A0A087YQL2_POEFO Loading...

Transmembrane protein 223

AlphaFold DB , UniProt , Accession A0A087YQL2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 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
1S47.5Very low44.9Very low143 Ų143103.6 Ų103.6100%159%0.59SS**  0-9.10-65.50000116.7
2G43.3Very low45.1Very low59 Ų59103.6 Ų103.661%0.60859%0.587SS**Hα-helixtrans-77.1-29.4-176.900000115.8
3T41.3Very low45.2Very low108 Ų10897.1 Ų97.166%0.66355%0.552SS**Hα-helixtrans-71.5-35.8-172.7-17.60000113N5 F6 V7T3-N5 PolarHBondContact O-N 3.39Å; T3-F6 PolarHBondContact O-N 3.07Å; T3-V7 WeakPolarHBondContact O-CG2 3.36Å; T3-V7 PolarHBondContact O-N 3Å
4N39.1Very low45.3Very low116 Ų11694 Ų9462%0.6253%0.533SS*.Hα-helixtrans-69.3-36.4-177.6-63.5-17.1000111.9F6 I8N4-F6 VanDerWaalsContact C-N 3.33Å; N4-F6 PolarHBondContact O-N 3.36Å; N4-I8 VanDerWaalsContact O-CD1 3.3Å; N4-I8 WeakPolarHBondContact O-CD1 3.21Å; N4-I8 WeakPolarHBondContact O-CG1 3.29Å; N4-I8 PolarHBondContact O-N 3.18Å; N4-I8 VanDerWaalsContact O-N 3.11Å
5N44.5Very low45.6Very low109 Ų10992.3 Ų92.358%0.58353%0.526SS*.Hα-helixtrans-69.9-32.2177.6-70.8-25.6000112.5T3 Q9T3-N5 PolarHBondContact O-N 3.39Å; N5-Q9 PolarHBondContact O-N 3Å
6F40.7Very low45.7Very low90 Ų9094 Ų9440%0.39553%0.525SS..Hα-helixtrans-70-43.8177.9-165.5-90.1000111.8T3 N4 I8 Q9 F10 F92 L96T3-F6 PolarHBondContact O-N 3.07Å; N4-F6 VanDerWaalsContact C-N 3.33Å; N4-F6 PolarHBondContact O-N 3.36Å; F6-I8 VanDerWaalsContact C-N 3.33Å; F6-I8 PolarHBondContact O-N 2.61Å; F6-Q9 PolarHBondContact O-N 2.75Å; F6-F10 VanDerWaalsContact O-CB 3.31Å; F6-F10 WeakPolarHBondContact O-CB 3.21Å; F6-F10 PolarHBondContact O-N 3.35Å; F6-F92 HydrophobicContact CD2-CE2 4.26Å; F6-F92 HydrophobicContact CD2-CZ 4.15Å; F6-F92 HydrophobicContact CE1-CZ 4.48Å; F6-F92 AromaticContact CE2-CE2 3.51Å; F6-F92 HydrophobicContact CE2-CE2 3.51Å; F6-F92 AromaticContact CE2-CZ 3.3Å; F6-F92 HydrophobicContact CE2-CZ 3.3Å; F6-F92 HydrophobicContact CZ-CE1 4.41Å; F6-F92 HydrophobicContact CZ-CE2 4.16Å; F6-F92 AromaticContact CZ-CZ 3.52Å; F6-F92 HydrophobicContact CZ-CZ 3.52Å; F6-L96 HydrophobicContact CE2-CD1 4.29Å; F6-L96 HydrophobicContact CE2-CD2 3.87Å; F6-L96 HydrophobicContact CZ-CD1 3.68Å; F6-L96 HydrophobicContact CZ-CD2 3.62Å; F6-L96 HydrophobicContact CZ-CG 4.22Å
7V46.2Very low45.7Very low88 Ų8891 Ų9153%0.53351%0.508SS..Hα-helixtrans-64-39.4175.7175.50000111T3 F10 N11T3-V7 WeakPolarHBondContact O-CG2 3.36Å; T3-V7 PolarHBondContact O-N 3Å; V7-F10 PolarHBondContact O-N 3.19Å; V7-N11 WeakPolarHBondContact O-CB 2.76Å; V7-N11 PolarHBondContact O-N 3.24Å
8I48.4Very low45.7Very low104 Ų10491.2 Ų91.253%0.53351%0.507SS..Hα-helixtrans-67.2-44.7179.1-66.6164.7000111.4N4 F6 F10 N11 N12N4-I8 VanDerWaalsContact O-CD1 3.3Å; N4-I8 WeakPolarHBondContact O-CD1 3.21Å; N4-I8 WeakPolarHBondContact O-CG1 3.29Å; N4-I8 PolarHBondContact O-N 3.18Å; N4-I8 VanDerWaalsContact O-N 3.11Å; F6-I8 VanDerWaalsContact C-N 3.33Å; F6-I8 PolarHBondContact O-N 2.61Å; I8-F10 VanDerWaalsContact C-N 3.34Å; I8-F10 PolarHBondContact O-N 3.39Å; I8-N11 PolarHBondContact O-N 3.17Å; I8-N12 WeakPolarHBondContact O-CB 3.33Å; I8-N12 PolarHBondContact O-N 3.22Å
9Q48Very low45.7Very low126 Ų12688.9 Ų88.959%0.58950%0.498SS*.Hα-helixtrans-64.7-38.1176.2-87.1-72.81400112.8N5 F6 S13N5-Q9 PolarHBondContact O-N 3Å; F6-Q9 PolarHBondContact O-N 2.75Å; Q9-S13 WeakPolarHBondContact O-CB 3.47Å; Q9-S13 PolarHBondContact O-N 2.85Å; Q9-S13 PolarHBondContact O-OG 3.06Å
10F45.7Very low45.9Very low94 Ų9487 Ų8741%0.41249%0.488SS..Hα-helixtrans-64.4-43.7175.2-168-101.8000111.5F6 V7 I8 N14 W93F6-F10 VanDerWaalsContact O-CB 3.31Å; F6-F10 WeakPolarHBondContact O-CB 3.21Å; F6-F10 PolarHBondContact O-N 3.35Å; V7-F10 PolarHBondContact O-N 3.19Å; I8-F10 VanDerWaalsContact C-N 3.34Å; I8-F10 PolarHBondContact O-N 3.39Å; F10-N14 WeakPolarHBondContact CD1-ND2 3.3Å; F10-N14 WeakPolarHBondContact CE1-ND2 3.46Å; F10-N14 WeakPolarHBondContact CZ-ND2 3.47Å; F10-N14 WeakPolarHBondContact O-CB 3.22Å; F10-N14 PolarHBondContact O-N 3.24Å; F10-N14 PolarHBondContact O-ND2 2.62Å; F10-W93 AromaticContact CE2-CH2 3.7Å; F10-W93 HydrophobicContact CE2-CH2 3.7Å; F10-W93 AromaticContact CE2-CZ2 3.87Å; F10-W93 HydrophobicContact CE2-CZ2 3.87Å; F10-W93 HydrophobicContact CZ-CH2 4.44Å
11N48.8Very low45.8Very low103 Ų10386.4 Ų86.455%0.55148%0.484SS*.Hα-helixtrans-67.8-40.4179.9-147.7-5.1000111.4V7 I8 N14 T15V7-N11 WeakPolarHBondContact O-CB 2.76Å; V7-N11 PolarHBondContact O-N 3.24Å; I8-N11 PolarHBondContact O-N 3.17Å; N11-N14 PolarHBondContact O-N 3.45Å; N11-T15 WeakPolarHBondContact O-CG2 3.47Å; N11-T15 PolarHBondContact O-N 2.76Å; N11-T15 PolarHBondContact O-OG1 2.98Å
12N48Very low45.5Very low103 Ų10386.1 Ų86.155%0.55147%0.465SS*.Hα-helixtrans-70.4-34.6178.6-125.9-16.7000113.4I8 T15 F16I8-N12 WeakPolarHBondContact O-CB 3.33Å; I8-N12 PolarHBondContact O-N 3.22Å; N12-T15 WeakPolarHBondContact CA-OG1 2.94Å; N12-T15 PolarHBondContact O-OG1 3.25Å; N12-F16 WeakPolarHBondContact O-CB 3.3Å; N12-F16 PolarHBondContact O-N 3.45Å; N12-F16 VanDerWaalsContact O-N 3.13Å
13S46.1Very low45.3Very low19 Ų1988.8 Ų88.813%0.13347%0.465CS..Hα-helixtrans-68.9-37.4174.7-60.80000111.3Q9 L17Q9-S13 WeakPolarHBondContact O-CB 3.47Å; Q9-S13 PolarHBondContact O-N 2.85Å; Q9-S13 PolarHBondContact O-OG 3.06Å; S13-L17 WeakPolarHBondContact O-CB 3.41Å; S13-L17 PolarHBondContact O-N 3.36Å
14N46.4Very low45Very low54 Ų5485.7 Ų85.729%0.28945%0.45SS..Hα-helixtrans-72-37.8175.8-76.9-51.7000112.7F10 N11 F16 L17 L18F10-N14 WeakPolarHBondContact CD1-ND2 3.3Å; F10-N14 WeakPolarHBondContact CE1-ND2 3.46Å; F10-N14 WeakPolarHBondContact CZ-ND2 3.47Å; F10-N14 WeakPolarHBondContact O-CB 3.22Å; F10-N14 PolarHBondContact O-N 3.24Å; F10-N14 PolarHBondContact O-ND2 2.62Å; N11-N14 PolarHBondContact O-N 3.45Å; N14-F16 VanDerWaalsContact C-N 3.3Å; N14-F16 PolarHBondContact O-N 3.33Å; N14-L17 PolarHBondContact O-N 3.33Å; N14-L18 VanDerWaalsContact O-CB 3.23Å; N14-L18 WeakPolarHBondContact O-CB 3.12Å; N14-L18 WeakPolarHBondContact O-CG 3.18Å; N14-L18 PolarHBondContact O-N 3.38Å
15T49.6Very low44.9Very low69 Ų6984.3 Ų84.342%0.42345%0.446SS..Hα-helixtrans-65.3-35.9174.552.40000111.7N11 N12 S19N11-T15 WeakPolarHBondContact O-CG2 3.47Å; N11-T15 PolarHBondContact O-N 2.76Å; N11-T15 PolarHBondContact O-OG1 2.98Å; N12-T15 WeakPolarHBondContact CA-OG1 2.94Å; N12-T15 PolarHBondContact O-OG1 3.25Å; T15-S19 WeakPolarHBondContact O-CB 3.38Å; T15-S19 PolarHBondContact O-N 3.28Å; T15-S19 PolarHBondContact O-OG 3.41Å
