A0A671ESN2_RHIFE Loading...

Ubiquitin-ribosomal protein eS31 fusion protein

Component of the 40S subunit of the ribosome. Part of the small subunit (SSU) processome, first precursor of the small eukaryotic ribosomal subunit. During the assembly of the SSU processome in the nucleolus, many ribosome biogenesis factors, an RNA chaperone and ribosomal proteins associate with the nascent pre-rRNA and work in concert to generate RNA folding, modifications, rearrangements and cleavage as well as targeted degradation of pre-ribosomal RNA by the RNA exosome.

AlphaFold DB , UniProt , Accession A0A671ESN2, Species RHIFE (Rhinolophus ferrumequinum, Greater horseshoe bat), Gene LOC117012346, Length 156 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
1M93Very high93.1Very high74 Ų7466.3 Ų66.337%0.36536%0.359SS..  0159.7071.2169.4107.900110.2I3 V17 P19 K63M1-I3 HydrophobicContact SD-CG2 4.39Å; M1-V17 HydrophobicContact CG-CG2 3.93Å; M1-V17 VanDerWaalsContact CG-O 3.31Å; M1-V17 WeakPolarHBondContact CG-O 3.39Å; M1-V17 PolarHBondContact N-O 2.79Å; M1-V17 PolarHBondContact O-N 2.77Å; M1-P19 HydrophobicContact CE-CB 3.37Å; M1-P19 HydrophobicContact CE-CG 3.82Å; M1-K63 HydrophobicContact CB-CB 4.29Å
2Q93.5Very high93.2Very high74 Ų7466.4 Ų66.435%0.34636%0.364SS..EExtended strand (participates in β ladder)trans-106.3133.3178.7-173.4174.7-0.400110.3L15 E64Q2-L15 WeakPolarHBondContact CA-O 3.23Å; Q2-E64 PolarHBondContact O-N 3.48Å
3I96.4Very high93.4Very high0 Ų062.3 Ų62.30%034%0.341CS..EExtended strand (participates in β ladder)trans-126.8162.317561.2169.5000110.4M1 L15 V17 V26 L56 I61 L67M1-I3 HydrophobicContact SD-CG2 4.39Å; I3-L15 HydrophobicContact CD1-CB 4.43Å; I3-L15 HydrophobicContact CG1-CB 3.95Å; I3-L15 PolarHBondContact N-O 2.93Å; I3-L15 PolarHBondContact O-N 2.91Å; I3-V17 HydrophobicContact CB-CG2 4.44Å; I3-V17 HydrophobicContact CD1-CB 4.47Å; I3-V17 HydrophobicContact CD1-CG1 3.99Å; I3-V17 HydrophobicContact CD1-CG2 3.68Å; I3-V17 HydrophobicContact CG1-CG1 4.31Å; I3-V17 HydrophobicContact CG1-CG2 3.72Å; I3-V17 HydrophobicContact CG2-CG2 3.94Å; I3-V26 HydrophobicContact CD1-CG1 4.39Å; I3-L56 HydrophobicContact CD1-CD1 4.49Å; I3-I61 HydrophobicContact CG2-CG2 4.14Å; I3-L67 HydrophobicContact CB-CD1 4.35Å; I3-L67 HydrophobicContact CD1-CD1 3.69Å; I3-L67 HydrophobicContact CG1-CD1 4.45Å
4F96.7Very high93.5Very high55 Ų5562.5 Ų62.524%0.24135%0.345CS..EExtended strand (participates in β ladder)trans-114.2138178.5-59.6-76.3000110.9T12 I13 T14 E64 S65 T66 L67F4-T12 HydrophobicContact CB-CG2 3.93Å; F4-T12 HydrophobicContact CD1-CG2 3.97Å; F4-T12 HydrophobicContact CG-CG2 4.33Å; F4-I13 CarbonylContact C-O 3.57Å; F4-I13 WeakPolarHBondContact CA-O 3.39Å; F4-T14 HydrophobicContact CD1-CG2 3.83Å; F4-T14 HydrophobicContact CE1-CG2 3.67Å; F4-E64 HydrophobicContact CE2-CB 3.99Å; F4-E64 HydrophobicContact CE2-CG 3.97Å; F4-S65 PolarHBondContact N-O 2.78Å; F4-T66 HydrophobicContact CB-CG2 4.05Å; F4-T66 HydrophobicContact CD2-CG2 4.37Å; F4-T66 CarbonylContact O-C 3.58Å; F4-T66 WeakPolarHBondContact O-CA 3.41Å; F4-L67 PolarHBondContact O-N 3.48Å
5V96.1Very high93.7Very high0 Ų058.6 Ų58.60%032%0.323CS..EExtended strand (participates in β ladder)trans-118.3115173.6-177.30000108.9T12 I13 L15 I30 L43 L67 L69V5-T12 CarbonylContact O-C 3.54Å; V5-T12 WeakPolarHBondContact O-CA 3.44Å; V5-I13 HydrophobicContact CB-CB 4.44Å; V5-I13 PolarHBondContact N-O 2.84Å; V5-I13 PolarHBondContact O-N 3.18Å; V5-L15 HydrophobicContact CG2-CD1 3.56Å; V5-L15 HydrophobicContact CG2-CG 4.33Å; V5-I30 HydrophobicContact CG1-CD1 4.19Å; V5-I30 HydrophobicContact CG2-CD1 4.12Å; V5-L43 HydrophobicContact CG1-CD2 4.33Å; V5-L67 CarbonylContact C-O 3.6Å; V5-L67 WeakPolarHBondContact CA-O 3.29Å; V5-L67 HydrophobicContact CG2-CB 4.47Å; V5-L69 HydrophobicContact CG1-CB 3.64Å
6K96.2Very high93.7Very high89 Ų8964.9 Ų64.939%0.38735%0.35SS..EExtended strand (participates in β ladder)trans-91.3119.5173.7-77.5-174.6177.3178.60110.1T12 L67 H68 L69K6-T12 HydrophobicContact CG-CG2 4.28Å; K6-L67 PolarHBondContact N-O 2.7Å; K6-H68 CarbonylContact O-C 3.54Å; K6-H68 WeakPolarHBondContact O-CA 3.31Å; K6-L69 PolarHBondContact O-N 2.77Å
7T92.6Very high93.8Very high17 Ų1761.2 Ų61.210%0.10433%0.33CS..EExtended strand (participates in β ladder)trans-79.3164.1172.962.30000111.3T9 G10 K11 I13 L69T7-T9 PolarHBondContact O-N 2.95Å; T7-T9 PolarHBondContact OG1-OG1 2.98Å; T7-G10 PolarHBondContact O-N 2.7Å; T7-K11 PolarHBondContact N-O 2.92Å; T7-K11 WeakPolarHBondContact OG1-CB 3.47Å; T7-K11 PolarHBondContact OG1-N 2.72Å; T7-K11 PolarHBondContact OG1-O 2.75Å; T7-I13 HydrophobicContact CG2-CD1 3.77Å; T7-L69 HydrophobicContact CG2-CD2 4.22Å
8L88.3Confident93.8Very high124 Ų12464.6 Ų64.665%0.64934%0.343SS*.THydrogen-bonded Turntrans-58.2-26.2174-69175.6000113.7G10 V70L8-G10 PolarHBondContact O-N 2.97Å; L8-V70 HydrophobicContact CD1-CG1 4.2Å; L8-V70 HydrophobicContact CD2-CG1 4.41Å; L8-V70 HydrophobicContact CD2-CG2 4.05Å
9T87.8Confident93.7Very high125 Ų12564.6 Ų64.677%0.76735%0.347SS*.THydrogen-bonded Turntrans-81.71.8178.757.90000112.8T7 K11T7-T9 PolarHBondContact O-N 2.95Å; T7-T9 PolarHBondContact OG1-OG1 2.98Å; T9-K11 VanDerWaalsContact C-N 3.28Å; T9-K11 PolarHBondContact O-N 2.84Å
10G90Very high93.7Very high58 Ų5864.9 Ų64.960%0.59835%0.354SS*.SBendtrans83.1-3.6-178.100000114.3T7 L8T7-G10 PolarHBondContact O-N 2.7Å; L8-G10 PolarHBondContact O-N 2.97Å
11K93.6Very high93.7Very high113 Ų11362.8 Ų62.849%0.49134%0.343SS..  trans-68.6132.6174.3-172.5-174.2179.9-1660109.9T7 T9 E34T7-K11 PolarHBondContact N-O 2.92Å; T7-K11 WeakPolarHBondContact OG1-CB 3.47Å; T7-K11 PolarHBondContact OG1-N 2.72Å; T7-K11 PolarHBondContact OG1-O 2.75Å; T9-K11 VanDerWaalsContact C-N 3.28Å; T9-K11 PolarHBondContact O-N 2.84Å; K11-E34 WeakPolarHBondContact CE-OE1 3.35Å; K11-E34 IonicContact NZ-OE1 3.53Å; K11-E34 PolarHBondContact NZ-OE1 2.97Å; K11-E34 IonicContact NZ-OE2 2.7Å
12T94.9Very high93.9Very high68 Ų6861.2 Ų61.242%0.41734%0.337SS..EExtended strand (participates in β ladder)trans-105.8127.5176.8-54.30000109.8F4 V5 K6F4-T12 HydrophobicContact CB-CG2 3.93Å; F4-T12 HydrophobicContact CD1-CG2 3.97Å; F4-T12 HydrophobicContact CG-CG2 4.33Å; V5-T12 CarbonylContact O-C 3.54Å; V5-T12 WeakPolarHBondContact O-CA 3.44Å; K6-T12 HydrophobicContact CG-CG2 4.28Å
13I94.9Very high94Very high13 Ų1357.7 Ų57.77%0.06732%0.321CS..EExtended strand (participates in β ladder)trans-110.5135.6-179.6-54.9155.9000108.1F4 V5 T7 L15 K33 E34F4-I13 CarbonylContact C-O 3.57Å; F4-I13 WeakPolarHBondContact CA-O 3.39Å; V5-I13 HydrophobicContact CB-CB 4.44Å; V5-I13 PolarHBondContact N-O 2.84Å; V5-I13 PolarHBondContact O-N 3.18Å; T7-I13 HydrophobicContact CG2-CD1 3.77Å; I13-L15 HydrophobicContact CG2-CD2 4.29Å; I13-L15 HydrophobicContact CG2-CG 4.49Å; I13-K33 HydrophobicContact CG2-CD 3.72Å; I13-E34 HydrophobicContact CD1-CG 3.32Å; I13-E34 WeakPolarHBondContact CD1-OE1 3.39Å; I13-E34 HydrophobicContact CG1-CG 4.41Å
14T95.7Very high93.9Very high65 Ų6563.4 Ų63.440%0.39935%0.348SS..EExtended strand (participates in β ladder)trans-90.8135.2172.351.60000110F4 K33F4-T14 HydrophobicContact CD1-CG2 3.83Å; F4-T14 HydrophobicContact CE1-CG2 3.67Å; T14-K33 PolarHBondContact O-NZ 3.1Å
15L95.3Very high93.8Very high4 Ų464.4 Ų64.42%0.02136%0.356CS..EExtended strand (participates in β ladder)trans-128.8138.8174.6-63.6173.6000110.8Q2 I3 V5 I13 V17 V26 K29 I30 K33Q2-L15 WeakPolarHBondContact CA-O 3.23Å; I3-L15 HydrophobicContact CD1-CB 4.43Å; I3-L15 HydrophobicContact CG1-CB 3.95Å; I3-L15 PolarHBondContact N-O 2.93Å; I3-L15 PolarHBondContact O-N 2.91Å; V5-L15 HydrophobicContact CG2-CD1 3.56Å; V5-L15 HydrophobicContact CG2-CG 4.33Å; I13-L15 HydrophobicContact CG2-CD2 4.29Å; I13-L15 HydrophobicContact CG2-CG 4.49Å; L15-V17 HydrophobicContact CB-CG1 4.14Å; L15-V26 HydrophobicContact CD1-CG1 4.2Å; L15-K29 HydrophobicContact CD2-CB 4.3Å; L15-I30 HydrophobicContact CD1-CD1 4.1Å; L15-I30 HydrophobicContact CD1-CG1 3.52Å; L15-K33 HydrophobicContact CD2-CD 3.76Å
16E94.6Very high93.8Very high159 Ų15964.4 Ų64.474%0.74336%0.356SS*.EExtended strand (participates in β ladder)trans-95.9118.4169.8-67.4-173.7169.800109.2K29E16-K29 PolarHBondContact O-NZ 2.97Å
