A0A077ZM71_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZM71, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 104 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
1M66.1Low90.4Very high241 Ų241123.4 Ų123.4100%1.18762%0.62SS**  0115.50-157.8178.2-75.700107
2A77.8Confident91Very high97 Ų97122.3 Ų122.380%0.80261%0.608SS**PPolyproline II helixtrans-66.7136.7-179.100000109.6K4A2-K4 PolarHBondContact O-N 3.13Å
3R84.1Confident91.5Very high247 Ų247113.5 Ų113.593%0.93257%0.565SS**PPolyproline II helixtrans-63.2129.8176.2-73.3-179170.9171.2-2.6108.3
4K91Very high91.9Very high158 Ų158105.6 Ų105.669%0.68753%0.526SS*.PPolyproline II helixtrans-61.2134.7172.6-69.6-173177.7-1740108.8A2A2-K4 PolarHBondContact O-N 3.13Å
5P95.5Very high92.3Very high74 Ų7499.4 Ų99.448%0.48150%0.495SS..PPolyproline II helixtrans-65.2143.1175.429.8-34.8000110.1E77P5-E77 HydrophobicContact CB-CG 4.2Å; P5-E77 WeakPolarHBondContact CB-OE2 3.17Å; P5-E77 HydrophobicContact CG-CB 4.32Å; P5-E77 HydrophobicContact CG-CG 4.4Å; P5-E77 WeakPolarHBondContact CG-OE2 3.18Å; P5-E77 PolarHBondContact O-N 2.93Å
6M96.4Very high92.7Very high95 Ų9593.2 Ų93.247%0.46846%0.464SS..EExtended strand (participates in β ladder)trans-126.9133.8-171.9-65-67.5-69.200109.7T8 P76M6-T8 HydrophobicContact CB-CG2 4.34Å; M6-P76 HydrophobicContact SD-CB 4.44Å; M6-P76 HydrophobicContact SD-CG 4.22Å
7V97.2Very high93Very high45 Ų4588.6 Ų88.627%0.27344%0.443SS..EExtended strand (participates in β ladder)trans-86.2124.5163.8-1780000107.5G74 M75 E77 F80V7-G74 CarbonylContact O-C 3.52Å; V7-G74 WeakPolarHBondContact O-CA 3.34Å; V7-M75 PolarHBondContact N-O 3.27Å; V7-M75 PolarHBondContact O-N 2.68Å; V7-E77 HydrophobicContact CG2-CB 4.49Å; V7-E77 HydrophobicContact CG2-CG 3.62Å; V7-F80 HydrophobicContact CB-CB 4.44Å; V7-F80 HydrophobicContact CB-CD2 4.48Å; V7-F80 HydrophobicContact CB-CG 4.38Å; V7-F80 HydrophobicContact CG1-CD2 4.17Å; V7-F80 HydrophobicContact CG1-CE2 4.38Å; V7-F80 HydrophobicContact CG1-CG 4.43Å; V7-F80 HydrophobicContact CG2-CB 3.88Å; V7-F80 HydrophobicContact CG2-CD1 4.07Å; V7-F80 HydrophobicContact CG2-CD2 4.4Å; V7-F80 HydrophobicContact CG2-CG 3.85Å
8T97.3Very high93.2Very high92 Ų9283.7 Ų83.756%0.56442%0.418SS*.EExtended strand (participates in β ladder)trans-125.614417860.40000111.5M6 L73M6-T8 HydrophobicContact CB-CG2 4.34Å; T8-L73 CarbonylContact C-O 3.6Å; T8-L73 VanDerWaalsContact CA-O 3.26Å; T8-L73 WeakPolarHBondContact CA-O 3.4Å
9R96.3Very high93.4Very high177 Ų17782.5 Ų82.567%0.66841%0.413SS*.EExtended strand (participates in β ladder)trans-147.4134.4172.7-169.6175.6178.7-150.80.8111I11 L73R9-I11 HydrophobicContact CB-CG1 4.31Å; R9-I11 HydrophobicContact CG-CD1 4.36Å; R9-I11 HydrophobicContact CG-CG1 3.87Å; R9-L73 PolarHBondContact N-O 3.19Å; R9-L73 PolarHBondContact O-N 2.8Å
10T96.9Very high93.6Very high81 Ų8178.4 Ų78.450%0.49739%0.393SS..EExtended strand (participates in β ladder)trans-82127166.5-51.90000109.4E70 K71T10-E70 HydrophobicContact CG2-CB 4.22Å; T10-K71 WeakPolarHBondContact CA-O 3.32Å
11I96Very high93.8Very high50 Ų5078.2 Ų78.226%0.25639%0.392SS..EExtended strand (participates in β ladder)trans-131.7138.7-178.3-54.1178.5000108.9R9 V13 K71R9-I11 HydrophobicContact CB-CG1 4.31Å; R9-I11 HydrophobicContact CG-CD1 4.36Å; R9-I11 HydrophobicContact CG-CG1 3.87Å; I11-V13 HydrophobicContact CG2-CG1 4.47Å; I11-K71 PolarHBondContact N-O 2.96Å; I11-K71 PolarHBondContact O-N 3.3Å
12K97.1Very high95.2Very high110 Ų11068.3 Ų68.348%0.47834%0.344SS..EExtended strand (participates in β ladder)trans-75.8120.6165.3-72.9-177.8179.1-174.80109.5R37 T38 V68 E69 E70K12-R37 WeakPolarHBondContact O-CA 3.44Å; K12-R37 PolarHBondContact O-N 3.25Å; K12-T38 HydrophobicContact CB-CG2 4Å; K12-T38 HydrophobicContact CD-CG2 4.34Å; K12-V68 HydrophobicContact CB-CG1 4.24Å; K12-V68 HydrophobicContact CG-CG1 4.47Å; K12-E69 WeakPolarHBondContact CA-O 3.34Å; K12-E70 WeakPolarHBondContact CE-OE1 2.89Å; K12-E70 HydrophobicContact CG-CG 3.67Å; K12-E70 IonicContact NZ-OE1 3.72Å
13V97.3Very high96Very high8 Ų868.2 Ų68.25%0.04833%0.329CS..EExtended strand (participates in β ladder)trans-112.6148.6174.1-58.40000109.6I11 T34 L35 V68 E69 K71I11-V13 HydrophobicContact CG2-CG1 4.47Å; V13-T34 HydrophobicContact CB-CG2 3.91Å; V13-T34 HydrophobicContact CG1-CG2 4.21Å; V13-T34 HydrophobicContact CG2-CG2 4.01Å; V13-L35 WeakPolarHBondContact CA-O 3.41Å; V13-V68 WeakPolarHBondContact O-CA 3.2Å; V13-E69 HydrophobicContact CG2-CG 3.53Å; V13-E69 PolarHBondContact N-O 3.46Å; V13-E69 PolarHBondContact O-N 3.35Å; V13-K71 HydrophobicContact CG2-CD 3.95Å; V13-K71 HydrophobicContact CG2-CG 4.26Å
14T98.1Very high96.5Very high4 Ų463.8 Ų63.83%0.02532%0.319CS..EExtended strand (participates in β ladder)trans-100.2121.5169.7-56.20000108.1L35 R37 T38 Y39 L45 W67T14-L35 PolarHBondContact N-O 3.33Å; T14-L35 PolarHBondContact O-N 2.78Å; T14-R37 PolarHBondContact N-O 3.34Å; T14-R37 PolarHBondContact OG1-O 3.12Å; T14-T38 WeakPolarHBondContact OG1-CA 3.46Å; T14-Y39 HydrophobicContact CG2-CD2 4.18Å; T14-L45 HydrophobicContact CG2-CD1 3.75Å; T14-L45 HydrophobicContact CG2-CD2 4.07Å; T14-W67 CarbonylContact C-O 3.56Å; T14-W67 WeakPolarHBondContact CA-O 3.36Å