16F48.3Very low44.4Very low119 Ų11986.5 Ų86.552%0.52245%0.453SS..Hα-helixtrans-70.4-42.6174.3-167.7-96.6000112.4N12 N14 L18 S19 V20N12-F16 WeakPolarHBondContact O-CB 3.3Å; N12-F16 PolarHBondContact O-N 3.45Å; N12-F16 VanDerWaalsContact O-N 3.13Å; N14-F16 VanDerWaalsContact C-N 3.3Å; N14-F16 PolarHBondContact O-N 3.33Å; F16-L18 VanDerWaalsContact C-N 3.32Å; F16-L18 PolarHBondContact O-N 3.34Å; F16-S19 WeakPolarHBondContact CA-OG 3.26Å; F16-S19 PolarHBondContact O-N 2.83Å; F16-S19 PolarHBondContact O-OG 3.45Å; F16-V20 HydrophobicContact CD1-CG2 4.17Å; F16-V20 HydrophobicContact CE1-CG2 3.92Å; F16-V20 HydrophobicContact CZ-CG2 4.32Å; F16-V20 WeakPolarHBondContact O-CB 3.38Å; F16-V20 VanDerWaalsContact O-CG2 3.23Å; F16-V20 WeakPolarHBondContact O-CG2 3.14Å; F16-V20 PolarHBondContact O-N 3.05Å
17L45Very low44Very low43 Ų4386 Ų8623%0.22546%0.461CS..Hα-helixtrans-62.3-40.4172.4-96.2160.6000111.8S13 N14 V20 L21 I153 L156S13-L17 WeakPolarHBondContact O-CB 3.41Å; S13-L17 PolarHBondContact O-N 3.36Å; N14-L17 PolarHBondContact O-N 3.33Å; L17-V20 PolarHBondContact O-N 3.48Å; L17-L21 VanDerWaalsContact O-CB 3.25Å; L17-L21 WeakPolarHBondContact O-CB 3.14Å; L17-L21 VanDerWaalsContact O-CG 3.24Å; L17-L21 WeakPolarHBondContact O-CG 3.3Å; L17-L21 PolarHBondContact O-N 3.29Å; L17-I153 HydrophobicContact CD1-CD1 4.44Å; L17-I153 HydrophobicContact CD1-CG1 4.29Å; L17-L156 HydrophobicContact CD2-CD2 4.47Å
18L45.2Very low43.5Very low94 Ų9486.4 Ų86.449%0.49247%0.467SS..Hα-helixtrans-69.3-34.5176.4-74.4172.8000112.3N14 F16 K22N14-L18 VanDerWaalsContact O-CB 3.23Å; N14-L18 WeakPolarHBondContact O-CB 3.12Å; N14-L18 WeakPolarHBondContact O-CG 3.18Å; N14-L18 PolarHBondContact O-N 3.38Å; F16-L18 VanDerWaalsContact C-N 3.32Å; F16-L18 PolarHBondContact O-N 3.34Å; L18-K22 WeakPolarHBondContact O-CB 3.17Å; L18-K22 WeakPolarHBondContact O-CG 3.09Å; L18-K22 PolarHBondContact O-N 3.41Å
19S47.1Very low42.7Very low49 Ų4984.2 Ų84.234%0.34347%0.47SS..Hα-helixtrans-70-38.7174.568.30000111.3T15 F16 N23T15-S19 WeakPolarHBondContact O-CB 3.38Å; T15-S19 PolarHBondContact O-N 3.28Å; T15-S19 PolarHBondContact O-OG 3.41Å; F16-S19 WeakPolarHBondContact CA-OG 3.26Å; F16-S19 PolarHBondContact O-N 2.83Å; F16-S19 PolarHBondContact O-OG 3.45Å; S19-N23 VanDerWaalsContact O-CB 3.31Å; S19-N23 WeakPolarHBondContact O-CB 3.21Å; S19-N23 VanDerWaalsContact O-CG 3.28Å; S19-N23 PolarHBondContact O-N 2.72Å
20V49.1Very low42.1Very low49 Ų4987 Ų8730%0.29748%0.483SS..Hα-helixtrans-65.5-42.7173172.20000111.3F16 L17 A24 F160F16-V20 HydrophobicContact CD1-CG2 4.17Å; F16-V20 HydrophobicContact CE1-CG2 3.92Å; F16-V20 HydrophobicContact CZ-CG2 4.32Å; F16-V20 WeakPolarHBondContact O-CB 3.38Å; F16-V20 VanDerWaalsContact O-CG2 3.23Å; F16-V20 WeakPolarHBondContact O-CG2 3.14Å; F16-V20 PolarHBondContact O-N 3.05Å; L17-V20 PolarHBondContact O-N 3.48Å; V20-A24 WeakPolarHBondContact O-CB 3.23Å; V20-A24 PolarHBondContact O-N 3.3Å; V20-F160 HydrophobicContact CG1-CE2 4.46Å; V20-F160 HydrophobicContact CG1-CZ 4.38Å
21L44Very low41.4Very low75 Ų7588.3 Ų88.339%0.39350%0.504SS..Hα-helixtrans-70.9-37.7177.3-76.8166.2000112.6L17 A24 T25 L156L17-L21 VanDerWaalsContact O-CB 3.25Å; L17-L21 WeakPolarHBondContact O-CB 3.14Å; L17-L21 VanDerWaalsContact O-CG 3.24Å; L17-L21 WeakPolarHBondContact O-CG 3.3Å; L17-L21 PolarHBondContact O-N 3.29Å; L21-A24 CarbonylContact O-C 3.57Å; L21-A24 WeakPolarHBondContact O-CB 3.26Å; L21-A24 PolarHBondContact O-N 3.35Å; L21-T25 PolarHBondContact O-N 2.94Å; L21-T25 PolarHBondContact O-OG1 3.13Å; L21-L156 HydrophobicContact CD2-CD2 4.19Å
22K41.2Very low40.7Very low138 Ų13889.8 Ų89.860%0.652%0.517SS*.Hα-helixtrans-65.6-44.1174.4-80176.6179.4-173.80111.3L18 A24 T25 Q26L18-K22 WeakPolarHBondContact O-CB 3.17Å; L18-K22 WeakPolarHBondContact O-CG 3.09Å; L18-K22 PolarHBondContact O-N 3.41Å; K22-A24 PolarHBondContact O-N 2.92Å; K22-T25 WeakPolarHBondContact CA-OG1 3.4Å; K22-T25 PolarHBondContact O-N 3.23Å; K22-T25 PolarHBondContact O-OG1 3.19Å; K22-Q26 WeakPolarHBondContact O-CB 3.24Å; K22-Q26 PolarHBondContact O-N 3.2Å
23N38.8Very low39.8Very low114 Ų11496.9 Ų96.961%0.6154%0.536SS*.Hα-helixtrans-62.3-31.8172.9-76.4-8.9000111.7S19S19-N23 VanDerWaalsContact O-CB 3.31Å; S19-N23 WeakPolarHBondContact O-CB 3.21Å; S19-N23 VanDerWaalsContact O-CG 3.28Å; S19-N23 PolarHBondContact O-N 2.72Å
24A35.3Very low39Very low43 Ų43103.6 Ų103.636%0.35557%0.569SS.*Hα-helixtrans-75-33174.600000113.9V20 L21 K22 F160V20-A24 WeakPolarHBondContact O-CB 3.23Å; V20-A24 PolarHBondContact O-N 3.3Å; L21-A24 CarbonylContact O-C 3.57Å; L21-A24 WeakPolarHBondContact O-CB 3.26Å; L21-A24 PolarHBondContact O-N 3.35Å; K22-A24 PolarHBondContact O-N 2.92Å; A24-F160 HydrophobicContact CB-CZ 4.41Å
25T36.3Very low38.1Very low88 Ų88110 Ų11054%0.5460%0.595SS.*Hα-helixtrans-82.7-32.3178.525.50000113L21 K22 S27 S28L21-T25 PolarHBondContact O-N 2.94Å; L21-T25 PolarHBondContact O-OG1 3.13Å; K22-T25 WeakPolarHBondContact CA-OG1 3.4Å; K22-T25 PolarHBondContact O-N 3.23Å; K22-T25 PolarHBondContact O-OG1 3.19Å; T25-S27 PolarHBondContact O-N 2.68Å; T25-S28 PolarHBondContact O-N 3.39Å; T25-S28 PolarHBondContact O-OG 3.34Å
26Q33.9Very low37Very low154 Ų154113.9 Ų113.972%0.7262%0.619SS**Hα-helixtrans-64.4-24.7173.3-155.5169.89.500111.9K22 S28K22-Q26 WeakPolarHBondContact O-CB 3.24Å; K22-Q26 PolarHBondContact O-N 3.2Å; Q26-S28 VanDerWaalsContact C-N 3.25Å; Q26-S28 PolarHBondContact O-N 2.83Å
27S33.1Very low36Very low81 Ų81118 Ų11857%0.56663%0.631SS**THydrogen-bonded Turntrans-73.1-8.8170.3177.50000114.3T25T25-S27 PolarHBondContact O-N 2.68Å
28S34.3Very low35.1Very low96 Ų96124.8 Ų124.867%0.67166%0.659SS**THydrogen-bonded Turntrans-116.1-0.5-174.866.70000114.7T25 Q26T25-S28 PolarHBondContact O-N 3.39Å; T25-S28 PolarHBondContact O-OG 3.34Å; Q26-S28 VanDerWaalsContact C-N 3.25Å; Q26-S28 PolarHBondContact O-N 2.83Å
29G31.9Very low34.2Very low57 Ų57123.4 Ų123.459%0.58867%0.667SS**  trans-130.941.3-163.200000115.7
30E36.4Very low33.3Very low184 Ų184128.3 Ų128.386%0.8669%0.689SS**  trans-139.380.4164.2-72.8-160.5150.400110.8
31S30.8Very low32.3Very low122 Ų122133.1 Ų133.185%0.85371%0.713SS**  trans-164.276.5155.3-90.40000109.8
32T34.8Very low31.6Very low134 Ų134132.8 Ų132.882%0.82273%0.728SS**  trans-136.480.9151.4-43.50000106.9
33R28.1Very low31.1Very low253 Ų253134.8 Ų134.896%0.95574%0.739SS**  trans-128.3113.2155.8-76.7-156.6163.5-159.4-4.1109.4
34L28.6Very low30.7Very low159 Ų159135.2 Ų135.283%0.83274%0.74SS**  trans-58.3144.7177.3-79.4151.9000111.4
35F29.5Very low30.6Very low189 Ų189140.8 Ų140.883%0.82976%0.763SS**  trans-41.1136.3154.8-80.1-102.3000112.4
36T25Very low30.4Very low151 Ų151142.3 Ų142.393%0.92677%0.773SS**  trans-154.1135.3136.922.50000110
37W27.2Very low30.8Very low205 Ų205140.6 Ų140.678%0.77778%0.775SS**  trans-92.7175.7-172.5-134.475.5000110.5
38F25.8Very low31.2Very low186 Ų186143.4 Ų143.482%0.81679%0.789SS**  trans84.5134.1175.7-63.9-83.5000116
39G26.3Very low31.2Very low64 Ų64144 Ų14466%0.6680%0.799SS**  cis164.9155.32.900000110.3
40L29.2Very low31Very low153 Ų153151.8 Ų151.880%0.80181%0.811SS**  trans75123.8156-91.284.8000123
41N27.8Very low30.7Very low150 Ų150150.5 Ų150.580%0.80281%0.805SS**  trans100133.4131.4-64.9-18.7000122.4