17V94.8Very high93.7Very high3 Ų360.7 Ų60.72%0.01834%0.34CS..  trans-140.9155.6-172.2-61.60000110.8M1 I3 L15 D21 V26 K29 L56M1-V17 HydrophobicContact CG-CG2 3.93Å; M1-V17 VanDerWaalsContact CG-O 3.31Å; M1-V17 WeakPolarHBondContact CG-O 3.39Å; M1-V17 PolarHBondContact N-O 2.79Å; M1-V17 PolarHBondContact O-N 2.77Å; I3-V17 HydrophobicContact CB-CG2 4.44Å; I3-V17 HydrophobicContact CD1-CB 4.47Å; I3-V17 HydrophobicContact CD1-CG1 3.99Å; I3-V17 HydrophobicContact CD1-CG2 3.68Å; I3-V17 HydrophobicContact CG1-CG1 4.31Å; I3-V17 HydrophobicContact CG1-CG2 3.72Å; I3-V17 HydrophobicContact CG2-CG2 3.94Å; L15-V17 HydrophobicContact CB-CG1 4.14Å; V17-D21 WeakPolarHBondContact CA-OD2 3.48Å; V17-V26 HydrophobicContact CG1-CG2 4.18Å; V17-K29 HydrophobicContact CG1-CD 4.14Å; V17-L56 HydrophobicContact CB-CD1 3.75Å; V17-L56 HydrophobicContact CG1-CD1 4.41Å; V17-L56 HydrophobicContact CG2-CD1 3.45Å; V17-L56 VanDerWaalsContact CG2-CD1 3.45Å
18E94.3Very high93.8Very high122 Ų12261.7 Ų61.757%0.5735%0.349SS*.  trans-99.2150.3170.7-66.2-170.4170.600110.5S20 D21E18-S20 WeakPolarHBondContact CB-OG 3.33Å; E18-S20 PolarHBondContact O-N 3.39Å; E18-D21 PolarHBondContact N-OD2 2.95Å; E18-D21 VanDerWaalsContact O-CB 3.28Å; E18-D21 WeakPolarHBondContact O-CB 3.4Å; E18-D21 PolarHBondContact O-N 3.22Å
19P92.1Very high94.1Very high64 Ų6459 Ų5942%0.41633%0.332SS..THydrogen-bonded Turntrans-58.1-29.117717.6-25.6000113.1M1 D21 L56 S57M1-P19 HydrophobicContact CE-CB 3.37Å; M1-P19 HydrophobicContact CE-CG 3.82Å; P19-D21 VanDerWaalsContact C-N 3.31Å; P19-L56 PolarHBondContact O-N 3.08Å; P19-S57 PolarHBondContact O-N 3.36Å; P19-S57 PolarHBondContact O-OG 3.46Å; P19-S57 VanDerWaalsContact O-OG 3.1Å
20S93.8Very high94.4Very high70 Ų7053 Ų5349%0.4930%0.296SS..THydrogen-bonded Turntrans-73.9-14.2174.841.50000114.1E18 T22E18-S20 WeakPolarHBondContact CB-OG 3.33Å; E18-S20 PolarHBondContact O-N 3.39Å; S20-T22 PolarHBondContact O-N 2.84Å
21D94.1Very high94.6Very high22 Ų2254 Ų5412%0.11829%0.285CS..  trans-62.3134178.5-81-27.9000110V17 E18 P19 N25 V26 K29 T55 L56V17-D21 WeakPolarHBondContact CA-OD2 3.48Å; E18-D21 PolarHBondContact N-OD2 2.95Å; E18-D21 VanDerWaalsContact O-CB 3.28Å; E18-D21 WeakPolarHBondContact O-CB 3.4Å; E18-D21 PolarHBondContact O-N 3.22Å; P19-D21 VanDerWaalsContact C-N 3.31Å; D21-N25 HydrophobicContact CB-CB 4.5Å; D21-V26 HydrophobicContact CB-CG2 4.37Å; D21-K29 IonicContact OD2-NZ 3.97Å; D21-K29 PolarHBondContact OD2-NZ 2.9Å; D21-T55 WeakPolarHBondContact O-CA 3.47Å; D21-L56 HydrophobicContact CB-CD1 4.34Å; D21-L56 PolarHBondContact O-N 3.03Å
22T95.9Very high94.6Very high40 Ų4055 Ų5525%0.24530%0.296CS..BIsolated β-bridgetrans-72.9156.6171.160.60000110.8S20 E24 N25 V26 R54 T55S20-T22 PolarHBondContact O-N 2.84Å; T22-E24 PolarHBondContact O-N 3.26Å; T22-N25 WeakPolarHBondContact O-CB 3.49Å; T22-N25 PolarHBondContact O-N 3.2Å; T22-N25 VanDerWaalsContact O-N 3.1Å; T22-N25 VanDerWaalsContact OG1-CG 3.26Å; T22-N25 PolarHBondContact OG1-N 2.97Å; T22-N25 PolarHBondContact OG1-OD1 3.18Å; T22-V26 WeakPolarHBondContact O-CG2 3.41Å; T22-V26 PolarHBondContact O-N 2.94Å; T22-V26 VanDerWaalsContact O-N 3.09Å; T22-R54 WeakPolarHBondContact CA-O 3.39Å; T22-T55 HydrophobicContact CG2-CG2 4.47Å
23I95.6Very high94.4Very high0 Ų057.1 Ų57.10%030%0.299CS..Hα-helixtrans-60.5-32.1174.6-61.3-53.9000111.5V26 K27 L43 L50 E51 R54 L56 Y59I23-V26 PolarHBondContact O-N 3.34Å; I23-K27 WeakPolarHBondContact O-CG 3.28Å; I23-K27 PolarHBondContact O-N 3.03Å; I23-L43 HydrophobicContact CG2-CD1 4.24Å; I23-L50 HydrophobicContact CD1-CB 4.15Å; I23-L50 HydrophobicContact CD1-CD1 3.63Å; I23-L50 HydrophobicContact CD1-CG 4.47Å; I23-L50 HydrophobicContact CG1-CB 4.02Å; I23-L50 HydrophobicContact CG1-CD1 4.42Å; I23-L50 HydrophobicContact CG2-CB 3.89Å; I23-E51 VanDerWaalsContact CB-O 3.29Å; I23-E51 WeakPolarHBondContact CB-O 3.36Å; I23-E51 WeakPolarHBondContact CG1-O 3.41Å; I23-R54 WeakPolarHBondContact CG1-O 3.38Å; I23-R54 PolarHBondContact N-O 3.22Å; I23-L56 HydrophobicContact CD1-CD2 3.76Å; I23-L56 HydrophobicContact CD1-CG 4.49Å; I23-Y59 HydrophobicContact CD1-CD2 4.44Å; I23-Y59 HydrophobicContact CG1-CD2 4.49Å; I23-Y59 HydrophobicContact CG1-CE2 4.21Å
24E95.2Very high94.2Very high120 Ų12059.2 Ų59.256%0.56131%0.309SS*.Hα-helixtrans-60.4-45.8172.3-170.4169.6-160.800112.4T22 V26 K27 A28 D52T22-E24 PolarHBondContact O-N 3.26Å; E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 PolarHBondContact O-N 2.91Å; E24-K27 WeakPolarHBondContact O-CB 3.41Å; E24-K27 PolarHBondContact O-N 3.02Å; E24-A28 PolarHBondContact O-N 2.87Å; E24-D52 HydrophobicContact CB-CB 4.29Å; E24-D52 PolarHBondContact N-O 3.27Å
25N94.4Very high94Very high77 Ų7759 Ų5941%0.41232%0.319SS..Hα-helixtrans-62.7-39176.2-70-6.4000111.8D21 T22 A28 K29D21-N25 HydrophobicContact CB-CB 4.5Å; T22-N25 WeakPolarHBondContact O-CB 3.49Å; T22-N25 PolarHBondContact O-N 3.2Å; T22-N25 VanDerWaalsContact O-N 3.1Å; T22-N25 VanDerWaalsContact OG1-CG 3.26Å; T22-N25 PolarHBondContact OG1-N 2.97Å; T22-N25 PolarHBondContact OG1-OD1 3.18Å; N25-A28 PolarHBondContact O-N 3.45Å; N25-K29 WeakPolarHBondContact O-CG 3.26Å; N25-K29 PolarHBondContact O-N 3.03Å
26V94.9Very high93.7Very high0 Ų060.3 Ų60.30%033%0.326CS..Hα-helixtrans-63.9-41.3175.8178.10000111I3 L15 V17 D21 T22 I23 E24 A28 K29 I30 L43 L56I3-V26 HydrophobicContact CD1-CG1 4.39Å; L15-V26 HydrophobicContact CD1-CG1 4.2Å; V17-V26 HydrophobicContact CG1-CG2 4.18Å; D21-V26 HydrophobicContact CB-CG2 4.37Å; T22-V26 WeakPolarHBondContact O-CG2 3.41Å; T22-V26 PolarHBondContact O-N 2.94Å; T22-V26 VanDerWaalsContact O-N 3.09Å; I23-V26 PolarHBondContact O-N 3.34Å; E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 PolarHBondContact O-N 2.91Å; V26-A28 VanDerWaalsContact C-N 3.35Å; V26-K29 PolarHBondContact O-N 2.76Å; V26-I30 HydrophobicContact CG1-CD1 4.17Å; V26-I30 WeakPolarHBondContact O-CG1 3.14Å; V26-I30 PolarHBondContact O-N 3.31Å; V26-L43 HydrophobicContact CB-CD1 4.5Å; V26-L43 HydrophobicContact CG1-CD1 3.96Å; V26-L56 HydrophobicContact CG2-CD1 3.9Å; V26-L56 HydrophobicContact CG2-CD2 4.12Å; V26-L56 HydrophobicContact CG2-CG 4.1Å
27K94.9Very high93.6Very high11 Ų1154.5 Ų54.55%0.04830%0.302CS..Hα-helixtrans-64.4-37.4175.3-71.9177.6174.8-177.10112.8I23 E24 I30 Q31 P38 Q41 L43 D52I23-K27 WeakPolarHBondContact O-CG 3.28Å; I23-K27 PolarHBondContact O-N 3.03Å; E24-K27 WeakPolarHBondContact O-CB 3.41Å; E24-K27 PolarHBondContact O-N 3.02Å; K27-I30 PolarHBondContact O-N 3.03Å; K27-Q31 PolarHBondContact O-N 3.32Å; K27-P38 HydrophobicContact CB-CB 3.94Å; K27-P38 HydrophobicContact CD-CB 4.42Å; K27-Q41 VanDerWaalsContact CA-OE1 3.26Å; K27-Q41 HydrophobicContact CD-CB 4.23Å; K27-Q41 WeakPolarHBondContact CE-O 3.25Å; K27-Q41 HydrophobicContact CG-CB 4.17Å; K27-Q41 PolarHBondContact NZ-O 3.29Å; K27-Q41 PolarHBondContact O-NE2 3.2Å; K27-Q41 PolarHBondContact O-OE1 2.83Å; K27-L43 HydrophobicContact CG-CD1 3.88Å; K27-L43 HydrophobicContact CG-CG 4.4Å; K27-D52 WeakPolarHBondContact CD-OD1 3.44Å; K27-D52 WeakPolarHBondContact CE-OD1 3.29Å; K27-D52 IonicContact NZ-OD1 2.79Å; K27-D52 PolarHBondContact NZ-OD1 2.83Å; K27-D52 IonicContact NZ-OD2 2.84Å; K27-D52 PolarHBondContact NZ-OD2 3.2Å
28A94.7Very high93.4Very high37 Ų3756.1 Ų56.131%0.30631%0.313SS..Hα-helixtrans-61.7-47.2173.300000111.2E24 N25 V26 I30 Q31 D32E24-A28 PolarHBondContact O-N 2.87Å; N25-A28 PolarHBondContact O-N 3.45Å; V26-A28 VanDerWaalsContact C-N 3.35Å; A28-I30 PolarHBondContact O-N 2.99Å; A28-Q31 WeakPolarHBondContact O-CA 3.36Å; A28-Q31 VanDerWaalsContact O-CB 3.26Å; A28-Q31 WeakPolarHBondContact O-CB 3.32Å; A28-Q31 PolarHBondContact O-N 3.3Å; A28-D32 PolarHBondContact O-N 3.41Å
29K94.8Very high93.1Very high68 Ų6854.3 Ų54.330%0.29631%0.307SS..Hα-helixtrans-59.8-32.9174.7-69.5176.3177.41790113L15 E16 V17 D21 N25 V26L15-K29 HydrophobicContact CD2-CB 4.3Å; E16-K29 PolarHBondContact O-NZ 2.97Å; V17-K29 HydrophobicContact CG1-CD 4.14Å; D21-K29 IonicContact OD2-NZ 3.97Å; D21-K29 PolarHBondContact OD2-NZ 2.9Å; N25-K29 WeakPolarHBondContact O-CG 3.26Å; N25-K29 PolarHBondContact O-N 3.03Å; V26-K29 PolarHBondContact O-N 2.76Å
