A0A087Y4G9_POEFO Loading...

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 (A0A3B3THF7), UniProt , Accession A0A087Y4G9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, 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
1M88.6Confident92.9Very high143 Ų143112.4 Ų112.470%0.70461%0.606SS**  01300-174.8170.6176.100106F8 V9 D10M1-F8 WeakPolarHBondContact O-CA 3.32Å; M1-V9 HydrophobicContact CB-CG2 4.05Å; M1-V9 HydrophobicContact CG-CG2 4.08Å; M1-V9 PolarHBondContact O-N 2.79Å; M1-V9 VanDerWaalsContact O-N 3.07Å; M1-D10 VanDerWaalsContact CB-OD1 3.24Å; M1-D10 WeakPolarHBondContact CB-OD1 3.4Å; M1-D10 WeakPolarHBondContact CB-OD2 3.26Å; M1-D10 VanDerWaalsContact N-CG 3.27Å; M1-D10 PolarHBondContact N-OD2 2.77Å
2Q92.6Very high93Very high116 Ų116114.4 Ų114.454%0.54260%0.6SS.*BIsolated β-bridgetrans-108.9133.3179.5-162.3174.6500107.2G6 E7Q2-G6 WeakPolarHBondContact CG-O 3.21Å; Q2-G6 PolarHBondContact NE2-O 2.84Å; Q2-E7 CarbonylContact C-O 3.45Å; Q2-E7 VanDerWaalsContact CA-O 3.27Å; Q2-E7 WeakPolarHBondContact CA-O 3.46Å
3N92.9Very high93.1Very high51 Ų51115 Ų11527%0.27361%0.611SS.*  trans-78175.3173.169.29.8000110.6A5 G6 E7 V9N3-A5 PolarHBondContact O-N 3.14Å; N3-A5 VanDerWaalsContact O-N 3.17Å; N3-A5 WeakPolarHBondContact OD1-CA 3.43Å; N3-A5 WeakPolarHBondContact OD1-CB 3.48Å; N3-A5 PolarHBondContact OD1-N 3.27Å; N3-A5 VanDerWaalsContact OD1-N 3.09Å; N3-G6 PolarHBondContact O-N 3.31Å; N3-G6 PolarHBondContact OD1-N 3.27Å; N3-E7 PolarHBondContact N-O 3.47Å; N3-E7 PolarHBondContact ND2-OE2 2.71Å; N3-E7 WeakPolarHBondContact OD1-CB 3.45Å; N3-E7 PolarHBondContact OD1-N 3.32Å; N3-V9 HydrophobicContact CB-CG1 4.03Å
4D94.1Very high93.3Very high182 Ų182109.5 Ų109.597%0.97359%0.585SS**THydrogen-bonded Turntrans-63.8-20.1179.8-60.3-28000113.2G6D4-G6 VanDerWaalsContact C-N 3.29Å
5A93.9Very high93.5Very high81 Ų81109.2 Ų109.267%0.66957%0.573SS**THydrogen-bonded Turntrans-83.6-2.3174.600000113.3N3 E7N3-A5 PolarHBondContact O-N 3.14Å; N3-A5 VanDerWaalsContact O-N 3.17Å; N3-A5 WeakPolarHBondContact OD1-CA 3.43Å; N3-A5 WeakPolarHBondContact OD1-CB 3.48Å; N3-A5 PolarHBondContact OD1-N 3.27Å; N3-A5 VanDerWaalsContact OD1-N 3.09Å; A5-E7 HydrophobicContact CB-CG 4.4Å
6G92.6Very high93.8Very high34 Ų34110.6 Ų110.635%0.35157%0.572SS.*SBendtrans86.510.6179.300000114.7Q2 N3 D4Q2-G6 WeakPolarHBondContact CG-O 3.21Å; Q2-G6 PolarHBondContact NE2-O 2.84Å; N3-G6 PolarHBondContact O-N 3.31Å; N3-G6 PolarHBondContact OD1-N 3.27Å; D4-G6 VanDerWaalsContact C-N 3.29Å
7E93.8Very high94Very high122 Ų122104.1 Ų104.157%0.5754%0.539SS*.  trans-94.1141.7-176.7-53.8173.7139.600111.8Q2 N3 A5 V9Q2-E7 CarbonylContact C-O 3.45Å; Q2-E7 VanDerWaalsContact CA-O 3.27Å; Q2-E7 WeakPolarHBondContact CA-O 3.46Å; N3-E7 PolarHBondContact N-O 3.47Å; N3-E7 PolarHBondContact ND2-OE2 2.71Å; N3-E7 WeakPolarHBondContact OD1-CB 3.45Å; N3-E7 PolarHBondContact OD1-N 3.32Å; A5-E7 HydrophobicContact CB-CG 4.4Å; E7-V9 PolarHBondContact O-N 3.46Å
8F92Very high94.2Very high170 Ų170100.7 Ų100.775%0.74653%0.526SS*.BIsolated β-bridgetrans-77.1115.3173.3-73.6-82.3000110.5M1M1-F8 WeakPolarHBondContact O-CA 3.32Å
9V94.7Very high94.4Very high81 Ų8196.4 Ų96.449%0.49151%0.506SS..  trans-101.3-5.5-177.3-65.20000114M1 N3 E7M1-V9 HydrophobicContact CB-CG2 4.05Å; M1-V9 HydrophobicContact CG-CG2 4.08Å; M1-V9 PolarHBondContact O-N 2.79Å; M1-V9 VanDerWaalsContact O-N 3.07Å; N3-V9 HydrophobicContact CB-CG1 4.03Å; E7-V9 PolarHBondContact O-N 3.46Å
10D92.8Very high94.4Very high77 Ų7794 Ų9441%0.41250%0.498SS..  trans-78.8140.8179.6-74-17.8000112M1M1-D10 VanDerWaalsContact CB-OD1 3.24Å; M1-D10 WeakPolarHBondContact CB-OD1 3.4Å; M1-D10 WeakPolarHBondContact CB-OD2 3.26Å; M1-D10 VanDerWaalsContact N-CG 3.27Å; M1-D10 PolarHBondContact N-OD2 2.77Å
11L93.8Very high94.6Very high179 Ų17995.4 Ų95.494%0.93751%0.506SS*.SBendtrans-65-38.6172.6-67173.5000112.5
12Y94.1Very high94.9Very high137 Ų13795.8 Ų95.854%0.53750%0.499SS..  trans-163.1158.2176.171.9-75.8000110.4P14Y12-P14 HydrophobicContact CD2-CB 4.38Å; Y12-P14 HydrophobicContact CE2-CB 3.75Å
13V94.2Very high95.1Very high122 Ų12295.3 Ų95.374%0.73950%0.499SS*.  trans-96.2115.8169.8-178.10000108.5