42G28.9Very low30.9Very low68 Ų68150.2 Ų150.270%0.70180%0.798SS**  trans124.782.7159.700000113.1
43E31.1Very low31Very low179 Ų179149.2 Ų149.284%0.83680%0.803SS**  60.3136.6105.1-74.4-15513200114.2
44I31.3Very low31.3Very low124 Ų124140.5 Ų140.564%0.63679%0.785SS**  cis171.5167.211.8-106177.8000103.9
45L31.6Very low31.5Very low159 Ų159143.6 Ų143.683%0.83279%0.785SS**  trans95.396.7164.2-75.8146.4000119.9
46T33.6Very low31.7Very low121 Ų121144.2 Ų144.274%0.74278%0.782SS**  trans-48.2161.7138.247.40000112.7
47P42.1Very low32.2Very low117 Ų117140.5 Ų140.576%0.7677%0.774SS**  cis-150.2178.843.837.7-13.3000118.7
48T41.4Very low32.4Very low141 Ų141139.8 Ų139.887%0.86577%0.773SS**  trans-41.2136.6175.147.20000117.8
49A32.9Very low32.5Very low107 Ų107137.3 Ų137.388%0.88478%0.777SS**  trans-140.1150.6156.800000111.6
50R28.8Very low32.4Very low222 Ų222139.5 Ų139.584%0.83878%0.782SS**  trans-104.6151.4-152.5-147-171.3-176.4157.4-2.2110.5
51Q30.2Very low32.7Very low157 Ų157137.1 Ų137.173%0.73478%0.778SS**  trans73.3132.8152.9-48.5-152.7-26.400119.8
52V33.8Very low32.7Very low116 Ų116136.3 Ų136.370%0.70378%0.779SS**  172.6108.289.9166.90000106.9A54V52-A54 HydrophobicContact CG1-CB 3.85Å; V52-A54 PolarHBondContact O-N 2.81Å
53A37.3Very low32.9Very low113 Ų113141.6 Ų141.693%0.93479%0.785SS**  trans-78.6102.6163.100000108.1
54A34.8Very low33Very low69 Ų69137.9 Ų137.957%0.5778%0.777SS**  trans-153.8119.5166.700000109.4V52V52-A54 HydrophobicContact CG1-CB 3.85Å; V52-A54 PolarHBondContact O-N 2.81Å
55R32.2Very low33.2Very low224 Ų224136.4 Ų136.485%0.84578%0.783SS**  trans169.9103.4137.3-89.3154.4-161.4-91.52.9108.6
56R33.9Very low33.3Very low202 Ų202136.9 Ų136.976%0.76278%0.779SS**  67.899.697.6-95.4-177.9173.4155.7-0.6111.9
57G35.2Very low33.4Very low74 Ų74136 Ų13676%0.76377%0.77SS**  trans-61.6137.6159.800000110.8
58Y31.5Very low33.4Very low190 Ų190134.2 Ų134.275%0.74576%0.756SS**  trans-135.4107154.3-81.6-74.3000107.4
59C27.6Very low33.2Very low134 Ų134131.3 Ų131.391%0.90574%0.738SS**  trans-88.9124.1149.9-65.50000106
60S25.8Very low33.6Very low110 Ų110130.9 Ų130.977%0.76972%0.721SS**  175.8125.8124.4-157.20000111.1
61S35.4Very low34.2Very low103 Ų103125.2 Ų125.272%0.7270%0.702SS**  trans14.4112143.7-164.20000118.5
62T27.4Very low34.8Very low133 Ų133122.4 Ų122.482%0.81669%0.689SS**  trans-146.3101.6135.833.20000107.7P64T62-P64 VanDerWaalsContact O-CD 3.22Å; T62-P64 WeakPolarHBondContact O-CD 3.45Å
63Q32Very low35.1Very low178 Ų178120 Ų12083%0.83267%0.67SS**  trans-61.9124168.4-74.6-141.9-1700110.3A65Q63-A65 PolarHBondContact O-N 3.49Å
64P33.9Very low35.4Very low101 Ų101118.9 Ų118.966%0.65665%0.648SS**  trans-85.6104.9167.7-4.824.4000108.8T62 K66 K172T62-P64 VanDerWaalsContact O-CD 3.22Å; T62-P64 WeakPolarHBondContact O-CD 3.45Å; P64-K66 PolarHBondContact O-N 2.82Å; P64-K172 WeakPolarHBondContact O-CD 3.36Å; P64-K172 WeakPolarHBondContact O-CE 3.41Å; P64-K172 PolarHBondContact O-NZ 3.49Å
65A35.8Very low36.2Very low93 Ų93120.3 Ų120.377%0.76964%0.639SS**  trans-84.750.6-174.100000116Q63Q63-A65 PolarHBondContact O-N 3.49Å
66K34.1Very low37.2Very low170 Ų170112 Ų11274%0.73961%0.613SS**SBendtrans-150.596.6-177.7-71.3-167.6177.1-179.20114.6P64 V68 K172P64-K66 PolarHBondContact O-N 2.82Å; K66-V68 WeakPolarHBondContact O-CG2 3.37Å; K66-V68 PolarHBondContact O-N 3.47Å; K66-K172 WeakPolarHBondContact O-CD 3.33Å; K66-K172 WeakPolarHBondContact O-CE 3.47Å; K66-K172 PolarHBondContact O-NZ 2.98Å
67D34.5Very low38.3Very low103 Ų103112.1 Ų112.155%0.55161%0.614SS**  trans-41.8113.6-179.9-73.9-44.8000111.9K172D67-K172 VanDerWaalsContact OD1-CB 3.29Å; D67-K172 WeakPolarHBondContact OD1-CB 3.2Å; D67-K172 PolarHBondContact OD1-N 3.42Å
68V42.7Very low39.7Very low79 Ų79113.6 Ų113.648%0.47960%0.599SS.*  trans-101.1100.7-179.7-177.30000106.5K66 L70K66-V68 WeakPolarHBondContact O-CG2 3.37Å; K66-V68 PolarHBondContact O-N 3.47Å; V68-L70 HydrophobicContact CG1-CB 4.47Å; V68-L70 HydrophobicContact CG1-CD1 4.06Å; V68-L70 PolarHBondContact O-N 3.2Å
69T37.2Very low41.4Very low79 Ų79106.7 Ų106.749%0.48557%0.573SS.*  trans-6285.6166.747.60000108.7F71T69-F71 VanDerWaalsContact C-N 3.28Å; T69-F71 PolarHBondContact O-N 2.98Å
70L42.3Very low43.4Very low99 Ų99108.9 Ų108.952%0.51856%0.562SS.*  trans-80.5-4.1-168.1-154.1123.2000114.2V68 F238V68-L70 HydrophobicContact CG1-CB 4.47Å; V68-L70 HydrophobicContact CG1-CD1 4.06Å; V68-L70 PolarHBondContact O-N 3.2Å; L70-F238 HydrophobicContact CD1-CD2 4.31Å; L70-F238 HydrophobicContact CD1-CE2 4.5Å; L70-F238 HydrophobicContact CD2-CD2 4.01Å; L70-F238 HydrophobicContact CD2-CE2 3.69Å
71F41.5Very low45.7Very low102 Ų102108.4 Ų108.445%0.44756%0.555SS.*  trans-157.288.6164.3-134.1-96.2000110.9T69 H73 K167T69-F71 VanDerWaalsContact C-N 3.28Å; T69-F71 PolarHBondContact O-N 2.98Å; F71-H73 HydrophobicContact CD1-CB 4.2Å; F71-H73 HydrophobicContact CE1-CB 4.18Å; F71-K167 WeakPolarHBondContact O-CG 3.44Å
72E41.4Very low47.5Very low98 Ų98105.2 Ų105.246%0.45853%0.529SS..  trans-98.580.4169.3-178.1138.5-168.600108.7D74 K167E72-D74 VanDerWaalsContact C-N 3.32Å; E72-D74 HydrophobicContact CG-CB 4.42Å; E72-D74 PolarHBondContact O-N 3.34Å; E72-K167 HydrophobicContact CG-CD 4.5Å; E72-K167 VanDerWaalsContact CG-CE 3.46Å; E72-K167 IonicContact OE1-NZ 2.62Å; E72-K167 PolarHBondContact OE1-NZ 3.07Å; E72-K167 WeakPolarHBondContact OE2-CE 3.31Å; E72-K167 IonicContact OE2-NZ 2.76Å; E72-K167 PolarHBondContact OE2-NZ 3.45Å
73H40.2Very low49.9Very low67 Ų67103.2 Ų103.231%0.3152%0.517SS..  trans-88.981.8168.2-161.253.8000109F71 R75 S166 D229F71-H73 HydrophobicContact CD1-CB 4.2Å; F71-H73 HydrophobicContact CE1-CB 4.18Å; H73-R75 VanDerWaalsContact CD2-CG 3.4Å; H73-R75 WeakPolarHBondContact CD2-CG 3.31Å; H73-R75 VanDerWaalsContact NE2-CG 3.26Å; H73-R75 WeakPolarHBondContact NE2-CG 3.23Å; H73-R75 PolarHBondContact NE2-NE 3.39Å; H73-R75 PolarHBondContact O-N 2.86Å; H73-S166 PolarHBondContact O-OG 3.33Å; H73-D229 PolarHBondContact CE1-O 3.13Å
74D44.5Very low52.2Low89 Ų89100 Ų10048%0.47651%0.509SS..  trans-74.476.9176-163.2-8.1000110.2E72 T76E72-D74 VanDerWaalsContact C-N 3.32Å; E72-D74 HydrophobicContact CG-CB 4.42Å; E72-D74 PolarHBondContact O-N 3.34Å; D74-T76 PolarHBondContact O-N 3.38Å; D74-T76 VanDerWaalsContact OD1-CB 3.26Å; D74-T76 WeakPolarHBondContact OD1-CB 3.41Å; D74-T76 WeakPolarHBondContact OD1-CG2 3.46Å; D74-T76 PolarHBondContact OD1-N 2.83Å; D74-T76 PolarHBondContact OD1-OG1 3.37Å
75R50.4Low54.6Low99 Ų9998.7 Ų98.737%0.37449%0.493SS..  trans-87.133.1170.2-81.5-87.4-161.7129.24.7111.3H73 R77 F78 F79H73-R75 VanDerWaalsContact CD2-CG 3.4Å; H73-R75 WeakPolarHBondContact CD2-CG 3.31Å; H73-R75 VanDerWaalsContact NE2-CG 3.26Å; H73-R75 WeakPolarHBondContact NE2-CG 3.23Å; H73-R75 PolarHBondContact NE2-NE 3.39Å; H73-R75 PolarHBondContact O-N 2.86Å; R75-R77 PolarHBondContact O-N 2.95Å; R75-R77 VanDerWaalsContact O-N 3.13Å; R75-F78 HydrophobicContact CB-CB 4.22Å; R75-F78 PolarHBondContact O-N 3.48Å; R75-F79 WeakPolarHBondContact O-CD2 3.2Å; R75-F79 PolarHBondContact O-N 3.35Å
