A0A087XDC1_POEFO Loading...

Family with sequence similarity 174 member C

AlphaFold DB , UniProt , Accession A0A087XDC1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 141 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
1M54.3Low69Low222 Ų222111.3 Ų111.3100%1.09456%0.556SS**  0-8.30-67.8-167.217800114.4
2S60.8Low70Confident73 Ų73108.8 Ų108.851%0.5155%0.551SS.*Hα-helixtrans-74-37.4-173.748.50000114.9W4 R5 V6S2-W4 VanDerWaalsContact C-N 3.29Å; S2-W4 PolarHBondContact O-N 3.44Å; S2-R5 WeakPolarHBondContact O-CA 3.35Å; S2-R5 WeakPolarHBondContact O-CB 3.14Å; S2-R5 PolarHBondContact O-N 3.13Å; S2-V6 WeakPolarHBondContact O-CG2 3.2Å; S2-V6 PolarHBondContact O-N 3.22Å
3F61.8Low71Confident165 Ų165105.3 Ų105.372%0.72454%0.543SS*.Hα-helixtrans-60-34.7-175.4-72.5-79.8000114.4R5 F7F3-R5 VanDerWaalsContact C-N 3.34Å; F3-F7 VanDerWaalsContact O-CB 3.25Å; F3-F7 WeakPolarHBondContact O-CB 3.34Å; F3-F7 PolarHBondContact O-N 3.25Å
4W62.3Low71.5Confident160 Ų160101.8 Ų101.861%0.60653%0.529SS*.Hα-helixtrans-73.8-29.9176.8-137.444.7000112S2 S8 K102S2-W4 VanDerWaalsContact C-N 3.29Å; S2-W4 PolarHBondContact O-N 3.44Å; W4-S8 WeakPolarHBondContact O-CB 3.27Å; W4-S8 PolarHBondContact O-N 3.45Å; W4-K102 HydrophobicContact CZ2-CD 4.43Å
5R68.8Low71.7Confident196 Ų19699.3 Ų99.374%0.7452%0.523SS*.Hα-helixtrans-72.1-45.1172.7-67-156.8163.8-156-3.2111.6S2 F3 F7 S8 V9S2-R5 WeakPolarHBondContact O-CA 3.35Å; S2-R5 WeakPolarHBondContact O-CB 3.14Å; S2-R5 PolarHBondContact O-N 3.13Å; F3-R5 VanDerWaalsContact C-N 3.34Å; R5-F7 VanDerWaalsContact C-N 3.28Å; R5-F7 PolarHBondContact O-N 3.32Å; R5-S8 PolarHBondContact O-N 3.23Å; R5-V9 WeakPolarHBondContact O-CB 3.13Å; R5-V9 VanDerWaalsContact O-CG2 3.23Å; R5-V9 WeakPolarHBondContact O-CG2 3.43Å; R5-V9 PolarHBondContact O-N 2.85Å
6V72.3Confident72.4Confident88 Ų88104.6 Ų104.653%0.53353%0.533SS..Hα-helixtrans-60.7-41.9174.8179.30000110.3S2 V9 V10S2-V6 WeakPolarHBondContact O-CG2 3.2Å; S2-V6 PolarHBondContact O-N 3.22Å; V6-V9 PolarHBondContact O-N 2.78Å; V6-V10 HydrophobicContact CG1-CG2 4.41Å; V6-V10 VanDerWaalsContact O-CG2 3.27Å; V6-V10 WeakPolarHBondContact O-CG2 3.38Å; V6-V10 PolarHBondContact O-N 3.44Å
7F69.3Low72.9Confident23 Ų23104.4 Ų104.410%0.10153%0.533CS..Hα-helixtrans-64-44.4176.3-174.9-122.2000113.1F3 R5 V9 V10 I11 F94 L95F3-F7 VanDerWaalsContact O-CB 3.25Å; F3-F7 WeakPolarHBondContact O-CB 3.34Å; F3-F7 PolarHBondContact O-N 3.25Å; R5-F7 VanDerWaalsContact C-N 3.28Å; R5-F7 PolarHBondContact O-N 3.32Å; F7-V9 VanDerWaalsContact C-N 3.34Å; F7-V9 PolarHBondContact O-N 2.88Å; F7-V10 PolarHBondContact O-N 3.06Å; F7-I11 HydrophobicContact CD1-CD1 3.55Å; F7-I11 HydrophobicContact CD2-CD1 3.92Å; F7-I11 HydrophobicContact CD2-CG1 4.24Å; F7-I11 HydrophobicContact CE1-CD1 3.11Å; F7-I11 HydrophobicContact CE1-CG1 4.33Å; F7-I11 HydrophobicContact CE2-CD1 3.5Å; F7-I11 HydrophobicContact CE2-CG1 3.89Å; F7-I11 HydrophobicContact CG-CD1 3.97Å; F7-I11 HydrophobicContact CZ-CD1 3.12Å; F7-I11 HydrophobicContact CZ-CG1 3.99Å; F7-I11 WeakPolarHBondContact O-CB 3.46Å; F7-I11 WeakPolarHBondContact O-CG1 3.5Å; F7-I11 PolarHBondContact O-N 3.04Å; F7-F94 HydrophobicContact CB-CE1 4.42Å; F7-F94 AromaticContact CD2-CD1 3.41Å; F7-F94 HydrophobicContact CD2-CD1 3.41Å; F7-F94 VanDerWaalsContact CD2-CD1 3.41Å; F7-F94 AromaticContact CD2-CE1 3.24Å; F7-F94 HydrophobicContact CD2-CE1 3.24Å; F7-F94 HydrophobicContact CD2-CZ 4.44Å; F7-F94 AromaticContact CE2-CD1 3.24Å; F7-F94 HydrophobicContact CE2-CD1 3.24Å; F7-F94 AromaticContact CE2-CE1 3.64Å; F7-F94 HydrophobicContact CE2-CE1 3.64Å; F7-F94 HydrophobicContact CE2-CG 4.37Å; F7-F94 HydrophobicContact CG-CD1 4.47Å; F7-F94 HydrophobicContact CG-CE1 4.05Å; F7-F94 HydrophobicContact CZ-CD1 4.18Å; F7-L95 HydrophobicContact CE1-CD1 3.36Å; F7-L95 HydrophobicContact CZ-CB 4.15Å; F7-L95 HydrophobicContact CZ-CD1 3.26Å; F7-L95 HydrophobicContact CZ-CG 4.29Å
8S73.9Confident72.7Confident64 Ų64104.4 Ų104.445%0.44853%0.534SS..Hα-helixtrans-61.1-43.4174.7-166.90000111.2W4 R5 V10 I11 V12W4-S8 WeakPolarHBondContact O-CB 3.27Å; W4-S8 PolarHBondContact O-N 3.45Å; R5-S8 PolarHBondContact O-N 3.23Å; S8-V10 PolarHBondContact O-N 2.89Å; S8-I11 PolarHBondContact O-N 3.39Å; S8-V12 WeakPolarHBondContact O-CB 3.3Å; S8-V12 WeakPolarHBondContact O-CG2 3.48Å; S8-V12 PolarHBondContact O-N 3.16Å
9V79.9Confident72.7Confident100 Ų100103.9 Ų103.961%0.60654%0.536SS*.Hα-helixtrans-63.5-43.2177.7171.10000111.5R5 V6 F7 S13R5-V9 WeakPolarHBondContact O-CB 3.13Å; R5-V9 VanDerWaalsContact O-CG2 3.23Å; R5-V9 WeakPolarHBondContact O-CG2 3.43Å; R5-V9 PolarHBondContact O-N 2.85Å; V6-V9 PolarHBondContact O-N 2.78Å; F7-V9 VanDerWaalsContact C-N 3.34Å; F7-V9 PolarHBondContact O-N 2.88Å; V9-S13 WeakPolarHBondContact O-CB 3.22Å; V9-S13 PolarHBondContact O-N 2.98Å
