A0A093HRI2_STRCA Loading...

Protein RD3-like

AlphaFold DB , UniProt , Accession A0A093HRI2, Species STRCA (Struthio camelus australis), Gene n/a, Length 198 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
1M39Very low49.3Very low217 Ų217133.3 Ų133.3100%1.06967%0.668SS**  01310-69.2-166.815200107.9L3M1-L3 PolarHBondContact O-N 3.15Å
2P47.3Very low49.2Very low117 Ų117135.2 Ų135.276%0.7668%0.682SS**  trans-81.4100.6177.232.1-26.1000107.6F4P2-F4 PolarHBondContact O-N 2.98Å
3L53.3Low49Very low124 Ų124129.5 Ų129.565%0.64965%0.654SS**THydrogen-bonded Turntrans-70.86.7176.7-68169.4000113M1M1-L3 PolarHBondContact O-N 3.15Å
4F52.1Low48.6Very low107 Ų107128.4 Ų128.447%0.46967%0.665SS.*THydrogen-bonded Turntrans-130.231.2-171.8-54.2-70.1000113.9P2 W6 M7P2-F4 PolarHBondContact O-N 2.98Å; F4-W6 AromaticContact CD1-NE1 3.98Å; F4-W6 PolarHBondContact O-N 2.87Å; F4-W6 VanDerWaalsContact O-N 3.15Å; F4-M7 HydrophobicContact CB-CE 4.45Å; F4-M7 HydrophobicContact CB-CG 4.24Å; F4-M7 HydrophobicContact CB-SD 4.13Å; F4-M7 HydrophobicContact CD1-CE 3.64Å; F4-M7 HydrophobicContact CD1-SD 4.42Å; F4-M7 HydrophobicContact CE1-CE 4.19Å; F4-M7 HydrophobicContact CG-CE 4.18Å; F4-M7 HydrophobicContact CG-SD 4.44Å; F4-M7 PolarHBondContact O-N 3.32Å
5G54.3Low48.8Very low66 Ų66123.5 Ų123.568%0.6864%0.635SS**THydrogen-bonded Turntrans-60.5-19.9176.400000115.2
6W59.6Low49.3Very low119 Ų119126.5 Ų126.545%0.45164%0.642SS.*THydrogen-bonded Turntrans-81.9-10.7173.660.5-14.1000115.8F4 K8 V104F4-W6 AromaticContact CD1-NE1 3.98Å; F4-W6 PolarHBondContact O-N 2.87Å; F4-W6 VanDerWaalsContact O-N 3.15Å; W6-K8 PolarHBondContact O-N 3.29Å; W6-V104 HydrophobicContact CH2-CG1 4.01Å; W6-V104 HydrophobicContact CH2-CG2 3.74Å; W6-V104 HydrophobicContact CZ2-CG1 4.18Å
7M48.4Very low49.6Very low75 Ų75125.1 Ų125.137%0.36964%0.643SS.*  trans-75.634.9170.9-69.2-173.5-175.300111.6F4 W9 Y117F4-M7 HydrophobicContact CB-CE 4.45Å; F4-M7 HydrophobicContact CB-CG 4.24Å; F4-M7 HydrophobicContact CB-SD 4.13Å; F4-M7 HydrophobicContact CD1-CE 3.64Å; F4-M7 HydrophobicContact CD1-SD 4.42Å; F4-M7 HydrophobicContact CE1-CE 4.19Å; F4-M7 HydrophobicContact CG-CE 4.18Å; F4-M7 HydrophobicContact CG-SD 4.44Å; F4-M7 PolarHBondContact O-N 3.32Å; M7-W9 PolarHBondContact O-N 3.05Å; M7-Y117 HydrophobicContact CE-CD1 4.23Å; M7-Y117 HydrophobicContact CE-CE1 3.68Å; M7-Y117 HydrophobicContact CG-CE1 4.08Å; M7-Y117 HydrophobicContact SD-CE1 4.04Å
8K51.4Low50.4Low189 Ų189122.8 Ų122.882%0.82264%0.636SS**  trans-89.999.9171.9-146.7-171.4101.7-179.80107.9W6 S10W6-K8 PolarHBondContact O-N 3.29Å; K8-S10 PolarHBondContact O-N 3.4Å
9W45.2Very low51.6Low188 Ų188123.9 Ų123.971%0.71264%0.638SS**  trans-56.7118.2-176.1-70.742.8000111.4M7M7-W9 PolarHBondContact O-N 3.05Å
10S46.1Very low52.8Low82 Ų82121.3 Ų121.357%0.57362%0.62SS**  trans-78.5115.7155.259.50000107.8K8K8-S10 PolarHBondContact O-N 3.4Å
11K45.6Very low53.9Low182 Ų182121.1 Ų121.179%0.79163%0.627SS**  trans-79.6135168.5-84.5175176.4175.30108.1
12N48.7Very low55.9Low156 Ų156112.9 Ų112.983%0.83460%0.598SS**  trans77.499178.4-64.2-2000115.5
13D46.7Very low57.9Low61 Ų61107.6 Ų107.633%0.32656%0.564SS.*  trans-112.6107.2156.8-64.6-38.1000108.6Y15 K124D13-Y15 HydrophobicContact CB-CD2 3.33Å; D13-Y15 HydrophobicContact CB-CE2 3.04Å; D13-Y15 HydrophobicContact CB-CG 4.29Å; D13-Y15 VanDerWaalsContact CG-CE2 3.43Å; D13-Y15 PolarHBondContact O-N 3.21Å; D13-Y15 VanDerWaalsContact O-N 3.08Å; D13-Y15 VanDerWaalsContact OD2-CE2 3.24Å; D13-Y15 WeakPolarHBondContact OD2-CE2 3.35Å; D13-Y15 PolarHBondContact OD2-OH 2.99Å; D13-K124 IonicContact OD2-NZ 2.62Å; D13-K124 PolarHBondContact OD2-NZ 3.44Å
14S42.6Very low59.7Low115 Ų115107.5 Ų107.580%0.80456%0.56SS**  trans-77.674.1164162.70000108K16S14-K16 PolarHBondContact O-N 3.02Å; S14-K16 VanDerWaalsContact O-N 3.13Å
15Y52.6Low61.6Low55 Ų55107.1 Ų107.122%0.21657%0.566CS.*  trans-66.4112.7174.8-76.9-78.6000109.4D13 P17 L85 Q88 L127D13-Y15 HydrophobicContact CB-CD2 3.33Å; D13-Y15 HydrophobicContact CB-CE2 3.04Å; D13-Y15 HydrophobicContact CB-CG 4.29Å; D13-Y15 VanDerWaalsContact CG-CE2 3.43Å; D13-Y15 PolarHBondContact O-N 3.21Å; D13-Y15 VanDerWaalsContact O-N 3.08Å; D13-Y15 VanDerWaalsContact OD2-CE2 3.24Å; D13-Y15 WeakPolarHBondContact OD2-CE2 3.35Å; D13-Y15 PolarHBondContact OD2-OH 2.99Å; Y15-P17 WeakPolarHBondContact O-CD 3.45Å; Y15-L85 HydrophobicContact CE2-CD2 4.14Å; Y15-Q88 VanDerWaalsContact CD1-OE1 3.27Å; Y15-L127 HydrophobicContact CE1-CB 4.46Å; Y15-L127 HydrophobicContact CE1-CD1 4.18Å
16K55.6Low63.6Low171 Ų171104.1 Ų104.174%0.74354%0.535SS*.  trans-72.2121.6163.6-69.7-171.9179.3-179.70107.2S14 T18S14-K16 PolarHBondContact O-N 3.02Å; S14-K16 VanDerWaalsContact O-N 3.13Å; K16-T18 PolarHBondContact O-N 3.42Å
17P55Low65.3Low103 Ų10399.3 Ų99.367%0.66952%0.518SS*.  trans-72.995.3-178.1-10.325.2000110Y15Y15-P17 WeakPolarHBondContact O-CD 3.45Å
18T64.2Low67.5Low84 Ų84101.9 Ų101.952%0.51553%0.528SS..  trans-88.9102.4165.6-53.30000107.3K16K16-T18 PolarHBondContact O-N 3.42Å
19Q71.9Confident69.7Low143 Ų14395.4 Ų95.467%0.66850%0.504SS*.PPolyproline II helixtrans-88.1121178.3-171.9172.215.600109.8S23Q19-S23 WeakPolarHBondContact CG-OG 3.42Å; Q19-S23 PolarHBondContact NE2-OG 2.95Å
20Y76.6Confident72.1Confident72 Ų7286.4 Ų86.428%0.28247%0.47SS..PPolyproline II helixtrans-83149178.2-73-77.1000112.5G22 S23 Q88 Q90Y20-G22 PolarHBondContact O-N 3.15Å; Y20-S23 WeakPolarHBondContact O-CB 3.16Å; Y20-S23 PolarHBondContact O-N 3.43Å; Y20-S23 PolarHBondContact O-OG 2.83Å; Y20-Q88 WeakPolarHBondContact CD2-O 3.42Å; Y20-Q88 WeakPolarHBondContact CE2-O 3.3Å; Y20-Q90 HydrophobicContact CD1-CG 3.95Å; Y20-Q90 HydrophobicContact CD2-CG 3.92Å; Y20-Q90 HydrophobicContact CE1-CG 3.86Å; Y20-Q90 HydrophobicContact CE2-CG 3.82Å; Y20-Q90 HydrophobicContact CG-CG 3.97Å; Y20-Q90 PolarHBondContact OH-NE2 3.06Å
21P76.6Confident74.5Confident118 Ų11883.2 Ų83.277%0.76645%0.446SS*.THydrogen-bonded Turntrans-60.4130.4169.926-32.8000109.9
22G81.2Confident76.9Confident44 Ų4483.8 Ų83.845%0.45444%0.443SS..THydrogen-bonded Turntrans84.34.5-174.600000115.2Y20 E24 V25Y20-G22 PolarHBondContact O-N 3.15Å; G22-E24 PolarHBondContact O-N 3.41Å; G22-E24 VanDerWaalsContact O-N 3.11Å; G22-V25 PolarHBondContact O-N 3.34Å
23S87.8Confident79.2Confident6 Ų678.4 Ų78.44%0.04241%0.413CS..Hα-helixtrans-58.1-25.4178.872.70000114.1Q19 Y20 V26 T27 S87Q19-S23 WeakPolarHBondContact CG-OG 3.42Å; Q19-S23 PolarHBondContact NE2-OG 2.95Å; Y20-S23 WeakPolarHBondContact O-CB 3.16Å; Y20-S23 PolarHBondContact O-N 3.43Å; Y20-S23 PolarHBondContact O-OG 2.83Å; S23-V26 PolarHBondContact O-N 3.06Å; S23-T27 WeakPolarHBondContact O-CB 3.3Å; S23-T27 PolarHBondContact O-N 3.05Å; S23-T27 PolarHBondContact O-OG1 3Å; S23-S87 WeakPolarHBondContact CB-O 3.43Å
24E90.8Very high81.5Confident121 Ų12175.5 Ų75.557%0.56540%0.397SS*.Hα-helixtrans-64.7-42.3179.1-171.4-174.717100111.6G22 V26 T27 K28G22-E24 PolarHBondContact O-N 3.41Å; G22-E24 VanDerWaalsContact O-N 3.11Å; E24-V26 VanDerWaalsContact C-N 3.33Å; E24-T27 PolarHBondContact O-N 2.64Å; E24-K28 HydrophobicContact CG-CD 4.3Å; E24-K28 WeakPolarHBondContact O-CB 3.32Å; E24-K28 VanDerWaalsContact O-CG 3.31Å; E24-K28 WeakPolarHBondContact O-CG 3.24Å; E24-K28 PolarHBondContact O-N 2.93Å; E24-K28 WeakPolarHBondContact OE1-CE 3.36Å; E24-K28 IonicContact OE1-NZ 2.77Å; E24-K28 PolarHBondContact OE1-NZ 2.98Å
25V93.1Very high84Confident99 Ų9974.1 Ų74.160%0.638%0.377SS*.Hα-helixtrans-67.4-39.3178.31800000110.4G22 T29G22-V25 PolarHBondContact O-N 3.34Å; V25-T29 VanDerWaalsContact O-CB 3.3Å; V25-T29 WeakPolarHBondContact O-CB 3.43Å; V25-T29 PolarHBondContact O-N 3.07Å; V25-T29 PolarHBondContact O-OG1 3.15Å
26V95.2Very high85.9Confident4 Ų478.4 Ų78.42%0.02439%0.393CS..Hα-helixtrans-60.7-52.2174.9179.30000110.2S23 E24 K28 T29 L30 I89 P91 T94S23-V26 PolarHBondContact O-N 3.06Å; E24-V26 VanDerWaalsContact C-N 3.33Å; V26-K28 PolarHBondContact O-N 2.81Å; V26-T29 PolarHBondContact O-N 3.38Å; V26-L30 HydrophobicContact CG1-CD1 3.68Å; V26-L30 HydrophobicContact CG1-CG 4.2Å; V26-L30 VanDerWaalsContact O-CB 3.27Å; V26-L30 WeakPolarHBondContact O-CB 3.46Å; V26-L30 WeakPolarHBondContact O-CG 3.48Å; V26-L30 PolarHBondContact O-N 3.47Å; V26-I89 HydrophobicContact CG1-CB 3.92Å; V26-I89 HydrophobicContact CG1-CG2 3.91Å; V26-P91 HydrophobicContact CG2-CB 4.03Å; V26-P91 HydrophobicContact CG2-CG 3.86Å; V26-T94 HydrophobicContact CG1-CG2 4.32Å
27T95.4Very high87.7Confident18 Ų1871.5 Ų71.511%0.1136%0.363CS..Hα-helixtrans-59.1-46.7180-56.60000111.8S23 E24 T29 L31 E83 C86S23-T27 WeakPolarHBondContact O-CB 3.3Å; S23-T27 PolarHBondContact O-N 3.05Å; S23-T27 PolarHBondContact O-OG1 3Å; E24-T27 PolarHBondContact O-N 2.64Å; T27-T29 PolarHBondContact O-N 3.35Å; T27-L31 HydrophobicContact CG2-CD1 3.69Å; T27-L31 HydrophobicContact CG2-CG 4.32Å; T27-L31 WeakPolarHBondContact O-CB 3.34Å; T27-L31 VanDerWaalsContact O-CG 3.25Å; T27-L31 WeakPolarHBondContact O-CG 3.46Å; T27-L31 PolarHBondContact O-N 3.49Å; T27-E83 HydrophobicContact CG2-CB 4.25Å; T27-E83 HydrophobicContact CG2-CG 4.05Å; T27-C86 HydrophobicContact CG2-CB 3.9Å
28K95.4Very high89.5Confident129 Ų12967 Ų6756%0.56133%0.334SS*.Hα-helixtrans-60.8-44.2176.7-75176.7-177.1172.70111.9E24 V26 R32E24-K28 HydrophobicContact CG-CD 4.3Å; E24-K28 WeakPolarHBondContact O-CB 3.32Å; E24-K28 VanDerWaalsContact O-CG 3.31Å; E24-K28 WeakPolarHBondContact O-CG 3.24Å; E24-K28 PolarHBondContact O-N 2.93Å; E24-K28 WeakPolarHBondContact OE1-CE 3.36Å; E24-K28 IonicContact OE1-NZ 2.77Å; E24-K28 PolarHBondContact OE1-NZ 2.98Å; V26-K28 PolarHBondContact O-N 2.81Å; K28-R32 WeakPolarHBondContact O-CB 3.47Å; K28-R32 PolarHBondContact O-N 3.29Å
29T96.8Very high90.7Very high52 Ų5270.4 Ų70.432%0.31934%0.341SS..Hα-helixtrans-64.7-51.6-179.4-59.10000111.3V25 V26 T27 L31 R32 E33 T94 L98V25-T29 VanDerWaalsContact O-CB 3.3Å; V25-T29 WeakPolarHBondContact O-CB 3.43Å; V25-T29 PolarHBondContact O-N 3.07Å; V25-T29 PolarHBondContact O-OG1 3.15Å; V26-T29 PolarHBondContact O-N 3.38Å; T27-T29 PolarHBondContact O-N 3.35Å; T29-L31 PolarHBondContact O-N 2.99Å; T29-R32 WeakPolarHBondContact O-CB 3.44Å; T29-R32 PolarHBondContact O-N 3.05Å; T29-E33 WeakPolarHBondContact O-CG 3.12Å; T29-E33 PolarHBondContact O-N 3.24Å; T29-T94 HydrophobicContact CG2-CG2 4.31Å; T29-L98 HydrophobicContact CG2-CD1 4.31Å
30L97.3Very high91.6Very high0 Ų066 Ų660%032%0.321CS..Hα-helixtrans-59.4-47.7-179.9-80-175.8000112.5V26 R32 E33 L34 C86 I89 T94 V97 L98 F119 L123V26-L30 HydrophobicContact CG1-CD1 3.68Å; V26-L30 HydrophobicContact CG1-CG 4.2Å; V26-L30 VanDerWaalsContact O-CB 3.27Å; V26-L30 WeakPolarHBondContact O-CB 3.46Å; V26-L30 WeakPolarHBondContact O-CG 3.48Å; V26-L30 PolarHBondContact O-N 3.47Å; L30-R32 VanDerWaalsContact C-N 3.32Å; L30-R32 PolarHBondContact O-N 3.44Å; L30-E33 PolarHBondContact O-N 3.31Å; L30-L34 PolarHBondContact O-N 3.01Å; L30-C86 HydrophobicContact CD1-CB 3.94Å; L30-I89 HydrophobicContact CD1-CD1 3.61Å; L30-T94 HydrophobicContact CD2-CG2 4.02Å; L30-T94 HydrophobicContact CG-CG2 4.12Å; L30-V97 HydrophobicContact CD2-CB 4.47Å; L30-V97 HydrophobicContact CD2-CG1 4Å; L30-L98 HydrophobicContact CD2-CD2 3.66Å; L30-L98 HydrophobicContact CD2-CG 3.82Å; L30-F119 HydrophobicContact CB-CZ 3.91Å; L30-F119 HydrophobicContact CD2-CE2 4.42Å; L30-F119 HydrophobicContact CD2-CZ 4.27Å; L30-L123 HydrophobicContact CD1-CD2 4.14Å