15Q97.6Very high96.6Very high12 Ų1262.8 Ų62.86%0.05632%0.317CS..EExtended strand (participates in β ladder)trans-88.9137.4166.3-62.5-61.4-13.700108.4V33 T34 S66 W67 E69 K71Q15-V33 WeakPolarHBondContact CA-O 3.33Å; Q15-V33 PolarHBondContact OE1-O 3Å; Q15-T34 VanDerWaalsContact CD-OG1 3.24Å; Q15-T34 PolarHBondContact NE2-OG1 3.43Å; Q15-T34 PolarHBondContact OE1-OG1 3.32Å; Q15-S66 CarbonylContact O-C 3.54Å; Q15-S66 WeakPolarHBondContact O-CA 3.15Å; Q15-W67 HydrophobicContact CB-CD2 3.59Å; Q15-W67 HydrophobicContact CB-CE3 3.89Å; Q15-W67 HydrophobicContact CB-CG 4.24Å; Q15-W67 HydrophobicContact CB-CH2 3.65Å; Q15-W67 HydrophobicContact CB-CZ2 3.32Å; Q15-W67 HydrophobicContact CB-CZ3 3.92Å; Q15-W67 HydrophobicContact CG-CD2 4.31Å; Q15-W67 HydrophobicContact CG-CH2 4.35Å; Q15-W67 HydrophobicContact CG-CZ2 3.59Å; Q15-W67 PolarHBondContact N-O 2.77Å; Q15-W67 PolarHBondContact O-N 3.42Å; Q15-E69 HydrophobicContact CG-CG 4.31Å; Q15-E69 PolarHBondContact NE2-OE1 2.96Å; Q15-K71 VanDerWaalsContact NE2-NZ 3.12Å
16A97.7Very high96.5Very high0 Ų061.8 Ų61.80%032%0.32CS..EExtended strand (participates in β ladder)trans-138.8131.2176.200000111.1V18 E32 V33 L45 I63 K65A16-V18 HydrophobicContact CB-CG2 4.17Å; A16-E32 WeakPolarHBondContact O-CA 3.38Å; A16-V33 HydrophobicContact CB-CG2 3.98Å; A16-V33 PolarHBondContact N-O 3.21Å; A16-V33 PolarHBondContact O-N 3.14Å; A16-L45 HydrophobicContact CB-CD1 4.32Å; A16-L45 HydrophobicContact CB-CD2 4.07Å; A16-L45 HydrophobicContact CB-CG 4.4Å; A16-I63 HydrophobicContact CB-CD1 4.36Å; A16-K65 CarbonylContact C-O 3.52Å; A16-K65 VanDerWaalsContact CA-O 3.31Å; A16-K65 WeakPolarHBondContact CA-O 3.48Å
17C97.6Very high96.3Very high16 Ų1662.9 Ų62.911%0.10832%0.324CS..EExtended strand (participates in β ladder)trans-86.1110.2162.6-55.90000107.2T30 S64 K65C17-T30 HydrophobicContact CB-CG2 4.1Å; C17-S64 PolarHBondContact O-N 3.41Å; C17-K65 HydrophobicContact CB-CB 4.1Å; C17-K65 PolarHBondContact N-O 2.85Å; C17-K65 PolarHBondContact O-N 3.36Å
18V97.7Very high96.3Very high0 Ų065.3 Ų65.30%034%0.341CS..EExtended strand (participates in β ladder)trans-102.6125.1-176.2-171.60000108.1A16 T30 K31 V33 L46 A49 A60 I63A16-V18 HydrophobicContact CB-CG2 4.17Å; V18-T30 WeakPolarHBondContact O-CA 3.35Å; V18-K31 PolarHBondContact N-O 2.82Å; V18-K31 PolarHBondContact O-N 3.31Å; V18-V33 HydrophobicContact CG2-CG2 3.66Å; V18-L46 HydrophobicContact CG1-CD1 4.47Å; V18-A49 HydrophobicContact CG1-CB 4.46Å; V18-A49 HydrophobicContact CG2-CB 3.87Å; V18-A60 HydrophobicContact CG1-CB 3.55Å; V18-I63 HydrophobicContact CG1-CD1 4.41Å; V18-I63 HydrophobicContact CG2-CD1 3.93Å
19L97.6Very high96.2Very high60 Ų6063 Ų6331%0.31433%0.328SS..EExtended strand (participates in β ladder)trans-76.4123.1167.6-177.267000107.9P28 V61 S62L19-P28 HydrophobicContact CD1-CB 4.16Å; L19-V61 PolarHBondContact O-N 2.75Å; L19-S62 PolarHBondContact N-O 2.83Å; L19-S62 PolarHBondContact O-N 3.02Å
20C97Very high96.2Very high1 Ų158.8 Ų58.81%0.00732%0.322CS..EExtended strand (participates in β ladder)trans-118.9154.6179.1-60.20000110.2P28 C29 L58 K59C20-P28 CarbonylContact O-C 3.56Å; C20-P28 WeakPolarHBondContact O-CA 3.48Å; C20-C29 WeakPolarHBondContact CA-O 3.5Å; C20-C29 PolarHBondContact N-O 2.84Å; C20-C29 PolarHBondContact O-N 3.23Å; C20-C29 VanDerWaalsContact O-O 3.12Å; C20-L58 HydrophobicContact CB-CD1 3.81Å; C20-L58 HydrophobicContact CB-CD2 4.42Å; C20-L58 HydrophobicContact CB-CG 4.02Å; C20-K59 CarbonylContact C-O 3.45Å; C20-K59 WeakPolarHBondContact CA-O 3.43Å
21L97.3Very high96.1Very high74 Ų7459.6 Ų59.639%0.38732%0.318SS..EExtended strand (participates in β ladder)trans-109.3123168.9-174.968000108.5K59 V61L21-K59 PolarHBondContact N-O 3.03Å; L21-K59 PolarHBondContact O-N 2.96Å; L21-V61 HydrophobicContact CB-CG2 4Å
22D96.3Very high96.2Very high34 Ų3464 Ų6418%0.18234%0.338CS..EExtended strand (participates in β ladder)trans-82115.2166.4-168.1-47.1000108.3E24 Q25 G26 E27 T57 L58D22-E24 PolarHBondContact OD1-N 2.78Å; D22-Q25 HydrophobicContact CB-CB 4.42Å; D22-Q25 PolarHBondContact OD1-N 2.82Å; D22-Q25 VanDerWaalsContact OD1-N 3.13Å; D22-G26 CarbonylContact O-C 3.58Å; D22-G26 WeakPolarHBondContact O-CA 3.46Å; D22-G26 PolarHBondContact O-N 2.89Å; D22-E27 PolarHBondContact N-O 2.99Å; D22-E27 PolarHBondContact O-N 2.89Å; D22-T57 CarbonylContact C-O 3.6Å; D22-L58 HydrophobicContact CB-CD1 4.25Å
23I94.8Very high96.1Very high94 Ų9459.7 Ų59.748%0.48232%0.321SS..THydrogen-bonded Turntrans-74.5-30.9-176.2-62.3170.4000111T57 K59I23-T57 PolarHBondContact N-O 2.83Å; I23-K59 HydrophobicContact CD1-CG 3.64Å; I23-K59 HydrophobicContact CG1-CG 4.42Å
24E93.5Very high96.1Very high154 Ų15463.1 Ų63.172%0.7234%0.342SS*.THydrogen-bonded Turntrans-72.9-42.6-179.3-66.4-170.7160.300111D22 T57D22-E24 PolarHBondContact OD1-N 2.78Å; E24-T57 VanDerWaalsContact CD-CG2 3.48Å; E24-T57 HydrophobicContact CG-CG2 3.67Å; E24-T57 WeakPolarHBondContact OE1-CG2 2.99Å
25Q93.9Very high96.1Very high138 Ų13863.7 Ų63.765%0.64535%0.345SS*.THydrogen-bonded Turntrans-89-21.2-179.8-60.4-169.2-19.400112.9D22 E27D22-Q25 HydrophobicContact CB-CB 4.42Å; D22-Q25 PolarHBondContact OD1-N 2.82Å; D22-Q25 VanDerWaalsContact OD1-N 3.13Å; Q25-E27 HydrophobicContact CB-CB 4.37Å; Q25-E27 HydrophobicContact CB-CG 4.26Å; Q25-E27 PolarHBondContact O-N 2.75Å