10V79Confident72.7Confident80 Ų80104.4 Ų104.449%0.48554%0.539SS..Hα-helixtrans-68.3-42.6178.5173.80000111.4V6 F7 S8 T14V6-V10 HydrophobicContact CG1-CG2 4.41Å; V6-V10 VanDerWaalsContact O-CG2 3.27Å; V6-V10 WeakPolarHBondContact O-CG2 3.38Å; V6-V10 PolarHBondContact O-N 3.44Å; F7-V10 PolarHBondContact O-N 3.06Å; S8-V10 PolarHBondContact O-N 2.89Å; V10-T14 HydrophobicContact CG1-CG2 4.49Å; V10-T14 WeakPolarHBondContact O-CB 3.48Å; V10-T14 VanDerWaalsContact O-CG2 3.29Å; V10-T14 WeakPolarHBondContact O-CG2 3.36Å; V10-T14 PolarHBondContact O-N 3.31Å; V10-T14 PolarHBondContact O-OG1 2.95Å
11I77.1Confident72.4Confident53 Ų53103.3 Ų103.327%0.27254%0.541SS..Hα-helixtrans-64.6-48.4174.8-71.2164.5000110.9F7 S8 S13 T14 C15F7-I11 HydrophobicContact CD1-CD1 3.55Å; F7-I11 HydrophobicContact CD2-CD1 3.92Å; F7-I11 HydrophobicContact CD2-CG1 4.24Å; F7-I11 HydrophobicContact CE1-CD1 3.11Å; F7-I11 HydrophobicContact CE1-CG1 4.33Å; F7-I11 HydrophobicContact CE2-CD1 3.5Å; F7-I11 HydrophobicContact CE2-CG1 3.89Å; F7-I11 HydrophobicContact CG-CD1 3.97Å; F7-I11 HydrophobicContact CZ-CD1 3.12Å; F7-I11 HydrophobicContact CZ-CG1 3.99Å; F7-I11 WeakPolarHBondContact O-CB 3.46Å; F7-I11 WeakPolarHBondContact O-CG1 3.5Å; F7-I11 PolarHBondContact O-N 3.04Å; S8-I11 PolarHBondContact O-N 3.39Å; I11-S13 VanDerWaalsContact C-N 3.3Å; I11-S13 PolarHBondContact O-N 3.31Å; I11-T14 WeakPolarHBondContact CA-OG1 3.47Å; I11-T14 PolarHBondContact O-N 3.25Å; I11-T14 PolarHBondContact O-OG1 3.27Å; I11-C15 VanDerWaalsContact O-CB 3.24Å; I11-C15 WeakPolarHBondContact O-CB 3.24Å; I11-C15 PolarHBondContact O-N 3.22Å
12V80.4Confident72.4Confident81 Ų8199.7 Ų99.749%0.49152%0.519SS..Hα-helixtrans-63.2-41.1-178.8171.70000109.9S8 W16S8-V12 WeakPolarHBondContact O-CB 3.3Å; S8-V12 WeakPolarHBondContact O-CG2 3.48Å; S8-V12 PolarHBondContact O-N 3.16Å; V12-W16 WeakPolarHBondContact O-CB 3.29Å; V12-W16 PolarHBondContact O-N 3Å
13S83.1Confident72.1Confident64 Ų64102.2 Ų102.245%0.44853%0.527SS..Hα-helixtrans-62.7-46.8175-179.80000112.4V9 I11 W16 L17V9-S13 WeakPolarHBondContact O-CB 3.22Å; V9-S13 PolarHBondContact O-N 2.98Å; I11-S13 VanDerWaalsContact C-N 3.3Å; I11-S13 PolarHBondContact O-N 3.31Å; S13-W16 PolarHBondContact O-N 3.48Å; S13-L17 WeakPolarHBondContact O-CG 3.37Å; S13-L17 PolarHBondContact O-N 3.34Å
14T78.3Confident71.8Confident56 Ų56102.8 Ų102.834%0.34453%0.532SS..Hα-helixtrans-68.3-39.817850.70000112.5V10 I11 L17 L18V10-T14 HydrophobicContact CG1-CG2 4.49Å; V10-T14 WeakPolarHBondContact O-CB 3.48Å; V10-T14 VanDerWaalsContact O-CG2 3.29Å; V10-T14 WeakPolarHBondContact O-CG2 3.36Å; V10-T14 PolarHBondContact O-N 3.31Å; V10-T14 PolarHBondContact O-OG1 2.95Å; I11-T14 WeakPolarHBondContact CA-OG1 3.47Å; I11-T14 PolarHBondContact O-N 3.25Å; I11-T14 PolarHBondContact O-OG1 3.27Å; T14-L17 PolarHBondContact O-N 3.44Å; T14-L18 WeakPolarHBondContact O-CB 3.38Å; T14-L18 VanDerWaalsContact O-CG 3.27Å; T14-L18 WeakPolarHBondContact O-CG 3.48Å; T14-L18 PolarHBondContact O-N 3.38Å
15C73.6Confident71.2Confident65 Ų65101.1 Ų101.144%0.43954%0.539SS..Hα-helixtrans-63.6-41.3171-94.30000111.8I11 L17 L18 V19I11-C15 VanDerWaalsContact O-CB 3.24Å; I11-C15 WeakPolarHBondContact O-CB 3.24Å; I11-C15 PolarHBondContact O-N 3.22Å; C15-L17 VanDerWaalsContact C-N 3.35Å; C15-L18 PolarHBondContact O-N 2.98Å; C15-V19 WeakPolarHBondContact O-CB 3.25Å; C15-V19 VanDerWaalsContact O-CG2 3.25Å; C15-V19 WeakPolarHBondContact O-CG2 3.36Å; C15-V19 PolarHBondContact O-N 2.87Å
16W83.8Confident70.1Confident183 Ų18396.3 Ų96.369%0.69354%0.541SS*.Hα-helixtrans-62-44.6177.7-167.8-86.6000110.9V12 S13 L18 V19 L20V12-W16 WeakPolarHBondContact O-CB 3.29Å; V12-W16 PolarHBondContact O-N 3Å; S13-W16 PolarHBondContact O-N 3.48Å; W16-L18 VanDerWaalsContact C-N 3.34Å; W16-L18 PolarHBondContact O-N 2.84Å; W16-V19 PolarHBondContact O-N 2.75Å; W16-L20 VanDerWaalsContact O-CB 3.27Å; W16-L20 WeakPolarHBondContact O-CB 3.21Å; W16-L20 PolarHBondContact O-N 3.25Å
17L80.7Confident68.9Low102 Ų10297 Ų9753%0.53456%0.555SS.*Hα-helixtrans-62.9-39.1174-72.6169.1000112.3S13 T14 C15 S21S13-L17 WeakPolarHBondContact O-CG 3.37Å; S13-L17 PolarHBondContact O-N 3.34Å; T14-L17 PolarHBondContact O-N 3.44Å; C15-L17 VanDerWaalsContact C-N 3.35Å; L17-S21 WeakPolarHBondContact O-CB 3.25Å; L17-S21 PolarHBondContact O-N 2.96Å; L17-S21 PolarHBondContact O-OG 2.82Å
18L69.7Low67.6Low105 Ų10599.3 Ų99.355%0.5559%0.586SS.*Hα-helixtrans-71.5-35.6177.7-76.5167.8000113.4T14 C15 W16 S21 K22T14-L18 WeakPolarHBondContact O-CB 3.38Å; T14-L18 VanDerWaalsContact O-CG 3.27Å; T14-L18 WeakPolarHBondContact O-CG 3.48Å; T14-L18 PolarHBondContact O-N 3.38Å; C15-L18 PolarHBondContact O-N 2.98Å; W16-L18 VanDerWaalsContact C-N 3.34Å; W16-L18 PolarHBondContact O-N 2.84Å; L18-S21 PolarHBondContact O-N 3.25Å; L18-K22 PolarHBondContact O-N 3.33Å