30I94.1Very high93Very high0 Ų054 Ų540%030%0.3CS..Hα-helixtrans-70.7-38.8173.3-68.3166.6000111.2V5 L15 V26 K27 A28 D32 K33 E34 L43 L69V5-I30 HydrophobicContact CG1-CD1 4.19Å; V5-I30 HydrophobicContact CG2-CD1 4.12Å; L15-I30 HydrophobicContact CD1-CD1 4.1Å; L15-I30 HydrophobicContact CD1-CG1 3.52Å; V26-I30 HydrophobicContact CG1-CD1 4.17Å; V26-I30 WeakPolarHBondContact O-CG1 3.14Å; V26-I30 PolarHBondContact O-N 3.31Å; K27-I30 PolarHBondContact O-N 3.03Å; A28-I30 PolarHBondContact O-N 2.99Å; I30-D32 VanDerWaalsContact C-N 3.29Å; I30-D32 PolarHBondContact O-N 3.32Å; I30-K33 PolarHBondContact O-N 3.09Å; I30-E34 PolarHBondContact O-N 3.42Å; I30-L43 HydrophobicContact CD1-CD1 3.99Å; I30-L43 HydrophobicContact CD1-CD2 3.66Å; I30-L43 HydrophobicContact CD1-CG 4.35Å; I30-L69 HydrophobicContact CG2-CD2 3.8Å
31Q94.3Very high93Very high77 Ų7750.8 Ų50.836%0.3628%0.277SS..Hα-helixtrans-59.3-42.9175.3179.3-176.210.200110.8K27 A28 K33 G35 I36 P38K27-Q31 PolarHBondContact O-N 3.32Å; A28-Q31 WeakPolarHBondContact O-CA 3.36Å; A28-Q31 VanDerWaalsContact O-CB 3.26Å; A28-Q31 WeakPolarHBondContact O-CB 3.32Å; A28-Q31 PolarHBondContact O-N 3.3Å; Q31-K33 PolarHBondContact O-N 3.28Å; Q31-G35 WeakPolarHBondContact O-CA 3.48Å; Q31-G35 PolarHBondContact O-N 2.88Å; Q31-I36 WeakPolarHBondContact CA-O 3.44Å; Q31-I36 VanDerWaalsContact CB-O 3.25Å; Q31-I36 WeakPolarHBondContact CB-O 3.46Å; Q31-I36 WeakPolarHBondContact CG-O 3.48Å; Q31-P38 HydrophobicContact CB-CG 4.48Å
32D93.2Very high93Very high135 Ų13553.8 Ų53.872%0.72229%0.286SS*.Hα-helixtrans-62.9-29.3179.6-64.3-30.3000112.8A28 I30A28-D32 PolarHBondContact O-N 3.41Å; I30-D32 VanDerWaalsContact C-N 3.29Å; I30-D32 PolarHBondContact O-N 3.32Å
33K91.6Very high92.9Very high112 Ų11251.9 Ų51.949%0.48728%0.275SS..Hα-helixtrans-91.6-39.4-179-66.9-165.1-179.1-165.90114.6I13 T14 L15 I30 Q31I13-K33 HydrophobicContact CG2-CD 3.72Å; T14-K33 PolarHBondContact O-NZ 3.1Å; L15-K33 HydrophobicContact CD2-CD 3.76Å; I30-K33 PolarHBondContact O-N 3.09Å; Q31-K33 PolarHBondContact O-N 3.28Å
34E89.9Confident92.9Very high58 Ų5854.3 Ų54.327%0.27129%0.287SS..Hα-helixtrans-108.7-10.2-174.7-69.3-73.5133.500113.3K11 I13 I30 I36K11-E34 WeakPolarHBondContact CE-OE1 3.35Å; K11-E34 IonicContact NZ-OE1 3.53Å; K11-E34 PolarHBondContact NZ-OE1 2.97Å; K11-E34 IonicContact NZ-OE2 2.7Å; I13-E34 HydrophobicContact CD1-CG 3.32Å; I13-E34 WeakPolarHBondContact CD1-OE1 3.39Å; I13-E34 HydrophobicContact CG1-CG 4.41Å; I30-E34 PolarHBondContact O-N 3.42Å; E34-I36 HydrophobicContact CB-CD1 3.84Å; E34-I36 HydrophobicContact CB-CG1 4.01Å; E34-I36 PolarHBondContact O-N 3Å
35G90.6Very high92.9Very high60 Ų6050.8 Ų50.862%0.61927%0.27SS*.  trans73.19.5-177.500000114.5Q31Q31-G35 WeakPolarHBondContact O-CA 3.48Å; Q31-G35 PolarHBondContact O-N 2.88Å
36I89.8Confident92.9Very high32 Ų3251.4 Ų51.416%0.16429%0.286CS..  trans-87.9123.4-177.1-57.5166.5000108.7Q31 E34 Q40 Q41 L69 L71Q31-I36 WeakPolarHBondContact CA-O 3.44Å; Q31-I36 VanDerWaalsContact CB-O 3.25Å; Q31-I36 WeakPolarHBondContact CB-O 3.46Å; Q31-I36 WeakPolarHBondContact CG-O 3.48Å; E34-I36 HydrophobicContact CB-CD1 3.84Å; E34-I36 HydrophobicContact CB-CG1 4.01Å; E34-I36 PolarHBondContact O-N 3Å; I36-Q40 HydrophobicContact CG2-CB 4.2Å; I36-Q41 HydrophobicContact CB-CG 4.38Å; I36-Q41 HydrophobicContact CG2-CG 3.78Å; I36-Q41 PolarHBondContact O-NE2 3.46Å; I36-L69 HydrophobicContact CD1-CD2 4.18Å; I36-L71 HydrophobicContact CD1-CD2 4.09Å; I36-L71 HydrophobicContact CG1-CD2 4.49Å; I36-L71 HydrophobicContact CG2-CD2 3.49Å; I36-L71 VanDerWaalsContact CG2-CD2 3.49Å
37P91.8Very high92.7Very high36 Ų3654.9 Ų54.923%0.23432%0.322CS..  trans-69.4146.9-176.629.6-35.7000111.9D39 Q40 Q41P37-D39 VanDerWaalsContact C-N 3.25Å; P37-D39 VanDerWaalsContact CB-OD1 3.29Å; P37-D39 WeakPolarHBondContact CB-OD1 3.48Å; P37-D39 WeakPolarHBondContact CG-OD1 3.48Å; P37-D39 PolarHBondContact O-N 3.1Å; P37-Q40 HydrophobicContact CG-CB 4.09Å; P37-Q40 HydrophobicContact CG-CG 3.82Å; P37-Q40 WeakPolarHBondContact O-CB 3.36Å; P37-Q40 PolarHBondContact O-N 2.82Å; P37-Q41 PolarHBondContact O-N 2.76Å
38P91.6Very high92.7Very high38 Ų3861.4 Ų61.425%0.24735%0.35CS..G310 helixtrans-59.8-30.9-171.2-27.436.5000114.2K27 Q31 Q40 Q41K27-P38 HydrophobicContact CB-CB 3.94Å; K27-P38 HydrophobicContact CD-CB 4.42Å; Q31-P38 HydrophobicContact CB-CG 4.48Å; P38-Q40 PolarHBondContact O-N 3.45Å; P38-Q41 PolarHBondContact O-N 2.97Å; P38-Q41 VanDerWaalsContact O-N 3.11Å
39D88.9Confident92.6Very high83 Ų8364.1 Ų64.144%0.44436%0.357SS..G310 helixtrans-65-26.3176.972.9-44.8000112.5P37 R72 R74P37-D39 VanDerWaalsContact C-N 3.25Å; P37-D39 VanDerWaalsContact CB-OD1 3.29Å; P37-D39 WeakPolarHBondContact CB-OD1 3.48Å; P37-D39 WeakPolarHBondContact CG-OD1 3.48Å; P37-D39 PolarHBondContact O-N 3.1Å; D39-R72 WeakPolarHBondContact O-CD 3.41Å; D39-R74 IonicContact OD2-CZ 2.63Å; D39-R74 IonicContact OD2-NE 2.92Å; D39-R74 IonicContact OD2-NH2 3.3Å; D39-R74 PolarHBondContact OD2-NH2 3.46Å
40Q89.8Confident92.6Very high58 Ų5861 Ų6127%0.27134%0.343SS..G310 helixtrans-91.2-6.3177-65.5176.722.900112.9I36 P37 P38 L71 R72I36-Q40 HydrophobicContact CG2-CB 4.2Å; P37-Q40 HydrophobicContact CG-CB 4.09Å; P37-Q40 HydrophobicContact CG-CG 3.82Å; P37-Q40 WeakPolarHBondContact O-CB 3.36Å; P37-Q40 PolarHBondContact O-N 2.82Å; P38-Q40 PolarHBondContact O-N 3.45Å; Q40-L71 CarbonylContact O-C 3.51Å; Q40-L71 WeakPolarHBondContact O-CA 3.47Å; Q40-R72 PolarHBondContact O-N 3.04Å
41Q92.5Very high92.6Very high2 Ų266 Ų661%0.00937%0.366CS..EExtended strand (participates in β ladder)trans-92.8132.5-178.8-61.6-179.729.200111.8K27 I36 P37 P38 L69K27-Q41 VanDerWaalsContact CA-OE1 3.26Å; K27-Q41 HydrophobicContact CD-CB 4.23Å; K27-Q41 WeakPolarHBondContact CE-O 3.25Å; K27-Q41 HydrophobicContact CG-CB 4.17Å; K27-Q41 PolarHBondContact NZ-O 3.29Å; K27-Q41 PolarHBondContact O-NE2 3.2Å; K27-Q41 PolarHBondContact O-OE1 2.83Å; I36-Q41 HydrophobicContact CB-CG 4.38Å; I36-Q41 HydrophobicContact CG2-CG 3.78Å; I36-Q41 PolarHBondContact O-NE2 3.46Å; P37-Q41 PolarHBondContact O-N 2.76Å; P38-Q41 PolarHBondContact O-N 2.97Å; P38-Q41 VanDerWaalsContact O-N 3.11Å; Q41-L69 HydrophobicContact CB-CD1 3.75Å; Q41-L69 HydrophobicContact CG-CD1 3.95Å
42R93.8Very high92.5Very high85 Ų8565.6 Ų65.632%0.32137%0.367SS..EExtended strand (participates in β ladder)trans-119.3117.8164.5-67.7-176.9176.5-160.20.2109.1V70 R72R42-V70 WeakPolarHBondContact CA-O 3.42Å; R42-V70 HydrophobicContact CB-CB 4.35Å; R42-V70 WeakPolarHBondContact CB-O 3.43Å; R42-V70 PolarHBondContact N-O 3.05Å; R42-V70 PolarHBondContact O-N 3.32Å; R42-R72 HydrophobicContact CG-CB 4.26Å
43L94.8Very high92.4Very high0 Ų062.8 Ų62.80%037%0.37CS..EExtended strand (participates in β ladder)trans-95.8133.5173.8-65.6175.8000109.6V5 I23 V26 K27 I30 L50 L67 H68 L69V5-L43 HydrophobicContact CG1-CD2 4.33Å; I23-L43 HydrophobicContact CG2-CD1 4.24Å; V26-L43 HydrophobicContact CB-CD1 4.5Å; V26-L43 HydrophobicContact CG1-CD1 3.96Å; K27-L43 HydrophobicContact CG-CD1 3.88Å; K27-L43 HydrophobicContact CG-CG 4.4Å; I30-L43 HydrophobicContact CD1-CD1 3.99Å; I30-L43 HydrophobicContact CD1-CD2 3.66Å; I30-L43 HydrophobicContact CD1-CG 4.35Å; L43-L50 HydrophobicContact CB-CB 4.36Å; L43-L50 HydrophobicContact CB-CD1 4.15Å; L43-L50 HydrophobicContact CB-CG 4.39Å; L43-L50 PolarHBondContact O-N 3.03Å; L43-L67 HydrophobicContact CB-CD2 4.3Å; L43-H68 WeakPolarHBondContact CA-O 3.33Å; L43-L69 HydrophobicContact CD2-CB 4.2Å; L43-L69 HydrophobicContact CD2-CD1 3.83Å
44I95.4Very high92.6Very high51 Ų5162.5 Ų62.526%0.26237%0.366SS..EExtended strand (participates in β ladder)trans-126.3130.6-179.2-56.3174.5000108.4K48 H68 V70I44-K48 WeakPolarHBondContact CA-O 3.49Å; I44-H68 HydrophobicContact CB-CB 4.3Å; I44-H68 PolarHBondContact N-O 2.92Å; I44-H68 PolarHBondContact O-N 2.79Å; I44-V70 HydrophobicContact CD1-CB 4.45Å; I44-V70 HydrophobicContact CD1-CG2 3.69Å
45F95.9Very high92.9Very high47 Ų4761.1 Ų61.121%0.20636%0.361CS..EExtended strand (participates in β ladder)trans-136135174-178.1-111.5000109.3G47 K48 L50 I61 T66 L67F45-G47 PolarHBondContact O-N 3.43Å; F45-G47 VanDerWaalsContact O-N 3.11Å; F45-K48 PolarHBondContact N-O 3.34Å; F45-K48 PolarHBondContact O-N 3.49Å; F45-L50 HydrophobicContact CB-CD1 4.26Å; F45-L50 HydrophobicContact CB-CD2 4.12Å; F45-L50 HydrophobicContact CB-CG 4.45Å; F45-I61 HydrophobicContact CD1-CD1 4.3Å; F45-I61 HydrophobicContact CD1-CG1 3.79Å; F45-I61 HydrophobicContact CE1-CG1 3.85Å; F45-I61 HydrophobicContact CG-CD1 4.41Å; F45-I61 HydrophobicContact CG-CG1 4.22Å; F45-I61 HydrophobicContact CZ-CG1 4.34Å; F45-T66 WeakPolarHBondContact CD2-O 3.34Å; F45-L67 HydrophobicContact CB-CD2 4.38Å; F45-L67 HydrophobicContact CB-CG 4.49Å; F45-L67 HydrophobicContact CD2-CG 4.5Å