26G92.2Very high95.8Very high53 Ų5366.5 Ų66.555%0.54637%0.366SS..  trans71.616.2-172.900000113.4D22D22-G26 CarbonylContact O-C 3.58Å; D22-G26 WeakPolarHBondContact O-CA 3.46Å; D22-G26 PolarHBondContact O-N 2.89Å
27E93.6Very high95.6Very high118 Ų11875.6 Ų75.655%0.55140%0.4SS*.  trans-105.7139.7-173.6-66.9-170.8174.300112.1D22 Q25D22-E27 PolarHBondContact N-O 2.99Å; D22-E27 PolarHBondContact O-N 2.89Å; Q25-E27 HydrophobicContact CB-CB 4.37Å; Q25-E27 HydrophobicContact CB-CG 4.26Å; Q25-E27 PolarHBondContact O-N 2.75Å
28P95.5Very high95.5Very high96 Ų9678.6 Ų78.662%0.62342%0.418SS*.EExtended strand (participates in β ladder)trans-73.5133.9169.730.2-31.8000110.1L19 C20L19-P28 HydrophobicContact CD1-CB 4.16Å; C20-P28 CarbonylContact O-C 3.56Å; C20-P28 WeakPolarHBondContact O-CA 3.48Å
29C95.3Very high95.4Very high43 Ų4381.9 Ų81.929%0.29143%0.431SS..EExtended strand (participates in β ladder)trans-131.7155.5173650000111.4C20 L58C20-C29 WeakPolarHBondContact CA-O 3.5Å; C20-C29 PolarHBondContact N-O 2.84Å; C20-C29 PolarHBondContact O-N 3.23Å; C20-C29 VanDerWaalsContact O-O 3.12Å; C29-L58 VanDerWaalsContact SG-CD1 3.59Å
30T96.4Very high95.3Very high89 Ų8989 Ų8955%0.54646%0.46SS..EExtended strand (participates in β ladder)trans-105.6129.3177.5-59.20000109.7C17 V18C17-T30 HydrophobicContact CB-CG2 4.1Å; V18-T30 WeakPolarHBondContact O-CA 3.35Å
31K96.1Very high95.2Very high97 Ų9792.6 Ų92.642%0.42248%0.479SS..EExtended strand (participates in β ladder)trans-116.9135.5171.5-74.8-159.9174.9179.70111.6V18 V53 L58V18-K31 PolarHBondContact N-O 2.82Å; V18-K31 PolarHBondContact O-N 3.31Å; K31-V53 HydrophobicContact CD-CG1 4.04Å; K31-L58 HydrophobicContact CD-CD2 3.7Å
32E97.1Very high95.1Very high144 Ų14493.3 Ų93.367%0.67348%0.483SS*.EExtended strand (participates in β ladder)trans-87.5131.4168.4-66.8-170.4170.500110A16A16-E32 WeakPolarHBondContact O-CA 3.38Å
33V96.5Very high95.1Very high18 Ų1899 Ų9911%0.10951%0.508CS..EExtended strand (participates in β ladder)trans-128.1139.4174.8-63.50000111.7Q15 A16 V18 L35 A49 V53Q15-V33 WeakPolarHBondContact CA-O 3.33Å; Q15-V33 PolarHBondContact OE1-O 3Å; A16-V33 HydrophobicContact CB-CG2 3.98Å; A16-V33 PolarHBondContact N-O 3.21Å; A16-V33 PolarHBondContact O-N 3.14Å; V18-V33 HydrophobicContact CG2-CG2 3.66Å; V33-L35 HydrophobicContact CG2-CD1 4.21Å; V33-L35 HydrophobicContact CG2-CG 4.14Å; V33-A49 HydrophobicContact CG2-CB 4.43Å; V33-V53 HydrophobicContact CG1-CG2 3.28Å
34T97Very high95.2Very high81 Ų8197.5 Ų97.550%0.49750%0.504SS..EExtended strand (participates in β ladder)trans-100.3114.4168.9-58.10000108.7V13 Q15V13-T34 HydrophobicContact CB-CG2 3.91Å; V13-T34 HydrophobicContact CG1-CG2 4.21Å; V13-T34 HydrophobicContact CG2-CG2 4.01Å; Q15-T34 VanDerWaalsContact CD-OG1 3.24Å; Q15-T34 PolarHBondContact NE2-OG1 3.43Å; Q15-T34 PolarHBondContact OE1-OG1 3.32Å
35L96.8Very high95.4Very high16 Ų1690.3 Ų90.38%0.08447%0.47CS..EExtended strand (participates in β ladder)trans-108.8140.4177.9-64.3172.4000110.4V13 T14 V33 Y39 L45 A48 A49 A52V13-L35 WeakPolarHBondContact CA-O 3.41Å; T14-L35 PolarHBondContact N-O 3.33Å; T14-L35 PolarHBondContact O-N 2.78Å; V33-L35 HydrophobicContact CG2-CD1 4.21Å; V33-L35 HydrophobicContact CG2-CG 4.14Å; L35-Y39 HydrophobicContact CB-CE2 3.89Å; L35-Y39 HydrophobicContact CD1-CE2 4.29Å; L35-L45 HydrophobicContact CD1-CD1 3.59Å; L35-A48 HydrophobicContact CD1-CB 3.98Å; L35-A49 HydrophobicContact CD1-CB 4.23Å; L35-A52 HydrophobicContact CD2-CB 3.89Å
36S93.2Very high95.5Very high71 Ų7185.2 Ų85.250%0.49745%0.447SS..EExtended strand (participates in β ladder)trans-67145.2173.172.40000110.1Y39S36-Y39 PolarHBondContact O-OH 3.45Å
37R92.1Very high95.8Very high191 Ų19190.6 Ų90.672%0.72146%0.455SS*.SBendtrans75.8177.7178.2-44.3172.4-177.2-164.5-0.6113.2K12 T14K12-R37 WeakPolarHBondContact O-CA 3.44Å; K12-R37 PolarHBondContact O-N 3.25Å; T14-R37 PolarHBondContact N-O 3.34Å; T14-R37 PolarHBondContact OG1-O 3.12Å
38T95.4Very high95.9Very high79 Ų7986 Ų8649%0.48544%0.438SS..  trans-107.8147.9173.959.20000110K12 T14 V68K12-T38 HydrophobicContact CB-CG2 4Å; K12-T38 HydrophobicContact CD-CG2 4.34Å; T14-T38 WeakPolarHBondContact OG1-CA 3.46Å; T38-V68 HydrophobicContact CG2-CB 4.45Å; T38-V68 HydrophobicContact CG2-CG1 3.64Å; T38-V68 HydrophobicContact CG2-CG2 3.88Å
39Y96.5Very high96Very high69 Ų6981.5 Ų81.527%0.27141%0.408SS..  trans-113.8149.2-178-63.2-92.7000110.1T14 L35 S36 L45 A48T14-Y39 HydrophobicContact CG2-CD2 4.18Å; L35-Y39 HydrophobicContact CB-CE2 3.89Å; L35-Y39 HydrophobicContact CD1-CE2 4.29Å; S36-Y39 PolarHBondContact O-OH 3.45Å; Y39-L45 HydrophobicContact CD1-CB 4.48Å; Y39-L45 HydrophobicContact CD2-CB 4.47Å; Y39-L45 HydrophobicContact CD2-CD1 3.53Å; Y39-L45 HydrophobicContact CE2-CD1 3.86Å; Y39-L45 HydrophobicContact CG-CB 4.03Å; Y39-L45 HydrophobicContact CG-CD1 3.95Å; Y39-A48 HydrophobicContact CD1-CB 4.43Å; Y39-A48 HydrophobicContact CE1-CB 3.42Å; Y39-A48 VanDerWaalsContact CE1-CB 3.42Å; Y39-A48 WeakPolarHBondContact OH-CB 3.22Å
40K94.2Very high96.1Very high210 Ų21083.5 Ų83.591%0.91341%0.412SS*.SBendtrans-77.4-32.8-175.3-68.3-175.8177.3-177.70112.3