19V72Confident66.5Low94 Ų94103.4 Ų103.457%0.5761%0.609SS**Hα-helixtrans-72-42.9175.9170.10000110.1C15 W16 S21 K22C15-V19 WeakPolarHBondContact O-CB 3.25Å; C15-V19 VanDerWaalsContact O-CG2 3.25Å; C15-V19 WeakPolarHBondContact O-CG2 3.36Å; C15-V19 PolarHBondContact O-N 2.87Å; W16-V19 PolarHBondContact O-N 2.75Å; V19-S21 PolarHBondContact O-N 2.94Å; V19-K22 WeakPolarHBondContact O-CB 3.39Å; V19-K22 PolarHBondContact O-N 3Å
20L73.7Confident64.5Low113 Ų113103 Ų10359%0.59262%0.616SS**Hα-helixtrans-64.6-26174.3-168.165000112.4W16 K22W16-L20 VanDerWaalsContact O-CB 3.27Å; W16-L20 WeakPolarHBondContact O-CB 3.21Å; W16-L20 PolarHBondContact O-N 3.25Å; L20-K22 VanDerWaalsContact C-N 3.34Å
21S66.7Low63.3Low82 Ų82104.9 Ų104.957%0.57363%0.63SS**THydrogen-bonded Turntrans-83.4-8173.4-57.10000113.5L17 L18 V19L17-S21 WeakPolarHBondContact O-CB 3.25Å; L17-S21 PolarHBondContact O-N 2.96Å; L17-S21 PolarHBondContact O-OG 2.82Å; L18-S21 PolarHBondContact O-N 3.25Å; V19-S21 PolarHBondContact O-N 2.94Å
22K54.1Low61.1Low147 Ų147108.7 Ų108.764%0.63966%0.655SS**SBendtrans-87.9-12.3-177.6-100.7-170.5166.9790114.2L18 V19 L20 E24 V25L18-K22 PolarHBondContact O-N 3.33Å; V19-K22 WeakPolarHBondContact O-CB 3.39Å; V19-K22 PolarHBondContact O-N 3Å; L20-K22 VanDerWaalsContact C-N 3.34Å; K22-E24 PolarHBondContact O-N 2.77Å; K22-E24 VanDerWaalsContact O-N 3.14Å; K22-V25 PolarHBondContact O-N 2.89Å
23D54.5Low59.1Low126 Ų126111.4 Ų111.467%0.67467%0.673SS**THydrogen-bonded Turntrans-68.6-8.3178.5-71.5-35.5000113.5
24E54.1Low57.3Low177 Ų177113.6 Ų113.683%0.82769%0.685SS**THydrogen-bonded Turntrans-108.29.2179.6-64.4-72.4144.700113.8K22K22-E24 PolarHBondContact O-N 2.77Å; K22-E24 VanDerWaalsContact O-N 3.14Å
25V50.2Low55.1Low125 Ų125115.8 Ų115.876%0.75871%0.709SS**  trans-127.227.5178.8-163.90000111.9K22K22-V25 PolarHBondContact O-N 2.89Å
26A46.5Very low53.4Low95 Ų95117.1 Ų117.179%0.78573%0.725SS**  trans-104.252171.100000111.4
27A47.2Very low51.1Low101 Ų101115.4 Ų115.484%0.83574%0.735SS**SBendtrans-143.2103.7161.300000109.6
28G42.1Very low49Very low73 Ų73113.9 Ų113.975%0.75374%0.743SS**SBendtrans123.542155.800000117.2
29T50.3Low47.9Very low149 Ų149114.4 Ų114.491%0.91475%0.753SS**  trans-150.998.5145.9-30.40000110.6
30A38.5Very low46.1Very low91 Ų91116.2 Ų116.275%0.75276%0.764SS**  trans-137.5135157.600000109.5
31P52.7Low44.4Very low121 Ų121116.8 Ų116.879%0.78677%0.773SS**  trans-87.3144.6-175.535.7-32.7000110.6
32T32Very low43.3Very low132 Ų132119.8 Ų119.881%0.8179%0.787SS**  trans-150.2101.4164.4-360000111.2
33T37.5Very low42.7Very low139 Ų139121.4 Ų121.485%0.85380%0.795SS**  trans-97.1131.6143.1-54.60000104.1
34P44.6Very low42.4Very low109 Ų109121.2 Ų121.271%0.70880%0.8SS**  -152.7174.778.137.8-16.4000116.8
35A33.2Very low41.8Very low103 Ų103116.6 Ų116.685%0.85179%0.792SS**  trans113.6126.5150.600000117.2
36A38.3Very low41.8Very low93 Ų93117.4 Ų117.477%0.76980%0.797SS**  trans-84.9160.8-165.900000114.2
37T34.8Very low41.6Very low147 Ų147117.9 Ų117.990%0.90280%0.795SS**  168.8126.1123.4-65.90000110.5
38G35.9Very low41.7Very low69 Ų69120.5 Ų120.571%0.71180%0.795SS**  trans106.7126.5148.900000118.4
39P46.5Very low42.1Very low117 Ų117121.4 Ų121.476%0.7679%0.79SS**  trans-98179.5-167.439.2-33.8000114
40T35.6Very low42Very low131 Ų131119.3 Ų119.380%0.80478%0.781SS**  trans95.9105165.166.90000117.9
41T37.8Very low42.6Very low126 Ų126126.1 Ų126.177%0.77379%0.787SS**  147.299.8118.5-65.90000109.4K43T41-K43 PolarHBondContact O-N 3.44Å
42V42.5Very low42.3Very low144 Ų144125 Ų12587%0.87379%0.788SS**  trans-73.5117.3171-1660000107.4
43K41.8Very low43.2Very low182 Ų182124.6 Ų124.679%0.79178%0.781SS**  trans-136.7104.9165.1-157.6175.3-172.9177.30108.3T41 A45T41-K43 PolarHBondContact O-N 3.44Å; K43-A45 PolarHBondContact O-N 3.37Å; K43-A45 VanDerWaalsContact O-N 3.17Å
44P49Very low43.7Very low121 Ų121122.9 Ų122.979%0.78677%0.774SS**  trans-82.494170.931.9-26000106.9
45A40.6Very low44Very low81 Ų81122.9 Ų122.967%0.66977%0.773SS**  trans-97.896.8167.400000107.9K43 S47K43-A45 PolarHBondContact O-N 3.37Å; K43-A45 VanDerWaalsContact O-N 3.17Å; A45-S47 PolarHBondContact O-N 3.49Å; A45-S47 VanDerWaalsContact O-N 3.13Å
46V50.3Low44.7Very low142 Ų142125.9 Ų125.986%0.86177%0.774SS**  trans-52.9113.7161.3169.50000107.5
47S41.9Very low45.2Very low105 Ų105127.2 Ų127.273%0.73478%0.777SS**  trans-12297.3166-153.30000107.9A45 S49A45-S47 PolarHBondContact O-N 3.49Å; A45-S47 VanDerWaalsContact O-N 3.13Å; S47-S49 PolarHBondContact O-N 3.41Å
48N50.2Low45.5Very low156 Ų156123.5 Ų123.583%0.83477%0.768SS**  trans-71.4113.8165.9-169.611.2000107.5
49S49.7Very low46.2Very low92 Ų92126.5 Ų126.564%0.64378%0.778SS**  trans-155.5102.7162.8620000111.5S47S47-S49 PolarHBondContact O-N 3.41Å
50S48.8Very low45.9Very low104 Ų104124 Ų12473%0.72777%0.774SS**  trans40.7106130.759.50000119.3
51R51.5Low46.8Very low235 Ų235123.6 Ų123.689%0.88778%0.776SS**  49.3105.3124.5-161.9177.9-172.5172.61.4117