31L96.3Very high92.2Very high14 Ų1465.9 Ų65.97%0.07332%0.32CS..Hα-helixtrans-69.8-29.8177.9-66.4176.7000112.8T27 T29 L34 K35 L82 E83 F119T27-L31 HydrophobicContact CG2-CD1 3.69Å; T27-L31 HydrophobicContact CG2-CG 4.32Å; T27-L31 WeakPolarHBondContact O-CB 3.34Å; T27-L31 VanDerWaalsContact O-CG 3.25Å; T27-L31 WeakPolarHBondContact O-CG 3.46Å; T27-L31 PolarHBondContact O-N 3.49Å; T29-L31 PolarHBondContact O-N 2.99Å; L31-L34 HydrophobicContact CD2-CD2 4.34Å; L31-K35 WeakPolarHBondContact O-CB 3.33Å; L31-K35 VanDerWaalsContact O-CG 3.26Å; L31-K35 WeakPolarHBondContact O-CG 3.42Å; L31-K35 PolarHBondContact O-N 3.31Å; L31-L82 HydrophobicContact CD2-CB 3.79Å; L31-L82 HydrophobicContact CD2-CD1 4.29Å; L31-E83 HydrophobicContact CD1-CG 3.52Å; L31-F119 HydrophobicContact CD2-CE1 4.5Å
32R96Very high92.8Very high194 Ų19461.1 Ų61.173%0.73229%0.287SS*.Hα-helixtrans-64.7-46.1174-177.3-176.5-168.6-173.33.3110.8K28 T29 L30 K35 W36K28-R32 WeakPolarHBondContact O-CB 3.47Å; K28-R32 PolarHBondContact O-N 3.29Å; T29-R32 WeakPolarHBondContact O-CB 3.44Å; T29-R32 PolarHBondContact O-N 3.05Å; L30-R32 VanDerWaalsContact C-N 3.32Å; L30-R32 PolarHBondContact O-N 3.44Å; R32-K35 PolarHBondContact O-N 3.4Å; R32-W36 WeakPolarHBondContact O-CB 3.41Å; R32-W36 PolarHBondContact O-N 3.38Å
33E96.4Very high93.1Very high43 Ų4364.3 Ų64.320%0.20129%0.285CS..Hα-helixtrans-61.2-46.6176.9-71.8-74.2164.500111.1T29 L30 K35 W36 H37 L98 R102T29-E33 WeakPolarHBondContact O-CG 3.12Å; T29-E33 PolarHBondContact O-N 3.24Å; L30-E33 PolarHBondContact O-N 3.31Å; E33-K35 PolarHBondContact O-N 3.16Å; E33-W36 WeakPolarHBondContact O-CB 3.48Å; E33-W36 PolarHBondContact O-N 3.23Å; E33-H37 PolarHBondContact O-CD2 2.95Å; E33-H37 VanDerWaalsContact O-CD2 3.29Å; E33-H37 PolarHBondContact O-N 3.21Å; E33-L98 HydrophobicContact CB-CD2 3.64Å; E33-L98 HydrophobicContact CG-CD1 4.11Å; E33-L98 HydrophobicContact CG-CD2 3.63Å; E33-R102 IonicContact OE1-NH2 2.76Å; E33-R102 PolarHBondContact OE1-NH2 3.22Å; E33-R102 IonicContact OE2-CZ 3.86Å; E33-R102 IonicContact OE2-NE 3.78Å; E33-R102 IonicContact OE2-NH2 2.66Å; E33-R102 PolarHBondContact OE2-NH2 2.83Å
34L95.3Very high93Very high0 Ų066.8 Ų66.80%030%0.298CS..Hα-helixtrans-53.8-52.1173.2170.362000112.1L30 L31 W36 H37 L38 I74 L82 F101 I115 F119L30-L34 PolarHBondContact O-N 3.01Å; L31-L34 HydrophobicContact CD2-CD2 4.34Å; L34-W36 VanDerWaalsContact C-N 3.26Å; L34-W36 PolarHBondContact O-N 2.73Å; L34-H37 PolarHBondContact O-N 2.91Å; L34-L38 HydrophobicContact CD1-CD1 4.07Å; L34-L38 HydrophobicContact CD1-CG 4.32Å; L34-L38 HydrophobicContact CG-CD1 4.1Å; L34-L38 WeakPolarHBondContact O-CG 3.39Å; L34-L38 PolarHBondContact O-N 2.87Å; L34-I74 HydrophobicContact CD2-CD1 3.76Å; L34-I74 HydrophobicContact CG-CD1 4.2Å; L34-L82 HydrophobicContact CD2-CD1 3.48Å; L34-L82 VanDerWaalsContact CD2-CD1 3.48Å; L34-F101 HydrophobicContact CD1-CZ 4.39Å; L34-I115 HydrophobicContact CD1-CG2 3.74Å; L34-F119 HydrophobicContact CB-CD1 4.22Å; L34-F119 HydrophobicContact CB-CE1 4.36Å; L34-F119 HydrophobicContact CB-CG 4.33Å; L34-F119 HydrophobicContact CD1-CB 3.86Å; L34-F119 HydrophobicContact CD1-CD1 4.32Å; L34-F119 HydrophobicContact CD1-CG 4.07Å; L34-F119 HydrophobicContact CD2-CD1 3.7Å; L34-F119 HydrophobicContact CD2-CE1 4.2Å; L34-F119 HydrophobicContact CD2-CG 4.29Å; L34-F119 HydrophobicContact CG-CD1 4.29Å; L34-F119 HydrophobicContact CG-CG 4.46Å
35K93.8Very high92.7Very high87 Ų8764.1 Ų64.138%0.37829%0.29SS..Hα-helixtrans-63-34.2-179.4-74.3174-177.7179.80112.1L31 R32 E33 K39 I74L31-K35 WeakPolarHBondContact O-CB 3.33Å; L31-K35 VanDerWaalsContact O-CG 3.26Å; L31-K35 WeakPolarHBondContact O-CG 3.42Å; L31-K35 PolarHBondContact O-N 3.31Å; R32-K35 PolarHBondContact O-N 3.4Å; E33-K35 PolarHBondContact O-N 3.16Å; K35-K39 WeakPolarHBondContact O-CG 3.39Å; K35-K39 PolarHBondContact O-N 3.3Å; K35-K39 VanDerWaalsContact O-N 3.15Å; K35-I74 HydrophobicContact CG-CD1 4.39Å
36W94Very high92.2Very high145 Ų14562.9 Ų62.955%0.54928%0.277SS..Hα-helixtrans-65.7-48.8176.1-173.189.6000110.9R32 E33 L34 L38 K39 E40R32-W36 WeakPolarHBondContact O-CB 3.41Å; R32-W36 PolarHBondContact O-N 3.38Å; E33-W36 WeakPolarHBondContact O-CB 3.48Å; E33-W36 PolarHBondContact O-N 3.23Å; L34-W36 VanDerWaalsContact C-N 3.26Å; L34-W36 PolarHBondContact O-N 2.73Å; W36-L38 VanDerWaalsContact C-N 3.33Å; W36-L38 PolarHBondContact O-N 3.4Å; W36-K39 PolarHBondContact O-N 2.91Å; W36-E40 HydrophobicContact CE3-CB 4.43Å; W36-E40 HydrophobicContact CH2-CB 4.22Å; W36-E40 HydrophobicContact CH2-CG 3.98Å; W36-E40 HydrophobicContact CZ2-CB 4.49Å; W36-E40 HydrophobicContact CZ2-CG 4.4Å; W36-E40 HydrophobicContact CZ3-CB 4.19Å; W36-E40 HydrophobicContact CZ3-CG 4.31Å; W36-E40 WeakPolarHBondContact O-CB 3.43Å; W36-E40 PolarHBondContact O-N 3.47Å
37H93.8Very high91.7Very high26 Ų2666.7 Ų66.712%0.1230%0.295CS..Hα-helixtrans-62.5-37.4178.3-81.3-73.7000113.2E33 L34 R41 F101 L105 I115E33-H37 PolarHBondContact O-CD2 2.95Å; E33-H37 VanDerWaalsContact O-CD2 3.29Å; E33-H37 PolarHBondContact O-N 3.21Å; L34-H37 PolarHBondContact O-N 2.91Å; H37-R41 WeakPolarHBondContact O-CB 3.46Å; H37-R41 WeakPolarHBondContact O-CG 3.38Å; H37-R41 PolarHBondContact O-N 2.66Å; H37-F101 HydrophobicContact CB-CE1 4.47Å; H37-F101 HydrophobicContact CB-CZ 4.45Å; H37-F101 AromaticContact CD2-CE1 3.54Å; H37-L105 HydrophobicContact CB-CD1 3.93Å; H37-L105 WeakPolarHBondContact ND1-CD1 3.42Å; H37-I115 HydrophobicContact CB-CG2 4.15Å
38L91.5Very high91.2Very high8 Ų870 Ų704%0.04231%0.311CS..Hα-helixtrans-58.8-51.8172.7-78.6166.7000112.3L34 W36 E40 R41 E42 I74 P112 I115 V116L34-L38 HydrophobicContact CD1-CD1 4.07Å; L34-L38 HydrophobicContact CD1-CG 4.32Å; L34-L38 HydrophobicContact CG-CD1 4.1Å; L34-L38 WeakPolarHBondContact O-CG 3.39Å; L34-L38 PolarHBondContact O-N 2.87Å; W36-L38 VanDerWaalsContact C-N 3.33Å; W36-L38 PolarHBondContact O-N 3.4Å; L38-E40 VanDerWaalsContact C-N 3.35Å; L38-E40 PolarHBondContact O-N 2.82Å; L38-R41 PolarHBondContact O-N 2.76Å; L38-E42 WeakPolarHBondContact O-CB 3.42Å; L38-E42 PolarHBondContact O-N 3.37Å; L38-I74 HydrophobicContact CD1-CD1 3.63Å; L38-I74 HydrophobicContact CD1-CG1 3.68Å; L38-P112 WeakPolarHBondContact CD2-O 3.49Å; L38-I115 HydrophobicContact CD2-CB 3.93Å; L38-I115 HydrophobicContact CD2-CD1 4.15Å; L38-I115 HydrophobicContact CD2-CG1 4.48Å; L38-I115 HydrophobicContact CD2-CG2 4.44Å; L38-I115 HydrophobicContact CG-CB 4.34Å; L38-I115 HydrophobicContact CG-CG2 4.31Å; L38-V116 HydrophobicContact CD1-CG2 3.91Å; L38-V116 HydrophobicContact CD2-CG2 4.07Å
39K90.4Very high90.5Very high155 Ų15567.4 Ų67.467%0.67430%0.301SS*.Hα-helixtrans-64-40.4-179.9-74-178.1176.6-168.80112.3K35 W36 E42 R43K35-K39 WeakPolarHBondContact O-CG 3.39Å; K35-K39 PolarHBondContact O-N 3.3Å; K35-K39 VanDerWaalsContact O-N 3.15Å; W36-K39 PolarHBondContact O-N 2.91Å; K39-E42 PolarHBondContact O-N 3.04Å; K39-R43 WeakPolarHBondContact O-CB 3.3Å; K39-R43 PolarHBondContact O-N 3Å
40E91.1Very high89.6Confident52 Ų5269.1 Ų69.124%0.24331%0.308CS..Hα-helixtrans-66.9-43.1-179.6-173.155.9-149.800111.3W36 L38 E42 R43 L44W36-E40 HydrophobicContact CE3-CB 4.43Å; W36-E40 HydrophobicContact CH2-CB 4.22Å; W36-E40 HydrophobicContact CH2-CG 3.98Å; W36-E40 HydrophobicContact CZ2-CB 4.49Å; W36-E40 HydrophobicContact CZ2-CG 4.4Å; W36-E40 HydrophobicContact CZ3-CB 4.19Å; W36-E40 HydrophobicContact CZ3-CG 4.31Å; W36-E40 WeakPolarHBondContact O-CB 3.43Å; W36-E40 PolarHBondContact O-N 3.47Å; L38-E40 VanDerWaalsContact C-N 3.35Å; L38-E40 PolarHBondContact O-N 2.82Å; E40-E42 VanDerWaalsContact C-N 3.35Å; E40-E42 PolarHBondContact O-N 3.32Å; E40-R43 WeakPolarHBondContact O-CB 3.39Å; E40-R43 PolarHBondContact O-N 2.96Å; E40-R43 IonicContact OE1-CZ 3.04Å; E40-R43 IonicContact OE1-NE 2.83Å; E40-R43 PolarHBondContact OE1-NE 3.16Å; E40-R43 IonicContact OE1-NH2 2.73Å; E40-R43 PolarHBondContact OE1-NH2 3.5Å; E40-R43 IonicContact OE2-NE 2.64Å; E40-R43 PolarHBondContact OE2-NE 3.02Å; E40-L44 WeakPolarHBondContact O-CG 3.35Å; E40-L44 PolarHBondContact O-N 3.14Å
41R88.8Confident88.8Confident69 Ų6974.3 Ų74.326%0.2633%0.333SS..Hα-helixtrans-66.3-38.3176.4-72.9-70.6-167.91744.2111.9H37 L38 L44 V45 L105 P112 I115H37-R41 WeakPolarHBondContact O-CB 3.46Å; H37-R41 WeakPolarHBondContact O-CG 3.38Å; H37-R41 PolarHBondContact O-N 2.66Å; L38-R41 PolarHBondContact O-N 2.76Å; R41-L44 PolarHBondContact O-N 3.12Å; R41-V45 WeakPolarHBondContact O-CG2 3.45Å; R41-V45 PolarHBondContact O-N 3.11Å; R41-L105 PolarHBondContact NH2-O 3.23Å; R41-P112 HydrophobicContact CB-CG 4.29Å; R41-I115 HydrophobicContact CB-CD1 3.78Å; R41-I115 HydrophobicContact CG-CD1 3.58Å
42E87.7Confident87.7Confident17 Ų1778.2 Ų78.28%0.07935%0.35CS..Hα-helixtrans-62.7-43.8173.2-176.1173.7-178.100112L38 K39 E40 L44 V45 Q46 Q71L38-E42 WeakPolarHBondContact O-CB 3.42Å; L38-E42 PolarHBondContact O-N 3.37Å; K39-E42 PolarHBondContact O-N 3.04Å; E40-E42 VanDerWaalsContact C-N 3.35Å; E40-E42 PolarHBondContact O-N 3.32Å; E42-L44 VanDerWaalsContact C-N 3.35Å; E42-L44 PolarHBondContact O-N 3.44Å; E42-V45 PolarHBondContact O-N 3.44Å; E42-Q46 WeakPolarHBondContact O-CG 3.42Å; E42-Q46 PolarHBondContact O-N 3.29Å; E42-Q46 PolarHBondContact OE1-NE2 2.97Å; E42-Q71 PolarHBondContact OE1-NE2 3.28Å; E42-Q71 PolarHBondContact OE1-OE1 2.99Å
43R88.3Confident86.5Confident111 Ų11171.7 Ų71.742%0.41933%0.327SS..Hα-helixtrans-56.9-47.5176-171.3-165.371.880.2-2.9111.5K39 E40 Q46 E47K39-R43 WeakPolarHBondContact O-CB 3.3Å; K39-R43 PolarHBondContact O-N 3Å; E40-R43 WeakPolarHBondContact O-CB 3.39Å; E40-R43 PolarHBondContact O-N 2.96Å; E40-R43 IonicContact OE1-CZ 3.04Å; E40-R43 IonicContact OE1-NE 2.83Å; E40-R43 PolarHBondContact OE1-NE 3.16Å; E40-R43 IonicContact OE1-NH2 2.73Å; E40-R43 PolarHBondContact OE1-NH2 3.5Å; E40-R43 IonicContact OE2-NE 2.64Å; E40-R43 PolarHBondContact OE2-NE 3.02Å; R43-Q46 PolarHBondContact O-N 3.43Å; R43-E47 IonicContact CZ-OE2 3.41Å; R43-E47 IonicContact NH1-OE1 3.75Å; R43-E47 IonicContact NH1-OE2 3.39Å; R43-E47 PolarHBondContact NH1-OE2 3.43Å; R43-E47 IonicContact NH2-OE2 3.7Å; R43-E47 WeakPolarHBondContact O-CB 3.4Å; R43-E47 PolarHBondContact O-N 3.5Å
44L85.9Confident85.3Confident59 Ų5974.5 Ų74.531%0.30935%0.347SS..Hα-helixtrans-63.5-42.7179.1-70.8170.6000112.2E40 R41 E42 Q46 E47 I48E40-L44 WeakPolarHBondContact O-CG 3.35Å; E40-L44 PolarHBondContact O-N 3.14Å; R41-L44 PolarHBondContact O-N 3.12Å; E42-L44 VanDerWaalsContact C-N 3.35Å; E42-L44 PolarHBondContact O-N 3.44Å; L44-Q46 VanDerWaalsContact C-N 3.34Å; L44-Q46 PolarHBondContact O-N 3.41Å; L44-E47 PolarHBondContact O-N 3.28Å; L44-I48 WeakPolarHBondContact O-CD1 3.38Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.43Å; L44-I48 PolarHBondContact O-N 3.21Å
45V83.8Confident83.9Confident65 Ų6582.3 Ų82.339%0.39438%0.384SS..Hα-helixtrans-61.7-43.7176.9168.80000111R41 E42 I48 E49 P112R41-V45 WeakPolarHBondContact O-CG2 3.45Å; R41-V45 PolarHBondContact O-N 3.11Å; E42-V45 PolarHBondContact O-N 3.44Å; V45-I48 PolarHBondContact O-N 3.02Å; V45-E49 WeakPolarHBondContact O-CB 3.39Å; V45-E49 PolarHBondContact O-N 2.89Å; V45-P112 HydrophobicContact CG2-CG 4.4Å
