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40S ribosomal protein S21

Component of the small ribosomal subunit. The ribosome is a large ribonucleoprotein complex responsible for the synthesis of proteins in the cell.

AlphaFold DB , UniProt , Accession G5C8F1, Species HETGA (Heterocephalus glaber, Naked mole rat), Gene Rps21, Length 83 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
1M88.8Confident93.4Very high148 Ų148112.2 Ų112.273%0.72961%0.609SS**  0132.80-170.1166.6179.200106.6F8 V9 D10M1-F8 WeakPolarHBondContact O-CA 3.25Å; M1-V9 HydrophobicContact CB-CG2 4.27Å; M1-V9 HydrophobicContact CG-CG2 4.34Å; M1-V9 PolarHBondContact O-N 2.88Å; M1-V9 VanDerWaalsContact O-N 3.1Å; M1-D10 WeakPolarHBondContact CA-OD2 3.5Å; M1-D10 WeakPolarHBondContact CB-OD1 3.45Å; M1-D10 VanDerWaalsContact CB-OD2 3.27Å; M1-D10 WeakPolarHBondContact CB-OD2 3.46Å; M1-D10 PolarHBondContact N-OD2 2.91Å
2Q93.6Very high93.4Very high109 Ų109114.8 Ų114.851%0.50961%0.605SS.*BIsolated β-bridgetrans-109.3144.9176.3-73177.4-22.300109.2E7 F8Q2-E7 CarbonylContact C-O 3.53Å; Q2-E7 WeakPolarHBondContact CA-O 3.42Å; Q2-F8 HydrophobicContact CG-CD1 3.84Å; Q2-F8 HydrophobicContact CG-CE1 3.84Å; Q2-F8 HydrophobicContact CG-CG 4.25Å; Q2-F8 HydrophobicContact CG-CZ 4.24Å
3N93.6Very high93.5Very high56 Ų56115.5 Ų115.530%0.29962%0.616SS.*  trans-79.3177.5167.767.79.5000110.7A5 G6 E7 V9N3-A5 PolarHBondContact O-N 3.13Å; N3-A5 VanDerWaalsContact O-N 3.17Å; N3-A5 WeakPolarHBondContact OD1-CA 3.5Å; N3-A5 WeakPolarHBondContact OD1-CB 3.48Å; N3-A5 PolarHBondContact OD1-N 2.79Å; N3-A5 VanDerWaalsContact OD1-N 3.09Å; N3-G6 PolarHBondContact O-N 2.81Å; N3-G6 PolarHBondContact OD1-N 3.31Å; N3-G6 VanDerWaalsContact OD1-N 3.11Å; N3-E7 PolarHBondContact N-O 3.37Å; N3-E7 PolarHBondContact ND2-OE2 3.41Å; N3-E7 WeakPolarHBondContact OD1-CB 3.32Å; N3-E7 PolarHBondContact OD1-N 3.32Å; N3-V9 HydrophobicContact CB-CG1 4.01Å
4D95Very high93.6Very high184 Ų184110 Ų11098%0.98459%0.59SS**THydrogen-bonded Turntrans-64-18.7179.6-62-26.6000113.5G6D4-G6 VanDerWaalsContact C-N 3.31Å
5A94.9Very high93.9Very high81 Ų81109.8 Ų109.867%0.66958%0.578SS**THydrogen-bonded Turntrans-85.4-0.6173.500000113.4N3 E7N3-A5 PolarHBondContact O-N 3.13Å; N3-A5 VanDerWaalsContact O-N 3.17Å; N3-A5 WeakPolarHBondContact OD1-CA 3.5Å; N3-A5 WeakPolarHBondContact OD1-CB 3.48Å; N3-A5 PolarHBondContact OD1-N 2.79Å; N3-A5 VanDerWaalsContact OD1-N 3.09Å; A5-E7 HydrophobicContact CB-CG 4.33Å
6G93.2Very high94.1Very high40 Ų40111.3 Ų111.341%0.41258%0.578SS.*SBendtrans82.77.7-179.900000114.9N3 D4N3-G6 PolarHBondContact O-N 2.81Å; N3-G6 PolarHBondContact OD1-N 3.31Å; N3-G6 VanDerWaalsContact OD1-N 3.11Å; D4-G6 VanDerWaalsContact C-N 3.31Å
7E94.2Very high94.3Very high121 Ų121104.7 Ų104.757%0.56554%0.544SS*.  trans-85138.4-178.2-54.7174.3139.700111.1Q2 N3 A5 V9Q2-E7 CarbonylContact C-O 3.53Å; Q2-E7 WeakPolarHBondContact CA-O 3.42Å; N3-E7 PolarHBondContact N-O 3.37Å; N3-E7 PolarHBondContact ND2-OE2 3.41Å; N3-E7 WeakPolarHBondContact OD1-CB 3.32Å; N3-E7 PolarHBondContact OD1-N 3.32Å; A5-E7 HydrophobicContact CB-CG 4.33Å; E7-V9 PolarHBondContact O-N 2.83Å
8F92.4Very high94.5Very high161 Ų161101.2 Ų101.271%0.70653%0.53SS*.BIsolated β-bridgetrans-74.3117.2174.4-71.6-80.8000110.7M1 Q2M1-F8 WeakPolarHBondContact O-CA 3.25Å; Q2-F8 HydrophobicContact CG-CD1 3.84Å; Q2-F8 HydrophobicContact CG-CE1 3.84Å; Q2-F8 HydrophobicContact CG-CG 4.25Å; Q2-F8 HydrophobicContact CG-CZ 4.24Å
9V95Very high94.7Very high80 Ų8096.8 Ų96.849%0.48551%0.51SS..  trans-104.4-5.4-176.6-64.50000114M1 N3 E7M1-V9 HydrophobicContact CB-CG2 4.27Å; M1-V9 HydrophobicContact CG-CG2 4.34Å; M1-V9 PolarHBondContact O-N 2.88Å; M1-V9 VanDerWaalsContact O-N 3.1Å; N3-V9 HydrophobicContact CB-CG1 4.01Å; E7-V9 PolarHBondContact O-N 2.83Å
10D93.1Very high94.8Very high80 Ų8094.4 Ų94.443%0.42850%0.501SS..  trans-76.5141.9179.3-75.8-23.5000111.9M1 Y12M1-D10 WeakPolarHBondContact CA-OD2 3.5Å; M1-D10 WeakPolarHBondContact CB-OD1 3.45Å; M1-D10 VanDerWaalsContact CB-OD2 3.27Å; M1-D10 WeakPolarHBondContact CB-OD2 3.46Å; M1-D10 PolarHBondContact N-OD2 2.91Å; D10-Y12 VanDerWaalsContact C-N 3.34Å; D10-Y12 PolarHBondContact O-N 3.21Å
11L93.2Very high94.9Very high174 Ų17495.6 Ų95.691%0.91151%0.508SS*.SBendtrans-65.8-36.7173.9-74.984.6000112.4
12Y93.8Very high95.2Very high143 Ų14395.8 Ų95.856%0.56150%0.5SS*.  trans-161.7156.2176.772.8-76.5000110.7D10 P14D10-Y12 VanDerWaalsContact C-N 3.34Å; D10-Y12 PolarHBondContact O-N 3.21Å; Y12-P14 HydrophobicContact CD2-CB 4.37Å; Y12-P14 HydrophobicContact CE2-CB 3.76Å
