A0A077ZHL4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZHL4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 82 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
1M40Very low54.7Low241 Ų241134.4 Ų134.4100%1.18775%0.752SS**  0100.30-70160.3105.700107.4
2I46.1Very low55.4Low175 Ų175127.2 Ų127.290%0.89771%0.713SS**  trans-126.5105.9167.1-62.1172.3000105
3T47Very low56Low134 Ų134127.8 Ų127.882%0.82270%0.704SS**PPolyproline II helixtrans-73.3128.2-175.6-37.60000109A5T3-A5 PolarHBondContact O-N 3.34Å
4C48Very low56.6Low117 Ų117121.6 Ų121.679%0.79168%0.684SS**PPolyproline II helixtrans-66.2117.7176.7-172.40000110
5A61Low57.3Low76 Ų76121.2 Ų121.263%0.62867%0.672SS**PPolyproline II helixtrans-76.4129.8164.200000108.2T3 I7T3-A5 PolarHBondContact O-N 3.34Å; A5-I7 PolarHBondContact O-N 3.01Å
6P59Low57.6Low113 Ų113115.9 Ų115.973%0.73464%0.642SS**  trans-68.5108.217927.5-32.4000109.1T8P6-T8 PolarHBondContact O-N 2.97Å
7I60.5Low58Low124 Ų124113.9 Ų113.964%0.63663%0.629SS**  trans-64.1101.8171-57.2168.5000106.7A5 F11 V12A5-I7 PolarHBondContact O-N 3.01Å; I7-F11 HydrophobicContact CG2-CB 4.38Å; I7-F11 HydrophobicContact CG2-CD1 4.01Å; I7-V12 HydrophobicContact CG2-CG2 3.39Å
8T58.1Low58.3Low84 Ų84117.4 Ų117.452%0.51564%0.637SS.*  trans-71.4151.1179.147.30000110.3P6 S10 F11 V12P6-T8 PolarHBondContact O-N 2.97Å; T8-S10 PolarHBondContact O-N 3.29Å; T8-S10 VanDerWaalsContact O-N 3.09Å; T8-F11 WeakPolarHBondContact O-CA 3.39Å; T8-F11 WeakPolarHBondContact O-CB 3.27Å; T8-F11 PolarHBondContact O-N 2.82Å; T8-V12 PolarHBondContact O-N 3.47Å
9K57.9Low58.5Low183 Ų183118.6 Ų118.680%0.79664%0.638SS**Hα-helixtrans-50.4-36175.9-72.1176.5175.6168.40112.3F13K9-F13 WeakPolarHBondContact O-CB 3.39Å; K9-F13 PolarHBondContact O-N 3.22Å
10S60.9Low58.6Low96 Ų96116 Ų11667%0.67163%0.626SS**Hα-helixtrans-66.5-34.1175-64.60000113.6T8 G14T8-S10 PolarHBondContact O-N 3.29Å; T8-S10 VanDerWaalsContact O-N 3.09Å; S10-G14 PolarHBondContact O-N 3.21Å
11F62.9Low58.7Low135 Ų135115.6 Ų115.659%0.59263%0.627SS**Hα-helixtrans-70.1-43177.3-168.3-90.8000111.3I7 T8 G14 F15I7-F11 HydrophobicContact CG2-CB 4.38Å; I7-F11 HydrophobicContact CG2-CD1 4.01Å; T8-F11 WeakPolarHBondContact O-CA 3.39Å; T8-F11 WeakPolarHBondContact O-CB 3.27Å; T8-F11 PolarHBondContact O-N 2.82Å; F11-G14 PolarHBondContact O-N 3.08Å; F11-F15 VanDerWaalsContact O-CB 3.27Å; F11-F15 WeakPolarHBondContact O-CB 3.3Å; F11-F15 PolarHBondContact O-N 3.26Å
12V63.6Low59.5Low48 Ų48109.5 Ų109.529%0.29161%0.606SS.*Hα-helixtrans-64.9-44.2174.9-174.90000110.8I7 T8 G14 F15 I16I7-V12 HydrophobicContact CG2-CG2 3.39Å; T8-V12 PolarHBondContact O-N 3.47Å; V12-G14 PolarHBondContact O-N 2.85Å; V12-F15 PolarHBondContact O-N 3.41Å; V12-I16 HydrophobicContact CG1-CG1 4.14Å; V12-I16 WeakPolarHBondContact O-CB 3.34Å; V12-I16 VanDerWaalsContact O-CG1 3.3Å; V12-I16 WeakPolarHBondContact O-CG1 3.27Å; V12-I16 PolarHBondContact O-N 3.22Å
13F63.8Low59.9Low136 Ų136106.9 Ų106.960%0.59659%0.594SS**Hα-helixtrans-60.9-46.6176.7-170.2-97.5000110.8K9 F15 I16 L17K9-F13 WeakPolarHBondContact O-CB 3.39Å; K9-F13 PolarHBondContact O-N 3.22Å; F13-F15 VanDerWaalsContact C-N 3.34Å; F13-F15 PolarHBondContact O-N 3.21Å; F13-I16 PolarHBondContact O-N 3.5Å; F13-L17 HydrophobicContact CD1-CD2 3.95Å; F13-L17 HydrophobicContact CD1-CG 4.17Å; F13-L17 HydrophobicContact CD2-CD2 3.82Å; F13-L17 HydrophobicContact CE1-CD2 3.74Å; F13-L17 HydrophobicContact CE1-CG 3.79Å; F13-L17 HydrophobicContact CE2-CD2 3.59Å; F13-L17 HydrophobicContact CE2-CG 4.49Å; F13-L17 HydrophobicContact CG-CD2 4Å; F13-L17 HydrophobicContact CZ-CD2 3.55Å; F13-L17 HydrophobicContact CZ-CG 3.97Å; F13-L17 VanDerWaalsContact O-CB 3.31Å; F13-L17 WeakPolarHBondContact O-CB 3.3Å; F13-L17 WeakPolarHBondContact O-CD2 3.2Å; F13-L17 PolarHBondContact O-N 2.86Å
14G63.4Low60.4Low40 Ų40110.9 Ų110.941%0.41259%0.593SS.*Hα-helixtrans-60.7-40.3175.200000113.2S10 F11 V12 K18S10-G14 PolarHBondContact O-N 3.21Å; F11-G14 PolarHBondContact O-N 3.08Å; V12-G14 PolarHBondContact O-N 2.85Å; G14-K18 WeakPolarHBondContact O-CB 3.4Å; G14-K18 PolarHBondContact O-N 3.41Å