14P96.2Very high95.4Very high38 Ų3893.2 Ų93.225%0.24749%0.488CS..PPolyproline II helixtrans-68.3153.8-178.328.2-35.1000111.8Y12 I23Y12-P14 HydrophobicContact CD2-CB 4.38Å; Y12-P14 HydrophobicContact CE2-CB 3.75Å; P14-I23 HydrophobicContact CB-CG2 3.7Å; P14-I23 HydrophobicContact CG-CG2 3.45Å; P14-I23 VanDerWaalsContact CG-CG2 3.45Å
15R97.1Very high95.5Very high105 Ų10586.5 Ų86.540%0.39646%0.461SS..PPolyproline II helixtrans-63.3144.3173.8-64.4178.4-64.4144.38.7109.8I24R15-I24 HydrophobicContact CB-CB 4.46Å; R15-I24 HydrophobicContact CB-CD1 4.16Å; R15-I24 WeakPolarHBondContact O-CB 3.38Å; R15-I24 PolarHBondContact O-N 3.22Å
16K97.8Very high95.6Very high131 Ų13186.5 Ų86.557%0.5746%0.461SS*.BIsolated β-bridgetrans-103.7141.2169.7-72.2-176.9-74.5-179.20109.4S18 R22 I23K16-S18 PolarHBondContact O-N 3.17Å; K16-R22 WeakPolarHBondContact CA-O 3.45Å; K16-I23 HydrophobicContact CG-CG1 4.26Å
17C97.4Very high95.9Very high0 Ų093 Ų930%048%0.48CS..PPolyproline II helixtrans-60.8121.3170.8-178.20000109.1A19 S20 N21 R22 A54 C56C17-A19 PolarHBondContact O-N 2.88Å; C17-S20 PolarHBondContact O-N 3.45Å; C17-S20 PolarHBondContact SG-OG 3.18Å; C17-N21 VanDerWaalsContact O-CA 3.27Å; C17-N21 WeakPolarHBondContact O-CA 3.48Å; C17-N21 PolarHBondContact O-N 3.14Å; C17-R22 HydrophobicContact CB-CB 4.5Å; C17-R22 WeakPolarHBondContact CB-O 3.46Å; C17-R22 PolarHBondContact N-O 3.03Å; C17-A54 CarbonylContact C-O 3.59Å; C17-A54 WeakPolarHBondContact CA-O 3.41Å; C17-C56 HydrophobicContact CB-CB 3.92Å; C17-C56 PolarHBondContact SG-N 3.22Å; C17-C56 VanDerWaalsContact SG-N 3.38Å; C17-C56 VanDerWaalsContact SG-SG 3.62Å
18S97.6Very high96Very high44 Ų4489.3 Ų89.331%0.30846%0.464SS..THydrogen-bonded Turntrans-60.5-28.4178.4-55.10000112.2K16 A54K16-S18 PolarHBondContact O-N 3.17Å; S18-A54 PolarHBondContact N-O 3.3Å; S18-A54 PolarHBondContact OG-N 2.92Å; S18-A54 PolarHBondContact OG-O 3.36Å
19A96.8Very high96.3Very high19 Ų1988.5 Ų88.516%0.15746%0.463CS..THydrogen-bonded Turntrans-81-43-17800000113.3C17 I55 R71C17-A19 PolarHBondContact O-N 2.88Å; A19-I55 HydrophobicContact CB-CD1 3.99Å; A19-R71 PolarHBondContact O-NH2 2.74Å
20S96.2Very high96.4Very high48 Ų4886.8 Ų86.834%0.33646%0.457SS..THydrogen-bonded Turntrans-1210.2-167.863.50000114.9C17 R22C17-S20 PolarHBondContact O-N 3.45Å; C17-S20 PolarHBondContact SG-OG 3.18Å; S20-R22 PolarHBondContact O-N 2.86Å
21N96.8Very high96.6Very high124 Ų12484.2 Ų84.266%0.66345%0.445SS*.  trans57.18.7-173.3-67.6-42.6000115.4C17C17-N21 VanDerWaalsContact O-CA 3.27Å; C17-N21 WeakPolarHBondContact O-CA 3.48Å; C17-N21 PolarHBondContact O-N 3.14Å
22R95.9Very high96.8Very high150 Ų15077.7 Ų77.757%0.56641%0.41SS*.  trans-69.3137.6175.1-173.8179.2-65.5-175.50.1110.6K16 C17 S20 I24 A58K16-R22 WeakPolarHBondContact CA-O 3.45Å; C17-R22 HydrophobicContact CB-CB 4.5Å; C17-R22 WeakPolarHBondContact CB-O 3.46Å; C17-R22 PolarHBondContact N-O 3.03Å; S20-R22 PolarHBondContact O-N 2.86Å; R22-I24 PolarHBondContact O-N 3.42Å; R22-A58 VanDerWaalsContact NH1-CB 3.31Å
23I97.2Very high97Very high107 Ų10776.1 Ų76.155%0.54941%0.408SS..BIsolated β-bridgetrans-63.9133.3172.8-65.7171.8000110.2P14 K16P14-I23 HydrophobicContact CB-CG2 3.7Å; P14-I23 HydrophobicContact CG-CG2 3.45Å; P14-I23 VanDerWaalsContact CG-CG2 3.45Å; K16-I23 HydrophobicContact CG-CG1 4.26Å
24I97.7Very high97.1Very high7 Ų773.4 Ų73.44%0.03639%0.389CS..  trans-89.2111.9172.7-63.9164000107.8R15 R22 D28 S31 A54 C56R15-I24 HydrophobicContact CB-CB 4.46Å; R15-I24 HydrophobicContact CB-CD1 4.16Å; R15-I24 WeakPolarHBondContact O-CB 3.38Å; R15-I24 PolarHBondContact O-N 3.22Å; R22-I24 PolarHBondContact O-N 3.42Å; I24-D28 HydrophobicContact CG2-CB 4.14Å; I24-S31 WeakPolarHBondContact CG2-OG 3.2Å; I24-A54 HydrophobicContact CD1-CB 3.85Å; I24-C56 HydrophobicContact CG1-CB 3.86Å
25G96.6Very high97.2Very high40 Ų4076.1 Ų76.141%0.41240%0.401SS..  trans-72.8158.9177.800000112.8K27 D28G25-K27 PolarHBondContact O-N 3.17Å; G25-K27 VanDerWaalsContact O-N 3.16Å; G25-D28 PolarHBondContact O-N 2.88Å; G25-D28 VanDerWaalsContact O-N 3.1Å
26A96.9Very high97.1Very high81 Ų8173.2 Ų73.267%0.66939%0.393SS*.THydrogen-bonded Turntrans-63.1-22-17800000114.4