52A46.2Very low47.3Very low98 Ų98123.8 Ų123.881%0.8178%0.777SS**  trans-13189.2145.700000109.2S54A52-S54 PolarHBondContact O-N 2.94Å
53N50.8Low48Very low123 Ų123127.1 Ų127.166%0.65878%0.78SS**  trans-73.9101158.2171.175.8000106.8
54S47.7Very low48.3Very low102 Ų102127 Ų12771%0.71378%0.78SS**  trans-101.986.2170.953.20000109.3A52 L56A52-S54 PolarHBondContact O-N 2.94Å; S54-L56 PolarHBondContact O-N 3.32Å
55T51Low48.6Very low110 Ų110128.9 Ų128.968%0.67579%0.788SS**  trans-70.195.7155.143.60000107.5
56L47.5Very low48.9Very low166 Ų166127.1 Ų127.187%0.86978%0.778SS**  trans-100.986.1169-152.577.5000108.7S54 G58S54-L56 PolarHBondContact O-N 3.32Å; L56-G58 PolarHBondContact O-N 3.14Å
57S49.1Very low48.9Very low121 Ų121129 Ų12985%0.84678%0.775SS**  trans-69.7103.9161.551.10000108.3
58G41.6Very low49.4Very low68 Ų68131.8 Ų131.870%0.70178%0.782SS**  trans-131.793.1178.400000110.3L56 G60L56-G58 PolarHBondContact O-N 3.14Å; G58-G60 PolarHBondContact O-N 3.23Å
59S50.4Low49.7Very low132 Ų132129.1 Ų129.192%0.92377%0.767SS**  trans-52.2119.7169.6-179.20000111.1
60G40.6Very low49.9Very low66 Ų66128.7 Ų128.768%0.6878%0.777SS**  trans-143.4100.4170.300000108.2G58 T62G58-G60 PolarHBondContact O-N 3.23Å; G60-T62 PolarHBondContact O-N 3.47Å; G60-T62 VanDerWaalsContact O-N 3.15Å
61S54.6Low50.4Low121 Ų121125.9 Ų125.985%0.84676%0.76SS**  trans-62.2113.2-177.965.60000110.6
62T47.7Very low51.5Low130 Ų130120 Ų12080%0.79875%0.746SS**  trans-136.7124158.1-45.40000107.8G60 K64G60-T62 PolarHBondContact O-N 3.47Å; G60-T62 VanDerWaalsContact O-N 3.15Å; T62-K64 PolarHBondContact O-N 2.78Å
63K57.4Low52.8Low214 Ų214120 Ų12093%0.9374%0.74SS**  trans-51.7105.3-170.9-56.5177-173.9-173.20110.1
64K47.5Very low53.9Low181 Ų181117.2 Ų117.279%0.78773%0.73SS**  trans-115108.5169.4-151.2172.8-164.7-70.40107.6T62 G66T62-K64 PolarHBondContact O-N 2.78Å; K64-G66 PolarHBondContact O-N 3.41Å
65V55.7Low55.6Low159 Ų159118.1 Ų118.196%0.96473%0.725SS**  trans-60.889.6159.4179.90000105.1
66G47.1Very low57.1Low44 Ų44116.1 Ų116.145%0.45471%0.709SS.*  trans-151.6105-16600000108.1K64 N68K64-G66 PolarHBondContact O-N 3.41Å; G66-N68 PolarHBondContact O-N 2.76Å; G66-N68 VanDerWaalsContact O-N 3.08Å
67F49.7Very low58.6Low183 Ų183113.5 Ų113.580%0.80369%0.693SS**  trans-25.4112.6166.2-105.6-98.7000110.9L69F67-L69 HydrophobicContact CB-CD1 3.82Å; F67-L69 HydrophobicContact CB-CG 4Å; F67-L69 HydrophobicContact CD1-CD1 3.6Å; F67-L69 HydrophobicContact CD1-CD2 4.11Å; F67-L69 HydrophobicContact CD1-CG 3.69Å; F67-L69 HydrophobicContact CE1-CD1 4.47Å; F67-L69 HydrophobicContact CG-CD1 4.03Å; F67-L69 HydrophobicContact CG-CG 4.31Å; F67-L69 PolarHBondContact O-N 3.21Å
68N52.5Low60.4Low163 Ų163116.8 Ų116.887%0.87269%0.687SS**  trans-72.768.8170.6-153.8-64.1000107.5G66G66-N68 PolarHBondContact O-N 2.76Å; G66-N68 VanDerWaalsContact O-N 3.08Å
69L56.4Low62.6Low100 Ų100116.2 Ų116.252%0.52468%0.675SS.*  trans-92.994.5170.8-70.6161.3000105F67 A71F67-L69 HydrophobicContact CB-CD1 3.82Å; F67-L69 HydrophobicContact CB-CG 4Å; F67-L69 HydrophobicContact CD1-CD1 3.6Å; F67-L69 HydrophobicContact CD1-CD2 4.11Å; F67-L69 HydrophobicContact CD1-CG 3.69Å; F67-L69 HydrophobicContact CE1-CD1 4.47Å; F67-L69 HydrophobicContact CG-CD1 4.03Å; F67-L69 HydrophobicContact CG-CG 4.31Å; F67-L69 PolarHBondContact O-N 3.21Å; L69-A71 HydrophobicContact CB-CB 4.09Å; L69-A71 PolarHBondContact O-N 3.31Å
70G54.6Low64.2Low82 Ų82114 Ų11485%0.84565%0.653SS**  trans-63.944.4158.800000111.5
71A58.8Low66.5Low46 Ų46118.7 Ų118.738%0.3865%0.651SS.*  trans-91.8128.2175.600000106.9L69 S73L69-A71 HydrophobicContact CB-CB 4.09Å; L69-A71 PolarHBondContact O-N 3.31Å; A71-S73 PolarHBondContact O-N 2.76Å
72D74.8Confident68.2Low110 Ų110117.3 Ų117.359%0.58864%0.637SS**  trans-48126.5178.4-56.1-53.8000109.6S74 M75 I76D72-S74 PolarHBondContact O-N 3.31Å; D72-M75 PolarHBondContact O-N 2.91Å; D72-I76 PolarHBondContact O-N 3.42Å
73S72.6Confident70.1Confident98 Ų98116.1 Ų116.169%0.68563%0.625SS**Hα-helixtrans-51.9-24.7-177.155.60000113.1A71 I76 Q77A71-S73 PolarHBondContact O-N 2.76Å; S73-I76 WeakPolarHBondContact O-CG2 3.4Å; S73-Q77 WeakPolarHBondContact O-CB 3.12Å; S73-Q77 PolarHBondContact O-N 2.85Å
74S75.8Confident71.5Confident65 Ų65110.3 Ų110.346%0.45560%0.603SS.*Hα-helixtrans-70.2-36.4174.81080000113.6D72 R78D72-S74 PolarHBondContact O-N 3.31Å; S74-R78 WeakPolarHBondContact O-CG 3.23Å; S74-R78 PolarHBondContact O-N 3.49Å
75M82Confident73.6Confident122 Ų122102.9 Ų102.960%0.60158%0.578SS**Hα-helixtrans-75-42.7179.8-71.8-176.668.200111D72 Q77 R78 A79D72-M75 PolarHBondContact O-N 2.91Å; M75-Q77 VanDerWaalsContact C-N 3.31Å; M75-Q77 PolarHBondContact O-N 2.79Å; M75-R78 PolarHBondContact O-N 2.91Å; M75-A79 PolarHBondContact O-N 2.88Å