76T54.4Low56.7Low50 Ų5095 Ų9531%0.30746%0.462SS..Hα-helixtrans-53.1-30.8169.144.50000112.2D74 R80D74-T76 PolarHBondContact O-N 3.38Å; D74-T76 VanDerWaalsContact OD1-CB 3.26Å; D74-T76 WeakPolarHBondContact OD1-CB 3.41Å; D74-T76 WeakPolarHBondContact OD1-CG2 3.46Å; D74-T76 PolarHBondContact OD1-N 2.83Å; D74-T76 PolarHBondContact OD1-OG1 3.37Å; T76-R80 WeakPolarHBondContact O-CB 3.45Å; T76-R80 WeakPolarHBondContact O-CG 3.47Å; T76-R80 PolarHBondContact O-N 3.25Å
77R56.4Low59Low203 Ų20388.6 Ų88.677%0.76644%0.444SS*.Hα-helixtrans-63.5-41.6173.9-61.3-175.9-172.5-175.91.8112.9R75 R80 V81R75-R77 PolarHBondContact O-N 2.95Å; R75-R77 VanDerWaalsContact O-N 3.13Å; R77-R80 PolarHBondContact O-N 2.86Å; R77-V81 WeakPolarHBondContact O-CB 3.31Å; R77-V81 VanDerWaalsContact O-CG2 3.24Å; R77-V81 WeakPolarHBondContact O-CG2 3.14Å; R77-V81 PolarHBondContact O-N 3.14Å
78F64.6Low61.5Low106 Ų10685.7 Ų85.747%0.46544%0.439SS..Hα-helixtrans-68.3-44.6178.5179.4-98.6000111.1R75 R80 V81 L82R75-F78 HydrophobicContact CB-CB 4.22Å; R75-F78 PolarHBondContact O-N 3.48Å; F78-R80 VanDerWaalsContact C-N 3.34Å; F78-R80 PolarHBondContact O-N 3.45Å; F78-V81 PolarHBondContact O-N 3.47Å; F78-L82 HydrophobicContact CE1-CD2 4.38Å; F78-L82 VanDerWaalsContact O-CB 3.28Å; F78-L82 WeakPolarHBondContact O-CB 3.31Å; F78-L82 PolarHBondContact O-N 3.18Å
79F67.3Low63.5Low44 Ų4483.3 Ų83.319%0.19342%0.422CS..Hα-helixtrans-64.8-36.9174.4-72.4-69.2000112.7R75 L82 T83 C161 S164R75-F79 WeakPolarHBondContact O-CD2 3.2Å; R75-F79 PolarHBondContact O-N 3.35Å; F79-L82 PolarHBondContact O-N 3.43Å; F79-T83 VanDerWaalsContact O-CB 3.23Å; F79-T83 WeakPolarHBondContact O-CB 3.28Å; F79-T83 PolarHBondContact O-N 2.94Å; F79-T83 PolarHBondContact O-OG1 2.82Å; F79-C161 HydrophobicContact CE1-CB 4.35Å; F79-S164 WeakPolarHBondContact CZ-O 3.15Å
80R69.9Low65.8Low180 Ų18083.6 Ų83.668%0.67942%0.417SS*.Hα-helixtrans-64-47173.3-78.1174.476-179.84.4111.1T76 R77 F78 T83 V84T76-R80 WeakPolarHBondContact O-CB 3.45Å; T76-R80 WeakPolarHBondContact O-CG 3.47Å; T76-R80 PolarHBondContact O-N 3.25Å; R77-R80 PolarHBondContact O-N 2.86Å; F78-R80 VanDerWaalsContact C-N 3.34Å; F78-R80 PolarHBondContact O-N 3.45Å; R80-T83 PolarHBondContact O-N 3.32Å; R80-V84 VanDerWaalsContact O-CB 3.3Å; R80-V84 WeakPolarHBondContact O-CB 3.25Å; R80-V84 WeakPolarHBondContact O-CG2 3.15Å; R80-V84 PolarHBondContact O-N 3.34Å
81V73.8Confident67.9Low101 Ų10183.6 Ų83.661%0.61242%0.42SS*.Hα-helixtrans-62.8-43.8176.6171.80000110.8R77 F78 V84 F85R77-V81 WeakPolarHBondContact O-CB 3.31Å; R77-V81 VanDerWaalsContact O-CG2 3.24Å; R77-V81 WeakPolarHBondContact O-CG2 3.14Å; R77-V81 PolarHBondContact O-N 3.14Å; F78-V81 PolarHBondContact O-N 3.47Å; V81-V84 PolarHBondContact O-N 3.42Å; V81-F85 WeakPolarHBondContact O-CB 3.12Å; V81-F85 PolarHBondContact O-N 3.37Å
82L74Confident70.1Confident36 Ų3682 Ų8219%0.18841%0.414CS..Hα-helixtrans-63.3-42.1176.7-178.461.8000111.8F78 F79 F85 C86 C161F78-L82 HydrophobicContact CE1-CD2 4.38Å; F78-L82 VanDerWaalsContact O-CB 3.28Å; F78-L82 WeakPolarHBondContact O-CB 3.31Å; F78-L82 PolarHBondContact O-N 3.18Å; F79-L82 PolarHBondContact O-N 3.43Å; L82-F85 PolarHBondContact O-N 2.77Å; L82-C86 VanDerWaalsContact O-CB 3.28Å; L82-C86 WeakPolarHBondContact O-CB 3.42Å; L82-C86 PolarHBondContact O-N 2.83Å; L82-C86 PolarHBondContact O-SG 3.41Å; L82-C86 VanDerWaalsContact O-SG 3.33Å; L82-C161 VanDerWaalsContact CD2-SG 3.53Å
83T76.5Confident72.2Confident90 Ų9078.8 Ų78.855%0.55240%0.397SS*.Hα-helixtrans-68.4-42.2177.9-55.90000111.3F79 R80 F85 G87F79-T83 VanDerWaalsContact O-CB 3.23Å; F79-T83 WeakPolarHBondContact O-CB 3.28Å; F79-T83 PolarHBondContact O-N 2.94Å; F79-T83 PolarHBondContact O-OG1 2.82Å; R80-T83 PolarHBondContact O-N 3.32Å; T83-F85 VanDerWaalsContact C-N 3.32Å; T83-G87 PolarHBondContact O-N 2.78Å
84V81Confident74.3Confident110 Ų11078.6 Ų78.667%0.66740%0.401SS*.Hα-helixtrans-63.6-40.6174.3169.20000110.4R80 V81 G88R80-V84 VanDerWaalsContact O-CB 3.3Å; R80-V84 WeakPolarHBondContact O-CB 3.25Å; R80-V84 WeakPolarHBondContact O-CG2 3.15Å; R80-V84 PolarHBondContact O-N 3.34Å; V81-V84 PolarHBondContact O-N 3.42Å; V84-G88 PolarHBondContact O-N 2.83Å
85F83.8Confident76.3Confident74 Ų7481.2 Ų81.233%0.32541%0.405SS..Hα-helixtrans-67.5-51177.9-176.7-100.9000111.7V81 L82 T83 G87 G88 Q89V81-F85 WeakPolarHBondContact O-CB 3.12Å; V81-F85 PolarHBondContact O-N 3.37Å; L82-F85 PolarHBondContact O-N 2.77Å; T83-F85 VanDerWaalsContact C-N 3.32Å; F85-G87 VanDerWaalsContact C-N 3.32Å; F85-G87 PolarHBondContact O-N 2.81Å; F85-G88 PolarHBondContact O-N 3.32Å; F85-Q89 HydrophobicContact CD1-CG 4.29Å; F85-Q89 HydrophobicContact CE1-CG 3.97Å; F85-Q89 HydrophobicContact CE2-CG 4.26Å; F85-Q89 HydrophobicContact CZ-CG 3.95Å; F85-Q89 WeakPolarHBondContact O-CB 3.3Å; F85-Q89 VanDerWaalsContact O-CG 3.27Å; F85-Q89 WeakPolarHBondContact O-CG 3.32Å; F85-Q89 PolarHBondContact O-N 3.29Å
86C80.1Confident77.8Confident17 Ų1778 Ų7812%0.11540%0.395CS..Hα-helixtrans-59.8-41.9175.4-74.40000111.7L82 F90L82-C86 VanDerWaalsContact O-CB 3.28Å; L82-C86 WeakPolarHBondContact O-CB 3.42Å; L82-C86 PolarHBondContact O-N 2.83Å; L82-C86 PolarHBondContact O-SG 3.41Å; L82-C86 VanDerWaalsContact O-SG 3.33Å; C86-F90 VanDerWaalsContact O-CB 3.32Å; C86-F90 WeakPolarHBondContact O-CB 3.37Å; C86-F90 PolarHBondContact O-N 3.01Å
87G82.8Confident79.1Confident34 Ų3476.1 Ų76.135%0.35138%0.384SS..Hα-helixtrans-63-46.9175.200000112.2T83 F85 F90 V91T83-G87 PolarHBondContact O-N 2.78Å; F85-G87 VanDerWaalsContact C-N 3.32Å; F85-G87 PolarHBondContact O-N 2.81Å; G87-F90 PolarHBondContact O-N 3.39Å; G87-V91 VanDerWaalsContact O-CG2 3.31Å; G87-V91 WeakPolarHBondContact O-CG2 3.27Å; G87-V91 PolarHBondContact O-N 2.76Å
88G87.8Confident80.2Confident43 Ų4371.3 Ų71.344%0.44337%0.371SS..Hα-helixtrans-61.7-44.4177.400000112.8V84 F85 V91 F92V84-G88 PolarHBondContact O-N 2.83Å; F85-G88 PolarHBondContact O-N 3.32Å; G88-V91 PolarHBondContact O-N 3.42Å; G88-F92 WeakPolarHBondContact O-CB 3.28Å; G88-F92 PolarHBondContact O-N 2.76Å
89Q83.6Confident81Confident29 Ų2972 Ų7214%0.13637%0.374CS..Hα-helixtrans-62.9-44.9175.3-69.6-66.9-28.500110.9F85 V91 F92 W93 I153F85-Q89 HydrophobicContact CD1-CG 4.29Å; F85-Q89 HydrophobicContact CE1-CG 3.97Å; F85-Q89 HydrophobicContact CE2-CG 4.26Å; F85-Q89 HydrophobicContact CZ-CG 3.95Å; F85-Q89 WeakPolarHBondContact O-CB 3.3Å; F85-Q89 VanDerWaalsContact O-CG 3.27Å; F85-Q89 WeakPolarHBondContact O-CG 3.32Å; F85-Q89 PolarHBondContact O-N 3.29Å; Q89-V91 PolarHBondContact O-N 2.84Å; Q89-F92 WeakPolarHBondContact O-CB 3.16Å; Q89-F92 PolarHBondContact O-N 3.4Å; Q89-W93 PolarHBondContact O-N 2.82Å; Q89-I153 HydrophobicContact CB-CG2 4.33Å