27K97.6Very high97.1Very high172 Ų17269.6 Ų69.675%0.74839%0.388SS*.THydrogen-bonded Turntrans-103.29.8177.8-62.3-62.4-173.4179.60113.7G25 H29G25-K27 PolarHBondContact O-N 3.17Å; G25-K27 VanDerWaalsContact O-N 3.16Å; K27-H29 PolarHBondContact O-CD2 2.9Å; K27-H29 PolarHBondContact O-N 3.46Å
28D97.1Very high97Very high44 Ų4473.4 Ų73.424%0.23541%0.405CS..  trans-77.778.9170.8-173.72.8000110I24 G25 A30 S31 G57I24-D28 HydrophobicContact CG2-CB 4.14Å; G25-D28 PolarHBondContact O-N 2.88Å; G25-D28 VanDerWaalsContact O-N 3.1Å; D28-A30 PolarHBondContact O-N 2.62Å; D28-A30 PolarHBondContact OD1-N 2.84Å; D28-S31 WeakPolarHBondContact O-CB 3.46Å; D28-S31 PolarHBondContact O-N 3.46Å; D28-S31 VanDerWaalsContact O-N 3.08Å; D28-S31 PolarHBondContact O-OG 3.12Å; D28-S31 PolarHBondContact OD1-N 3.11Å; D28-S31 VanDerWaalsContact OD1-N 3.13Å; D28-G57 WeakPolarHBondContact OD1-CA 3.23Å; D28-G57 PolarHBondContact OD1-N 3.24Å; D28-G57 PolarHBondContact OD2-N 3.17Å
29H97.5Very high96.9Very high153 Ų15375.3 Ų75.371%0.70842%0.415SS*.THydrogen-bonded Turntrans-69.5-15.3179.2-60.7-61.5000113.4K27K27-H29 PolarHBondContact O-CD2 2.9Å; K27-H29 PolarHBondContact O-N 3.46Å
30A97.6Very high96.9Very high45 Ų4577.4 Ų77.437%0.37242%0.424SS..THydrogen-bonded Turntrans-86.8-8172.900000111.8D28 R60D28-A30 PolarHBondContact O-N 2.62Å; D28-A30 PolarHBondContact OD1-N 2.84Å; A30-R60 WeakPolarHBondContact O-CD 3.44Å; A30-R60 PolarHBondContact O-NH1 2.55Å
31S97.1Very high96.7Very high23 Ų2385 Ų8516%0.16145%0.451CS..  trans-66.5146.7174.168.40000112I24 D28 I55I24-S31 WeakPolarHBondContact CG2-OG 3.2Å; D28-S31 WeakPolarHBondContact O-CB 3.46Å; D28-S31 PolarHBondContact O-N 3.46Å; D28-S31 VanDerWaalsContact O-N 3.08Å; D28-S31 PolarHBondContact O-OG 3.12Å; D28-S31 PolarHBondContact OD1-N 3.11Å; D28-S31 VanDerWaalsContact OD1-N 3.13Å; S31-I55 VanDerWaalsContact CA-O 3.31Å; S31-I55 WeakPolarHBondContact CA-O 3.33Å
32I97.6Very high96.7Very high41 Ų4185.6 Ų85.621%0.2146%0.459CS..EExtended strand (participates in β ladder)trans-127.8157.6175.363.9-177.3000110.8I34 A54 I55I32-I34 HydrophobicContact CD1-CD1 3.48Å; I32-I34 VanDerWaalsContact CD1-CD1 3.48Å; I32-I34 HydrophobicContact CD1-CG1 3.95Å; I32-I34 HydrophobicContact CG1-CD1 4.3Å; I32-I34 HydrophobicContact CG1-CG1 4.31Å; I32-A54 WeakPolarHBondContact O-CA 3.5Å; I32-I55 HydrophobicContact CD1-CB 4.49Å; I32-I55 HydrophobicContact CG1-CB 4Å; I32-I55 PolarHBondContact N-O 2.77Å; I32-I55 PolarHBondContact O-N 3.12Å
33Q97.6Very high96.7Very high105 Ų10582.5 Ų82.549%0.49146%0.456SS..EExtended strand (participates in β ladder)trans-127.4122.3166.8-173.4168.6-36.300107.7T52 Y53Q33-T52 HydrophobicContact CG-CG2 3.45Å; Q33-T52 VanDerWaalsContact CG-CG2 3.45Å; Q33-Y53 CarbonylContact C-O 3.58Å; Q33-Y53 WeakPolarHBondContact CA-O 3.28Å
34I96.9Very high96.6Very high65 Ų6579.8 Ų79.833%0.33346%0.455SS..EExtended strand (participates in β ladder)trans-116.2133.8-178.2-63.5171.4000108.1I32 I36 T52 Y53 I69I32-I34 HydrophobicContact CD1-CD1 3.48Å; I32-I34 VanDerWaalsContact CD1-CD1 3.48Å; I32-I34 HydrophobicContact CD1-CG1 3.95Å; I32-I34 HydrophobicContact CG1-CD1 4.3Å; I32-I34 HydrophobicContact CG1-CG1 4.31Å; I34-I36 HydrophobicContact CG2-CG1 4.28Å; I34-T52 CarbonylContact O-C 3.57Å; I34-T52 WeakPolarHBondContact O-CA 3.35Å; I34-Y53 PolarHBondContact N-O 2.96Å; I34-Y53 PolarHBondContact O-N 2.86Å; I34-I69 HydrophobicContact CD1-CD1 3.87Å
35N97.6Very high96.6Very high95 Ų9588.6 Ų88.651%0.50849%0.488SS..EExtended strand (participates in β ladder)trans-102.9121.5170.6-65.3-22.2000108.8T52N35-T52 WeakPolarHBondContact OD1-CB 3.27Å; N35-T52 VanDerWaalsContact OD1-CG2 3.31Å; N35-T52 WeakPolarHBondContact OD1-CG2 3.45Å; N35-T52 PolarHBondContact OD1-OG1 3.28Å
36I96.4Very high96.6Very high43 Ų4392.9 Ų92.922%0.22150%0.495CS..EExtended strand (participates in β ladder)trans-97.9121172.6-53.9-163.4000108.3I34 S50 K51 Y53 V78I34-I36 HydrophobicContact CG2-CG1 4.28Å; I36-S50 CarbonylContact O-C 3.48Å; I36-S50 WeakPolarHBondContact O-CA 3.48Å; I36-S50 WeakPolarHBondContact O-CB 3.37Å; I36-K51 PolarHBondContact N-O 3.46Å; I36-K51 PolarHBondContact O-N 3.24Å; I36-Y53 HydrophobicContact CD1-CD2 3.93Å; I36-Y53 HydrophobicContact CD1-CE2 3.58Å; I36-Y53 HydrophobicContact CG1-CD2 4.09Å; I36-Y53 HydrophobicContact CG1-CE2 3.94Å; I36-V78 HydrophobicContact CG2-CG1 4.03Å