13V94.1Very high95.4Very high124 Ų12495.6 Ų95.675%0.75250%0.502SS*.  trans-98.2116170.5-178.20000108.5
14P96.2Very high95.6Very high39 Ų3993.4 Ų93.425%0.25349%0.49SS..  trans-69.7156.2-176.928.2-35.2000112.1Y12 I23Y12-P14 HydrophobicContact CD2-CB 4.37Å; Y12-P14 HydrophobicContact CE2-CB 3.76Å; P14-I23 HydrophobicContact CB-CG2 3.62Å; P14-I23 HydrophobicContact CG-CD1 4.47Å; P14-I23 HydrophobicContact CG-CG2 3.4Å
15R97.1Very high95.7Very high107 Ų10786.5 Ų86.540%0.40446%0.462SS..  trans-65.1147.8172.7-64.8-178.3-63.8151.87.8110.3I24R15-I24 HydrophobicContact CB-CB 4.46Å; R15-I24 HydrophobicContact CB-CD1 4.25Å; R15-I24 PolarHBondContact O-N 3.47Å
16K97.8Very high95.8Very high133 Ų13386.3 Ų86.358%0.57846%0.461SS*.BIsolated β-bridgetrans-106.4141.9170.4-73.9-175.5-74.8177.90110.1S18 I23K16-S18 PolarHBondContact O-N 2.87Å; K16-I23 HydrophobicContact CG-CG1 4.31Å
17C97.8Very high96Very high0 Ų092.7 Ų92.70%048%0.477CS..  trans-62.6124.8170.9-178.70000109.6A19 S20 N21 R22 I24 A54 C56C17-A19 PolarHBondContact O-N 3.38Å; C17-S20 PolarHBondContact SG-OG 3.13Å; C17-N21 VanDerWaalsContact O-CA 3.23Å; C17-N21 WeakPolarHBondContact O-CA 3.48Å; C17-N21 PolarHBondContact O-N 3.32Å; C17-R22 WeakPolarHBondContact CB-O 3.44Å; C17-R22 PolarHBondContact N-O 2.89Å; C17-I24 HydrophobicContact CB-CG1 4.48Å; C17-A54 CarbonylContact C-O 3.57Å; C17-A54 WeakPolarHBondContact CA-O 3.45Å; C17-C56 HydrophobicContact CB-CB 3.92Å; C17-C56 PolarHBondContact SG-N 3.18Å; C17-C56 VanDerWaalsContact SG-N 3.39Å; C17-C56 VanDerWaalsContact SG-SG 3.6Å
18S97.9Very high96.1Very high42 Ų4289 Ų8929%0.29446%0.461SS..THydrogen-bonded Turntrans-62.3-28.6178.8-55.40000112.4K16 A54K16-S18 PolarHBondContact O-N 2.87Å; S18-A54 PolarHBondContact N-O 3.16Å; S18-A54 PolarHBondContact OG-N 3.2Å; S18-A54 PolarHBondContact OG-O 3.14Å
19A97.2Very high96.4Very high18 Ų1888.8 Ų88.815%0.14946%0.462CS..THydrogen-bonded Turntrans-83.7-46.1-177.700000113.1C17 I55C17-A19 PolarHBondContact O-N 3.38Å; A19-I55 HydrophobicContact CB-CD1 4.03Å
20S96.7Very high96.5Very high47 Ų4787.2 Ų87.233%0.32946%0.457SS..THydrogen-bonded Turntrans-114.3-1.5-169.362.40000114.6C17 R22C17-S20 PolarHBondContact SG-OG 3.13Å; S20-R22 PolarHBondContact O-N 3.03Å
21N97.1Very high96.7Very high120 Ų12084.5 Ų84.564%0.64245%0.445SS*.  trans57.46.3-172.9-64.1-49.5000115.3C17C17-N21 VanDerWaalsContact O-CA 3.23Å; C17-N21 WeakPolarHBondContact O-CA 3.48Å; C17-N21 PolarHBondContact O-N 3.32Å
22R96.1Very high96.9Very high152 Ų15278.5 Ų78.557%0.57441%0.413SS*.  trans-67.1138.4174.8-171.2180-66177.60.2110C17 S20C17-R22 WeakPolarHBondContact CB-O 3.44Å; C17-R22 PolarHBondContact N-O 2.89Å; S20-R22 PolarHBondContact O-N 3.03Å
23I97.3Very high97.1Very high106 Ų10676.8 Ų76.854%0.54441%0.41SS..BIsolated β-bridgetrans-62.7134.7172.5-65174.5000109.9P14 K16P14-I23 HydrophobicContact CB-CG2 3.62Å; P14-I23 HydrophobicContact CG-CD1 4.47Å; P14-I23 HydrophobicContact CG-CG2 3.4Å; K16-I23 HydrophobicContact CG-CG1 4.31Å
24I97.8Very high97.3Very high9 Ų973.7 Ų73.75%0.04639%0.388CS..  trans-88.2112.9173.2-61.1174000107.8R15 C17 D28 S31 A54 C56R15-I24 HydrophobicContact CB-CB 4.46Å; R15-I24 HydrophobicContact CB-CD1 4.25Å; R15-I24 PolarHBondContact O-N 3.47Å; C17-I24 HydrophobicContact CB-CG1 4.48Å; I24-D28 HydrophobicContact CG2-CB 4.3Å; I24-S31 WeakPolarHBondContact CG2-OG 3.31Å; I24-A54 HydrophobicContact CD1-CB 3.85Å; I24-C56 HydrophobicContact CG1-CB 4.02Å
25G96.9Very high97.3Very high39 Ų3975.9 Ų75.940%0.40240%0.398SS..  trans-70.6154.3179.100000112.7K27 D28G25-K27 PolarHBondContact O-N 3.49Å; G25-D28 WeakPolarHBondContact O-CB 3.41Å; G25-D28 PolarHBondContact O-N 3.42Å
26A96.8Very high97.4Very high78 Ų7872.5 Ų72.565%0.64539%0.389SS*.THydrogen-bonded Turntrans-62.7-23.8-178.200000114.2
27K97.6Very high97.3Very high173 Ų17368.6 Ų68.675%0.75238%0.381SS*.THydrogen-bonded Turntrans-101.97.7177.1-63-62.2-172.81790113.7G25 H29G25-K27 PolarHBondContact O-N 3.49Å; K27-H29 PolarHBondContact O-CD2 2.6Å; K27-H29 PolarHBondContact O-N 3.12Å
