R27AA_ORYSJ Loading...

Ubiquitin-ribosomal protein eS31z fusion protein

Exists either covalently attached to another protein, or free (unanchored). When covalently bound, it is conjugated to target proteins via an isopeptide bond either as a monomer (monoubiquitin), a polymer linked via different Lys residues of the ubiquitin (polyubiquitin chains) or a linear polymer linked via the initiator Met of the ubiquitin (linear polyubiquitin chains). Polyubiquitin chains, when attached to a target protein, have different functions depending on the Lys residue of the ubiquitin that is linked: Lys-48-linked is involved in protein degradation via the proteasome; Lys-63-linked is involved in endocytosis, and DNA-damage responses. Linear polymer chains formed via attachment by the initiator Met lead to cell signaling. Ubiquitin is usually conjugated to Lys residues of target proteins, however, in rare cases, conjugation to Cys or Ser residues has been observed. When polyubiquitin is free (unanchored-polyubiquitin), it also has distinct roles, such as in activation of protein kinases, and in signaling (By similarity). Component of the 40S subunit of the ribosome.

AlphaFold DB , UniProt , Accession Q9ARZ9, Species ORYSJ (Oryza sativa subsp. japonica, Rice), Gene RPS27AA, Length 155 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M91.3Very high92.3Very high73 Ų7366.8 Ų66.836%0.3636%0.363SS..  0154.2064.8179.9-174.900110.4V17 L56 K63M1-V17 WeakPolarHBondContact CA-O 3.48Å; M1-V17 HydrophobicContact CE-CG2 3.87Å; M1-V17 HydrophobicContact CG-CG2 3.89Å; M1-V17 WeakPolarHBondContact CG-O 3.34Å; M1-V17 PolarHBondContact N-O 3.01Å; M1-V17 PolarHBondContact O-N 2.92Å; M1-L56 HydrophobicContact CE-CB 3.98Å; M1-L56 HydrophobicContact CE-CD1 3.61Å; M1-L56 HydrophobicContact CE-CG 4.44Å; M1-K63 HydrophobicContact CB-CB 4.37Å
2Q92.5Very high92.5Very high72 Ų7267.1 Ų67.134%0.33637%0.368SS..EExtended strand (participates in β ladder)trans-104.7133.4179.2-167.7176.22300110.2L15 E64Q2-L15 WeakPolarHBondContact CA-O 3.45Å; Q2-E64 PolarHBondContact O-N 3.01Å
3I95.4Very high92.6Very high0 Ų062.9 Ų62.90%035%0.345CS..EExtended strand (participates in β ladder)trans-125.7159.7174.163.9169.5000110.4L15 V17 V26 I61 L67I3-L15 HydrophobicContact CG1-CB 3.98Å; I3-L15 PolarHBondContact N-O 3.43Å; I3-L15 PolarHBondContact O-N 3.49Å; I3-V17 HydrophobicContact CB-CG2 4.45Å; I3-V17 HydrophobicContact CD1-CG1 4.12Å; I3-V17 HydrophobicContact CD1-CG2 3.85Å; I3-V17 HydrophobicContact CG1-CG1 4.34Å; I3-V17 HydrophobicContact CG1-CG2 3.8Å; I3-V17 HydrophobicContact CG2-CG2 3.9Å; I3-V26 HydrophobicContact CD1-CG1 4.28Å; I3-I61 HydrophobicContact CG2-CG2 4.14Å; I3-L67 HydrophobicContact CD1-CD1 3.79Å
4F95.7Very high92.7Very high57 Ų5762.9 Ų62.925%0.2535%0.348CS..EExtended strand (participates in β ladder)trans-111.7135.4178.4-60.2-76.2000110.5T12 I13 T14 E64 S65 T66 L67F4-T12 HydrophobicContact CB-CG2 3.95Å; F4-T12 HydrophobicContact CD1-CG2 3.96Å; F4-T12 HydrophobicContact CG-CG2 4.34Å; F4-I13 CarbonylContact C-O 3.6Å; F4-I13 WeakPolarHBondContact CA-O 3.26Å; F4-T14 HydrophobicContact CD1-CG2 3.73Å; F4-T14 HydrophobicContact CE1-CG2 3.58Å; F4-E64 HydrophobicContact CE2-CB 3.98Å; F4-E64 HydrophobicContact CE2-CG 3.93Å; F4-S65 PolarHBondContact N-O 3.14Å; F4-T66 HydrophobicContact CB-CG2 3.92Å; F4-T66 HydrophobicContact CD2-CG2 4.33Å; F4-T66 CarbonylContact O-C 3.52Å; F4-T66 WeakPolarHBondContact O-CA 3.49Å; F4-L67 PolarHBondContact O-N 3.47Å
5V95.3Very high92.8Very high0 Ų058.8 Ų58.80%033%0.325CS..EExtended strand (participates in β ladder)trans-115.9116.2174-1770000108.6T12 I13 L15 I30 L43 L67 L69V5-T12 CarbonylContact O-C 3.52Å; V5-T12 WeakPolarHBondContact O-CA 3.45Å; V5-I13 HydrophobicContact CB-CB 4.41Å; V5-I13 PolarHBondContact N-O 3.41Å; V5-I13 PolarHBondContact O-N 3.12Å; V5-L15 HydrophobicContact CG2-CD1 3.58Å; V5-L15 HydrophobicContact CG2-CG 4.34Å; V5-I30 HydrophobicContact CG1-CD1 4.2Å; V5-I30 HydrophobicContact CG2-CD1 4.12Å; V5-L43 HydrophobicContact CG1-CD2 4.3Å; V5-L67 CarbonylContact C-O 3.56Å; V5-L67 WeakPolarHBondContact CA-O 3.34Å; V5-L67 HydrophobicContact CG2-CB 4.34Å; V5-L69 HydrophobicContact CG1-CB 3.59Å
6K95.3Very high92.9Very high87 Ų8764.9 Ų64.938%0.37835%0.351SS..EExtended strand (participates in β ladder)trans-94.5121.4175-73.7-174.9177.2179.50110.1K11 T12 L67 H68 L69K6-K11 WeakPolarHBondContact CA-O 3.36Å; K6-T12 HydrophobicContact CG-CG2 4.27Å; K6-L67 PolarHBondContact N-O 3.34Å; K6-H68 WeakPolarHBondContact O-CA 3.5Å; K6-L69 PolarHBondContact O-N 3.17Å
7T92.5Very high92.9Very high18 Ų1861.4 Ų61.411%0.1133%0.332CS..EExtended strand (participates in β ladder)trans-80.4164.4173.267.80000110.9T9 G10 K11 I13 L69T7-T9 PolarHBondContact O-N 3.45Å; T7-T9 PolarHBondContact OG1-N 3.41Å; T7-T9 PolarHBondContact OG1-OG1 3.5Å; T7-G10 PolarHBondContact O-N 2.85Å; T7-K11 HydrophobicContact CG2-CB 4.5Å; T7-K11 PolarHBondContact N-O 2.85Å; T7-K11 WeakPolarHBondContact OG1-CB 3.38Å; T7-K11 PolarHBondContact OG1-N 3.03Å; T7-K11 PolarHBondContact OG1-O 3.08Å; T7-I13 HydrophobicContact CG2-CD1 3.88Å; T7-L69 HydrophobicContact CG2-CD2 4.14Å
8L89Confident93Very high130 Ų13065 Ų6568%0.68135%0.346SS*.THydrogen-bonded Turntrans-59.3-23.7172.3-68.8174.5000113.6G10 V70L8-G10 PolarHBondContact O-N 3.15Å; L8-V70 HydrophobicContact CD1-CG1 4.22Å; L8-V70 HydrophobicContact CD2-CG2 4.1Å; L8-V70 HydrophobicContact CG-CG2 4.5Å
9T87.5Confident92.9Very high125 Ų12565.2 Ų65.277%0.76735%0.353SS*.THydrogen-bonded Turntrans-82.21.4177.7530000113.2T7 K11T7-T9 PolarHBondContact O-N 3.45Å; T7-T9 PolarHBondContact OG1-N 3.41Å; T7-T9 PolarHBondContact OG1-OG1 3.5Å; T9-K11 VanDerWaalsContact C-N 3.31Å
10G88.7Confident92.9Very high60 Ų6065.6 Ų65.662%0.61936%0.361SS*.SBendtrans83.20.2-178.700000114.5T7 L8T7-G10 PolarHBondContact O-N 2.85Å; L8-G10 PolarHBondContact O-N 3.15Å
11K92.6Very high92.9Very high113 Ų11363.5 Ų63.549%0.49135%0.349SS..  trans-71.9134.3175-169-177.4179.6-168.70109.6K6 T7 T9 E34K6-K11 WeakPolarHBondContact CA-O 3.36Å; T7-K11 HydrophobicContact CG2-CB 4.5Å; T7-K11 PolarHBondContact N-O 2.85Å; T7-K11 WeakPolarHBondContact OG1-CB 3.38Å; T7-K11 PolarHBondContact OG1-N 3.03Å; T7-K11 PolarHBondContact OG1-O 3.08Å; T9-K11 VanDerWaalsContact C-N 3.31Å; K11-E34 WeakPolarHBondContact CE-OE1 3.48Å; K11-E34 IonicContact NZ-OE1 2.69Å; K11-E34 PolarHBondContact NZ-OE1 3.12Å
12T94.4Very high93.1Very high70 Ų7062 Ų6243%0.42934%0.344SS..EExtended strand (participates in β ladder)trans-107.2126.8174.6-54.80000109.4F4 V5 K6F4-T12 HydrophobicContact CB-CG2 3.95Å; F4-T12 HydrophobicContact CD1-CG2 3.96Å; F4-T12 HydrophobicContact CG-CG2 4.34Å; V5-T12 CarbonylContact O-C 3.52Å; V5-T12 WeakPolarHBondContact O-CA 3.45Å; K6-T12 HydrophobicContact CG-CG2 4.27Å
13I93.4Very high93.2Very high13 Ų1358.5 Ų58.57%0.06733%0.328CS..EExtended strand (participates in β ladder)trans-110.8133.2179.7-55.8154.4000107.9F4 V5 T7 L15 K33 E34F4-I13 CarbonylContact C-O 3.6Å; F4-I13 WeakPolarHBondContact CA-O 3.26Å; V5-I13 HydrophobicContact CB-CB 4.41Å; V5-I13 PolarHBondContact N-O 3.41Å; V5-I13 PolarHBondContact O-N 3.12Å; T7-I13 HydrophobicContact CG2-CD1 3.88Å; I13-L15 HydrophobicContact CG2-CD2 4.33Å; I13-L15 HydrophobicContact CG2-CG 4.46Å; I13-K33 HydrophobicContact CG2-CB 4.46Å; I13-K33 HydrophobicContact CG2-CD 3.74Å; I13-E34 HydrophobicContact CD1-CG 3.31Å; I13-E34 WeakPolarHBondContact CD1-OE1 3.44Å; I13-E34 HydrophobicContact CG1-CG 4.41Å
14T94.8Very high93.2Very high62 Ų6262.1 Ų62.138%0.3835%0.347SS..EExtended strand (participates in β ladder)trans-90.5134.4172.750.10000110F4 K33F4-T14 HydrophobicContact CD1-CG2 3.73Å; F4-T14 HydrophobicContact CE1-CG2 3.58Å; T14-K33 PolarHBondContact O-NZ 3.23Å
15L94Very high93.1Very high2 Ų263.2 Ų63.21%0.0136%0.356CS..EExtended strand (participates in β ladder)trans-127.8139.5175.3-65.8174000110.9Q2 I3 V5 I13 V17 V26 K29 I30 K33Q2-L15 WeakPolarHBondContact CA-O 3.45Å; I3-L15 HydrophobicContact CG1-CB 3.98Å; I3-L15 PolarHBondContact N-O 3.43Å; I3-L15 PolarHBondContact O-N 3.49Å; V5-L15 HydrophobicContact CG2-CD1 3.58Å; V5-L15 HydrophobicContact CG2-CG 4.34Å; I13-L15 HydrophobicContact CG2-CD2 4.33Å; I13-L15 HydrophobicContact CG2-CG 4.46Å; L15-V17 HydrophobicContact CB-CG1 4.19Å; L15-V26 HydrophobicContact CD1-CG1 4.16Å; L15-K29 HydrophobicContact CD2-CB 4.23Å; L15-I30 HydrophobicContact CD1-CD1 4.1Å; L15-I30 HydrophobicContact CD1-CG1 3.5Å; L15-I30 VanDerWaalsContact CD1-CG1 3.5Å; L15-K33 HydrophobicContact CD2-CD 3.71Å