76I82.1Confident75.2Confident68 Ų68100.5 Ų100.535%0.34956%0.559SS.*Hα-helixtrans-64.7-37.6178.9-159.975.1000111D72 S73 R78 A79 L80D72-I76 PolarHBondContact O-N 3.42Å; S73-I76 WeakPolarHBondContact O-CG2 3.4Å; I76-R78 PolarHBondContact O-N 3.33Å; I76-A79 PolarHBondContact O-N 3.27Å; I76-L80 HydrophobicContact CG1-CD1 4.1Å; I76-L80 HydrophobicContact CG1-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CB 3.47Å; I76-L80 WeakPolarHBondContact O-CG 3.24Å; I76-L80 PolarHBondContact O-N 3.17Å
77Q80.9Confident77Confident111 Ų111102.1 Ų102.152%0.51956%0.56SS.*Hα-helixtrans-63.2-44.9178-172.6176.4-2.200111.8S73 M75 A79 L80 Y81S73-Q77 WeakPolarHBondContact O-CB 3.12Å; S73-Q77 PolarHBondContact O-N 2.85Å; M75-Q77 VanDerWaalsContact C-N 3.31Å; M75-Q77 PolarHBondContact O-N 2.79Å; Q77-A79 PolarHBondContact O-N 2.9Å; Q77-L80 PolarHBondContact O-N 3.48Å; Q77-Y81 HydrophobicContact CG-CD2 3.98Å; Q77-Y81 HydrophobicContact CG-CE2 3.8Å; Q77-Y81 VanDerWaalsContact O-CD2 3.25Å; Q77-Y81 WeakPolarHBondContact O-CD2 3.42Å; Q77-Y81 PolarHBondContact O-N 2.88Å
78R86.6Confident78.8Confident190 Ų19098.2 Ų98.272%0.71755%0.547SS*.Hα-helixtrans-61.6-43.8176-68.5175.7-175.7-143.91.6111.4S74 M75 I76 Y81 V82S74-R78 WeakPolarHBondContact O-CG 3.23Å; S74-R78 PolarHBondContact O-N 3.49Å; M75-R78 PolarHBondContact O-N 2.91Å; I76-R78 PolarHBondContact O-N 3.33Å; R78-Y81 PolarHBondContact O-N 2.87Å; R78-V82 WeakPolarHBondContact O-CG2 3.1Å; R78-V82 PolarHBondContact O-N 3.4Å
79A86.5Confident80.6Confident56 Ų5695.8 Ų95.846%0.46353%0.532SS..Hα-helixtrans-64-41.4177.900000112.4M75 I76 Q77 V82 L83M75-A79 PolarHBondContact O-N 2.88Å; I76-A79 PolarHBondContact O-N 3.27Å; Q77-A79 PolarHBondContact O-N 2.9Å; A79-V82 PolarHBondContact O-N 3.41Å; A79-L83 WeakPolarHBondContact O-CB 3.04Å; A79-L83 PolarHBondContact O-N 3.41Å
80L85.3Confident82.1Confident86 Ų8692.7 Ų92.745%0.4553%0.525SS..Hα-helixtrans-66.3-41.7178.6-71171.9000112.1I76 Q77 V82 L83 I84I76-L80 HydrophobicContact CG1-CD1 4.1Å; I76-L80 HydrophobicContact CG1-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CB 3.47Å; I76-L80 WeakPolarHBondContact O-CG 3.24Å; I76-L80 PolarHBondContact O-N 3.17Å; Q77-L80 PolarHBondContact O-N 3.48Å; L80-V82 VanDerWaalsContact C-N 3.3Å; L80-V82 PolarHBondContact O-N 3.25Å; L80-L83 PolarHBondContact O-N 2.82Å; L80-I84 WeakPolarHBondContact O-CB 3.27Å; L80-I84 WeakPolarHBondContact O-CD1 3.34Å; L80-I84 WeakPolarHBondContact O-CG1 3.24Å; L80-I84 PolarHBondContact O-N 3.38Å
81Y87.1Confident83.5Confident164 Ų16492.2 Ų92.264%0.64351%0.505SS*.Hα-helixtrans-59.7-41.6174.7-89.3-68.8000112.3Q77 R78 G85Q77-Y81 HydrophobicContact CG-CD2 3.98Å; Q77-Y81 HydrophobicContact CG-CE2 3.8Å; Q77-Y81 VanDerWaalsContact O-CD2 3.25Å; Q77-Y81 WeakPolarHBondContact O-CD2 3.42Å; Q77-Y81 PolarHBondContact O-N 2.88Å; R78-Y81 PolarHBondContact O-N 2.87Å; Y81-G85 PolarHBondContact O-N 3.46Å
82V91.9Very high84.8Confident91 Ų9194.6 Ų94.655%0.55251%0.511SS*.Hα-helixtrans-67.3-44.3177.6174.80000111R78 A79 L80 I84 G85 I86R78-V82 WeakPolarHBondContact O-CG2 3.1Å; R78-V82 PolarHBondContact O-N 3.4Å; A79-V82 PolarHBondContact O-N 3.41Å; L80-V82 VanDerWaalsContact C-N 3.3Å; L80-V82 PolarHBondContact O-N 3.25Å; V82-I84 PolarHBondContact O-N 2.79Å; V82-G85 PolarHBondContact O-N 3.11Å; V82-I86 HydrophobicContact CG1-CD1 3.7Å; V82-I86 HydrophobicContact CG1-CG1 4.36Å; V82-I86 VanDerWaalsContact O-CG1 3.3Å; V82-I86 WeakPolarHBondContact O-CG1 3.27Å; V82-I86 PolarHBondContact O-N 3.04Å
83L87.4Confident85.2Confident105 Ų10596.8 Ų96.855%0.5551%0.512SS..Hα-helixtrans-60.9-45.6177.8-172.274.8000111.7A79 L80 G85 I86 T87A79-L83 WeakPolarHBondContact O-CB 3.04Å; A79-L83 PolarHBondContact O-N 3.41Å; L80-L83 PolarHBondContact O-N 2.82Å; L83-G85 VanDerWaalsContact C-N 3.32Å; L83-G85 PolarHBondContact O-N 2.71Å; L83-I86 PolarHBondContact O-N 3.46Å; L83-T87 WeakPolarHBondContact O-CG2 3.33Å; L83-T87 PolarHBondContact O-N 2.99Å; L83-T87 PolarHBondContact O-OG1 3.13Å; L83-T87 VanDerWaalsContact O-OG1 3.11Å
84I86.8Confident85.4Confident92 Ų9297.1 Ų97.147%0.47250%0.502SS..Hα-helixtrans-62.5-42.1175.8-65.5163.4000110L80 V82 T87 I88L80-I84 WeakPolarHBondContact O-CB 3.27Å; L80-I84 WeakPolarHBondContact O-CD1 3.34Å; L80-I84 WeakPolarHBondContact O-CG1 3.24Å; L80-I84 PolarHBondContact O-N 3.38Å; V82-I84 PolarHBondContact O-N 2.79Å; I84-T87 WeakPolarHBondContact CA-OG1 3.24Å; I84-T87 PolarHBondContact O-N 2.93Å; I84-T87 PolarHBondContact O-OG1 3.23Å; I84-I88 HydrophobicContact CG2-CD1 3.74Å; I84-I88 HydrophobicContact CG2-CG1 4.4Å; I84-I88 VanDerWaalsContact O-CG1 3.24Å; I84-I88 WeakPolarHBondContact O-CG1 3.27Å; I84-I88 PolarHBondContact O-N 2.96Å
85G90.4Very high85.6Confident25 Ų2597.5 Ų97.526%0.25850%0.498SS..Hα-helixtrans-57.7-50.8173.800000112.6Y81 V82 L83 T87 I88 I89Y81-G85 PolarHBondContact O-N 3.46Å; V82-G85 PolarHBondContact O-N 3.11Å; L83-G85 VanDerWaalsContact C-N 3.32Å; L83-G85 PolarHBondContact O-N 2.71Å; G85-T87 VanDerWaalsContact C-N 3.34Å; G85-T87 PolarHBondContact O-N 3.47Å; G85-I88 PolarHBondContact O-N 2.95Å; G85-I89 WeakPolarHBondContact O-CD1 3.29Å; G85-I89 PolarHBondContact O-N 3.35Å