41N95.2Very high96.1Very high76 Ų7683.8 Ų83.841%0.40642%0.423SS..SBendtrans-155.1165.5-175.759.916.1000110.1E43 T44 L45N41-E43 PolarHBondContact O-N 2.81Å; N41-T44 PolarHBondContact N-OG1 3.21Å; N41-T44 PolarHBondContact O-N 3.45Å; N41-T44 PolarHBondContact O-OG1 3.28Å; N41-T44 WeakPolarHBondContact OD1-CB 3.18Å; N41-T44 VanDerWaalsContact OD1-CG2 3.27Å; N41-T44 WeakPolarHBondContact OD1-CG2 3.4Å; N41-T44 PolarHBondContact OD1-N 2.81Å; N41-T44 PolarHBondContact OD1-OG1 3.31Å; N41-L45 PolarHBondContact O-N 3.44Å; N41-L45 VanDerWaalsContact O-N 3.12Å
42D95.2Very high96Very high88 Ų8882.2 Ų82.247%0.47143%0.429SS..Hα-helixtrans-64.8-24-177.9-70.5-21.6000113.1L45 L46 I63D42-L45 PolarHBondContact O-N 2.9Å; D42-L46 WeakPolarHBondContact O-CB 3.39Å; D42-L46 PolarHBondContact O-N 2.88Å; D42-I63 HydrophobicContact CB-CB 4.36Å; D42-I63 HydrophobicContact CB-CG1 4.35Å
43E95.9Very high95.9Very high154 Ų15476 Ų7672%0.7240%0.4SS*.Hα-helixtrans-67.3-48.5175.8-170.4-174.3173.300111.9N41 L45 L46 K47N41-E43 PolarHBondContact O-N 2.81Å; E43-L45 VanDerWaalsContact C-N 3.29Å; E43-L45 PolarHBondContact O-N 3.05Å; E43-L46 PolarHBondContact O-N 3.35Å; E43-K47 PolarHBondContact O-N 3.42Å
44T97.2Very high95.9Very high63 Ų6378 Ų7839%0.38741%0.41SS..Hα-helixtrans-66.4-33.9175.854.30000111.9N41 A48N41-T44 PolarHBondContact N-OG1 3.21Å; N41-T44 PolarHBondContact O-N 3.45Å; N41-T44 PolarHBondContact O-OG1 3.28Å; N41-T44 WeakPolarHBondContact OD1-CB 3.18Å; N41-T44 VanDerWaalsContact OD1-CG2 3.27Å; N41-T44 WeakPolarHBondContact OD1-CG2 3.4Å; N41-T44 PolarHBondContact OD1-N 2.81Å; N41-T44 PolarHBondContact OD1-OG1 3.31Å; T44-A48 PolarHBondContact O-N 2.81Å
45L97.6Very high95.9Very high3 Ų377.4 Ų77.42%0.01641%0.407CS..Hα-helixtrans-66.5-46.9173.5178.257.7000111.6T14 A16 L35 Y39 N41 D42 E43 K47 A48 A49 I63 S66T14-L45 HydrophobicContact CG2-CD1 3.75Å; T14-L45 HydrophobicContact CG2-CD2 4.07Å; A16-L45 HydrophobicContact CB-CD1 4.32Å; A16-L45 HydrophobicContact CB-CD2 4.07Å; A16-L45 HydrophobicContact CB-CG 4.4Å; L35-L45 HydrophobicContact CD1-CD1 3.59Å; Y39-L45 HydrophobicContact CD1-CB 4.48Å; Y39-L45 HydrophobicContact CD2-CB 4.47Å; Y39-L45 HydrophobicContact CD2-CD1 3.53Å; Y39-L45 HydrophobicContact CE2-CD1 3.86Å; Y39-L45 HydrophobicContact CG-CB 4.03Å; Y39-L45 HydrophobicContact CG-CD1 3.95Å; N41-L45 PolarHBondContact O-N 3.44Å; N41-L45 VanDerWaalsContact O-N 3.12Å; D42-L45 PolarHBondContact O-N 2.9Å; E43-L45 VanDerWaalsContact C-N 3.29Å; E43-L45 PolarHBondContact O-N 3.05Å; L45-K47 VanDerWaalsContact C-N 3.29Å; L45-K47 PolarHBondContact O-N 2.79Å; L45-A48 PolarHBondContact O-N 2.82Å; L45-A48 VanDerWaalsContact O-N 3.12Å; L45-A49 WeakPolarHBondContact O-CB 3.47Å; L45-A49 PolarHBondContact O-N 3.36Å; L45-I63 HydrophobicContact CD2-CD1 4.31Å; L45-I63 HydrophobicContact CD2-CG1 4.15Å; L45-I63 HydrophobicContact CD2-CG2 4.04Å; L45-I63 HydrophobicContact CG-CD1 4.04Å; L45-I63 HydrophobicContact CG-CG1 4.16Å; L45-S66 VanDerWaalsContact CD2-CB 3.42Å
46L97.4Very high95.8Very high31 Ų3183.9 Ų83.916%0.16244%0.441CS..Hα-helixtrans-61.3-37.9178.7-17762.3000111.5V18 D42 E43 A48 A49 K50 A60 V61 I63V18-L46 HydrophobicContact CG1-CD1 4.47Å; D42-L46 WeakPolarHBondContact O-CB 3.39Å; D42-L46 PolarHBondContact O-N 2.88Å; E43-L46 PolarHBondContact O-N 3.35Å; L46-A48 VanDerWaalsContact C-N 3.32Å; L46-A48 PolarHBondContact O-N 3.27Å; L46-A49 PolarHBondContact O-N 2.82Å; L46-K50 HydrophobicContact CG-CD 4.44Å; L46-K50 WeakPolarHBondContact O-CB 3.44Å; L46-K50 WeakPolarHBondContact O-CG 3.19Å; L46-K50 PolarHBondContact O-N 3.49Å; L46-A60 HydrophobicContact CD1-CB 4.23Å; L46-V61 WeakPolarHBondContact CD2-O 3.41Å; L46-I63 HydrophobicContact CB-CD1 4.27Å; L46-I63 HydrophobicContact CB-CG1 4.09Å; L46-I63 HydrophobicContact CD1-CD1 4.03Å; L46-I63 HydrophobicContact CD1-CG1 4.38Å
47K97.3Very high95.9Very high166 Ų16682.8 Ų82.872%0.72243%0.432SS*.Hα-helixtrans-61.9-41175.2-171.8173.8-177.3174.20112.2E43 L45 A51E43-K47 PolarHBondContact O-N 3.42Å; L45-K47 VanDerWaalsContact C-N 3.29Å; L45-K47 PolarHBondContact O-N 2.79Å; K47-A51 PolarHBondContact O-N 3.12Å
48A97Very high96.1Very high22 Ų2274 Ų7418%0.18240%0.399CS..Hα-helixtrans-71.5-37.8175.200000112.3L35 Y39 T44 L45 L46 A51 A52L35-A48 HydrophobicContact CD1-CB 3.98Å; Y39-A48 HydrophobicContact CD1-CB 4.43Å; Y39-A48 HydrophobicContact CE1-CB 3.42Å; Y39-A48 VanDerWaalsContact CE1-CB 3.42Å; Y39-A48 WeakPolarHBondContact OH-CB 3.22Å; T44-A48 PolarHBondContact O-N 2.81Å; L45-A48 PolarHBondContact O-N 2.82Å; L45-A48 VanDerWaalsContact O-N 3.12Å; L46-A48 VanDerWaalsContact C-N 3.32Å; L46-A48 PolarHBondContact O-N 3.27Å; A48-A51 PolarHBondContact O-N 3.29Å; A48-A52 PolarHBondContact O-N 2.92Å
49A96.6Very high96.1Very high0 Ų074.1 Ų74.10%039%0.393CS..Hα-helixtrans-62.9-43.4174.800000111.6V18 V33 L35 L45 L46 A51 A52 V53 I63V18-A49 HydrophobicContact CG1-CB 4.46Å; V18-A49 HydrophobicContact CG2-CB 3.87Å; V33-A49 HydrophobicContact CG2-CB 4.43Å; L35-A49 HydrophobicContact CD1-CB 4.23Å; L45-A49 WeakPolarHBondContact O-CB 3.47Å; L45-A49 PolarHBondContact O-N 3.36Å; L46-A49 PolarHBondContact O-N 2.82Å; A49-A51 VanDerWaalsContact C-N 3.35Å; A49-A51 PolarHBondContact O-N 2.77Å; A49-A52 CarbonylContact O-C 3.53Å; A49-A52 WeakPolarHBondContact O-CA 3.08Å; A49-A52 PolarHBondContact O-N 2.95Å; A49-V53 WeakPolarHBondContact O-CB 3.27Å; A49-V53 WeakPolarHBondContact O-CG2 3.37Å; A49-V53 PolarHBondContact O-N 2.8Å; A49-I63 HydrophobicContact CB-CD1 4.27Å