46Q83.6Confident82.6Confident72 Ų7285.9 Ų85.934%0.33640%0.399SS..Hα-helixtrans-65-39.1177.4-71.51775.700112.4E42 R43 L44 E49 N50E42-Q46 WeakPolarHBondContact O-CG 3.42Å; E42-Q46 PolarHBondContact O-N 3.29Å; E42-Q46 PolarHBondContact OE1-NE2 2.97Å; R43-Q46 PolarHBondContact O-N 3.43Å; L44-Q46 VanDerWaalsContact C-N 3.34Å; L44-Q46 PolarHBondContact O-N 3.41Å; Q46-E49 PolarHBondContact O-N 3.41Å; Q46-N50 WeakPolarHBondContact O-CB 3.48Å; Q46-N50 PolarHBondContact O-N 2.89Å
47E84.9Confident80.9Confident84 Ų8481.6 Ų81.639%0.39339%0.389SS..Hα-helixtrans-62.6-48176.9-175.2164.8-14900111.4R43 L44 E49 N50 E51R43-E47 IonicContact CZ-OE2 3.41Å; R43-E47 IonicContact NH1-OE1 3.75Å; R43-E47 IonicContact NH1-OE2 3.39Å; R43-E47 PolarHBondContact NH1-OE2 3.43Å; R43-E47 IonicContact NH2-OE2 3.7Å; R43-E47 WeakPolarHBondContact O-CB 3.4Å; R43-E47 PolarHBondContact O-N 3.5Å; L44-E47 PolarHBondContact O-N 3.28Å; E47-E49 VanDerWaalsContact C-N 3.35Å; E47-E49 PolarHBondContact O-N 3.24Å; E47-N50 WeakPolarHBondContact O-CB 2.95Å; E47-N50 PolarHBondContact O-N 3.12Å; E47-E51 WeakPolarHBondContact O-CG 3.48Å; E47-E51 PolarHBondContact O-N 3.42Å
48I83.6Confident79.3Confident89 Ų8983.2 Ų83.246%0.45641%0.413SS..Hα-helixtrans-60.4-44.9175.6-66.9162.4000111L44 V45 N50 E51 Q52L44-I48 WeakPolarHBondContact O-CD1 3.38Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.43Å; L44-I48 PolarHBondContact O-N 3.21Å; V45-I48 PolarHBondContact O-N 3.02Å; I48-N50 VanDerWaalsContact C-N 3.3Å; I48-N50 PolarHBondContact O-N 2.77Å; I48-E51 PolarHBondContact O-N 3Å; I48-Q52 WeakPolarHBondContact O-CG 3.34Å; I48-Q52 PolarHBondContact O-N 3.02Å
49E81.8Confident77.7Confident74 Ų7489.3 Ų89.335%0.34645%0.45SS..Hα-helixtrans-62.1-40.5178.5-169-171.9-179.200111.4V45 Q46 E47 K53V45-E49 WeakPolarHBondContact O-CB 3.39Å; V45-E49 PolarHBondContact O-N 2.89Å; Q46-E49 PolarHBondContact O-N 3.41Å; E47-E49 VanDerWaalsContact C-N 3.35Å; E47-E49 PolarHBondContact O-N 3.24Å; E49-K53 HydrophobicContact CG-CD 4.22Å; E49-K53 WeakPolarHBondContact O-CB 3.45Å; E49-K53 VanDerWaalsContact O-CG 3.24Å; E49-K53 WeakPolarHBondContact O-CG 3.43Å; E49-K53 PolarHBondContact O-N 2.98Å; E49-K53 WeakPolarHBondContact OE1-CE 3.24Å; E49-K53 IonicContact OE1-NZ 3.32Å; E49-K53 PolarHBondContact OE1-NZ 3.3Å; E49-K53 IonicContact OE2-NZ 3Å
50N78.4Confident76.3Confident87 Ų8786.7 Ų86.747%0.46544%0.444SS..Hα-helixtrans-64.7-47.7177.5-174.145.9000111.8Q46 E47 I48 Q52 K53 V54Q46-N50 WeakPolarHBondContact O-CB 3.48Å; Q46-N50 PolarHBondContact O-N 2.89Å; E47-N50 WeakPolarHBondContact O-CB 2.95Å; E47-N50 PolarHBondContact O-N 3.12Å; I48-N50 VanDerWaalsContact C-N 3.3Å; I48-N50 PolarHBondContact O-N 2.77Å; N50-Q52 VanDerWaalsContact C-N 3.33Å; N50-Q52 PolarHBondContact O-N 3.22Å; N50-K53 PolarHBondContact O-N 2.85Å; N50-K53 VanDerWaalsContact O-N 3.15Å; N50-V54 WeakPolarHBondContact O-CG2 3.49Å; N50-V54 PolarHBondContact O-N 3.09Å
51E79.3Confident74.9Confident110 Ų11093.2 Ų93.251%0.51447%0.468SS..Hα-helixtrans-58.7-44.3176.5-71.9-176167.600112E47 I48 K53 V54 Q55E47-E51 WeakPolarHBondContact O-CG 3.48Å; E47-E51 PolarHBondContact O-N 3.42Å; I48-E51 PolarHBondContact O-N 3Å; E51-K53 VanDerWaalsContact C-N 3.32Å; E51-K53 PolarHBondContact O-N 3.45Å; E51-V54 PolarHBondContact O-N 2.95Å; E51-Q55 WeakPolarHBondContact O-CG 3.39Å; E51-Q55 PolarHBondContact O-N 3.45Å
52Q74.3Confident73.5Confident96 Ų9695 Ų9545%0.44948%0.482SS..Hα-helixtrans-63.8-36.9176.6-72.2-174.226.800112.6I48 N50 K56I48-Q52 WeakPolarHBondContact O-CG 3.34Å; I48-Q52 PolarHBondContact O-N 3.02Å; N50-Q52 VanDerWaalsContact C-N 3.33Å; N50-Q52 PolarHBondContact O-N 3.22Å; Q52-K56 WeakPolarHBondContact O-CB 3.41Å; Q52-K56 WeakPolarHBondContact O-CG 3.43Å; Q52-K56 PolarHBondContact O-N 3.4Å; Q52-K56 VanDerWaalsContact O-N 3.15Å
53K70.4Confident72.2Confident57 Ų57100.7 Ų100.725%0.24850%0.503CS..Hα-helixtrans-68.1-42176.6-77.5170.1-179.7167.30111.7E49 N50 E51 Q55 K56 T57E49-K53 HydrophobicContact CG-CD 4.22Å; E49-K53 WeakPolarHBondContact O-CB 3.45Å; E49-K53 VanDerWaalsContact O-CG 3.24Å; E49-K53 WeakPolarHBondContact O-CG 3.43Å; E49-K53 PolarHBondContact O-N 2.98Å; E49-K53 WeakPolarHBondContact OE1-CE 3.24Å; E49-K53 IonicContact OE1-NZ 3.32Å; E49-K53 PolarHBondContact OE1-NZ 3.3Å; E49-K53 IonicContact OE2-NZ 3Å; N50-K53 PolarHBondContact O-N 2.85Å; N50-K53 VanDerWaalsContact O-N 3.15Å; E51-K53 VanDerWaalsContact C-N 3.32Å; E51-K53 PolarHBondContact O-N 3.45Å; K53-Q55 VanDerWaalsContact C-N 3.35Å; K53-K56 PolarHBondContact O-N 3.34Å; K53-T57 WeakPolarHBondContact O-CB 3.4Å; K53-T57 PolarHBondContact O-N 2.89Å; K53-T57 PolarHBondContact O-OG1 3.23Å
54V70.1Confident70.7Confident101 Ų101100.5 Ų100.561%0.61251%0.51SS*.Hα-helixtrans-61.3-42.5176171.20000111.2N50 E51N50-V54 WeakPolarHBondContact O-CG2 3.49Å; N50-V54 PolarHBondContact O-N 3.09Å; E51-V54 PolarHBondContact O-N 2.95Å
55Q67.3Low69.3Low164 Ų164106.1 Ų106.177%0.76653%0.532SS*.Hα-helixtrans-67.4-35.1177.7-70.6178.610.200113.3E51 K53E51-Q55 WeakPolarHBondContact O-CG 3.39Å; E51-Q55 PolarHBondContact O-N 3.45Å; K53-Q55 VanDerWaalsContact C-N 3.35Å
56K65.3Low67.9Low162 Ų162108.5 Ų108.570%0.70454%0.542SS*.Hα-helixtrans-86.8-25.4-177.3-71.9173.5-178.8169.80113.8Q52 K53Q52-K56 WeakPolarHBondContact O-CB 3.41Å; Q52-K56 WeakPolarHBondContact O-CG 3.43Å; Q52-K56 PolarHBondContact O-N 3.4Å; Q52-K56 VanDerWaalsContact O-N 3.15Å; K53-K56 PolarHBondContact O-N 3.34Å
57T59.8Low66.4Low56 Ų56114 Ų11434%0.34456%0.561SS.*  trans-113.575.8-169.1-46.80000109.8K53 T59 D60K53-T57 WeakPolarHBondContact O-CB 3.4Å; K53-T57 PolarHBondContact O-N 2.89Å; K53-T57 PolarHBondContact O-OG1 3.23Å; T57-T59 PolarHBondContact O-N 3.3Å; T57-D60 HydrophobicContact CG2-CB 3.62Å; T57-D60 VanDerWaalsContact CG2-O 3.3Å; T57-D60 WeakPolarHBondContact CG2-O 3.36Å
58G60.2Low64.8Low60 Ų60118.7 Ų118.762%0.61958%0.583SS**SBendtrans-63.4119.5156.800000108.2D60G58-D60 PolarHBondContact O-N 3.24Å
59T57.7Low63.4Low135 Ų135117 Ų11783%0.82858%0.575SS**SBendtrans77.2-9.8166.735.60000121.9T57T57-T59 PolarHBondContact O-N 3.3Å
60D60.8Low62.1Low101 Ų101118.8 Ų118.854%0.5459%0.593SS.*  trans-94.8121.8176.1-66.7-32000113.4T57 G58 N62T57-D60 HydrophobicContact CG2-CB 3.62Å; T57-D60 VanDerWaalsContact CG2-O 3.3Å; T57-D60 WeakPolarHBondContact CG2-O 3.36Å; G58-D60 PolarHBondContact O-N 3.24Å; D60-N62 PolarHBondContact O-N 2.72Å
61Y61.2Low61.3Low188 Ų188120.4 Ų120.474%0.73760%0.598SS**G310 helixtrans-67.419.4176.9-62.5-86.2000114.6W63 L64Y61-W63 PolarHBondContact O-N 2.86Å; Y61-L64 WeakPolarHBondContact O-CB 3.48Å; Y61-L64 PolarHBondContact O-N 3.43Å; Y61-L64 VanDerWaalsContact O-N 3.16Å
62N60.4Low60.7Low106 Ų106116.8 Ų116.857%0.56759%0.587SS**G310 helixtrans-64.6-20.9-179.9-76.8-41000113.1D60 L64 K65D60-N62 PolarHBondContact O-N 2.72Å; N62-L64 PolarHBondContact O-N 3.42Å; N62-K65 PolarHBondContact O-N 2.95Å
63W59.9Low60.9Low137 Ų137117.6 Ų117.652%0.51960%0.599SS.*G310 helixtrans-60.3-29.817367.1-91.8000113Y61 K65Y61-W63 PolarHBondContact O-N 2.86Å; W63-K65 VanDerWaalsContact C-N 3.26Å; W63-K65 PolarHBondContact O-N 3.5Å
64L55.9Low61.5Low108 Ų108115.9 Ų115.957%0.56559%0.592SS**G310 helixtrans-72.6-21.5-178.3-153.478.9000112.5Y61 N62Y61-L64 WeakPolarHBondContact O-CB 3.48Å; Y61-L64 PolarHBondContact O-N 3.43Å; Y61-L64 VanDerWaalsContact O-N 3.16Å; N62-L64 PolarHBondContact O-N 3.42Å
65K57.1Low62.3Low177 Ų177114 Ų11477%0.7758%0.581SS**THydrogen-bonded Turntrans-98-16.4-169.7-152.1175.8-179.8-178.10113.9N62 W63 Y67N62-K65 PolarHBondContact O-N 2.95Å; W63-K65 VanDerWaalsContact C-N 3.26Å; W63-K65 PolarHBondContact O-N 3.5Å; K65-Y67 PolarHBondContact O-N 3.44Å
66N54.4Low63.4Low114 Ų114109.5 Ų109.561%0.6157%0.573SS**  trans-104.368-173-11514.2000112.4
67Y51.5Low64.5Low188 Ų188106.5 Ų106.574%0.73757%0.568SS**  trans-96.811.1170.7-82.6-82.7000113.6K65 N69K65-Y67 PolarHBondContact O-N 3.44Å; Y67-N69 VanDerWaalsContact C-N 3.26Å; Y67-N69 PolarHBondContact O-N 3.03Å; Y67-N69 VanDerWaalsContact O-N 3.16Å
68Q51.7Low65.9Low183 Ų183107.5 Ų107.586%0.85557%0.569SS**  trans-90.960.6177.6-64.4-173.2-2.400110.4
69N54.1Low67.4Low52 Ų52107.5 Ų107.528%0.27855%0.553SS.*  trans-83.9123.5163.3-165.7-31.6000107.4Y67 Q71Y67-N69 VanDerWaalsContact C-N 3.26Å; Y67-N69 PolarHBondContact O-N 3.03Å; Y67-N69 VanDerWaalsContact O-N 3.16Å; N69-Q71 PolarHBondContact O-N 3.31Å
70P55.1Low69.1Low113 Ų113109.6 Ų109.673%0.73455%0.546SS*.  trans-61.5100.1175.424-32.3000109.8A72P70-A72 PolarHBondContact O-N 3.15Å
71Q60.7Low70.7Confident121 Ų121109.2 Ų109.257%0.56554%0.541SS*.  trans-48.9124173.9-71.4-73.5-49.600109.5E42 N69 T73E42-Q71 PolarHBondContact OE1-NE2 3.28Å; E42-Q71 PolarHBondContact OE1-OE1 2.99Å; N69-Q71 PolarHBondContact O-N 3.31Å; Q71-T73 PolarHBondContact O-N 2.98Å; Q71-T73 PolarHBondContact O-OG1 3.29Å
72A66.1Low72.3Confident34 Ų34100.4 Ų100.428%0.28151%0.506SS..  trans-69.879.6179.900000109.7P70 P112P70-A72 PolarHBondContact O-N 3.15Å; A72-P112 HydrophobicContact CB-CB 3.92Å
73T78.9Confident73.9Confident113 Ų11398.7 Ų98.769%0.69350%0.495SS*.PPolyproline II helixtrans-95.2127.4-176.6-53.90000109.3Q71 P75Q71-T73 PolarHBondContact O-N 2.98Å; Q71-T73 PolarHBondContact O-OG1 3.29Å; T73-P75 WeakPolarHBondContact O-CD 3.2Å
74I83.8Confident75.5Confident20 Ų2095.5 Ų95.510%0.10349%0.49CS..PPolyproline II helixtrans-68.2121.7176.3-51.1175.9000108.5L34 K35 L38 E78 Q79 V116L34-I74 HydrophobicContact CD2-CD1 3.76Å; L34-I74 HydrophobicContact CG-CD1 4.2Å; K35-I74 HydrophobicContact CG-CD1 4.39Å; L38-I74 HydrophobicContact CD1-CD1 3.63Å; L38-I74 HydrophobicContact CD1-CG1 3.68Å; I74-E78 HydrophobicContact CG2-CB 3.97Å; I74-Q79 HydrophobicContact CG2-CB 4.19Å; I74-V116 HydrophobicContact CD1-CG2 4.38Å; I74-V116 HydrophobicContact CG1-CG2 3.94Å; I74-V116 HydrophobicContact CG2-CG1 4.34Å
75P87.4Confident77.4Confident61 Ų6190.7 Ų90.740%0.39647%0.465SS..PPolyproline II helixtrans-56.1142.1172.7-23.533.4000111.6T73 T77 E78 Q79T73-P75 WeakPolarHBondContact O-CD 3.2Å; P75-T77 PolarHBondContact O-N 3.22Å; P75-T77 VanDerWaalsContact O-N 3.12Å; P75-E78 HydrophobicContact CB-CB 4.48Å; P75-E78 HydrophobicContact CB-CG 4.24Å; P75-E78 WeakPolarHBondContact CD-OE2 3.38Å; P75-E78 HydrophobicContact CG-CG 4.28Å; P75-E78 PolarHBondContact O-N 3.02Å; P75-Q79 PolarHBondContact O-N 2.86Å
76A88.6Confident79.2Confident71 Ų7182.3 Ų82.359%0.58743%0.429SS*.Hα-helixtrans-58.3-31.7-177.600000113.3R80A76-R80 WeakPolarHBondContact O-CG 3.45Å; A76-R80 PolarHBondContact O-N 2.99Å; A76-R80 VanDerWaalsContact O-N 3.16Å
77T88.9Confident81.1Confident98 Ų9877.7 Ų77.760%0.60141%0.405SS*.Hα-helixtrans-64.9-44175.246.50000111.9P75 R80 Q81P75-T77 PolarHBondContact O-N 3.22Å; P75-T77 VanDerWaalsContact O-N 3.12Å; T77-R80 PolarHBondContact O-N 3.48Å; T77-Q81 WeakPolarHBondContact O-CG 3.27Å; T77-Q81 PolarHBondContact O-N 3.38Å
78E89.2Confident83.1Confident77 Ų7769.8 Ų69.836%0.3638%0.375SS..Hα-helixtrans-69.2-40.8177.7-66.2-174.4176.200111.4I74 P75 R80 Q81 L82I74-E78 HydrophobicContact CG2-CB 3.97Å; P75-E78 HydrophobicContact CB-CB 4.48Å; P75-E78 HydrophobicContact CB-CG 4.24Å; P75-E78 WeakPolarHBondContact CD-OE2 3.38Å; P75-E78 HydrophobicContact CG-CG 4.28Å; P75-E78 PolarHBondContact O-N 3.02Å; E78-R80 VanDerWaalsContact C-N 3.31Å; E78-R80 PolarHBondContact O-N 3.35Å; E78-Q81 WeakPolarHBondContact O-CB 3.35Å; E78-Q81 PolarHBondContact O-N 3.01Å; E78-Q81 VanDerWaalsContact O-N 3.11Å; E78-L82 WeakPolarHBondContact O-CG 3.45Å; E78-L82 PolarHBondContact O-N 2.98Å