16E93.9Very high93Very high157 Ų15763.2 Ų63.273%0.73436%0.356SS*.EExtended strand (participates in β ladder)trans-95.5119.1169.1-68.1-174168.200109.3K29E16-K29 PolarHBondContact O-NZ 2.88Å
17V93.7Very high92.9Very high4 Ų459.1 Ų59.12%0.02434%0.338CS..  trans-139.6156.9-173.5-62.50000110.3M1 I3 L15 D21 V26 K29 L56M1-V17 WeakPolarHBondContact CA-O 3.48Å; M1-V17 HydrophobicContact CE-CG2 3.87Å; M1-V17 HydrophobicContact CG-CG2 3.89Å; M1-V17 WeakPolarHBondContact CG-O 3.34Å; M1-V17 PolarHBondContact N-O 3.01Å; M1-V17 PolarHBondContact O-N 2.92Å; I3-V17 HydrophobicContact CB-CG2 4.45Å; I3-V17 HydrophobicContact CD1-CG1 4.12Å; I3-V17 HydrophobicContact CD1-CG2 3.85Å; I3-V17 HydrophobicContact CG1-CG1 4.34Å; I3-V17 HydrophobicContact CG1-CG2 3.8Å; I3-V17 HydrophobicContact CG2-CG2 3.9Å; L15-V17 HydrophobicContact CB-CG1 4.19Å; V17-D21 WeakPolarHBondContact CA-OD2 3.16Å; V17-V26 HydrophobicContact CG1-CG2 4.1Å; V17-K29 HydrophobicContact CG1-CD 4.15Å; V17-L56 HydrophobicContact CB-CD1 3.8Å; V17-L56 HydrophobicContact CG1-CD1 4.42Å; V17-L56 HydrophobicContact CG2-CD1 3.55Å
18E93.7Very high93Very high127 Ų12760.1 Ų60.159%0.59335%0.348SS*.  trans-100.2155169.4-65.7-171.5174.700110.4S20 D21E18-S20 WeakPolarHBondContact CB-OG 3.44Å; E18-S20 PolarHBondContact O-N 3.34Å; E18-D21 PolarHBondContact N-OD2 2.81Å; E18-D21 WeakPolarHBondContact O-CB 3.29Å; E18-D21 PolarHBondContact O-N 2.82Å
19S90.9Very high93.3Very high68 Ų6857.2 Ų57.248%0.47633%0.33SS..THydrogen-bonded Turntrans-64.8-23.9178.246.80000112.9D21 A57S19-D21 VanDerWaalsContact C-N 3.35Å; S19-A57 WeakPolarHBondContact O-CB 3.44Å; S19-A57 PolarHBondContact O-N 3.42Å
20S93Very high93.6Very high73 Ų7351.3 Ų51.351%0.5129%0.293SS..THydrogen-bonded Turntrans-77-14.6172.846.60000113.9E18 T22E18-S20 WeakPolarHBondContact CB-OG 3.44Å; E18-S20 PolarHBondContact O-N 3.34Å; S20-T22 PolarHBondContact O-N 3.18Å
21D93.9Very high93.8Very high22 Ų2252 Ų5212%0.11828%0.28CS..  trans-62.2135.8179.6-83.3-28.8000110.1V17 E18 S19 N25 V26 K29 T55 L56V17-D21 WeakPolarHBondContact CA-OD2 3.16Å; E18-D21 PolarHBondContact N-OD2 2.81Å; E18-D21 WeakPolarHBondContact O-CB 3.29Å; E18-D21 PolarHBondContact O-N 2.82Å; S19-D21 VanDerWaalsContact C-N 3.35Å; D21-N25 HydrophobicContact CB-CB 4.39Å; D21-V26 HydrophobicContact CB-CG2 4.48Å; D21-K29 IonicContact OD2-NZ 3.94Å; D21-K29 PolarHBondContact OD2-NZ 2.74Å; D21-T55 WeakPolarHBondContact O-CA 3.34Å; D21-L56 HydrophobicContact CB-CD1 4.35Å; D21-L56 PolarHBondContact O-N 2.81Å
22T94.9Very high93.7Very high41 Ų4152.9 Ų52.925%0.25229%0.291SS..BIsolated β-bridgetrans-74.6157.9171.258.70000111S20 D24 N25 V26 R54 T55S20-T22 PolarHBondContact O-N 3.18Å; T22-D24 PolarHBondContact O-N 3.47Å; T22-N25 WeakPolarHBondContact O-CB 3.44Å; T22-N25 PolarHBondContact O-N 3.32Å; T22-N25 VanDerWaalsContact O-N 3.09Å; T22-N25 VanDerWaalsContact OG1-CG 3.28Å; T22-N25 PolarHBondContact OG1-N 3.2Å; T22-N25 PolarHBondContact OG1-OD1 3.23Å; T22-V26 WeakPolarHBondContact O-CG2 3.21Å; T22-V26 PolarHBondContact O-N 2.77Å; T22-V26 VanDerWaalsContact O-N 3.14Å; T22-R54 WeakPolarHBondContact CA-O 3.28Å; T22-T55 HydrophobicContact CG2-CG2 4.4Å
23I94.9Very high93.5Very high0 Ų055 Ų550%029%0.294CS..Hα-helixtrans-59.5-34.2174.5-61.8-52.8000111.5V26 K27 L43 L50 E51 R54 L56 Y59I23-V26 PolarHBondContact O-N 2.87Å; I23-K27 WeakPolarHBondContact O-CG 3.47Å; I23-K27 PolarHBondContact O-N 3.07Å; I23-L43 HydrophobicContact CG2-CD1 4.26Å; I23-L50 HydrophobicContact CD1-CB 4.09Å; I23-L50 HydrophobicContact CD1-CD1 3.63Å; I23-L50 HydrophobicContact CD1-CG 4.41Å; I23-L50 HydrophobicContact CG1-CB 4.02Å; I23-L50 HydrophobicContact CG1-CD1 4.48Å; I23-L50 HydrophobicContact CG2-CB 3.98Å; I23-E51 VanDerWaalsContact CB-O 3.31Å; I23-E51 WeakPolarHBondContact CB-O 3.46Å; I23-E51 VanDerWaalsContact CG1-O 3.29Å; I23-E51 WeakPolarHBondContact CG1-O 3.06Å; I23-R54 WeakPolarHBondContact CG1-O 3.27Å; I23-R54 PolarHBondContact N-O 2.79Å; I23-L56 HydrophobicContact CD1-CD2 3.72Å; I23-L56 HydrophobicContact CD1-CG 4.47Å; I23-Y59 HydrophobicContact CD1-CD2 4.46Å; I23-Y59 HydrophobicContact CG1-CE2 4.3Å
24D94.6Very high93.3Very high75 Ų7557 Ų5740%0.40130%0.303SS..Hα-helixtrans-60-43.8172.8-79.9-22.8000112.9T22 V26 K27 A28 D52T22-D24 PolarHBondContact O-N 3.47Å; D24-V26 VanDerWaalsContact C-N 3.31Å; D24-V26 PolarHBondContact O-N 3.12Å; D24-K27 PolarHBondContact O-N 2.96Å; D24-A28 PolarHBondContact O-N 2.84Å; D24-D52 PolarHBondContact N-O 3.06Å; D24-D52 WeakPolarHBondContact OD1-CB 3.42Å
25N93.6Very high93.1Very high80 Ų8056.9 Ų56.943%0.42831%0.314SS..Hα-helixtrans-62.4-39.7175.8-70.1-6.5000111.5D21 T22 A28 K29D21-N25 HydrophobicContact CB-CB 4.39Å; T22-N25 WeakPolarHBondContact O-CB 3.44Å; T22-N25 PolarHBondContact O-N 3.32Å; T22-N25 VanDerWaalsContact O-N 3.09Å; T22-N25 VanDerWaalsContact OG1-CG 3.28Å; T22-N25 PolarHBondContact OG1-N 3.2Å; T22-N25 PolarHBondContact OG1-OD1 3.23Å; N25-A28 PolarHBondContact O-N 2.98Å; N25-K29 WeakPolarHBondContact O-CG 3.28Å; N25-K29 PolarHBondContact O-N 3.24Å
26V93.9Very high92.9Very high0 Ų058.3 Ų58.30%032%0.321CS..Hα-helixtrans-64.4-41.5176.9179.70000111I3 L15 V17 D21 T22 I23 D24 K29 I30 L43 L56I3-V26 HydrophobicContact CD1-CG1 4.28Å; L15-V26 HydrophobicContact CD1-CG1 4.16Å; V17-V26 HydrophobicContact CG1-CG2 4.1Å; D21-V26 HydrophobicContact CB-CG2 4.48Å; T22-V26 WeakPolarHBondContact O-CG2 3.21Å; T22-V26 PolarHBondContact O-N 2.77Å; T22-V26 VanDerWaalsContact O-N 3.14Å; I23-V26 PolarHBondContact O-N 2.87Å; D24-V26 VanDerWaalsContact C-N 3.31Å; D24-V26 PolarHBondContact O-N 3.12Å; V26-K29 PolarHBondContact O-N 3.22Å; V26-I30 HydrophobicContact CG1-CD1 4.18Å; V26-I30 WeakPolarHBondContact O-CG1 3.42Å; V26-I30 PolarHBondContact O-N 3.24Å; V26-L43 HydrophobicContact CB-CD1 4.48Å; V26-L43 HydrophobicContact CG1-CD1 3.98Å; V26-L56 HydrophobicContact CG2-CD1 3.84Å; V26-L56 HydrophobicContact CG2-CD2 4.11Å; V26-L56 HydrophobicContact CG2-CG 4.1Å
27K94.1Very high92.7Very high2 Ų252.8 Ų52.81%0.00930%0.299CS..Hα-helixtrans-64.8-37.7176.3-72177.3171.4-171.10112.9I23 D24 I30 Q31 P38 Q41 L43 D52I23-K27 WeakPolarHBondContact O-CG 3.47Å; I23-K27 PolarHBondContact O-N 3.07Å; D24-K27 PolarHBondContact O-N 2.96Å; K27-I30 PolarHBondContact O-N 2.77Å; K27-Q31 PolarHBondContact O-N 2.85Å; K27-P38 HydrophobicContact CB-CB 3.8Å; K27-P38 HydrophobicContact CD-CB 4.37Å; K27-Q41 HydrophobicContact CD-CB 4.39Å; K27-Q41 HydrophobicContact CG-CB 4.31Å; K27-Q41 PolarHBondContact NZ-O 2.96Å; K27-Q41 PolarHBondContact O-NE2 3.36Å; K27-Q41 PolarHBondContact O-OE1 2.75Å; K27-L43 HydrophobicContact CG-CD1 3.9Å; K27-L43 HydrophobicContact CG-CG 4.48Å; K27-D52 VanDerWaalsContact CE-OD1 3.27Å; K27-D52 WeakPolarHBondContact CE-OD1 3.08Å; K27-D52 IonicContact NZ-OD1 2.9Å; K27-D52 PolarHBondContact NZ-OD1 2.9Å; K27-D52 IonicContact NZ-OD2 2.88Å
28A94Very high92.6Very high39 Ų3954.7 Ų54.732%0.32231%0.312SS..Hα-helixtrans-61.5-46.9173.100000111D24 N25 I30 Q31 D32D24-A28 PolarHBondContact O-N 2.84Å; N25-A28 PolarHBondContact O-N 2.98Å; A28-I30 PolarHBondContact O-N 2.94Å; A28-Q31 WeakPolarHBondContact O-CA 3.3Å; A28-Q31 VanDerWaalsContact O-CB 3.27Å; A28-Q31 WeakPolarHBondContact O-CB 3.34Å; A28-Q31 PolarHBondContact O-N 3.31Å; A28-D32 PolarHBondContact O-N 3.45Å
29K94Very high92.4Very high69 Ų6953.2 Ų53.230%0.331%0.308SS..Hα-helixtrans-60.1-33.1174.7-69.9175.7176.8177.60113L15 E16 V17 D21 N25 V26 K33L15-K29 HydrophobicContact CD2-CB 4.23Å; E16-K29 PolarHBondContact O-NZ 2.88Å; V17-K29 HydrophobicContact CG1-CD 4.15Å; D21-K29 IonicContact OD2-NZ 3.94Å; D21-K29 PolarHBondContact OD2-NZ 2.74Å; N25-K29 WeakPolarHBondContact O-CG 3.28Å; N25-K29 PolarHBondContact O-N 3.24Å; V26-K29 PolarHBondContact O-N 3.22Å; K29-K33 PolarHBondContact O-N 3.18Å