50K96.9Very high96.2Very high86 Ų8671 Ų7137%0.37438%0.382SS..Hα-helixtrans-55.7-47.8173.1-79.8178.7172.7-173.90111.8L46 A52 V53 D54 A60L46-K50 HydrophobicContact CG-CD 4.44Å; L46-K50 WeakPolarHBondContact O-CB 3.44Å; L46-K50 WeakPolarHBondContact O-CG 3.19Å; L46-K50 PolarHBondContact O-N 3.49Å; K50-A52 PolarHBondContact O-N 3.23Å; K50-A52 VanDerWaalsContact O-N 3.14Å; K50-V53 PolarHBondContact O-N 3.46Å; K50-D54 WeakPolarHBondContact CB-OD2 3.47Å; K50-D54 WeakPolarHBondContact CG-OD2 3.39Å; K50-D54 WeakPolarHBondContact O-CB 3.31Å; K50-D54 PolarHBondContact O-N 3.11Å; K50-A60 WeakPolarHBondContact CE-O 3.43Å; K50-A60 HydrophobicContact CG-CB 3.82Å
51A96.5Very high96.3Very high94 Ų9464.9 Ų64.978%0.77736%0.361SS*.Hα-helixtrans-61.6-22.817700000113.7K47 A48 A49K47-A51 PolarHBondContact O-N 3.12Å; A48-A51 PolarHBondContact O-N 3.29Å; A49-A51 VanDerWaalsContact C-N 3.35Å; A49-A51 PolarHBondContact O-N 2.77Å
52A94.8Very high96.3Very high65 Ų6563.4 Ų63.454%0.53736%0.357SS..Hα-helixtrans-96.3-27.1179.500000114L35 A48 A49 K50L35-A52 HydrophobicContact CD2-CB 3.89Å; A48-A52 PolarHBondContact O-N 2.92Å; A49-A52 CarbonylContact O-C 3.53Å; A49-A52 WeakPolarHBondContact O-CA 3.08Å; A49-A52 PolarHBondContact O-N 2.95Å; K50-A52 PolarHBondContact O-N 3.23Å; K50-A52 VanDerWaalsContact O-N 3.14Å
53V95.3Very high96.5Very high12 Ų1260.4 Ų60.47%0.07334%0.341CS..Hα-helixtrans-115.4-29.7-168.5-177.80000113.4K31 V33 A49 K50 T55 L58K31-V53 HydrophobicContact CD-CG1 4.04Å; V33-V53 HydrophobicContact CG1-CG2 3.28Å; A49-V53 WeakPolarHBondContact O-CB 3.27Å; A49-V53 WeakPolarHBondContact O-CG2 3.37Å; A49-V53 PolarHBondContact O-N 2.8Å; K50-V53 PolarHBondContact O-N 3.46Å; V53-T55 PolarHBondContact O-N 3.31Å; V53-L58 HydrophobicContact CG1-CD2 3.76Å
54D96Very high96.5Very high61 Ų6157.3 Ų57.333%0.32634%0.336SS..  trans-65.3124.2-174-74.4-1.3000110.2K50 L58 K59 A60K50-D54 WeakPolarHBondContact CB-OD2 3.47Å; K50-D54 WeakPolarHBondContact CG-OD2 3.39Å; K50-D54 WeakPolarHBondContact O-CB 3.31Å; K50-D54 PolarHBondContact O-N 3.11Å; D54-L58 WeakPolarHBondContact CA-O 3.44Å; D54-K59 HydrophobicContact CB-CD 4.44Å; D54-A60 WeakPolarHBondContact OD1-CB 3.2Å; D54-A60 PolarHBondContact OD1-N 2.73Å
55T96.1Very high96.4Very high69 Ų6960.3 Ų60.342%0.42334%0.344SS..  trans-120-176.3167.865.80000108.5V53 T57 L58 K59V53-T55 PolarHBondContact O-N 3.31Å; T55-T57 PolarHBondContact O-N 3.42Å; T55-T57 PolarHBondContact OG1-N 3.1Å; T55-T57 PolarHBondContact OG1-OG1 2.85Å; T55-L58 PolarHBondContact N-O 3.33Å; T55-L58 VanDerWaalsContact O-O 3.13Å; T55-L58 WeakPolarHBondContact OG1-CB 3.45Å; T55-L58 PolarHBondContact OG1-N 3.09Å; T55-K59 WeakPolarHBondContact O-CE 3.29Å; T55-K59 PolarHBondContact O-NZ 2.91Å
56D95Very high96.4Very high151 Ų15162.5 Ų62.581%0.80736%0.36SS*.SBendtrans-64.9-31175.1-65.6-31000112.1
57T95.3Very high96.4Very high48 Ų4865.2 Ų65.229%0.29437%0.368SS..SBendtrans-101.4-17.9-175.759.20000113.5D22 I23 E24 T55D22-T57 CarbonylContact C-O 3.6Å; I23-T57 PolarHBondContact N-O 2.83Å; E24-T57 VanDerWaalsContact CD-CG2 3.48Å; E24-T57 HydrophobicContact CG-CG2 3.67Å; E24-T57 WeakPolarHBondContact OE1-CG2 2.99Å; T55-T57 PolarHBondContact O-N 3.42Å; T55-T57 PolarHBondContact OG1-N 3.1Å; T55-T57 PolarHBondContact OG1-OG1 2.85Å
58L96.1Very high96.4Very high8 Ų861.1 Ų61.14%0.04236%0.357CS..EExtended strand (participates in β ladder)trans-125.3126.8-175.9-168.275.7000110.7C20 D22 C29 K31 V53 D54 T55C20-L58 HydrophobicContact CB-CD1 3.81Å; C20-L58 HydrophobicContact CB-CD2 4.42Å; C20-L58 HydrophobicContact CB-CG 4.02Å; D22-L58 HydrophobicContact CB-CD1 4.25Å; C29-L58 VanDerWaalsContact SG-CD1 3.59Å; K31-L58 HydrophobicContact CD-CD2 3.7Å; V53-L58 HydrophobicContact CG1-CD2 3.76Å; D54-L58 WeakPolarHBondContact CA-O 3.44Å; T55-L58 PolarHBondContact N-O 3.33Å; T55-L58 VanDerWaalsContact O-O 3.13Å; T55-L58 WeakPolarHBondContact OG1-CB 3.45Å; T55-L58 PolarHBondContact OG1-N 3.09Å
59K97Very high96.4Very high80 Ų8062.8 Ų62.835%0.34836%0.361SS..EExtended strand (participates in β ladder)trans-123.6128.6178.3-60.7-61.3-178.1-162.80111.6C20 L21 I23 D54 T55C20-K59 CarbonylContact C-O 3.45Å; C20-K59 WeakPolarHBondContact CA-O 3.43Å; L21-K59 PolarHBondContact N-O 3.03Å; L21-K59 PolarHBondContact O-N 2.96Å; I23-K59 HydrophobicContact CD1-CG 3.64Å; I23-K59 HydrophobicContact CG1-CG 4.42Å; D54-K59 HydrophobicContact CB-CD 4.44Å; T55-K59 WeakPolarHBondContact O-CE 3.29Å; T55-K59 PolarHBondContact O-NZ 2.91Å
60A97.5Very high96.5Very high4 Ų469 Ų693%0.03339%0.389CS..EExtended strand (participates in β ladder)trans-72.9127170.900000110.8V18 L46 K50 D54V18-A60 HydrophobicContact CG1-CB 3.55Å; L46-A60 HydrophobicContact CD1-CB 4.23Å; K50-A60 WeakPolarHBondContact CE-O 3.43Å; K50-A60 HydrophobicContact CG-CB 3.82Å; D54-A60 WeakPolarHBondContact OD1-CB 3.2Å; D54-A60 PolarHBondContact OD1-N 2.73Å
61V96Very high96.4Very high81 Ų8168.5 Ų68.549%0.49139%0.387SS..EExtended strand (participates in β ladder)trans-105-49.9-174.1-177.60000111L19 L21 L46L19-V61 PolarHBondContact O-N 2.75Å; L21-V61 HydrophobicContact CB-CG2 4Å; L46-V61 WeakPolarHBondContact CD2-O 3.41Å
62S96.6Very high96.5Very high45 Ų4570.1 Ų70.132%0.31538%0.382SS..EExtended strand (participates in β ladder)trans-154.2164-17765.20000112.6L19L19-S62 PolarHBondContact N-O 2.83Å; L19-S62 PolarHBondContact O-N 3.02Å