79Q92.5Very high85Confident61 Ų6161.1 Ų61.129%0.28534%0.335SS..Hα-helixtrans-56.5-46.6175.9-175.7179.9-26.900111.4I74 P75 Q81 L82 E83I74-Q79 HydrophobicContact CG2-CB 4.19Å; P75-Q79 PolarHBondContact O-N 2.86Å; Q79-Q81 VanDerWaalsContact C-N 3.32Å; Q79-Q81 PolarHBondContact O-N 3.2Å; Q79-L82 PolarHBondContact O-N 2.9Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.43Å; Q79-E83 PolarHBondContact NE2-OE1 3.04Å; Q79-E83 WeakPolarHBondContact O-CG 3.26Å; Q79-E83 PolarHBondContact O-N 2.9Å
80R93Very high86.8Confident179 Ų17962.3 Ų62.368%0.67534%0.338SS*.Hα-helixtrans-61.3-39.4176.8-72.7178.1-176.4-170.91.6112.5A76 T77 E78 L82 E83 V84A76-R80 WeakPolarHBondContact O-CG 3.45Å; A76-R80 PolarHBondContact O-N 2.99Å; A76-R80 VanDerWaalsContact O-N 3.16Å; T77-R80 PolarHBondContact O-N 3.48Å; E78-R80 VanDerWaalsContact C-N 3.31Å; E78-R80 PolarHBondContact O-N 3.35Å; R80-L82 VanDerWaalsContact C-N 3.34Å; R80-E83 PolarHBondContact O-N 3.24Å; R80-V84 WeakPolarHBondContact O-CG2 3.32Å; R80-V84 PolarHBondContact O-N 2.81Å; R80-V84 VanDerWaalsContact O-N 3.1Å
81Q93.4Very high88.5Confident93 Ų9360.1 Ų60.144%0.43532%0.324SS..Hα-helixtrans-64.3-40.9176.7-71.3179.1-2.700111.7T77 E78 Q79 V84 L85T77-Q81 WeakPolarHBondContact O-CG 3.27Å; T77-Q81 PolarHBondContact O-N 3.38Å; E78-Q81 WeakPolarHBondContact O-CB 3.35Å; E78-Q81 PolarHBondContact O-N 3.01Å; E78-Q81 VanDerWaalsContact O-N 3.11Å; Q79-Q81 VanDerWaalsContact C-N 3.32Å; Q79-Q81 PolarHBondContact O-N 3.2Å; Q81-V84 PolarHBondContact O-N 3.31Å; Q81-L85 WeakPolarHBondContact O-CG 3.31Å; Q81-L85 PolarHBondContact O-N 3.2Å
82L94.8Very high89.9Confident2 Ų258.7 Ų58.71%0.0133%0.327CS..Hα-helixtrans-66.3-39.6176.3-68.7174.9000111.9L31 L34 E78 Q79 R80 V84 L85 C86 V116 F119 K120 L123L31-L82 HydrophobicContact CD2-CB 3.79Å; L31-L82 HydrophobicContact CD2-CD1 4.29Å; L34-L82 HydrophobicContact CD2-CD1 3.48Å; L34-L82 VanDerWaalsContact CD2-CD1 3.48Å; E78-L82 WeakPolarHBondContact O-CG 3.45Å; E78-L82 PolarHBondContact O-N 2.98Å; Q79-L82 PolarHBondContact O-N 2.9Å; R80-L82 VanDerWaalsContact C-N 3.34Å; L82-V84 VanDerWaalsContact C-N 3.31Å; L82-V84 PolarHBondContact O-N 3.49Å; L82-L85 PolarHBondContact O-N 2.75Å; L82-C86 WeakPolarHBondContact O-CB 3.22Å; L82-C86 PolarHBondContact O-N 3.06Å; L82-C86 PolarHBondContact O-SG 3.44Å; L82-V116 HydrophobicContact CD1-CG1 4.06Å; L82-F119 HydrophobicContact CD1-CD1 4.33Å; L82-F119 HydrophobicContact CD2-CD1 3.81Å; L82-F119 HydrophobicContact CD2-CE1 4.26Å; L82-K120 HydrophobicContact CD2-CB 3.88Å; L82-K120 HydrophobicContact CD2-CG 4.22Å; L82-L123 HydrophobicContact CD2-CD1 3.91Å
83E95.1Very high91.2Very high70 Ų7060.3 Ų60.333%0.32733%0.328SS..Hα-helixtrans-58.1-43.7174.4-74.5167.2-17400111.6T27 L31 Q79 R80 C86 S87T27-E83 HydrophobicContact CG2-CB 4.25Å; T27-E83 HydrophobicContact CG2-CG 4.05Å; L31-E83 HydrophobicContact CD1-CG 3.52Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.43Å; Q79-E83 PolarHBondContact NE2-OE1 3.04Å; Q79-E83 WeakPolarHBondContact O-CG 3.26Å; Q79-E83 PolarHBondContact O-N 2.9Å; R80-E83 PolarHBondContact O-N 3.24Å; E83-C86 PolarHBondContact O-N 3.37Å; E83-S87 WeakPolarHBondContact O-CB 3.37Å; E83-S87 PolarHBondContact O-N 3.46Å
84V93.9Very high92Very high70 Ų7055.8 Ų55.842%0.42430%0.301SS..Hα-helixtrans-65.9-37.6176.5172.90000112.4R80 Q81 L82 S87 Q88R80-V84 WeakPolarHBondContact O-CG2 3.32Å; R80-V84 PolarHBondContact O-N 2.81Å; R80-V84 VanDerWaalsContact O-N 3.1Å; Q81-V84 PolarHBondContact O-N 3.31Å; L82-V84 VanDerWaalsContact C-N 3.31Å; L82-V84 PolarHBondContact O-N 3.49Å; V84-S87 PolarHBondContact O-OG 3.07Å; V84-Q88 PolarHBondContact O-NE2 3.01Å
85L94.9Very high92.6Very high8 Ų856.8 Ų56.84%0.04232%0.316CS..Hα-helixtrans-70.9-41.7176.3-70.6170.6000111.4Y15 Q81 L82 S87 Q88 K120 L123 K124 L127Y15-L85 HydrophobicContact CE2-CD2 4.14Å; Q81-L85 WeakPolarHBondContact O-CG 3.31Å; Q81-L85 PolarHBondContact O-N 3.2Å; L82-L85 PolarHBondContact O-N 2.75Å; L85-S87 VanDerWaalsContact C-N 3.3Å; L85-S87 PolarHBondContact O-N 2.87Å; L85-Q88 PolarHBondContact O-N 3.28Å; L85-K120 HydrophobicContact CD1-CG 3.9Å; L85-L123 HydrophobicContact CB-CB 4.19Å; L85-L123 HydrophobicContact CB-CD1 3.78Å; L85-L123 HydrophobicContact CD1-CB 4.37Å; L85-L123 HydrophobicContact CD1-CD1 4.27Å; L85-K124 HydrophobicContact CD1-CG 4.34Å; L85-K124 HydrophobicContact CD2-CG 4.33Å; L85-L127 HydrophobicContact CD2-CD1 3.88Å
86C94.9Very high93Very high0 Ų057 Ų570%032%0.316CS..Hα-helixtrans-66.6-32.1179.6-66.10000112.6T27 L30 L82 E83 Q88 I89T27-C86 HydrophobicContact CG2-CB 3.9Å; L30-C86 HydrophobicContact CD1-CB 3.94Å; L82-C86 WeakPolarHBondContact O-CB 3.22Å; L82-C86 PolarHBondContact O-N 3.06Å; L82-C86 PolarHBondContact O-SG 3.44Å; E83-C86 PolarHBondContact O-N 3.37Å; C86-Q88 PolarHBondContact O-N 3.1Å; C86-I89 PolarHBondContact O-N 3.26Å; C86-I89 VanDerWaalsContact O-N 3.15Å
87S93.9Very high93.4Very high18 Ų1853.6 Ų53.613%0.12629%0.289CS..THydrogen-bonded Turntrans-69.4-17.9-179.270.30000113.8S23 E83 V84 L85 I89S23-S87 WeakPolarHBondContact CB-O 3.43Å; E83-S87 WeakPolarHBondContact O-CB 3.37Å; E83-S87 PolarHBondContact O-N 3.46Å; V84-S87 PolarHBondContact O-OG 3.07Å; L85-S87 VanDerWaalsContact C-N 3.3Å; L85-S87 PolarHBondContact O-N 2.87Å; S87-I89 VanDerWaalsContact C-N 3.33Å
88Q93.4Very high93.8Very high21 Ų2149.9 Ų49.910%0.09827%0.265CS..THydrogen-bonded Turntrans-84.7-6.1175.8-65.4172.171.600112.8Y15 Y20 V84 L85 C86 L127Y15-Q88 VanDerWaalsContact CD1-OE1 3.27Å; Y20-Q88 WeakPolarHBondContact CD2-O 3.42Å; Y20-Q88 WeakPolarHBondContact CE2-O 3.3Å; V84-Q88 PolarHBondContact O-NE2 3.01Å; L85-Q88 PolarHBondContact O-N 3.28Å; C86-Q88 PolarHBondContact O-N 3.1Å; Q88-L127 HydrophobicContact CB-CD1 4.13Å; Q88-L127 HydrophobicContact CB-CD2 3.79Å
89I92.8Very high94.1Very high1 Ų149.8 Ų49.81%0.00527%0.273CS..SBendtrans-90.2130.6-179.7-66167.7000109.9V26 L30 C86 S87 Q93 V97 L123 F126 L127V26-I89 HydrophobicContact CG1-CB 3.92Å; V26-I89 HydrophobicContact CG1-CG2 3.91Å; L30-I89 HydrophobicContact CD1-CD1 3.61Å; C86-I89 PolarHBondContact O-N 3.26Å; C86-I89 VanDerWaalsContact O-N 3.15Å; S87-I89 VanDerWaalsContact C-N 3.33Å; I89-Q93 HydrophobicContact CG2-CB 4.24Å; I89-V97 HydrophobicContact CD1-CG1 4.26Å; I89-V97 HydrophobicContact CD1-CG2 4.06Å; I89-V97 HydrophobicContact CG2-CG2 4.37Å; I89-L123 HydrophobicContact CD1-CD2 3.24Å; I89-F126 HydrophobicContact CG1-CD1 4.42Å; I89-L127 HydrophobicContact CG1-CD2 4.27Å
90Q91.3Very high94.3Very high77 Ų7752.7 Ų52.736%0.3628%0.281SS..  trans-71143.5174.5-65.6-173.816.200111.3Y20 C92 Q93 T94Y20-Q90 HydrophobicContact CD1-CG 3.95Å; Y20-Q90 HydrophobicContact CD2-CG 3.92Å; Y20-Q90 HydrophobicContact CE1-CG 3.86Å; Y20-Q90 HydrophobicContact CE2-CG 3.82Å; Y20-Q90 HydrophobicContact CG-CG 3.97Å; Y20-Q90 PolarHBondContact OH-NE2 3.06Å; Q90-C92 VanDerWaalsContact C-N 3.28Å; Q90-C92 PolarHBondContact O-N 3.49Å; Q90-Q93 HydrophobicContact CB-CG 4.31Å; Q90-Q93 PolarHBondContact O-N 3.33Å; Q90-T94 PolarHBondContact O-N 3.26Å
91P91.6Very high94.5Very high67 Ų6744.1 Ų44.144%0.43525%0.249SC..G310 helixtrans-52.1-41.6-179.7-2935.1000114.8V26 Q93 T94V26-P91 HydrophobicContact CG2-CB 4.03Å; V26-P91 HydrophobicContact CG2-CG 3.86Å; P91-Q93 PolarHBondContact O-N 3Å; P91-T94 WeakPolarHBondContact O-CB 3.49Å; P91-T94 PolarHBondContact O-N 3.49Å; P91-T94 PolarHBondContact O-OG1 3.08Å
92C89.8Confident94.6Very high92 Ų9245.2 Ų45.262%0.62225%0.249SC*.G310 helixtrans-62.8-23.6178.456.60000113.7Q90Q90-C92 VanDerWaalsContact C-N 3.28Å; Q90-C92 PolarHBondContact O-N 3.49Å
93Q93.3Very high94.5Very high67 Ų6748.7 Ų48.731%0.31327%0.265SS..G310 helixtrans-94.9-8-177.4-63.7-57.4-20.200113.9I89 Q90 P91 G95 T96 V97 F126I89-Q93 HydrophobicContact CG2-CB 4.24Å; Q90-Q93 HydrophobicContact CB-CG 4.31Å; Q90-Q93 PolarHBondContact O-N 3.33Å; P91-Q93 PolarHBondContact O-N 3Å; Q93-G95 PolarHBondContact O-N 3.39Å; Q93-T96 WeakPolarHBondContact O-CB 3.43Å; Q93-T96 PolarHBondContact O-N 3.49Å; Q93-T96 VanDerWaalsContact O-N 3.08Å; Q93-T96 PolarHBondContact OE1-OG1 3.47Å; Q93-V97 PolarHBondContact O-N 3.43Å; Q93-F126 HydrophobicContact CB-CE1 3.85Å; Q93-F126 HydrophobicContact CB-CZ 3.62Å; Q93-F126 HydrophobicContact CG-CE1 4.37Å; Q93-F126 HydrophobicContact CG-CZ 3.94Å
94T95.4Very high94.4Very high18 Ų1845.7 Ų45.711%0.1125%0.252CS..Hα-helixtrans-54.1-41.4-179.1-48.50000112V26 T29 L30 Q90 P91 T96 V97 L98V26-T94 HydrophobicContact CG1-CG2 4.32Å; T29-T94 HydrophobicContact CG2-CG2 4.31Å; L30-T94 HydrophobicContact CD2-CG2 4.02Å; L30-T94 HydrophobicContact CG-CG2 4.12Å; Q90-T94 PolarHBondContact O-N 3.26Å; P91-T94 WeakPolarHBondContact O-CB 3.49Å; P91-T94 PolarHBondContact O-N 3.49Å; P91-T94 PolarHBondContact O-OG1 3.08Å; T94-T96 PolarHBondContact O-N 3.45Å; T94-V97 PolarHBondContact O-N 3.21Å; T94-L98 HydrophobicContact CG2-CD1 4.25Å; T94-L98 WeakPolarHBondContact O-CG 3.24Å; T94-L98 PolarHBondContact O-N 3.36Å
95G95.9Very high94.3Very high42 Ų4242.6 Ų42.643%0.43323%0.233SC..Hα-helixtrans-64.3-39.1179.800000113Q93 L98 S99Q93-G95 PolarHBondContact O-N 3.39Å; G95-L98 PolarHBondContact O-N 3.05Å; G95-S99 WeakPolarHBondContact O-CB 3.34Å; G95-S99 PolarHBondContact O-N 3.41Å; G95-S99 PolarHBondContact O-OG 2.91Å
96T95.8Very high94.1Very high64 Ų6446.4 Ų46.439%0.39327%0.265SS..Hα-helixtrans-62.5-47.8177.2-50.20000110.8Q93 T94 L98 S99 R100 F126Q93-T96 WeakPolarHBondContact O-CB 3.43Å; Q93-T96 PolarHBondContact O-N 3.49Å; Q93-T96 VanDerWaalsContact O-N 3.08Å; Q93-T96 PolarHBondContact OE1-OG1 3.47Å; T94-T96 PolarHBondContact O-N 3.45Å; T96-L98 PolarHBondContact O-N 2.93Å; T96-S99 PolarHBondContact O-N 3.05Å; T96-R100 PolarHBondContact O-N 3.33Å; T96-F126 HydrophobicContact CG2-CE2 3.99Å
97V96.8Very high93.8Very high1 Ų153 Ų531%0.00630%0.296CS..Hα-helixtrans-61.4-46.5178.8174.70000111.3L30 I89 Q93 T94 S99 R100 F101 V122 L123 F126L30-V97 HydrophobicContact CD2-CB 4.47Å; L30-V97 HydrophobicContact CD2-CG1 4Å; I89-V97 HydrophobicContact CD1-CG1 4.26Å; I89-V97 HydrophobicContact CD1-CG2 4.06Å; I89-V97 HydrophobicContact CG2-CG2 4.37Å; Q93-V97 PolarHBondContact O-N 3.43Å; T94-V97 PolarHBondContact O-N 3.21Å; V97-S99 VanDerWaalsContact C-N 3.33Å; V97-S99 PolarHBondContact O-N 3.36Å; V97-R100 PolarHBondContact O-N 3.01Å; V97-F101 WeakPolarHBondContact O-CB 3.48Å; V97-F101 PolarHBondContact O-N 2.73Å; V97-V122 HydrophobicContact CG1-CG1 4.24Å; V97-L123 HydrophobicContact CG1-CD2 3.82Å; V97-F126 HydrophobicContact CG2-CB 4.29Å; V97-F126 HydrophobicContact CG2-CD1 3.44Å; V97-F126 VanDerWaalsContact CG2-CD1 3.44Å; V97-F126 HydrophobicContact CG2-CD2 3.98Å; V97-F126 HydrophobicContact CG2-CE1 3.65Å; V97-F126 HydrophobicContact CG2-CE2 4.2Å; V97-F126 HydrophobicContact CG2-CG 3.62Å; V97-F126 HydrophobicContact CG2-CZ 4.06Å