15F67.1Low60.8Low116 Ų116109.5 Ų109.551%0.50959%0.585SS.*Hα-helixtrans-64.8-49.3177.4-172.2-94.4000111.6F11 V12 F13 L17 K18 E19F11-F15 VanDerWaalsContact O-CB 3.27Å; F11-F15 WeakPolarHBondContact O-CB 3.3Å; F11-F15 PolarHBondContact O-N 3.26Å; V12-F15 PolarHBondContact O-N 3.41Å; F13-F15 VanDerWaalsContact C-N 3.34Å; F13-F15 PolarHBondContact O-N 3.21Å; F15-L17 PolarHBondContact O-N 2.83Å; F15-K18 PolarHBondContact O-N 3.09Å; F15-E19 PolarHBondContact O-N 2.98Å
16I62.6Low60.6Low37 Ų37109.2 Ų109.219%0.1958%0.583CS.*Hα-helixtrans-63.9-42.6178.5-69.2-67.9000111.3V12 F13 K18 E19 V20 L40V12-I16 HydrophobicContact CG1-CG1 4.14Å; V12-I16 WeakPolarHBondContact O-CB 3.34Å; V12-I16 VanDerWaalsContact O-CG1 3.3Å; V12-I16 WeakPolarHBondContact O-CG1 3.27Å; V12-I16 PolarHBondContact O-N 3.22Å; F13-I16 PolarHBondContact O-N 3.5Å; I16-K18 VanDerWaalsContact C-N 3.29Å; I16-K18 PolarHBondContact O-N 3.41Å; I16-E19 PolarHBondContact O-N 2.81Å; I16-V20 HydrophobicContact CG2-CG2 4.28Å; I16-V20 VanDerWaalsContact O-CB 3.26Å; I16-V20 WeakPolarHBondContact O-CB 3.47Å; I16-V20 VanDerWaalsContact O-CG2 3.23Å; I16-V20 WeakPolarHBondContact O-CG2 3.4Å; I16-V20 PolarHBondContact O-N 3.32Å; I16-L40 HydrophobicContact CG2-CD2 3.79Å
17L65Low60.2Low81 Ų81110.6 Ų110.642%0.42458%0.583SS.*Hα-helixtrans-67.4-31.6177.4-85.7-73.4000111.7F13 F15 V21F13-L17 HydrophobicContact CD1-CD2 3.95Å; F13-L17 HydrophobicContact CD1-CG 4.17Å; F13-L17 HydrophobicContact CD2-CD2 3.82Å; F13-L17 HydrophobicContact CE1-CD2 3.74Å; F13-L17 HydrophobicContact CE1-CG 3.79Å; F13-L17 HydrophobicContact CE2-CD2 3.59Å; F13-L17 HydrophobicContact CE2-CG 4.49Å; F13-L17 HydrophobicContact CG-CD2 4Å; F13-L17 HydrophobicContact CZ-CD2 3.55Å; F13-L17 HydrophobicContact CZ-CG 3.97Å; F13-L17 VanDerWaalsContact O-CB 3.31Å; F13-L17 WeakPolarHBondContact O-CB 3.3Å; F13-L17 WeakPolarHBondContact O-CD2 3.2Å; F13-L17 PolarHBondContact O-N 2.86Å; F15-L17 PolarHBondContact O-N 2.83Å; L17-V21 WeakPolarHBondContact O-CG2 3.36Å
18K62.2Low59.9Low178 Ų178110.6 Ų110.677%0.77459%0.589SS**Hα-helixtrans-73.3-33.8176.1-170.5177.6167.3100.50112.1G14 F15 I16G14-K18 WeakPolarHBondContact O-CB 3.4Å; G14-K18 PolarHBondContact O-N 3.41Å; F15-K18 PolarHBondContact O-N 3.09Å; I16-K18 VanDerWaalsContact C-N 3.29Å; I16-K18 PolarHBondContact O-N 3.41Å
19E61.9Low59.7Low140 Ų140114 Ų11465%0.65460%0.604SS**Hα-helixtrans-76.9-31.5175.2-152.375.4-167.800112.2F15 I16 V21F15-E19 PolarHBondContact O-N 2.98Å; I16-E19 PolarHBondContact O-N 2.81Å; E19-V21 VanDerWaalsContact C-N 3.28Å; E19-V21 PolarHBondContact O-N 2.84Å
20V61.5Low59.7Low66 Ų66111.3 Ų111.340%0.460%0.597SS.*THydrogen-bonded Turntrans-85.214.1-179.2171.90000113.4I16 P22I16-V20 HydrophobicContact CG2-CG2 4.28Å; I16-V20 VanDerWaalsContact O-CB 3.26Å; I16-V20 WeakPolarHBondContact O-CB 3.47Å; I16-V20 VanDerWaalsContact O-CG2 3.23Å; I16-V20 WeakPolarHBondContact O-CG2 3.4Å; I16-V20 PolarHBondContact O-N 3.32Å; V20-P22 WeakPolarHBondContact O-CD 3.42Å
21V59.7Low59.2Low108 Ų108118.9 Ų118.966%0.65561%0.611SS**  trans-104.378163.7-175.60000109.3L17 E19 D23L17-V21 WeakPolarHBondContact O-CG2 3.36Å; E19-V21 VanDerWaalsContact C-N 3.28Å; E19-V21 PolarHBondContact O-N 2.84Å; V21-D23 PolarHBondContact O-N 2.95Å
22P56.5Low58.7Low113 Ų113116.4 Ų116.473%0.73461%0.611SS**  trans-76.4120.8168.231.5-31000109.4V20V20-P22 WeakPolarHBondContact O-CD 3.42Å
23D55.5Low58.1Low120 Ų120121 Ų12164%0.64264%0.638SS**  trans18.1115.9160.1-160.733.2000118.8V21 S25V21-D23 PolarHBondContact O-N 2.95Å; D23-S25 PolarHBondContact O-N 2.81Å; D23-S25 PolarHBondContact OD1-OG 3.41Å; D23-S25 VanDerWaalsContact OD1-OG 3.12Å; D23-S25 WeakPolarHBondContact OD2-CB 3.12Å; D23-S25 PolarHBondContact OD2-OG 3.47Å
24R57.6Low57.4Low217 Ų217118.4 Ų118.482%0.81963%0.634SS**THydrogen-bonded Turntrans-64.69.5178.2-72.8-160.4179-139.53.5114.7A26R24-A26 VanDerWaalsContact C-N 3.34Å; R24-A26 PolarHBondContact O-N 3.01Å
25S55.8Low56.9Low89 Ų89120.8 Ų120.862%0.62265%0.649SS**THydrogen-bonded Turntrans-82.7-3-172.5-51.90000114.5D23 L27D23-S25 PolarHBondContact O-N 2.81Å; D23-S25 PolarHBondContact OD1-OG 3.41Å; D23-S25 VanDerWaalsContact OD1-OG 3.12Å; D23-S25 WeakPolarHBondContact OD2-CB 3.12Å; D23-S25 PolarHBondContact OD2-OG 3.47Å; S25-L27 PolarHBondContact O-N 2.89Å