63I97.7Very high96.5Very high25 Ų2571.1 Ų71.113%0.12838%0.378CS..EExtended strand (participates in β ladder)trans-91.4121.8170.6-55.4-57.1000108A16 V18 D42 L45 L46 A49A16-I63 HydrophobicContact CB-CD1 4.36Å; V18-I63 HydrophobicContact CG1-CD1 4.41Å; V18-I63 HydrophobicContact CG2-CD1 3.93Å; D42-I63 HydrophobicContact CB-CB 4.36Å; D42-I63 HydrophobicContact CB-CG1 4.35Å; L45-I63 HydrophobicContact CD2-CD1 4.31Å; L45-I63 HydrophobicContact CD2-CG1 4.15Å; L45-I63 HydrophobicContact CD2-CG2 4.04Å; L45-I63 HydrophobicContact CG-CD1 4.04Å; L45-I63 HydrophobicContact CG-CG1 4.16Å; L46-I63 HydrophobicContact CB-CD1 4.27Å; L46-I63 HydrophobicContact CB-CG1 4.09Å; L46-I63 HydrophobicContact CD1-CD1 4.03Å; L46-I63 HydrophobicContact CD1-CG1 4.38Å; A49-I63 HydrophobicContact CB-CD1 4.27Å
64S96Very high96.6Very high90 Ų9072.8 Ų72.863%0.62940%0.398SS*.EExtended strand (participates in β ladder)trans-85.2-39.6175.1171.90000111.6C17C17-S64 PolarHBondContact O-N 3.41Å
65K96.8Very high96.6Very high125 Ų12573.3 Ų73.354%0.54340%0.399SS..EExtended strand (participates in β ladder)trans-153.2143.2-180-176.7-179.9177.7-176.50109.2A16 C17 W67A16-K65 CarbonylContact C-O 3.52Å; A16-K65 VanDerWaalsContact CA-O 3.31Å; A16-K65 WeakPolarHBondContact CA-O 3.48Å; C17-K65 HydrophobicContact CB-CB 4.1Å; C17-K65 PolarHBondContact N-O 2.85Å; C17-K65 PolarHBondContact O-N 3.36Å; K65-W67 HydrophobicContact CD-CE3 4.31Å; K65-W67 HydrophobicContact CD-CZ3 4.22Å; K65-W67 HydrophobicContact CG-CE3 4.2Å; K65-W67 HydrophobicContact CG-CZ3 4.35Å
66S97.2Very high96.7Very high49 Ų4972.4 Ų72.434%0.34340%0.395SS..EExtended strand (participates in β ladder)trans-140150170.366.40000111.1Q15 L45Q15-S66 CarbonylContact O-C 3.54Å; Q15-S66 WeakPolarHBondContact O-CA 3.15Å; L45-S66 VanDerWaalsContact CD2-CB 3.42Å
67W97.4Very high96.7Very high89 Ų8969.1 Ų69.134%0.33738%0.375SS..EExtended strand (participates in β ladder)trans-150.9159.1170.86997.6000110.7T14 Q15 K65T14-W67 CarbonylContact C-O 3.56Å; T14-W67 WeakPolarHBondContact CA-O 3.36Å; Q15-W67 HydrophobicContact CB-CD2 3.59Å; Q15-W67 HydrophobicContact CB-CE3 3.89Å; Q15-W67 HydrophobicContact CB-CG 4.24Å; Q15-W67 HydrophobicContact CB-CH2 3.65Å; Q15-W67 HydrophobicContact CB-CZ2 3.32Å; Q15-W67 HydrophobicContact CB-CZ3 3.92Å; Q15-W67 HydrophobicContact CG-CD2 4.31Å; Q15-W67 HydrophobicContact CG-CH2 4.35Å; Q15-W67 HydrophobicContact CG-CZ2 3.59Å; Q15-W67 PolarHBondContact N-O 2.77Å; Q15-W67 PolarHBondContact O-N 3.42Å; K65-W67 HydrophobicContact CD-CE3 4.31Å; K65-W67 HydrophobicContact CD-CZ3 4.22Å; K65-W67 HydrophobicContact CG-CE3 4.2Å; K65-W67 HydrophobicContact CG-CZ3 4.35Å
68V97.6Very high96.8Very high80 Ų8072.5 Ų72.549%0.48539%0.391SS..EExtended strand (participates in β ladder)trans-108.2134.1177.2177.10000109K12 V13 T38K12-V68 HydrophobicContact CB-CG1 4.24Å; K12-V68 HydrophobicContact CG-CG1 4.47Å; V13-V68 WeakPolarHBondContact O-CA 3.2Å; T38-V68 HydrophobicContact CG2-CB 4.45Å; T38-V68 HydrophobicContact CG2-CG1 3.64Å; T38-V68 HydrophobicContact CG2-CG2 3.88Å
69E97.1Very high96.8Very high57 Ų5777 Ų7727%0.26641%0.41SS..EExtended strand (participates in β ladder)trans-133.9151.9173.364.2-175.8-169.700110.6K12 V13 Q15 K71K12-E69 WeakPolarHBondContact CA-O 3.34Å; V13-E69 HydrophobicContact CG2-CG 3.53Å; V13-E69 PolarHBondContact N-O 3.46Å; V13-E69 PolarHBondContact O-N 3.35Å; Q15-E69 HydrophobicContact CG-CG 4.31Å; Q15-E69 PolarHBondContact NE2-OE1 2.96Å; E69-K71 HydrophobicContact CG-CG 4.36Å; E69-K71 WeakPolarHBondContact OE1-CD 3.43Å; E69-K71 WeakPolarHBondContact OE1-CE 3.46Å; E69-K71 IonicContact OE1-NZ 2.69Å; E69-K71 PolarHBondContact OE1-NZ 2.84Å
70E97.2Very high96.9Very high129 Ų12977.6 Ų77.660%0.60341%0.413SS*.EExtended strand (participates in β ladder)trans-90.9127169.6-74.5-174.5-177.400109.4T10 K12T10-E70 HydrophobicContact CG2-CB 4.22Å; K12-E70 WeakPolarHBondContact CE-OE1 2.89Å; K12-E70 HydrophobicContact CG-CG 3.67Å; K12-E70 IonicContact NZ-OE1 3.72Å
71K96.2Very high96.8Very high77 Ų7783.2 Ų83.234%0.33544%0.441SS..EExtended strand (participates in β ladder)trans-119.6128.2175.9-82.5-176159.11530110.5T10 I11 V13 Q15 E69 L73T10-K71 WeakPolarHBondContact CA-O 3.32Å; I11-K71 PolarHBondContact N-O 2.96Å; I11-K71 PolarHBondContact O-N 3.3Å; V13-K71 HydrophobicContact CG2-CD 3.95Å; V13-K71 HydrophobicContact CG2-CG 4.26Å; Q15-K71 VanDerWaalsContact NE2-NZ 3.12Å; E69-K71 HydrophobicContact CG-CG 4.36Å; E69-K71 WeakPolarHBondContact OE1-CD 3.43Å; E69-K71 WeakPolarHBondContact OE1-CE 3.46Å; E69-K71 IonicContact OE1-NZ 2.69Å; E69-K71 PolarHBondContact OE1-NZ 2.84Å; K71-L73 HydrophobicContact CB-CD2 4.29Å; K71-L73 HydrophobicContact CB-CG 4.32Å; K71-L73 PolarHBondContact O-N 3.45Å
72L97.4Very high96.9Very high127 Ų12783 Ų8367%0.66545%0.448SS*.EExtended strand (participates in β ladder)trans-81110.8166.1177.361.5000108.2
73L96Very high96.9Very high86 Ų8686.9 Ų86.945%0.4546%0.461SS..EExtended strand (participates in β ladder)trans-109.6148.6177.9-60.3177000109.6T8 R9 K71T8-L73 CarbonylContact C-O 3.6Å; T8-L73 VanDerWaalsContact CA-O 3.26Å; T8-L73 WeakPolarHBondContact CA-O 3.4Å; R9-L73 PolarHBondContact N-O 3.19Å; R9-L73 PolarHBondContact O-N 2.8Å; K71-L73 HydrophobicContact CB-CD2 4.29Å; K71-L73 HydrophobicContact CB-CG 4.32Å; K71-L73 PolarHBondContact O-N 3.45Å