30I93.7Very high92.3Very high0 Ų054.3 Ų54.30%031%0.306CS..Hα-helixtrans-70.5-39173-67.4166.4000111.1V5 L15 V26 K27 A28 D32 K33 E34 L43 L69V5-I30 HydrophobicContact CG1-CD1 4.2Å; V5-I30 HydrophobicContact CG2-CD1 4.12Å; L15-I30 HydrophobicContact CD1-CD1 4.1Å; L15-I30 HydrophobicContact CD1-CG1 3.5Å; L15-I30 VanDerWaalsContact CD1-CG1 3.5Å; V26-I30 HydrophobicContact CG1-CD1 4.18Å; V26-I30 WeakPolarHBondContact O-CG1 3.42Å; V26-I30 PolarHBondContact O-N 3.24Å; K27-I30 PolarHBondContact O-N 2.77Å; A28-I30 PolarHBondContact O-N 2.94Å; I30-D32 VanDerWaalsContact C-N 3.28Å; I30-D32 PolarHBondContact O-N 2.9Å; I30-K33 PolarHBondContact O-N 3.34Å; I30-E34 PolarHBondContact O-N 3.37Å; I30-L43 HydrophobicContact CD1-CD1 4.02Å; I30-L43 HydrophobicContact CD1-CD2 3.66Å; I30-L43 HydrophobicContact CD1-CG 4.35Å; I30-L69 HydrophobicContact CG2-CD2 3.89Å
31Q93Very high92.3Very high74 Ų7450.9 Ų50.935%0.34628%0.281SS..Hα-helixtrans-58.6-42.7175.7179.9-176.7700110.8K27 A28 K33 G35 I36K27-Q31 PolarHBondContact O-N 2.85Å; A28-Q31 WeakPolarHBondContact O-CA 3.3Å; A28-Q31 VanDerWaalsContact O-CB 3.27Å; A28-Q31 WeakPolarHBondContact O-CB 3.34Å; A28-Q31 PolarHBondContact O-N 3.31Å; Q31-K33 VanDerWaalsContact C-N 3.27Å; Q31-K33 PolarHBondContact O-N 2.88Å; Q31-G35 WeakPolarHBondContact O-CA 3.49Å; Q31-G35 PolarHBondContact O-N 3.24Å; Q31-I36 WeakPolarHBondContact CA-O 3.25Å; Q31-I36 VanDerWaalsContact CB-O 3.3Å; Q31-I36 WeakPolarHBondContact CB-O 3.44Å; Q31-I36 WeakPolarHBondContact CG-O 3.32Å
32D92Very high92.2Very high133 Ų13354.8 Ų54.871%0.71129%0.294SS*.Hα-helixtrans-64.4-31.3179.4-64.2-31.5000112.8A28 I30A28-D32 PolarHBondContact O-N 3.45Å; I30-D32 VanDerWaalsContact C-N 3.28Å; I30-D32 PolarHBondContact O-N 2.9Å
33K90Very high92.2Very high114 Ų11452.8 Ų52.850%0.49628%0.282SS..Hα-helixtrans-88.8-40.4-178.4-67.1-163.8-178.4-166.30114.5I13 T14 L15 K29 I30 Q31I13-K33 HydrophobicContact CG2-CB 4.46Å; I13-K33 HydrophobicContact CG2-CD 3.74Å; T14-K33 PolarHBondContact O-NZ 3.23Å; L15-K33 HydrophobicContact CD2-CD 3.71Å; K29-K33 PolarHBondContact O-N 3.18Å; I30-K33 PolarHBondContact O-N 3.34Å; Q31-K33 VanDerWaalsContact C-N 3.27Å; Q31-K33 PolarHBondContact O-N 2.88Å
34E89Confident92.2Very high56 Ų5655 Ų5526%0.26229%0.294SS..Hα-helixtrans-105.7-11.5-176.3-71.6-72.5132.800113.3K11 I13 I30 I36K11-E34 WeakPolarHBondContact CE-OE1 3.48Å; K11-E34 IonicContact NZ-OE1 2.69Å; K11-E34 PolarHBondContact NZ-OE1 3.12Å; I13-E34 HydrophobicContact CD1-CG 3.31Å; I13-E34 WeakPolarHBondContact CD1-OE1 3.44Å; I13-E34 HydrophobicContact CG1-CG 4.41Å; I30-E34 PolarHBondContact O-N 3.37Å; E34-I36 VanDerWaalsContact C-N 3.27Å; E34-I36 HydrophobicContact CB-CD1 4.01Å; E34-I36 HydrophobicContact CB-CG1 3.96Å; E34-I36 PolarHBondContact O-N 3.09Å
35G90.4Very high92.3Very high59 Ų5953.7 Ų53.761%0.60828%0.284SS*.  trans74.812.5-176.800000114.4Q31Q31-G35 WeakPolarHBondContact O-CA 3.49Å; Q31-G35 PolarHBondContact O-N 3.24Å
36I89Confident92.2Very high31 Ų3154.1 Ų54.116%0.15930%0.299CS..  trans-93.4121.7-173.9-56.5178.9000109.6Q31 E34 Q40 Q41 L71Q31-I36 WeakPolarHBondContact CA-O 3.25Å; Q31-I36 VanDerWaalsContact CB-O 3.3Å; Q31-I36 WeakPolarHBondContact CB-O 3.44Å; Q31-I36 WeakPolarHBondContact CG-O 3.32Å; E34-I36 VanDerWaalsContact C-N 3.27Å; E34-I36 HydrophobicContact CB-CD1 4.01Å; E34-I36 HydrophobicContact CB-CG1 3.96Å; E34-I36 PolarHBondContact O-N 3.09Å; I36-Q40 HydrophobicContact CG2-CB 4.19Å; I36-Q41 HydrophobicContact CB-CG 4.45Å; I36-Q41 HydrophobicContact CG2-CG 3.88Å; I36-Q41 PolarHBondContact O-NE2 3.09Å; I36-L71 HydrophobicContact CD1-CD2 3.88Å; I36-L71 HydrophobicContact CG2-CD2 3.53Å
37P91.4Very high92.1Very high42 Ų4257.6 Ų57.627%0.27334%0.335SS..  trans-56.7140.4178.3-28.337.2000113.4D39 Q40 Q41P37-D39 WeakPolarHBondContact CB-OD1 3.48Å; P37-D39 PolarHBondContact O-N 3.02Å; P37-Q40 HydrophobicContact CB-CG 4.3Å; P37-Q40 WeakPolarHBondContact O-CA 2.58Å; P37-Q40 WeakPolarHBondContact O-CB 3.37Å; P37-Q40 PolarHBondContact O-N 3.46Å; P37-Q41 WeakPolarHBondContact O-CG 3.13Å; P37-Q41 PolarHBondContact O-N 3.4Å
38P91Very high92Very high43 Ų4364.6 Ų64.628%0.27937%0.366SS..G310 helixtrans-63.5-27.9-174.224.1-34.8000113.2K27 Q40 Q41K27-P38 HydrophobicContact CB-CB 3.8Å; K27-P38 HydrophobicContact CD-CB 4.37Å; P38-Q40 PolarHBondContact O-N 3.32Å; P38-Q41 PolarHBondContact O-N 3.47Å
39D88.8Confident92Very high97 Ų9767.1 Ų67.152%0.51937%0.371SS..G310 helixtrans-68.9-18.7173.272.9-47000112.6P37 R72P37-D39 WeakPolarHBondContact CB-OD1 3.48Å; P37-D39 PolarHBondContact O-N 3.02Å; D39-R72 WeakPolarHBondContact O-CD 3.49Å; D39-R72 PolarHBondContact O-NH1 3.18Å
40Q89.7Confident92Very high91 Ų9163.9 Ų63.943%0.42536%0.357SS..G310 helixtrans-94.4-7.6174.2-61.3-179.5900112.4I36 P37 P38 L71 R72I36-Q40 HydrophobicContact CG2-CB 4.19Å; P37-Q40 HydrophobicContact CB-CG 4.3Å; P37-Q40 WeakPolarHBondContact O-CA 2.58Å; P37-Q40 WeakPolarHBondContact O-CB 3.37Å; P37-Q40 PolarHBondContact O-N 3.46Å; P38-Q40 PolarHBondContact O-N 3.32Å; Q40-L71 CarbonylContact O-C 3.53Å; Q40-L71 WeakPolarHBondContact O-CA 3.12Å; Q40-R72 PolarHBondContact O-N 3.22Å
41Q92Very high92Very high0 Ų068.9 Ų68.90%038%0.38CS..EExtended strand (participates in β ladder)trans-91.6137.6-177.4-6117928.100112.2K27 I36 P37 P38 L69K27-Q41 HydrophobicContact CD-CB 4.39Å; K27-Q41 HydrophobicContact CG-CB 4.31Å; K27-Q41 PolarHBondContact NZ-O 2.96Å; K27-Q41 PolarHBondContact O-NE2 3.36Å; K27-Q41 PolarHBondContact O-OE1 2.75Å; I36-Q41 HydrophobicContact CB-CG 4.45Å; I36-Q41 HydrophobicContact CG2-CG 3.88Å; I36-Q41 PolarHBondContact O-NE2 3.09Å; P37-Q41 WeakPolarHBondContact O-CG 3.13Å; P37-Q41 PolarHBondContact O-N 3.4Å; P38-Q41 PolarHBondContact O-N 3.47Å; Q41-L69 HydrophobicContact CB-CD1 3.8Å; Q41-L69 HydrophobicContact CG-CD1 3.94Å
42R92.9Very high91.9Very high104 Ų10467.9 Ų67.939%0.39238%0.377SS..EExtended strand (participates in β ladder)trans-122121.6162.2-69-179.7171.9-164.6-3.3108.8V70 R72R42-V70 WeakPolarHBondContact CA-O 3.4Å; R42-V70 HydrophobicContact CB-CB 4.33Å; R42-V70 WeakPolarHBondContact CB-O 3.46Å; R42-V70 PolarHBondContact N-O 3.35Å; R42-V70 PolarHBondContact O-N 3.45Å; R42-R72 HydrophobicContact CG-CG 3.7Å
43L94.4Very high91.8Very high0 Ų065.1 Ų65.10%038%0.38CS..EExtended strand (participates in β ladder)trans-97.4133.6171.9-65.8173.6000109.1V5 I23 V26 K27 I30 L50 H68 L69V5-L43 HydrophobicContact CG1-CD2 4.3Å; I23-L43 HydrophobicContact CG2-CD1 4.26Å; V26-L43 HydrophobicContact CB-CD1 4.48Å; V26-L43 HydrophobicContact CG1-CD1 3.98Å; K27-L43 HydrophobicContact CG-CD1 3.9Å; K27-L43 HydrophobicContact CG-CG 4.48Å; I30-L43 HydrophobicContact CD1-CD1 4.02Å; I30-L43 HydrophobicContact CD1-CD2 3.66Å; I30-L43 HydrophobicContact CD1-CG 4.35Å; L43-L50 HydrophobicContact CB-CB 4.34Å; L43-L50 HydrophobicContact CB-CD1 3.97Å; L43-L50 HydrophobicContact CB-CG 4.29Å; L43-L50 PolarHBondContact O-N 3.19Å; L43-H68 WeakPolarHBondContact CA-O 3.01Å; L43-L69 HydrophobicContact CD2-CB 4.3Å; L43-L69 HydrophobicContact CD2-CD1 3.89Å
44I95.3Very high91.9Very high47 Ų4764.9 Ų64.924%0.24138%0.376CS..EExtended strand (participates in β ladder)trans-125.4130.5-179.4-56.2176000108.5K48 H68 V70I44-K48 WeakPolarHBondContact CA-O 3.14Å; I44-H68 HydrophobicContact CB-CB 4.27Å; I44-H68 PolarHBondContact N-O 3.39Å; I44-H68 PolarHBondContact O-N 2.98Å; I44-V70 HydrophobicContact CD1-CB 4.32Å; I44-V70 HydrophobicContact CD1-CG2 3.66Å; I44-V70 HydrophobicContact CG1-CG2 4.48Å
45F95.3Very high92.2Very high46 Ų4663.9 Ų63.920%0.20237%0.374CS..EExtended strand (participates in β ladder)trans-134.8136.1174.3-172.9-122000109.7G47 K48 L50 I61 T66 L67F45-G47 PolarHBondContact O-N 2.91Å; F45-K48 PolarHBondContact N-O 2.88Å; F45-K48 PolarHBondContact O-N 3.37Å; F45-L50 HydrophobicContact CB-CD1 4.39Å; F45-L50 HydrophobicContact CB-CD2 4.02Å; F45-L50 HydrophobicContact CB-CG 4.46Å; F45-I61 HydrophobicContact CD1-CD1 4.32Å; F45-I61 HydrophobicContact CD1-CG1 3.74Å; F45-I61 HydrophobicContact CE1-CG1 3.82Å; F45-I61 HydrophobicContact CG-CG1 4.25Å; F45-I61 HydrophobicContact CZ-CG1 4.39Å; F45-T66 WeakPolarHBondContact CD2-O 3.3Å; F45-L67 HydrophobicContact CB-CD2 3.55Å; F45-L67 HydrophobicContact CD2-CD2 3.71Å; F45-L67 HydrophobicContact CG-CD2 3.81Å
46A92.7Very high92.3Very high89 Ų8961 Ų6174%0.73635%0.345SS*.THydrogen-bonded Turntrans48.237.4-179.600000113.8K48A46-K48 PolarHBondContact O-N 3.22Å
47G91.9Very high92.5Very high74 Ų7461.8 Ų61.876%0.76336%0.356SS*.THydrogen-bonded Turntrans74.81.9-178.100000115.7F45F45-G47 PolarHBondContact O-N 2.91Å