37A96.9Very high96.5Very high56 Ų5692.3 Ų92.346%0.46348%0.481SS..EExtended strand (participates in β ladder)trans-62.8132.2179.200000111.6F46A37-F46 HydrophobicContact CB-CD2 3.55Å; A37-F46 HydrophobicContact CB-CE2 3.66Å
38E96.3Very high96.4Very high79 Ų7986.4 Ų86.437%0.36947%0.469SS..EExtended strand (participates in β ladder)trans-84.9145.8167.4-65.9-170.8179.800110.3F46 N47 Q49E38-F46 WeakPolarHBondContact O-CD2 3.46Å; E38-N47 WeakPolarHBondContact CB-ND2 3.18Å; E38-N47 WeakPolarHBondContact CB-OD1 3.43Å; E38-N47 PolarHBondContact O-N 2.87Å; E38-N47 VanDerWaalsContact O-N 3.12Å; E38-N47 PolarHBondContact O-OD1 2.71Å; E38-N47 VanDerWaalsContact O-OD1 3.11Å; E38-Q49 HydrophobicContact CB-CB 4.33Å; E38-Q49 PolarHBondContact N-O 2.85Å
39V95.9Very high96.3Very high84 Ų8490.1 Ų90.151%0.50949%0.485SS..EExtended strand (participates in β ladder)trans-116.5144.4-179.2-61.60000110.6R45V39-R45 CarbonylContact C-O 3.57Å; V39-R45 WeakPolarHBondContact CA-O 3.28Å
40D95.2Very high96.3Very high63 Ų6385.3 Ų85.334%0.33747%0.468SS..  trans-63133.2169.2173.6-104.9000110.2V42 T43 G44 R45D40-V42 VanDerWaalsContact C-N 3.25Å; D40-V42 PolarHBondContact O-N 2.82Å; D40-V42 PolarHBondContact OD1-N 2.85Å; D40-V42 VanDerWaalsContact OD1-N 3.14Å; D40-T43 WeakPolarHBondContact CB-OG1 3.36Å; D40-T43 WeakPolarHBondContact OD1-CB 3.14Å; D40-T43 WeakPolarHBondContact OD1-CG2 3.34Å; D40-T43 PolarHBondContact OD1-N 3.21Å; D40-T43 PolarHBondContact OD1-OG1 3.38Å; D40-G44 VanDerWaalsContact O-CA 3.26Å; D40-G44 WeakPolarHBondContact O-CA 3.17Å; D40-G44 PolarHBondContact O-N 3.06Å; D40-R45 PolarHBondContact N-O 2.85Å
41K93.1Very high96.2Very high209 Ų20986.2 Ų86.291%0.90946%0.464SS*.THydrogen-bonded Turntrans-69.3-22-171.2-65.7-177.6-179.1177.40113.6
42V96.3Very high96.2Very high136 Ų13688.2 Ų88.282%0.82448%0.475SS*.THydrogen-bonded Turntrans-95.1-46.4-176.8-178.50000110.7D40D40-V42 VanDerWaalsContact C-N 3.25Å; D40-V42 PolarHBondContact O-N 2.82Å; D40-V42 PolarHBondContact OD1-N 2.85Å; D40-V42 VanDerWaalsContact OD1-N 3.14Å
43T95.9Very high96.2Very high84 Ų8486.7 Ų86.752%0.51547%0.467SS..THydrogen-bonded Turntrans-94.7-17.4-173.263.40000113.6D40 R45D40-T43 WeakPolarHBondContact CB-OG1 3.36Å; D40-T43 WeakPolarHBondContact OD1-CB 3.14Å; D40-T43 WeakPolarHBondContact OD1-CG2 3.34Å; D40-T43 PolarHBondContact OD1-N 3.21Å; D40-T43 PolarHBondContact OD1-OG1 3.38Å; T43-R45 PolarHBondContact O-N 3.45Å; T43-R45 PolarHBondContact OG1-N 3.3Å
44G95.1Very high96.2Very high51 Ų5182.2 Ų82.253%0.52645%0.447SS..  trans67.79.8-175.500000114.1D40D40-G44 VanDerWaalsContact O-CA 3.26Å; D40-G44 WeakPolarHBondContact O-CA 3.17Å; D40-G44 PolarHBondContact O-N 3.06Å
45R96.8Very high96.3Very high191 Ų19179.1 Ų79.172%0.72143%0.432SS*.  trans-89.3152.6-178.8-67.1-179.5175166.6-1110.9V39 D40 T43 N47V39-R45 CarbonylContact C-O 3.57Å; V39-R45 WeakPolarHBondContact CA-O 3.28Å; D40-R45 PolarHBondContact N-O 2.85Å; T43-R45 PolarHBondContact O-N 3.45Å; T43-R45 PolarHBondContact OG1-N 3.3Å; R45-N47 PolarHBondContact O-N 3.23Å
46F97.2Very high96.3Very high130 Ų13074.7 Ų74.757%0.5741%0.408SS*.EExtended strand (participates in β ladder)trans-55.3128.5174177.7-126.3000111A37 E38 G48 Q49A37-F46 HydrophobicContact CB-CD2 3.55Å; A37-F46 HydrophobicContact CB-CE2 3.66Å; E38-F46 WeakPolarHBondContact O-CD2 3.46Å; F46-G48 VanDerWaalsContact CE1-CA 3.47Å; F46-Q49 WeakPolarHBondContact CE2-O 3.35Å
47N95.1Very high96.4Very high70 Ų7073 Ų7337%0.37440%0.401SS..EExtended strand (participates in β ladder)trans-95.93.2-17669.65.5000113.7E38 R45 Q49E38-N47 WeakPolarHBondContact CB-ND2 3.18Å; E38-N47 WeakPolarHBondContact CB-OD1 3.43Å; E38-N47 PolarHBondContact O-N 2.87Å; E38-N47 VanDerWaalsContact O-N 3.12Å; E38-N47 PolarHBondContact O-OD1 2.71Å; E38-N47 VanDerWaalsContact O-OD1 3.11Å; R45-N47 PolarHBondContact O-N 3.23Å; N47-Q49 VanDerWaalsContact C-N 3.32Å; N47-Q49 WeakPolarHBondContact OD1-CA 3.38Å; N47-Q49 WeakPolarHBondContact OD1-CB 3.22Å; N47-Q49 PolarHBondContact OD1-N 2.8Å; N47-Q49 PolarHBondContact OD1-O 3.46Å
48G95.2Very high96.4Very high47 Ų4771.1 Ų71.149%0.48539%0.386SS..EExtended strand (participates in β ladder)trans88.9-13-176.700000114.8F46F46-G48 VanDerWaalsContact CE1-CA 3.47Å