74G96.1Very high96.8Very high48 Ų4887.8 Ų87.850%0.49547%0.472SS..EExtended strand (participates in β ladder)trans-151.2156.7174.700000113.3V7V7-G74 CarbonylContact O-C 3.52Å; V7-G74 WeakPolarHBondContact O-CA 3.34Å
75M96.7Very high96.8Very high71 Ų7189.4 Ų89.435%0.3548%0.478SS..EExtended strand (participates in β ladder)trans-147156.1175.758.6-179.74800110.3V7 F79 F80V7-M75 PolarHBondContact N-O 3.27Å; V7-M75 PolarHBondContact O-N 2.68Å; M75-F79 HydrophobicContact CB-CD1 4.28Å; M75-F79 HydrophobicContact CE-CD1 3.94Å; M75-F79 HydrophobicContact CE-CE1 3.87Å; M75-F79 HydrophobicContact CG-CD1 4.44Å; M75-F79 HydrophobicContact SD-CD1 3.64Å; M75-F79 HydrophobicContact SD-CE1 4.13Å; M75-F80 HydrophobicContact CG-CB 4.26Å; M75-F80 HydrophobicContact SD-CB 3.99Å; M75-F80 HydrophobicContact SD-CD2 4.08Å
76P97.3Very high96.6Very high51 Ų5191.2 Ų91.233%0.33149%0.494SS..EExtended strand (participates in β ladder)trans-58.4144.7173.7-23.234.2000111.8M6 D78 F79 F80M6-P76 HydrophobicContact SD-CB 4.44Å; M6-P76 HydrophobicContact SD-CG 4.22Å; P76-D78 VanDerWaalsContact C-N 3.29Å; P76-D78 PolarHBondContact O-N 2.9Å; P76-F79 HydrophobicContact CB-CB 4.44Å; P76-F79 PolarHBondContact O-N 3.3Å; P76-F79 VanDerWaalsContact O-N 3.11Å; P76-F80 PolarHBondContact O-N 3.25Å
77E96.6Very high96.3Very high82 Ų8296.1 Ų96.138%0.38352%0.515SS..Hα-helixtrans-57.1-40.3177.8-82.1-179.3179.500112.7P5 V7 F79 F80 I81P5-E77 HydrophobicContact CB-CG 4.2Å; P5-E77 WeakPolarHBondContact CB-OE2 3.17Å; P5-E77 HydrophobicContact CG-CB 4.32Å; P5-E77 HydrophobicContact CG-CG 4.4Å; P5-E77 WeakPolarHBondContact CG-OE2 3.18Å; P5-E77 PolarHBondContact O-N 2.93Å; V7-E77 HydrophobicContact CG2-CB 4.49Å; V7-E77 HydrophobicContact CG2-CG 3.62Å; E77-F79 VanDerWaalsContact C-N 3.27Å; E77-F79 PolarHBondContact O-N 3.16Å; E77-F80 WeakPolarHBondContact O-CB 3.4Å; E77-F80 PolarHBondContact O-N 3.31Å; E77-F80 VanDerWaalsContact O-N 3.09Å; E77-I81 VanDerWaalsContact O-CG1 3.29Å; E77-I81 WeakPolarHBondContact O-CG1 3.26Å; E77-I81 PolarHBondContact O-N 2.87Å
78D96.4Very high96Very high119 Ų11998.1 Ų98.164%0.63654%0.536SS*.Hα-helixtrans-59.1-40.5177.8-57.1-25.7000112P76 A82P76-D78 VanDerWaalsContact C-N 3.29Å; P76-D78 PolarHBondContact O-N 2.9Å; D78-A82 WeakPolarHBondContact O-CB 3.38Å; D78-A82 PolarHBondContact O-N 2.95Å; D78-A82 VanDerWaalsContact O-N 3.1Å
79F97.1Very high95.3Very high101 Ų101105.1 Ų105.144%0.44355%0.554SS.*Hα-helixtrans-69.2-39.9177.2-174.8-86.3000110.9M75 P76 E77 A82 H83M75-F79 HydrophobicContact CB-CD1 4.28Å; M75-F79 HydrophobicContact CE-CD1 3.94Å; M75-F79 HydrophobicContact CE-CE1 3.87Å; M75-F79 HydrophobicContact CG-CD1 4.44Å; M75-F79 HydrophobicContact SD-CD1 3.64Å; M75-F79 HydrophobicContact SD-CE1 4.13Å; P76-F79 HydrophobicContact CB-CB 4.44Å; P76-F79 PolarHBondContact O-N 3.3Å; P76-F79 VanDerWaalsContact O-N 3.11Å; E77-F79 VanDerWaalsContact C-N 3.27Å; E77-F79 PolarHBondContact O-N 3.16Å; F79-A82 PolarHBondContact O-N 2.69Å; F79-H83 AromaticContact CD1-ND1 3.81Å; F79-H83 AromaticContact CD2-CE1 3.53Å; F79-H83 AromaticContact CD2-ND1 3.82Å; F79-H83 AromaticContact CE1-CE1 3.99Å; F79-H83 AromaticContact CE1-ND1 3.69Å; F79-H83 AromaticContact CE2-CE1 3.19Å; F79-H83 WeakPolarHBondContact CE2-CE1 3.26Å; F79-H83 AromaticContact CE2-ND1 3.7Å; F79-H83 AromaticContact CE2-NE2 3.82Å; F79-H83 AromaticContact CG-ND1 3.88Å; F79-H83 AromaticContact CZ-CE1 3.44Å; F79-H83 VanDerWaalsContact CZ-CE1 3.44Å; F79-H83 WeakPolarHBondContact CZ-CE1 3.38Å; F79-H83 AromaticContact CZ-ND1 3.63Å; F79-H83 AromaticContact CZ-NE2 3.82Å; F79-H83 PolarHBondContact O-N 3.05Å; F79-H83 PolarHBondContact O-ND1 3.18Å
80F97.1Very high94.4Very high93 Ų93113.7 Ų113.741%0.40858%0.584SS.*Hα-helixtrans-61.1-49.2175.6178.7-97.4000111.2V7 M75 P76 E77 A82 H83 A84V7-F80 HydrophobicContact CB-CB 4.44Å; V7-F80 HydrophobicContact CB-CD2 4.48Å; V7-F80 HydrophobicContact CB-CG 4.38Å; V7-F80 HydrophobicContact CG1-CD2 4.17Å; V7-F80 HydrophobicContact CG1-CE2 4.38Å; V7-F80 HydrophobicContact CG1-CG 4.43Å; V7-F80 HydrophobicContact CG2-CB 3.88Å; V7-F80 HydrophobicContact CG2-CD1 4.07Å; V7-F80 HydrophobicContact CG2-CD2 4.4Å; V7-F80 HydrophobicContact CG2-CG 3.85Å; M75-F80 HydrophobicContact CG-CB 4.26Å; M75-F80 HydrophobicContact SD-CB 3.99Å; M75-F80 HydrophobicContact SD-CD2 4.08Å; P76-F80 PolarHBondContact O-N 3.25Å; E77-F80 WeakPolarHBondContact O-CB 3.4Å; E77-F80 PolarHBondContact O-N 3.31Å; E77-F80 VanDerWaalsContact O-N 3.09Å; F80-A82 VanDerWaalsContact C-N 3.28Å; F80-A82 PolarHBondContact O-N 2.77Å; F80-H83 PolarHBondContact O-N 2.92Å; F80-A84 HydrophobicContact CD1-CB 4.25Å; F80-A84 HydrophobicContact CD2-CB 4.39Å; F80-A84 HydrophobicContact CE1-CB 3.95Å; F80-A84 HydrophobicContact CE2-CB 4.1Å; F80-A84 HydrophobicContact CG-CB 4.47Å; F80-A84 HydrophobicContact CZ-CB 3.88Å; F80-A84 WeakPolarHBondContact O-CB 3.09Å; F80-A84 PolarHBondContact O-N 3.32Å
81I96.6Very high93.1Very high122 Ų122116.7 Ų116.763%0.62660%0.595SS**Hα-helixtrans-60.1-39-179.9-67.3164.5000111.1E77 H83E77-I81 VanDerWaalsContact O-CG1 3.29Å; E77-I81 WeakPolarHBondContact O-CG1 3.26Å; E77-I81 PolarHBondContact O-N 2.87Å; I81-H83 VanDerWaalsContact C-N 3.35Å; I81-H83 PolarHBondContact O-N 3.17Å