90F85.9Confident81.4Confident85 Ų8570.4 Ų70.437%0.37337%0.369SS..Hα-helixtrans-61.5-42.7177.8-176.7-99.8000112.8C86 G87 F92 W93 T94 V154C86-F90 VanDerWaalsContact O-CB 3.32Å; C86-F90 WeakPolarHBondContact O-CB 3.37Å; C86-F90 PolarHBondContact O-N 3.01Å; G87-F90 PolarHBondContact O-N 3.39Å; F90-F92 VanDerWaalsContact C-N 3.35Å; F90-W93 PolarHBondContact O-N 3.34Å; F90-T94 VanDerWaalsContact O-CB 3.31Å; F90-T94 WeakPolarHBondContact O-CB 3.45Å; F90-T94 PolarHBondContact O-N 3.44Å; F90-T94 PolarHBondContact O-OG1 2.74Å; F90-V154 HydrophobicContact CB-CG2 3.9Å; F90-V154 HydrophobicContact CD2-CG2 3.81Å; F90-V154 HydrophobicContact CG-CG2 4.12Å
91V87.3Confident81.4Confident98 Ų9865.4 Ų65.459%0.59435%0.352SS*.Hα-helixtrans-63.5-42.2175.6171.50000110.8G87 G88 Q89 T94 Y95G87-V91 VanDerWaalsContact O-CG2 3.31Å; G87-V91 WeakPolarHBondContact O-CG2 3.27Å; G87-V91 PolarHBondContact O-N 2.76Å; G88-V91 PolarHBondContact O-N 3.42Å; Q89-V91 PolarHBondContact O-N 2.84Å; V91-T94 PolarHBondContact O-N 3.36Å; V91-Y95 VanDerWaalsContact O-CB 3.3Å; V91-Y95 WeakPolarHBondContact O-CB 3.44Å; V91-Y95 PolarHBondContact O-N 3.44Å
92F87.6Confident81.2Confident69 Ų6963.4 Ų63.430%0.30334%0.34SS..Hα-helixtrans-61.6-48.5177.2171.6-103.7000112.7F6 G88 Q89 F90 Y95 L96F6-F92 HydrophobicContact CD2-CE2 4.26Å; F6-F92 HydrophobicContact CD2-CZ 4.15Å; F6-F92 HydrophobicContact CE1-CZ 4.48Å; F6-F92 AromaticContact CE2-CE2 3.51Å; F6-F92 HydrophobicContact CE2-CE2 3.51Å; F6-F92 AromaticContact CE2-CZ 3.3Å; F6-F92 HydrophobicContact CE2-CZ 3.3Å; F6-F92 HydrophobicContact CZ-CE1 4.41Å; F6-F92 HydrophobicContact CZ-CE2 4.16Å; F6-F92 AromaticContact CZ-CZ 3.52Å; F6-F92 HydrophobicContact CZ-CZ 3.52Å; G88-F92 WeakPolarHBondContact O-CB 3.28Å; G88-F92 PolarHBondContact O-N 2.76Å; Q89-F92 WeakPolarHBondContact O-CB 3.16Å; Q89-F92 PolarHBondContact O-N 3.4Å; F90-F92 VanDerWaalsContact C-N 3.35Å; F92-Y95 PolarHBondContact O-N 3.5Å; F92-L96 HydrophobicContact CD1-CD1 4.04Å; F92-L96 HydrophobicContact CE1-CD1 3.5Å; F92-L96 VanDerWaalsContact CE1-CD1 3.5Å; F92-L96 HydrophobicContact CE2-CD1 4.18Å; F92-L96 HydrophobicContact CE2-CG 4.46Å; F92-L96 HydrophobicContact CZ-CD1 3.61Å; F92-L96 HydrophobicContact CZ-CG 4.35Å; F92-L96 PolarHBondContact O-N 3.1Å
93W84.3Confident80.7Confident31 Ų3163.5 Ų63.512%0.11735%0.349CS..Hα-helixtrans-63.9-44.1175.5-73104.2000110.8F10 Q89 F90 Y95 L96 A97 C146 I149F10-W93 AromaticContact CE2-CH2 3.7Å; F10-W93 HydrophobicContact CE2-CH2 3.7Å; F10-W93 AromaticContact CE2-CZ2 3.87Å; F10-W93 HydrophobicContact CE2-CZ2 3.87Å; F10-W93 HydrophobicContact CZ-CH2 4.44Å; Q89-W93 PolarHBondContact O-N 2.82Å; F90-W93 PolarHBondContact O-N 3.34Å; W93-Y95 VanDerWaalsContact C-N 3.28Å; W93-Y95 PolarHBondContact O-N 2.87Å; W93-L96 HydrophobicContact CE3-CD1 4.42Å; W93-L96 PolarHBondContact O-N 2.88Å; W93-L96 VanDerWaalsContact O-N 3.12Å; W93-A97 PolarHBondContact O-N 3.33Å; W93-C146 VanDerWaalsContact C-SG 3.58Å; W93-C146 VanDerWaalsContact CE3-SG 3.56Å; W93-C146 PolarHBondContact O-SG 2.97Å; W93-I149 HydrophobicContact CD2-CG2 4.13Å; W93-I149 HydrophobicContact CE3-CB 4.38Å; W93-I149 HydrophobicContact CE3-CG2 4.31Å; W93-I149 HydrophobicContact CH2-CB 4.26Å; W93-I149 HydrophobicContact CH2-CD1 3.83Å; W93-I149 HydrophobicContact CH2-CG2 3.66Å; W93-I149 HydrophobicContact CZ2-CB 4.44Å; W93-I149 HydrophobicContact CZ2-CG2 3.45Å; W93-I149 VanDerWaalsContact CZ2-CG2 3.45Å; W93-I149 HydrophobicContact CZ3-CB 4.24Å; W93-I149 HydrophobicContact CZ3-CD1 3.83Å; W93-I149 HydrophobicContact CZ3-CG2 4.1Å
94T85.4Confident79.9Confident63 Ų6361.7 Ų61.739%0.38734%0.336SS..Hα-helixtrans-59.9-39.4175.7-54.90000111.9F90 V91 A97 Q98F90-T94 VanDerWaalsContact O-CB 3.31Å; F90-T94 WeakPolarHBondContact O-CB 3.45Å; F90-T94 PolarHBondContact O-N 3.44Å; F90-T94 PolarHBondContact O-OG1 2.74Å; V91-T94 PolarHBondContact O-N 3.36Å; T94-A97 WeakPolarHBondContact O-CB 3.35Å; T94-A97 PolarHBondContact O-N 3.2Å; T94-Q98 WeakPolarHBondContact O-CB 3.2Å; T94-Q98 PolarHBondContact O-N 2.92Å
95Y85.1Confident78.6Confident143 Ų14364.4 Ų64.456%0.56133%0.334SS*.Hα-helixtrans-64.7-42.8174.5179.9-99.5000111.9V91 F92 W93 Q98 F99V91-Y95 VanDerWaalsContact O-CB 3.3Å; V91-Y95 WeakPolarHBondContact O-CB 3.44Å; V91-Y95 PolarHBondContact O-N 3.44Å; F92-Y95 PolarHBondContact O-N 3.5Å; W93-Y95 VanDerWaalsContact C-N 3.28Å; W93-Y95 PolarHBondContact O-N 2.87Å; Y95-Q98 PolarHBondContact O-N 2.81Å; Y95-F99 VanDerWaalsContact O-CB 3.28Å; Y95-F99 WeakPolarHBondContact O-CB 3.48Å; Y95-F99 PolarHBondContact O-N 2.95Å
96L82.8Confident76.9Confident33 Ų3368 Ų6817%0.17336%0.357CS..Hα-helixtrans-63.5-39.6173.6-75.5171.5000112.6F6 F92 W93 Q98 A100F6-L96 HydrophobicContact CE2-CD1 4.29Å; F6-L96 HydrophobicContact CE2-CD2 3.87Å; F6-L96 HydrophobicContact CZ-CD1 3.68Å; F6-L96 HydrophobicContact CZ-CD2 3.62Å; F6-L96 HydrophobicContact CZ-CG 4.22Å; F92-L96 HydrophobicContact CD1-CD1 4.04Å; F92-L96 HydrophobicContact CE1-CD1 3.5Å; F92-L96 VanDerWaalsContact CE1-CD1 3.5Å; F92-L96 HydrophobicContact CE2-CD1 4.18Å; F92-L96 HydrophobicContact CE2-CG 4.46Å; F92-L96 HydrophobicContact CZ-CD1 3.61Å; F92-L96 HydrophobicContact CZ-CG 4.35Å; F92-L96 PolarHBondContact O-N 3.1Å; W93-L96 HydrophobicContact CE3-CD1 4.42Å; W93-L96 PolarHBondContact O-N 2.88Å; W93-L96 VanDerWaalsContact O-N 3.12Å; L96-Q98 VanDerWaalsContact C-N 3.32Å; L96-A100 VanDerWaalsContact O-CB 3.22Å; L96-A100 WeakPolarHBondContact O-CB 3.42Å; L96-A100 PolarHBondContact O-N 3.22Å
97A81.9Confident75.5Confident9 Ų972.1 Ų72.17%0.07438%0.382CS..Hα-helixtrans-62.1-43.6174.800000110.8W93 T94 F101 T143 C146W93-A97 PolarHBondContact O-N 3.33Å; T94-A97 WeakPolarHBondContact O-CB 3.35Å; T94-A97 PolarHBondContact O-N 3.2Å; A97-F101 VanDerWaalsContact O-CB 3.28Å; A97-F101 WeakPolarHBondContact O-CB 3.39Å; A97-F101 PolarHBondContact O-N 2.95Å; A97-T143 HydrophobicContact CB-CG2 4.35Å; A97-C146 HydrophobicContact CB-CB 3.9Å
98Q79.9Confident74Confident102 Ų10273.9 Ų73.948%0.47740%0.4SS..Hα-helixtrans-68.9-44.6180-163.6-93.1-82.800111.2T94 Y95 L96 F101 T102T94-Q98 WeakPolarHBondContact O-CB 3.2Å; T94-Q98 PolarHBondContact O-N 2.92Å; Y95-Q98 PolarHBondContact O-N 2.81Å; L96-Q98 VanDerWaalsContact C-N 3.32Å; Q98-F101 PolarHBondContact O-N 3.43Å; Q98-T102 PolarHBondContact NE2-OG1 3.27Å; Q98-T102 PolarHBondContact O-N 3.3Å; Q98-T102 PolarHBondContact O-OG1 2.87Å
99F80.4Confident72Confident122 Ų12275 Ų7554%0.53541%0.412SS..Hα-helixtrans-62.5-41.8175.2178.4-100.5000111.9Y95 T102 G103Y95-F99 VanDerWaalsContact O-CB 3.28Å; Y95-F99 WeakPolarHBondContact O-CB 3.48Å; Y95-F99 PolarHBondContact O-N 2.95Å; F99-T102 PolarHBondContact O-OG1 3.46Å; F99-G103 WeakPolarHBondContact O-CA 3.28Å; F99-G103 PolarHBondContact O-N 2.82Å
