136 PolarHBondContact O-N 3Å; L134-S137 WeakPolarHBondContact O-CB 3.34Å; L134-S137 PolarHBondContact O-N 2.89Å; L134-L138 HydrophobicContact CD1-CD1 4.15Å; L134-L138 HydrophobicContact CD1-CG 4.28Å; L134-L138 HydrophobicContact CG-CD1 4.07Å; L134-L138 WeakPolarHBondContact O-CG 3.46Å; L134-L138 PolarHBondContact O-N 3.25Å
135V98.5Very high97.7Very high0 Ų059.3 Ų59.30%030%0.297CS..Hα-helixtrans-62.6-44.6-178.3171.20000111.6F26 F28 Y36 L131 K132 S137 L138 I139F26-V135 HydrophobicContact CB-CG1 4.08Å; F26-V135 HydrophobicContact CB-CG2 4.49Å; F26-V135 HydrophobicContact CD1-CB 4.35Å; F26-V135 HydrophobicContact CD1-CG1 3.99Å; F26-V135 HydrophobicContact CD1-CG2 4.2Å; F26-V135 HydrophobicContact CD2-CG2 3.75Å; F26-V135 HydrophobicContact CE1-CG2 4.33Å; F26-V135 HydrophobicContact CE2-CG2 3.89Å; F26-V135 HydrophobicContact CG-CB 4.43Å; F26-V135 HydrophobicContact CG-CG1 4.02Å; F26-V135 HydrophobicContact CG-CG2 3.9Å; F26-V135 HydrophobicContact CZ-CG2 4.18Å; F28-V135 HydrophobicContact CE2-CG2 3.62Å; F28-V135 HydrophobicContact CZ-CG2 3.83Å; Y36-V135 HydrophobicContact CD2-CG1 3.69Å; Y36-V135 HydrophobicContact CE2-CG1 4.15Å; L131-V135 WeakPolarHBondContact O-CB 3.49Å; L131-V135 VanDerWaalsContact O-CG2 3.29Å; L131-V135 WeakPolarHBondContact O-CG2 3.38Å; L131-V135 PolarHBondContact O-N 3.43Å; K132-V135 PolarHBondContact O-N 2.81Å; V135-S137 VanDerWaalsContact C-N 3.3Å; V135-S137 PolarHBondContact O-N 3.29Å; V135-L138 PolarHBondContact O-N 2.88Å; V135-I139 HydrophobicContact CG1-CG1 4.14Å; V135-I139 WeakPolarHBondContact O-CB 3.42Å; V135-I139 VanDerWaalsContact O-CG1 3.32Å; V135-I139 WeakPolarHBondContact O-CG1 3.08Å; V135-I139 PolarHBondContact O-N 3.2Å
136F98Very high97.2Very high45 Ų4565.2 Ų65.220%0.19732%0.323CS..Hα-helixtrans-63.4-37.4178.2-66.9-14.2000112L24 Y36 K132 L134 G140 P147 I148L24-F136 HydrophobicContact CD1-CE1 4.19Å; L24-F136 HydrophobicContact CD2-CE1 3.84Å; L24-F136 HydrophobicContact CD2-CZ 3.7Å; Y36-F136 HydrophobicContact CE2-CD1 4.3Å; Y36-F136 HydrophobicContact CE2-CE1 4.16Å; K132-F136 HydrophobicContact CB-CD2 4.37Å; K132-F136 HydrophobicContact CB-CE2 4Å; K132-F136 HydrophobicContact CB-CZ 4.21Å; K132-F136 HydrophobicContact CG-CE2 4.46Å; K132-F136 HydrophobicContact CG-CZ 4.25Å; K132-F136 VanDerWaalsContact O-CB 3.25Å; K132-F136 WeakPolarHBondContact O-CB 3.16Å; K132-F136 WeakPolarHBondContact O-CD2 3.25Å; K132-F136 WeakPolarHBondContact O-CG 3.09Å; K132-F136 PolarHBondContact