49Q96Very high96.4Very high123 Ų12368.3 Ų68.358%0.57537%0.373SS*.EExtended strand (participates in β ladder)trans-97.2151.9178.7-58.2-59.7-39.200111.1E38 F46 N47E38-Q49 HydrophobicContact CB-CB 4.33Å; E38-Q49 PolarHBondContact N-O 2.85Å; F46-Q49 WeakPolarHBondContact CE2-O 3.35Å; N47-Q49 VanDerWaalsContact C-N 3.32Å; N47-Q49 WeakPolarHBondContact OD1-CA 3.38Å; N47-Q49 WeakPolarHBondContact OD1-CB 3.22Å; N47-Q49 PolarHBondContact OD1-N 2.8Å; N47-Q49 PolarHBondContact OD1-O 3.46Å
50S96.8Very high96.5Very high51 Ų5169.5 Ų69.536%0.35737%0.368SS..EExtended strand (participates in β ladder)trans-142.8147.9177670000111.3I36I36-S50 CarbonylContact O-C 3.48Å; I36-S50 WeakPolarHBondContact O-CA 3.48Å; I36-S50 WeakPolarHBondContact O-CB 3.37Å
51K95.8Very high96.6Very high65 Ų6576.8 Ų76.828%0.28339%0.391SS..EExtended strand (participates in β ladder)trans-97123.1173.7-155.7142.2-170.1-178.10109.9I36 Y53 D76I36-K51 PolarHBondContact N-O 3.46Å; I36-K51 PolarHBondContact O-N 3.24Å; K51-Y53 HydrophobicContact CG-CE1 4.45Å; K51-D76 HydrophobicContact CD-CB 3.98Å; K51-D76 WeakPolarHBondContact CE-OD1 3.49Å; K51-D76 WeakPolarHBondContact CE-OD2 3.42Å; K51-D76 VanDerWaalsContact NZ-CB 3.34Å; K51-D76 IonicContact NZ-OD1 2.71Å; K51-D76 PolarHBondContact NZ-OD1 3.04Å; K51-D76 IonicContact NZ-OD2 3.46Å; K51-D76 PolarHBondContact NZ-OD2 2.77Å
52T97.1Very high96.8Very high65 Ų6572.4 Ų72.440%0.39938%0.375SS..EExtended strand (participates in β ladder)trans-100.7129.5-173.7-58.10000111.3Q33 I34 N35Q33-T52 HydrophobicContact CG-CG2 3.45Å; Q33-T52 VanDerWaalsContact CG-CG2 3.45Å; I34-T52 CarbonylContact O-C 3.57Å; I34-T52 WeakPolarHBondContact O-CA 3.35Å; N35-T52 WeakPolarHBondContact OD1-CB 3.27Å; N35-T52 VanDerWaalsContact OD1-CG2 3.31Å; N35-T52 WeakPolarHBondContact OD1-CG2 3.45Å; N35-T52 PolarHBondContact OD1-OG1 3.28Å
53Y97.6Very high96.8Very high9 Ų968.2 Ų68.24%0.03536%0.36CS..EExtended strand (participates in β ladder)trans-118.1140.3171.1-56-67.1000110.8Q33 I34 I36 K51 L72 D76Q33-Y53 CarbonylContact C-O 3.58Å; Q33-Y53 WeakPolarHBondContact CA-O 3.28Å; I34-Y53 PolarHBondContact N-O 2.96Å; I34-Y53 PolarHBondContact O-N 2.86Å; I36-Y53 HydrophobicContact CD1-CD2 3.93Å; I36-Y53 HydrophobicContact CD1-CE2 3.58Å; I36-Y53 HydrophobicContact CG1-CD2 4.09Å; I36-Y53 HydrophobicContact CG1-CE2 3.94Å; K51-Y53 HydrophobicContact CG-CE1 4.45Å; Y53-L72 HydrophobicContact CD1-CB 4.12Å; Y53-L72 HydrophobicContact CD1-CD1 3.89Å; Y53-L72 HydrophobicContact CD1-CG 4.45Å; Y53-L72 HydrophobicContact CE1-CB 3.79Å; Y53-L72 HydrophobicContact CE1-CD1 4.41Å; Y53-L72 HydrophobicContact CE1-CG 4.49Å; Y53-L72 HydrophobicContact CG-CD1 4.33Å; Y53-D76 VanDerWaalsContact CE1-OD2 3.28Å; Y53-D76 WeakPolarHBondContact CE1-OD2 3.44Å; Y53-D76 WeakPolarHBondContact OH-CB 3.38Å; Y53-D76 PolarHBondContact OH-OD2 3.24Å
54A98Very high96.9Very high10 Ų1069 Ų698%0.08336%0.357CS..EExtended strand (participates in β ladder)trans-112.1124.9172.400000109.5C17 S18 I24 I32C17-A54 CarbonylContact C-O 3.59Å; C17-A54 WeakPolarHBondContact CA-O 3.41Å; S18-A54 PolarHBondContact N-O 3.3Å; S18-A54 PolarHBondContact OG-N 2.92Å; S18-A54 PolarHBondContact OG-O 3.36Å; I24-A54 HydrophobicContact CD1-CB 3.85Å; I32-A54 WeakPolarHBondContact O-CA 3.5Å
55I98.2Very high97Very high1 Ų167.5 Ų67.51%0.00534%0.339CS..EExtended strand (participates in β ladder)trans-116.7126.7177.3-52.7-62.4000108.5A19 S31 I32 I59 R60 I69 L72A19-I55 HydrophobicContact CB-CD1 3.99Å; S31-I55 VanDerWaalsContact CA-O 3.31Å; S31-I55 WeakPolarHBondContact CA-O 3.33Å; I32-I55 HydrophobicContact CD1-CB 4.49Å; I32-I55 HydrophobicContact CG1-CB 4Å; I32-I55 PolarHBondContact N-O 2.77Å; I32-I55 PolarHBondContact O-N 3.12Å; I55-I59 HydrophobicContact CG2-CB 3.93Å; I55-I59 HydrophobicContact CG2-CG2 3.87Å; I55-R60 HydrophobicContact CG2-CG 3.87Å; I55-I69 HydrophobicContact CD1-CG1 4.38Å; I55-I69 HydrophobicContact CG1-CG1 4.31Å; I55-L72 HydrophobicContact CD1-CD1 4.27Å
56C97.9Very high97Very high2 Ų264 Ų641%0.01434%0.335CS..  trans-74.7154.6177.765.40000111.8C17 I24 A58 I59 R60C17-C56 HydrophobicContact CB-CB 3.92Å; C17-C56 PolarHBondContact SG-N 3.22Å; C17-C56 VanDerWaalsContact SG-N 3.38Å; C17-C56 VanDerWaalsContact SG-SG 3.62Å; I24-C56 HydrophobicContact CG1-CB 3.86Å; C56-A58 PolarHBondContact O-N 3.34Å; C56-I59 PolarHBondContact O-N 2.75Å; C56-R60 PolarHBondContact O-N 3.37Å