26A56.4Low56.2Low69 Ų69121.3 Ų121.357%0.5765%0.654SS**  trans-84.734.7170.100000113.5R24 T28 I30R24-A26 VanDerWaalsContact C-N 3.34Å; R24-A26 PolarHBondContact O-N 3.01Å; A26-T28 PolarHBondContact O-N 2.81Å; A26-T28 VanDerWaalsContact O-N 3.1Å; A26-I30 HydrophobicContact CB-CD1 4.07Å
27L52.3Low56.1Low142 Ų142123.4 Ų123.474%0.74366%0.664SS**THydrogen-bonded Turntrans-74.58.2-157-16067000117.4S25S25-L27 PolarHBondContact O-N 2.89Å
28T52.8Low55.9Low125 Ų125120.7 Ų120.777%0.76765%0.653SS**THydrogen-bonded Turntrans-131-9.6-166.257.90000120.3A26A26-T28 PolarHBondContact O-N 2.81Å; A26-T28 VanDerWaalsContact O-N 3.1Å
29N54.9Low56.3Low154 Ų154117 Ų11782%0.82464%0.641SS**  trans-160.715.5179.4-125.7-91.6000119.6R31N29-R31 PolarHBondContact O-N 3.47Å; N29-R31 VanDerWaalsContact O-N 3.11Å
30I57.9Low56.7Low127 Ų127112.1 Ų112.165%0.65162%0.619SS**  trans-91.467.1-177-51.3171000110.5A26 S32A26-I30 HydrophobicContact CB-CD1 4.07Å; I30-S32 VanDerWaalsContact C-N 3.34Å; I30-S32 PolarHBondContact O-N 3.22Å
31R49.1Very low56.8Low256 Ų256109 Ų10997%0.96660%0.6SS**  trans-88.670.1168.9-99.8-170-176.5-172.72.7110.3N29N29-R31 PolarHBondContact O-N 3.47Å; N29-R31 VanDerWaalsContact O-N 3.11Å
32S53Low57.2Low83 Ų83104 Ų10458%0.5857%0.569SS**SBendtrans-150.879.9154.363.50000107.6I30 T34I30-S32 VanDerWaalsContact C-N 3.34Å; I30-S32 PolarHBondContact O-N 3.22Å; S32-T34 PolarHBondContact O-N 3.1Å; S32-T34 PolarHBondContact O-OG1 3.1Å
33V51.3Low58Low143 Ų143103.2 Ų103.287%0.86756%0.559SS**  trans2.379.4147.6-175.70000111.4A35V33-A35 VanDerWaalsContact C-N 3.26Å; V33-A35 PolarHBondContact O-N 2.91Å
34T48.9Very low58.8Low83 Ų8397.7 Ų97.751%0.50953%0.53SS..  trans-77.592.3177.4-63.70000103.9S32 Q36S32-T34 PolarHBondContact O-N 3.1Å; S32-T34 PolarHBondContact O-OG1 3.1Å; T34-Q36 HydrophobicContact CG2-CB 3.48Å; T34-Q36 VanDerWaalsContact CG2-CB 3.48Å; T34-Q36 HydrophobicContact CG2-CG 3.3Å; T34-Q36 PolarHBondContact O-N 3.47Å
35A52.1Low59.4Low89 Ų8991.9 Ų91.974%0.73651%0.513SS*.  trans-63.726.3171.600000112.7V33 L37V33-A35 VanDerWaalsContact C-N 3.26Å; V33-A35 PolarHBondContact O-N 2.91Å; A35-L37 PolarHBondContact O-N 2.97Å
36Q54.2Low60.4Low128 Ų12893.3 Ų93.360%0.59851%0.513SS*.  trans-104.841.4-163.5-53.1171.1-10.200112.9T34 S38T34-Q36 HydrophobicContact CG2-CB 3.48Å; T34-Q36 VanDerWaalsContact CG2-CB 3.48Å; T34-Q36 HydrophobicContact CG2-CG 3.3Å; T34-Q36 PolarHBondContact O-N 3.47Å; Q36-S38 PolarHBondContact O-N 3.05Å
37L60.5Low61.4Low80 Ų8095.3 Ų95.342%0.41951%0.514SS..THydrogen-bonded Turntrans-75.52.1155-105.4159.1000111.7A35 L39 L40 P41 L56A35-L37 PolarHBondContact O-N 2.97Å; L37-L39 PolarHBondContact O-N 3.49Å; L37-L40 HydrophobicContact CD2-CB 4Å; L37-L40 HydrophobicContact CD2-CD2 3.6Å; L37-L40 HydrophobicContact CD2-CG 4.46Å; L37-L40 PolarHBondContact O-N 2.66Å; L37-P41 WeakPolarHBondContact O-CD 3.31Å; L37-L56 HydrophobicContact CB-CD2 4.01Å; L37-L56 HydrophobicContact CD1-CD2 4.07Å; L37-L56 HydrophobicContact CD2-CD2 4.4Å; L37-L56 HydrophobicContact CG-CD2 4.38Å
38S60.6Low62.4Low25 Ų2591.6 Ų91.618%0.17551%0.509CS..THydrogen-bonded Turntrans-67.9-13.8175.952.20000115Q36 P41 T42Q36-S38 PolarHBondContact O-N 3.05Å; S38-P41 WeakPolarHBondContact O-CD 3.46Å; S38-T42 PolarHBondContact O-OG1 3.42Å
39L69.3Low63.2Low101 Ų10189.5 Ų89.553%0.52949%0.492SS..Hα-helixtrans-77.8-30171.9-69175.5000112.7L37 T42 L43L37-L39 PolarHBondContact O-N 3.49Å; L39-T42 PolarHBondContact O-N 2.86Å; L39-L43 WeakPolarHBondContact O-CB 3.21Å; L39-L43 PolarHBondContact O-N 3.35Å
40L70.1Confident63.6Low37 Ų3788.1 Ų88.119%0.19449%0.492CS..Hα-helixtrans-63.5-43.2179.7-158.663.3000112.2I16 L37 T42 A44 F53I16-L40 HydrophobicContact CG2-CD2 3.79Å; L37-L40 HydrophobicContact CD2-CB 4Å; L37-L40 HydrophobicContact CD2-CD2 3.6Å; L37-L40 HydrophobicContact CD2-CG 4.46Å; L37-L40 PolarHBondContact O-N 2.66Å; L40-T42 VanDerWaalsContact C-N 3.29Å; L40-T42 PolarHBondContact O-N 3.12Å; L40-A44 WeakPolarHBondContact O-CB 3.09Å; L40-A44 PolarHBondContact O-N 3.44Å; L40-F53 HydrophobicContact CB-CD1 4.39Å; L40-F53 HydrophobicContact CB-CE1 3.62Å; L40-F53 HydrophobicContact CB-CZ 4.24Å; L40-F53 HydrophobicContact CD2-CE1 3.84Å; L40-F53 HydrophobicContact CG-CE1 3.46Å; L40-F53 VanDerWaalsContact CG-CE1 3.46Å; L40-F53 HydrophobicContact CG-CZ 3.87Å; L40-F53 WeakPolarHBondContact O-CZ 3.08Å