100A74.9Confident70.2Confident10 Ų1082.6 Ų82.68%0.08345%0.445CS..Hα-helixtrans-69.2-38.3176.500000112L96 T102 L104 F142L96-A100 VanDerWaalsContact O-CB 3.22Å; L96-A100 WeakPolarHBondContact O-CB 3.42Å; L96-A100 PolarHBondContact O-N 3.22Å; A100-T102 PolarHBondContact O-N 2.93Å; A100-L104 VanDerWaalsContact O-CB 3.31Å; A100-L104 WeakPolarHBondContact O-CB 3.46Å; A100-L104 PolarHBondContact O-N 3.42Å; A100-F142 HydrophobicContact CB-CD1 3.16Å; A100-F142 HydrophobicContact CB-CE1 3.07Å; A100-F142 HydrophobicContact CB-CG 4.23Å; A100-F142 HydrophobicContact CB-CZ 4.06Å
101F70.4Confident68.2Low75 Ų7586 Ų8633%0.32947%0.467SS..Hα-helixtrans-65.2-38.6177.2-173.6-99.1000112.3A97 Q98 R105A97-F101 VanDerWaalsContact O-CB 3.28Å; A97-F101 WeakPolarHBondContact O-CB 3.39Å; A97-F101 PolarHBondContact O-N 2.95Å; Q98-F101 PolarHBondContact O-N 3.43Å; F101-R105 WeakPolarHBondContact O-CB 3.47Å
102T69.4Low66.1Low59 Ų5991.1 Ų91.136%0.36248%0.475SS..Hα-helixtrans-84.9-36.3178.154.80000113.4Q98 F99 A100 R105Q98-T102 PolarHBondContact NE2-OG1 3.27Å; Q98-T102 PolarHBondContact O-N 3.3Å; Q98-T102 PolarHBondContact O-OG1 2.87Å; F99-T102 PolarHBondContact O-OG1 3.46Å; A100-T102 PolarHBondContact O-N 2.93Å; T102-R105 VanDerWaalsContact O-CB 3.23Å; T102-R105 WeakPolarHBondContact O-CB 3.23Å; T102-R105 PolarHBondContact O-N 2.86Å; T102-R105 VanDerWaalsContact O-N 3.11Å
103G63.6Low64.1Low37 Ų3792.6 Ų92.638%0.38150%0.5SS..Hα-helixtrans-70.4-35.4178.500000113F99 R105F99-G103 WeakPolarHBondContact O-CA 3.28Å; F99-G103 PolarHBondContact O-N 2.82Å; G103-R105 VanDerWaalsContact C-N 3.26Å; G103-R105 PolarHBondContact O-N 3.5Å
104L60.1Low62.2Low53 Ų53101 Ų10128%0.27754%0.537SS..THydrogen-bonded Turntrans-78.7-7.1169.4-88.266000113.1A100 D106 W138A100-L104 VanDerWaalsContact O-CB 3.31Å; A100-L104 WeakPolarHBondContact O-CB 3.46Å; A100-L104 PolarHBondContact O-N 3.42Å; L104-D106 VanDerWaalsContact C-N 3.34Å; L104-W138 VanDerWaalsContact CD2-CD1 3.49Å
105R54.1Low59.7Low167 Ų167101.3 Ų101.363%0.6355%0.546SS*.THydrogen-bonded Turntrans-75.8-22.6178.1-171.5170161.1115.20.5112.6F101 T102 G103 R139F101-R105 WeakPolarHBondContact O-CB 3.47Å; T102-R105 VanDerWaalsContact O-CB 3.23Å; T102-R105 WeakPolarHBondContact O-CB 3.23Å; T102-R105 PolarHBondContact O-N 2.86Å; T102-R105 VanDerWaalsContact O-N 3.11Å; G103-R105 VanDerWaalsContact C-N 3.26Å; G103-R105 PolarHBondContact O-N 3.5Å; R105-R139 VanDerWaalsContact CA-NH2 3.3Å; R105-R139 VanDerWaalsContact CB-NH2 3.29Å
106D48.6Very low57.7Low149 Ų149100.6 Ų100.680%0.79756%0.559SS**THydrogen-bonded Turntrans-94.90.2-173.4-96.1-13.8000115.9L104L104-D106 VanDerWaalsContact C-N 3.34Å
107T50.8Low55.7Low103 Ų103104.4 Ų104.463%0.63258%0.584SS**THydrogen-bonded Turntrans-96.13.717851.50000114.3
108G49.8Very low53.9Low71 Ų71109.2 Ų109.273%0.73261%0.612SS**SBendtrans-111-5.5-175.800000116.5
109G46.7Very low52Low68 Ų68109.9 Ų109.970%0.70162%0.624SS**SBendtrans-103.8-22.5-163.900000117.2
110K44.6Very low50.3Low188 Ų188109.8 Ų109.882%0.81763%0.633SS**SBendtrans-146.1134.3179.4-71.6178.8178.5172.20107
111D44Very low49Very low157 Ų157115.5 Ų115.584%0.8467%0.668SS**  trans90.137179.4-48.1-26.4000118.6
112R45Very low47.5Very low205 Ų205114.8 Ų114.877%0.77468%0.681SS**  trans-121.834157.1-80.2-163.8-179.8162.10.4114.8K114R112-K114 PolarHBondContact O-N 3.17Å
113A44.3Very low46.5Very low99 Ų99120.4 Ų120.482%0.81871%0.708SS**SBendtrans-78.6108.7145.600000107
114K44.1Very low45.5Very low208 Ų208122.9 Ų122.990%0.90473%0.725SS**SBendtrans8985.1164.8-146.8176.2-168.1179.40117.5R112R112-K114 PolarHBondContact O-N 3.17Å
115A33.2Very low44.7Very low70 Ų70124.2 Ų124.258%0.57975%0.752SS**  161.4126.3129.800000111.2T117A115-T117 PolarHBondContact O-N 3.45Å
116P44.3Very low44.2Very low128 Ų128123.6 Ų123.683%0.83176%0.758SS**  trans-88.786.8166.834.3-24.8000108.1
117T39Very low43.9Very low113 Ų113126.7 Ų126.769%0.69376%0.758SS**  trans-108.588.1169.937.90000109.2A115 T119A115-T117 PolarHBondContact O-N 3.45Å; T117-T119 PolarHBondContact O-N 3.28Å
118T44Very low43.5Very low109 Ų109126.5 Ų126.567%0.66976%0.761SS**  trans-54.394.3163.2-410000108.7T120T118-T120 VanDerWaalsContact C-N 3.25Å; T118-T120 PolarHBondContact O-N 2.86Å
119T41.7Very low43.3Very low117 Ų117131 Ų13172%0.71876%0.761SS**  trans-78.581.8171.7-52.70000108.5T117 T121T117-T119 PolarHBondContact O-N 3.28Å; T119-T121 WeakPolarHBondContact CG2-OG1 3.44Å; T119-T121 PolarHBondContact O-N 2.9Å; T119-T121 VanDerWaalsContact O-N 3.14Å
120T45.1Very low43.2Very low119 Ų119134.7 Ų134.773%0.7376%0.76SS**  trans-66.6100.9165.5-59.20000108T118T118-T120 VanDerWaalsContact C-N 3.25Å; T118-T120 PolarHBondContact O-N 2.86Å
121T46.3Very low43.5Very low131 Ų131131.1 Ų131.180%0.80475%0.747SS**  trans-125.596.8167.5-47.50000108.4T119T119-T121 WeakPolarHBondContact CG2-OG1 3.44Å; T119-T121 PolarHBondContact O-N 2.9Å; T119-T121 VanDerWaalsContact O-N 3.14Å
122G39.5Very low43.8Very low60 Ų60128 Ų12862%0.61973%0.731SS**SBendtrans168.2122.1172.300000111.9A124G122-A124 PolarHBondContact O-N 3.35Å
123L48.6Very low44.1Very low177 Ų177122.7 Ų122.793%0.92772%0.717SS**SBendtrans-44.8130.9178.6-85.382.7000113.2
124A41.7Very low44.4Very low89 Ų89119.9 Ų119.974%0.73670%0.698SS**SBendtrans45.784.6150.700000117.5G122 M126G122-A124 PolarHBondContact O-N 3.35Å; A124-M126 VanDerWaalsContact C-N 3.29Å; A124-M126 PolarHBondContact O-N 3.38Å
125G43.5Very low45.2Very low81 Ų81112.6 Ų112.684%0.83567%0.673SS**SBend66-15.7126.300000121.9
126M44.1Very low46.5Very low154 Ų154113.7 Ų113.776%0.75967%0.669SS**SBendtrans-112.9-16.6-173.9-160.770.566.800113.7A124A124-M126 VanDerWaalsContact C-N 3.29Å; A124-M126 PolarHBondContact O-N 3.38Å
127W40.9Very low47.6Very low214 Ų214111 Ų11181%0.81166%0.658SS**  trans-138.252.2-179.7-59.492.2000110.4F129W127-F129 PolarHBondContact O-N 3.39Å
128S42.9Very low49.2Very low98 Ų98110.5 Ų110.569%0.68564%0.643SS**  trans-69.583.6172.844.30000109.3E130S128-E130 PolarHBondContact O-N 3.03Å
129F45.6Very low50.5Low166 Ų166107.5 Ų107.573%0.72862%0.62SS**  trans-66.391.9154.5-79.2-77000106.2W127 M131W127-F129 PolarHBondContact O-N 3.39Å; F129-M131 PolarHBondContact O-N 3.01Å
130E45.9Very low52.1Low145 Ų145109 Ų10968%0.67861%0.613SS**  trans-51.390.6163.6-163.684.3-157.700106.9S128 N132S128-E130 PolarHBondContact O-N 3.03Å; E130-N132 PolarHBondContact O-N 3.22Å
131M49.7Very low53.8Low114 Ų114105.2 Ų105.256%0.56260%0.598SS**  trans-77.167.9-177.1-96-169.3156.200108.8F129 L133 W138F129-M131 PolarHBondContact O-N 3.01Å; M131-L133 HydrophobicContact CB-CD1 4.23Å; M131-L133 HydrophobicContact CB-CG 4.28Å; M131-L133 PolarHBondContact O-N 3.31Å; M131-W138 HydrophobicContact CE-CH2 3.95Å; M131-W138 HydrophobicContact CE-CZ2 4.16Å; M131-W138 HydrophobicContact CE-CZ3 4.48Å
132N49.9Very low55.5Low91 Ų91103.4 Ų103.449%0.48758%0.579SS.*  trans-75.575.2162-136-57000107.3E130 G134 S135E130-N132 PolarHBondContact O-N 3.22Å; N132-G134 PolarHBondContact O-N 3.03Å; N132-S135 WeakPolarHBondContact O-CB 3.31Å; N132-S135 PolarHBondContact O-N 3.24Å