28D97.2Very high97.3Very high44 Ų4472.4 Ų72.424%0.23540%0.399CS..  trans-77.379.1171.4-1755.1000110I24 G25 A30 S31 G57I24-D28 HydrophobicContact CG2-CB 4.3Å; G25-D28 WeakPolarHBondContact O-CB 3.41Å; G25-D28 PolarHBondContact O-N 3.42Å; D28-A30 PolarHBondContact O-N 2.89Å; D28-A30 PolarHBondContact OD1-N 2.83Å; D28-S31 WeakPolarHBondContact O-CB 3.46Å; D28-S31 PolarHBondContact O-N 3.08Å; D28-S31 VanDerWaalsContact O-N 3.1Å; D28-S31 PolarHBondContact O-OG 2.77Å; D28-S31 PolarHBondContact OD1-N 3.36Å; D28-S31 VanDerWaalsContact OD1-N 3.11Å; D28-G57 PolarHBondContact OD2-N 2.77Å
29H97.4Very high97.2Very high156 Ų15674.5 Ų74.572%0.72241%0.41SS*.THydrogen-bonded Turntrans-71.1-11.8177.2-60.1-62.8000113.2K27 S31K27-H29 PolarHBondContact O-CD2 2.6Å; K27-H29 PolarHBondContact O-N 3.12Å; H29-S31 VanDerWaalsContact C-N 3.35Å
30A97.8Very high97.1Very high47 Ų4776.6 Ų76.639%0.38842%0.419SS..THydrogen-bonded Turntrans-85-10171.500000111.8D28 R60D28-A30 PolarHBondContact O-N 2.89Å; D28-A30 PolarHBondContact OD1-N 2.83Å; A30-R60 WeakPolarHBondContact O-CD 3.46Å; A30-R60 PolarHBondContact O-NH1 2.82Å
31S97.4Very high97Very high23 Ų2384.3 Ų84.316%0.16145%0.447CS..  trans-66.6148.4173.667.50000112I24 D28 H29 I55I24-S31 WeakPolarHBondContact CG2-OG 3.31Å; D28-S31 WeakPolarHBondContact O-CB 3.46Å; D28-S31 PolarHBondContact O-N 3.08Å; D28-S31 VanDerWaalsContact O-N 3.1Å; D28-S31 PolarHBondContact O-OG 2.77Å; D28-S31 PolarHBondContact OD1-N 3.36Å; D28-S31 VanDerWaalsContact OD1-N 3.11Å; H29-S31 VanDerWaalsContact C-N 3.35Å; S31-I55 WeakPolarHBondContact CA-O 3.29Å
32I97.6Very high96.9Very high49 Ų4985.1 Ų85.125%0.25146%0.455SS..EExtended strand (participates in β ladder)trans-126.7157.8174.462.5167.4000111.2A54 I55 R60I32-A54 WeakPolarHBondContact O-CA 3.23Å; I32-I55 HydrophobicContact CG1-CB 3.97Å; I32-I55 PolarHBondContact N-O 2.93Å; I32-I55 PolarHBondContact O-N 2.88Å; I32-R60 VanDerWaalsContact CG2-CZ 3.43Å
33Q97.6Very high96.9Very high107 Ų10781.8 Ų81.850%0.545%0.452SS..EExtended strand (participates in β ladder)trans-122.2122163.1-172.9168.6-37.100107.6T52 Y53Q33-T52 HydrophobicContact CG-CG2 3.36Å; Q33-Y53 CarbonylContact C-O 3.5Å; Q33-Y53 WeakPolarHBondContact CA-O 3.37Å
34M97.2Very high96.8Very high58 Ų5879.3 Ų79.329%0.28645%0.452SS..EExtended strand (participates in β ladder)trans-112.4129.6-178.6-170.7-178.870.900109.2V36 T52 Y53 I69M34-V36 HydrophobicContact CE-CG2 3.77Å; M34-T52 WeakPolarHBondContact O-CA 3.44Å; M34-Y53 HydrophobicContact CE-CD2 4.02Å; M34-Y53 PolarHBondContact N-O 2.88Å; M34-Y53 PolarHBondContact O-N 3.29Å; M34-I69 HydrophobicContact CE-CB 4.41Å; M34-I69 HydrophobicContact CE-CD1 3.82Å; M34-I69 HydrophobicContact CE-CG1 4.07Å; M34-I69 HydrophobicContact CE-CG2 3.45Å; M34-I69 VanDerWaalsContact CE-CG2 3.45Å; M34-I69 HydrophobicContact SD-CD1 4.02Å
35N98Very high96.8Very high86 Ų8687.9 Ų87.946%0.4648%0.484SS..EExtended strand (participates in β ladder)trans-104124.3175.9-68.5-17.2000109.1F50 T52N35-F50 HydrophobicContact CB-CB 4.04Å; N35-F50 HydrophobicContact CB-CD1 3.79Å; N35-F50 HydrophobicContact CB-CE1 4.47Å; N35-F50 HydrophobicContact CB-CG 4Å; N35-T52 WeakPolarHBondContact OD1-CG2 3.36Å; N35-T52 PolarHBondContact OD1-OG1 3.38Å
36V97.3Very high96.8Very high36 Ų3691.2 Ų91.222%0.21849%0.488CS..EExtended strand (participates in β ladder)trans-104.6121.9173.9-175.30000108M34 E38 F50 K51 Y53 I78M34-V36 HydrophobicContact CE-CG2 3.77Å; V36-E38 PolarHBondContact O-N 2.81Å; V36-F50 CarbonylContact O-C 3.56Å; V36-F50 VanDerWaalsContact O-CA 3.28Å; V36-F50 WeakPolarHBondContact O-CA 3.32Å; V36-K51 PolarHBondContact N-O 3.41Å; V36-K51 PolarHBondContact O-N 2.8Å; V36-Y53 HydrophobicContact CG2-CD2 4.13Å; V36-Y53 HydrophobicContact CG2-CE2 3.94Å; V36-I78 HydrophobicContact CB-CD1 4.29Å; V36-I78 HydrophobicContact CG1-CD1 4.02Å; V36-I78 HydrophobicContact CG1-CG2 4.02Å
37A97.5Very high96.8Very high50 Ų5090.9 Ų90.941%0.41348%0.475SS..EExtended strand (participates in β ladder)trans-64.2130.6-179.600000110.9F46 F50A37-F46 HydrophobicContact CB-CD2 3.58Å; A37-F46 HydrophobicContact CB-CE2 3.76Å; A37-F50 HydrophobicContact CB-CD1 4.27Å; A37-F50 HydrophobicContact CB-CE1 4.12Å
38E96.8Very high96.7Very high80 Ų8084.5 Ų84.537%0.37446%0.458SS..EExtended strand (participates in β ladder)trans-83.3146168.8-66.3-170.2177.700110.5V36 F46 N47 Q49V36-E38 PolarHBondContact O-N 2.81Å; E38-F46 WeakPolarHBondContact O-CA 3.39Å; E38-F46 WeakPolarHBondContact O-CD2 3.28Å; E38-N47 WeakPolarHBondContact CB-ND2 3.3Å; E38-N47 WeakPolarHBondContact CB-OD1 3.47Å; E38-N47 PolarHBondContact O-N 3.17Å; E38-N47 VanDerWaalsContact O-N 3.08Å; E38-N47 PolarHBondContact O-OD1 2.94Å; E38-N47 VanDerWaalsContact O-OD1 3.12Å; E38-Q49 HydrophobicContact CB-CB 4.28Å; E38-Q49 HydrophobicContact CG-CB 4.48Å; E38-Q49 PolarHBondContact N-O 2.75Å