46A93.4Very high93.1Very high89 Ų8958.3 Ų58.374%0.73633%0.332SS*.THydrogen-bonded Turntrans48.338.5-176.400000114K48A46-K48 PolarHBondContact O-N 2.78Å
47G91.9Very high93.3Very high74 Ų7459.3 Ų59.376%0.76334%0.342SS*.THydrogen-bonded Turntrans74.40.2-178.500000115.5F45F45-G47 PolarHBondContact O-N 3.43Å; F45-G47 VanDerWaalsContact O-N 3.11Å
48K93.1Very high93.3Very high148 Ų14862.2 Ų62.264%0.64336%0.355SS*.EExtended strand (participates in β ladder)trans-104.4135.6177.9-65.1-177.6-178.2177.70110.8I44 F45 A46I44-K48 WeakPolarHBondContact CA-O 3.49Å; F45-K48 PolarHBondContact N-O 3.34Å; F45-K48 PolarHBondContact O-N 3.49Å; A46-K48 PolarHBondContact O-N 2.78Å
49Q93.7Very high93.5Very high94 Ų9462.2 Ų62.244%0.43935%0.351SS..EExtended strand (participates in β ladder)trans-72.1133.8170.4-175-177-3400109.3
50L94.6Very high93.7Very high3 Ų364.6 Ų64.62%0.01636%0.363CS..PPolyproline II helixtrans-83.5141.5178.1-54.1-172.6000111.3I23 L43 F45 Y59 I61 L67I23-L50 HydrophobicContact CD1-CB 4.15Å; I23-L50 HydrophobicContact CD1-CD1 3.63Å; I23-L50 HydrophobicContact CD1-CG 4.47Å; I23-L50 HydrophobicContact CG1-CB 4.02Å; I23-L50 HydrophobicContact CG1-CD1 4.42Å; I23-L50 HydrophobicContact CG2-CB 3.89Å; L43-L50 HydrophobicContact CB-CB 4.36Å; L43-L50 HydrophobicContact CB-CD1 4.15Å; L43-L50 HydrophobicContact CB-CG 4.39Å; L43-L50 PolarHBondContact O-N 3.03Å; F45-L50 HydrophobicContact CB-CD1 4.26Å; F45-L50 HydrophobicContact CB-CD2 4.12Å; F45-L50 HydrophobicContact CB-CG 4.45Å; L50-Y59 HydrophobicContact CB-CE2 4.18Å; L50-Y59 HydrophobicContact CD2-CD1 3.63Å; L50-Y59 HydrophobicContact CD2-CD2 3.71Å; L50-Y59 HydrophobicContact CD2-CE1 3.67Å; L50-Y59 HydrophobicContact CD2-CE2 3.71Å; L50-Y59 HydrophobicContact CD2-CG 3.64Å; L50-Y59 HydrophobicContact CG-CE2 4.46Å; L50-I61 HydrophobicContact CD1-CD1 3.92Å; L50-L67 HydrophobicContact CD1-CD2 3.32Å
51E94.1Very high93.9Very high103 Ų10362 Ų6248%0.48135%0.352SS..PPolyproline II helixtrans-97.7140.8179-66.1175.5173.800110.7I23 G53 R54 Y59I23-E51 VanDerWaalsContact CB-O 3.29Å; I23-E51 WeakPolarHBondContact CB-O 3.36Å; I23-E51 WeakPolarHBondContact CG1-O 3.41Å; E51-G53 VanDerWaalsContact C-N 3.28Å; E51-G53 PolarHBondContact O-N 3.28Å; E51-R54 PolarHBondContact O-N 2.92Å; E51-R54 IonicContact OE1-NH2 3.92Å; E51-R54 IonicContact OE2-CZ 3.68Å; E51-R54 VanDerWaalsContact OE2-CZ 3.23Å; E51-R54 IonicContact OE2-NE 3.23Å; E51-R54 PolarHBondContact OE2-NE 2.91Å; E51-R54 IonicContact OE2-NH2 2.73Å; E51-R54 PolarHBondContact OE2-NH2 2.85Å; E51-Y59 PolarHBondContact N-OH 3.18Å
52D92.3Very high94Very high70 Ų7068.8 Ų68.837%0.37438%0.383SS..THydrogen-bonded Turntrans-63.6-30.2-172.6-67-32.1000113.8E24 K27 R54E24-D52 HydrophobicContact CB-CB 4.29Å; E24-D52 PolarHBondContact N-O 3.27Å; K27-D52 WeakPolarHBondContact CD-OD1 3.44Å; K27-D52 WeakPolarHBondContact CE-OD1 3.29Å; K27-D52 IonicContact NZ-OD1 2.79Å; K27-D52 PolarHBondContact NZ-OD1 2.83Å; K27-D52 IonicContact NZ-OD2 2.84Å; K27-D52 PolarHBondContact NZ-OD2 3.2Å; D52-R54 PolarHBondContact O-N 3.17Å
53G91.9Very high94Very high75 Ų7571 Ų7177%0.77340%0.395SS*.THydrogen-bonded Turntrans-85.33.8-178.100000116.1E51E51-G53 VanDerWaalsContact C-N 3.28Å; E51-G53 PolarHBondContact O-N 3.28Å
54R94.9Very high93.9Very high107 Ų10776.6 Ų76.640%0.40442%0.421SS..SBendtrans-107.1159.8177.2-65.7-169.5-153.5-163.7-0111.1T22 I23 E51 D52 D58 Y59T22-R54 WeakPolarHBondContact CA-O 3.39Å; I23-R54 WeakPolarHBondContact CG1-O 3.38Å; I23-R54 PolarHBondContact N-O 3.22Å; E51-R54 PolarHBondContact O-N 2.92Å; E51-R54 IonicContact OE1-NH2 3.92Å; E51-R54 IonicContact OE2-CZ 3.68Å; E51-R54 VanDerWaalsContact OE2-CZ 3.23Å; E51-R54 IonicContact OE2-NE 3.23Å; E51-R54 PolarHBondContact OE2-NE 2.91Å; E51-R54 IonicContact OE2-NH2 2.73Å; E51-R54 PolarHBondContact OE2-NH2 2.85Å; D52-R54 PolarHBondContact O-N 3.17Å; R54-D58 HydrophobicContact CB-CB 4.24Å; R54-Y59 HydrophobicContact CB-CD2 4.3Å; R54-Y59 HydrophobicContact CB-CE2 3.61Å; R54-Y59 HydrophobicContact CG-CE2 4.33Å
55T95.4Very high93.9Very high29 Ų2975.1 Ų75.118%0.17842%0.415CS..BIsolated β-bridgetrans-91.5165.2177.363.70000111.9D21 T22 S57 D58 Y59D21-T55 WeakPolarHBondContact O-CA 3.47Å; T22-T55 HydrophobicContact CG2-CG2 4.47Å; T55-S57 VanDerWaalsContact C-N 3.25Å; T55-S57 PolarHBondContact O-N 3.47Å; T55-S57 PolarHBondContact OG1-OG 3.31Å; T55-D58 PolarHBondContact N-OD2 2.88Å; T55-D58 PolarHBondContact O-N 2.96Å; T55-D58 PolarHBondContact OG1-N 2.89Å; T55-D58 PolarHBondContact OG1-OD1 3.24Å; T55-D58 PolarHBondContact OG1-OD2 3.11Å; T55-Y59 WeakPolarHBondContact O-CD2 3.1Å
56L94.8Very high93.9Very high0 Ų075.8 Ų75.80%042%0.423CS..THydrogen-bonded Turntrans-60.9-36.6170.5-70.5176.8000111.9I3 V17 P19 D21 I23 V26 D58 Y59 N60 I61I3-L56 HydrophobicContact CD1-CD1 4.49Å; V17-L56 HydrophobicContact CB-CD1 3.75Å; V17-L56 HydrophobicContact CG1-CD1 4.41Å; V17-L56 HydrophobicContact CG2-CD1 3.45Å; V17-L56 VanDerWaalsContact CG2-CD1 3.45Å; P19-L56 PolarHBondContact O-N 3.08Å; D21-L56 HydrophobicContact CB-CD1 4.34Å; D21-L56 PolarHBondContact O-N 3.03Å; I23-L56 HydrophobicContact CD1-CD2 3.76Å; I23-L56 HydrophobicContact CD1-CG 4.49Å; V26-L56 HydrophobicContact CG2-CD1 3.9Å; V26-L56 HydrophobicContact CG2-CD2 4.12Å; V26-L56 HydrophobicContact CG2-CG 4.1Å; L56-D58 PolarHBondContact O-N 3.45Å; L56-Y59 PolarHBondContact O-N 3.29Å; L56-N60 PolarHBondContact O-N 3.18Å; L56-I61 HydrophobicContact CB-CB 4.28Å; L56-I61 HydrophobicContact CD2-CB 4.23Å; L56-I61 HydrophobicContact CD2-CD1 3.49Å; L56-I61 VanDerWaalsContact CD2-CD1 3.49Å; L56-I61 HydrophobicContact CD2-CG1 4.44Å; L56-I61 HydrophobicContact CD2-CG2 4.19Å; L56-I61 WeakPolarHBondContact O-CB 3.4Å; L56-I61 PolarHBondContact O-N 3.48Å
57S93.7Very high94Very high54 Ų5471.5 Ų71.538%0.37839%0.388SS..G310 helixtrans-62.6-37174.940.70000113.4P19 T55 Y59 N60P19-S57 PolarHBondContact O-N 3.36Å; P19-S57 PolarHBondContact O-OG 3.46Å; P19-S57 VanDerWaalsContact O-OG 3.1Å; T55-S57 VanDerWaalsContact C-N 3.25Å; T55-S57 PolarHBondContact O-N 3.47Å; T55-S57 PolarHBondContact OG1-OG 3.31Å; S57-Y59 PolarHBondContact O-N 2.95Å; S57-Y59 VanDerWaalsContact O-N 3.17Å; S57-N60 PolarHBondContact O-N 3.17Å
58D93.8Very high94.2Very high97 Ų9772.3 Ų72.352%0.51937%0.372SS..G310 helixtrans-62.8-25.8179.8-63-35.9000112.7R54 T55 L56R54-D58 HydrophobicContact CB-CB 4.24Å; T55-D58 PolarHBondContact N-OD2 2.88Å; T55-D58 PolarHBondContact O-N 2.96Å; T55-D58 PolarHBondContact OG1-N 2.89Å; T55-D58 PolarHBondContact OG1-OD1 3.24Å; T55-D58 PolarHBondContact OG1-OD2 3.11Å; L56-D58 PolarHBondContact O-N 3.45Å
59Y94.4Very high94.3Very high38 Ų3865.6 Ų65.615%0.14934%0.343CS..G310 helixtrans-97.78.1176.2-69.9-72.6000113.4I23 L50 E51 R54 T55 L56 S57 I61I23-Y59 HydrophobicContact CD1-CD2 4.44Å; I23-Y59 HydrophobicContact CG1-CD2 4.49Å; I23-Y59 HydrophobicContact CG1-CE2 4.21Å; L50-Y59 HydrophobicContact CB-CE2 4.18Å; L50-Y59 HydrophobicContact CD2-CD1 3.63Å; L50-Y59 HydrophobicContact CD2-CD2 3.71Å; L50-Y59 HydrophobicContact CD2-CE1 3.67Å; L50-Y59 HydrophobicContact CD2-CE2 3.71Å; L50-Y59 HydrophobicContact CD2-CG 3.64Å; L50-Y59 HydrophobicContact CG-CE2 4.46Å; E51-Y59 PolarHBondContact N-OH 3.18Å; R54-Y59 HydrophobicContact CB-CD2 4.3Å; R54-Y59 HydrophobicContact CB-CE2 3.61Å; R54-Y59 HydrophobicContact CG-CE2 4.33Å; T55-Y59 WeakPolarHBondContact O-CD2 3.1Å; L56-Y59 PolarHBondContact O-N 3.29Å; S57-Y59 PolarHBondContact O-N 2.95Å; S57-Y59 VanDerWaalsContact O-N 3.17Å; Y59-I61 PolarHBondContact O-N 3.11Å
60N93.8Very high94.2Very high132 Ų13263 Ų6371%0.70633%0.334SS*.THydrogen-bonded Turntrans52.638.4-175-65.6-46.8000112.7L56 S57 Q62L56-N60 PolarHBondContact O-N 3.18Å; S57-N60 PolarHBondContact O-N 3.17Å; N60-Q62 PolarHBondContact O-N 2.63Å