57G97.6Very high97Very high6 Ų661.6 Ų61.66%0.06233%0.328CS..Hα-helixtrans-60.9-27.9-17800000113.6D28 R60 R61D28-G57 WeakPolarHBondContact OD1-CA 3.23Å; D28-G57 PolarHBondContact OD1-N 3.24Å; D28-G57 PolarHBondContact OD2-N 3.17Å; G57-R60 PolarHBondContact O-N 2.96Å; G57-R61 WeakPolarHBondContact O-CB 3.49Å; G57-R61 PolarHBondContact O-N 2.79Å
58A97.1Very high97.1Very high18 Ų1858.7 Ų58.715%0.14931%0.313CS..Hα-helixtrans-62.8-45.1177.100000112.6R22 C56 R61 M62R22-A58 VanDerWaalsContact NH1-CB 3.31Å; C56-A58 PolarHBondContact O-N 3.34Å; A58-R61 PolarHBondContact O-N 3.5Å; A58-M62 WeakPolarHBondContact O-CG 3.45Å; A58-M62 PolarHBondContact O-N 3.09Å
59I97.2Very high97.2Very high19 Ų1958.4 Ų58.410%0.09730%0.3CS..Hα-helixtrans-65.4-42.6177.5-64.9-66.4000110.2I55 C56 R61 M62 G63 E64I55-I59 HydrophobicContact CG2-CB 3.93Å; I55-I59 HydrophobicContact CG2-CG2 3.87Å; C56-I59 PolarHBondContact O-N 2.75Å; I59-R61 VanDerWaalsContact C-N 3.34Å; I59-R61 PolarHBondContact O-N 2.81Å; I59-M62 HydrophobicContact CD1-CE 3.36Å; I59-M62 HydrophobicContact CG1-CE 4.32Å; I59-M62 PolarHBondContact O-N 2.78Å; I59-G63 PolarHBondContact O-N 3.07Å; I59-E64 HydrophobicContact CG2-CB 4.19Å; I59-E64 PolarHBondContact O-N 2.95Å
60R97.3Very high97.2Very high109 Ų10955.2 Ų55.241%0.41129%0.286SS..Hα-helixtrans-61.3-40.9177.3-66.6-178.470.2-155.31.4113.2A30 I55 C56 G57 M62 G63A30-R60 WeakPolarHBondContact O-CD 3.44Å; A30-R60 PolarHBondContact O-NH1 2.55Å; I55-R60 HydrophobicContact CG2-CG 3.87Å; C56-R60 PolarHBondContact O-N 3.37Å; G57-R60 PolarHBondContact O-N 2.96Å; R60-M62 VanDerWaalsContact C-N 3.29Å; R60-M62 PolarHBondContact O-N 3.39Å; R60-G63 PolarHBondContact O-N 3.07Å
61R97.3Very high97.2Very high217 Ų21758.5 Ų58.582%0.81929%0.291SS*.Hα-helixtrans-68.1-29.1178.1-176174.959.6-167.8-1.8112.9G57 A58 I59 G63G57-R61 WeakPolarHBondContact O-CB 3.49Å; G57-R61 PolarHBondContact O-N 2.79Å; A58-R61 PolarHBondContact O-N 3.5Å; I59-R61 VanDerWaalsContact C-N 3.34Å; I59-R61 PolarHBondContact O-N 2.81Å; R61-G63 PolarHBondContact O-N 2.82Å
62M96.9Very high97.2Very high117 Ų11756.4 Ų56.458%0.57628%0.283SS*.Hα-helixtrans-74.8-13.6176.2-68.7-175.3-53.900113.1A58 I59 R60 E64A58-M62 WeakPolarHBondContact O-CG 3.45Å; A58-M62 PolarHBondContact O-N 3.09Å; I59-M62 HydrophobicContact CD1-CE 3.36Å; I59-M62 HydrophobicContact CG1-CE 4.32Å; I59-M62 PolarHBondContact O-N 2.78Å; R60-M62 VanDerWaalsContact C-N 3.29Å; R60-M62 PolarHBondContact O-N 3.39Å; M62-E64 VanDerWaalsContact C-N 3.28Å; M62-E64 HydrophobicContact CB-CG 4.05Å
63G96.9Very high97.2Very high48 Ų4853.5 Ų53.550%0.49527%0.265SS..THydrogen-bonded Turntrans88.5-13.9-173.600000113.9I59 R60 R61 S65I59-G63 PolarHBondContact O-N 3.07Å; R60-G63 PolarHBondContact O-N 3.07Å; R61-G63 PolarHBondContact O-N 2.82Å; G63-S65 PolarHBondContact O-N 2.99Å
64E97.4Very high97.1Very high99 Ų9955.8 Ų55.846%0.46328%0.275SS..THydrogen-bonded Turntrans-74.715.8-176.4-58.2-60.9154.700114.8I59 M62 S68I59-E64 HydrophobicContact CG2-CB 4.19Å; I59-E64 PolarHBondContact O-N 2.95Å; M62-E64 VanDerWaalsContact C-N 3.28Å; M62-E64 HydrophobicContact CB-CG 4.05Å; E64-S68 VanDerWaalsContact O-CB 3.23Å; E64-S68 WeakPolarHBondContact O-CB 3.41Å; E64-S68 PolarHBondContact O-N 2.9Å; E64-S68 PolarHBondContact O-OG 3.38Å
65S97.1Very high96.9Very high21 Ų2159.3 Ų59.315%0.14730%0.304CS..Hα-helixtrans-75.7-35.6-175.1-171.50000112.6G63 I69G63-S65 PolarHBondContact O-N 2.99Å; S65-I69 WeakPolarHBondContact O-CD1 3.31Å; S65-I69 VanDerWaalsContact O-CG1 3.28Å; S65-I69 WeakPolarHBondContact O-CG1 3.48Å; S65-I69 PolarHBondContact O-N 3.4Å
66D97.1Very high96.7Very high118 Ų11862.3 Ų62.363%0.63132%0.321SS*.Hα-helixtrans-72.2-48-179.171.3-51.3000110.5S68 I69 L70D66-S68 VanDerWaalsContact C-N 3.3Å; D66-S68 PolarHBondContact O-N 3.43Å; D66-I69 PolarHBondContact O-N 3.19Å; D66-I69 VanDerWaalsContact O-N 3.12Å; D66-L70 WeakPolarHBondContact O-CB 3.49Å; D66-L70 PolarHBondContact O-N 2.95Å