39V96.3Very high96.7Very high86 Ų8688 Ų8852%0.52147%0.474SS..EExtended strand (participates in β ladder)trans-116142.8-178.8-63.80000110.8R45V39-R45 CarbonylContact C-O 3.57Å; V39-R45 WeakPolarHBondContact CA-O 2.99Å
40D95.5Very high96.7Very high62 Ų6285.3 Ų85.333%0.33246%0.46SS..  trans-63.9135.2170.2172.4-106.6000110.5V42 T43 G44 R45D40-V42 VanDerWaalsContact C-N 3.28Å; D40-V42 PolarHBondContact O-N 2.82Å; D40-V42 PolarHBondContact OD1-N 2.93Å; D40-V42 VanDerWaalsContact OD1-N 3.13Å; D40-T43 WeakPolarHBondContact CB-OG1 3.47Å; D40-T43 WeakPolarHBondContact OD1-CB 3.47Å; D40-T43 WeakPolarHBondContact OD1-CG2 3.37Å; D40-T43 PolarHBondContact OD1-N 3.1Å; D40-T43 PolarHBondContact OD1-OG1 3.26Å; D40-G44 VanDerWaalsContact O-CA 3.25Å; D40-G44 WeakPolarHBondContact O-CA 3.49Å; D40-G44 PolarHBondContact O-N 3.48Å; D40-R45 PolarHBondContact N-O 2.88Å
41K92.9Very high96.7Very high210 Ų21086.3 Ų86.391%0.91346%0.455SS*.THydrogen-bonded Turntrans-69.3-24.4-172.1-67.8-175.8179.5178.60113.5
42V96.3Very high96.7Very high136 Ų13688.1 Ų88.182%0.82447%0.466SS*.THydrogen-bonded Turntrans-91.7-46.8-176.6-179.10000110.6D40D40-V42 VanDerWaalsContact C-N 3.28Å; D40-V42 PolarHBondContact O-N 2.82Å; D40-V42 PolarHBondContact OD1-N 2.93Å; D40-V42 VanDerWaalsContact OD1-N 3.13Å
43T95.9Very high96.7Very high83 Ų8386 Ų8651%0.50946%0.455SS..THydrogen-bonded Turntrans-94.5-17.9-172.662.70000113.5D40 R45D40-T43 WeakPolarHBondContact CB-OG1 3.47Å; D40-T43 WeakPolarHBondContact OD1-CB 3.47Å; D40-T43 WeakPolarHBondContact OD1-CG2 3.37Å; D40-T43 PolarHBondContact OD1-N 3.1Å; D40-T43 PolarHBondContact OD1-OG1 3.26Å; T43-R45 PolarHBondContact O-N 3.42Å; T43-R45 PolarHBondContact OG1-N 3.38Å
44G95.4Very high96.7Very high53 Ų5381.4 Ų81.455%0.54644%0.435SS..  trans66.810.5-173.800000113.9D40D40-G44 VanDerWaalsContact O-CA 3.25Å; D40-G44 WeakPolarHBondContact O-CA 3.49Å; D40-G44 PolarHBondContact O-N 3.48Å
45R97.1Very high96.8Very high189 Ų18978.7 Ų78.771%0.71342%0.421SS*.  trans-91.4153.1-178.2-66.2-179.5176.6170.9-0.9110.8V39 D40 T43 N47V39-R45 CarbonylContact C-O 3.57Å; V39-R45 WeakPolarHBondContact CA-O 2.99Å; D40-R45 PolarHBondContact N-O 2.88Å; T43-R45 PolarHBondContact O-N 3.42Å; T43-R45 PolarHBondContact OG1-N 3.38Å; R45-N47 PolarHBondContact O-N 3.09Å
46F97.5Very high96.8Very high110 Ų11074.7 Ų74.748%0.48240%0.4SS..EExtended strand (participates in β ladder)trans-54.8130.7174.4175.1-126.5000111.4A37 E38 G48 Q49 F50A37-F46 HydrophobicContact CB-CD2 3.58Å; A37-F46 HydrophobicContact CB-CE2 3.76Å; E38-F46 WeakPolarHBondContact O-CA 3.39Å; E38-F46 WeakPolarHBondContact O-CD2 3.28Å; F46-G48 VanDerWaalsContact CZ-C 3.46Å; F46-Q49 VanDerWaalsContact CE2-O 3.32Å; F46-Q49 WeakPolarHBondContact CE2-O 3.46Å; F46-F50 HydrophobicContact CE1-CZ 4.29Å; F46-F50 HydrophobicContact CE2-CD1 4.29Å; F46-F50 AromaticContact CE2-CE1 3.82Å; F46-F50 HydrophobicContact CE2-CE1 3.82Å; F46-F50 HydrophobicContact CE2-CE2 4.31Å; F46-F50 AromaticContact CE2-CZ 3.84Å; F46-F50 HydrophobicContact CE2-CZ 3.84Å; F46-F50 HydrophobicContact CZ-CD2 4.49Å; F46-F50 AromaticContact CZ-CE1 3.83Å; F46-F50 HydrophobicContact CZ-CE1 3.83Å; F46-F50 AromaticContact CZ-CE2 3.73Å; F46-F50 HydrophobicContact CZ-CE2 3.73Å; F46-F50 AromaticContact CZ-CZ 3.35Å; F46-F50 HydrophobicContact CZ-CZ 3.35Å
47N95.7Very high96.8Very high70 Ų7073.2 Ų73.237%0.37439%0.392SS..EExtended strand (participates in β ladder)trans-99.23.3-175.470.44.8000114.1E38 R45 Q49E38-N47 WeakPolarHBondContact CB-ND2 3.3Å; E38-N47 WeakPolarHBondContact CB-OD1 3.47Å; E38-N47 PolarHBondContact O-N 3.17Å; E38-N47 VanDerWaalsContact O-N 3.08Å; E38-N47 PolarHBondContact O-OD1 2.94Å; E38-N47 VanDerWaalsContact O-OD1 3.12Å; R45-N47 PolarHBondContact O-N 3.09Å; N47-Q49 VanDerWaalsContact C-N 3.35Å; N47-Q49 WeakPolarHBondContact OD1-CA 3.49Å; N47-Q49 VanDerWaalsContact OD1-CB 3.31Å; N47-Q49 WeakPolarHBondContact OD1-CB 3.19Å; N47-Q49 PolarHBondContact OD1-N 3.11Å
48G95.8Very high96.8Very high39 Ų3971.9 Ų71.940%0.40238%0.381SS..EExtended strand (participates in β ladder)trans89.9-10.8-176.500000115F46F46-G48 VanDerWaalsContact CZ-C 3.46Å