48K92.7Very high92.6Very high148 Ų14864.5 Ų64.564%0.64337%0.368SS*.EExtended strand (participates in β ladder)trans-106.9137177.5-66.7-176.9-179.91780111.1I44 F45 A46I44-K48 WeakPolarHBondContact CA-O 3.14Å; F45-K48 PolarHBondContact N-O 2.88Å; F45-K48 PolarHBondContact O-N 3.37Å; A46-K48 PolarHBondContact O-N 3.22Å
49Q93.1Very high92.7Very high92 Ų9264.3 Ų64.343%0.4336%0.362SS..EExtended strand (participates in β ladder)trans-73.2132.8170.2-172.4-173.4-46.200109.2
50L94.2Very high92.8Very high2 Ų266 Ų661%0.0137%0.371CS..PPolyproline II helixtrans-80139.8177.4-53.7-175.1000110.8I23 L43 F45 Y59 I61 L67I23-L50 HydrophobicContact CD1-CB 4.09Å; I23-L50 HydrophobicContact CD1-CD1 3.63Å; I23-L50 HydrophobicContact CD1-CG 4.41Å; I23-L50 HydrophobicContact CG1-CB 4.02Å; I23-L50 HydrophobicContact CG1-CD1 4.48Å; I23-L50 HydrophobicContact CG2-CB 3.98Å; L43-L50 HydrophobicContact CB-CB 4.34Å; L43-L50 HydrophobicContact CB-CD1 3.97Å; L43-L50 HydrophobicContact CB-CG 4.29Å; L43-L50 PolarHBondContact O-N 3.19Å; F45-L50 HydrophobicContact CB-CD1 4.39Å; F45-L50 HydrophobicContact CB-CD2 4.02Å; F45-L50 HydrophobicContact CB-CG 4.46Å; L50-Y59 HydrophobicContact CB-CE2 4.2Å; L50-Y59 HydrophobicContact CD2-CD1 3.71Å; L50-Y59 HydrophobicContact CD2-CD2 3.69Å; L50-Y59 HydrophobicContact CD2-CE1 3.81Å; L50-Y59 HydrophobicContact CD2-CE2 3.74Å; L50-Y59 HydrophobicContact CD2-CG 3.64Å; L50-I61 HydrophobicContact CD1-CD1 3.93Å; L50-L67 HydrophobicContact CD1-CD1 4.44Å; L50-L67 HydrophobicContact CD1-CD2 3.96Å
51E93.5Very high93Very high105 Ų10562 Ų6249%0.49135%0.352SS..PPolyproline II helixtrans-95141.7177.7-66.6177.2167.200111.1I23 G53 R54 Y59I23-E51 VanDerWaalsContact CB-O 3.31Å; I23-E51 WeakPolarHBondContact CB-O 3.46Å; I23-E51 VanDerWaalsContact CG1-O 3.29Å; I23-E51 WeakPolarHBondContact CG1-O 3.06Å; E51-G53 VanDerWaalsContact C-N 3.32Å; E51-G53 PolarHBondContact O-N 3.46Å; E51-R54 HydrophobicContact CB-CG 4.42Å; E51-R54 PolarHBondContact O-N 2.69Å; E51-R54 IonicContact OE2-CZ 2.92Å; E51-R54 IonicContact OE2-NE 3.39Å; E51-R54 PolarHBondContact OE2-NE 3.23Å; E51-R54 IonicContact OE2-NH2 2.81Å; E51-R54 PolarHBondContact OE2-NH2 2.97Å; E51-Y59 PolarHBondContact N-OH 3.21Å
52D90Very high93Very high53 Ų5368.9 Ų68.928%0.28338%0.384SS..THydrogen-bonded Turntrans-59.8-35.8-172-72.4-7.8000113.3D24 K27 R72D24-D52 PolarHBondContact N-O 3.06Å; D24-D52 WeakPolarHBondContact OD1-CB 3.42Å; K27-D52 VanDerWaalsContact CE-OD1 3.27Å; K27-D52 WeakPolarHBondContact CE-OD1 3.08Å; K27-D52 IonicContact NZ-OD1 2.9Å; K27-D52 PolarHBondContact NZ-OD1 2.9Å; K27-D52 IonicContact NZ-OD2 2.88Å; D52-R72 IonicContact OD2-NH2 2.93Å
53G89.8Confident92.9Very high75 Ų7570 Ų7077%0.77339%0.392SS*.THydrogen-bonded Turntrans-88.57.2-177.800000116.8E51E51-G53 VanDerWaalsContact C-N 3.32Å; E51-G53 PolarHBondContact O-N 3.46Å
54R93.4Very high92.8Very high108 Ų10875.6 Ų75.641%0.40842%0.418SS..SBendtrans-105.4160.2177.1-62.6-164.4-159.1-155.3-1.1111.6T22 I23 E51 D58 Y59T22-R54 WeakPolarHBondContact CA-O 3.28Å; I23-R54 WeakPolarHBondContact CG1-O 3.27Å; I23-R54 PolarHBondContact N-O 2.79Å; E51-R54 HydrophobicContact CB-CG 4.42Å; E51-R54 PolarHBondContact O-N 2.69Å; E51-R54 IonicContact OE2-CZ 2.92Å; E51-R54 IonicContact OE2-NE 3.39Å; E51-R54 PolarHBondContact OE2-NE 3.23Å; E51-R54 IonicContact OE2-NH2 2.81Å; E51-R54 PolarHBondContact OE2-NH2 2.97Å; R54-D58 HydrophobicContact CB-CB 4.33Å; R54-Y59 HydrophobicContact CB-CD2 4.31Å; R54-Y59 HydrophobicContact CB-CE2 3.64Å; R54-Y59 HydrophobicContact CG-CE2 4.29Å
55T94.4Very high92.8Very high35 Ų3574.2 Ų74.222%0.21541%0.413CS..BIsolated β-bridgetrans-91164176.365.90000111.9D21 T22 A57 D58D21-T55 WeakPolarHBondContact O-CA 3.34Å; T22-T55 HydrophobicContact CG2-CG2 4.4Å; T55-A57 PolarHBondContact O-N 2.88Å; T55-D58 PolarHBondContact N-OD2 2.76Å; T55-D58 PolarHBondContact O-N 3.33Å; T55-D58 PolarHBondContact OG1-N 3.29Å; T55-D58 PolarHBondContact OG1-OD1 3.04Å; T55-D58 PolarHBondContact OG1-OD2 3.24Å
56L93.7Very high92.8Very high0 Ų074.7 Ų74.70%042%0.42CS..THydrogen-bonded Turntrans-61.6-35.2171.4-70.5177.7000112.1M1 V17 D21 I23 V26 Y59 N60 I61M1-L56 HydrophobicContact CE-CB 3.98Å; M1-L56 HydrophobicContact CE-CD1 3.61Å; M1-L56 HydrophobicContact CE-CG 4.44Å; V17-L56 HydrophobicContact CB-CD1 3.8Å; V17-L56 HydrophobicContact CG1-CD1 4.42Å; V17-L56 HydrophobicContact CG2-CD1 3.55Å; D21-L56 HydrophobicContact CB-CD1 4.35Å; D21-L56 PolarHBondContact O-N 2.81Å; I23-L56 HydrophobicContact CD1-CD2 3.72Å; I23-L56 HydrophobicContact CD1-CG 4.47Å; V26-L56 HydrophobicContact CG2-CD1 3.84Å; V26-L56 HydrophobicContact CG2-CD2 4.11Å; V26-L56 HydrophobicContact CG2-CG 4.1Å; L56-Y59 PolarHBondContact O-N 3.05Å; L56-N60 PolarHBondContact O-N 2.98Å; L56-I61 HydrophobicContact CB-CB 4.3Å; L56-I61 HydrophobicContact CD2-CB 4.23Å; L56-I61 HydrophobicContact CD2-CD1 3.44Å; L56-I61 VanDerWaalsContact CD2-CD1 3.44Å; L56-I61 HydrophobicContact CD2-CG1 4.42Å; L56-I61 HydrophobicContact CD2-CG2 4.21Å; L56-I61 PolarHBondContact O-N 3.35Å
57A92.5Very high93Very high47 Ų4770.5 Ų70.539%0.38839%0.385SS..G310 helixtrans-62.2-39.1175.500000112.6S19 T55 Y59 N60S19-A57 WeakPolarHBondContact O-CB 3.44Å; S19-A57 PolarHBondContact O-N 3.42Å; T55-A57 PolarHBondContact O-N 2.88Å; A57-Y59 PolarHBondContact O-N 2.76Å; A57-Y59 VanDerWaalsContact O-N 3.16Å; A57-N60 PolarHBondContact O-N 3.43Å
58D93.2Very high93.1Very high98 Ų9871.3 Ų71.352%0.52437%0.368SS..G310 helixtrans-61.4-26.5179.5-62.8-40.2000113R54 T55R54-D58 HydrophobicContact CB-CB 4.33Å; T55-D58 PolarHBondContact N-OD2 2.76Å; T55-D58 PolarHBondContact O-N 3.33Å; T55-D58 PolarHBondContact OG1-N 3.29Å; T55-D58 PolarHBondContact OG1-OD1 3.04Å; T55-D58 PolarHBondContact OG1-OD2 3.24Å
59Y92.9Very high93.2Very high39 Ų3964.5 Ų64.515%0.15334%0.339CS..G310 helixtrans-97.68.2176.3-70.6-72.2000113.5I23 L50 E51 R54 L56 A57 I61I23-Y59 HydrophobicContact CD1-CD2 4.46Å; I23-Y59 HydrophobicContact CG1-CE2 4.3Å; L50-Y59 HydrophobicContact CB-CE2 4.2Å; L50-Y59 HydrophobicContact CD2-CD1 3.71Å; L50-Y59 HydrophobicContact CD2-CD2 3.69Å; L50-Y59 HydrophobicContact CD2-CE1 3.81Å; L50-Y59 HydrophobicContact CD2-CE2 3.74Å; L50-Y59 HydrophobicContact CD2-CG 3.64Å; E51-Y59 PolarHBondContact N-OH 3.21Å; R54-Y59 HydrophobicContact CB-CD2 4.31Å; R54-Y59 HydrophobicContact CB-CE2 3.64Å; R54-Y59 HydrophobicContact CG-CE2 4.29Å; L56-Y59 PolarHBondContact O-N 3.05Å; A57-Y59 PolarHBondContact O-N 2.76Å; A57-Y59 VanDerWaalsContact O-N 3.16Å; Y59-I61 PolarHBondContact O-N 2.99Å
60N92.1Very high93.1Very high133 Ų13362 Ų6271%0.71133%0.33SS*.THydrogen-bonded Turntrans52.636.9-175.4-62.3-52.3000112.9L56 A57 Q62L56-N60 PolarHBondContact O-N 2.98Å; A57-N60 PolarHBondContact O-N 3.43Å; N60-Q62 PolarHBondContact O-N 3.23Å
61I92.9Very high92.9Very high6 Ų665.8 Ų65.83%0.03135%0.35CS..  trans-77.2114.4178.9-64.5165.6000108.2I3 F45 L50 L56 Y59 L67I3-I61 HydrophobicContact CG2-CG2 4.14Å; F45-I61 HydrophobicContact CD1-CD1 4.32Å; F45-I61 HydrophobicContact CD1-CG1 3.74Å; F45-I61 HydrophobicContact CE1-CG1 3.82Å; F45-I61 HydrophobicContact CG-CG1 4.25Å; F45-I61 HydrophobicContact CZ-CG1 4.39Å; L50-I61 HydrophobicContact CD1-CD1 3.93Å; L56-I61 HydrophobicContact CB-CB 4.3Å; L56-I61 HydrophobicContact CD2-CB 4.23Å; L56-I61 HydrophobicContact CD2-CD1 3.44Å; L56-I61 VanDerWaalsContact CD2-CD1 3.44Å; L56-I61 HydrophobicContact CD2-CG1 4.42Å; L56-I61 HydrophobicContact CD2-CG2 4.21Å; L56-I61 PolarHBondContact O-N 3.35Å; Y59-I61 PolarHBondContact O-N 2.99Å; I61-L67 HydrophobicContact CD1-CD2 4.05Å
62Q91.2Very high92.4Very high145 Ų14564.9 Ų64.968%0.67834%0.342SS*.  trans-97.3173.2-178.6-64.5-172.8-16.100111.9N60 E64 S65N60-Q62 PolarHBondContact O-N 3.23Å; Q62-E64 PolarHBondContact O-N 3.25Å; Q62-S65 PolarHBondContact N-OG 3.09Å; Q62-S65 VanDerWaalsContact O-CB 3.24Å; Q62-S65 WeakPolarHBondContact O-CB 3.45Å; Q62-S65 PolarHBondContact O-N 2.96Å; Q62-S65 PolarHBondContact O-OG 3.41Å
63K92.5Very high91.7Very high129 Ų12970.3 Ų70.356%0.56137%0.37SS*.THydrogen-bonded Turntrans-52.7140.4168.2-171.6-175.4172.3-164.40109.8M1 S65M1-K63 HydrophobicContact CB-CB 4.37Å; K63-S65 PolarHBondContact O-N 3.14Å