133L52.3Low57.5Low94 Ų94101.9 Ų101.949%0.49256%0.558SS.*THydrogen-bonded Turntrans-57.3-8.5-176.9-72.1134.7000114M131M131-L133 HydrophobicContact CB-CD1 4.23Å; M131-L133 HydrophobicContact CB-CG 4.28Å; M131-L133 PolarHBondContact O-N 3.31Å
134G50.6Low59.2Low40 Ų4098.8 Ų98.841%0.41254%0.542SS..THydrogen-bonded Turntrans-102.7-5.1174.200000115.2N132N132-G134 PolarHBondContact O-N 3.03Å
135S60.2Low61.4Low55 Ų5595.9 Ų95.939%0.38552%0.52SS..SBendtrans-76140178.9-178.60000111.1N132 A137 W138N132-S135 WeakPolarHBondContact O-CB 3.31Å; N132-S135 PolarHBondContact O-N 3.24Å; S135-A137 PolarHBondContact O-N 3.38Å; S135-W138 PolarHBondContact O-N 2.91Å
136N61.1Low63.4Low93 Ų9392.3 Ų92.350%0.49748%0.482SS..Hα-helixtrans-52.7-27.2177.6-69.3-48.9000112.5R139 Y140N136-R139 PolarHBondContact O-N 2.92Å; N136-Y140 HydrophobicContact CB-CD2 4.13Å; N136-Y140 HydrophobicContact CB-CE2 3.89Å; N136-Y140 WeakPolarHBondContact O-CD2 3.46Å; N136-Y140 PolarHBondContact O-N 2.92Å
137A68.1Low65.5Low72 Ų7289.3 Ų89.360%0.59547%0.469SS*.Hα-helixtrans-61.3-42.3176.300000113.9S135 G141S135-A137 PolarHBondContact O-N 3.38Å; A137-G141 PolarHBondContact O-N 2.77Å
138W71.8Confident67.8Low102 Ų10283 Ų8339%0.38645%0.454SS..Hα-helixtrans-71-34.6177.9-178.5-111000111.7L104 M131 S135 G141 F142L104-W138 VanDerWaalsContact CD2-CD1 3.49Å; M131-W138 HydrophobicContact CE-CH2 3.95Å; M131-W138 HydrophobicContact CE-CZ2 4.16Å; M131-W138 HydrophobicContact CE-CZ3 4.48Å; S135-W138 PolarHBondContact O-N 2.91Å; W138-G141 PolarHBondContact O-N 2.83Å; W138-F142 WeakPolarHBondContact O-CB 3.35Å; W138-F142 PolarHBondContact O-N 3.12Å
139R70.3Confident70Confident45 Ų4582.2 Ų82.217%0.1744%0.441CS..Hα-helixtrans-64.7-50.7177.1-55.3172.579.3172.78.8110.5R105 N136 T143R105-R139 VanDerWaalsContact CA-NH2 3.3Å; R105-R139 VanDerWaalsContact CB-NH2 3.29Å; N136-R139 PolarHBondContact O-N 2.92Å; R139-T143 WeakPolarHBondContact O-CB 3.49Å; R139-T143 PolarHBondContact O-N 3.3Å; R139-T143 VanDerWaalsContact O-N 3.11Å; R139-T143 PolarHBondContact O-OG1 3.3Å; R139-T143 VanDerWaalsContact O-OG1 3.07Å
140Y75.1Confident71.8Confident149 Ų14974.3 Ų74.358%0.58441%0.407SS*.Hα-helixtrans-66.8-36.8175-68.8-59.9000111.8N136 L144N136-Y140 HydrophobicContact CB-CD2 4.13Å; N136-Y140 HydrophobicContact CB-CE2 3.89Å; N136-Y140 WeakPolarHBondContact O-CD2 3.46Å; N136-Y140 PolarHBondContact O-N 2.92Å; Y140-L144 WeakPolarHBondContact O-CA 3.48Å; Y140-L144 WeakPolarHBondContact O-CB 3.48Å; Y140-L144 PolarHBondContact O-N 2.96Å
141G82.7Confident73.6Confident39 Ų3970 Ų7040%0.40240%0.396SS..Hα-helixtrans-62.3-47.2177.700000112.9A137 W138 L144 G145A137-G141 PolarHBondContact O-N 2.77Å; W138-G141 PolarHBondContact O-N 2.83Å; G141-L144 PolarHBondContact O-N 3.44Å; G141-G145 PolarHBondContact O-N 2.78Å
142F81.3Confident75.5Confident94 Ų9466.6 Ų66.641%0.41239%0.39SS..Hα-helixtrans-67.5-45.6178.2-172.1-85.6000111.8A100 W138 L144 G145 C146A100-F142 HydrophobicContact CB-CD1 3.16Å; A100-F142 HydrophobicContact CB-CE1 3.07Å; A100-F142 HydrophobicContact CB-CG 4.23Å; A100-F142 HydrophobicContact CB-CZ 4.06Å; W138-F142 WeakPolarHBondContact O-CB 3.35Å; W138-F142 PolarHBondContact O-N 3.12Å; F142-L144 VanDerWaalsContact C-N 3.34Å; F142-L144 PolarHBondContact O-N 2.86Å; F142-G145 PolarHBondContact O-N 3.47Å; F142-C146 VanDerWaalsContact O-CB 3.31Å; F142-C146 WeakPolarHBondContact O-CB 3.25Å; F142-C146 PolarHBondContact O-N 3.32Å
143T82Confident77.1Confident28 Ų2863.2 Ų63.217%0.17237%0.371CS..Hα-helixtrans-61.5-42.6176-62.20000111.5A97 R139 C146 L147A97-T143 HydrophobicContact CB-CG2 4.35Å; R139-T143 WeakPolarHBondContact O-CB 3.49Å; R139-T143 PolarHBondContact O-N 3.3Å; R139-T143 VanDerWaalsContact O-N 3.11Å; R139-T143 PolarHBondContact O-OG1 3.3Å; R139-T143 VanDerWaalsContact O-OG1 3.07Å; T143-C146 WeakPolarHBondContact O-CB 3Å; T143-C146 PolarHBondContact O-N 3.47Å; T143-L147 HydrophobicContact CG2-CD1 4.16Å; T143-L147 WeakPolarHBondContact O-CB 3.23Å; T143-L147 PolarHBondContact O-N 2.89Å
144L84.4Confident78.5Confident112 Ų11261.4 Ų61.459%0.58636%0.364SS*.Hα-helixtrans-66.2-43.3177.7-173.566.5000111.2Y140 G141 F142 C146 L147 T148Y140-L144 WeakPolarHBondContact O-CA 3.48Å; Y140-L144 WeakPolarHBondContact O-CB 3.48Å; Y140-L144 PolarHBondContact O-N 2.96Å; G141-L144 PolarHBondContact O-N 3.44Å; F142-L144 VanDerWaalsContact C-N 3.34Å; F142-L144 PolarHBondContact O-N 2.86Å; L144-C146 VanDerWaalsContact C-N 3.3Å; L144-C146 PolarHBondContact O-N 3.38Å; L144-L147 PolarHBondContact O-N 3.48Å; L144-T148 HydrophobicContact CD1-CG2 4.48Å; L144-T148 HydrophobicContact CG-CG2 4.39Å; L144-T148 VanDerWaalsContact O-CG2 3.25Å; L144-T148 WeakPolarHBondContact O-CG2 3.28Å; L144-T148 PolarHBondContact O-N 2.9Å; L144-T148 PolarHBondContact O-OG1 2.84Å
145G87.2Confident80Confident27 Ų2761.4 Ų61.428%0.27836%0.364SS..Hα-helixtrans-60.7-39.6175.100000112.7G141 F142 T148 I149G141-G145 PolarHBondContact O-N 2.78Å; F142-G145 PolarHBondContact O-N 3.47Å; G145-T148 WeakPolarHBondContact CA-OG1 3.31Å; G145-T148 PolarHBondContact O-OG1 2.85Å; G145-I149 WeakPolarHBondContact O-CD1 3.4Å; G145-I149 VanDerWaalsContact O-CG1 3.26Å; G145-I149 WeakPolarHBondContact O-CG1 3.42Å; G145-I149 PolarHBondContact O-N 3.36Å; G145-I149 VanDerWaalsContact O-N 3.15Å
146C86.1Confident81Confident6 Ų661.5 Ų61.54%0.04136%0.36CS..Hα-helixtrans-65.7-44.3176.1-165.80000112W93 A97 F142 T143 L144 G150W93-C146 VanDerWaalsContact C-SG 3.58Å; W93-C146 VanDerWaalsContact CE3-SG 3.56Å; W93-C146 PolarHBondContact O-SG 2.97Å; A97-C146 HydrophobicContact CB-CB 3.9Å; F142-C146 VanDerWaalsContact O-CB 3.31Å; F142-C146 WeakPolarHBondContact O-CB 3.25Å; F142-C146 PolarHBondContact O-N 3.32Å; T143-C146 WeakPolarHBondContact O-CB 3Å; T143-C146 PolarHBondContact O-N 3.47Å; L144-C146 VanDerWaalsContact C-N 3.3Å; L144-C146 PolarHBondContact O-N 3.38Å; C146-G150 PolarHBondContact O-N 3.28Å
147L86.9Confident81.7Confident92 Ų9257.4 Ų57.448%0.48234%0.34SS..Hα-helixtrans-65.8-40.1176.5-103.5149.7000112.7T143 L144 G150 A151T143-L147 HydrophobicContact CG2-CD1 4.16Å; T143-L147 WeakPolarHBondContact O-CB 3.23Å; T143-L147 PolarHBondContact O-N 2.89Å; L144-L147 PolarHBondContact O-N 3.48Å; L147-G150 PolarHBondContact O-N 3.38Å; L147-A151 WeakPolarHBondContact O-CB 3.46Å; L147-A151 PolarHBondContact O-N 3.14Å
148T90.1Very high81.7Confident82 Ų8255.9 Ų55.950%0.50333%0.328SS..Hα-helixtrans-66.8-41.1179.253.60000111.4L144 G145 G152L144-T148 HydrophobicContact CD1-CG2 4.48Å; L144-T148 HydrophobicContact CG-CG2 4.39Å; L144-T148 VanDerWaalsContact O-CG2 3.25Å; L144-T148 WeakPolarHBondContact O-CG2 3.28Å; L144-T148 PolarHBondContact O-N 2.9Å; L144-T148 PolarHBondContact O-OG1 2.84Å; G145-T148 WeakPolarHBondContact CA-OG1 3.31Å; G145-T148 PolarHBondContact O-OG1 2.85Å; T148-G152 PolarHBondContact O-N 3.15Å