49Q96.9Very high96.8Very high119 Ų11969 Ų6956%0.55637%0.368SS*.EExtended strand (participates in β ladder)trans-100.5152.4-178.1-56.9-58.8-43.200111.7E38 F46 N47E38-Q49 HydrophobicContact CB-CB 4.28Å; E38-Q49 HydrophobicContact CG-CB 4.48Å; E38-Q49 PolarHBondContact N-O 2.75Å; F46-Q49 VanDerWaalsContact CE2-O 3.32Å; F46-Q49 WeakPolarHBondContact CE2-O 3.46Å; N47-Q49 VanDerWaalsContact C-N 3.35Å; N47-Q49 WeakPolarHBondContact OD1-CA 3.49Å; N47-Q49 VanDerWaalsContact OD1-CB 3.31Å; N47-Q49 WeakPolarHBondContact OD1-CB 3.19Å; N47-Q49 PolarHBondContact OD1-N 3.11Å
50F97.8Very high96.9Very high99 Ų9970.2 Ų70.243%0.43436%0.364SS..EExtended strand (participates in β ladder)trans-128139.6178.3-62.9-81.9000111.1N35 V36 A37 F46N35-F50 HydrophobicContact CB-CB 4.04Å; N35-F50 HydrophobicContact CB-CD1 3.79Å; N35-F50 HydrophobicContact CB-CE1 4.47Å; N35-F50 HydrophobicContact CB-CG 4Å; V36-F50 CarbonylContact O-C 3.56Å; V36-F50 VanDerWaalsContact O-CA 3.28Å; V36-F50 WeakPolarHBondContact O-CA 3.32Å; A37-F50 HydrophobicContact CB-CD1 4.27Å; A37-F50 HydrophobicContact CB-CE1 4.12Å; F46-F50 HydrophobicContact CE1-CZ 4.29Å; F46-F50 HydrophobicContact CE2-CD1 4.29Å; F46-F50 AromaticContact CE2-CE1 3.82Å; F46-F50 HydrophobicContact CE2-CE1 3.82Å; F46-F50 HydrophobicContact CE2-CE2 4.31Å; F46-F50 AromaticContact CE2-CZ 3.84Å; F46-F50 HydrophobicContact CE2-CZ 3.84Å; F46-F50 HydrophobicContact CZ-CD2 4.49Å; F46-F50 AromaticContact CZ-CE1 3.83Å; F46-F50 HydrophobicContact CZ-CE1 3.83Å; F46-F50 AromaticContact CZ-CE2 3.73Å; F46-F50 HydrophobicContact CZ-CE2 3.73Å; F46-F50 AromaticContact CZ-CZ 3.35Å; F46-F50 HydrophobicContact CZ-CZ 3.35Å
51K97.4Very high97Very high67 Ų6777.6 Ų77.629%0.29139%0.387SS..EExtended strand (participates in β ladder)trans-87.8121.7159.3-169.973.6171.3-154.40109.1V36 Y53 D76 I78V36-K51 PolarHBondContact N-O 3.41Å; V36-K51 PolarHBondContact O-N 2.8Å; K51-Y53 HydrophobicContact CG-CE1 4.2Å; K51-Y53 HydrophobicContact CG-CE2 4.19Å; K51-D76 WeakPolarHBondContact CE-OD1 3.29Å; K51-D76 WeakPolarHBondContact CE-OD2 3.35Å; K51-D76 IonicContact NZ-OD1 2.77Å; K51-D76 PolarHBondContact NZ-OD1 3.04Å; K51-D76 IonicContact NZ-OD2 3.36Å; K51-D76 PolarHBondContact NZ-OD2 2.77Å; K51-I78 HydrophobicContact CB-CD1 3.88Å; K51-I78 HydrophobicContact CG-CD1 3.97Å
52T97.8Very high97.2Very high61 Ų6173.2 Ų73.237%0.37437%0.371SS..EExtended strand (participates in β ladder)trans-107.1132.3-175-620000111.9Q33 M34 N35Q33-T52 HydrophobicContact CG-CG2 3.36Å; M34-T52 WeakPolarHBondContact O-CA 3.44Å; N35-T52 WeakPolarHBondContact OD1-CG2 3.36Å; N35-T52 PolarHBondContact OD1-OG1 3.38Å
53Y98Very high97.2Very high6 Ų669.5 Ų69.52%0.02436%0.36CS..EExtended strand (participates in β ladder)trans-117.7138172.1-56.7-65.2000111Q33 M34 V36 K51 L72 D76 I78Q33-Y53 CarbonylContact C-O 3.5Å; Q33-Y53 WeakPolarHBondContact CA-O 3.37Å; M34-Y53 HydrophobicContact CE-CD2 4.02Å; M34-Y53 PolarHBondContact N-O 2.88Å; M34-Y53 PolarHBondContact O-N 3.29Å; V36-Y53 HydrophobicContact CG2-CD2 4.13Å; V36-Y53 HydrophobicContact CG2-CE2 3.94Å; K51-Y53 HydrophobicContact CG-CE1 4.2Å; K51-Y53 HydrophobicContact CG-CE2 4.19Å; Y53-L72 HydrophobicContact CD1-CB 4.12Å; Y53-L72 HydrophobicContact CD1-CD1 3.94Å; Y53-L72 HydrophobicContact CE1-CB 3.77Å; Y53-L72 HydrophobicContact CE1-CD1 4.43Å; Y53-L72 HydrophobicContact CG-CD1 4.42Å; Y53-D76 VanDerWaalsContact CE1-OD2 3.3Å; Y53-D76 WeakPolarHBondContact CE1-OD2 3.34Å; Y53-D76 WeakPolarHBondContact OH-CB 3.33Å; Y53-D76 PolarHBondContact OH-OD2 3.41Å; Y53-I78 HydrophobicContact CE2-CD1 4.44Å; Y53-I78 WeakPolarHBondContact OH-CD1 3.47Å
54A98.2Very high97.3Very high10 Ų1070.1 Ų70.18%0.08336%0.357CS..EExtended strand (participates in β ladder)trans-109.6124172.700000109.4C17 S18 I24 I32C17-A54 CarbonylContact C-O 3.57Å; C17-A54 WeakPolarHBondContact CA-O 3.45Å; S18-A54 PolarHBondContact N-O 3.16Å; S18-A54 PolarHBondContact OG-N 3.2Å; S18-A54 PolarHBondContact OG-O 3.14Å; I24-A54 HydrophobicContact CD1-CB 3.85Å; I32-A54 WeakPolarHBondContact O-CA 3.23Å
55I98.3Very high97.4Very high0 Ų068.7 Ų68.70%034%0.338CS..EExtended strand (participates in β ladder)trans-117.9126.1178.6-55-63.1000108.7A19 S31 I32 I59 R60 I69 L72A19-I55 HydrophobicContact CB-CD1 4.03Å; S31-I55 WeakPolarHBondContact CA-O 3.29Å; I32-I55 HydrophobicContact CG1-CB 3.97Å; I32-I55 PolarHBondContact N-O 2.93Å; I32-I55 PolarHBondContact O-N 2.88Å; I55-I59 HydrophobicContact CG2-CB 3.91Å; I55-I59 HydrophobicContact CG2-CG2 3.88Å; I55-R60 HydrophobicContact CG2-CG 3.88Å; I55-I69 HydrophobicContact CD1-CG1 4.33Å; I55-I69 HydrophobicContact CG1-CD1 4.42Å; I55-I69 HydrophobicContact CG1-CG1 4.24Å; I55-L72 HydrophobicContact CD1-CD1 4.36Å