64E92.4Very high90.7Very high116 Ų11678.6 Ų78.654%0.54238%0.378SS..THydrogen-bonded Turntrans66.311.7-179.5-67.2157.4-148.800115.3Q2 F4 Q62Q2-E64 PolarHBondContact O-N 3.01Å; F4-E64 HydrophobicContact CE2-CB 3.98Å; F4-E64 HydrophobicContact CE2-CG 3.93Å; Q62-E64 PolarHBondContact O-N 3.25Å
65S94.9Very high89.5Confident18 Ų1876.9 Ų76.913%0.12639%0.394CS..  trans-64.5144.6171.3-62.90000111.6F4 Q62 K63F4-S65 PolarHBondContact N-O 3.14Å; Q62-S65 PolarHBondContact N-OG 3.09Å; Q62-S65 VanDerWaalsContact O-CB 3.24Å; Q62-S65 WeakPolarHBondContact O-CB 3.45Å; Q62-S65 PolarHBondContact O-N 2.96Å; Q62-S65 PolarHBondContact O-OG 3.41Å; K63-S65 PolarHBondContact O-N 3.14Å
66T95Very high88.1Confident57 Ų5778.5 Ų78.535%0.3542%0.417SS..EExtended strand (participates in β ladder)trans-104.8120176.3560000110.6F4 F45F4-T66 HydrophobicContact CB-CG2 3.92Å; F4-T66 HydrophobicContact CD2-CG2 4.33Å; F4-T66 CarbonylContact O-C 3.52Å; F4-T66 WeakPolarHBondContact O-CA 3.49Å; F45-T66 WeakPolarHBondContact CD2-O 3.3Å
67L95.7Very high86.9Confident0 Ų083.1 Ų83.10%046%0.456CS..EExtended strand (participates in β ladder)trans-98.3145.1171.3-61.3-179.3000109.5I3 F4 V5 K6 F45 L50 I61I3-L67 HydrophobicContact CD1-CD1 3.79Å; F4-L67 PolarHBondContact O-N 3.47Å; V5-L67 CarbonylContact C-O 3.56Å; V5-L67 WeakPolarHBondContact CA-O 3.34Å; V5-L67 HydrophobicContact CG2-CB 4.34Å; K6-L67 PolarHBondContact N-O 3.34Å; F45-L67 HydrophobicContact CB-CD2 3.55Å; F45-L67 HydrophobicContact CD2-CD2 3.71Å; F45-L67 HydrophobicContact CG-CD2 3.81Å; L50-L67 HydrophobicContact CD1-CD1 4.44Å; L50-L67 HydrophobicContact CD1-CD2 3.96Å; I61-L67 HydrophobicContact CD1-CD2 4.05Å
68H95.8Very high85.8Confident91 Ų9191 Ų9142%0.42148%0.481SS..EExtended strand (participates in β ladder)trans-99.8122.5171.5-68.1-74.8000110.2K6 L43 I44K6-H68 WeakPolarHBondContact O-CA 3.5Å; L43-H68 WeakPolarHBondContact CA-O 3.01Å; I44-H68 HydrophobicContact CB-CB 4.27Å; I44-H68 PolarHBondContact N-O 3.39Å; I44-H68 PolarHBondContact O-N 2.98Å
69L94.2Very high84.8Confident6 Ų695.8 Ų95.83%0.03150%0.497CS..EExtended strand (participates in β ladder)trans-91.4117.1172.7179.167000109.9V5 K6 T7 I30 Q41 L43V5-L69 HydrophobicContact CG1-CB 3.59Å; K6-L69 PolarHBondContact O-N 3.17Å; T7-L69 HydrophobicContact CG2-CD2 4.14Å; I30-L69 HydrophobicContact CG2-CD2 3.89Å; Q41-L69 HydrophobicContact CB-CD1 3.8Å; Q41-L69 HydrophobicContact CG-CD1 3.94Å; L43-L69 HydrophobicContact CD2-CB 4.3Å; L43-L69 HydrophobicContact CD2-CD1 3.89Å
70V91.5Very high83.7Confident39 Ų39105.7 Ų105.724%0.23654%0.535CS..EExtended strand (participates in β ladder)trans-118137.9174.6-178.70000108.3L8 R42 I44L8-V70 HydrophobicContact CD1-CG1 4.22Å; L8-V70 HydrophobicContact CD2-CG2 4.1Å; L8-V70 HydrophobicContact CG-CG2 4.5Å; R42-V70 WeakPolarHBondContact CA-O 3.4Å; R42-V70 HydrophobicContact CB-CB 4.33Å; R42-V70 WeakPolarHBondContact CB-O 3.46Å; R42-V70 PolarHBondContact N-O 3.35Å; R42-V70 PolarHBondContact O-N 3.45Å; I44-V70 HydrophobicContact CD1-CB 4.32Å; I44-V70 HydrophobicContact CD1-CG2 3.66Å; I44-V70 HydrophobicContact CG1-CG2 4.48Å
71L89.9Confident83Confident82 Ų82109 Ų10943%0.42954%0.542SS..EExtended strand (participates in β ladder)trans-82.3139.7177-61.7176000111.3I36 Q40 L73I36-L71 HydrophobicContact CD1-CD2 3.88Å; I36-L71 HydrophobicContact CG2-CD2 3.53Å; Q40-L71 CarbonylContact O-C 3.53Å; Q40-L71 WeakPolarHBondContact O-CA 3.12Å; L71-L73 PolarHBondContact O-N 2.89Å
72R82.8Confident82.5Confident85 Ų85118.2 Ų118.232%0.32158%0.582SS.*PPolyproline II helixtrans-62.3121.3167.2-65.5-159.4-176.2139.1-9.9107.3D39 Q40 R42 D52 R74D39-R72 WeakPolarHBondContact O-CD 3.49Å; D39-R72 PolarHBondContact O-NH1 3.18Å; Q40-R72 PolarHBondContact O-N 3.22Å; R42-R72 HydrophobicContact CG-CG 3.7Å; D52-R72 IonicContact OD2-NH2 2.93Å; R72-R74 PolarHBondContact O-N 2.76Å
73L74.8Confident82.1Confident168 Ų168121.4 Ų121.488%0.8859%0.594SS**PPolyproline II helixtrans-59.9124.6174-63174.8000108.5L71 G75L71-L73 PolarHBondContact O-N 2.89Å; L73-G75 PolarHBondContact O-N 3.44Å
74R69.5Low81.8Confident249 Ų249121.3 Ų121.394%0.9460%0.604SS**  trans-57.1111.7174.9-160.8174.4-170170.23.5107.5R72 G76R72-R74 PolarHBondContact O-N 2.76Å; R74-G76 PolarHBondContact O-N 3.18Å
75G66.9Low81.5Confident71 Ų71123.2 Ų123.273%0.73261%0.608SS**PPolyproline II helixtrans-48.7124.3-175.500000110.6L73L73-G75 PolarHBondContact O-N 3.44Å
76G66.7Low81.2Confident69 Ų69128.4 Ų128.471%0.71164%0.639SS**PPolyproline II helixtrans-51.9140.8-171.500000112.4R74 K78R74-G76 PolarHBondContact O-N 3.18Å; G76-K78 PolarHBondContact O-N 3.29Å
77A68.6Low81Confident97 Ų97133.2 Ų133.280%0.80266%0.655SS**PPolyproline II helixtrans-46.8126.4-178.700000110.9K79A77-K79 PolarHBondContact O-N 2.95Å
78K69.4Low80.8Confident214 Ų214138.7 Ų138.793%0.9369%0.69SS**  trans-53.1108-177.9-72.2179.2179.8170.60109.2G76 R80G76-K78 PolarHBondContact O-N 3.29Å; K78-R80 PolarHBondContact O-N 3.46Å
79K70.2Confident80.5Confident198 Ų198143 Ų14386%0.86171%0.708SS**PPolyproline II helixtrans-61.5136.1-179.8-67.1-170.7179-179.30109.4A77 K81A77-K79 PolarHBondContact O-N 2.95Å; K79-K81 PolarHBondContact O-N 2.58Å
80R71.5Confident80.5Confident247 Ų247152 Ų15293%0.93275%0.747SS**PPolyproline II helixtrans-54.4126173.2-95.1-177.9165.9178.9-2.6109.2K78K78-R80 PolarHBondContact O-N 3.46Å
81K77Confident80.5Confident202 Ų202159.4 Ų159.488%0.87878%0.779SS**PPolyproline II helixtrans-59.3139.4174.3-66.2-174.7178.4-177.90109.3K79K79-K81 PolarHBondContact O-N 2.58Å
82K81.9Confident80.8Confident200 Ų200164.7 Ų164.787%0.8780%0.798SS**PPolyproline II helixtrans-59.1139.2173.5-71-177.8179.2178.10108.9T84K82-T84 PolarHBondContact O-N 3.25Å
83K83.6Confident81.4Confident211 Ų211168.8 Ų168.892%0.91782%0.821SS**PPolyproline II helixtrans-69.5122.9176.9-65.9-178.8-179.6178.70108.9
84T86.3Confident82.3Confident127 Ų127169.6 Ų169.678%0.77982%0.817SS**PPolyproline II helixtrans-97.9118.7171.9-54.10000108.7K82K82-T84 PolarHBondContact O-N 3.25Å
85Y84.5Confident83.4Confident156 Ų156165.3 Ų165.361%0.61281%0.807SS**PPolyproline II helixtrans-94.8117.4-178.7-170.3-121000109.8K87 P88 K89Y85-K87 WeakPolarHBondContact CD1-O 3.4Å; Y85-K87 WeakPolarHBondContact CE1-O 3.48Å; Y85-K87 WeakPolarHBondContact CE2-O 3.47Å; Y85-K87 PolarHBondContact OH-O 2.81Å; Y85-P88 PolarHBondContact OH-O 3.31Å; Y85-K89 HydrophobicContact CE1-CB 4.16Å; Y85-K89 WeakPolarHBondContact OH-CA 3.42Å; Y85-K89 PolarHBondContact OH-N 3.3Å
86T89.7Confident84.6Confident127 Ų127170.2 Ų170.278%0.77981%0.809SS**  trans-99.2-15.8-168.251.90000114.8
87K91.3Very high85.8Confident158 Ų158176 Ų17669%0.68781%0.814SS**SBendtrans-127.6144.1-178.7-64.7-178.1178.9-179.20107.9Y85Y85-K87 WeakPolarHBondContact CD1-O 3.4Å; Y85-K87 WeakPolarHBondContact CE1-O 3.48Å; Y85-K87 WeakPolarHBondContact CE2-O 3.47Å; Y85-K87 PolarHBondContact OH-O 2.81Å
88P90.5Very high87Confident115 Ų115175.2 Ų175.275%0.74780%0.799SS**PPolyproline II helixtrans-63.4156.8178.326.2-34.6000112.9Y85 K90Y85-P88 PolarHBondContact OH-O 3.31Å; P88-K90 PolarHBondContact O-N 3.07Å
89K90.5Very high88.2Confident183 Ų183174.5 Ų174.580%0.79680%0.796SS**PPolyproline II helixtrans-74.3119.6-177.9-170.1175.7-178.8178.80109.8Y85Y85-K89 HydrophobicContact CE1-CB 4.16Å; Y85-K89 WeakPolarHBondContact OH-CA 3.42Å; Y85-K89 PolarHBondContact OH-N 3.3Å
90K93.4Very high89.3Confident194 Ų194171.5 Ų171.584%0.84379%0.789SS**PPolyproline II helixtrans-71.3129.9178.8-67.7-173.6177.5-174.90110.6P88P88-K90 PolarHBondContact O-N 3.07Å
91Q91.9Very high90.2Very high194 Ų194161.2 Ų161.291%0.90776%0.757SS**PPolyproline II helixtrans-71.9138.9170.1-62.5-169.719.900109.7
92K95.2Very high90.7Very high193 Ų193155.9 Ų155.984%0.83974%0.741SS**PPolyproline II helixtrans-80.3143178.4-65.5-173.4177-174.80110.3K94K92-K94 PolarHBondContact O-N 2.88Å
93H95.5Very high91.1Very high171 Ų171151.9 Ų151.979%0.79273%0.728SS**PPolyproline II helixtrans-57.9135.1172.6176.1-101.1000110.6
94K94.1Very high91.4Very high186 Ų186147.9 Ų147.981%0.80971%0.713SS**  trans-118.2128.7174.6-68.2-175.9178.1-179.30108.6K92 K96K92-K94 PolarHBondContact O-N 2.88Å; K94-K96 PolarHBondContact O-N 2.89Å
95H92.5Very high91.7Very high158 Ų158143.3 Ų143.373%0.73168%0.682SS**PPolyproline II helixtrans-65.8123.1179.3-170.1-79.9000110.8K97H95-K97 PolarHBondContact O-N 2.93Å