41P64.1Low63.8Low0 Ų084 Ų840%047%0.471CS..Hα-helixtrans-57-42.6169.4-11.713.3000114.1L37 S38 M45 F53 L56 F59L37-P41 WeakPolarHBondContact O-CD 3.31Å; S38-P41 WeakPolarHBondContact O-CD 3.46Å; P41-M45 WeakPolarHBondContact O-CB 3.44Å; P41-M45 PolarHBondContact O-N 2.96Å; P41-F53 VanDerWaalsContact CA-CE2 3.41Å; P41-F53 HydrophobicContact CB-CB 3.6Å; P41-F53 HydrophobicContact CB-CD1 3.75Å; P41-F53 HydrophobicContact CB-CD2 3.65Å; P41-F53 HydrophobicContact CB-CE1 4.43Å; P41-F53 HydrophobicContact CB-CE2 4.28Å; P41-F53 HydrophobicContact CB-CG 3.35Å; P41-F53 HydrophobicContact CG-CB 3.65Å; P41-F53 HydrophobicContact CG-CD1 3.42Å; P41-F53 VanDerWaalsContact CG-CD1 3.42Å; P41-F53 HydrophobicContact CG-CD2 4.27Å; P41-F53 HydrophobicContact CG-CE1 4.22Å; P41-F53 HydrophobicContact CG-CG 3.49Å; P41-F53 VanDerWaalsContact CG-CG 3.49Å; P41-F53 VanDerWaalsContact N-CE1 3.31Å; P41-L56 HydrophobicContact CG-CB 4.24Å; P41-F59 HydrophobicContact CB-CD1 4.17Å; P41-F59 HydrophobicContact CB-CE1 3.96Å
42T68.1Low64.3Low2 Ų276.7 Ų76.71%0.01246%0.457CS..Hα-helixtrans-73.4-42.9-173.6-46.90000111S38 L39 L40 M45 L46 L63 F64S38-T42 PolarHBondContact O-OG1 3.42Å; L39-T42 PolarHBondContact O-N 2.86Å; L40-T42 VanDerWaalsContact C-N 3.29Å; L40-T42 PolarHBondContact O-N 3.12Å; T42-M45 PolarHBondContact O-N 3.39Å; T42-L46 WeakPolarHBondContact O-CB 3.23Å; T42-L46 PolarHBondContact O-N 3.41Å; T42-L63 HydrophobicContact CG2-CB 4Å; T42-L63 HydrophobicContact CG2-CD2 3.39Å; T42-L63 HydrophobicContact CG2-CG 4.26Å; T42-F64 HydrophobicContact CG2-CZ 4.43Å
43L73.2Confident64.7Low97 Ų9773.2 Ų73.251%0.50843%0.431SS..Hα-helixtrans-65.9-39.8176-172.668.2000111.6L39 L46 L47L39-L43 WeakPolarHBondContact O-CB 3.21Å; L39-L43 PolarHBondContact O-N 3.35Å; L43-L46 PolarHBondContact O-N 2.9Å; L43-L47 HydrophobicContact CD1-CD1 4.12Å; L43-L47 HydrophobicContact CD1-CG 4.34Å; L43-L47 HydrophobicContact CD2-CD1 4.34Å; L43-L47 HydrophobicContact CG-CD1 3.8Å; L43-L47 HydrophobicContact CG-CG 4.36Å; L43-L47 VanDerWaalsContact O-CB 3.3Å; L43-L47 WeakPolarHBondContact O-CB 3.26Å; L43-L47 VanDerWaalsContact O-CG 3.27Å; L43-L47 WeakPolarHBondContact O-CG 3.22Å; L43-L47 PolarHBondContact O-N 3.33Å
44A72Confident65Low4 Ų471.1 Ų71.13%0.03342%0.423CS..Hα-helixtrans-66.1-42.117600000112.4L40 L47 G48 I49 I51 F53L40-A44 WeakPolarHBondContact O-CB 3.09Å; L40-A44 PolarHBondContact O-N 3.44Å; A44-L47 PolarHBondContact O-N 2.88Å; A44-G48 PolarHBondContact O-N 3.25Å; A44-G48 VanDerWaalsContact O-N 3.08Å; A44-I49 CarbonylContact C-O 3.56Å; A44-I49 PolarHBondContact O-N 3.17Å; A44-I51 HydrophobicContact CB-CB 4.24Å; A44-I51 HydrophobicContact CB-CD1 3.81Å; A44-I51 HydrophobicContact CB-CG1 4.43Å; A44-F53 HydrophobicContact CB-CD2 4.39Å; A44-F53 HydrophobicContact CB-CE2 3.22Å; A44-F53 HydrophobicContact CB-CZ 3.5Å
45M71.7Confident65.5Low96 Ų9674.5 Ų74.547%0.47344%0.438SS..Hα-helixtrans-60-44.6170.9-94.8-74.7-179.600111.6P41 T42 G48 F59 F64P41-M45 WeakPolarHBondContact O-CB 3.44Å; P41-M45 PolarHBondContact O-N 2.96Å; T42-M45 PolarHBondContact O-N 3.39Å; M45-G48 PolarHBondContact O-N 3.22Å; M45-F59 HydrophobicContact CB-CE1 4.47Å; M45-F59 HydrophobicContact CE-CE1 4.03Å; M45-F59 HydrophobicContact CE-CE2 4.37Å; M45-F59 HydrophobicContact CE-CZ 3.74Å; M45-F59 HydrophobicContact CG-CD1 3.99Å; M45-F59 HydrophobicContact CG-CE1 3.43Å; M45-F59 VanDerWaalsContact CG-CE1 3.43Å; M45-F59 HydrophobicContact CG-CZ 4.13Å; M45-F64 HydrophobicContact CB-CE1 4.4Å; M45-F64 HydrophobicContact CB-CZ 4.36Å
46L75Confident65.9Low119 Ų11973.2 Ų73.262%0.62342%0.418SS*.Hα-helixtrans-67.5-36.9-179.6-170.765.7000112.7T42 L43 G48T42-L46 WeakPolarHBondContact O-CB 3.23Å; T42-L46 PolarHBondContact O-N 3.41Å; L43-L46 PolarHBondContact O-N 2.9Å; L46-G48 VanDerWaalsContact C-N 3.26Å; L46-G48 PolarHBondContact O-N 2.93Å