56C98Very high97.4Very high2 Ų265.6 Ų65.61%0.01434%0.336CS..  trans-74154.7177.764.80000111.9C17 I24 A58 I59 R60C17-C56 HydrophobicContact CB-CB 3.92Å; C17-C56 PolarHBondContact SG-N 3.18Å; C17-C56 VanDerWaalsContact SG-N 3.39Å; C17-C56 VanDerWaalsContact SG-SG 3.6Å; I24-C56 HydrophobicContact CG1-CB 4.02Å; C56-A58 PolarHBondContact O-N 3.29Å; C56-A58 VanDerWaalsContact O-N 3.15Å; C56-I59 PolarHBondContact O-N 3.37Å; C56-R60 PolarHBondContact O-N 2.98Å
57G97.7Very high97.4Very high6 Ų664.5 Ų64.56%0.06234%0.335CS..Hα-helixtrans-60.3-28-177.700000113.7D28 R60 R61D28-G57 PolarHBondContact OD2-N 2.77Å; G57-R60 PolarHBondContact O-N 3.15Å; G57-R61 WeakPolarHBondContact O-CB 3.23Å; G57-R61 PolarHBondContact O-N 3.23Å
58A97.4Very high97.5Very high21 Ų2161.8 Ų61.817%0.17432%0.322CS..Hα-helixtrans-62-46.117700000112.7C56 R60 R61 M62C56-A58 PolarHBondContact O-N 3.29Å; C56-A58 VanDerWaalsContact O-N 3.15Å; A58-R60 VanDerWaalsContact C-N 3.34Å; A58-R61 PolarHBondContact O-N 2.86Å; A58-M62 WeakPolarHBondContact O-CG 3.46Å; A58-M62 PolarHBondContact O-N 2.92Å
59I97.6Very high97.6Very high21 Ų2161.4 Ų61.411%0.10831%0.31CS..Hα-helixtrans-65.6-40.7178.7-64.6-71000110.4I55 C56 R61 M62 G63 E64I55-I59 HydrophobicContact CG2-CB 3.91Å; I55-I59 HydrophobicContact CG2-CG2 3.88Å; C56-I59 PolarHBondContact O-N 3.37Å; I59-R61 PolarHBondContact O-N 2.85Å; I59-M62 HydrophobicContact CD1-CE 3.41Å; I59-M62 VanDerWaalsContact CD1-CE 3.41Å; I59-M62 HydrophobicContact CG1-CE 4.29Å; I59-M62 PolarHBondContact O-N 2.99Å; I59-G63 PolarHBondContact O-N 3.36Å; I59-E64 HydrophobicContact CG2-CB 4.24Å; I59-E64 PolarHBondContact O-N 3.1Å
60R97.5Very high97.6Very high111 Ų11158 Ų5842%0.41930%0.295SS..Hα-helixtrans-61.9-43.5176.5-62.9-179.774.5-157.2-0.8112.8A30 I32 I55 C56 G57 A58 M62 G63A30-R60 WeakPolarHBondContact O-CD 3.46Å; A30-R60 PolarHBondContact O-NH1 2.82Å; I32-R60 VanDerWaalsContact CG2-CZ 3.43Å; I55-R60 HydrophobicContact CG2-CG 3.88Å; C56-R60 PolarHBondContact O-N 2.98Å; G57-R60 PolarHBondContact O-N 3.15Å; A58-R60 VanDerWaalsContact C-N 3.34Å; R60-M62 VanDerWaalsContact C-N 3.28Å; R60-M62 PolarHBondContact O-N 2.56Å; R60-G63 PolarHBondContact O-N 2.83Å
61R97.4Very high97.6Very high216 Ų21659.3 Ų59.382%0.81530%0.298SS*.Hα-helixtrans-66.9-29179.2-174.217363.1-1530.1112.9G57 A58 I59 G63G57-R61 WeakPolarHBondContact O-CB 3.23Å; G57-R61 PolarHBondContact O-N 3.23Å; A58-R61 PolarHBondContact O-N 2.86Å; I59-R61 PolarHBondContact O-N 2.85Å; R61-G63 PolarHBondContact O-N 2.99Å
62M97.3Very high97.6Very high119 Ų11957.2 Ų57.259%0.58629%0.289SS*.Hα-helixtrans-74-13.9176.1-68.6-175-53.300113.2A58 I59 R60 E64A58-M62 WeakPolarHBondContact O-CG 3.46Å; A58-M62 PolarHBondContact O-N 2.92Å; I59-M62 HydrophobicContact CD1-CE 3.41Å; I59-M62 VanDerWaalsContact CD1-CE 3.41Å; I59-M62 HydrophobicContact CG1-CE 4.29Å; I59-M62 PolarHBondContact O-N 2.99Å; R60-M62 VanDerWaalsContact C-N 3.28Å; R60-M62 PolarHBondContact O-N 2.56Å; M62-E64 VanDerWaalsContact C-N 3.28Å; M62-E64 HydrophobicContact CB-CG 4.09Å
63G97.4Very high97.6Very high57 Ų5754.7 Ų54.759%0.58828%0.275SS*.THydrogen-bonded Turntrans86.9-7.5-173.300000114.1I59 R60 R61 S65I59-G63 PolarHBondContact O-N 3.36Å; R60-G63 PolarHBondContact O-N 2.83Å; R61-G63 PolarHBondContact O-N 2.99Å; G63-S65 PolarHBondContact O-N 2.84Å; G63-S65 VanDerWaalsContact O-N 3.17Å
64E97.8Very high97.5Very high97 Ų9757 Ų5745%0.45329%0.285SS..THydrogen-bonded Turntrans-81.710.9-175.9-59.4-59.1156.700114.2I59 M62 S68I59-E64 HydrophobicContact CG2-CB 4.24Å; I59-E64 PolarHBondContact O-N 3.1Å; M62-E64 VanDerWaalsContact C-N 3.28Å; M62-E64 HydrophobicContact CB-CG 4.09Å; E64-S68 VanDerWaalsContact O-CB 3.23Å; E64-S68 WeakPolarHBondContact O-CB 3.2Å; E64-S68 PolarHBondContact O-N 3.39Å; E64-S68 VanDerWaalsContact O-N 3.15Å; E64-S68 PolarHBondContact O-OG 3.47Å
65S97.4Very high97.4Very high22 Ų2260.4 Ų60.415%0.15431%0.313CS..Hα-helixtrans-69.4-37.9-176.4-171.10000112.7G63 I69G63-S65 PolarHBondContact O-N 2.84Å; G63-S65 VanDerWaalsContact O-N 3.17Å; S65-I69 WeakPolarHBondContact O-CD1 3.27Å; S65-I69 VanDerWaalsContact O-CG1 3.29Å; S65-I69 WeakPolarHBondContact O-CG1 3.47Å; S65-I69 PolarHBondContact O-N 3.46Å
66D97.6Very high97.3Very high124 Ų12463.8 Ų63.866%0.66333%0.331SS*.Hα-helixtrans-67.7-55.6-179-179.826.2000110.6S68 I69 L70D66-S68 VanDerWaalsContact C-N 3.26Å; D66-S68 PolarHBondContact O-N 3.17Å; D66-I69 PolarHBondContact O-N 3.39Å; D66-L70 PolarHBondContact O-N 2.71Å