61I94.5Very high93.9Very high5 Ų566.6 Ų66.63%0.02635%0.352CS..PPolyproline II helixtrans-78.3117.4177.7-63.9168.2000108.3I3 F45 L50 L56 Y59 L67I3-I61 HydrophobicContact CG2-CG2 4.14Å; F45-I61 HydrophobicContact CD1-CD1 4.3Å; F45-I61 HydrophobicContact CD1-CG1 3.79Å; F45-I61 HydrophobicContact CE1-CG1 3.85Å; F45-I61 HydrophobicContact CG-CD1 4.41Å; F45-I61 HydrophobicContact CG-CG1 4.22Å; F45-I61 HydrophobicContact CZ-CG1 4.34Å; L50-I61 HydrophobicContact CD1-CD1 3.92Å; L56-I61 HydrophobicContact CB-CB 4.28Å; L56-I61 HydrophobicContact CD2-CB 4.23Å; L56-I61 HydrophobicContact CD2-CD1 3.49Å; L56-I61 VanDerWaalsContact CD2-CD1 3.49Å; L56-I61 HydrophobicContact CD2-CG1 4.44Å; L56-I61 HydrophobicContact CD2-CG2 4.19Å; L56-I61 WeakPolarHBondContact O-CB 3.4Å; L56-I61 PolarHBondContact O-N 3.48Å; Y59-I61 PolarHBondContact O-N 3.11Å; I61-L67 HydrophobicContact CD1-CD2 4.18Å
62Q93.3Very high93.3Very high143 Ų14367.9 Ų67.967%0.66835%0.353SS*.PPolyproline II helixtrans-101.7173.8-178.4-63.7-174.6-1000111.6N60 E64 S65N60-Q62 PolarHBondContact O-N 2.63Å; Q62-E64 PolarHBondContact O-N 3.27Å; Q62-S65 PolarHBondContact N-OG 2.96Å; Q62-S65 VanDerWaalsContact N-OG 3.08Å; Q62-S65 VanDerWaalsContact O-CB 3.23Å; Q62-S65 WeakPolarHBondContact O-CB 3.39Å; Q62-S65 PolarHBondContact O-N 3.3Å; Q62-S65 PolarHBondContact O-OG 3.21Å
63K93.8Very high92.3Very high131 Ų13172.1 Ų72.157%0.5738%0.375SS*.THydrogen-bonded Turntrans-52.2140.7169.6-176.4-179.2173.4-163.40109.7M1 S65M1-K63 HydrophobicContact CB-CB 4.29Å; K63-S65 PolarHBondContact O-N 3.31Å
64E93.4Very high91.1Very high118 Ų11877.1 Ų77.155%0.55137%0.37SS*.THydrogen-bonded Turntrans66.210.2-179.7-67.6156.5-14900115.6Q2 F4 Q62Q2-E64 PolarHBondContact O-N 3.48Å; F4-E64 HydrophobicContact CE2-CB 3.99Å; F4-E64 HydrophobicContact CE2-CG 3.97Å; Q62-E64 PolarHBondContact O-N 3.27Å
65S95.6Very high89.5Confident20 Ų2075.4 Ų75.414%0.1439%0.386CS..PPolyproline II helixtrans-64.8142.9172.6-62.40000112.1F4 Q62 K63F4-S65 PolarHBondContact N-O 2.78Å; Q62-S65 PolarHBondContact N-OG 2.96Å; Q62-S65 VanDerWaalsContact N-OG 3.08Å; Q62-S65 VanDerWaalsContact O-CB 3.23Å; Q62-S65 WeakPolarHBondContact O-CB 3.39Å; Q62-S65 PolarHBondContact O-N 3.3Å; Q62-S65 PolarHBondContact O-OG 3.21Å; K63-S65 PolarHBondContact O-N 3.31Å
66T95.6Very high88.1Confident61 Ų6177.7 Ų77.737%0.37442%0.415SS..EExtended strand (participates in β ladder)trans-104117.817763.20000111.4F4 F45F4-T66 HydrophobicContact CB-CG2 4.05Å; F4-T66 HydrophobicContact CD2-CG2 4.37Å; F4-T66 CarbonylContact O-C 3.58Å; F4-T66 WeakPolarHBondContact O-CA 3.41Å; F45-T66 WeakPolarHBondContact CD2-O 3.34Å
67L96.1Very high87Confident0 Ų082 Ų820%045%0.45CS..EExtended strand (participates in β ladder)trans-95150.7168.2-62.7101.8000111.1I3 F4 V5 K6 L43 F45 L50 I61I3-L67 HydrophobicContact CB-CD1 4.35Å; I3-L67 HydrophobicContact CD1-CD1 3.69Å; I3-L67 HydrophobicContact CG1-CD1 4.45Å; F4-L67 PolarHBondContact O-N 3.48Å; V5-L67 CarbonylContact C-O 3.6Å; V5-L67 WeakPolarHBondContact CA-O 3.29Å; V5-L67 HydrophobicContact CG2-CB 4.47Å; K6-L67 PolarHBondContact N-O 2.7Å; L43-L67 HydrophobicContact CB-CD2 4.3Å; F45-L67 HydrophobicContact CB-CD2 4.38Å; F45-L67 HydrophobicContact CB-CG 4.49Å; F45-L67 HydrophobicContact CD2-CG 4.5Å; L50-L67 HydrophobicContact CD1-CD2 3.32Å; I61-L67 HydrophobicContact CD1-CD2 4.18Å
68H96Very high85.9Confident90 Ų9089.5 Ų89.542%0.41748%0.476SS..EExtended strand (participates in β ladder)trans-103124171.9-65.7-79.1000110.3K6 L43 I44K6-H68 CarbonylContact O-C 3.54Å; K6-H68 WeakPolarHBondContact O-CA 3.31Å; L43-H68 WeakPolarHBondContact CA-O 3.33Å; I44-H68 HydrophobicContact CB-CB 4.3Å; I44-H68 PolarHBondContact N-O 2.92Å; I44-H68 PolarHBondContact O-N 2.79Å
69L94.3Very high85Confident7 Ų794.4 Ų94.44%0.03749%0.493CS..EExtended strand (participates in β ladder)trans-94.3118.4173.4177.966.1000110.1V5 K6 T7 I30 I36 Q41 L43V5-L69 HydrophobicContact CG1-CB 3.64Å; K6-L69 PolarHBondContact O-N 2.77Å; T7-L69 HydrophobicContact CG2-CD2 4.22Å; I30-L69 HydrophobicContact CG2-CD2 3.8Å; I36-L69 HydrophobicContact CD1-CD2 4.18Å; Q41-L69 HydrophobicContact CB-CD1 3.75Å; Q41-L69 HydrophobicContact CG-CD1 3.95Å; L43-L69 HydrophobicContact CD2-CB 4.2Å; L43-L69 HydrophobicContact CD2-CD1 3.83Å
70V91.7Very high84.2Confident41 Ų41104 Ų10425%0.24853%0.529CS..EExtended strand (participates in β ladder)trans-116.6138.8174.3-1760000108.8L8 R42 I44L8-V70 HydrophobicContact CD1-CG1 4.2Å; L8-V70 HydrophobicContact CD2-CG1 4.41Å; L8-V70 HydrophobicContact CD2-CG2 4.05Å; R42-V70 WeakPolarHBondContact CA-O 3.42Å; R42-V70 HydrophobicContact CB-CB 4.35Å; R42-V70 WeakPolarHBondContact CB-O 3.43Å; R42-V70 PolarHBondContact N-O 3.05Å; R42-V70 PolarHBondContact O-N 3.32Å; I44-V70 HydrophobicContact CD1-CB 4.45Å; I44-V70 HydrophobicContact CD1-CG2 3.69Å
71L88.5Confident83.7Confident78 Ų78107.3 Ų107.341%0.40854%0.537SS..EExtended strand (participates in β ladder)trans-77.7132.5175.7-69.6174.7000111I36 Q40 L73I36-L71 HydrophobicContact CD1-CD2 4.09Å; I36-L71 HydrophobicContact CG1-CD2 4.49Å; I36-L71 HydrophobicContact CG2-CD2 3.49Å; I36-L71 VanDerWaalsContact CG2-CD2 3.49Å; Q40-L71 CarbonylContact O-C 3.51Å; Q40-L71 WeakPolarHBondContact O-CA 3.47Å; L71-L73 PolarHBondContact O-N 2.84Å
72R81Confident83.3Confident130 Ų130117 Ų11749%0.49158%0.579SS.*  trans-70.899167.8-166.2171.6-170.2128.1-3107.2D39 Q40 R42 R74D39-R72 WeakPolarHBondContact O-CD 3.41Å; Q40-R72 PolarHBondContact O-N 3.04Å; R42-R72 HydrophobicContact CG-CB 4.26Å; R72-R74 PolarHBondContact O-N 2.73Å
73L71.7Confident83Confident159 Ų159117.8 Ų117.883%0.83258%0.58SS**  trans-56.9106.9175.4-60.1176.6000108.6L71 G75L71-L73 PolarHBondContact O-N 2.84Å; L73-G75 PolarHBondContact O-N 3.11Å; L73-G75 VanDerWaalsContact O-N 3.11Å
74R66.3Low82.8Confident180 Ų180116.8 Ų116.868%0.67959%0.589SS**  trans-64.3113.2166.7-86.5-176.5178.8178.41106.3D39 R72 G76D39-R74 IonicContact OD2-CZ 2.63Å; D39-R74 IonicContact OD2-NE 2.92Å; D39-R74 IonicContact OD2-NH2 3.3Å; D39-R74 PolarHBondContact OD2-NH2 3.46Å; R72-R74 PolarHBondContact O-N 2.73Å; R74-G76 PolarHBondContact O-N 2.89Å
75G62.9Low82.6Confident71 Ų71120 Ų12073%0.73260%0.598SS**  trans-47.5139.1173.900000110.7L73 A77L73-G75 PolarHBondContact O-N 3.11Å; L73-G75 VanDerWaalsContact O-N 3.11Å; G75-A77 PolarHBondContact O-N 3.4Å
76G65.9Low82.4Confident76 Ų76125.3 Ų125.378%0.78463%0.63SS**  trans-46.5133.1-169.500000113R74 K78R74-G76 PolarHBondContact O-N 2.89Å; G76-K78 PolarHBondContact O-N 2.87Å
77A70.6Confident82.2Confident91 Ų91127.4 Ų127.475%0.75264%0.643SS**  trans-42.7136-179.900000111.6G75 K79G75-A77 PolarHBondContact O-N 3.4Å; A77-K79 PolarHBondContact O-N 3.42Å
78K70Confident82Confident212 Ų212133 Ų13392%0.92268%0.679SS**  trans-48.8107.4-179.6-77.4-179179171.90109.8G76 R80G76-K78 PolarHBondContact O-N 2.87Å; K78-R80 PolarHBondContact O-N 3.23Å
79K75.6Confident81.9Confident199 Ų199137.5 Ų137.587%0.86570%0.697SS**PPolyproline II helixtrans-63.2136.8179-67.2-175.7178.91780109.1A77 K81A77-K79 PolarHBondContact O-N 3.42Å; K79-K81 PolarHBondContact O-N 3.5Å
80R77.9Confident81.9Confident239 Ų239146 Ų14690%0.90273%0.734SS**PPolyproline II helixtrans-56.2127.5173.6-75.4178.788173.89.4108.8K78K78-R80 PolarHBondContact O-N 3.23Å
81K83.4Confident81.9Confident202 Ų202152 Ų15288%0.87877%0.765SS**PPolyproline II helixtrans-60.8138.9174.4-68-176.4178-177.60109.4K79K79-K81 PolarHBondContact O-N 3.5Å
82K86.1Confident82.2Confident208 Ų208156.8 Ų156.890%0.90478%0.782SS**PPolyproline II helixtrans-62.7138.4173-71-176.6179.7178.60109.2S84K82-S84 PolarHBondContact O-N 3.46Å
83K87.3Confident82.8Confident161 Ų161158.5 Ų158.570%0.780%0.795SS**PPolyproline II helixtrans-68.7128.3172.6-66.5-179.3179.4179.70108.7Y85K83-Y85 HydrophobicContact CB-CE2 4.15Å
84S89.8Confident83.8Confident109 Ų109159.2 Ų159.276%0.76279%0.792SS**PPolyproline II helixtrans-101.6118.4169.5-174.70000108.5K82K82-S84 PolarHBondContact O-N 3.46Å
85Y88Confident85Confident186 Ų186161.6 Ų161.673%0.72980%0.801SS**  trans-94.8114.3177.5-61-78.3000108.8K83K83-Y85 HydrophobicContact CB-CE2 4.15Å
86T91.4Very high86.4Confident132 Ų132167.4 Ų167.481%0.8181%0.806SS**  trans-85.6-18.2-179.3530000113.3
87T91.9Very high87.5Confident105 Ų105173.6 Ų173.664%0.64481%0.811SS**SBendtrans-125142.8-17752.40000111.1
88P92.7Very high88.4Confident116 Ų116173.9 Ų173.975%0.75380%0.803SS**PPolyproline II helixtrans-66.3148.5177.128-34.1000110.6K90P88-K90 PolarHBondContact O-N 3.47Å
89K92.8Very high89.5Confident186 Ų186173 Ų17381%0.80980%0.799SS**PPolyproline II helixtrans-68.8122.8178.4-172.865177.1-177.30110.1
90K94.1Very high90.1Very high186 Ų186169.9 Ų169.981%0.80979%0.791SS**PPolyproline II helixtrans-70.3134.2176.2-63.1-176.3-179.6-178.20111.5P88 K92P88-K90 PolarHBondContact O-N 3.47Å; K90-K92 PolarHBondContact O-N 3.29Å