82A97.5Very high91.8Very high76 Ų76118.9 Ų118.963%0.62862%0.617SS**Hα-helixtrans-69.7-25.9-179.500000114.6D78 F79 F80D78-A82 WeakPolarHBondContact O-CB 3.38Å; D78-A82 PolarHBondContact O-N 2.95Å; D78-A82 VanDerWaalsContact O-N 3.1Å; F79-A82 PolarHBondContact O-N 2.69Å; F80-A82 VanDerWaalsContact C-N 3.28Å; F80-A82 PolarHBondContact O-N 2.77Å
83H97.5Very high90.2Very high128 Ų128120.5 Ų120.559%0.59363%0.626SS**Hα-helixtrans-114.8-13.4-173.6-61.483.7000113.9F79 F80 I81F79-H83 AromaticContact CD1-ND1 3.81Å; F79-H83 AromaticContact CD2-CE1 3.53Å; F79-H83 AromaticContact CD2-ND1 3.82Å; F79-H83 AromaticContact CE1-CE1 3.99Å; F79-H83 AromaticContact CE1-ND1 3.69Å; F79-H83 AromaticContact CE2-CE1 3.19Å; F79-H83 WeakPolarHBondContact CE2-CE1 3.26Å; F79-H83 AromaticContact CE2-ND1 3.7Å; F79-H83 AromaticContact CE2-NE2 3.82Å; F79-H83 AromaticContact CG-ND1 3.88Å; F79-H83 AromaticContact CZ-CE1 3.44Å; F79-H83 VanDerWaalsContact CZ-CE1 3.44Å; F79-H83 WeakPolarHBondContact CZ-CE1 3.38Å; F79-H83 AromaticContact CZ-ND1 3.63Å; F79-H83 AromaticContact CZ-NE2 3.82Å; F79-H83 PolarHBondContact O-N 3.05Å; F79-H83 PolarHBondContact O-ND1 3.18Å; F80-H83 PolarHBondContact O-N 2.92Å; I81-H83 VanDerWaalsContact C-N 3.35Å; I81-H83 PolarHBondContact O-N 3.17Å
84A96.1Very high88.5Confident44 Ų44120.8 Ų120.836%0.36464%0.641SS.*  trans-80.1158.2179.300000111.9F80F80-A84 HydrophobicContact CD1-CB 4.25Å; F80-A84 HydrophobicContact CD2-CB 4.39Å; F80-A84 HydrophobicContact CE1-CB 3.95Å; F80-A84 HydrophobicContact CE2-CB 4.1Å; F80-A84 HydrophobicContact CG-CB 4.47Å; F80-A84 HydrophobicContact CZ-CB 3.88Å; F80-A84 WeakPolarHBondContact O-CB 3.09Å; F80-A84 PolarHBondContact O-N 3.32Å
85T95.6Very high86.6Confident124 Ų124127.5 Ų127.576%0.76166%0.66SS**  trans-114.3140.6170.855.90000109.8I87T85-I87 PolarHBondContact O-N 2.92Å
86D92.8Very high84.8Confident162 Ų162131.5 Ų131.587%0.86668%0.681SS**  trans-60133.6178.5-74.7-27.3000112.5
87I90.8Very high82.8Confident153 Ų153134.5 Ų134.579%0.78570%0.7SS**  trans-96.9101.7175.5-57.9177.5000108.6T85 R89T85-I87 PolarHBondContact O-N 2.92Å; I87-R89 PolarHBondContact O-N 3.04Å
88V89.7Confident81.2Confident131 Ų131140.4 Ų140.479%0.79473%0.725SS**  trans-77.6108.9169.8-174.80000108.7R90V88-R90 PolarHBondContact O-N 3.26Å; V88-R90 VanDerWaalsContact O-N 3.16Å
89R83.1Confident79.5Confident226 Ų226143.2 Ų143.285%0.85373%0.734SS**  trans-66.4115.2171.6-66-173.3-176.7-162.92108.3I87 K91I87-R89 PolarHBondContact O-N 3.04Å; R89-K91 PolarHBondContact O-N 3.09Å
90R78.7Confident77.9Confident238 Ų238143.8 Ų143.890%0.89875%0.748SS**PPolyproline II helixtrans-60.7124.2166.9-65.4-177.6-177.1174.50.2107.1V88V88-R90 PolarHBondContact O-N 3.26Å; V88-R90 VanDerWaalsContact O-N 3.16Å
91K70.6Confident76.2Confident192 Ų192150.7 Ų150.784%0.83577%0.771SS**PPolyproline II helixtrans-57.7133.5165.6-75.5179.8-179.7172.80106.5R89 D93R89-K91 PolarHBondContact O-N 3.09Å; K91-D93 PolarHBondContact O-N 3.45Å
92P68.9Low74.7Confident122 Ų122151.9 Ų151.979%0.79278%0.779SS**PPolyproline II helixtrans-58.3131.8171.322.5-27.7000107.7A94P92-A94 PolarHBondContact O-N 3.37Å
93D63.7Low73.5Confident162 Ų162154.3 Ų154.387%0.86679%0.788SS**PPolyproline II helixtrans-50.5125178.7-67-43.9000108.4K91 E95K91-D93 PolarHBondContact O-N 3.45Å; D93-E95 PolarHBondContact O-N 3.41Å
94A58.7Low72Confident91 Ų91161 Ų16175%0.75282%0.82SS**PPolyproline II helixtrans-53126.4178.300000108.7P92 I96P92-A94 PolarHBondContact O-N 3.37Å; A94-I96 PolarHBondContact O-N 3.22Å
95E56.6Low70.8Confident190 Ų190166.9 Ų166.989%0.88884%0.842SS**  trans-45.4107176.6-116.4174.3160.300109.7D93 P97D93-E95 PolarHBondContact O-N 3.41Å; E95-P97 VanDerWaalsContact O-CD 3.26Å; E95-P97 WeakPolarHBondContact O-CD 2.88Å
96I59.3Low69.5Low154 Ų154169.1 Ų169.179%0.7985%0.847SS**  trans-62.6118.7170.7-60.7170000105.6A94 K98A94-I96 PolarHBondContact O-N 3.22Å; I96-K98 PolarHBondContact O-N 2.85Å
97P56.3Low68.2Low114 Ų114169.5 Ų169.574%0.7485%0.846SS**  trans-57.2118.1-179.2-23.333.1000109.5E95 Q99E95-P97 VanDerWaalsContact O-CD 3.26Å; E95-P97 WeakPolarHBondContact O-CD 2.88Å; P97-Q99 PolarHBondContact O-N 2.98Å; P97-Q99 VanDerWaalsContact O-N 3.09Å
98K61.5Low66.9Low207 Ų207170.5 Ų170.590%0.985%0.849SS**  trans-63.3112.7171.2-69.1177.4-178.2170.70107I96I96-K98 PolarHBondContact O-N 2.85Å
99Q62.3Low65.5Low177 Ų177172.9 Ų172.983%0.82785%0.853SS**  trans-58.2137.9172.5-71.2-173-1.400109P97 R101P97-Q99 PolarHBondContact O-N 2.98Å; P97-Q99 VanDerWaalsContact O-N 3.09Å; Q99-R101 PolarHBondContact O-N 2.93Å
100P63.6Low64.3Low114 Ų114169.4 Ų169.474%0.7485%0.853SS**  trans-56.2128.3176.3-19.330.2000109.3D102P100-D102 PolarHBondContact O-N 3.49Å
101R59.4Low63.2Low238 Ų238164.5 Ų164.590%0.89885%0.849SS**  trans-78.6115164.3-77.8-176.8-78-176.7-2.6106.3Q99Q99-R101 PolarHBondContact O-N 2.93Å
102D66.6Low62.7Low146 Ų146162.4 Ų162.478%0.78185%0.85SS**  trans-56.9132.5172.9-71.8-44.3000109.6P100 Q104P100-D102 PolarHBondContact O-N 3.49Å; D102-Q104 PolarHBondContact O-N 2.93Å
103P72.3Confident62.2Low127 Ų127165.8 Ų165.883%0.82586%0.855SS**  trans-66126.7172.3-14.628.2000109.9
104Q65.7Low62Low269 Ų269166.1 Ų166.1100%1.25785%0.854SS**  trans-710161.9-76-174.3-6700111D102D102-Q104 PolarHBondContact O-N 2.93Å

Retrieved 104 of 104 residues in 113.6 ms (Link to these results)