67D97.5Very high97.1Very high88 Ų8866.6 Ų66.647%0.47136%0.361SS..Hα-helixtrans-55.2-42.8177.5-178.368.4000112.2I69 L70 R71D67-I69 VanDerWaalsContact C-N 3.34Å; D67-I69 PolarHBondContact O-N 3.28Å; D67-L70 PolarHBondContact O-N 3.43Å; D67-R71 WeakPolarHBondContact O-CB 3.48Å; D67-R71 PolarHBondContact O-N 2.95Å
68S97.6Very high97Very high12 Ų1270 Ų708%0.08438%0.376CS..Hα-helixtrans-58-44.4175.7-69.20000112.7E64 D66 L72E64-S68 VanDerWaalsContact O-CB 3.23Å; E64-S68 WeakPolarHBondContact O-CB 3.2Å; E64-S68 PolarHBondContact O-N 3.39Å; E64-S68 VanDerWaalsContact O-N 3.15Å; E64-S68 PolarHBondContact O-OG 3.47Å; D66-S68 VanDerWaalsContact C-N 3.26Å; D66-S68 PolarHBondContact O-N 3.17Å; S68-L72 WeakPolarHBondContact O-CB 3.32Å; S68-L72 WeakPolarHBondContact O-CD1 3.34Å; S68-L72 WeakPolarHBondContact O-CG 3.39Å; S68-L72 PolarHBondContact O-N 3.1Å; S68-L72 VanDerWaalsContact O-N 3.1Å
69I97.5Very high96.9Very high32 Ų3271 Ų7116%0.16438%0.38CS..Hα-helixtrans-69-44.7178.9-73.3166.9000110.3M34 I55 S65 D66 D67 R71 L72 A73M34-I69 HydrophobicContact CE-CB 4.41Å; M34-I69 HydrophobicContact CE-CD1 3.82Å; M34-I69 HydrophobicContact CE-CG1 4.07Å; M34-I69 HydrophobicContact CE-CG2 3.45Å; M34-I69 VanDerWaalsContact CE-CG2 3.45Å; M34-I69 HydrophobicContact SD-CD1 4.02Å; I55-I69 HydrophobicContact CD1-CG1 4.33Å; I55-I69 HydrophobicContact CG1-CD1 4.42Å; I55-I69 HydrophobicContact CG1-CG1 4.24Å; S65-I69 WeakPolarHBondContact O-CD1 3.27Å; S65-I69 VanDerWaalsContact O-CG1 3.29Å; S65-I69 WeakPolarHBondContact O-CG1 3.47Å; S65-I69 PolarHBondContact O-N 3.46Å; D66-I69 PolarHBondContact O-N 3.39Å; D67-I69 VanDerWaalsContact C-N 3.34Å; D67-I69 PolarHBondContact O-N 3.28Å; I69-R71 VanDerWaalsContact C-N 3.32Å; I69-R71 PolarHBondContact O-N 3.49Å; I69-L72 PolarHBondContact O-N 3.11Å; I69-A73 VanDerWaalsContact O-CB 3.29Å; I69-A73 WeakPolarHBondContact O-CB 3.43Å; I69-A73 PolarHBondContact O-N 3.15Å
70L97.4Very high96.8Very high46 Ų4673.7 Ų73.724%0.24140%0.401CS..Hα-helixtrans-57.6-47.1178.1177.461.7000111D66 D67 A73 K74 V79 F83D66-L70 PolarHBondContact O-N 2.71Å; D67-L70 PolarHBondContact O-N 3.43Å; L70-A73 PolarHBondContact O-N 2.89Å; L70-K74 HydrophobicContact CD1-CG 4.43Å; L70-K74 WeakPolarHBondContact O-CB 3.36Å; L70-K74 WeakPolarHBondContact O-CG 3.44Å; L70-K74 PolarHBondContact O-N 3.19Å; L70-V79 HydrophobicContact CD1-CG1 4.08Å; L70-V79 HydrophobicContact CD1-CG2 4.32Å; L70-F83 HydrophobicContact CD1-CD1 4.09Å; L70-F83 HydrophobicContact CD1-CE1 4.03Å; L70-F83 HydrophobicContact CD2-CD1 4.46Å; L70-F83 HydrophobicContact CD2-CE1 3.99Å
71R97.1Very high96.5Very high128 Ų12877.2 Ų77.248%0.48342%0.419SS..Hα-helixtrans-62.6-43.6178-172.7-178.963.177.3-0.1112.1D67 I69 A75D67-R71 WeakPolarHBondContact O-CB 3.48Å; D67-R71 PolarHBondContact O-N 2.95Å; I69-R71 VanDerWaalsContact C-N 3.32Å; I69-R71 PolarHBondContact O-N 3.49Å; R71-A75 WeakPolarHBondContact O-CB 3.39Å; R71-A75 PolarHBondContact O-N 3.19Å
72L97.3Very high96.2Very high22 Ų2274.7 Ų74.712%0.11542%0.422CS..Hα-helixtrans-63.2-47.2176.3-72.5168.6000111.2Y53 I55 S68 I69 K74 A75 D76Y53-L72 HydrophobicContact CD1-CB 4.12Å; Y53-L72 HydrophobicContact CD1-CD1 3.94Å; Y53-L72 HydrophobicContact CE1-CB 3.77Å; Y53-L72 HydrophobicContact CE1-CD1 4.43Å; Y53-L72 HydrophobicContact CG-CD1 4.42Å; I55-L72 HydrophobicContact CD1-CD1 4.36Å; S68-L72 WeakPolarHBondContact O-CB 3.32Å; S68-L72 WeakPolarHBondContact O-CD1 3.34Å; S68-L72 WeakPolarHBondContact O-CG 3.39Å; S68-L72 PolarHBondContact O-N 3.1Å; S68-L72 VanDerWaalsContact O-N 3.1Å; I69-L72 PolarHBondContact O-N 3.11Å; L72-K74 VanDerWaalsContact C-N 3.35Å; L72-K74 PolarHBondContact O-N 3.41Å; L72-A75 WeakPolarHBondContact O-CB 3.39Å; L72-A75 PolarHBondContact O-N 3.39Å; L72-A75 VanDerWaalsContact O-N 3.14Å; L72-D76 WeakPolarHBondContact O-CB 3.08Å; L72-D76 PolarHBondContact O-N 3.39Å
73A97.1Very high95.3Very high8 Ų877.1 Ų77.17%0.06643%0.43CS..Hα-helixtrans-64.9-35.6179.700000112.9I69 L70 G77 I78 V79I69-A73 VanDerWaalsContact O-CB 3.29Å; I69-A73 WeakPolarHBondContact O-CB 3.43Å; I69-A73 PolarHBondContact O-N 3.15Å; L70-A73 PolarHBondContact O-N 2.89Å; A73-G77 PolarHBondContact O-N 3.45Å; A73-I78 HydrophobicContact CB-CB 4.2Å; A73-I78 WeakPolarHBondContact O-CB 3.46Å; A73-I78 PolarHBondContact O-N 3.07Å; A73-V79 HydrophobicContact CB-CB 4.47Å; A73-V79 HydrophobicContact CB-CG2 3.8Å; A73-V79 PolarHBondContact O-N 3.32Å; A73-V79 VanDerWaalsContact O-N 3.13Å