91N92.6Very high90.5Very high167 Ų167159.9 Ų159.989%0.89376%0.76SS**PPolyproline II helixtrans-67.3127170.3-75.1-29.6000110
92K94.1Very high90.6Very high178 Ų178154.3 Ų154.377%0.77474%0.743SS**PPolyproline II helixtrans-77.8138.4177.9-65.4-173.3178.3-1750110.3K90 K94K90-K92 PolarHBondContact O-N 3.29Å; K92-K94 PolarHBondContact O-N 3.48Å
93H94.2Very high90.7Very high166 Ų166149.5 Ų149.577%0.76973%0.726SS**PPolyproline II helixtrans-61.5128.7171.9175.6-97.8000110.3
94K92.8Very high90.7Very high173 Ų173149 Ų14975%0.75272%0.724SS**  trans-120.2126.7173.3-67.3-175.4177.9-177.80108.3K92 K96K92-K94 PolarHBondContact O-N 3.48Å; K94-K96 PolarHBondContact O-N 3.3Å
95R90.9Very high90.6Very high231 Ų231146.3 Ų146.387%0.87270%0.698SS**PPolyproline II helixtrans-66.2121.3176.1-70.9-176.7177.1175.7-0.6109.4
96K91.6Very high90.8Very high193 Ų193141.2 Ų141.284%0.83968%0.678SS**PPolyproline II helixtrans-100.4123171-66.1-177.2-179.7-179.40108.7K94K94-K96 PolarHBondContact O-N 3.3Å
97K89.3Confident90.8Very high206 Ų206140.5 Ų140.590%0.89666%0.663SS**PPolyproline II helixtrans-83.6122.2175.6-67.6-173.6179.7-177.90109.3
98V90.6Very high90.8Very high97 Ų97140.1 Ų140.159%0.58866%0.661SS**PPolyproline II helixtrans-88.8119171.1-179.90000107.7A101V98-A101 HydrophobicContact CB-CB 4.15Å; V98-A101 HydrophobicContact CG1-CB 4.28Å; V98-A101 WeakPolarHBondContact O-CB 3.48Å; V98-A101 PolarHBondContact O-N 3.37Å
99K92.5Very high90.8Very high192 Ų192137.9 Ų137.984%0.83564%0.642SS**THydrogen-bonded Turntrans-61.1139.6178.6-65.1-176.5-179.9-179.20109.6A101K99-A101 PolarHBondContact O-N 3.45Å; K99-A101 VanDerWaalsContact O-N 3.11Å
100L88.1Confident90.8Very high134 Ų134138.5 Ų138.570%0.70265%0.648SS**THydrogen-bonded Turntrans55.924.8177.5-57174000115.2V102 L103L100-V102 PolarHBondContact O-N 3.21Å; L100-V102 VanDerWaalsContact O-N 3.11Å; L100-L103 HydrophobicContact CB-CD1 4.17Å; L100-L103 HydrophobicContact CD1-CD1 4.38Å; L100-L103 HydrophobicContact CD2-CD1 4.02Å; L100-L103 HydrophobicContact CG-CD1 4.42Å; L100-L103 PolarHBondContact O-N 3.05Å; L100-L103 VanDerWaalsContact O-N 3.15Å
101A87.3Confident90.7Very high29 Ų29136.5 Ų136.524%0.2465%0.646CS.*G310 helixtrans-58.4-28.1-179.200000114V98 K99 K104V98-A101 HydrophobicContact CB-CB 4.15Å; V98-A101 HydrophobicContact CG1-CB 4.28Å; V98-A101 WeakPolarHBondContact O-CB 3.48Å; V98-A101 PolarHBondContact O-N 3.37Å; K99-A101 PolarHBondContact O-N 3.45Å; K99-A101 VanDerWaalsContact O-N 3.11Å; A101-K104 WeakPolarHBondContact O-CB 3.42Å; A101-K104 PolarHBondContact O-N 3.11Å
102V85.2Confident90.6Very high85 Ų85131 Ų13152%0.51563%0.63SS.*G310 helixtrans-70.4-32.1-179.3-179.80000112.3L100 K104 Y105 Y106L100-V102 PolarHBondContact O-N 3.21Å; L100-V102 VanDerWaalsContact O-N 3.11Å; V102-K104 PolarHBondContact O-N 3.11Å; V102-Y105 HydrophobicContact CG1-CD2 4.28Å; V102-Y105 WeakPolarHBondContact O-CB 3.45Å; V102-Y105 WeakPolarHBondContact O-CD2 3.44Å; V102-Y105 PolarHBondContact O-N 3.15Å; V102-Y106 HydrophobicContact CG1-CE2 4.22Å
103L87.4Confident90.6Very high108 Ų108129.5 Ų129.557%0.56562%0.623SS**G310 helixtrans-64.7-24.4179.3-67.6-178.3000112.3L100 Y105 Y106L100-L103 HydrophobicContact CB-CD1 4.17Å; L100-L103 HydrophobicContact CD1-CD1 4.38Å; L100-L103 HydrophobicContact CD2-CD1 4.02Å; L100-L103 HydrophobicContact CG-CD1 4.42Å; L100-L103 PolarHBondContact O-N 3.05Å; L100-L103 VanDerWaalsContact O-N 3.15Å; L103-Y105 PolarHBondContact O-N 2.83Å; L103-Y106 PolarHBondContact O-N 3.31Å; L103-Y106 VanDerWaalsContact O-N 3.14Å
104K86.8Confident90.3Very high151 Ų151127.1 Ų127.166%0.65762%0.615SS**G310 helixtrans-63.1-11.5174.5-60.6-173176.3-170.70113.6A101 V102A101-K104 WeakPolarHBondContact O-CB 3.42Å; A101-K104 PolarHBondContact O-N 3.11Å; V102-K104 PolarHBondContact O-N 3.11Å
105Y89.4Confident90.2Very high51 Ų51121 Ų12120%0.259%0.593CS.*G310 helixtrans-93.3-2.6-179.5-48.3-26.4000112.6V102 L103 L117 R118 F131V102-Y105 HydrophobicContact CG1-CD2 4.28Å; V102-Y105 WeakPolarHBondContact O-CB 3.45Å; V102-Y105 WeakPolarHBondContact O-CD2 3.44Å; V102-Y105 PolarHBondContact O-N 3.15Å; L103-Y105 PolarHBondContact O-N 2.83Å; Y105-L117 PolarHBondContact O-N 3.13Å; Y105-R118 HydrophobicContact CD1-CG 4.23Å; Y105-R118 HydrophobicContact CG-CG 4.4Å; Y105-R118 PolarHBondContact OH-NH1 3.4Å; Y105-R118 VanDerWaalsContact OH-NH1 3.16Å; Y105-F131 HydrophobicContact CD2-CB 4.3Å; Y105-F131 AromaticContact CD2-CD2 3.78Å; Y105-F131 HydrophobicContact CD2-CD2 3.78Å; Y105-F131 HydrophobicContact CD2-CE2 4.44Å; Y105-F131 HydrophobicContact CD2-CG 4.15Å
106Y90.4Very high90.1Very high79 Ų79116.6 Ų116.631%0.3158%0.577SS.*EExtended strand (participates in β ladder)trans-118.6142.9178.5-60.8-87000109.6V102 L103 I114 S115 R116 F131V102-Y106 HydrophobicContact CG1-CE2 4.22Å; L103-Y106 PolarHBondContact O-N 3.31Å; L103-Y106 VanDerWaalsContact O-N 3.14Å; Y106-I114 HydrophobicContact CD1-CG2 3.71Å; Y106-I114 HydrophobicContact CG-CG2 4.38Å; Y106-S115 CarbonylContact C-O 3.59Å; Y106-S115 WeakPolarHBondContact CA-O 3.42Å; Y106-R116 HydrophobicContact CD1-CG 4.04Å; Y106-R116 HydrophobicContact CE1-CG 3.9Å; Y106-F131 HydrophobicContact CE1-CZ 4Å; Y106-F131 HydrophobicContact CE2-CE2 4.04Å; Y106-F131 HydrophobicContact CE2-CZ 4.19Å; Y106-F131 AromaticContact CZ-CE2 3.75Å; Y106-F131 AromaticContact CZ-CZ 3.56Å; Y106-F131 VanDerWaalsContact OH-CE2 3.3Å; Y106-F131 WeakPolarHBondContact OH-CE2 3.4Å; Y106-F131 VanDerWaalsContact OH-CZ 3.26Å; Y106-F131 WeakPolarHBondContact OH-CZ 3.4Å
107K91.7Very high90Very high117 Ų117112.6 Ų112.651%0.50956%0.564SS.*EExtended strand (participates in β ladder)trans-120.1131.8169.2-179.4-176.9178.2-169.30107.6I114 S115 L117K107-I114 WeakPolarHBondContact O-CA 3.34Å; K107-S115 PolarHBondContact N-O 3.28Å; K107-S115 PolarHBondContact O-N 3.04Å; K107-S115 PolarHBondContact O-OG 3.42Å; K107-L117 HydrophobicContact CB-CD1 4.29Å; K107-L117 HydrophobicContact CB-CD2 4.16Å; K107-L117 HydrophobicContact CB-CG 4.24Å
108V92.5Very high90Very high98 Ų98106.4 Ų106.459%0.59454%0.535SS*.EExtended strand (participates in β ladder)trans-104.7125176.5-171.70000107.1K113 I114V108-K113 WeakPolarHBondContact CA-O 3.42Å; V108-I114 HydrophobicContact CG2-CG1 4.36Å
109D92.9Very high89.9Confident68 Ų68108 Ų10836%0.36453%0.53SS..  trans-83.1164.8175-61.1-35.9000110.4N111 G112 K113D109-N111 PolarHBondContact O-N 2.8Å; D109-N111 VanDerWaalsContact O-N 3.11Å; D109-G112 PolarHBondContact O-N 3.39Å; D109-K113 PolarHBondContact N-O 2.99Å
110E92.4Very high89.8Confident200 Ų200101.5 Ų101.594%0.93550%0.503SS*.THydrogen-bonded Turntrans-57.7-29.1-178-65.9174.5-17900113.2G112E110-G112 PolarHBondContact O-N 3.43Å
111N92.6Very high89.9Confident143 Ų14395.6 Ų95.677%0.76547%0.473SS*.THydrogen-bonded Turntrans-82.58176.5-62.9-38.6000113.6D109 K113D109-N111 PolarHBondContact O-N 2.8Å; D109-N111 VanDerWaalsContact O-N 3.11Å; N111-K113 VanDerWaalsContact C-N 3.26Å; N111-K113 PolarHBondContact O-N 3.3Å
112G90.4Very high90Very high53 Ų5397.3 Ų97.355%0.54648%0.482SS..SBendtrans75.47.5-178.600000115D109 E110D109-G112 PolarHBondContact O-N 3.39Å; E110-G112 PolarHBondContact O-N 3.43Å
113K92.9Very high90.2Very high146 Ų14694.8 Ų94.864%0.63547%0.467SS*.  trans-74.1138.4173.9-66.3-176.7-178.1177.90110V108 D109 N111V108-K113 WeakPolarHBondContact CA-O 3.42Å; D109-K113 PolarHBondContact N-O 2.99Å; N111-K113 VanDerWaalsContact C-N 3.26Å; N111-K113 PolarHBondContact O-N 3.3Å
114I89.7Confident90Very high116 Ų11697.6 Ų97.660%0.59548%0.483SS*.EExtended strand (participates in β ladder)trans-105.4123.1-178.9-58.3172.5000109.3Y106 K107 V108Y106-I114 HydrophobicContact CD1-CG2 3.71Å; Y106-I114 HydrophobicContact CG-CG2 4.38Å; K107-I114 WeakPolarHBondContact O-CA 3.34Å; V108-I114 HydrophobicContact CG2-CG1 4.36Å
115S89.4Confident90Very high43 Ų4397.5 Ų97.530%0.30149%0.485SS..EExtended strand (participates in β ladder)trans-108.7143.1171.155.20000110.9Y106 K107Y106-S115 CarbonylContact C-O 3.59Å; Y106-S115 WeakPolarHBondContact CA-O 3.42Å; K107-S115 PolarHBondContact N-O 3.28Å; K107-S115 PolarHBondContact O-N 3.04Å; K107-S115 PolarHBondContact O-OG 3.42Å