98L97.4Very high93.4Very high19 Ų1953.6 Ų53.610%0.09930%0.298CS..Hα-helixtrans-63.7-38.3177.4-73.6177.3000112.7T29 L30 E33 T94 G95 T96 F101 R102T29-L98 HydrophobicContact CG2-CD1 4.31Å; L30-L98 HydrophobicContact CD2-CD2 3.66Å; L30-L98 HydrophobicContact CD2-CG 3.82Å; E33-L98 HydrophobicContact CB-CD2 3.64Å; E33-L98 HydrophobicContact CG-CD1 4.11Å; E33-L98 HydrophobicContact CG-CD2 3.63Å; T94-L98 HydrophobicContact CG2-CD1 4.25Å; T94-L98 WeakPolarHBondContact O-CG 3.24Å; T94-L98 PolarHBondContact O-N 3.36Å; G95-L98 PolarHBondContact O-N 3.05Å; T96-L98 PolarHBondContact O-N 2.93Å; L98-F101 PolarHBondContact O-N 3.04Å; L98-R102 WeakPolarHBondContact O-CB 3.37Å; L98-R102 WeakPolarHBondContact O-CG 3.42Å; L98-R102 PolarHBondContact O-N 3.17Å
99S96.6Very high93Very high75 Ų7560.5 Ų60.552%0.52434%0.335SS..Hα-helixtrans-63.2-49.6178.5-590000110.7G95 T96 V97 F101 R102 E103G95-S99 WeakPolarHBondContact O-CB 3.34Å; G95-S99 PolarHBondContact O-N 3.41Å; G95-S99 PolarHBondContact O-OG 2.91Å; T96-S99 PolarHBondContact O-N 3.05Å; V97-S99 VanDerWaalsContact C-N 3.33Å; V97-S99 PolarHBondContact O-N 3.36Å; S99-F101 VanDerWaalsContact C-N 3.34Å; S99-F101 PolarHBondContact O-N 3.14Å; S99-R102 PolarHBondContact O-N 3.03Å; S99-E103 WeakPolarHBondContact O-CB 3.34Å; S99-E103 PolarHBondContact O-N 3.08Å
100R95.9Very high92.7Very high122 Ų12261 Ų6146%0.4634%0.338SS..Hα-helixtrans-61.1-42176.3-68-56.3-61.9171.6-1.5112.2T96 V97 R102 E103 V104 V122T96-R100 PolarHBondContact O-N 3.33Å; V97-R100 PolarHBondContact O-N 3.01Å; R100-R102 PolarHBondContact O-N 2.72Å; R100-E103 IonicContact CZ-OE1 3.57Å; R100-E103 IonicContact CZ-OE2 3.64Å; R100-E103 IonicContact NE-OE2 2.73Å; R100-E103 IonicContact NH1-OE1 3.64Å; R100-E103 PolarHBondContact NH1-OE1 3.09Å; R100-E103 IonicContact NH1-OE2 3.71Å; R100-E103 PolarHBondContact NH1-OE2 3.39Å; R100-E103 PolarHBondContact O-N 3.03Å; R100-V104 VanDerWaalsContact O-CG2 3.3Å; R100-V104 WeakPolarHBondContact O-CG2 3.44Å; R100-V104 PolarHBondContact O-N 3.39Å; R100-V104 VanDerWaalsContact O-N 3.12Å; R100-V122 HydrophobicContact CB-CG1 4.18Å
101F96.6Very high92.4Very high0 Ų060.8 Ų60.80%034%0.339CS..Hα-helixtrans-59.9-47.4177173.4-123.6000112.5L34 H37 V97 L98 S99 V104 L105 I115 I118 F119 V122L34-F101 HydrophobicContact CD1-CZ 4.39Å; H37-F101 HydrophobicContact CB-CE1 4.47Å; H37-F101 HydrophobicContact CB-CZ 4.45Å; H37-F101 AromaticContact CD2-CE1 3.54Å; V97-F101 WeakPolarHBondContact O-CB 3.48Å; V97-F101 PolarHBondContact O-N 2.73Å; L98-F101 PolarHBondContact O-N 3.04Å; S99-F101 VanDerWaalsContact C-N 3.34Å; S99-F101 PolarHBondContact O-N 3.14Å; F101-V104 PolarHBondContact O-N 3.3Å; F101-L105 HydrophobicContact CD1-CD1 4.39Å; F101-L105 HydrophobicContact CD2-CD1 4.4Å; F101-L105 HydrophobicContact CD2-CG 4.31Å; F101-L105 HydrophobicContact CE1-CD1 3.8Å; F101-L105 HydrophobicContact CE2-CD1 3.79Å; F101-L105 HydrophobicContact CE2-CD2 4.2Å; F101-L105 HydrophobicContact CE2-CG 3.94Å; F101-L105 HydrophobicContact CZ-CD1 3.48Å; F101-L105 VanDerWaalsContact CZ-CD1 3.48Å; F101-L105 HydrophobicContact CZ-CG 4.17Å; F101-L105 WeakPolarHBondContact O-CG 3.47Å; F101-L105 PolarHBondContact O-N 3Å; F101-L105 VanDerWaalsContact O-N 3.11Å; F101-I115 HydrophobicContact CE2-CG2 4.13Å; F101-I115 HydrophobicContact CZ-CG2 3.71Å; F101-I118 HydrophobicContact CD2-CG2 4.11Å; F101-I118 HydrophobicContact CE2-CG2 4.16Å; F101-F119 AromaticContact CD1-CD2 3.97Å; F101-F119 HydrophobicContact CD1-CD2 3.97Å; F101-F119 HydrophobicContact CD1-CE2 4.36Å; F101-F119 HydrophobicContact CD2-CB 4.19Å; F101-F119 AromaticContact CD2-CD2 3.74Å; F101-F119 HydrophobicContact CD2-CD2 3.74Å; F101-F119 HydrophobicContact CD2-CG 4.49Å; F101-F119 HydrophobicContact CE1-CD2 4Å; F101-F119 HydrophobicContact CE2-CB 3.7Å; F101-F119 AromaticContact CE2-CD2 3.79Å; F101-F119 HydrophobicContact CE2-CD2 3.79Å; F101-F119 HydrophobicContact CE2-CG 4.23Å; F101-F119 AromaticContact CG-CD2 3.82Å; F101-F119 HydrophobicContact CG-CD2 3.82Å; F101-F119 HydrophobicContact CG-CE2 4.41Å; F101-F119 HydrophobicContact CZ-CB 4.16Å; F101-F119 AromaticContact CZ-CD2 3.9Å; F101-F119 HydrophobicContact CZ-CD2 3.9Å; F101-F119 HydrophobicContact CZ-CG 4.4Å; F101-V122 HydrophobicContact CB-CG1 4.29Å
102R95.9Very high92Very high116 Ų11658.1 Ų58.144%0.43832%0.322SS..Hα-helixtrans-66.3-37.8179.8-73.1174.8177.6174.81.1112.8E33 L98 S99 R100 L105 A106E33-R102 IonicContact OE1-NH2 2.76Å; E33-R102 PolarHBondContact OE1-NH2 3.22Å; E33-R102 IonicContact OE2-CZ 3.86Å; E33-R102 IonicContact OE2-NE 3.78Å; E33-R102 IonicContact OE2-NH2 2.66Å; E33-R102 PolarHBondContact OE2-NH2 2.83Å; L98-R102 WeakPolarHBondContact O-CB 3.37Å; L98-R102 WeakPolarHBondContact O-CG 3.42Å; L98-R102 PolarHBondContact O-N 3.17Å; S99-R102 PolarHBondContact O-N 3.03Å; R100-R102 PolarHBondContact O-N 2.72Å; R102-L105 PolarHBondContact O-N 3.5Å; R102-A106 WeakPolarHBondContact O-CB 3.5Å; R102-A106 PolarHBondContact O-N 3.12Å
103E92.9Very high91.6Very high74 Ų7462 Ų6235%0.34632%0.323SS..Hα-helixtrans-58.1-49.6174.4-174.3-178.916500110.8S99 R100 L105 A106 E107S99-E103 WeakPolarHBondContact O-CB 3.34Å; S99-E103 PolarHBondContact O-N 3.08Å; R100-E103 IonicContact CZ-OE1 3.57Å; R100-E103 IonicContact CZ-OE2 3.64Å; R100-E103 IonicContact NE-OE2 2.73Å; R100-E103 IonicContact NH1-OE1 3.64Å; R100-E103 PolarHBondContact NH1-OE1 3.09Å; R100-E103 IonicContact NH1-OE2 3.71Å; R100-E103 PolarHBondContact NH1-OE2 3.39Å; R100-E103 PolarHBondContact O-N 3.03Å; E103-L105 VanDerWaalsContact C-N 3.3Å; E103-L105 PolarHBondContact O-N 3.27Å; E103-A106 PolarHBondContact O-N 3.13Å; E103-E107 WeakPolarHBondContact O-CG 3.41Å; E103-E107 PolarHBondContact O-N 2.9Å
104V93Very high91.4Very high8 Ų862.1 Ų62.15%0.04832%0.324CS..Hα-helixtrans-61-39.1177.5178.10000111.7W6 R100 F101 A106 N108 I118W6-V104 HydrophobicContact CH2-CG1 4.01Å; W6-V104 HydrophobicContact CH2-CG2 3.74Å; W6-V104 HydrophobicContact CZ2-CG1 4.18Å; R100-V104 VanDerWaalsContact O-CG2 3.3Å; R100-V104 WeakPolarHBondContact O-CG2 3.44Å; R100-V104 PolarHBondContact O-N 3.39Å; R100-V104 VanDerWaalsContact O-N 3.12Å; F101-V104 PolarHBondContact O-N 3.3Å; V104-A106 VanDerWaalsContact C-N 3.31Å; V104-A106 PolarHBondContact O-N 3.11Å; V104-N108 WeakPolarHBondContact O-CB 3.38Å; V104-N108 PolarHBondContact O-N 2.92Å; V104-N108 PolarHBondContact O-ND2 3.24Å; V104-I118 HydrophobicContact CB-CG2 4.22Å; V104-I118 HydrophobicContact CG1-CG2 3.6Å
105L92.9Very high91.2Very high5 Ų561.2 Ų61.23%0.02632%0.319CS..Hα-helixtrans-70.5-24176.2-69.5-173.6000114.3H37 R41 F101 R102 E103 V110 I115 I118H37-L105 HydrophobicContact CB-CD1 3.93Å; H37-L105 WeakPolarHBondContact ND1-CD1 3.42Å; R41-L105 PolarHBondContact NH2-O 3.23Å; F101-L105 HydrophobicContact CD1-CD1 4.39Å; F101-L105 HydrophobicContact CD2-CD1 4.4Å; F101-L105 HydrophobicContact CD2-CG 4.31Å; F101-L105 HydrophobicContact CE1-CD1 3.8Å; F101-L105 HydrophobicContact CE2-CD1 3.79Å; F101-L105 HydrophobicContact CE2-CD2 4.2Å; F101-L105 HydrophobicContact CE2-CG 3.94Å; F101-L105 HydrophobicContact CZ-CD1 3.48Å; F101-L105 VanDerWaalsContact CZ-CD1 3.48Å; F101-L105 HydrophobicContact CZ-CG 4.17Å; F101-L105 WeakPolarHBondContact O-CG 3.47Å; F101-L105 PolarHBondContact O-N 3Å; F101-L105 VanDerWaalsContact O-N 3.11Å; R102-L105 PolarHBondContact O-N 3.5Å; E103-L105 VanDerWaalsContact C-N 3.3Å; E103-L105 PolarHBondContact O-N 3.27Å; L105-V110 HydrophobicContact CD2-CB 4.21Å; L105-V110 HydrophobicContact CD2-CG1 4.07Å; L105-V110 HydrophobicContact CD2-CG2 4.04Å; L105-I115 HydrophobicContact CD1-CG2 4.42Å; L105-I115 HydrophobicContact CD2-CG1 4.26Å; L105-I115 HydrophobicContact CD2-CG2 4.36Å; L105-I118 HydrophobicContact CD2-CD1 4.25Å
106A90.6Very high91Very high87 Ų8760 Ų6072%0.71930%0.302SS*.Hα-helixtrans-84.6-33.9179.600000112R102 E103 V104R102-A106 WeakPolarHBondContact O-CB 3.5Å; R102-A106 PolarHBondContact O-N 3.12Å; E103-A106 PolarHBondContact O-N 3.13Å; V104-A106 VanDerWaalsContact C-N 3.31Å; V104-A106 PolarHBondContact O-N 3.11Å
107E88.8Confident90.8Very high140 Ų14060 Ų6065%0.65430%0.296SS*.Hα-helixtrans-80.4-16.3179.9-68.9179176.200113.6E103E103-E107 WeakPolarHBondContact O-CG 3.41Å; E103-E107 PolarHBondContact O-N 2.9Å
108N84.3Confident90.6Very high30 Ų3060.9 Ų60.916%0.1630%0.3CS..SBendtrans-123.5141.5-172.5-62.4-87.3000112V104 V110V104-N108 WeakPolarHBondContact O-CB 3.38Å; V104-N108 PolarHBondContact O-N 2.92Å; V104-N108 PolarHBondContact O-ND2 3.24Å; N108-V110 VanDerWaalsContact C-N 3.34Å; N108-V110 HydrophobicContact CB-CG2 3.59Å; N108-V110 PolarHBondContact O-N 3.05Å
109D85.6Confident90.5Very high165 Ų16560 Ų6088%0.88230%0.296SS*.  trans-78.985.3167.6-74.5-37.5000109.5
110V87.2Confident90.4Very high11 Ų1159.1 Ų59.17%0.06728%0.283CS..  trans-93.7131.7-172-179.20000111.5L105 N108 E114 I115 I118L105-V110 HydrophobicContact CD2-CB 4.21Å; L105-V110 HydrophobicContact CD2-CG1 4.07Å; L105-V110 HydrophobicContact CD2-CG2 4.04Å; N108-V110 VanDerWaalsContact C-N 3.34Å; N108-V110 HydrophobicContact CB-CG2 3.59Å; N108-V110 PolarHBondContact O-N 3.05Å; V110-E114 HydrophobicContact CG1-CB 3.68Å; V110-I115 HydrophobicContact CG1-CG1 3.7Å; V110-I118 HydrophobicContact CB-CD1 4.17Å; V110-I118 HydrophobicContact CG1-CD1 3.43Å; V110-I118 VanDerWaalsContact CG1-CD1 3.43Å; V110-I118 HydrophobicContact CG2-CD1 3.53Å
111L84.6Confident90.3Very high74 Ų7455.4 Ų55.439%0.38727%0.27SS..  trans-79.2151.7173.2-62.3164000110.9W113 E114L111-W113 VanDerWaalsContact C-N 3.3Å; L111-W113 HydrophobicContact CB-CD2 3.88Å; L111-W113 HydrophobicContact CB-CE3 4.15Å; L111-W113 HydrophobicContact CB-CH2 3.89Å; L111-W113 HydrophobicContact CB-CZ2 3.61Å; L111-W113 HydrophobicContact CB-CZ3 4.13Å; L111-W113 HydrophobicContact CD1-CH2 3.79Å; L111-W113 HydrophobicContact CD1-CZ2 3.16Å; L111-W113 HydrophobicContact CD2-CH2 3.96Å; L111-W113 HydrophobicContact CD2-CZ2 4.19Å; L111-W113 HydrophobicContact CG-CH2 4.07Å; L111-W113 HydrophobicContact CG-CZ2 3.8Å; L111-W113 PolarHBondContact O-N 3.44Å; L111-W113 VanDerWaalsContact O-N 3.14Å; L111-E114 HydrophobicContact CB-CG 4.13Å; L111-E114 WeakPolarHBondContact CB-OE2 3.38Å; L111-E114 PolarHBondContact N-OE2 3.06Å; L111-E114 WeakPolarHBondContact O-CB 3.42Å; L111-E114 PolarHBondContact O-N 2.97Å
112P83.4Confident90.3Very high11 Ų1155.9 Ų55.97%0.07127%0.273CS..Hα-helixtrans-51.5-43.7-175.4-29.235.3000114.2L38 R41 V45 A72 E114 I115L38-P112 WeakPolarHBondContact CD2-O 3.49Å; R41-P112 HydrophobicContact CB-CG 4.29Å; V45-P112 HydrophobicContact CG2-CG 4.4Å; A72-P112 HydrophobicContact CB-CB 3.92Å; P112-E114 VanDerWaalsContact C-N 3.26Å; P112-E114 PolarHBondContact O-N 3.26Å; P112-I115 WeakPolarHBondContact O-CB 3.42Å; P112-I115 PolarHBondContact O-N 3.49Å
113W80.9Confident90.3Very high172 Ų17250.4 Ų50.465%0.65225%0.253SS*.Hα-helixtrans-67.3-23.8179.654.388000114L111 I115L111-W113 VanDerWaalsContact C-N 3.3Å; L111-W113 HydrophobicContact CB-CD2 3.88Å; L111-W113 HydrophobicContact CB-CE3 4.15Å; L111-W113 HydrophobicContact CB-CH2 3.89Å; L111-W113 HydrophobicContact CB-CZ2 3.61Å; L111-W113 HydrophobicContact CB-CZ3 4.13Å; L111-W113 HydrophobicContact CD1-CH2 3.79Å; L111-W113 HydrophobicContact CD1-CZ2 3.16Å; L111-W113 HydrophobicContact CD2-CH2 3.96Å; L111-W113 HydrophobicContact CD2-CZ2 4.19Å; L111-W113 HydrophobicContact CG-CH2 4.07Å; L111-W113 HydrophobicContact CG-CZ2 3.8Å; L111-W113 PolarHBondContact O-N 3.44Å; L111-W113 VanDerWaalsContact O-N 3.14Å; W113-I115 VanDerWaalsContact C-N 3.35Å