96K92.1Very high92Very high175 Ų175139.7 Ų139.776%0.76167%0.668SS**PPolyproline II helixtrans-77.1117176.1-170.9176179.9-179.80109.3K94K94-K96 PolarHBondContact O-N 2.89Å
97K92.8Very high92.1Very high191 Ų191139.1 Ų139.183%0.8366%0.655SS**PPolyproline II helixtrans-90.5118.9173.7-67.1-174.9179.1-176.60109.1H95H95-K97 PolarHBondContact O-N 2.93Å
98V93.2Very high92.1Very high79 Ų79135.2 Ų135.248%0.47964%0.644SS.*PPolyproline II helixtrans-102119.5170.7-179.70000107.2L100 A101V98-L100 PolarHBondContact O-N 3.19Å; V98-A101 HydrophobicContact CB-CB 4.15Å; V98-A101 HydrophobicContact CG1-CB 4.23Å
99K95Very high92.2Very high199 Ų199132.6 Ų132.687%0.86562%0.624SS**THydrogen-bonded Turntrans-63.4134.7-179.8-67.2-176.5179.4-179.60109.1A101K99-A101 PolarHBondContact O-N 3.5Å
100L92.6Very high92.1Very high135 Ų135131.8 Ų131.871%0.70763%0.628SS**THydrogen-bonded Turntrans56.629.7175.5-57.8167.4000114.9V98 V102 L103V98-L100 PolarHBondContact O-N 3.19Å; L100-V102 PolarHBondContact O-N 3Å; L100-L103 HydrophobicContact CB-CD1 4.09Å; L100-L103 HydrophobicContact CB-CG 4.49Å; L100-L103 HydrophobicContact CD1-CD1 4.47Å; L100-L103 PolarHBondContact O-N 2.9Å; L100-L103 VanDerWaalsContact O-N 3.09Å
101A91.2Very high91.9Very high32 Ų32127.5 Ų127.526%0.26463%0.629SS.*G310 helixtrans-55.2-26.9-177.700000114.6V98 K99 L103 Q104 F105V98-A101 HydrophobicContact CB-CB 4.15Å; V98-A101 HydrophobicContact CG1-CB 4.23Å; K99-A101 PolarHBondContact O-N 3.5Å; A101-L103 VanDerWaalsContact C-N 3.27Å; A101-L103 PolarHBondContact O-N 3.44Å; A101-Q104 WeakPolarHBondContact O-CB 3.38Å; A101-Q104 PolarHBondContact O-N 2.89Å; A101-F105 WeakPolarHBondContact O-CE1 3.35Å
102V88Confident91.9Very high90 Ų90123.1 Ų123.155%0.54562%0.616SS.*G310 helixtrans-63.7-31.8-179.9-179.50000112.3L100 Q104 F105 Y106L100-V102 PolarHBondContact O-N 3Å; V102-Q104 PolarHBondContact O-N 3.26Å; V102-F105 HydrophobicContact CG1-CD2 4.44Å; V102-F105 WeakPolarHBondContact O-CB 3.31Å; V102-F105 PolarHBondContact O-N 2.98Å; V102-F105 VanDerWaalsContact O-N 3.12Å; V102-Y106 HydrophobicContact CG1-CE2 4.25Å
103L90.3Very high91.6Very high116 Ų116116.3 Ų116.361%0.60760%0.6SS**G310 helixtrans-65.2-25179.5-64.8179.2000112.2L100 A101 F105 Y106L100-L103 HydrophobicContact CB-CD1 4.09Å; L100-L103 HydrophobicContact CB-CG 4.49Å; L100-L103 HydrophobicContact CD1-CD1 4.47Å; L100-L103 PolarHBondContact O-N 2.9Å; L100-L103 VanDerWaalsContact O-N 3.09Å; A101-L103 VanDerWaalsContact C-N 3.27Å; A101-L103 PolarHBondContact O-N 3.44Å; L103-F105 PolarHBondContact O-N 2.78Å; L103-F105 VanDerWaalsContact O-N 3.09Å; L103-Y106 PolarHBondContact O-N 3.24Å
104Q89.5Confident91.5Very high126 Ų126115.1 Ų115.159%0.58959%0.593SS**G310 helixtrans-66-10.6176.8-59.8-176.4-32.600113.2A101 V102A101-Q104 WeakPolarHBondContact O-CB 3.38Å; A101-Q104 PolarHBondContact O-N 2.89Å; V102-Q104 PolarHBondContact O-N 3.26Å
105F91.6Very high91.3Very high31 Ų31110.4 Ų110.414%0.13658%0.579CS.*G310 helixtrans-92.4-4.3-178.5-49.2-20.6000112.6A101 V102 L103 R117 L118 R119 F132A101-F105 WeakPolarHBondContact O-CE1 3.35Å; V102-F105 HydrophobicContact CG1-CD2 4.44Å; V102-F105 WeakPolarHBondContact O-CB 3.31Å; V102-F105 PolarHBondContact O-N 2.98Å; V102-F105 VanDerWaalsContact O-N 3.12Å; L103-F105 PolarHBondContact O-N 2.78Å; L103-F105 VanDerWaalsContact O-N 3.09Å; F105-R117 CarbonylContact O-C 3.55Å; F105-L118 PolarHBondContact O-N 2.86Å; F105-R119 HydrophobicContact CD1-CG 4.26Å; F105-R119 VanDerWaalsContact CE1-CZ 3.42Å; F105-F132 HydrophobicContact CB-CD2 4.26Å; F105-F132 HydrophobicContact CB-CE2 4.31Å; F105-F132 HydrophobicContact CD2-CB 4.36Å; F105-F132 AromaticContact CD2-CD2 3.57Å; F105-F132 HydrophobicContact CD2-CD2 3.57Å; F105-F132 HydrophobicContact CD2-CE2 4.17Å; F105-F132 HydrophobicContact CD2-CG 4.14Å; F105-F132 HydrophobicContact CE2-CD2 4.36Å; F105-F132 HydrophobicContact CG-CD2 4.27Å
106Y91.6Very high91.2Very high81 Ų81105.2 Ų105.232%0.31856%0.559SS.*EExtended strand (participates in β ladder)trans-125.7144.2-178.1-58.9-86.1000109.8V102 L103 V115 T116 R117 F132V102-Y106 HydrophobicContact CG1-CE2 4.25Å; L103-Y106 PolarHBondContact O-N 3.24Å; Y106-V115 HydrophobicContact CD1-CG1 3.79Å; Y106-V115 HydrophobicContact CG-CG1 4.38Å; Y106-T116 CarbonylContact C-O 3.56Å; Y106-T116 VanDerWaalsContact CA-O 3.32Å; Y106-T116 WeakPolarHBondContact CA-O 3.47Å; Y106-R117 HydrophobicContact CD1-CG 4.03Å; Y106-R117 HydrophobicContact CE1-CG 3.85Å; Y106-F132 AromaticContact CE1-CZ 3.98Å; Y106-F132 HydrophobicContact CE1-CZ 3.98Å; Y106-F132 HydrophobicContact CE2-CE2 4.1Å; Y106-F132 HydrophobicContact CE2-CZ 4.34Å; Y106-F132 AromaticContact CZ-CE2 3.73Å; Y106-F132 AromaticContact CZ-CZ 3.64Å; Y106-F132 VanDerWaalsContact OH-CE2 3.28Å; Y106-F132 WeakPolarHBondContact OH-CE2 3.5Å; Y106-F132 WeakPolarHBondContact OH-CZ 3.27Å
107K91.7Very high91.2Very high114 Ų114103.7 Ų103.750%0.49655%0.548SS..EExtended strand (participates in β ladder)trans-123.3126.9166.9177.9-174.6177.8-166.70107.7D109 T116 L118K107-D109 IonicContact NZ-OD1 3.32Å; K107-T116 WeakPolarHBondContact CB-OG1 3.43Å; K107-T116 PolarHBondContact N-O 3.24Å; K107-T116 PolarHBondContact O-N 3.47Å; K107-T116 PolarHBondContact O-OG1 3.3Å; K107-L118 HydrophobicContact CB-CD1 4.12Å; K107-L118 HydrophobicContact CB-CD2 4.05Å; K107-L118 HydrophobicContact CB-CG 4.14Å
108V91.7Very high91Very high77 Ų7799.2 Ų99.247%0.46753%0.533SS..EExtended strand (participates in β ladder)trans-101.9130.4175.2-171.90000107.1V115V108-V115 HydrophobicContact CG2-CG2 4.19Å
109D91.6Very high90.9Very high59 Ų5999.2 Ų99.232%0.31652%0.524SS..  trans-86.9117.4172.5-68.2-35.6000109.1K107 A111 T112 G113 K114K107-D109 IonicContact NZ-OD1 3.32Å; D109-A111 PolarHBondContact O-N 3.27Å; D109-T112 PolarHBondContact O-N 2.99Å; D109-G113 WeakPolarHBondContact O-CA 3.43Å; D109-G113 PolarHBondContact O-N 3.04Å; D109-K114 PolarHBondContact N-O 3.02Å
110D88.5Confident90.6Very high166 Ų16694.5 Ų94.589%0.88850%0.504SS*.THydrogen-bonded Turntrans-61.4-29.3-171.3-62.9-41.9000113.6
111A90.2Very high90.6Very high104 Ų10490.8 Ų90.886%0.8648%0.483SS*.THydrogen-bonded Turntrans-77-28.9-177.900000113.9D109D109-A111 PolarHBondContact O-N 3.27Å
112T90.8Very high90.7Very high103 Ų10389.8 Ų89.863%0.63247%0.473SS*.THydrogen-bonded Turntrans-117.7-13.9-172.960.50000113.3D109 K114D109-T112 PolarHBondContact O-N 2.99Å; T112-K114 PolarHBondContact O-N 2.91Å; T112-K114 WeakPolarHBondContact OG1-CB 3.29Å; T112-K114 PolarHBondContact OG1-N 3.44Å
113G89.7Confident90.8Very high50 Ų5089.3 Ų89.352%0.51547%0.472SS..  trans66.48.7-170.600000113.4D109 V115D109-G113 WeakPolarHBondContact O-CA 3.43Å; D109-G113 PolarHBondContact O-N 3.04Å; G113-V115 PolarHBondContact O-N 2.78Å
114K93.1Very high90.8Very high146 Ų14686.8 Ų86.864%0.63546%0.46SS*.  trans-72.9129.8-178.9-166.5175-178178.50109.8D109 T112D109-K114 PolarHBondContact N-O 3.02Å; T112-K114 PolarHBondContact O-N 2.91Å; T112-K114 WeakPolarHBondContact OG1-CB 3.29Å; T112-K114 PolarHBondContact OG1-N 3.44Å
115V90.3Very high90.7Very high86 Ų8685.5 Ų85.552%0.52147%0.471SS..EExtended strand (participates in β ladder)trans-95.7122.7178.8-173.50000109.7Y106 V108 G113Y106-V115 HydrophobicContact CD1-CG1 3.79Å; Y106-V115 HydrophobicContact CG-CG1 4.38Å; V108-V115 HydrophobicContact CG2-CG2 4.19Å; G113-V115 PolarHBondContact O-N 2.78Å
116T91Very high90.5Very high49 Ų4991.2 Ų91.230%0.30150%0.497SS..EExtended strand (participates in β ladder)trans-108139.9173.9600000110.3Y106 K107Y106-T116 CarbonylContact C-O 3.56Å; Y106-T116 VanDerWaalsContact CA-O 3.32Å; Y106-T116 WeakPolarHBondContact CA-O 3.47Å; K107-T116 WeakPolarHBondContact CB-OG1 3.43Å; K107-T116 PolarHBondContact N-O 3.24Å; K107-T116 PolarHBondContact O-N 3.47Å; K107-T116 PolarHBondContact O-OG1 3.3Å
117R90.3Very high90.1Very high144 Ų14487.6 Ų87.654%0.54348%0.484SS..EExtended strand (participates in β ladder)trans-92.1127.3177.1-63.9173.8-175.9172-1.7109F105 Y106 E121 F132F105-R117 CarbonylContact O-C 3.55Å; Y106-R117 HydrophobicContact CD1-CG 4.03Å; Y106-R117 HydrophobicContact CE1-CG 3.85Å; R117-E121 IonicContact CZ-OE1 3.57Å; R117-E121 IonicContact NE-OE1 2.58Å; R117-E121 IonicContact NH1-OE1 3.9Å; R117-E121 PolarHBondContact NH1-OE1 2.69Å; R117-E121 IonicContact NH1-OE2 4Å; R117-E121 PolarHBondContact NH1-OE2 3.29Å; R117-F132 HydrophobicContact CB-CE1 4.29Å; R117-F132 HydrophobicContact CG-CE1 4.3Å; R117-F132 HydrophobicContact CG-CZ 4.38Å