86I89.5Confident85.4Confident109 Ų10996.2 Ų96.256%0.55949%0.493SS*.Hα-helixtrans-63.2-39.9-179-65.5164.8000111.2V82 L83 I89 G90V82-I86 HydrophobicContact CG1-CD1 3.7Å; V82-I86 HydrophobicContact CG1-CG1 4.36Å; V82-I86 VanDerWaalsContact O-CG1 3.3Å; V82-I86 WeakPolarHBondContact O-CG1 3.27Å; V82-I86 PolarHBondContact O-N 3.04Å; L83-I86 PolarHBondContact O-N 3.46Å; I86-I89 PolarHBondContact O-N 2.94Å; I86-G90 PolarHBondContact O-N 2.87Å
87T86.4Confident85Confident78 Ų78100.1 Ų100.148%0.47950%0.503SS..Hα-helixtrans-64.4-43.517653.70000111.9L83 I84 G85 G90 V91L83-T87 WeakPolarHBondContact O-CG2 3.33Å; L83-T87 PolarHBondContact O-N 2.99Å; L83-T87 PolarHBondContact O-OG1 3.13Å; L83-T87 VanDerWaalsContact O-OG1 3.11Å; I84-T87 WeakPolarHBondContact CA-OG1 3.24Å; I84-T87 PolarHBondContact O-N 2.93Å; I84-T87 PolarHBondContact O-OG1 3.23Å; G85-T87 VanDerWaalsContact C-N 3.34Å; G85-T87 PolarHBondContact O-N 3.47Å; T87-G90 PolarHBondContact O-N 3.32Å; T87-V91 WeakPolarHBondContact O-CB 3.39Å; T87-V91 VanDerWaalsContact O-CG2 3.24Å; T87-V91 WeakPolarHBondContact O-CG2 3.33Å; T87-V91 PolarHBondContact O-N 2.94Å
88I87.1Confident84.2Confident101 Ų10195.7 Ų95.752%0.51849%0.486SS..Hα-helixtrans-62.9-47.2175.4-66.5167000110.9I84 G85 G90 V91 L92I84-I88 HydrophobicContact CG2-CD1 3.74Å; I84-I88 HydrophobicContact CG2-CG1 4.4Å; I84-I88 VanDerWaalsContact O-CG1 3.24Å; I84-I88 WeakPolarHBondContact O-CG1 3.27Å; I84-I88 PolarHBondContact O-N 2.96Å; G85-I88 PolarHBondContact O-N 2.95Å; I88-G90 VanDerWaalsContact C-N 3.35Å; I88-G90 PolarHBondContact O-N 3.2Å; I88-V91 PolarHBondContact O-N 3.4Å; I88-L92 VanDerWaalsContact O-CB 3.3Å; I88-L92 WeakPolarHBondContact O-CB 3.36Å; I88-L92 PolarHBondContact O-N 3.48Å
89I89.9Confident83.2Confident112 Ų11291.2 Ų91.257%0.57448%0.479SS*.Hα-helixtrans-60.3-45177.2-88.583.5000110.7G85 I86 L92 Y93G85-I89 WeakPolarHBondContact O-CD1 3.29Å; G85-I89 PolarHBondContact O-N 3.35Å; I86-I89 PolarHBondContact O-N 2.94Å; I89-L92 PolarHBondContact O-N 3.02Å; I89-Y93 WeakPolarHBondContact O-CB 3.25Å; I89-Y93 PolarHBondContact O-N 3.3Å
90G87Confident82.1Confident36 Ų3697.3 Ų97.337%0.37149%0.49SS..Hα-helixtrans-61.8-45.5179.300000112I86 T87 I88 F94I86-G90 PolarHBondContact O-N 2.87Å; T87-G90 PolarHBondContact O-N 3.32Å; I88-G90 VanDerWaalsContact C-N 3.35Å; I88-G90 PolarHBondContact O-N 3.2Å; G90-F94 WeakPolarHBondContact O-CB 3.44Å; G90-F94 PolarHBondContact O-N 3.47Å
91V84.4Confident80.6Confident71 Ų7198.6 Ų98.643%0.4350%0.497SS..Hα-helixtrans-63.2-45.4175.6172.70000110.9T87 I88 F94 L95T87-V91 WeakPolarHBondContact O-CB 3.39Å; T87-V91 VanDerWaalsContact O-CG2 3.24Å; T87-V91 WeakPolarHBondContact O-CG2 3.33Å; T87-V91 PolarHBondContact O-N 2.94Å; I88-V91 PolarHBondContact O-N 3.4Å; V91-F94 PolarHBondContact O-N 2.93Å; V91-L95 VanDerWaalsContact O-CB 3.24Å; V91-L95 WeakPolarHBondContact O-CB 3.22Å; V91-L95 PolarHBondContact O-N 3.48Å
92L85.8Confident79Confident97 Ų9796.6 Ų96.651%0.50849%0.492SS..Hα-helixtrans-63.7-47.9179.7-178.363.6000112.1I88 I89 F94 L95 I96I88-L92 VanDerWaalsContact O-CB 3.3Å; I88-L92 WeakPolarHBondContact O-CB 3.36Å; I88-L92 PolarHBondContact O-N 3.48Å; I89-L92 PolarHBondContact O-N 3.02Å; L92-F94 VanDerWaalsContact C-N 3.31Å; L92-F94 PolarHBondContact O-N 2.92Å; L92-L95 WeakPolarHBondContact O-CB 3.3Å; L92-L95 PolarHBondContact O-N 2.9Å; L92-I96 HydrophobicContact CD1-CD1 4.39Å; L92-I96 HydrophobicContact CG-CD1 4.15Å; L92-I96 WeakPolarHBondContact O-CD1 3.39Å; L92-I96 VanDerWaalsContact O-CG1 3.29Å; L92-I96 WeakPolarHBondContact O-CG1 3.45Å; L92-I96 PolarHBondContact O-N 3.38Å
93Y84.9Confident77.2Confident155 Ų15599.7 Ų99.761%0.60850%0.497SS*.Hα-helixtrans-59.3-44.4176.4171.9-105.6000111.2I89 I96 R97I89-Y93 WeakPolarHBondContact O-CB 3.25Å; I89-Y93 PolarHBondContact O-N 3.3Å; Y93-I96 PolarHBondContact O-N 3.35Å; Y93-R97 WeakPolarHBondContact O-CB 3.34Å; Y93-R97 PolarHBondContact O-N 3.43Å
94F76.9Confident75.7Confident105 Ų105100.1 Ų100.146%0.46151%0.507SS..Hα-helixtrans-66.4-38.8178.4-166.8-81.4000111.7F7 G90 V91 L92 I96 R97 A98F7-F94 HydrophobicContact CB-CE1 4.42Å; F7-F94 AromaticContact CD2-CD1 3.41Å; F7-F94 HydrophobicContact CD2-CD1 3.41Å; F7-F94 VanDerWaalsContact CD2-CD1 3.41Å; F7-F94 AromaticContact CD2-CE1 3.24Å; F7-F94 HydrophobicContact CD2-CE1 3.24Å; F7-F94 HydrophobicContact CD2-CZ 4.44Å; F7-F94 AromaticContact CE2-CD1 3.24Å; F7-F94 HydrophobicContact CE2-CD1 3.24Å; F7-F94 AromaticContact CE2-CE1 3.64Å; F7-F94 HydrophobicContact CE2-CE1 3.64Å; F7-F94 HydrophobicContact CE2-CG 4.37Å; F7-F94 HydrophobicContact CG-CD1 4.47Å; F7-F94 HydrophobicContact CG-CE1 4.05Å; F7-F94 HydrophobicContact CZ-CD1 4.18Å; G90-F94 WeakPolarHBondContact O-CB 3.44Å; G90-F94 PolarHBondContact O-N 3.47Å; V91-F94 PolarHBondContact O-N 2.93Å; L92-F94 VanDerWaalsContact C-N 3.31Å; L92-F94 PolarHBondContact O-N 2.92Å; F94-I96 VanDerWaalsContact C-N 3.35Å; F94-I96 PolarHBondContact O-N 3.49Å; F94-R97 PolarHBondContact O-N 3.35Å; F94-A98 HydrophobicContact CD1-CB 4.26Å; F94-A98 HydrophobicContact CE1-CB 4.17Å; F94-A98 WeakPolarHBondContact O-CB 3.41Å; F94-A98 PolarHBondContact O-N 2.87Å