47L78.1Confident66.2Low111 Ų11168.9 Ų68.958%0.58141%0.408SS*.THydrogen-bonded Turntrans-81.5-1.2175.9-68.2172.9000113.2L43 A44 I49L43-L47 HydrophobicContact CD1-CD1 4.12Å; L43-L47 HydrophobicContact CD1-CG 4.34Å; L43-L47 HydrophobicContact CD2-CD1 4.34Å; L43-L47 HydrophobicContact CG-CD1 3.8Å; L43-L47 HydrophobicContact CG-CG 4.36Å; L43-L47 VanDerWaalsContact O-CB 3.3Å; L43-L47 WeakPolarHBondContact O-CB 3.26Å; L43-L47 VanDerWaalsContact O-CG 3.27Å; L43-L47 WeakPolarHBondContact O-CG 3.22Å; L43-L47 PolarHBondContact O-N 3.33Å; A44-L47 PolarHBondContact O-N 2.88Å; L47-I49 HydrophobicContact CB-CD1 3.88Å; L47-I49 HydrophobicContact CB-CG1 3.8Å; L47-I49 HydrophobicContact CD1-CD1 4.08Å; L47-I49 PolarHBondContact O-N 3.1Å
48G73Confident66.4Low63 Ų6367.6 Ų67.665%0.64941%0.409SS*.THydrogen-bonded Turntrans66.718.6-176.800000114A44 M45 L46 P50A44-G48 PolarHBondContact O-N 3.25Å; A44-G48 VanDerWaalsContact O-N 3.08Å; M45-G48 PolarHBondContact O-N 3.22Å; L46-G48 VanDerWaalsContact C-N 3.26Å; L46-G48 PolarHBondContact O-N 2.93Å; G48-P50 WeakPolarHBondContact O-CD 3.31Å
49I71.2Confident66.6Low81 Ų8167 Ų6742%0.41540%0.403SS..  trans-89.8115.5-179.5-49.8176.4000108.2A44 L47 I51A44-I49 CarbonylContact C-O 3.56Å; A44-I49 PolarHBondContact O-N 3.17Å; L47-I49 HydrophobicContact CB-CD1 3.88Å; L47-I49 HydrophobicContact CB-CG1 3.8Å; L47-I49 HydrophobicContact CD1-CD1 4.08Å; L47-I49 PolarHBondContact O-N 3.1Å; I49-I51 HydrophobicContact CB-CD1 4.25Å; I49-I51 HydrophobicContact CB-CG1 4.48Å; I49-I51 HydrophobicContact CG2-CD1 3.78Å; I49-I51 HydrophobicContact CG2-CG1 3.74Å; I49-I51 PolarHBondContact O-N 3.31Å
50P62Low66.7Low125 Ų12565.1 Ų65.181%0.81239%0.393SS*.  trans-76.375-179.632.7-35.9000110.5G48G48-P50 WeakPolarHBondContact O-CD 3.31Å
51I62.6Low66.4Low40 Ų4064.8 Ų64.821%0.20539%0.393CS..  trans-92129.1169.6-59.5153.7000107.3A44 I49 F53A44-I51 HydrophobicContact CB-CB 4.24Å; A44-I51 HydrophobicContact CB-CD1 3.81Å; A44-I51 HydrophobicContact CB-CG1 4.43Å; I49-I51 HydrophobicContact CB-CD1 4.25Å; I49-I51 HydrophobicContact CB-CG1 4.48Å; I49-I51 HydrophobicContact CG2-CD1 3.78Å; I49-I51 HydrophobicContact CG2-CG1 3.74Å; I49-I51 PolarHBondContact O-N 3.31Å; I51-F53 HydrophobicContact CB-CD2 4.26Å; I51-F53 HydrophobicContact CB-CE1 4.47Å; I51-F53 HydrophobicContact CB-CE2 3.34Å; I51-F53 HydrophobicContact CB-CZ 3.46Å; I51-F53 VanDerWaalsContact CB-CZ 3.46Å; I51-F53 HydrophobicContact CD1-CZ 4.14Å; I51-F53 HydrophobicContact CG1-CZ 4.42Å; I51-F53 HydrophobicContact CG2-CD2 4.32Å; I51-F53 HydrophobicContact CG2-CE1 3.86Å; I51-F53 HydrophobicContact CG2-CE2 3.58Å; I51-F53 HydrophobicContact CG2-CZ 3.3Å; I51-F53 WeakPolarHBondContact O-CD2 3.35Å; I51-F53 WeakPolarHBondContact O-CE2 3.02Å; I51-F53 PolarHBondContact O-N 2.92Å
52P59.3Low66.7Low103 Ų10371.4 Ų71.467%0.66942%0.424SS*.  trans-79.5101.4-178.129.6-33.1000111.1S54P52-S54 VanDerWaalsContact C-N 3.29Å; P52-S54 PolarHBondContact O-N 2.89Å
53F60.4Low66.7Low10 Ų1076.3 Ų76.34%0.04445%0.449CS..  trans-90.525.1178.6-64.6-81.7000114.6L40 P41 A44 I51 N55 L56L40-F53 HydrophobicContact CB-CD1 4.39Å; L40-F53 HydrophobicContact CB-CE1 3.62Å; L40-F53 HydrophobicContact CB-CZ 4.24Å; L40-F53 HydrophobicContact CD2-CE1 3.84Å; L40-F53 HydrophobicContact CG-CE1 3.46Å; L40-F53 VanDerWaalsContact CG-CE1 3.46Å; L40-F53 HydrophobicContact CG-CZ 3.87Å; L40-F53 WeakPolarHBondContact O-CZ 3.08Å; P41-F53 VanDerWaalsContact CA-CE2 3.41Å; P41-F53 HydrophobicContact CB-CB 3.6Å; P41-F53 HydrophobicContact CB-CD1 3.75Å; P41-F53 HydrophobicContact CB-CD2 3.65Å; P41-F53 HydrophobicContact CB-CE1 4.43Å; P41-F53 HydrophobicContact CB-CE2 4.28Å; P41-F53 HydrophobicContact CB-CG 3.35Å; P41-F53 HydrophobicContact CG-CB 3.65Å; P41-F53 HydrophobicContact CG-CD1 3.42Å; P41-F53 VanDerWaalsContact CG-CD1 3.42Å; P41-F53 HydrophobicContact CG-CD2 4.27Å; P41-F53 HydrophobicContact CG-CE1 4.22Å; P41-F53 HydrophobicContact CG-CG 3.49Å; P41-F53 VanDerWaalsContact CG-CG 3.49Å; P41-F53 VanDerWaalsContact N-CE1 3.31Å; A44-F53 HydrophobicContact CB-CD2 4.39Å; A44-F53 HydrophobicContact CB-CE2 3.22Å; A44-F53 HydrophobicContact CB-CZ 3.5Å; I51-F53 HydrophobicContact CB-CD2 4.26Å; I51-F53 HydrophobicContact CB-CE1 4.47Å; I51-F53 HydrophobicContact CB-CE2 3.34Å; I51-F53 HydrophobicContact CB-CZ 3.46Å; I51-F53 VanDerWaalsContact CB-CZ 3.46Å; I51-F53 HydrophobicContact CD1-CZ 4.14Å; I51-F53 HydrophobicContact CG1-CZ 4.42Å; I51-F53 HydrophobicContact CG2-CD2 4.32Å; I51-F53 HydrophobicContact CG2-CE1 3.86Å; I51-F53 HydrophobicContact CG2-CE2 3.58Å; I51-F53 HydrophobicContact CG2-CZ 3.3Å; I51-F53 WeakPolarHBondContact O-CD2 3.35Å; I51-F53 WeakPolarHBondContact O-CE2 3.02Å; I51-F53 PolarHBondContact O-N 2.92Å; F53-N55 PolarHBondContact O-N 3.32Å; F53-L56 HydrophobicContact CB-CB 4.11Å; F53-L56 HydrophobicContact CD1-CB 3.87Å; F53-L56 HydrophobicContact CD1-CD1 3.29Å; F53-L56 HydrophobicContact CD1-CG 4.15Å; F53-L56 HydrophobicContact CE1-CD1 3.79Å; F53-L56 HydrophobicContact CG-CB 4.49Å; F53-L56 HydrophobicContact CG-CD1 4.32Å; F53-L56 PolarHBondContact O-N 3.47Å