118L90.1Very high89.6Confident96 Ų9684 Ų8450%0.50348%0.48SS..  trans-90.7-9.7-179.1-62.8176.7000113.4F105 K107F105-L118 PolarHBondContact O-N 2.86Å; K107-L118 HydrophobicContact CB-CD1 4.12Å; K107-L118 HydrophobicContact CB-CD2 4.05Å; K107-L118 HydrophobicContact CB-CG 4.14Å
119R90.5Very high89.3Confident80 Ų8085 Ų8530%0.30250%0.496SS..SBendtrans-120.5149.3178.3-76.2-167.9168.3168.30.6112.3F105 F132 M133F105-R119 HydrophobicContact CD1-CG 4.26Å; F105-R119 VanDerWaalsContact CE1-CZ 3.42Å; R119-F132 HydrophobicContact CB-CB 3.92Å; R119-F132 HydrophobicContact CB-CD1 3.71Å; R119-F132 HydrophobicContact CB-CG 4.05Å; R119-F132 WeakPolarHBondContact O-CD1 3.33Å; R119-M133 WeakPolarHBondContact CD-O 3.4Å
120K89.6Confident89.1Confident99 Ų9984 Ų8443%0.4350%0.499SS..PPolyproline II helixtrans-71.5134.2174.8-168.6175.8-177.4178.90110M133K120-M133 HydrophobicContact CD-SD 4.49Å; K120-M133 PolarHBondContact O-N 2.69Å
121E91.6Very high89.2Confident58 Ų5877.6 Ų77.627%0.27147%0.466SS..BIsolated β-bridgetrans-79.4147.4171.7-67.7-174.2142.700110.8R117 P123 G130 T131 F132R117-E121 IonicContact CZ-OE1 3.57Å; R117-E121 IonicContact NE-OE1 2.58Å; R117-E121 IonicContact NH1-OE1 3.9Å; R117-E121 PolarHBondContact NH1-OE1 2.69Å; R117-E121 IonicContact NH1-OE2 4Å; R117-E121 PolarHBondContact NH1-OE2 3.29Å; E121-P123 WeakPolarHBondContact O-CD 3.42Å; E121-G130 PolarHBondContact OE1-N 2.94Å; E121-T131 WeakPolarHBondContact CA-O 3.36Å; E121-F132 HydrophobicContact CG-CD1 3.98Å; E121-F132 HydrophobicContact CG-CE1 3.81Å
122C92.8Very high89.4Confident10 Ų1074.1 Ų74.17%0.06843%0.432CS..PPolyproline II helixtrans-69.8127175.1-1720000109.5N124 C127 T131 M133 C142C122-N124 VanDerWaalsContact C-N 3.26Å; C122-N124 PolarHBondContact O-N 3.43Å; C122-C127 HydrophobicContact CB-CB 3.66Å; C122-T131 HydrophobicContact CB-CG2 4.33Å; C122-T131 PolarHBondContact N-O 3.24Å; C122-M133 HydrophobicContact CB-CG 4.11Å; C122-C142 HydrophobicContact CB-CB 4.33Å
123P91.2Very high89.5Confident81 Ų8169.2 Ų69.253%0.52640%0.402SS..  trans-78.8-7.118030.8-35.5000113.8E121 A125 L147 Y149E121-P123 WeakPolarHBondContact O-CD 3.42Å; P123-A125 PolarHBondContact O-N 2.81Å; P123-L147 HydrophobicContact CG-CD2 3.81Å; P123-Y149 HydrophobicContact CG-CE2 3.82Å; P123-Y149 WeakPolarHBondContact CG-OH 3.34Å
124N89Confident89.7Confident63 Ų6368.2 Ų68.234%0.33739%0.388SS..SBendtrans-69131.8-178.2-169.85.9000110.3C122 E126 C127C122-N124 VanDerWaalsContact C-N 3.26Å; C122-N124 PolarHBondContact O-N 3.43Å; N124-E126 PolarHBondContact O-N 2.72Å; N124-E126 VanDerWaalsContact O-N 3.15Å; N124-C127 HydrophobicContact CB-CB 4.29Å; N124-C127 CarbonylContact O-C 3.56Å; N124-C127 WeakPolarHBondContact O-CA 3.38Å; N124-C127 WeakPolarHBondContact O-CB 3.49Å; N124-C127 PolarHBondContact O-N 2.97Å
125A87.6Confident89.6Confident99 Ų9964.5 Ų64.582%0.81838%0.376SS*.THydrogen-bonded Turntrans-57.8-32.4-175.600000113.2P123 C127P123-A125 PolarHBondContact O-N 2.81Å; A125-C127 VanDerWaalsContact C-N 3.27Å; A125-C127 PolarHBondContact O-N 2.83Å
126E88.1Confident89.7Confident150 Ų15064.1 Ų64.170%0.70137%0.368SS*.THydrogen-bonded Turntrans-72.5-21.6175.8-60.1-172.8161.100113.6N124 G128 K144N124-E126 PolarHBondContact O-N 2.72Å; N124-E126 VanDerWaalsContact O-N 3.15Å; E126-G128 PolarHBondContact O-N 2.88Å; E126-K144 PolarHBondContact O-NZ 2.93Å
127C83.8Confident89.7Confident5 Ų570.6 Ų70.63%0.03439%0.393CS..SBendtrans-9774.8175.1-64.60000108.3C122 N124 A125 T131 C145C122-C127 HydrophobicContact CB-CB 3.66Å; N124-C127 HydrophobicContact CB-CB 4.29Å; N124-C127 CarbonylContact O-C 3.56Å; N124-C127 WeakPolarHBondContact O-CA 3.38Å; N124-C127 WeakPolarHBondContact O-CB 3.49Å; N124-C127 PolarHBondContact O-N 2.97Å; A125-C127 VanDerWaalsContact C-N 3.27Å; A125-C127 PolarHBondContact O-N 2.83Å; C127-T131 HydrophobicContact CB-CG2 3.99Å; C127-C145 VanDerWaalsContact SG-CB 3.51Å; C127-C145 PolarHBondContact SG-SG 3.44Å
128G80.8Confident89.8Confident40 Ų4066 Ų6641%0.41238%0.378SS..  trans-54170.2-179.500000114.7E126 T131E126-G128 PolarHBondContact O-N 2.88Å; G128-T131 WeakPolarHBondContact O-CB 3.33Å; G128-T131 PolarHBondContact O-N 2.89Å; G128-T131 VanDerWaalsContact O-N 3.12Å; G128-T131 PolarHBondContact O-OG1 3.05Å
129A85.3Confident90Very high97 Ų9765.3 Ų65.380%0.80237%0.369SS*.THydrogen-bonded Turntrans-48.2138.4-179.100000112.3
130G86.1Confident90.2Very high37 Ų3762.6 Ų62.638%0.38136%0.36SS..THydrogen-bonded Turntrans87.8-4.4-17300000115.5E121 F132E121-G130 PolarHBondContact OE1-N 2.94Å; G130-F132 VanDerWaalsContact O-CD2 3.3Å; G130-F132 WeakPolarHBondContact O-CD2 3.47Å; G130-F132 PolarHBondContact O-N 3.27Å
131T92.1Very high90.4Very high33 Ų3362 Ų6220%0.20236%0.356CS..  trans-8195.9170.9-50.80000110.4E121 C122 C127 G128 K144E121-T131 WeakPolarHBondContact CA-O 3.36Å; C122-T131 HydrophobicContact CB-CG2 4.33Å; C122-T131 PolarHBondContact N-O 3.24Å; C127-T131 HydrophobicContact CB-CG2 3.99Å; G128-T131 WeakPolarHBondContact O-CB 3.33Å; G128-T131 PolarHBondContact O-N 2.89Å; G128-T131 VanDerWaalsContact O-N 3.12Å; G128-T131 PolarHBondContact O-OG1 3.05Å; T131-K144 HydrophobicContact CG2-CB 4.15Å; T131-K144 HydrophobicContact CG2-CD 4.31Å
132F93.5Very high90.6Very high30 Ų3059.3 Ų59.313%0.13234%0.343CS..BIsolated β-bridgetrans-81.4136.2179.8-62.4-70.6000113.1F105 Y106 R117 R119 E121 G130F105-F132 HydrophobicContact CB-CD2 4.26Å; F105-F132 HydrophobicContact CB-CE2 4.31Å; F105-F132 HydrophobicContact CD2-CB 4.36Å; F105-F132 AromaticContact CD2-CD2 3.57Å; F105-F132 HydrophobicContact CD2-CD2 3.57Å; F105-F132 HydrophobicContact CD2-CE2 4.17Å; F105-F132 HydrophobicContact CD2-CG 4.14Å; F105-F132 HydrophobicContact CE2-CD2 4.36Å; F105-F132 HydrophobicContact CG-CD2 4.27Å; Y106-F132 AromaticContact CE1-CZ 3.98Å; Y106-F132 HydrophobicContact CE1-CZ 3.98Å; Y106-F132 HydrophobicContact CE2-CE2 4.1Å; Y106-F132 HydrophobicContact CE2-CZ 4.34Å; Y106-F132 AromaticContact CZ-CE2 3.73Å; Y106-F132 AromaticContact CZ-CZ 3.64Å; Y106-F132 VanDerWaalsContact OH-CE2 3.28Å; Y106-F132 WeakPolarHBondContact OH-CE2 3.5Å; Y106-F132 WeakPolarHBondContact OH-CZ 3.27Å; R117-F132 HydrophobicContact CB-CE1 4.29Å; R117-F132 HydrophobicContact CG-CE1 4.3Å; R117-F132 HydrophobicContact CG-CZ 4.38Å; R119-F132 HydrophobicContact CB-CB 3.92Å; R119-F132 HydrophobicContact CB-CD1 3.71Å; R119-F132 HydrophobicContact CB-CG 4.05Å; R119-F132 WeakPolarHBondContact O-CD1 3.33Å; E121-F132 HydrophobicContact CG-CD1 3.98Å; E121-F132 HydrophobicContact CG-CE1 3.81Å; G130-F132 VanDerWaalsContact O-CD2 3.3Å; G130-F132 WeakPolarHBondContact O-CD2 3.47Å; G130-F132 PolarHBondContact O-N 3.27Å
133M93.7Very high90.6Very high0 Ų061.9 Ų61.90%037%0.372CS..PPolyproline II helixtrans-76140.4170.1-58-174.478.400110.2R119 K120 C122 H140 Y141 C142 L147 Y149R119-M133 WeakPolarHBondContact CD-O 3.4Å; K120-M133 HydrophobicContact CD-SD 4.49Å; K120-M133 PolarHBondContact O-N 2.69Å; C122-M133 HydrophobicContact CB-CG 4.11Å; M133-H140 HydrophobicContact CB-CB 4.15Å; M133-H140 HydrophobicContact CE-CB 3.93Å; M133-H140 WeakPolarHBondContact CE-O 3.42Å; M133-H140 HydrophobicContact SD-CB 4.16Å; M133-Y141 CarbonylContact C-O 3.45Å; M133-Y141 WeakPolarHBondContact CA-O 3.44Å; M133-C142 HydrophobicContact CE-CB 4.18Å; M133-C142 HydrophobicContact CG-CB 4.27Å; M133-L147 HydrophobicContact CE-CG 4.48Å; M133-L147 VanDerWaalsContact CE-O 3.26Å; M133-L147 WeakPolarHBondContact CE-O 3.41Å; M133-Y149 HydrophobicContact CE-CD2 3.83Å; M133-Y149 HydrophobicContact CE-CE2 4.37Å; M133-Y149 HydrophobicContact SD-CD2 4Å; M133-Y149 HydrophobicContact SD-CE2 4.32Å
134A93.1Very high90.6Very high29 Ų2964.9 Ų64.924%0.2438%0.376CS..EExtended strand (participates in β ladder)trans-70.5133.5171.300000110.1H140 Y141A134-H140 CarbonylContact O-C 3.52Å; A134-H140 VanDerWaalsContact O-CA 3.28Å; A134-H140 WeakPolarHBondContact O-CA 3.37Å; A134-Y141 PolarHBondContact N-O 3.28Å; A134-Y141 PolarHBondContact O-N 3.16Å
135N91.7Very high90.9Very high69 Ų6964 Ų6437%0.36938%0.375SS..EExtended strand (participates in β ladder)trans-91.9104.4173.9-64.93.2000108.4H140N135-H140 PolarHBondContact OD1-CE1 2.84Å; N135-H140 PolarHBondContact OD1-ND1 3.05Å