114E88Confident90.4Very high70 Ų7048.9 Ų48.933%0.32725%0.245SC..Hα-helixtrans-77.8-22.7180-61.8178.5133.900112.2V110 L111 P112 V116 Y117 I118V110-E114 HydrophobicContact CG1-CB 3.68Å; L111-E114 HydrophobicContact CB-CG 4.13Å; L111-E114 WeakPolarHBondContact CB-OE2 3.38Å; L111-E114 PolarHBondContact N-OE2 3.06Å; L111-E114 WeakPolarHBondContact O-CB 3.42Å; L111-E114 PolarHBondContact O-N 2.97Å; P112-E114 VanDerWaalsContact C-N 3.26Å; P112-E114 PolarHBondContact O-N 3.26Å; E114-V116 VanDerWaalsContact C-N 3.3Å; E114-V116 PolarHBondContact O-N 3.36Å; E114-Y117 WeakPolarHBondContact O-CB 3.25Å; E114-Y117 PolarHBondContact O-N 3.23Å; E114-Y117 VanDerWaalsContact O-N 3.09Å; E114-I118 HydrophobicContact CB-CD1 4.47Å; E114-I118 WeakPolarHBondContact O-CG1 3.36Å; E114-I118 PolarHBondContact O-N 3.38Å
115I92.2Very high90.4Very high0 Ų051.5 Ų51.50%026%0.259CS..Hα-helixtrans-60.5-41.3-178.3-57.3176.4000111L34 H37 L38 R41 F101 L105 V110 P112 W113 Y117 I118 F119L34-I115 HydrophobicContact CD1-CG2 3.74Å; H37-I115 HydrophobicContact CB-CG2 4.15Å; L38-I115 HydrophobicContact CD2-CB 3.93Å; L38-I115 HydrophobicContact CD2-CD1 4.15Å; L38-I115 HydrophobicContact CD2-CG1 4.48Å; L38-I115 HydrophobicContact CD2-CG2 4.44Å; L38-I115 HydrophobicContact CG-CB 4.34Å; L38-I115 HydrophobicContact CG-CG2 4.31Å; R41-I115 HydrophobicContact CB-CD1 3.78Å; R41-I115 HydrophobicContact CG-CD1 3.58Å; F101-I115 HydrophobicContact CE2-CG2 4.13Å; F101-I115 HydrophobicContact CZ-CG2 3.71Å; L105-I115 HydrophobicContact CD1-CG2 4.42Å; L105-I115 HydrophobicContact CD2-CG1 4.26Å; L105-I115 HydrophobicContact CD2-CG2 4.36Å; V110-I115 HydrophobicContact CG1-CG1 3.7Å; P112-I115 WeakPolarHBondContact O-CB 3.42Å; P112-I115 PolarHBondContact O-N 3.49Å; W113-I115 VanDerWaalsContact C-N 3.35Å; I115-Y117 VanDerWaalsContact C-N 3.3Å; I115-Y117 PolarHBondContact O-N 3.43Å; I115-I118 PolarHBondContact O-N 3.21Å; I115-F119 VanDerWaalsContact O-CB 3.24Å; I115-F119 WeakPolarHBondContact O-CB 3.37Å; I115-F119 PolarHBondContact O-N 3.11Å
116V91.8Very high90.5Very high15 Ų1552.7 Ų52.79%0.09126%0.264CS..Hα-helixtrans-61.6-42.7177.1-176.10000110.6L38 I74 L82 E114 K120L38-V116 HydrophobicContact CD1-CG2 3.91Å; L38-V116 HydrophobicContact CD2-CG2 4.07Å; I74-V116 HydrophobicContact CD1-CG2 4.38Å; I74-V116 HydrophobicContact CG1-CG2 3.94Å; I74-V116 HydrophobicContact CG2-CG1 4.34Å; L82-V116 HydrophobicContact CD1-CG1 4.06Å; E114-V116 VanDerWaalsContact C-N 3.3Å; E114-V116 PolarHBondContact O-N 3.36Å; V116-K120 WeakPolarHBondContact O-CB 3.27Å; V116-K120 PolarHBondContact O-N 2.93Å
117Y91.1Very high90.6Very high64 Ų6449.3 Ų49.325%0.25123%0.234SC..Hα-helixtrans-66.6-48.3179.1177.3-94.1000111.6M7 E114 I115 F119 K120 Q121M7-Y117 HydrophobicContact CE-CD1 4.23Å; M7-Y117 HydrophobicContact CE-CE1 3.68Å; M7-Y117 HydrophobicContact CG-CE1 4.08Å; M7-Y117 HydrophobicContact SD-CE1 4.04Å; E114-Y117 WeakPolarHBondContact O-CB 3.25Å; E114-Y117 PolarHBondContact O-N 3.23Å; E114-Y117 VanDerWaalsContact O-N 3.09Å; I115-Y117 VanDerWaalsContact C-N 3.3Å; I115-Y117 PolarHBondContact O-N 3.43Å; Y117-F119 VanDerWaalsContact C-N 3.29Å; Y117-F119 PolarHBondContact O-N 2.84Å; Y117-K120 WeakPolarHBondContact O-CB 3.47Å; Y117-K120 PolarHBondContact O-N 3.09Å; Y117-Q121 HydrophobicContact CD1-CG 4.19Å; Y117-Q121 HydrophobicContact CE1-CG 3.71Å; Y117-Q121 HydrophobicContact CE2-CG 4.3Å; Y117-Q121 VanDerWaalsContact CZ-NE2 3.29Å; Y117-Q121 WeakPolarHBondContact O-CG 3.26Å; Y117-Q121 PolarHBondContact O-N 3.07Å; Y117-Q121 PolarHBondContact OH-NE2 2.96Å
118I93.6Very high90.7Very high20 Ų2045.5 Ų45.510%0.10322%0.22CC..Hα-helixtrans-57.6-46.9176.9-71.7166.4000110F101 V104 L105 V110 E114 I115 K120 Q121 V122F101-I118 HydrophobicContact CD2-CG2 4.11Å; F101-I118 HydrophobicContact CE2-CG2 4.16Å; V104-I118 HydrophobicContact CB-CG2 4.22Å; V104-I118 HydrophobicContact CG1-CG2 3.6Å; L105-I118 HydrophobicContact CD2-CD1 4.25Å; V110-I118 HydrophobicContact CB-CD1 4.17Å; V110-I118 HydrophobicContact CG1-CD1 3.43Å; V110-I118 VanDerWaalsContact CG1-CD1 3.43Å; V110-I118 HydrophobicContact CG2-CD1 3.53Å; E114-I118 HydrophobicContact CB-CD1 4.47Å; E114-I118 WeakPolarHBondContact O-CG1 3.36Å; E114-I118 PolarHBondContact O-N 3.38Å; I115-I118 PolarHBondContact O-N 3.21Å; I118-K120 VanDerWaalsContact C-N 3.35Å; I118-K120 PolarHBondContact O-N 2.95Å; I118-Q121 PolarHBondContact O-N 3.41Å; I118-Q121 VanDerWaalsContact O-N 3.12Å; I118-V122 HydrophobicContact CG2-CG2 4.36Å; I118-V122 WeakPolarHBondContact O-CG2 3.44Å; I118-V122 PolarHBondContact O-N 3.2Å
119F95.6Very high91Very high0 Ų046.2 Ų46.20%023%0.225CC..Hα-helixtrans-59-47.3178.9-173.2-109.2000111.6L30 L31 L34 L82 F101 I115 Y117 Q121 V122 L123L30-F119 HydrophobicContact CB-CZ 3.91Å; L30-F119 HydrophobicContact CD2-CE2 4.42Å; L30-F119 HydrophobicContact CD2-CZ 4.27Å; L31-F119 HydrophobicContact CD2-CE1 4.5Å; L34-F119 HydrophobicContact CB-CD1 4.22Å; L34-F119 HydrophobicContact CB-CE1 4.36Å; L34-F119 HydrophobicContact CB-CG 4.33Å; L34-F119 HydrophobicContact CD1-CB 3.86Å; L34-F119 HydrophobicContact CD1-CD1 4.32Å; L34-F119 HydrophobicContact CD1-CG 4.07Å; L34-F119 HydrophobicContact CD2-CD1 3.7Å; L34-F119 HydrophobicContact CD2-CE1 4.2Å; L34-F119 HydrophobicContact CD2-CG 4.29Å; L34-F119 HydrophobicContact CG-CD1 4.29Å; L34-F119 HydrophobicContact CG-CG 4.46Å; L82-F119 HydrophobicContact CD1-CD1 4.33Å; L82-F119 HydrophobicContact CD2-CD1 3.81Å; L82-F119 HydrophobicContact CD2-CE1 4.26Å; F101-F119 AromaticContact CD1-CD2 3.97Å; F101-F119 HydrophobicContact CD1-CD2 3.97Å; F101-F119 HydrophobicContact CD1-CE2 4.36Å; F101-F119 HydrophobicContact CD2-CB 4.19Å; F101-F119 AromaticContact CD2-CD2 3.74Å; F101-F119 HydrophobicContact CD2-CD2 3.74Å; F101-F119 HydrophobicContact CD2-CG 4.49Å; F101-F119 HydrophobicContact CE1-CD2 4Å; F101-F119 HydrophobicContact CE2-CB 3.7Å; F101-F119 AromaticContact CE2-CD2 3.79Å; F101-F119 HydrophobicContact CE2-CD2 3.79Å; F101-F119 HydrophobicContact CE2-CG 4.23Å; F101-F119 AromaticContact CG-CD2 3.82Å; F101-F119 HydrophobicContact CG-CD2 3.82Å; F101-F119 HydrophobicContact CG-CE2 4.41Å; F101-F119 HydrophobicContact CZ-CB 4.16Å; F101-F119 AromaticContact CZ-CD2 3.9Å; F101-F119 HydrophobicContact CZ-CD2 3.9Å; F101-F119 HydrophobicContact CZ-CG 4.4Å; I115-F119 VanDerWaalsContact O-CB 3.24Å; I115-F119 WeakPolarHBondContact O-CB 3.37Å; I115-F119 PolarHBondContact O-N 3.11Å; Y117-F119 VanDerWaalsContact C-N 3.29Å; Y117-F119 PolarHBondContact O-N 2.84Å; F119-Q121 VanDerWaalsContact C-N 3.28Å; F119-Q121 PolarHBondContact O-N 3.37Å; F119-V122 PolarHBondContact O-N 2.92Å; F119-L123 HydrophobicContact CD1-CD1 3.92Å; F119-L123 HydrophobicContact CD1-CG 4.47Å; F119-L123 HydrophobicContact CE1-CD1 3.55Å; F119-L123 HydrophobicContact CE1-CD2 4.39Å; F119-L123 HydrophobicContact CE1-CG 4.16Å; F119-L123 HydrophobicContact CZ-CD1 4.03Å; F119-L123 HydrophobicContact CZ-CD2 4.03Å; F119-L123 HydrophobicContact CZ-CG 4.2Å; F119-L123 VanDerWaalsContact O-CG 3.31Å; F119-L123 WeakPolarHBondContact O-CG 3.42Å; F119-L123 PolarHBondContact O-N 3.23Å
120K94.8Very high91.2Very high58 Ų5840.4 Ų40.425%0.25219%0.194SC..Hα-helixtrans-57.2-40.8175-171.7179.8-174.21720112.5L82 L85 V116 Y117 I118 L123 K124L82-K120 HydrophobicContact CD2-CB 3.88Å; L82-K120 HydrophobicContact CD2-CG 4.22Å; L85-K120 HydrophobicContact CD1-CG 3.9Å; V116-K120 WeakPolarHBondContact O-CB 3.27Å; V116-K120 PolarHBondContact O-N 2.93Å; Y117-K120 WeakPolarHBondContact O-CB 3.47Å; Y117-K120 PolarHBondContact O-N 3.09Å; I118-K120 VanDerWaalsContact C-N 3.35Å; I118-K120 PolarHBondContact O-N 2.95Å; K120-L123 PolarHBondContact O-N 2.84Å; K120-K124 WeakPolarHBondContact O-CG 3.15Å; K120-K124 PolarHBondContact O-N 2.87Å; K120-K124 VanDerWaalsContact O-N 3.1Å
121Q93.6Very high91.2Very high43 Ų4345 Ų4520%0.20122%0.215CC..Hα-helixtrans-69-44.6179.1-68.7-61.23.300112Y117 I118 F119 L123 K124 D125Y117-Q121 HydrophobicContact CD1-CG 4.19Å; Y117-Q121 HydrophobicContact CE1-CG 3.71Å; Y117-Q121 HydrophobicContact CE2-CG 4.3Å; Y117-Q121 VanDerWaalsContact CZ-NE2 3.29Å; Y117-Q121 WeakPolarHBondContact O-CG 3.26Å; Y117-Q121 PolarHBondContact O-N 3.07Å; Y117-Q121 PolarHBondContact OH-NE2 2.96Å; I118-Q121 PolarHBondContact O-N 3.41Å; I118-Q121 VanDerWaalsContact O-N 3.12Å; F119-Q121 VanDerWaalsContact C-N 3.28Å; F119-Q121 PolarHBondContact O-N 3.37Å; Q121-L123 PolarHBondContact O-N 3.26Å; Q121-K124 PolarHBondContact O-N 3.45Å; Q121-K124 VanDerWaalsContact O-N 3.07Å; Q121-D125 WeakPolarHBondContact O-CB 3.48Å; Q121-D125 PolarHBondContact O-N 3.48Å
122V96Very high91.2Very high11 Ų1148.8 Ų48.87%0.06722%0.224CC..Hα-helixtrans-56.6-41.4175.3172.40000111.1V97 R100 F101 I118 F119 F126V97-V122 HydrophobicContact CG1-CG1 4.24Å; R100-V122 HydrophobicContact CB-CG1 4.18Å; F101-V122 HydrophobicContact CB-CG1 4.29Å; I118-V122 HydrophobicContact CG2-CG2 4.36Å; I118-V122 WeakPolarHBondContact O-CG2 3.44Å; I118-V122 PolarHBondContact O-N 3.2Å; F119-V122 PolarHBondContact O-N 2.92Å; V122-F126 VanDerWaalsContact O-CB 3.22Å; V122-F126 WeakPolarHBondContact O-CB 3.33Å; V122-F126 PolarHBondContact O-N 2.98Å
123L95.8Very high91.3Very high0 Ų053 Ų530%024%0.242CC..Hα-helixtrans-62.3-47.1175.3-64.1173.5000112.1L30 L82 L85 I89 V97 F119 K120 Q121 F126 L127L30-L123 HydrophobicContact CD1-CD2 4.14Å; L82-L123 HydrophobicContact CD2-CD1 3.91Å; L85-L123 HydrophobicContact CB-CB 4.19Å; L85-L123 HydrophobicContact CB-CD1 3.78Å; L85-L123 HydrophobicContact CD1-CB 4.37Å; L85-L123 HydrophobicContact CD1-CD1 4.27Å; I89-L123 HydrophobicContact CD1-CD2 3.24Å; V97-L123 HydrophobicContact CG1-CD2 3.82Å; F119-L123 HydrophobicContact CD1-CD1 3.92Å; F119-L123 HydrophobicContact CD1-CG 4.47Å; F119-L123 HydrophobicContact CE1-CD1 3.55Å; F119-L123 HydrophobicContact CE1-CD2 4.39Å; F119-L123 HydrophobicContact CE1-CG 4.16Å; F119-L123 HydrophobicContact CZ-CD1 4.03Å; F119-L123 HydrophobicContact CZ-CD2 4.03Å; F119-L123 HydrophobicContact CZ-CG 4.2Å; F119-L123 VanDerWaalsContact O-CG 3.31Å; F119-L123 WeakPolarHBondContact O-CG 3.42Å; F119-L123 PolarHBondContact O-N 3.23Å; K120-L123 PolarHBondContact O-N 2.84Å; Q121-L123 PolarHBondContact O-N 3.26Å; L123-F126 PolarHBondContact O-N 2.78Å; L123-L127 VanDerWaalsContact O-CG 3.27Å; L123-L127 WeakPolarHBondContact O-CG 3.42Å; L123-L127 PolarHBondContact O-N 3.44Å
124K94.8Very high91.3Very high43 Ų4348 Ų4819%0.18723%0.228CC..Hα-helixtrans-65-46.1179.7-76.4-177.3161.7-127.70112.4D13 L85 K120 Q121 F126 L127 T128D13-K124 IonicContact OD2-NZ 2.62Å; D13-K124 PolarHBondContact OD2-NZ 3.44Å; L85-K124 HydrophobicContact CD1-CG 4.34Å; L85-K124 HydrophobicContact CD2-CG 4.33Å; K120-K124 WeakPolarHBondContact O-CG 3.15Å; K120-K124 PolarHBondContact O-N 2.87Å; K120-K124 VanDerWaalsContact O-N 3.1Å; Q121-K124 PolarHBondContact O-N 3.45Å; Q121-K124 VanDerWaalsContact O-N 3.07Å; K124-F126 VanDerWaalsContact C-N 3.25Å; K124-F126 PolarHBondContact O-N 3.13Å; K124-L127 PolarHBondContact O-N 3.21Å; K124-T128 WeakPolarHBondContact O-CB 3.38Å; K124-T128 VanDerWaalsContact O-CG2 3.26Å; K124-T128 WeakPolarHBondContact O-CG2 3.29Å; K124-T128 PolarHBondContact O-N 2.98Å; K124-T128 PolarHBondContact O-OG1 3.46Å
125D93.8Very high90.8Very high62 Ų6250 Ų5033%0.33224%0.238SC..Hα-helixtrans-61.8-38.6179.3-71.7-4.3000110.9Q121 T128 T129Q121-D125 WeakPolarHBondContact O-CB 3.48Å; Q121-D125 PolarHBondContact O-N 3.48Å; D125-T128 WeakPolarHBondContact CA-OG1 3.15Å; D125-T128 PolarHBondContact O-OG1 3.1Å; D125-T129 WeakPolarHBondContact O-CB 3.49Å; D125-T129 PolarHBondContact O-N 3.24Å; D125-T129 PolarHBondContact O-OG1 3.31Å