54S59Low66.4Low99 Ų9972.5 Ų72.569%0.69243%0.429SS*.THydrogen-bonded Turntrans-51.7-24-174.1-164.40000114.2P52P52-S54 VanDerWaalsContact C-N 3.29Å; P52-S54 PolarHBondContact O-N 2.89Å
55N59.9Low66.6Low155 Ų15578.9 Ų78.983%0.82947%0.467SS*.THydrogen-bonded Turntrans-112.32.6-179.3-63.94.4000113.9F53F53-N55 PolarHBondContact O-N 3.32Å
56L60.1Low67Low61 Ų6178.9 Ų78.932%0.31947%0.469SS..THydrogen-bonded Turntrans-106.51.1-168.3-67.5169.9000114.1L37 P41 F53L37-L56 HydrophobicContact CB-CD2 4.01Å; L37-L56 HydrophobicContact CD1-CD2 4.07Å; L37-L56 HydrophobicContact CD2-CD2 4.4Å; L37-L56 HydrophobicContact CG-CD2 4.38Å; P41-L56 HydrophobicContact CG-CB 4.24Å; F53-L56 HydrophobicContact CB-CB 4.11Å; F53-L56 HydrophobicContact CD1-CB 3.87Å; F53-L56 HydrophobicContact CD1-CD1 3.29Å; F53-L56 HydrophobicContact CD1-CG 4.15Å; F53-L56 HydrophobicContact CE1-CD1 3.79Å; F53-L56 HydrophobicContact CG-CB 4.49Å; F53-L56 HydrophobicContact CG-CD1 4.32Å; F53-L56 PolarHBondContact O-N 3.47Å
57G59.7Low67.1Low38 Ų3877.3 Ų77.339%0.39247%0.469SS..  trans112.1160.7170.400000113.8
58A64.5Low67.3Low52 Ų5278.1 Ų78.143%0.4347%0.473SS..  trans-51.1138.9177.700000112.1I60 N77A58-I60 PolarHBondContact O-N 3.33Å; A58-N77 WeakPolarHBondContact CA-OD1 2.95Å; A58-N77 WeakPolarHBondContact CB-OD1 3.43Å
59F65Low67.6Low13 Ų1379 Ų796%0.05746%0.462CS..  trans-58.8137.8166.7-64.4-73.5000109.1P41 M45 P61 A73 V76P41-F59 HydrophobicContact CB-CD1 4.17Å; P41-F59 HydrophobicContact CB-CE1 3.96Å; M45-F59 HydrophobicContact CB-CE1 4.47Å; M45-F59 HydrophobicContact CE-CE1 4.03Å; M45-F59 HydrophobicContact CE-CE2 4.37Å; M45-F59 HydrophobicContact CE-CZ 3.74Å; M45-F59 HydrophobicContact CG-CD1 3.99Å; M45-F59 HydrophobicContact CG-CE1 3.43Å; M45-F59 VanDerWaalsContact CG-CE1 3.43Å; M45-F59 HydrophobicContact CG-CZ 4.13Å; F59-P61 WeakPolarHBondContact O-CD 3.09Å; F59-A73 HydrophobicContact CB-CB 4.33Å; F59-V76 HydrophobicContact CD2-CB 4.22Å; F59-V76 HydrophobicContact CD2-CG1 4.06Å; F59-V76 HydrophobicContact CE2-CB 4.05Å; F59-V76 HydrophobicContact CE2-CG1 3.45Å; F59-V76 VanDerWaalsContact CE2-CG1 3.45Å; F59-V76 HydrophobicContact CZ-CG1 4.42Å
60I71.6Confident67.9Low62 Ų6281.1 Ų81.132%0.31847%0.465SS..  trans-88.496.6175.1-61.2173.7000106.8A58 E62 L63A58-I60 PolarHBondContact O-N 3.33Å; I60-E62 HydrophobicContact CG2-CB 4.16Å; I60-E62 WeakPolarHBondContact CG2-OE2 3.12Å; I60-E62 PolarHBondContact O-N 2.92Å; I60-E62 VanDerWaalsContact O-N 3.1Å; I60-L63 PolarHBondContact O-N 3.28Å
61P64.2Low68.8Low30 Ų3080.2 Ų80.220%0.19545%0.453CS..G310 helixtrans-64.1-15-175.829.2-37.6000112.9F59 L63 R70F59-P61 WeakPolarHBondContact O-CD 3.09Å; P61-L63 VanDerWaalsContact C-N 3.29Å; P61-L63 PolarHBondContact O-N 2.91Å; P61-R70 WeakPolarHBondContact O-CG 3.08Å
62E70Confident69.8Low139 Ų13982.7 Ų82.765%0.6546%0.463SS*.G310 helixtrans-71.8-19.3-179.5-61.875.4-16400113.3I60 F64I60-E62 HydrophobicContact CG2-CB 4.16Å; I60-E62 WeakPolarHBondContact CG2-OE2 3.12Å; I60-E62 PolarHBondContact O-N 2.92Å; I60-E62 VanDerWaalsContact O-N 3.1Å; E62-F64 VanDerWaalsContact C-N 3.34Å
63L67.5Low70.4Confident104 Ų10478.1 Ų78.155%0.54543%0.434SS..G310 helixtrans-82.5-13.2179.7-158.765.9000113.2T42 I60 P61T42-L63 HydrophobicContact CG2-CB 4Å; T42-L63 HydrophobicContact CG2-CD2 3.39Å; T42-L63 HydrophobicContact CG2-CG 4.26Å; I60-L63 PolarHBondContact O-N 3.28Å; P61-L63 VanDerWaalsContact C-N 3.29Å; P61-L63 PolarHBondContact O-N 2.91Å