116R89.3Confident89.7Confident140 Ų14095.3 Ų95.353%0.52848%0.477SS..EExtended strand (participates in β ladder)trans-95130.1178.2-63.5170.3-175.4172.6-7.9109.3Y106 E120 F131Y106-R116 HydrophobicContact CD1-CG 4.04Å; Y106-R116 HydrophobicContact CE1-CG 3.9Å; R116-E120 IonicContact CZ-OE1 3.75Å; R116-E120 IonicContact CZ-OE2 2.84Å; R116-E120 IonicContact NE-OE1 3.72Å; R116-E120 IonicContact NH1-OE1 3.14Å; R116-E120 PolarHBondContact NH1-OE1 2.87Å; R116-E120 IonicContact NH1-OE2 3.78Å; R116-E120 PolarHBondContact NH1-OE2 3.47Å; R116-E120 IonicContact NH2-OE1 2.89Å; R116-F131 HydrophobicContact CB-CE1 4.39Å; R116-F131 HydrophobicContact CG-CE1 4.34Å
117L88.3Confident89.2Confident108 Ų10893.8 Ų93.857%0.56549%0.485SS*.SBendtrans-91.3-9-179.7-61.3177.1000113.2Y105 K107Y105-L117 PolarHBondContact O-N 3.13Å; K107-L117 HydrophobicContact CB-CD1 4.29Å; K107-L117 HydrophobicContact CB-CD2 4.16Å; K107-L117 HydrophobicContact CB-CG 4.24Å
118R89.6Confident88.8Confident76 Ų7692.7 Ų92.729%0.28750%0.498SS..SBendtrans-126.5149.6178.4-72.5-169.6174.2-179.3-1.8111.7Y105 F131Y105-R118 HydrophobicContact CD1-CG 4.23Å; Y105-R118 HydrophobicContact CG-CG 4.4Å; Y105-R118 PolarHBondContact OH-NH1 3.4Å; Y105-R118 VanDerWaalsContact OH-NH1 3.16Å; R118-F131 HydrophobicContact CB-CB 4.05Å; R118-F131 HydrophobicContact CB-CD1 3.83Å; R118-F131 HydrophobicContact CB-CG 4.21Å; R118-F131 WeakPolarHBondContact O-CD1 3.44Å
119R88.4Confident88.4Confident131 Ų13189.8 Ų89.849%0.49449%0.488SS..PPolyproline II helixtrans-70.3135.2174.7-170.6178.1-177.6176.72110.8F131 M132R119-F131 WeakPolarHBondContact O-CA 3.49Å; R119-M132 PolarHBondContact O-N 3.43Å
120E90.3Very high88.2Confident56 Ų5688.2 Ų88.226%0.26248%0.481SS..BIsolated β-bridgetrans-77.4146.4170-68.3-175.2149.700110.7R116 G129 V130 F131R116-E120 IonicContact CZ-OE1 3.75Å; R116-E120 IonicContact CZ-OE2 2.84Å; R116-E120 IonicContact NE-OE1 3.72Å; R116-E120 IonicContact NH1-OE1 3.14Å; R116-E120 PolarHBondContact NH1-OE1 2.87Å; R116-E120 IonicContact NH1-OE2 3.78Å; R116-E120 PolarHBondContact NH1-OE2 3.47Å; R116-E120 IonicContact NH2-OE1 2.89Å; E120-G129 PolarHBondContact OE1-N 2.79Å; E120-V130 WeakPolarHBondContact CA-O 3.44Å; E120-F131 HydrophobicContact CG-CD1 4.01Å; E120-F131 HydrophobicContact CG-CE1 3.76Å
121C90.9Very high88.2Confident9 Ų980 Ų806%0.06144%0.442CS..PPolyproline II helixtrans-69.7128.2176.7-172.70000109.8S123 C126 V130 M132 C141 C144C121-S123 VanDerWaalsContact C-N 3.28Å; C121-S123 PolarHBondContact O-N 3.25Å; C121-C126 HydrophobicContact CB-CB 3.72Å; C121-V130 HydrophobicContact CB-CG1 4.12Å; C121-V130 PolarHBondContact N-O 2.92Å; C121-M132 HydrophobicContact CB-CG 4.01Å; C121-C141 HydrophobicContact CB-CB 4.27Å; C121-C144 PolarHBondContact SG-SG 2.83Å
122P89.8Confident88.2Confident66 Ų6673.1 Ų73.143%0.42941%0.406SS..  trans-83.90.1-178.733.7-35.9000113.9L146 Y148P122-L146 HydrophobicContact CG-CD2 3.99Å; P122-Y148 HydrophobicContact CG-CE2 3.86Å; P122-Y148 WeakPolarHBondContact CG-OH 3.13Å
123S88.3Confident88.3Confident31 Ų3172 Ų7222%0.21739%0.391CS..  trans-70.9134.3179.7172.20000110C121 E125 C126C121-S123 VanDerWaalsContact C-N 3.28Å; C121-S123 PolarHBondContact O-N 3.25Å; S123-E125 PolarHBondContact O-N 2.78Å; S123-E125 VanDerWaalsContact O-N 3.13Å; S123-C126 CarbonylContact O-C 3.42Å; S123-C126 WeakPolarHBondContact O-CA 3.41Å; S123-C126 WeakPolarHBondContact O-CB 3.33Å; S123-C126 PolarHBondContact O-N 3.16Å; S123-C126 VanDerWaalsContact O-O 3.1Å
124D84.7Confident88.1Confident167 Ų16767.9 Ų67.989%0.89338%0.381SS*.THydrogen-bonded Turntrans-60.3-25.5-180-60.1-39.8000112.9C126D124-C126 PolarHBondContact O-N 3.14Å
125E85.1Confident88.2Confident149 Ų14966.5 Ų66.570%0.69637%0.371SS*.THydrogen-bonded Turntrans-72.1-18.7173.7-58.4-175.8169.900112.9S123 K143S123-E125 PolarHBondContact O-N 2.78Å; S123-E125 VanDerWaalsContact O-N 3.13Å; E125-K143 PolarHBondContact O-NZ 3.06Å
126C84.7Confident88.2Confident6 Ų674.1 Ų74.14%0.04140%0.4CS..SBendtrans-107.788.7180-66.40000110.1C121 S123 D124 V130 C144C121-C126 HydrophobicContact CB-CB 3.72Å; S123-C126 CarbonylContact O-C 3.42Å; S123-C126 WeakPolarHBondContact O-CA 3.41Å; S123-C126 WeakPolarHBondContact O-CB 3.33Å; S123-C126 PolarHBondContact O-N 3.16Å; S123-C126 VanDerWaalsContact O-O 3.1Å; D124-C126 PolarHBondContact O-N 3.14Å; C126-V130 HydrophobicContact CB-CB 4.1Å; C126-V130 HydrophobicContact CB-CG1 4.05Å; C126-V130 HydrophobicContact CB-CG2 4.31Å; C126-C144 VanDerWaalsContact SG-CB 3.5Å; C126-C144 PolarHBondContact SG-SG 2.82Å
127G79.9Confident88.2Confident46 Ų4671 Ų7147%0.47439%0.393SS..  trans-61.8176.4174.200000114.8V130G127-V130 WeakPolarHBondContact O-CG2 3.48Å; G127-V130 PolarHBondContact O-N 3.45Å
128A82.8Confident88.4Confident95 Ų9570.7 Ų70.779%0.78539%0.385SS*.THydrogen-bonded Turntrans-51.3140.2-179.600000112.7
129G83Confident88.5Confident37 Ų3768.1 Ų68.138%0.38138%0.376SS..THydrogen-bonded Turntrans87.1-1.4-17700000115.8E120 F131E120-G129 PolarHBondContact OE1-N 2.79Å; G129-F131 WeakPolarHBondContact O-CD2 3.26Å; G129-F131 WeakPolarHBondContact O-CE2 3.3Å; G129-F131 PolarHBondContact O-N 3.33Å
130V90.3Very high88.8Confident35 Ų3565.3 Ų65.321%0.21237%0.366CS..  trans-85.3102.8168.2-179.30000109.8E120 C121 C126 G127 K143E120-V130 WeakPolarHBondContact CA-O 3.44Å; C121-V130 HydrophobicContact CB-CG1 4.12Å; C121-V130 PolarHBondContact N-O 2.92Å; C126-V130 HydrophobicContact CB-CB 4.1Å; C126-V130 HydrophobicContact CB-CG1 4.05Å; C126-V130 HydrophobicContact CB-CG2 4.31Å; G127-V130 WeakPolarHBondContact O-CG2 3.48Å; G127-V130 PolarHBondContact O-N 3.45Å; V130-K143 HydrophobicContact CG1-CB 4.13Å; V130-K143 HydrophobicContact CG1-CD 4.48Å; V130-K143 HydrophobicContact CG2-CD 3.98Å
131F91.9Very high88.9Confident26 Ų2662.7 Ų62.711%0.11435%0.353CS..BIsolated β-bridgetrans-88.3135.6178.7-62.3-76.1000112.3Y105 Y106 R116 R118 R119 E120 G129Y105-F131 HydrophobicContact CD2-CB 4.3Å; Y105-F131 AromaticContact CD2-CD2 3.78Å; Y105-F131 HydrophobicContact CD2-CD2 3.78Å; Y105-F131 HydrophobicContact CD2-CE2 4.44Å; Y105-F131 HydrophobicContact CD2-CG 4.15Å; Y106-F131 HydrophobicContact CE1-CZ 4Å; Y106-F131 HydrophobicContact CE2-CE2 4.04Å; Y106-F131 HydrophobicContact CE2-CZ 4.19Å; Y106-F131 AromaticContact CZ-CE2 3.75Å; Y106-F131 AromaticContact CZ-CZ 3.56Å; Y106-F131 VanDerWaalsContact OH-CE2 3.3Å; Y106-F131 WeakPolarHBondContact OH-CE2 3.4Å; Y106-F131 VanDerWaalsContact OH-CZ 3.26Å; Y106-F131 WeakPolarHBondContact OH-CZ 3.4Å; R116-F131 HydrophobicContact CB-CE1 4.39Å; R116-F131 HydrophobicContact CG-CE1 4.34Å; R118-F131 HydrophobicContact CB-CB 4.05Å; R118-F131 HydrophobicContact CB-CD1 3.83Å; R118-F131 HydrophobicContact CB-CG 4.21Å; R118-F131 WeakPolarHBondContact O-CD1 3.44Å; R119-F131 WeakPolarHBondContact O-CA 3.49Å; E120-F131 HydrophobicContact CG-CD1 4.01Å; E120-F131 HydrophobicContact CG-CE1 3.76Å; G129-F131 WeakPolarHBondContact O-CD2 3.26Å; G129-F131 WeakPolarHBondContact O-CE2 3.3Å; G129-F131 PolarHBondContact O-N 3.33Å
132M92.5Very high88.9Confident0 Ų065.2 Ų65.20%038%0.381CS..PPolyproline II helixtrans-71.8138.5170.3-59.3-170.279.800110.2R119 C121 S134 H139 C141 L146 Y148R119-M132 PolarHBondContact O-N 3.43Å; C121-M132 HydrophobicContact CB-CG 4.01Å; M132-S134 PolarHBondContact O-N 2.82Å; M132-H139 HydrophobicContact CB-CB 4.16Å; M132-H139 HydrophobicContact CE-CB 3.98Å; M132-H139 WeakPolarHBondContact CE-O 3.45Å; M132-H139 HydrophobicContact SD-CB 4.21Å; M132-C141 HydrophobicContact CE-CB 4.17Å; M132-C141 HydrophobicContact CG-CB 4.34Å; M132-L146 HydrophobicContact CE-CG 4.49Å; M132-L146 WeakPolarHBondContact CE-O 3.45Å; M132-Y148 HydrophobicContact CE-CD2 3.62Å; M132-Y148 HydrophobicContact CE-CE2 4.06Å; M132-Y148 HydrophobicContact SD-CD2 3.77Å; M132-Y148 HydrophobicContact SD-CE2 3.97Å
133A91.4Very high89Confident30 Ų3068.3 Ų68.325%0.24839%0.388CS..EExtended strand (participates in β ladder)trans-74.4122.6172.400000109.8H135 H139 Y140A133-H135 PolarHBondContact O-N 2.85Å; A133-H139 CarbonylContact O-C 3.42Å; A133-H139 WeakPolarHBondContact O-CA 3.29Å; A133-Y140 WeakPolarHBondContact CB-O 3.46Å; A133-Y140 PolarHBondContact N-O 3.34Å; A133-Y140 PolarHBondContact O-N 2.85Å
134S90.7Very high89.2Confident59 Ų5968.4 Ų68.441%0.41339%0.388SS..EExtended strand (participates in β ladder)trans-81106.8173.2-47.50000109.5M132 H139M132-S134 PolarHBondContact O-N 2.82Å; S134-H139 PolarHBondContact OG-NE2 3.32Å