O-N 3.15Å; L134-F136 PolarHBondContact O-N 3Å; F136-G140 WeakPolarHBondContact O-CA 3.41Å; F136-G140 PolarHBondContact O-N 2.98Å; F136-P147 HydrophobicContact CB-CB 4.22Å; F136-P147 HydrophobicContact CB-CG 3.72Å; F136-P147 HydrophobicContact CD1-CB 3.86Å; F136-P147 HydrophobicContact CD1-CG 4.15Å; F136-P147 HydrophobicContact CG-CB 4.2Å; F136-P147 HydrophobicContact CG-CG 3.96Å; F136-I148 HydrophobicContact CD2-CD1 4.46Å; F136-I148 HydrophobicContact CE2-CD1 3.95Å; F136-I148 HydrophobicContact CE2-CG1 4.32Å; F136-I148 HydrophobicContact CZ-CD1 4.31Å; F136-I148 HydrophobicContact CZ-CG1 4.28Å
137S98.3Very high96.2Very high68 Ų6861.2 Ų61.248%0.47631%0.311SS..Hα-helixtrans-64.1-47.7173.7-600000111.6C133 L134 V135 L141C133-S137 WeakPolarHBondContact O-CB 3.41Å; C133-S137 PolarHBondContact O-N 3.02Å; C133-S137 VanDerWaalsContact O-N 3.1Å; C133-S137 PolarHBondContact O-OG 3.36Å; L134-S137 WeakPolarHBondContact O-CB 3.34Å; L134-S137 PolarHBondContact O-N 2.89Å; V135-S137 VanDerWaalsContact C-N 3.3Å; V135-S137 PolarHBondContact O-N 3.29Å; S137-L141 VanDerWaalsContact O-CB 3.28Å; S137-L141 WeakPolarHBondContact O-CB 3.28Å; S137-L141 VanDerWaalsContact O-CG 3.28Å; S137-L141 WeakPolarHBondContact O-CG 3.47Å; S137-L141 PolarHBondContact O-N 2.85Å
138L98.3Very high95.2Very high43 Ų4367.2 Ų67.223%0.22534%0.342CS..Hα-helixtrans-60.4-51.4178.8-69.7170000111.7F28 L34 V54 V58 L134 V135 H142F28-L138 HydrophobicContact CE1-CD1 4.36Å; F28-L138 HydrophobicContact CZ-CD1 4.18Å; L34-L138 HydrophobicContact CD2-CB 4.23Å; L34-L138 HydrophobicContact CD2-CD1 4.17Å; V54-L138 HydrophobicContact CG1-CD1 4.35Å; V58-L138 HydrophobicContact CG1-CD1 3.92Å; L134-L138 HydrophobicContact CD1-CD1 4.15Å; L134-L138 HydrophobicContact CD1-CG 4.28Å; L134-L138 HydrophobicContact CG-CD1 4.07Å; L134-L138 WeakPolarHBondContact O-CG 3.46Å; L134-L138 PolarHBondContact O-N 3.25Å; V135-L138 PolarHBondContact O-N 2.88Å; L138-H142 WeakPolarHBondContact O-CB 3.43Å; L138-H142 PolarHBondContact O-N 3.1Å
139I97.8Very high95Very high1 Ų170.4 Ų70.41%0.00536%0.357CS..Hα-helixtrans-66.8-45.6-178.6-65.1-61.2000111L34 Y36 K50 V135 F143 I145 P147L34-I139 HydrophobicContact CD2-CD1 3.87Å; L34-I139 HydrophobicContact CD2-CG1 4.35Å; L34-I139 HydrophobicContact CG-CD1 4.39Å; Y36-I139 HydrophobicContact CD1-CG1 4.46Å; Y36-I139 HydrophobicContact CD1-CG2 4.33Å; Y36-I139 HydrophobicContact CD2-CG1 3.9Å; Y36-I139 HydrophobicContact CE1-CG2 4.44Å; Y36-I139 