95L79.3Confident74.1Confident73 Ų73100.3 Ų100.338%0.38252%0.522SS..Hα-helixtrans-61.1-43.9175.8-168.867.1000110.6F7 V91 L92 A98 V99F7-L95 HydrophobicContact CE1-CD1 3.36Å; F7-L95 HydrophobicContact CZ-CB 4.15Å; F7-L95 HydrophobicContact CZ-CD1 3.26Å; F7-L95 HydrophobicContact CZ-CG 4.29Å; V91-L95 VanDerWaalsContact O-CB 3.24Å; V91-L95 WeakPolarHBondContact O-CB 3.22Å; V91-L95 PolarHBondContact O-N 3.48Å; L92-L95 WeakPolarHBondContact O-CB 3.3Å; L92-L95 PolarHBondContact O-N 2.9Å; L95-A98 PolarHBondContact O-N 3.45Å; L95-V99 WeakPolarHBondContact O-CB 3.37Å; L95-V99 WeakPolarHBondContact O-CG2 3.35Å; L95-V99 PolarHBondContact O-N 3.49Å
96I77.8Confident72.4Confident95 Ų95105.6 Ų105.649%0.48754%0.539SS..Hα-helixtrans-63-44.7174.9-63.7161.6000111.2L92 Y93 F94 R100L92-I96 HydrophobicContact CD1-CD1 4.39Å; L92-I96 HydrophobicContact CG-CD1 4.15Å; L92-I96 WeakPolarHBondContact O-CD1 3.39Å; L92-I96 VanDerWaalsContact O-CG1 3.29Å; L92-I96 WeakPolarHBondContact O-CG1 3.45Å; L92-I96 PolarHBondContact O-N 3.38Å; Y93-I96 PolarHBondContact O-N 3.35Å; F94-I96 VanDerWaalsContact C-N 3.35Å; F94-I96 PolarHBondContact O-N 3.49Å; I96-R100 WeakPolarHBondContact O-CG 3.37Å; I96-R100 PolarHBondContact O-N 3.23Å
97R74Confident71Confident150 Ų150108.6 Ų108.657%0.56654%0.544SS*.Hα-helixtrans-63.5-43.3176.7-177.465-179.7-1632.1111.7Y93 F94 R100 L101Y93-R97 WeakPolarHBondContact O-CB 3.34Å; Y93-R97 PolarHBondContact O-N 3.43Å; F94-R97 PolarHBondContact O-N 3.35Å; R97-R100 PolarHBondContact O-N 3.3Å; R97-L101 HydrophobicContact CG-CD1 3.98Å; R97-L101 WeakPolarHBondContact O-CD1 3.33Å; R97-L101 PolarHBondContact O-N 3.06Å
98A64.2Low69.9Low18 Ų18113.4 Ų113.415%0.14956%0.558CS.*Hα-helixtrans-68-38.218000000112.1F94 L95 R100 L101 K102F94-A98 HydrophobicContact CD1-CB 4.26Å; F94-A98 HydrophobicContact CE1-CB 4.17Å; F94-A98 WeakPolarHBondContact O-CB 3.41Å; F94-A98 PolarHBondContact O-N 2.87Å; L95-A98 PolarHBondContact O-N 3.45Å; A98-R100 VanDerWaalsContact C-N 3.31Å; A98-L101 PolarHBondContact O-N 3.15Å; A98-K102 PolarHBondContact O-N 3Å; A98-K102 VanDerWaalsContact O-N 3.16Å
99V65.4Low68.5Low96 Ų96116.3 Ų116.358%0.58257%0.567SS**Hα-helixtrans-67-34173.6173.50000111L95 K102L95-V99 WeakPolarHBondContact O-CB 3.37Å; L95-V99 WeakPolarHBondContact O-CG2 3.35Å; L95-V99 PolarHBondContact O-N 3.49Å; V99-K102 PolarHBondContact O-N 2.9Å
100R62.3Low67.2Low185 Ų185121.5 Ų121.570%0.69858%0.581SS**Hα-helixtrans-71.6-31.2173.5-74.8-81.4-177.6107.3-1.3113.3I96 R97 A98 K102 K103I96-R100 WeakPolarHBondContact O-CG 3.37Å; I96-R100 PolarHBondContact O-N 3.23Å; R97-R100 PolarHBondContact O-N 3.3Å; A98-R100 VanDerWaalsContact C-N 3.31Å; R100-K102 VanDerWaalsContact C-N 3.26Å; R100-K103 PolarHBondContact O-N 3.34Å
101L55Low66.2Low113 Ų113122.1 Ų122.159%0.59259%0.587SS**Hα-helixtrans-73.7-16.6171.6-94.6113.4000113.3R97 A98 K103R97-L101 HydrophobicContact CG-CD1 3.98Å; R97-L101 WeakPolarHBondContact O-CD1 3.33Å; R97-L101 PolarHBondContact O-N 3.06Å; A98-L101 PolarHBondContact O-N 3.15Å; L101-K103 PolarHBondContact O-N 2.82Å
102K53.5Low64.8Low122 Ų122126.9 Ų126.953%0.5361%0.61SS.*THydrogen-bonded Turntrans-84.431.1170.1-163.3167.8162.9-169.40112W4 A98 V99 R100 P104W4-K102 HydrophobicContact CZ2-CD 4.43Å; A98-K102 PolarHBondContact O-N 3Å; A98-K102 VanDerWaalsContact O-N 3.16Å; V99-K102 PolarHBondContact O-N 2.9Å; R100-K102 VanDerWaalsContact C-N 3.26Å; K102-P104 VanDerWaalsContact O-CD 3.27Å; K102-P104 WeakPolarHBondContact O-CD 3.19Å
103K54.1Low63.6Low155 Ų155130 Ų13067%0.67463%0.626SS**  trans-98.594.1153-67.4-173.5179.9-171.60106.1R100 L101 A105R100-K103 PolarHBondContact O-N 3.34Å; L101-K103 PolarHBondContact O-N 2.82Å; K103-A105 PolarHBondContact O-N 3.19Å
104P56.3Low62.2Low115 Ų115125 Ų12575%0.74761%0.614SS**  trans-58.3104.3157.726.1-30.1000105.1K102 H106K102-P104 VanDerWaalsContact O-CD 3.27Å; K102-P104 WeakPolarHBondContact O-CD 3.19Å; P104-H106 VanDerWaalsContact C-N 3.27Å; P104-H106 PolarHBondContact O-N 3.33Å
105A53.1Low61Low95 Ų95126.2 Ų126.279%0.78563%0.625SS**  trans-61.897.7177.700000107.2K103 R107K103-A105 PolarHBondContact O-N 3.19Å; A105-R107 PolarHBondContact O-N 3.2Å
106H54.2Low59.8Low136 Ų136131.3 Ų131.363%0.6364%0.64SS**  trans58.156.9149.6-158.2-98.4000116.1P104P104-H106 VanDerWaalsContact C-N 3.27Å; P104-H106 PolarHBondContact O-N 3.33Å