126F94.3Very high90Very high30 Ų3056 Ų5613%0.13227%0.266CS..Hα-helixtrans-65.9-48.9175.4-173.1-105.4000112.2I89 Q93 T96 V97 V122 L123 K124 T128 T129 I130I89-F126 HydrophobicContact CG1-CD1 4.42Å; Q93-F126 HydrophobicContact CB-CE1 3.85Å; Q93-F126 HydrophobicContact CB-CZ 3.62Å; Q93-F126 HydrophobicContact CG-CE1 4.37Å; Q93-F126 HydrophobicContact CG-CZ 3.94Å; T96-F126 HydrophobicContact CG2-CE2 3.99Å; V97-F126 HydrophobicContact CG2-CB 4.29Å; V97-F126 HydrophobicContact CG2-CD1 3.44Å; V97-F126 VanDerWaalsContact CG2-CD1 3.44Å; V97-F126 HydrophobicContact CG2-CD2 3.98Å; V97-F126 HydrophobicContact CG2-CE1 3.65Å; V97-F126 HydrophobicContact CG2-CE2 4.2Å; V97-F126 HydrophobicContact CG2-CG 3.62Å; V97-F126 HydrophobicContact CG2-CZ 4.06Å; V122-F126 VanDerWaalsContact O-CB 3.22Å; V122-F126 WeakPolarHBondContact O-CB 3.33Å; V122-F126 PolarHBondContact O-N 2.98Å; L123-F126 PolarHBondContact O-N 2.78Å; K124-F126 VanDerWaalsContact C-N 3.25Å; K124-F126 PolarHBondContact O-N 3.13Å; F126-T128 PolarHBondContact O-N 3.21Å; F126-T129 PolarHBondContact O-N 3.02Å; F126-I130 HydrophobicContact CD1-CD1 3.69Å; F126-I130 HydrophobicContact CE1-CD1 3.15Å; F126-I130 HydrophobicContact CE1-CG1 4.28Å; F126-I130 HydrophobicContact CE2-CD1 4.3Å; F126-I130 HydrophobicContact CG-CD1 4.46Å; F126-I130 HydrophobicContact CZ-CD1 3.48Å; F126-I130 VanDerWaalsContact CZ-CD1 3.48Å; F126-I130 HydrophobicContact CZ-CG1 4.27Å; F126-I130 PolarHBondContact O-N 3.19Å
127L92.7Very high89.1Confident17 Ų1761 Ų619%0.08929%0.288CS..Hα-helixtrans-64-41.7179.8-69.7172.9000112.3Y15 L85 Q88 I89 L123 K124 T129 I130 E131Y15-L127 HydrophobicContact CE1-CB 4.46Å; Y15-L127 HydrophobicContact CE1-CD1 4.18Å; L85-L127 HydrophobicContact CD2-CD1 3.88Å; Q88-L127 HydrophobicContact CB-CD1 4.13Å; Q88-L127 HydrophobicContact CB-CD2 3.79Å; I89-L127 HydrophobicContact CG1-CD2 4.27Å; L123-L127 VanDerWaalsContact O-CG 3.27Å; L123-L127 WeakPolarHBondContact O-CG 3.42Å; L123-L127 PolarHBondContact O-N 3.44Å; K124-L127 PolarHBondContact O-N 3.21Å; L127-T129 VanDerWaalsContact C-N 3.3Å; L127-T129 PolarHBondContact O-N 3.11Å; L127-I130 PolarHBondContact O-N 3.49Å; L127-E131 PolarHBondContact O-N 3.32Å
128T91.4Very high88.3Confident59 Ų5963.6 Ų63.636%0.36230%0.303SS..Hα-helixtrans-66.1-32.7176.553.90000112.4K124 D125 F126 R132K124-T128 WeakPolarHBondContact O-CB 3.38Å; K124-T128 VanDerWaalsContact O-CG2 3.26Å; K124-T128 WeakPolarHBondContact O-CG2 3.29Å; K124-T128 PolarHBondContact O-N 2.98Å; K124-T128 PolarHBondContact O-OG1 3.46Å; D125-T128 WeakPolarHBondContact CA-OG1 3.15Å; D125-T128 PolarHBondContact O-OG1 3.1Å; F126-T128 PolarHBondContact O-N 3.21Å; T128-R132 PolarHBondContact O-N 3.31Å
129T90.2Very high87.1Confident46 Ų4668.5 Ų68.528%0.28233%0.329SS..Hα-helixtrans-66.9-47174.5-61.30000111.2D125 F126 L127 E131 R132 E133D125-T129 WeakPolarHBondContact O-CB 3.49Å; D125-T129 PolarHBondContact O-N 3.24Å; D125-T129 PolarHBondContact O-OG1 3.31Å; F126-T129 PolarHBondContact O-N 3.02Å; L127-T129 VanDerWaalsContact C-N 3.3Å; L127-T129 PolarHBondContact O-N 3.11Å; T129-E131 VanDerWaalsContact C-N 3.34Å; T129-E131 PolarHBondContact O-N 3.19Å; T129-R132 PolarHBondContact O-N 3.39Å; T129-R132 PolarHBondContact OG1-NH2 2.94Å; T129-E133 WeakPolarHBondContact O-CG 3.43Å; T129-E133 PolarHBondContact O-N 3.33Å
130I88.6Confident85.9Confident42 Ų4272 Ų7222%0.21535%0.35CS..Hα-helixtrans-60.2-43.3175.9-71.4168.4000111.4F126 L127 R132 E133 N134F126-I130 HydrophobicContact CD1-CD1 3.69Å; F126-I130 HydrophobicContact CE1-CD1 3.15Å; F126-I130 HydrophobicContact CE1-CG1 4.28Å; F126-I130 HydrophobicContact CE2-CD1 4.3Å; F126-I130 HydrophobicContact CG-CD1 4.46Å; F126-I130 HydrophobicContact CZ-CD1 3.48Å; F126-I130 VanDerWaalsContact CZ-CD1 3.48Å; F126-I130 HydrophobicContact CZ-CG1 4.27Å; F126-I130 PolarHBondContact O-N 3.19Å; L127-I130 PolarHBondContact O-N 3.49Å; I130-R132 VanDerWaalsContact C-N 3.3Å; I130-R132 PolarHBondContact O-N 2.82Å; I130-E133 PolarHBondContact O-N 3.41Å; I130-N134 WeakPolarHBondContact CG2-ND2 3.47Å; I130-N134 WeakPolarHBondContact O-CB 3.33Å; I130-N134 VanDerWaalsContact O-CG 3.27Å; I130-N134 PolarHBondContact O-N 2.99Å; I130-N134 PolarHBondContact O-ND2 3Å
131E87.5Confident84.6Confident109 Ų10973.7 Ų73.751%0.50936%0.362SS..Hα-helixtrans-63.1-38.6-178.7-176.2155.9-162.500112.1L127 T129 Q135L127-E131 PolarHBondContact O-N 3.32Å; T129-E131 VanDerWaalsContact C-N 3.34Å; T129-E131 PolarHBondContact O-N 3.19Å; E131-Q135 WeakPolarHBondContact O-CG 3.44Å; E131-Q135 PolarHBondContact O-N 2.87Å; E131-Q135 VanDerWaalsContact O-N 3.11Å
132R85.7Confident83.3Confident152 Ų15276.5 Ų76.557%0.57438%0.377SS*.Hα-helixtrans-66.2-41.5174.2177176.651.2-163.7-10.9112.4T128 T129 I130 Q135 Q136T128-R132 PolarHBondContact O-N 3.31Å; T129-R132 PolarHBondContact O-N 3.39Å; T129-R132 PolarHBondContact OG1-NH2 2.94Å; I130-R132 VanDerWaalsContact C-N 3.3Å; I130-R132 PolarHBondContact O-N 2.82Å; R132-Q135 PolarHBondContact O-N 3.1Å; R132-Q136 PolarHBondContact O-N 3.01Å; R132-Q136 VanDerWaalsContact O-N 3.13Å
133E84.5Confident81.4Confident100 Ų10084.6 Ų84.647%0.46741%0.406SS..Hα-helixtrans-62.3-46.6176.3-72.1170.5173.300110.9T129 I130 Q135 Q136 E137T129-E133 WeakPolarHBondContact O-CG 3.43Å; T129-E133 PolarHBondContact O-N 3.33Å; I130-E133 PolarHBondContact O-N 3.41Å; E133-Q135 VanDerWaalsContact C-N 3.31Å; E133-Q135 PolarHBondContact O-N 3.1Å; E133-Q136 WeakPolarHBondContact O-CB 3.48Å; E133-Q136 PolarHBondContact O-N 3.42Å; E133-Q136 VanDerWaalsContact O-N 3.09Å; E133-E137 WeakPolarHBondContact O-CG 3.4Å; E133-E137 PolarHBondContact O-N 3.43Å
134N81.4Confident79.6Confident67 Ų6788.7 Ų88.736%0.35843%0.428SS..Hα-helixtrans-61.7-35.3177.3-70.6-29.6000113.4I130 Q138I130-N134 WeakPolarHBondContact CG2-ND2 3.47Å; I130-N134 WeakPolarHBondContact O-CB 3.33Å; I130-N134 VanDerWaalsContact O-CG 3.27Å; I130-N134 PolarHBondContact O-N 2.99Å; I130-N134 PolarHBondContact O-ND2 3Å; N134-Q138 WeakPolarHBondContact O-CB 3.2Å; N134-Q138 WeakPolarHBondContact O-CG 3.31Å; N134-Q138 PolarHBondContact O-N 3.15Å; N134-Q138 VanDerWaalsContact O-N 3.1Å; N134-Q138 PolarHBondContact O-NE2 2.79Å
135Q78.4Confident77.9Confident111 Ų11191.2 Ų91.252%0.51945%0.447SS..Hα-helixtrans-69-36.9175.4-7417717.900111.5E131 R132 E133 L139E131-Q135 WeakPolarHBondContact O-CG 3.44Å; E131-Q135 PolarHBondContact O-N 2.87Å; E131-Q135 VanDerWaalsContact O-N 3.11Å; R132-Q135 PolarHBondContact O-N 3.1Å; E133-Q135 VanDerWaalsContact C-N 3.31Å; E133-Q135 PolarHBondContact O-N 3.1Å; Q135-L139 WeakPolarHBondContact O-CG 3.41Å; Q135-L139 PolarHBondContact O-N 2.92Å
136Q73.6Confident75.9Confident128 Ų12893.7 Ų93.760%0.59846%0.461SS*.Hα-helixtrans-70.2-42.4177.3-171.8170.2400111.7R132 E133 L139 V140R132-Q136 PolarHBondContact O-N 3.01Å; R132-Q136 VanDerWaalsContact O-N 3.13Å; E133-Q136 WeakPolarHBondContact O-CB 3.48Å; E133-Q136 PolarHBondContact O-N 3.42Å; E133-Q136 VanDerWaalsContact O-N 3.09Å; Q136-L139 PolarHBondContact O-N 3.37Å; Q136-V140 WeakPolarHBondContact O-CG2 3.46Å; Q136-V140 PolarHBondContact O-N 3.16Å
137E73.5Confident73.6Confident118 Ų11896 Ų9655%0.55148%0.479SS*.Hα-helixtrans-60.3-45.8174.4-72.8-179.2173.400111.6E133 L139 V140 D141E133-E137 WeakPolarHBondContact O-CG 3.4Å; E133-E137 PolarHBondContact O-N 3.43Å; E137-L139 VanDerWaalsContact C-N 3.31Å; E137-L139 PolarHBondContact O-N 3.17Å; E137-V140 PolarHBondContact O-N 3.41Å; E137-V140 VanDerWaalsContact O-N 3.11Å; E137-D141 WeakPolarHBondContact O-CB 3.39Å; E137-D141 PolarHBondContact O-N 2.88Å
138Q73.7Confident71.4Confident119 Ų11999 Ų9956%0.55650%0.502SS*.Hα-helixtrans-58.6-40175.7-79.8171.981.200112.9N134 D141 I142N134-Q138 WeakPolarHBondContact O-CB 3.2Å; N134-Q138 WeakPolarHBondContact O-CG 3.31Å; N134-Q138 PolarHBondContact O-N 3.15Å; N134-Q138 VanDerWaalsContact O-N 3.1Å; N134-Q138 PolarHBondContact O-NE2 2.79Å; Q138-D141 PolarHBondContact O-N 3.28Å; Q138-I142 WeakPolarHBondContact O-CB 3.41Å; Q138-I142 VanDerWaalsContact O-CD1 3.29Å; Q138-I142 WeakPolarHBondContact O-CD1 3.3Å; Q138-I142 WeakPolarHBondContact O-CG1 3.37Å; Q138-I142 PolarHBondContact O-N 3.18Å
139L69.3Low69.1Low124 Ų124104.5 Ų104.565%0.64952%0.523SS*.Hα-helixtrans-67.1-38.2176.5-73.5172.1000112.3Q135 Q136 E137 W143Q135-L139 WeakPolarHBondContact O-CG 3.41Å; Q135-L139 PolarHBondContact O-N 2.92Å; Q136-L139 PolarHBondContact O-N 3.37Å; E137-L139 VanDerWaalsContact C-N 3.31Å; E137-L139 PolarHBondContact O-N 3.17Å; L139-W143 PolarHBondContact O-N 3.42Å; L139-W143 VanDerWaalsContact O-N 3.1Å
140V69.4Low67Low73 Ų73110.6 Ų110.644%0.44255%0.548SS..Hα-helixtrans-68.8-40.8176.6171.80000110.9Q136 E137 W143 N144Q136-V140 WeakPolarHBondContact O-CG2 3.46Å; Q136-V140 PolarHBondContact O-N 3.16Å; E137-V140 PolarHBondContact O-N 3.41Å; E137-V140 VanDerWaalsContact O-N 3.11Å; V140-W143 WeakPolarHBondContact O-CB 3.37Å; V140-W143 PolarHBondContact O-N 2.73Å; V140-N144 WeakPolarHBondContact CG1-ND2 3.44Å; V140-N144 WeakPolarHBondContact O-CB 3.45Å; V140-N144 PolarHBondContact O-N 3.45Å; V140-N144 PolarHBondContact O-ND2 3.16Å
141D67.7Low64.8Low94 Ų94117.5 Ų117.550%0.50358%0.577SS.*Hα-helixtrans-66.8-38.8177.7-73.4-20.2000112.2E137 Q138 W143 N144 T145E137-D141 WeakPolarHBondContact O-CB 3.39Å; E137-D141 PolarHBondContact O-N 2.88Å; Q138-D141 PolarHBondContact O-N 3.28Å; D141-W143 VanDerWaalsContact C-N 3.35Å; D141-N144 PolarHBondContact O-N 3.17Å; D141-T145 WeakPolarHBondContact O-CB 3.35Å; D141-T145 PolarHBondContact O-N 3.42Å; D141-T145 PolarHBondContact O-OG1 2.78Å
142I66.8Low62.5Low101 Ų101115.4 Ų115.452%0.51858%0.584SS.*Hα-helixtrans-62.7-43172.6-68.2161.6000110.4Q138 T145 N146Q138-I142 WeakPolarHBondContact O-CB 3.41Å; Q138-I142 VanDerWaalsContact O-CD1 3.29Å; Q138-I142 WeakPolarHBondContact O-CD1 3.3Å; Q138-I142 WeakPolarHBondContact O-CG1 3.37Å; Q138-I142 PolarHBondContact O-N 3.18Å; I142-T145 PolarHBondContact O-N 3.41Å; I142-N146 PolarHBondContact O-N 3.15Å; I142-N146 VanDerWaalsContact O-N 3.15Å; I142-N146 PolarHBondContact O-ND2 3.11Å
143W57.3Low60.7Low181 Ų181116.7 Ų116.769%0.68660%0.602SS**Hα-helixtrans-63.2-44.6176.3-176.1-94.5000112.1L139 V140 D141 T145 N146 C147L139-W143 PolarHBondContact O-N 3.42Å; L139-W143 VanDerWaalsContact O-N 3.1Å; V140-W143 WeakPolarHBondContact O-CB 3.37Å; V140-W143 PolarHBondContact O-N 2.73Å; D141-W143 VanDerWaalsContact C-N 3.35Å; W143-T145 VanDerWaalsContact C-N 3.34Å; W143-T145 PolarHBondContact O-N 2.95Å; W143-N146 PolarHBondContact O-N 2.91Å; W143-C147 PolarHBondContact O-N 3.46Å
144N56.5Low58.4Low87 Ų87122.7 Ų122.747%0.46562%0.62SS.*Hα-helixtrans-66.4-35.5179.1-67.9-24.7000112.5V140 D141 C147 S148V140-N144 WeakPolarHBondContact CG1-ND2 3.44Å; V140-N144 WeakPolarHBondContact O-CB 3.45Å; V140-N144 PolarHBondContact O-N 3.45Å; V140-N144 PolarHBondContact O-ND2 3.16Å; D141-N144 PolarHBondContact O-N 3.17Å; N144-C147 PolarHBondContact O-N 3.46Å; N144-S148 PolarHBondContact O-N 3.33Å