64F67.6Low71.3Confident18 Ų1879.7 Ų79.78%0.07945%0.449CS..  trans-86.3119.7179.6-54.9-78.5000110T42 M45 E62 D66 I69 R70 A73T42-F64 HydrophobicContact CG2-CZ 4.43Å; M45-F64 HydrophobicContact CB-CE1 4.4Å; M45-F64 HydrophobicContact CB-CZ 4.36Å; E62-F64 VanDerWaalsContact C-N 3.34Å; F64-D66 VanDerWaalsContact C-N 3.33Å; F64-I69 HydrophobicContact CB-CB 4.23Å; F64-I69 HydrophobicContact CB-CG2 4.1Å; F64-I69 HydrophobicContact CD1-CB 4.24Å; F64-I69 HydrophobicContact CD1-CG2 3.24Å; F64-I69 HydrophobicContact CE1-CG2 3.71Å; F64-I69 HydrophobicContact CG-CB 4.39Å; F64-I69 HydrophobicContact CG-CG2 3.72Å; F64-R70 HydrophobicContact CB-CB 4.48Å; F64-R70 HydrophobicContact CB-CG 3.58Å; F64-R70 WeakPolarHBondContact O-CD 3.48Å; F64-R70 WeakPolarHBondContact O-CG 2.89Å; F64-A73 HydrophobicContact CD2-CB 3.68Å; F64-A73 HydrophobicContact CE2-CB 3.25Å; F64-A73 HydrophobicContact CZ-CB 3.92Å
65T75.2Confident72.3Confident137 Ų13780.6 Ų80.684%0.8444%0.438SS*.  trans-70.5-31.7175.243.90000112.2
66D80.6Confident73.1Confident96 Ų9675 Ų7551%0.51341%0.409SS..SBendtrans-84.4123.5-177.9-72-82.8000112.4F64 N68 I69 R70F64-D66 VanDerWaalsContact C-N 3.33Å; D66-N68 PolarHBondContact O-N 3.44Å; D66-I69 HydrophobicContact CB-CB 4.08Å; D66-I69 HydrophobicContact CB-CG1 3.72Å; D66-I69 PolarHBondContact O-N 2.84Å; D66-R70 VanDerWaalsContact O-CG 3.31Å; D66-R70 WeakPolarHBondContact O-CG 3.43Å; D66-R70 PolarHBondContact O-N 3.48Å
67S78.4Confident73.7Confident87 Ų8774.6 Ų74.661%0.60841%0.407SS*.Hα-helixtrans-55.1-37.9178.156.80000113.2L71S67-L71 PolarHBondContact O-N 2.87Å; S67-L71 VanDerWaalsContact O-N 3.1Å
68N82.4Confident74.4Confident127 Ų12778 Ų7868%0.67942%0.42SS*.Hα-helixtrans-65.2-41.8177.2-68.8-57.5000112.2D66 Q72D66-N68 PolarHBondContact O-N 3.44Å; N68-Q72 PolarHBondContact O-N 2.85Å; N68-Q72 VanDerWaalsContact O-N 3.1Å
69I77.9Confident74.9Confident81 Ų8183.5 Ų83.542%0.41543%0.431SS..Hα-helixtrans-74.6-36.5-179.3-53.2-61000110.5F64 D66 L71 Q72 A73F64-I69 HydrophobicContact CB-CB 4.23Å; F64-I69 HydrophobicContact CB-CG2 4.1Å; F64-I69 HydrophobicContact CD1-CB 4.24Å; F64-I69 HydrophobicContact CD1-CG2 3.24Å; F64-I69 HydrophobicContact CE1-CG2 3.71Å; F64-I69 HydrophobicContact CG-CB 4.39Å; F64-I69 HydrophobicContact CG-CG2 3.72Å; D66-I69 HydrophobicContact CB-CB 4.08Å; D66-I69 HydrophobicContact CB-CG1 3.72Å; D66-I69 PolarHBondContact O-N 2.84Å; I69-L71 PolarHBondContact O-N 3.21Å; I69-Q72 PolarHBondContact O-N 3.4Å; I69-A73 WeakPolarHBondContact O-CB 3.3Å; I69-A73 PolarHBondContact O-N 3.33Å
70R78Confident74.8Confident127 Ų12786.4 Ų86.448%0.47944%0.444SS..Hα-helixtrans-57-47.9171.9-68.9177.971.7-171-4.8112.1P61 F64 D66 Q72 A73 A74P61-R70 WeakPolarHBondContact O-CG 3.08Å; F64-R70 HydrophobicContact CB-CB 4.48Å; F64-R70 HydrophobicContact CB-CG 3.58Å; F64-R70 WeakPolarHBondContact O-CD 3.48Å; F64-R70 WeakPolarHBondContact O-CG 2.89Å; D66-R70 VanDerWaalsContact O-CG 3.31Å; D66-R70 WeakPolarHBondContact O-CG 3.43Å; D66-R70 PolarHBondContact O-N 3.48Å; R70-Q72 VanDerWaalsContact C-N 3.3Å; R70-Q72 PolarHBondContact O-N 3.46Å; R70-A73 PolarHBondContact O-N 3.01Å; R70-A74 WeakPolarHBondContact O-CB 3.37Å; R70-A74 PolarHBondContact O-N 3.16Å
71L81.3Confident74.3Confident105 Ų10588.7 Ų88.755%0.5547%0.466SS..Hα-helixtrans-64.9-37.9178.9-171.9141.8000111.1S67 I69 R75S67-L71 PolarHBondContact O-N 2.87Å; S67-L71 VanDerWaalsContact O-N 3.1Å; I69-L71 PolarHBondContact O-N 3.21Å; L71-R75 VanDerWaalsContact O-CB 3.24Å; L71-R75 WeakPolarHBondContact O-CB 3.2Å; L71-R75 PolarHBondContact O-N 3.45Å
72Q82.6Confident73.7Confident92 Ų9296.9 Ų96.943%0.4351%0.508SS..Hα-helixtrans-66.1-44.4175.1-170.269.6-9.500111.7N68 I69 R70 R75 V76N68-Q72 PolarHBondContact O-N 2.85Å; N68-Q72 VanDerWaalsContact O-N 3.1Å; I69-Q72 PolarHBondContact O-N 3.4Å; R70-Q72 VanDerWaalsContact C-N 3.3Å; R70-Q72 PolarHBondContact O-N 3.46Å; Q72-R75 WeakPolarHBondContact O-CB 3.3Å; Q72-R75 PolarHBondContact O-N 3.26Å; Q72-V76 VanDerWaalsContact O-CG2 3.3Å; Q72-V76 WeakPolarHBondContact O-CG2 3.09Å; Q72-V76 PolarHBondContact O-N 3.09Å
73A73Confident73.9Confident7 Ų794.8 Ų94.86%0.05850%0.501CS..Hα-helixtrans-63.3-43.5176.700000111.9F59 F64 I69 R70 R75 V76 N77F59-A73 HydrophobicContact CB-CB 4.33Å; F64-A73 HydrophobicContact CD2-CB 3.68Å; F64-A73 HydrophobicContact CE2-CB 3.25Å; F64-A73 HydrophobicContact CZ-CB 3.92Å; I69-A73 WeakPolarHBondContact O-CB 3.3Å; I69-A73 PolarHBondContact O-N 3.33Å; R70-A73 PolarHBondContact O-N 3.01Å; A73-R75 VanDerWaalsContact C-N 3.34Å; A73-R75 PolarHBondContact O-N 3.3Å; A73-V76 PolarHBondContact O-N 3.27Å; A73-N77 WeakPolarHBondContact O-CB 3.24Å; A73-N77 PolarHBondContact O-N 3.18Å