74K96.8Very high95.2Very high54 Ų5478.1 Ų78.124%0.23542%0.422CS..Hα-helixtrans-64.5-44.5170.6-78.6-174.1-178.1-173.40111.8L70 L72 D76 G77 V79 F83L70-K74 HydrophobicContact CD1-CG 4.43Å; L70-K74 WeakPolarHBondContact O-CB 3.36Å; L70-K74 WeakPolarHBondContact O-CG 3.44Å; L70-K74 PolarHBondContact O-N 3.19Å; L72-K74 VanDerWaalsContact C-N 3.35Å; L72-K74 PolarHBondContact O-N 3.41Å; K74-D76 VanDerWaalsContact C-N 3.31Å; K74-D76 PolarHBondContact O-N 3.18Å; K74-G77 PolarHBondContact O-N 3.18Å; K74-G77 VanDerWaalsContact O-N 3.16Å; K74-V79 HydrophobicContact CG-CB 3.77Å; K74-V79 HydrophobicContact CG-CG1 3.71Å; K74-F83 VanDerWaalsContact NZ-C 3.31Å; K74-F83 PolarHBondContact NZ-O 2.71Å
75A95.7Very high95.1Very high83 Ų8377.1 Ų77.169%0.68642%0.42SS*.Hα-helixtrans-63.3-39.217900000112R71 L72 G77R71-A75 WeakPolarHBondContact O-CB 3.39Å; R71-A75 PolarHBondContact O-N 3.19Å; L72-A75 WeakPolarHBondContact O-CB 3.39Å; L72-A75 PolarHBondContact O-N 3.39Å; L72-A75 VanDerWaalsContact O-N 3.14Å; A75-G77 PolarHBondContact O-N 2.96Å
76D95.5Very high95Very high71 Ų7180.2 Ų80.238%0.3844%0.435SS..THydrogen-bonded Turntrans-81.74177.3-76.1-49.5000113.6K51 Y53 L72 K74 I78K51-D76 WeakPolarHBondContact CE-OD1 3.29Å; K51-D76 WeakPolarHBondContact CE-OD2 3.35Å; K51-D76 IonicContact NZ-OD1 2.77Å; K51-D76 PolarHBondContact NZ-OD1 3.04Å; K51-D76 IonicContact NZ-OD2 3.36Å; K51-D76 PolarHBondContact NZ-OD2 2.77Å; Y53-D76 VanDerWaalsContact CE1-OD2 3.3Å; Y53-D76 WeakPolarHBondContact CE1-OD2 3.34Å; Y53-D76 WeakPolarHBondContact OH-CB 3.33Å; Y53-D76 PolarHBondContact OH-OD2 3.41Å; L72-D76 WeakPolarHBondContact O-CB 3.08Å; L72-D76 PolarHBondContact O-N 3.39Å; K74-D76 VanDerWaalsContact C-N 3.31Å; K74-D76 PolarHBondContact O-N 3.18Å; D76-I78 HydrophobicContact CB-CG1 4.39Å; D76-I78 PolarHBondContact O-N 2.93Å
77G94.6Very high94.8Very high61 Ų6177.6 Ų77.663%0.62942%0.422SS*.THydrogen-bonded Turntrans71.71517500000114.9A73 K74 A75A73-G77 PolarHBondContact O-N 3.45Å; K74-G77 PolarHBondContact O-N 3.18Å; K74-G77 VanDerWaalsContact O-N 3.16Å; A75-G77 PolarHBondContact O-N 2.96Å
78I95Very high94.6Very high76 Ų7676.9 Ų76.939%0.3942%0.419SS..SBendtrans-76.7-43.5174.3-58.4178.9000109.9V36 K51 Y53 A73 D76V36-I78 HydrophobicContact CB-CD1 4.29Å; V36-I78 HydrophobicContact CG1-CD1 4.02Å; V36-I78 HydrophobicContact CG1-CG2 4.02Å; K51-I78 HydrophobicContact CB-CD1 3.88Å; K51-I78 HydrophobicContact CG-CD1 3.97Å; Y53-I78 HydrophobicContact CE2-CD1 4.44Å; Y53-I78 WeakPolarHBondContact OH-CD1 3.47Å; A73-I78 HydrophobicContact CB-CB 4.2Å; A73-I78 WeakPolarHBondContact O-CB 3.46Å; A73-I78 PolarHBondContact O-N 3.07Å; D76-I78 HydrophobicContact CB-CG1 4.39Å; D76-I78 PolarHBondContact O-N 2.93Å
79V96.4Very high94.5Very high42 Ų4281.3 Ų81.326%0.25544%0.441SS..SBendtrans-98.2138.5172.7177.10000108.6L70 A73 K74 F83L70-V79 HydrophobicContact CD1-CG1 4.08Å; L70-V79 HydrophobicContact CD1-CG2 4.32Å; A73-V79 HydrophobicContact CB-CB 4.47Å; A73-V79 HydrophobicContact CB-CG2 3.8Å; A73-V79 PolarHBondContact O-N 3.32Å; A73-V79 VanDerWaalsContact O-N 3.13Å; K74-V79 HydrophobicContact CG-CB 3.77Å; K74-V79 HydrophobicContact CG-CG1 3.71Å; V79-F83 HydrophobicContact CG1-CB 4.27Å; V79-F83 HydrophobicContact CG1-CD1 4.38Å
80S94.9Very high94.2Very high79 Ų7984.8 Ų84.855%0.55246%0.461SS*.  trans-64.2147.6179.573.90000111.4N82 F83S80-N82 PolarHBondContact O-N 3.23Å; S80-F83 PolarHBondContact O-N 3.22Å
81K92.3Very high94Very high184 Ų18487.8 Ų87.880%0.848%0.478SS*.THydrogen-bonded Turntrans-71.3-16179.1-65.4-177.1-179.7179.30113.7F83K81-F83 VanDerWaalsContact C-N 3.27Å
82N90.4Very high93.7Very high163 Ų16384.4 Ų84.487%0.87248%0.477SS*.THydrogen-bonded Turntrans-871-176.7-62.5-5.9000112.7S80S80-N82 PolarHBondContact O-N 3.23Å
83F78.9Confident93.4Very high170 Ų17090.1 Ų90.175%0.74651%0.51SS*.  trans-83.40171-175.9-104.7000111.1L70 K74 V79 S80 K81L70-F83 HydrophobicContact CD1-CD1 4.09Å; L70-F83 HydrophobicContact CD1-CE1 4.03Å; L70-F83 HydrophobicContact CD2-CD1 4.46Å; L70-F83 HydrophobicContact CD2-CE1 3.99Å; K74-F83 VanDerWaalsContact NZ-C 3.31Å; K74-F83 PolarHBondContact NZ-O 2.71Å; V79-F83 HydrophobicContact CG1-CB 4.27Å; V79-F83 HydrophobicContact CG1-CD1 4.38Å; S80-F83 PolarHBondContact O-N 3.22Å; K81-F83 VanDerWaalsContact C-N 3.27Å

Retrieved 83 of 83 residues in 22.9 ms (Link to these results)

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