135H90.5Very high89.6Confident86 Ų8664 Ų6440%0.39837%0.369SS..  trans-93.4172.8165.2-65.3-87000109.4A133 D137 R138A133-H135 PolarHBondContact O-N 2.85Å; H135-D137 VanDerWaalsContact C-N 3.3Å; H135-D137 PolarHBondContact O-N 2.75Å; H135-R138 CarbonylContact C-O 3.59Å; H135-R138 WeakPolarHBondContact CA-O 3.34Å; H135-R138 HydrophobicContact CB-CG 3.76Å; H135-R138 WeakPolarHBondContact CB-O 3.47Å; H135-R138 PolarHBondContact N-O 2.9Å
136F89.9Confident89.9Confident204 Ų20459.5 Ų59.590%0.89535%0.35SS*.SBendtrans-58.7-41.3-178.4177.1-103.9000112.8
137D89.9Confident90.3Very high74 Ų7462 Ų6240%0.39637%0.365SS..SBendtrans-110.3-12.5-171.960.6-34.5000113.6H135 F150H135-D137 VanDerWaalsContact C-N 3.3Å; H135-D137 PolarHBondContact O-N 2.75Å; D137-F150 PolarHBondContact O-N 3.38Å
138R91.3Very high90.8Very high101 Ų10164 Ų6438%0.38136%0.359SS..EExtended strand (participates in β ladder)trans-152.7158.2-169.967-169.9-176.2-170-0.5114.5H135 T147 Y148H135-R138 CarbonylContact C-O 3.59Å; H135-R138 WeakPolarHBondContact CA-O 3.34Å; H135-R138 HydrophobicContact CB-CG 3.76Å; H135-R138 WeakPolarHBondContact CB-O 3.47Å; H135-R138 PolarHBondContact N-O 2.9Å; R138-T147 HydrophobicContact CB-CG2 4Å; R138-T147 HydrophobicContact CG-CG2 4.3Å; R138-Y148 CarbonylContact C-O 3.58Å; R138-Y148 WeakPolarHBondContact CA-O 3.38Å; R138-Y148 WeakPolarHBondContact CB-O 3.14Å
139H92.8Very high91Very high23 Ų2363.3 Ų63.311%0.10635%0.348CS..EExtended strand (participates in β ladder)trans-101.8128.8160.5-79.858.5000109.8M132 A133 S134 T147 Y148 F150M132-H139 HydrophobicContact CB-CB 4.16Å; M132-H139 HydrophobicContact CE-CB 3.98Å; M132-H139 WeakPolarHBondContact CE-O 3.45Å; M132-H139 HydrophobicContact SD-CB 4.21Å; A133-H139 CarbonylContact O-C 3.42Å; A133-H139 WeakPolarHBondContact O-CA 3.29Å; S134-H139 PolarHBondContact OG-NE2 3.32Å; H139-T147 CarbonylContact O-C 3.56Å; H139-T147 VanDerWaalsContact O-CA 3.29Å; H139-T147 WeakPolarHBondContact O-CA 3.47Å; H139-Y148 PolarHBondContact N-O 3.38Å; H139-Y148 PolarHBondContact O-N 3.5Å; H139-F150 AromaticContact CE1-CE2 3.16Å; H139-F150 WeakPolarHBondContact CE1-CE2 3.38Å; H139-F150 AromaticContact CE1-CZ 3.04Å; H139-F150 WeakPolarHBondContact CE1-CZ 3.16Å; H139-F150 AromaticContact CG-CZ 3.93Å; H139-F150 AromaticContact ND1-CE1 3.95Å; H139-F150 AromaticContact ND1-CE2 2.9Å; H139-F150 WeakPolarHBondContact ND1-CE2 3.33Å; H139-F150 AromaticContact ND1-CZ 2.83Å; H139-F150 WeakPolarHBondContact ND1-CZ 3.2Å
140Y93.9Very high90.9Very high72 Ų7267.3 Ų67.328%0.28236%0.355SS..EExtended strand (participates in β ladder)trans-124126-178.2174.1-108.1000111.4A133 C145 L146 T147A133-Y140 WeakPolarHBondContact CB-O 3.46Å; A133-Y140 PolarHBondContact N-O 3.34Å; A133-Y140 PolarHBondContact O-N 2.85Å; Y140-C145 HydrophobicContact CE2-CB 4.06Å; Y140-C145 PolarHBondContact OH-SG 2.91Å; Y140-L146 CarbonylContact C-O 3.59Å; Y140-L146 WeakPolarHBondContact CA-O 3.04Å; Y140-T147 WeakPolarHBondContact CD2-OG1 2.83Å
141C93.3Very high89.9Confident0 Ų071.5 Ų71.50%038%0.376CS..  trans-84.1118.2171.1-175.60000110.2C121 M132 K143 C145 L146C121-C141 HydrophobicContact CB-CB 4.27Å; M132-C141 HydrophobicContact CE-CB 4.17Å; M132-C141 HydrophobicContact CG-CB 4.34Å; C141-K143 PolarHBondContact O-N 2.87Å; C141-K143 PolarHBondContact SG-N 2.88Å; C141-C145 WeakPolarHBondContact O-CA 2.9Å; C141-C145 PolarHBondContact O-N 3.11Å; C141-L146 HydrophobicContact CB-CB 4.17Å; C141-L146 PolarHBondContact N-O 2.75Å
142G90.3Very high88.5Confident62 Ų6279.2 Ų79.264%0.63941%0.41SS*.THydrogen-bonded Turntrans-72.2-6.7176.600000115.3
143K91.3Very high87.1Confident132 Ų13284.5 Ų84.557%0.57444%0.444SS*.THydrogen-bonded Turntrans-98-58.6-179.1-170.8-176.4180-157.80112.1E125 V130 C141E125-K143 PolarHBondContact O-NZ 3.06Å; V130-K143 HydrophobicContact CG1-CB 4.13Å; V130-K143 HydrophobicContact CG1-CD 4.48Å; V130-K143 HydrophobicContact CG2-CD 3.98Å; C141-K143 PolarHBondContact O-N 2.87Å; C141-K143 PolarHBondContact SG-N 2.88Å
144C93.4Very high85.9Confident32 Ų3291.9 Ų91.922%0.21647%0.473CS..THydrogen-bonded Turntrans-98.34.6179.365.20000114C121 C126 L146C121-C144 PolarHBondContact SG-SG 2.83Å; C126-C144 VanDerWaalsContact SG-CB 3.5Å; C126-C144 PolarHBondContact SG-SG 2.82Å; C144-L146 PolarHBondContact O-N 3.31Å; C144-L146 VanDerWaalsContact SG-CB 3.54Å
145C93.1Very high84.6Confident75 Ų7597 Ų9751%0.50750%0.496SS..  trans61.99.9-178.8-59.40000115.8Y140 C141 T147Y140-C145 HydrophobicContact CE2-CB 4.06Å; Y140-C145 PolarHBondContact OH-SG 2.91Å; C141-C145 WeakPolarHBondContact O-CA 2.9Å; C141-C145 PolarHBondContact O-N 3.11Å; C145-T147 PolarHBondContact O-N 2.81Å; C145-T147 PolarHBondContact O-OG1 2.99Å
146L91.6Very high82.7Confident55 Ų55106 Ų10629%0.28853%0.534SS..  trans-60.1133.3177.2-174.169.1000111.2P122 M132 Y140 C141 C144 Y148P122-L146 HydrophobicContact CG-CD2 3.99Å; M132-L146 HydrophobicContact CE-CG 4.49Å; M132-L146 WeakPolarHBondContact CE-O 3.45Å; Y140-L146 CarbonylContact C-O 3.59Å; Y140-L146 WeakPolarHBondContact CA-O 3.04Å; C141-L146 HydrophobicContact CB-CB 4.17Å; C141-L146 PolarHBondContact N-O 2.75Å; C144-L146 PolarHBondContact O-N 3.31Å; C144-L146 VanDerWaalsContact SG-CB 3.54Å; L146-Y148 HydrophobicContact CD2-CE2 3.72Å; L146-Y148 HydrophobicContact CG-CE2 4.3Å
147T92.3Very high82.3Confident59 Ų59101.1 Ų101.136%0.36252%0.516SS..EExtended strand (participates in β ladder)trans-125.7128-178.5-52.90000110.8R138 H139 Y140 C145R138-T147 HydrophobicContact CB-CG2 4Å; R138-T147 HydrophobicContact CG-CG2 4.3Å; H139-T147 CarbonylContact O-C 3.56Å; H139-T147 VanDerWaalsContact O-CA 3.29Å; H139-T147 WeakPolarHBondContact O-CA 3.47Å; Y140-T147 WeakPolarHBondContact CD2-OG1 2.83Å; C145-T147 PolarHBondContact O-N 2.81Å; C145-T147 PolarHBondContact O-OG1 2.99Å
148Y89.9Confident81.9Confident86 Ų86102.5 Ų102.534%0.33752%0.522SS..EExtended strand (participates in β ladder)trans-112.7117.8168.3-69.1-61.9000109.3P122 M132 R138 H139 L146P122-Y148 HydrophobicContact CG-CE2 3.86Å; P122-Y148 WeakPolarHBondContact CG-OH 3.13Å; M132-Y148 HydrophobicContact CE-CD2 3.62Å; M132-Y148 HydrophobicContact CE-CE2 4.06Å; M132-Y148 HydrophobicContact SD-CD2 3.77Å; M132-Y148 HydrophobicContact SD-CE2 3.97Å; R138-Y148 CarbonylContact C-O 3.58Å; R138-Y148 WeakPolarHBondContact CA-O 3.38Å; R138-Y148 WeakPolarHBondContact CB-O 3.14Å; H139-Y148 PolarHBondContact N-O 3.38Å; H139-Y148 PolarHBondContact O-N 3.5Å; L146-Y148 HydrophobicContact CD2-CE2 3.72Å; L146-Y148 HydrophobicContact CG-CE2 4.3Å
149C88.2Confident81.4Confident82 Ų82102.6 Ų102.655%0.55453%0.53SS*.EExtended strand (participates in β ladder)trans-93.2139.3174.8-59.30000110.2
150F80.9Confident80.7Confident120 Ų120107.3 Ų107.353%0.52656%0.555SS.*SBendtrans-91.3-41.4-178.3-64.4-58.9000113.7D137 H139D137-F150 PolarHBondContact O-N 3.38Å; H139-F150 AromaticContact CE1-CE2 3.16Å; H139-F150 WeakPolarHBondContact CE1-CE2 3.38Å; H139-F150 AromaticContact CE1-CZ 3.04Å; H139-F150 WeakPolarHBondContact CE1-CZ 3.16Å; H139-F150 AromaticContact CG-CZ 3.93Å; H139-F150 AromaticContact ND1-CE1 3.95Å; H139-F150 AromaticContact ND1-CE2 2.9Å; H139-F150 WeakPolarHBondContact ND1-CE2 3.33Å; H139-F150 AromaticContact ND1-CZ 2.83Å; H139-F150 WeakPolarHBondContact ND1-CZ 3.2Å
151N68.1Low79.9Confident124 Ų124109.5 Ų109.566%0.66357%0.572SS**SBendtrans-105.2109.2175.4-66.1-13.9000106.4
152K62.6Low79Confident188 Ų188116.8 Ų116.882%0.81761%0.61SS**PPolyproline II helixtrans-64.1130.4158.2-71.8-178.4179.8178.80105.8E154K152-E154 PolarHBondContact O-N 3.19Å
153P64Low78.2Confident110 Ų110120.7 Ų120.771%0.71461%0.608SS**PPolyproline II helixtrans-55.2128163.625.1-29.9000106.3D155P153-D155 PolarHBondContact O-N 2.97Å; P153-D155 VanDerWaalsContact O-N 3.1Å
154E65.6Low77.2Confident186 Ų186119.8 Ų119.887%0.86961%0.611SS**PPolyproline II helixtrans-54.1120.1166.6-69.9177.2166.900106.3K152 K156K152-E154 PolarHBondContact O-N 3.19Å; E154-K156 PolarHBondContact O-N 3.1Å
155D63.3Low75.8Confident165 Ų165127.2 Ų127.288%0.88264%0.643SS**  trans-56.6110.7176.6-67.6-50.5000107.1P153P153-D155 PolarHBondContact O-N 2.97Å; P153-D155 VanDerWaalsContact O-N 3.1Å
156K50.6Low74.3Confident276 Ų276131.9 Ų131.9100%1.266%0.656SS**  trans-88.40171.4-85-171.6177.1-177.30110.3E154E154-K156 PolarHBondContact O-N 3.1Å

Retrieved 156 of 156 residues in 75.4 ms (Link to these results)