67D97Very high96.5Very high79 Ų7965 Ų6542%0.42235%0.348SS..Hα-helixtrans-58-44.9176.3178.769.1000111I69 L70 R71D67-I69 VanDerWaalsContact C-N 3.33Å; D67-I69 PolarHBondContact O-N 3.45Å; D67-L70 PolarHBondContact O-N 3.47Å; D67-R71 WeakPolarHBondContact O-CB 3.33Å; D67-R71 PolarHBondContact O-N 2.99Å
68S97.2Very high96.3Very high9 Ų968.1 Ų68.16%0.06337%0.366CS..Hα-helixtrans-57.1-44.7176.4-70.70000112.5E64 D66 L72E64-S68 VanDerWaalsContact O-CB 3.23Å; E64-S68 WeakPolarHBondContact O-CB 3.41Å; E64-S68 PolarHBondContact O-N 2.9Å; E64-S68 PolarHBondContact O-OG 3.38Å; D66-S68 VanDerWaalsContact C-N 3.3Å; D66-S68 PolarHBondContact O-N 3.43Å; S68-L72 WeakPolarHBondContact O-CB 3.47Å; S68-L72 WeakPolarHBondContact O-CD1 3.33Å; S68-L72 WeakPolarHBondContact O-CG 3.4Å; S68-L72 PolarHBondContact O-N 2.97Å
69I96.9Very high96.2Very high41 Ų4169.1 Ų69.121%0.2137%0.37CS..Hα-helixtrans-69.2-43.1179-70169000110.3I34 I55 S65 D66 D67 R71 L72 A73I34-I69 HydrophobicContact CD1-CD1 3.87Å; I55-I69 HydrophobicContact CD1-CG1 4.38Å; I55-I69 HydrophobicContact CG1-CG1 4.31Å; S65-I69 WeakPolarHBondContact O-CD1 3.31Å; S65-I69 VanDerWaalsContact O-CG1 3.28Å; S65-I69 WeakPolarHBondContact O-CG1 3.48Å; S65-I69 PolarHBondContact O-N 3.4Å; D66-I69 PolarHBondContact O-N 3.19Å; D66-I69 VanDerWaalsContact O-N 3.12Å; D67-I69 VanDerWaalsContact C-N 3.33Å; D67-I69 PolarHBondContact O-N 3.45Å; I69-R71 VanDerWaalsContact C-N 3.34Å; I69-R71 PolarHBondContact O-N 3.42Å; I69-L72 PolarHBondContact O-N 2.86Å; I69-A73 WeakPolarHBondContact O-CB 3.27Å; I69-A73 PolarHBondContact O-N 3.43Å
70L96.8Very high96Very high55 Ų5571 Ų7129%0.28839%0.388SS..Hα-helixtrans-58.8-47.1177.8177.761.2000111D66 D67 A73 K74 V79 F83D66-L70 WeakPolarHBondContact O-CB 3.49Å; D66-L70 PolarHBondContact O-N 2.95Å; D67-L70 PolarHBondContact O-N 3.47Å; L70-A73 PolarHBondContact O-N 3.36Å; L70-K74 HydrophobicContact CD1-CG 4.38Å; L70-K74 WeakPolarHBondContact O-CB 3.44Å; L70-K74 WeakPolarHBondContact O-CG 3.42Å; L70-K74 PolarHBondContact O-N 3.2Å; L70-V79 HydrophobicContact CD1-CG1 4.07Å; L70-V79 HydrophobicContact CD1-CG2 4.25Å; L70-F83 HydrophobicContact CD1-CD1 4.07Å; L70-F83 HydrophobicContact CD1-CE1 4.06Å; L70-F83 HydrophobicContact CD2-CD1 4.4Å; L70-F83 HydrophobicContact CD2-CE1 4.05Å
71R96.2Very high95.7Very high121 Ų12174.9 Ų74.946%0.45741%0.408SS..Hα-helixtrans-61.7-44.9177.8-175.1179.160.778.4-2.3112A19 D67 I69 A75A19-R71 PolarHBondContact O-NH2 2.74Å; D67-R71 WeakPolarHBondContact O-CB 3.33Å; D67-R71 PolarHBondContact O-N 2.99Å; I69-R71 VanDerWaalsContact C-N 3.34Å; I69-R71 PolarHBondContact O-N 3.42Å; R71-A75 WeakPolarHBondContact O-CB 3.24Å; R71-A75 PolarHBondContact O-N 2.69Å
72L96.6Very high95.3Very high21 Ų2171.7 Ų71.711%0.1141%0.407CS..Hα-helixtrans-63.2-47176.6-72.3168.9000111.2Y53 I55 S68 I69 K74 A75 D76Y53-L72 HydrophobicContact CD1-CB 4.12Å; Y53-L72 HydrophobicContact CD1-CD1 3.89Å; Y53-L72 HydrophobicContact CD1-CG 4.45Å; Y53-L72 HydrophobicContact CE1-CB 3.79Å; Y53-L72 HydrophobicContact CE1-CD1 4.41Å; Y53-L72 HydrophobicContact CE1-CG 4.49Å; Y53-L72 HydrophobicContact CG-CD1 4.33Å; I55-L72 HydrophobicContact CD1-CD1 4.27Å; S68-L72 WeakPolarHBondContact O-CB 3.47Å; S68-L72 WeakPolarHBondContact O-CD1 3.33Å; S68-L72 WeakPolarHBondContact O-CG 3.4Å; S68-L72 PolarHBondContact O-N 2.97Å; I69-L72 PolarHBondContact O-N 2.86Å; L72-K74 PolarHBondContact O-N 3.17Å; L72-A75 WeakPolarHBondContact O-CB 3.44Å; L72-A75 PolarHBondContact O-N 3.43Å; L72-D76 WeakPolarHBondContact O-CB 3.31Å; L72-D76 PolarHBondContact O-N 2.94Å
73A96.2Very high94.3Very high4 Ų474.3 Ų74.33%0.03342%0.416CS..Hα-helixtrans-64.4-36.5179.700000112.7I69 L70 G77 V78 V79I69-A73 WeakPolarHBondContact O-CB 3.27Å; I69-A73 PolarHBondContact O-N 3.43Å; L70-A73 PolarHBondContact O-N 3.36Å; A73-G77 PolarHBondContact O-N 3.46Å; A73-G77 VanDerWaalsContact O-N 3.17Å; A73-V78 HydrophobicContact CB-CB 4.1Å; A73-V78 HydrophobicContact CB-CG1 4.45Å; A73-V78 WeakPolarHBondContact O-CB 3.16Å; A73-V78 PolarHBondContact O-N 2.94Å; A73-V79 HydrophobicContact CB-CB 4.48Å; A73-V79 HydrophobicContact CB-CG2 3.78Å; A73-V79 PolarHBondContact O-N 3.31Å; A73-V79 VanDerWaalsContact O-N 3.17Å