136H92.6Very high91.2Very high78 Ų7860.9 Ų60.936%0.36135%0.352SS..  trans-90172.5163.2-63.4-79.8000109.3D138 R139H136-D138 VanDerWaalsContact C-N 3.25Å; H136-D138 PolarHBondContact O-N 3.42Å; H136-R139 WeakPolarHBondContact CA-O 3.5Å; H136-R139 HydrophobicContact CB-CG 3.8Å; H136-R139 WeakPolarHBondContact CB-O 3.17Å; H136-R139 PolarHBondContact N-O 3.32Å
137F91.4Very high91.4Very high185 Ų18556.4 Ų56.481%0.81133%0.332SS*.SBendtrans-63.6-31.6-176.771.7-85.2000113
138D91.9Very high91.9Very high46 Ų4659.1 Ų59.125%0.24635%0.349CS..SBendtrans-114.8-12-173.255.7-16.5000113.5H136 V150 Y151H136-D138 VanDerWaalsContact C-N 3.25Å; H136-D138 PolarHBondContact O-N 3.42Å; D138-V150 WeakPolarHBondContact O-CG1 3.39Å; D138-Y151 WeakPolarHBondContact O-CD2 3.44Å; D138-Y151 PolarHBondContact O-N 2.76Å; D138-Y151 VanDerWaalsContact O-N 3.08Å
139R93.2Very high92.4Very high82 Ų8261.7 Ų61.731%0.30935%0.347SS..EExtended strand (participates in β ladder)trans-154.4155.5-171.166.4-167.4178.9-96.25.3114H136 T148 Y149H136-R139 WeakPolarHBondContact CA-O 3.5Å; H136-R139 HydrophobicContact CB-CG 3.8Å; H136-R139 WeakPolarHBondContact CB-O 3.17Å; H136-R139 PolarHBondContact N-O 3.32Å; R139-T148 HydrophobicContact CB-CG2 3.92Å; R139-T148 HydrophobicContact CG-CG2 4.23Å; R139-Y149 CarbonylContact C-O 3.37Å; R139-Y149 WeakPolarHBondContact CA-O 3.33Å; R139-Y149 WeakPolarHBondContact CB-O 3.24Å
140H94.6Very high92.7Very high23 Ų2362.1 Ų62.111%0.10634%0.339CS..EExtended strand (participates in β ladder)trans-94.7129.5157.2-65.7-67.4000109.8M133 A134 N135 T148 Y149 Y151M133-H140 HydrophobicContact CB-CB 4.15Å; M133-H140 HydrophobicContact CE-CB 3.93Å; M133-H140 WeakPolarHBondContact CE-O 3.42Å; M133-H140 HydrophobicContact SD-CB 4.16Å; A134-H140 CarbonylContact O-C 3.52Å; A134-H140 VanDerWaalsContact O-CA 3.28Å; A134-H140 WeakPolarHBondContact O-CA 3.37Å; N135-H140 PolarHBondContact OD1-CE1 2.84Å; N135-H140 PolarHBondContact OD1-ND1 3.05Å; H140-T148 CarbonylContact O-C 3.57Å; H140-T148 VanDerWaalsContact O-CA 3.29Å; H140-T148 WeakPolarHBondContact O-CA 3.41Å; H140-Y149 PolarHBondContact N-O 3.5Å; H140-Y149 PolarHBondContact O-N 2.77Å; H140-Y151 AromaticContact CD2-CE1 3.57Å; H140-Y151 AromaticContact CD2-CZ 3.83Å; H140-Y151 AromaticContact CE1-CE1 3.97Å; H140-Y151 AromaticContact CE1-CZ 3.78Å; H140-Y151 PolarHBondContact CE1-OH 2.94Å; H140-Y151 AromaticContact NE2-CE1 3.21Å; H140-Y151 WeakPolarHBondContact NE2-CE1 3.36Å; H140-Y151 AromaticContact NE2-CZ 3.48Å; H140-Y151 PolarHBondContact NE2-OH 2.91Å; H140-Y151 VanDerWaalsContact NE2-OH 3.12Å
141Y95.3Very high92.7Very high88 Ų8865 Ų6535%0.34534%0.339SS..EExtended strand (participates in β ladder)trans-125.5126.8-179.3173.3-105.4000111.6M133 A134 T148M133-Y141 CarbonylContact C-O 3.45Å; M133-Y141 WeakPolarHBondContact CA-O 3.44Å; A134-Y141 PolarHBondContact N-O 3.28Å; A134-Y141 PolarHBondContact O-N 3.16Å; Y141-T148 WeakPolarHBondContact CD2-OG1 3.43Å
142C95Very high92.1Very high0 Ų070.7 Ų70.70%037%0.368CS..  trans-83.3116.6172-176.10000110.5C122 M133 K144 C145 G146 L147C122-C142 HydrophobicContact CB-CB 4.33Å; M133-C142 HydrophobicContact CE-CB 4.18Å; M133-C142 HydrophobicContact CG-CB 4.27Å; C142-K144 PolarHBondContact O-N 2.82Å; C142-K144 PolarHBondContact SG-N 2.82Å; C142-C145 PolarHBondContact SG-SG 3.05Å; C142-G146 VanDerWaalsContact O-CA 3.25Å; C142-G146 WeakPolarHBondContact O-CA 3.33Å; C142-G146 PolarHBondContact O-N 3.19Å; C142-L147 HydrophobicContact CB-CB 4.2Å; C142-L147 PolarHBondContact N-O 2.92Å
143G92Very high90.9Very high65 Ų6578.1 Ų78.167%0.6740%0.403SS*.THydrogen-bonded Turntrans-67.9-14.2175.900000115.1
144K92.5Very high89.6Confident144 Ų14487.2 Ų87.263%0.62645%0.446SS*.THydrogen-bonded Turntrans-92.7-51.9-178-168.7-177.9-179.9-164.10112.7E126 T131 C142E126-K144 PolarHBondContact O-NZ 2.93Å; T131-K144 HydrophobicContact CG2-CB 4.15Å; T131-K144 HydrophobicContact CG2-CD 4.31Å; C142-K144 PolarHBondContact O-N 2.82Å; C142-K144 PolarHBondContact SG-N 2.82Å
145C94.6Very high87.7Confident45 Ų4594.1 Ų94.130%0.30450%0.503SS..THydrogen-bonded Turntrans-106.4-5-177.964.40000114.6C127 C142 L147C127-C145 VanDerWaalsContact SG-CB 3.51Å; C127-C145 PolarHBondContact SG-SG 3.44Å; C142-C145 PolarHBondContact SG-SG 3.05Å; C145-L147 PolarHBondContact O-N 2.91Å; C145-L147 VanDerWaalsContact SG-CB 3.55Å
146G93.4Very high87.5Confident32 Ų3295.4 Ų95.433%0.3351%0.509SS..  trans77.31.1-178.300000115.2C142 T148C142-G146 VanDerWaalsContact O-CA 3.25Å; C142-G146 WeakPolarHBondContact O-CA 3.33Å; C142-G146 PolarHBondContact O-N 3.19Å; G146-T148 PolarHBondContact O-N 2.78Å; G146-T148 PolarHBondContact O-OG1 2.81Å
147L93.2Very high87.3Confident56 Ų5696.3 Ų96.329%0.29352%0.517SS..  trans-57.6131.3177.9-176.767.5000110.8P123 M133 C142 C145 Y149P123-L147 HydrophobicContact CG-CD2 3.81Å; M133-L147 HydrophobicContact CE-CG 4.48Å; M133-L147 VanDerWaalsContact CE-O 3.26Å; M133-L147 WeakPolarHBondContact CE-O 3.41Å; C142-L147 HydrophobicContact CB-CB 4.2Å; C142-L147 PolarHBondContact N-O 2.92Å; C145-L147 PolarHBondContact O-N 2.91Å; C145-L147 VanDerWaalsContact SG-CB 3.55Å; L147-Y149 HydrophobicContact CD2-CE2 3.85Å; L147-Y149 HydrophobicContact CG-CE2 4.36Å
148T94.4Very high87Confident62 Ų6291.3 Ų91.338%0.3850%0.501SS..EExtended strand (participates in β ladder)trans-125.4128.7-177.3-54.10000110.3R139 H140 Y141 G146R139-T148 HydrophobicContact CB-CG2 3.92Å; R139-T148 HydrophobicContact CG-CG2 4.23Å; H140-T148 CarbonylContact O-C 3.57Å; H140-T148 VanDerWaalsContact O-CA 3.29Å; H140-T148 WeakPolarHBondContact O-CA 3.41Å; Y141-T148 WeakPolarHBondContact CD2-OG1 3.43Å; G146-T148 PolarHBondContact O-N 2.78Å; G146-T148 PolarHBondContact O-OG1 2.81Å
149Y91Very high86.7Confident95 Ų9594 Ų9437%0.37352%0.516SS..EExtended strand (participates in β ladder)trans-112.3123166.4-71-62.9000109P123 M133 R139 H140 L147P123-Y149 HydrophobicContact CG-CE2 3.82Å; P123-Y149 WeakPolarHBondContact CG-OH 3.34Å; M133-Y149 HydrophobicContact CE-CD2 3.83Å; M133-Y149 HydrophobicContact CE-CE2 4.37Å; M133-Y149 HydrophobicContact SD-CD2 4Å; M133-Y149 HydrophobicContact SD-CE2 4.32Å; R139-Y149 CarbonylContact C-O 3.37Å; R139-Y149 WeakPolarHBondContact CA-O 3.33Å; R139-Y149 WeakPolarHBondContact CB-O 3.24Å; H140-Y149 PolarHBondContact N-O 3.5Å; H140-Y149 PolarHBondContact O-N 2.77Å; L147-Y149 HydrophobicContact CD2-CE2 3.85Å; L147-Y149 HydrophobicContact CG-CE2 4.36Å
150V90.7Very high86.3Confident105 Ų10594.8 Ų94.864%0.63653%0.529SS*.EExtended strand (participates in β ladder)trans-88.5140.5173.8-176.20000108.1D138 N152D138-V150 WeakPolarHBondContact O-CG1 3.39Å; V150-N152 PolarHBondContact O-N 3.07Å
151Y86.6Confident85.8Confident97 Ų9799.5 Ų99.538%0.3856%0.557SS.*  trans-68.3133.1172.3-59.5-66.3000109.2D138 H140 Q153D138-Y151 WeakPolarHBondContact O-CD2 3.44Å; D138-Y151 PolarHBondContact O-N 2.76Å; D138-Y151 VanDerWaalsContact O-N 3.08Å; H140-Y151 AromaticContact CD2-CE1 3.57Å; H140-Y151 AromaticContact CD2-CZ 3.83Å; H140-Y151 AromaticContact CE1-CE1 3.97Å; H140-Y151 AromaticContact CE1-CZ 3.78Å; H140-Y151 PolarHBondContact CE1-OH 2.94Å; H140-Y151 AromaticContact NE2-CE1 3.21Å; H140-Y151 WeakPolarHBondContact NE2-CE1 3.36Å; H140-Y151 AromaticContact NE2-CZ 3.48Å; H140-Y151 PolarHBondContact NE2-OH 2.91Å; H140-Y151 VanDerWaalsContact NE2-OH 3.12Å; Y151-Q153 PolarHBondContact O-N 3.19Å
152N79.2Confident85.1Confident153 Ų153100.4 Ų100.482%0.81857%0.572SS**  trans-64112.4166.3-81-4.6000107.1V150 Q154V150-N152 PolarHBondContact O-N 3.07Å; N152-Q154 PolarHBondContact O-N 3.29Å
153Q68.3Low84.3Confident186 Ų186108.1 Ų108.187%0.86962%0.616SS**  trans-62.3108.8165.9-70.1178.6-5.700105.6Y151 A155Y151-Q153 PolarHBondContact O-N 3.19Å; Q153-A155 PolarHBondContact O-N 3.24Å; Q153-A155 VanDerWaalsContact O-N 3.14Å
154Q67Low83.7Confident192 Ų192111.7 Ų111.790%0.89761%0.611SS**  trans-60.9118.4166.2-74.1178-13.200105.8N152N152-Q154 PolarHBondContact O-N 3.29Å
155A53.7Low82.9Confident173 Ų173108.7 Ų108.7100%1.4361%0.61SS**  trans-63.60175.700000110.8Q153Q153-A155 PolarHBondContact O-N 3.24Å; Q153-A155 VanDerWaalsContact O-N 3.14Å

Retrieved 155 of 155 residues in 621.9 ms (Link to these results)