HydrophobicContact CE2-CG1 4.48Å; Y36-I139 HydrophobicContact CG-CD1 4.04Å; Y36-I139 HydrophobicContact CG-CG1 3.88Å; K50-I139 HydrophobicContact CB-CD1 4.14Å; V135-I139 HydrophobicContact CG1-CG1 4.14Å; V135-I139 WeakPolarHBondContact O-CB 3.42Å; V135-I139 VanDerWaalsContact O-CG1 3.32Å; V135-I139 WeakPolarHBondContact O-CG1 3.08Å; V135-I139 PolarHBondContact O-N 3.2Å; I139-F143 HydrophobicContact CD1-CD2 4.12Å; I139-F143 HydrophobicContact CD1-CE2 3.86Å; I139-F143 HydrophobicContact CG2-CD2 4.17Å; I139-F143 WeakPolarHBondContact O-CB 3.4Å; I139-F143 PolarHBondContact O-N 3.19Å; I139-I145 HydrophobicContact CG2-CD1 3.85Å; I139-I145 HydrophobicContact CG2-CG1 4.12Å; I139-P147 HydrophobicContact CG2-CB 4.25Å
140G97.1Very high94.8Very high18 Ų1870.2 Ų70.219%0.18636%0.358CS..Hα-helixtrans-62.9-47.5-177.900000112.5F136 K144 I145F136-G140 WeakPolarHBondContact O-CA 3.41Å; F136-G140 PolarHBondContact O-N 2.98Å; G140-K144 WeakPolarHBondContact O-CA 3.41Å; G140-K144 PolarHBondContact O-N 3.44Å; G140-I145 WeakPolarHBondContact CA-O 3.48Å; G140-I145 PolarHBondContact O-N 3.45Å
141L97.8Very high94.6Very high146 Ų14669.1 Ų69.176%0.76435%0.351SS*.Hα-helixtrans-71.9-42.9180-67.6171.6000112.3S137S137-L141 VanDerWaalsContact O-CB 3.28Å; S137-L141 WeakPolarHBondContact O-CB 3.28Å; S137-L141 VanDerWaalsContact O-CG 3.28Å; S137-L141 WeakPolarHBondContact O-CG 3.47Å; S137-L141 PolarHBondContact O-N 2.85Å
142H97.9Very high94.4Very high128 Ų12873.2 Ų73.259%0.59337%0.372SS*.Hα-helixtrans-70.7-44.3-175.8-171.775.6000112.2L138L138-H142 WeakPolarHBondContact O-CB 3.43Å; L138-H142 PolarHBondContact O-N 3.1Å
143F96.6Very high94.1Very high57 Ų5774.7 Ų74.725%0.2538%0.382CS..Hα-helixtrans-96.8-7.1-176.9-64.1-72.2000114.2K50 E51 A52 I139 I145K50-F143 HydrophobicContact CB-CD2 3.97Å; K50-F143 HydrophobicContact CB-CE2 3.56Å; K50-F143 HydrophobicContact CB-CZ 3.89Å; K50-F143 HydrophobicContact CD-CB 4.44Å; K50-F143 HydrophobicContact CD-CD1 3.73Å; K50-F143 HydrophobicContact CD-CD2 3.97Å; K50-F143 HydrophobicContact CD-CE1 3.85Å; K50-F143 HydrophobicContact CD-CE2 4.11Å; K50-F143 HydrophobicContact CD-CG 3.77Å; K50-F143 HydrophobicContact CD-CZ 4.03Å; K50-F143 HydrophobicContact CG-CD2 3.88Å; K50-F143 HydrophobicContact CG-CE2 3.99Å; K50-F143 HydrophobicContact CG-CG 4.16Å; K50-F143 HydrophobicContact CG-CZ 4.33Å; E51-F143 WeakPolarHBondContact O-CZ 3.28Å; A52-F143 HydrophobicContact CB-CE2 4.36Å; A52-F143 HydrophobicContact CB-CZ 