74K95.9Very high94.2Very high56 Ų5675.7 Ų75.724%0.24341%0.412CS..Hα-helixtrans-64.6-45.7171.1-77.4-174.7-175.5-1710111.7L70 L72 D76 G77 V79 F83L70-K74 HydrophobicContact CD1-CG 4.38Å; L70-K74 WeakPolarHBondContact O-CB 3.44Å; L70-K74 WeakPolarHBondContact O-CG 3.42Å; L70-K74 PolarHBondContact O-N 3.2Å; L72-K74 PolarHBondContact O-N 3.17Å; K74-D76 PolarHBondContact O-N 3.39Å; K74-G77 PolarHBondContact O-N 3.16Å; K74-G77 VanDerWaalsContact O-N 3.14Å; K74-V79 HydrophobicContact CG-CB 3.8Å; K74-V79 HydrophobicContact CG-CG1 3.76Å; K74-F83 PolarHBondContact NZ-O 3.19Å; K74-F83 PolarHBondContact NZ-OXT 3.13Å
75A94.4Very high94.1Very high84 Ų8474.4 Ų74.469%0.69441%0.409SS*.Hα-helixtrans-60.6-38.1178.600000111.7R71 L72 G77R71-A75 WeakPolarHBondContact O-CB 3.24Å; R71-A75 PolarHBondContact O-N 2.69Å; L72-A75 WeakPolarHBondContact O-CB 3.44Å; L72-A75 PolarHBondContact O-N 3.43Å; A75-G77 VanDerWaalsContact C-N 3.29Å; A75-G77 PolarHBondContact O-N 3.1Å
76D94.4Very high93.9Very high65 Ų6577.4 Ų77.435%0.34842%0.424SS..THydrogen-bonded Turntrans-865179.7-76.9-37.4000114.5K51 Y53 L72 K74 V78K51-D76 HydrophobicContact CD-CB 3.98Å; K51-D76 WeakPolarHBondContact CE-OD1 3.49Å; K51-D76 WeakPolarHBondContact CE-OD2 3.42Å; K51-D76 VanDerWaalsContact NZ-CB 3.34Å; K51-D76 IonicContact NZ-OD1 2.71Å; K51-D76 PolarHBondContact NZ-OD1 3.04Å; K51-D76 IonicContact NZ-OD2 3.46Å; K51-D76 PolarHBondContact NZ-OD2 2.77Å; Y53-D76 VanDerWaalsContact CE1-OD2 3.28Å; Y53-D76 WeakPolarHBondContact CE1-OD2 3.44Å; Y53-D76 WeakPolarHBondContact OH-CB 3.38Å; Y53-D76 PolarHBondContact OH-OD2 3.24Å; L72-D76 WeakPolarHBondContact O-CB 3.31Å; L72-D76 PolarHBondContact O-N 2.94Å; K74-D76 PolarHBondContact O-N 3.39Å; D76-V78 HydrophobicContact CB-CG2 4.41Å; D76-V78 PolarHBondContact O-N 3.22Å
77G93.1Very high93.7Very high57 Ų5775 Ų7559%0.58841%0.412SS*.THydrogen-bonded Turntrans70.914.4175.300000114.8A73 K74 A75A73-G77 PolarHBondContact O-N 3.46Å; A73-G77 VanDerWaalsContact O-N 3.17Å; K74-G77 PolarHBondContact O-N 3.16Å; K74-G77 VanDerWaalsContact O-N 3.14Å; A75-G77 VanDerWaalsContact C-N 3.29Å; A75-G77 PolarHBondContact O-N 3.1Å
78V93.1Very high93.5Very high72 Ų7274.8 Ų74.844%0.43641%0.411SS..SBendtrans-75-41.1173.9177.80000110.2I36 A73 D76I36-V78 HydrophobicContact CG2-CG1 4.03Å; A73-V78 HydrophobicContact CB-CB 4.1Å; A73-V78 HydrophobicContact CB-CG1 4.45Å; A73-V78 WeakPolarHBondContact O-CB 3.16Å; A73-V78 PolarHBondContact O-N 2.94Å; D76-V78 HydrophobicContact CB-CG2 4.41Å; D76-V78 PolarHBondContact O-N 3.22Å
79V95.1Very high93.2Very high40 Ų4079.1 Ų79.124%0.24243%0.434CS..SBendtrans-99.9143173.5176.10000109L70 A73 K74 F83L70-V79 HydrophobicContact CD1-CG1 4.07Å; L70-V79 HydrophobicContact CD1-CG2 4.25Å; A73-V79 HydrophobicContact CB-CB 4.48Å; A73-V79 HydrophobicContact CB-CG2 3.78Å; A73-V79 PolarHBondContact O-N 3.31Å; A73-V79 VanDerWaalsContact O-N 3.17Å; K74-V79 HydrophobicContact CG-CB 3.8Å; K74-V79 HydrophobicContact CG-CG1 3.76Å; V79-F83 HydrophobicContact CG1-CB 4.05Å; V79-F83 HydrophobicContact CG1-CD1 4.37Å; V79-F83 HydrophobicContact CG1-CG 4.25Å
80A93.3Very high93Very high57 Ų5781.9 Ų81.947%0.47145%0.45SS..  trans-61141.7179.200000111.6N82 F83A80-N82 WeakPolarHBondContact CB-OD1 3.42Å; A80-N82 PolarHBondContact O-N 3.08Å; A80-F83 WeakPolarHBondContact O-CB 3.36Å; A80-F83 PolarHBondContact O-N 3.32Å
81K90.1Very high92.7Very high192 Ų19283.9 Ų83.984%0.83546%0.463SS*.THydrogen-bonded Turntrans-69.3-19.5-175.1-66.3-173.9178.7-177.90114.1
82N89.6Confident92.4Very high149 Ų14980.8 Ų80.880%0.79746%0.463SS*.THydrogen-bonded Turntrans-947.1-178.861.6-34.9000113.5A80A80-N82 WeakPolarHBondContact CB-OD1 3.42Å; A80-N82 PolarHBondContact O-N 3.08Å
83F76.8Confident92Very high173 Ų17386.3 Ų86.376%0.75950%0.495SS*.  trans-77.90169.5-171.3-95.2000111.2L70 K74 V79 A80L70-F83 HydrophobicContact CD1-CD1 4.07Å; L70-F83 HydrophobicContact CD1-CE1 4.06Å; L70-F83 HydrophobicContact CD2-CD1 4.4Å; L70-F83 HydrophobicContact CD2-CE1 4.05Å; K74-F83 PolarHBondContact NZ-O 3.19Å; K74-F83 PolarHBondContact NZ-OXT 3.13Å; V79-F83 HydrophobicContact CG1-CB 4.05Å; V79-F83 HydrophobicContact CG1-CD1 4.37Å; V79-F83 HydrophobicContact CG1-CG 4.25Å; A80-F83 WeakPolarHBondContact O-CB 3.36Å; A80-F83 PolarHBondContact O-N 3.32Å

Retrieved 83 of 83 residues in 221.6 ms (Link to these results)

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