107R59.2Low58.8Low173 Ų173134.5 Ų134.565%0.65366%0.658SS**  trans-68.3132.4145.2-78.5-171.4150.1-158-5.8107A105 S114A105-R107 PolarHBondContact O-N 3.2Å; R107-S114 VanDerWaalsContact NH2-CB 3.33Å; R107-S114 PolarHBondContact NH2-O 3.27Å; R107-S114 PolarHBondContact NH2-OG 3.08Å
108K62.9Low57.8Low179 Ų179135.5 Ų135.578%0.77868%0.675SS**  trans93.476.1173.8-48.2166.8-173.7-168.50115
109K58.9Low57.1Low161 Ų161138 Ų13870%0.769%0.691SS**SBend-141.2-7123.6-68.9-158179.9-177.80114.6
110Y62.9Low56.4Low222 Ų222137.7 Ų137.787%0.87169%0.69SS**SBendtrans-142.825.9171.8-57.4-77.4000113.3L112Y110-L112 VanDerWaalsContact C-N 3.35Å; Y110-L112 PolarHBondContact O-N 2.79Å; Y110-L112 VanDerWaalsContact O-N 3.13Å
111G64.6Low55.9Low49 Ų49138.5 Ų138.551%0.50570%0.701SS.*  trans-88.658.3-172.200000114L113G111-L113 VanDerWaalsContact C-N 3.33Å
112L56.4Low55.7Low171 Ų171139.8 Ų139.890%0.89571%0.706SS**SBendtrans-85.1-6.8165.8-90.2159.6000112.7Y110Y110-L112 VanDerWaalsContact C-N 3.35Å; Y110-L112 PolarHBondContact O-N 2.79Å; Y110-L112 VanDerWaalsContact O-N 3.13Å
113L59.1Low55.7Low162 Ų162140.5 Ų140.585%0.84871%0.711SS**SBendtrans-107.56.8-175.6-74.1167.5000115G111G111-L113 VanDerWaalsContact C-N 3.33Å
114S56.8Low55.3Low51 Ų51138.6 Ų138.636%0.35773%0.725SS.*THydrogen-bonded Turntrans-99.821.9-173.978.30000115.1R107R107-S114 VanDerWaalsContact NH2-CB 3.33Å; R107-S114 PolarHBondContact NH2-O 3.27Å; R107-S114 PolarHBondContact NH2-OG 3.08Å
115N50.9Low54.9Low130 Ų130136.9 Ų136.970%0.69571%0.712SS**THydrogen-bonded Turntrans-125.124.8178.4-73.3-37.2000112.7
116Y54.7Low54.9Low180 Ų180140.9 Ų140.971%0.70671%0.714SS**SBendtrans-95.9-16.6178.6-153.5-94.8000114.1V120Y116-V120 HydrophobicContact CE1-CG2 4.34Å
117D55.8Low55Low162 Ų162139.3 Ų139.387%0.86672%0.718SS**SBendtrans-103.9-1.2-166.5-149.649.8000115
118D54.5Low54.6Low170 Ų170139.3 Ų139.391%0.90973%0.726SS**SBendtrans-122.58.9-175.1-130.52.6000112.8
119S49Very low54.2Low71 Ų71138.9 Ų138.950%0.49773%0.726SS.*SBendtrans-133.27.3176.2730000114.7
120V50.1Low53.9Low90 Ų90137.7 Ų137.755%0.54573%0.728SS.*  trans-109.847.8173.2-177.30000109.2Y116Y116-V120 HydrophobicContact CE1-CG2 4.34Å
121E51.8Low53.5Low201 Ų201134.3 Ų134.394%0.93973%0.725SS**  trans-97.325.7142.8-65.6-167.616500109.2E123E121-E123 PolarHBondContact O-N 2.81Å
122M51.6Low53.3Low140 Ų140137.7 Ų137.769%0.6974%0.736SS**  trans-77.2110.9166.7-80.6-146.5-80.700108.4
123E52.1Low53.5Low137 Ų137137.4 Ų137.464%0.6473%0.734SS**  69.472120-161.7172.2-160.900113.4E121 V125E121-E123 PolarHBondContact O-N 2.81Å; E123-V125 HydrophobicContact CG-CB 3.53Å; E123-V125 HydrophobicContact CG-CG2 3.52Å; E123-V125 PolarHBondContact O-N 3.33Å
124A45.4Very low52.9Low116 Ų116139.2 Ų139.296%0.95973%0.731SS**  trans-69.954.9150.500000109.9
125V48Very low52.9Low79 Ų79143.1 Ų143.148%0.47974%0.744SS.*  trans-104.3108.5167.1-177.90000105.4E123E123-V125 HydrophobicContact CG-CB 3.53Å; E123-V125 HydrophobicContact CG-CG2 3.52Å; E123-V125 PolarHBondContact O-N 3.33Å
126E54Low53.2Low178 Ų178142.2 Ų142.283%0.83275%0.754SS**SBendtrans54.597.7141.8-56.2169.1173.100116.8
127S56.4Low53.3Low103 Ų103143.2 Ų143.272%0.7276%0.757SS**  trans164.580.7134176.80000111.8
128E49.7Very low53.3Low174 Ų174140.3 Ų140.381%0.81375%0.749SS**  trans-14849.9149.4133.6-179.4139.200108D130E128-D130 PolarHBondContact O-N 2.75Å
129E55Low53.2Low169 Ų169140.2 Ų140.279%0.7975%0.748SS**THydrogen-bonded Turntrans-73.258.8163.649.9-179.6172.600110.5
130D53Low53.2Low136 Ų136148 Ų14873%0.72777%0.766SS**THydrogen-bonded Turntrans-15124.7172.5-133-1.5000117E128E128-D130 PolarHBondContact O-N 2.75Å
131D55.4Low53.2Low151 Ų151159 Ų15981%0.80780%0.798SS**SBendtrans-108.230.8173.3-97.6-10.3000113.4
132T60Low53.3Low120 Ų120156.9 Ų156.974%0.73679%0.791SS**  trans-12427.8-176630000116.9
133L60.4Low53.3Low165 Ų165157.8 Ų157.886%0.86480%0.796SS**  trans-10775.3167.7-73.6175.3000113.3
134Y45.6Very low53.4Low201 Ų201158.9 Ų158.979%0.78881%0.805SS**  trans-4.4129.9142.4-118.7-104.1000119
135E57.4Low53.9Low133 Ų133161.5 Ų161.562%0.62180%0.796SS**  trans36.399.2130.9-144.6-165.3176.500119.1R137E135-R137 IonicContact OE1-NE 3.83Å
136A57Low54.3Low110 Ų110166.6 Ų166.691%0.90982%0.816SS**  trans-103.387.4153.100000110
137R56.9Low54.3Low202 Ų202165.9 Ų165.976%0.76282%0.815SS**  trans-65.9134.9163.8-171.7-163.7-92.4-145.2-3.5109.8E135E135-R137 IonicContact OE1-NE 3.83Å
138S55.4Low54.1Low101 Ų101170.4 Ų170.471%0.70682%0.821SS**  trans73.6119.5155.975.20000120.7
139L53.5Low54.5Low168 Ų168170.1 Ų170.188%0.8882%0.822SS**  -168.4127.6115.6-149.382.5000112
140R49.2Very low54.4Low235 Ų235170.2 Ų170.289%0.88783%0.825SS**  trans-26137.5168.1-64.5169.2166-150.9-4.3117.6
141R49.2Very low54.5Low320 Ų320173.3 Ų173.3100%1.20883%0.834SS**  -1670108.4-121.7-179.4-176.2167.91.8112

Retrieved 141 of 141 residues in 34.3 ms (Link to these results)