4.17Å; I139-F143 HydrophobicContact CD1-CD2 4.12Å; I139-F143 HydrophobicContact CD1-CE2 3.86Å; I139-F143 HydrophobicContact CG2-CD2 4.17Å; I139-F143 WeakPolarHBondContact O-CB 3.4Å; I139-F143 PolarHBondContact O-N 3.19Å; F143-I145 VanDerWaalsContact C-N 3.31Å; F143-I145 HydrophobicContact CB-CD1 4.23Å; F143-I145 HydrophobicContact CB-CG1 4.06Å; F143-I145 HydrophobicContact CB-CG2 4.25Å; F143-I145 PolarHBondContact O-N 2.94Å
144K95.1Very high93.8Very high191 Ų19174.5 Ų74.583%0.8337%0.372SS*.THydrogen-bonded Turntrans56.143.7-176.6-56-178.5180179.70112.6G140G140-K144 WeakPolarHBondContact O-CA 3.41Å; G140-K144 PolarHBondContact O-N 3.44Å
145I91.1Very high93.5Very high52 Ų5276.9 Ų76.927%0.26738%0.384SS..SBendtrans-121.2161.4179.265.5175.8000111I48 K50 I139 G140 F143 P147I48-I145 HydrophobicContact CG2-CD1 3.82Å; K50-I145 HydrophobicContact CG-CD1 4.16Å; I139-I145 HydrophobicContact CG2-CD1 3.85Å; I139-I145 HydrophobicContact CG2-CG1 4.12Å; G140-I145 WeakPolarHBondContact CA-O 3.48Å; G140-I145 PolarHBondContact O-N 3.45Å; F143-I145 VanDerWaalsContact C-N 3.31Å; F143-I145 HydrophobicContact CB-CD1 4.23Å; F143-I145 HydrophobicContact CB-CG1 4.06Å; F143-I145 HydrophobicContact CB-CG2 4.25Å; F143-I145 PolarHBondContact O-N 2.94Å; I145-P147 WeakPolarHBondContact O-CD 3.15Å
146K87.8Confident93.1Very high174 Ų17482.8 Ų82.876%0.75741%0.413SS*.  trans-76.2123.9160.5-68.5-175179.2-178.70107.9I148K146-I148 PolarHBondContact O-N 3.35Å
147P77.2Confident92.7Very high24 Ų2486 Ų8616%0.15643%0.431CS..  trans-80.816.818033.6-34.5000112.4Y36 N38 F136 I139 I145Y36-P147 PolarHBondContact OH-O 3.09Å; N38-P147 PolarHBondContact ND2-O 3.42Å; F136-P147 HydrophobicContact CB-CB 4.22Å; F136-P147 HydrophobicContact CB-CG 3.72Å; F136-P147 HydrophobicContact CD1-CB 3.86Å; F136-P147 HydrophobicContact CD1-CG 4.15Å; F136-P147 HydrophobicContact CG-CB 4.2Å; F136-P147 HydrophobicContact CG-CG 3.96Å; I139-P147 HydrophobicContact CG2-CB 4.25Å; I145-P147 WeakPolarHBondContact O-CD 3.15Å
148I77.9Confident92.2Very high130 Ų13087.6 Ų87.667%0.66743%0.427SS*.  trans-144.60178.1-53.5176.9000107.6F136 K146F136-I148 HydrophobicContact CD2-CD1 4.46Å; F136-I148 HydrophobicContact CE2-CD1 3.95Å; F136-I148 HydrophobicContact CE2-CG1 4.32Å; F136-I148 HydrophobicContact CZ-CD1 4.31Å; F136-I148 HydrophobicContact CZ-CG1 4.28Å; K146-I148 PolarHBondContact O-N 3.35Å

Retrieved 148 of 148 residues in 100.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).