74A77.9Confident74.2Confident43 Ų4394.3 Ų94.336%0.35550%0.499SS..Hα-helixtrans-61.1-42.5174.300000111.8R70 N77 V78R70-A74 WeakPolarHBondContact O-CB 3.37Å; R70-A74 PolarHBondContact O-N 3.16Å; A74-N77 WeakPolarHBondContact O-CB 3.04Å; A74-N77 PolarHBondContact O-N 3.25Å; A74-V78 WeakPolarHBondContact O-CG2 2.97Å; A74-V78 PolarHBondContact O-N 3.1Å; A74-V78 VanDerWaalsContact O-N 3.09Å
75R81.4Confident74.6Confident119 Ų11998.6 Ų98.645%0.44952%0.522SS..Hα-helixtrans-61.1-46.9175.6176.5-174.9-70155.9-7.8111.6L71 Q72 A73 N77 V78 Y79L71-R75 VanDerWaalsContact O-CB 3.24Å; L71-R75 WeakPolarHBondContact O-CB 3.2Å; L71-R75 PolarHBondContact O-N 3.45Å; Q72-R75 WeakPolarHBondContact O-CB 3.3Å; Q72-R75 PolarHBondContact O-N 3.26Å; A73-R75 VanDerWaalsContact C-N 3.34Å; A73-R75 PolarHBondContact O-N 3.3Å; R75-N77 VanDerWaalsContact C-N 3.25Å; R75-N77 PolarHBondContact O-N 3.43Å; R75-V78 PolarHBondContact O-N 2.81Å; R75-Y79 HydrophobicContact CG-CD2 3.84Å; R75-Y79 HydrophobicContact CG-CE2 3.42Å; R75-Y79 VanDerWaalsContact CG-CE2 3.42Å; R75-Y79 WeakPolarHBondContact O-CD2 3.39Å; R75-Y79 PolarHBondContact O-N 2.98Å; R75-Y79 VanDerWaalsContact O-N 3.16Å
76V75.8Confident74.5Confident37 Ų3796.3 Ų96.322%0.22450%0.504CS..Hα-helixtrans-65.2-34.4178.3-176.20000110.7F59 Q72 A73 V78 Y79 Q80F59-V76 HydrophobicContact CD2-CB 4.22Å; F59-V76 HydrophobicContact CD2-CG1 4.06Å; F59-V76 HydrophobicContact CE2-CB 4.05Å; F59-V76 HydrophobicContact CE2-CG1 3.45Å; F59-V76 VanDerWaalsContact CE2-CG1 3.45Å; F59-V76 HydrophobicContact CZ-CG1 4.42Å; Q72-V76 VanDerWaalsContact O-CG2 3.3Å; Q72-V76 WeakPolarHBondContact O-CG2 3.09Å; Q72-V76 PolarHBondContact O-N 3.09Å; A73-V76 PolarHBondContact O-N 3.27Å; V76-V78 VanDerWaalsContact C-N 3.34Å; V76-V78 PolarHBondContact O-N 3.41Å; V76-Y79 PolarHBondContact O-N 2.73Å; V76-Q80 HydrophobicContact CG1-CG 4.33Å; V76-Q80 VanDerWaalsContact O-CG 3.3Å; V76-Q80 WeakPolarHBondContact O-CG 3.49Å; V76-Q80 PolarHBondContact O-N 2.96Å
77N73Confident74.1Confident53 Ų5396.3 Ų96.328%0.28350%0.503SS..Hα-helixtrans-62.6-39.5175.7-158.443.5000112.7A58 A73 A74 R75 Q80 S81A58-N77 WeakPolarHBondContact CA-OD1 2.95Å; A58-N77 WeakPolarHBondContact CB-OD1 3.43Å; A73-N77 WeakPolarHBondContact O-CB 3.24Å; A73-N77 PolarHBondContact O-N 3.18Å; A74-N77 WeakPolarHBondContact O-CB 3.04Å; A74-N77 PolarHBondContact O-N 3.25Å; R75-N77 VanDerWaalsContact C-N 3.25Å; R75-N77 PolarHBondContact O-N 3.43Å; N77-Q80 PolarHBondContact O-N 3.31Å; N77-S81 PolarHBondContact O-N 3.11Å
78V74.4Confident73.9Confident108 Ų10896.9 Ų96.966%0.65550%0.496SS*.Hα-helixtrans-63-43.3173.1174.50000111A74 R75 V76 Q80 S81A74-V78 WeakPolarHBondContact O-CG2 2.97Å; A74-V78 PolarHBondContact O-N 3.1Å; A74-V78 VanDerWaalsContact O-N 3.09Å; R75-V78 PolarHBondContact O-N 2.81Å; V76-V78 VanDerWaalsContact C-N 3.34Å; V76-V78 PolarHBondContact O-N 3.41Å; V78-Q80 PolarHBondContact O-N 3.34Å; V78-S81 PolarHBondContact O-N 3.3Å
79Y74.4Confident73.3Confident168 Ų16894.8 Ų94.866%0.65948%0.483SS*.Hα-helixtrans-68-19.6177.7-72.7-62000114.1R75 V76R75-Y79 HydrophobicContact CG-CD2 3.84Å; R75-Y79 HydrophobicContact CG-CE2 3.42Å; R75-Y79 VanDerWaalsContact CG-CE2 3.42Å; R75-Y79 WeakPolarHBondContact O-CD2 3.39Å; R75-Y79 PolarHBondContact O-N 2.98Å; R75-Y79 VanDerWaalsContact O-N 3.16Å; V76-Y79 PolarHBondContact O-N 2.73Å
80Q63.7Low72.9Confident74 Ų7495.8 Ų95.835%0.34649%0.488SS..Hα-helixtrans-87.6-17177.9-74.6178.7-7.600113.6V76 N77 V78V76-Q80 HydrophobicContact CG1-CG 4.33Å; V76-Q80 VanDerWaalsContact O-CG 3.3Å; V76-Q80 WeakPolarHBondContact O-CG 3.49Å; V76-Q80 PolarHBondContact O-N 2.96Å; N77-Q80 PolarHBondContact O-N 3.31Å; V78-Q80 PolarHBondContact O-N 3.34Å
81S61.9Low72.5Confident111 Ų11193.3 Ų93.378%0.77649%0.489SS*.  trans-94.29-178.2-169.30000114N77 V78N77-S81 PolarHBondContact O-N 3.11Å; V78-S81 PolarHBondContact O-N 3.3Å
82N50.3Low71.7Confident202 Ų20292.2 Ų92.2100%1.0848%0.483SS*.  trans-121.40178.2-177.388.4000110.9

Retrieved 82 of 82 residues in 71.8 ms (Link to these results)