145T58.8Low56.7Low96 Ų96122.9 Ų122.959%0.58964%0.638SS**Hα-helixtrans-67.8-38176.8-53.20000111.3D141 I142 W143 C147 S148D141-T145 WeakPolarHBondContact O-CB 3.35Å; D141-T145 PolarHBondContact O-N 3.42Å; D141-T145 PolarHBondContact O-OG1 2.78Å; I142-T145 PolarHBondContact O-N 3.41Å; W143-T145 VanDerWaalsContact C-N 3.34Å; W143-T145 PolarHBondContact O-N 2.95Å; T145-C147 VanDerWaalsContact C-N 3.29Å; T145-C147 PolarHBondContact O-N 2.92Å; T145-S148 WeakPolarHBondContact O-CB 3.33Å; T145-S148 PolarHBondContact O-N 3.29Å; T145-S148 VanDerWaalsContact O-N 3.11Å
146N52.3Low54.6Low114 Ų114123.7 Ų123.761%0.6165%0.646SS**Hα-helixtrans-70.7-21.2175.2-72.3-57.5000113.5I142 W143 S148I142-N146 PolarHBondContact O-N 3.15Å; I142-N146 VanDerWaalsContact O-N 3.15Å; I142-N146 PolarHBondContact O-ND2 3.11Å; W143-N146 PolarHBondContact O-N 2.91Å; N146-S148 VanDerWaalsContact C-N 3.34Å
147C47.3Very low53.3Low77 Ų77122.6 Ų122.652%0.5265%0.652SS.*THydrogen-bonded Turntrans-85.1-5.4170.6-70.30000113.6W143 N144 T145W143-C147 PolarHBondContact O-N 3.46Å; N144-C147 PolarHBondContact O-N 3.46Å; T145-C147 VanDerWaalsContact C-N 3.29Å; T145-C147 PolarHBondContact O-N 2.92Å
148S46Very low51.7Low80 Ų80121.9 Ų121.956%0.55966%0.661SS**THydrogen-bonded Turntrans-95.513.7-177.5-154.10000113.9N144 T145 N146N144-S148 PolarHBondContact O-N 3.33Å; T145-S148 WeakPolarHBondContact O-CB 3.33Å; T145-S148 PolarHBondContact O-N 3.29Å; T145-S148 VanDerWaalsContact O-N 3.11Å; N146-S148 VanDerWaalsContact C-N 3.34Å
149E42.8Very low50.3Low175 Ų175123.8 Ų123.882%0.81868%0.675SS**THydrogen-bonded Turntrans-88.10171-72.6-166.4156.800113.6
150H47.2Very low48.9Very low175 Ų175127.5 Ų127.581%0.8169%0.686SS**  trans-112.925.2-177.8-117.1-50.8000116.1
151F41.8Very low47.7Very low187 Ų187129.2 Ų129.282%0.8270%0.701SS**  trans-111.555.1164.1-64.8-74.6000111.3
152G37.9Very low46.6Very low64 Ų64131.1 Ų131.166%0.6671%0.711SS**  trans-69.4137.6159.500000110.4R154G152-R154 PolarHBondContact O-N 2.88Å
153L48.7Very low45.9Very low179 Ų179134.2 Ų134.294%0.93772%0.721SS**  trans-15.6120.1175.4-82.674.9000115.7
154R37.1Very low46Very low226 Ų226132.6 Ų132.685%0.85373%0.725SS**  trans-136.297.5149-167.6168.5-179.9-132.1-3.9109G152 D156G152-R154 PolarHBondContact O-N 2.88Å; R154-D156 PolarHBondContact O-N 2.67Å
155G44.9Very low46.5Very low72 Ų72136.5 Ų136.574%0.74274%0.741SS**  trans-60.2131.6154.900000108.1
156D33.9Very low46.8Very low127 Ų127139.3 Ų139.368%0.67975%0.751SS**  trans-157.9129.6134-141.9-21.2000110.2R154 S158R154-D156 PolarHBondContact O-N 2.67Å; D156-S158 PolarHBondContact O-N 3.05Å
157S47Very low47.4Very low105 Ų105139 Ų13973%0.73476%0.755SS**  trans-49.5127.7165.539.20000111.5
158S39.6Very low48.6Very low103 Ų103139.2 Ų139.272%0.7275%0.754SS**  trans-142.887.4164.1-178.50000110.6D156 K160D156-S158 PolarHBondContact O-N 3.05Å; S158-K160 PolarHBondContact O-N 3.33Å
159N43.4Very low49.4Very low160 Ų160141.5 Ų141.586%0.85677%0.765SS**  trans21.496.5144.5-63.9-27.6000116.4
160K40Very low50.2Low201 Ų201137.2 Ų137.287%0.87475%0.754SS**  trans-99114.6156.6-59-171.3-177.4-175.70106.4S158 D162S158-K160 PolarHBondContact O-N 3.33Å; K160-D162 PolarHBondContact O-N 3.34Å
161S44.2Very low51Low109 Ų109130.6 Ų130.676%0.76273%0.727SS**  trans-64.8107.1172.860.30000108.1K163S161-K163 PolarHBondContact O-N 3.19Å; S161-K163 VanDerWaalsContact O-N 3.17Å
162D46.1Very low51.7Low134 Ų134130.2 Ų130.272%0.71772%0.721SS**  trans-56.9111.4172.2-140.60.2000108.7K160K160-D162 PolarHBondContact O-N 3.34Å
163K51.7Low52.7Low166 Ų166131.2 Ų131.272%0.72272%0.715SS**  trans-108.1106.7157.3-71-69.1179-1780103.7S161 E165S161-K163 PolarHBondContact O-N 3.19Å; S161-K163 VanDerWaalsContact O-N 3.17Å; K163-E165 PolarHBondContact O-N 3.18Å
164D58.7Low53Low147 Ų147127.4 Ų127.479%0.78670%0.695SS**  trans-59.881.7175.4-68.5-57.4000110
165E66.6Low54.1Low169 Ų169123.1 Ų123.179%0.7968%0.683SS**  trans-87.7126168.4-70.2-175.4-177.100108.3K163 P167K163-E165 PolarHBondContact O-N 3.18Å; E165-P167 WeakPolarHBondContact O-CD 3.14Å; E165-P167 VanDerWaalsContact O-N 3.11Å
166I66.3Low54.5Low155 Ų155124.3 Ų124.380%0.79567%0.672SS**  trans-56.6118.5177.6-59.2172.8000107.8T168I166-T168 PolarHBondContact O-N 3.11Å
167P63.5Low55.3Low108 Ų108121.2 Ų121.270%0.70166%0.658SS**  trans-65.2108.9-177.323.3-30.9000109.4E165E165-P167 WeakPolarHBondContact O-CD 3.14Å; E165-P167 VanDerWaalsContact O-N 3.11Å
168T73.6Confident55.6Low82 Ų82123.4 Ų123.450%0.50366%0.657SS.*  trans-78150.2173.850.30000110.1I166 S170 S171I166-T168 PolarHBondContact O-N 3.11Å; T168-S170 PolarHBondContact O-N 2.62Å; T168-S170 VanDerWaalsContact O-N 3.16Å; T168-S170 PolarHBondContact OG1-OG 3.17Å; T168-S171 WeakPolarHBondContact O-CB 3.35Å; T168-S171 PolarHBondContact O-N 3.49Å; T168-S171 PolarHBondContact O-OG 3.2Å
169V62.8Low56.2Low128 Ų128123.1 Ų123.178%0.77666%0.655SS**Hα-helixtrans-55.3-32177.3177.20000111.5S171 Y172 V173V169-S171 PolarHBondContact O-N 3.41Å; V169-Y172 PolarHBondContact O-N 2.76Å; V169-V173 PolarHBondContact O-N 3.44Å
170S59.5Low56.6Low85 Ų85121.2 Ų121.259%0.59464%0.642SS**Hα-helixtrans-64.5-37.5175.858.70000113.1T168 Y172 V173 D174T168-S170 PolarHBondContact O-N 2.62Å; T168-S170 VanDerWaalsContact O-N 3.16Å; T168-S170 PolarHBondContact OG1-OG 3.17Å; S170-Y172 VanDerWaalsContact C-N 3.28Å; S170-Y172 PolarHBondContact O-N 2.84Å; S170-V173 PolarHBondContact O-N 3.41Å; S170-D174 PolarHBondContact O-N 3.25Å
171S63.2Low56.7Low36 Ų36118.7 Ų118.725%0.25263%0.631SS.*Hα-helixtrans-63-36.8178.479.90000111.4T168 V169 V173 D174 K175T168-S171 WeakPolarHBondContact O-CB 3.35Å; T168-S171 PolarHBondContact O-N 3.49Å; T168-S171 PolarHBondContact O-OG 3.2Å; V169-S171 PolarHBondContact O-N 3.41Å; S171-V173 VanDerWaalsContact C-N 3.32Å; S171-V173 PolarHBondContact O-N 3.11Å; S171-D174 PolarHBondContact O-N 3.36Å; S171-K175 WeakPolarHBondContact O-CE 2.87Å; S171-K175 WeakPolarHBondContact O-CG 3.15Å; S171-K175 PolarHBondContact O-N 3.49Å
172Y57Low56.8Low178 Ų178119 Ų11970%0.69863%0.63SS**Hα-helixtrans-71.3-29.3-177.2-149.6-92000112.4V169 S170V169-Y172 PolarHBondContact O-N 2.76Å; S170-Y172 VanDerWaalsContact C-N 3.28Å; S170-Y172 PolarHBondContact O-N 2.84Å
173V59.4Low57Low86 Ų86119.3 Ų119.352%0.52164%0.637SS.*Hα-helixtrans-74.1-39.9176.3179.10000110.7V169 S170 S171 K175 N176 T177V169-V173 PolarHBondContact O-N 3.44Å; S170-V173 PolarHBondContact O-N 3.41Å; S171-V173 VanDerWaalsContact C-N 3.32Å; S171-V173 PolarHBondContact O-N 3.11Å; V173-K175 PolarHBondContact O-N 3.31Å; V173-N176 PolarHBondContact O-N 3.48Å; V173-T177 HydrophobicContact CG1-CG2 4.01Å; V173-T177 WeakPolarHBondContact O-CG2 2.9Å; V173-T177 PolarHBondContact O-N 2.95Å; V173-T177 VanDerWaalsContact O-N 3.11Å; V173-T177 PolarHBondContact O-OG1 3.49Å
174D55.3Low56.8Low99 Ų99120.6 Ų120.653%0.52964%0.643SS.*Hα-helixtrans-68.7-32.3-174.2-152.721.5000113.6S170 S171 N176 T177 Q178S170-D174 PolarHBondContact O-N 3.25Å; S171-D174 PolarHBondContact O-N 3.36Å; D174-N176 VanDerWaalsContact C-N 3.34Å; D174-T177 PolarHBondContact O-OG1 3.35Å; D174-Q178 WeakPolarHBondContact O-CG 3.46Å
175K59.2Low56.4Low135 Ų135119.2 Ų119.259%0.58765%0.645SS**Hα-helixtrans-75.1-24.6176.2-3.9-177.5177.9-177.40112.6S171 V173S171-K175 WeakPolarHBondContact O-CE 2.87Å; S171-K175 WeakPolarHBondContact O-CG 3.15Å; S171-K175 PolarHBondContact O-N 3.49Å; V173-K175 PolarHBondContact O-N 3.31Å
176N52.8Low55.6Low98 Ų98120.1 Ų120.152%0.52465%0.649SS.*Hα-helixtrans-97.4-17.4-174.3-16370000113.3V173 D174V173-N176 PolarHBondContact O-N 3.48Å; D174-N176 VanDerWaalsContact C-N 3.34Å
177T52.4Low54.9Low61 Ų61123 Ų12337%0.37465%0.65SS.*Hα-helixtrans-87.3-21.5177.252.20000113.3V173 D174 S179V173-T177 HydrophobicContact CG1-CG2 4.01Å; V173-T177 WeakPolarHBondContact O-CG2 2.9Å; V173-T177 PolarHBondContact O-N 2.95Å; V173-T177 VanDerWaalsContact O-N 3.11Å; V173-T177 PolarHBondContact O-OG1 3.49Å; D174-T177 PolarHBondContact O-OG1 3.35Å; T177-S179 VanDerWaalsContact C-N 3.31Å; T177-S179 PolarHBondContact O-N 2.98Å
178Q52.2Low54.4Low151 Ų151124.2 Ų124.271%0.70665%0.649SS**THydrogen-bonded Turntrans-72.1-19179.7-71.2-178.225.500114.1D174D174-Q178 WeakPolarHBondContact O-CG 3.46Å
179S52.5Low53.1Low97 Ų97131.4 Ų131.468%0.67867%0.667SS**THydrogen-bonded Turntrans-106.2-5.2-177.5630000115.1T177T177-S179 VanDerWaalsContact C-N 3.31Å; T177-S179 PolarHBondContact O-N 2.98Å
180M52.1Low52.6Low120 Ų120132.2 Ų132.259%0.59167%0.667SS**THydrogen-bonded Turntrans-123-4.6-167.8-103.5-175.568.400117
181F42.5Very low52.3Low149 Ų149135 Ų13565%0.65468%0.675SS**  trans-139.3128.8178.4-60.5-75.9000112.2
182P45.5Very low51.9Low114 Ų114138.9 Ų138.974%0.7470%0.699SS**  trans-65.1137.6167.628.1-31.2000109F184P182-F184 VanDerWaalsContact C-N 3.32Å; P182-F184 PolarHBondContact O-N 3.16Å
183T50.3Low51.5Low141 Ų141141 Ų14187%0.86571%0.707SS**SBendtrans-59.980.6-177.84.70000112.1
184F48Very low51.3Low193 Ų193147 Ų14785%0.84672%0.722SS**  trans-144.886.9166.8-87.2-78.6000110.8P182P182-F184 VanDerWaalsContact C-N 3.32Å; P182-F184 PolarHBondContact O-N 3.16Å
185S49.3Very low51.5Low118 Ų118152 Ų15283%0.82574%0.735SS**  trans-157.259161-820000111.8
186H50.1Low51.5Low189 Ų189150.7 Ų150.788%0.87574%0.74SS**  trans-113.368.9150.1-76.8-61.1000108.5
187R51.8Low51.5Low215 Ų215151.8 Ų151.881%0.81176%0.756SS**  trans-121.798.4155.5-91.8-169.2-161.7-159.87108.8W189R187-W189 PolarHBondContact O-N 3.47Å; R187-W189 VanDerWaalsContact O-N 3.14Å
188I52.4Low51.8Low133 Ų133158.3 Ų158.368%0.68280%0.804SS**  trans-61.3100.9165.1-60.1157.4000106.3N190I188-N190 VanDerWaalsContact C-N 3.26Å; I188-N190 WeakPolarHBondContact CG2-OD1 3.34Å; I188-N190 PolarHBondContact O-N 3.48Å
189W46.9Very low51.8Low234 Ų234158.7 Ų158.789%0.88681%0.809SS**  trans-72.488.5166.4-71.7101.4000107.8R187 L191R187-W189 PolarHBondContact O-N 3.47Å; R187-W189 VanDerWaalsContact O-N 3.14Å; W189-L191 VanDerWaalsContact C-N 3.35Å; W189-L191 PolarHBondContact O-N 3.48Å
190N52.3Low51.7Low144 Ų144161.9 Ų161.977%0.7782%0.815SS**  trans-69.695.7167.5-70.7-42.7000108.2I188I188-N190 VanDerWaalsContact C-N 3.26Å; I188-N190 WeakPolarHBondContact CG2-OD1 3.34Å; I188-N190 PolarHBondContact O-N 3.48Å
191L52.7Low51.7Low143 Ų143164.2 Ų164.275%0.74983%0.828SS**PPolyproline II helixtrans-78.1129164.5-150.578.4000107.6W189 Y193W189-L191 VanDerWaalsContact C-N 3.35Å; W189-L191 PolarHBondContact O-N 3.48Å; L191-Y193 PolarHBondContact O-N 3.47Å
192P54.5Low52.3Low119 Ų119165.1 Ų165.177%0.77384%0.838SS**PPolyproline II helixtrans-67.9118.7174.325.9-30.6000109.3Y194P192-Y194 PolarHBondContact O-N 3.03Å
193Y50.3Low52.7Low221 Ų221168.3 Ų168.387%0.86784%0.844SS**PPolyproline II helixtrans-65.1119.7174.5-79.8-90.4000110L191L191-Y193 PolarHBondContact O-N 3.47Å
194Y53.4Low52.8Low212 Ų212170.1 Ų170.183%0.83184%0.843SS**  trans-80.5114.4171.6-166-94000109.2P192P192-Y194 PolarHBondContact O-N 3.03Å
195Y59.8Low53.2Low206 Ų206168.5 Ų168.581%0.80884%0.843SS**PPolyproline II helixtrans-92.9120.8170.7-96.4-90.6000109.7
196P58.8Low53.5Low106 Ų106172.4 Ų172.469%0.68884%0.844SS**PPolyproline II helixtrans-75.8131.1165.930.1-29.8000109.5
197S53.1Low53.8Low121 Ų121171 Ų17185%0.84684%0.841SS**PPolyproline II helixtrans-73.3137.2171.1-63.70000109.9
198S59.3Low53.9Low198 Ų198167 Ų167100%1.38584%0.844SS**  trans-660173.6-61.30000112.9

Retrieved 198 of 198 residues in 52.6 ms (Link to these results)

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