149I88Confident81.8Confident80 Ų8055.8 Ų55.841%0.4133%0.334SS..Hα-helixtrans-65.6-47.6175.3-64.1166000110.5W93 G145 A151 G152 I153W93-I149 HydrophobicContact CD2-CG2 4.13Å; W93-I149 HydrophobicContact CE3-CB 4.38Å; W93-I149 HydrophobicContact CE3-CG2 4.31Å; W93-I149 HydrophobicContact CH2-CB 4.26Å; W93-I149 HydrophobicContact CH2-CD1 3.83Å; W93-I149 HydrophobicContact CH2-CG2 3.66Å; W93-I149 HydrophobicContact CZ2-CB 4.44Å; W93-I149 HydrophobicContact CZ2-CG2 3.45Å; W93-I149 VanDerWaalsContact CZ2-CG2 3.45Å; W93-I149 HydrophobicContact CZ3-CB 4.24Å; W93-I149 HydrophobicContact CZ3-CD1 3.83Å; W93-I149 HydrophobicContact CZ3-CG2 4.1Å; G145-I149 WeakPolarHBondContact O-CD1 3.4Å; G145-I149 VanDerWaalsContact O-CG1 3.26Å; G145-I149 WeakPolarHBondContact O-CG1 3.42Å; G145-I149 PolarHBondContact O-N 3.36Å; G145-I149 VanDerWaalsContact O-N 3.15Å; I149-A151 PolarHBondContact O-N 3.42Å; I149-G152 PolarHBondContact O-N 2.77Å; I149-I153 HydrophobicContact CG2-CD1 4.12Å; I149-I153 WeakPolarHBondContact O-CG1 3.45Å; I149-I153 PolarHBondContact O-N 3.38Å
150G84.4Confident81.7Confident1 Ų157.3 Ų57.31%0.0134%0.342CS..Hα-helixtrans-59.1-44.9176.800000112.9C146 L147 G152 I153 V154C146-G150 PolarHBondContact O-N 3.28Å; L147-G150 PolarHBondContact O-N 3.38Å; G150-G152 VanDerWaalsContact C-N 3.34Å; G150-G152 PolarHBondContact O-N 2.93Å; G150-I153 PolarHBondContact O-N 2.96Å; G150-V154 WeakPolarHBondContact O-CG2 3.26Å; G150-V154 PolarHBondContact O-N 3.49Å; G150-V154 VanDerWaalsContact O-N 3.1Å
151A84.4Confident80.9Confident54 Ų5452 Ų5245%0.44633%0.326SS..Hα-helixtrans-65.8-35175.700000112.4L147 I149 G155L147-A151 WeakPolarHBondContact O-CB 3.46Å; L147-A151 PolarHBondContact O-N 3.14Å; I149-A151 PolarHBondContact O-N 3.42Å; A151-G155 WeakPolarHBondContact O-CA 3.24Å; A151-G155 PolarHBondContact O-N 3.31Å
152G88.4Confident79.5Confident42 Ų4260.3 Ų60.343%0.43335%0.345SS..Hα-helixtrans-62.5-45.4174.400000112.3T148 I149 G150 G155 L156T148-G152 PolarHBondContact O-N 3.15Å; I149-G152 PolarHBondContact O-N 2.77Å; G150-G152 VanDerWaalsContact C-N 3.34Å; G150-G152 PolarHBondContact O-N 2.93Å; G152-G155 PolarHBondContact O-N 3.02Å; G152-L156 WeakPolarHBondContact O-CB 3.31Å; G152-L156 PolarHBondContact O-N 2.95Å
153I84.2Confident78.2Confident20 Ų2063.9 Ų63.910%0.10336%0.356CS..Hα-helixtrans-64.2-45.3177.7-64.1165.4000110.8L17 Q89 I149 G150 G157L17-I153 HydrophobicContact CD1-CD1 4.44Å; L17-I153 HydrophobicContact CD1-CG1 4.29Å; Q89-I153 HydrophobicContact CB-CG2 4.33Å; I149-I153 HydrophobicContact CG2-CD1 4.12Å; I149-I153 WeakPolarHBondContact O-CG1 3.45Å; I149-I153 PolarHBondContact O-N 3.38Å; G150-I153 PolarHBondContact O-N 2.96Å; I153-G157 PolarHBondContact O-N 2.72Å
154V81.4Confident76.2Confident56 Ų5665.3 Ų65.334%0.33937%0.367SS..Hα-helixtrans-67.6-41.9177.81740000111.4F90 G150 G157 A158F90-V154 HydrophobicContact CB-CG2 3.9Å; F90-V154 HydrophobicContact CD2-CG2 3.81Å; F90-V154 HydrophobicContact CG-CG2 4.12Å; G150-V154 WeakPolarHBondContact O-CG2 3.26Å; G150-V154 PolarHBondContact O-N 3.49Å; G150-V154 VanDerWaalsContact O-N 3.1Å; V154-G157 PolarHBondContact O-N 2.93Å; V154-A158 WeakPolarHBondContact O-CB 3.32Å; V154-A158 PolarHBondContact O-N 3.36Å
155G82.5Confident74.4Confident40 Ų4063.9 Ų63.941%0.41236%0.363SS..Hα-helixtrans-64.1-44.9178.700000111.9A151 G152 A158 L159A151-G155 WeakPolarHBondContact O-CA 3.24Å; A151-G155 PolarHBondContact O-N 3.31Å; G152-G155 PolarHBondContact O-N 3.02Å; G155-A158 PolarHBondContact O-N 2.86Å; G155-L159 WeakPolarHBondContact O-CB 3.25Å; G155-L159 PolarHBondContact O-N 2.88Å
156L81.3Confident72.2Confident57 Ų5764.6 Ų64.630%0.29836%0.364SS..Hα-helixtrans-64.7-47174.8-17060.5000110.5L17 L21 G152 A158 L159 F160L17-L156 HydrophobicContact CD2-CD2 4.47Å; L21-L156 HydrophobicContact CD2-CD2 4.19Å; G152-L156 WeakPolarHBondContact O-CB 3.31Å; G152-L156 PolarHBondContact O-N 2.95Å; L156-A158 PolarHBondContact O-N 3.28Å; L156-L159 PolarHBondContact O-N 3.19Å; L156-F160 HydrophobicContact CD1-CD2 3.87Å; L156-F160 HydrophobicContact CD1-CE2 3.48Å; L156-F160 VanDerWaalsContact CD1-CE2 3.48Å; L156-F160 HydrophobicContact CD2-CE2 4.1Å; L156-F160 HydrophobicContact CG-CD2 3.72Å; L156-F160 HydrophobicContact CG-CE2 3.53Å; L156-F160 WeakPolarHBondContact O-CB 3.42Å; L156-F160 WeakPolarHBondContact O-CD2 3.34Å; L156-F160 PolarHBondContact O-N 2.7Å
157G75.5Confident70Confident7 Ų768 Ų687%0.07238%0.378CS..Hα-helixtrans-56.8-45.7174.400000112.9I153 V154 F160 C161I153-G157 PolarHBondContact O-N 2.72Å; V154-G157 PolarHBondContact O-N 2.93Å; G157-F160 PolarHBondContact O-N 2.86Å; G157-C161 WeakPolarHBondContact O-CB 3.23Å; G157-C161 PolarHBondContact O-N 2.85Å; G157-C161 PolarHBondContact O-SG 2.8Å
158A68.2Low67.7Low41 Ų4167.8 Ų67.834%0.33938%0.38SS..Hα-helixtrans-67.8-35.817700000112.5V154 G155 L156 C161 R162V154-A158 WeakPolarHBondContact O-CB 3.32Å; V154-A158 PolarHBondContact O-N 3.36Å; G155-A158 PolarHBondContact O-N 2.86Å; L156-A158 PolarHBondContact O-N 3.28Å; A158-C161 PolarHBondContact O-N 2.88Å; A158-R162 VanDerWaalsContact O-CB 3.31Å; A158-R162 WeakPolarHBondContact O-CB 3.18Å; A158-R162 WeakPolarHBondContact O-CG 3.14Å; A158-R162 PolarHBondContact O-N 3.39Å
159L73.9Confident65.2Low100 Ų10065.5 Ų65.552%0.52437%0.366SS..Hα-helixtrans-68.6-39.8174.8-172.3134000111.1G155 L156 R162 R163G155-L159 WeakPolarHBondContact O-CB 3.25Å; G155-L159 PolarHBondContact O-N 2.88Å; L156-L159 PolarHBondContact O-N 3.19Å; L159-R162 PolarHBondContact O-N 2.95Å; L159-R163 VanDerWaalsContact O-CB 3.25Å; L159-R163 WeakPolarHBondContact O-CB 3.22Å; L159-R163 PolarHBondContact O-N 2.93Å
160F67.8Low62.8Low76 Ų7666.3 Ų66.333%0.33337%0.371SS..Hα-helixtrans-64.1-43.4170.9-86.2-72.7000111.8V20 A24 L156 G157 R162 R163 S164V20-F160 HydrophobicContact CG1-CE2 4.46Å; V20-F160 HydrophobicContact CG1-CZ 4.38Å; A24-F160 HydrophobicContact CB-CZ 4.41Å; L156-F160 HydrophobicContact CD1-CD2 3.87Å; L156-F160 HydrophobicContact CD1-CE2 3.48Å; L156-F160 VanDerWaalsContact CD1-CE2 3.48Å; L156-F160 HydrophobicContact CD2-CE2 4.1Å; L156-F160 HydrophobicContact CG-CD2 3.72Å; L156-F160 HydrophobicContact CG-CE2 3.53Å; L156-F160 WeakPolarHBondContact O-CB 3.42Å; L156-F160 WeakPolarHBondContact O-CD2 3.34Å; L156-F160 PolarHBondContact O-N 2.7Å; G157-F160 PolarHBondContact O-N 2.86Å; F160-R162 VanDerWaalsContact C-N 3.34Å; F160-R162 PolarHBondContact O-N 3.47Å; F160-R163 PolarHBondContact O-N 2.78Å; F160-S164 VanDerWaalsContact O-CB 3.23Å; F160-S164 WeakPolarHBondContact O-CB 3.46Å; F160-S164 PolarHBondContact O-N 2.92Å
161C57.7Low60.4Low37 Ų3770 Ų7025%0.2539%0.388CS..Hα-helixtrans-60.9-42.2173.3-69.40000112.2F79 L82 G157 A158 R163 S164F79-C161 HydrophobicContact CE1-CB 4.35Å; L82-C161 VanDerWaalsContact CD2-SG 3.53Å; G157-C161 WeakPolarHBondContact O-CB 3.23Å; G157-C161 PolarHBondContact O-N 2.85Å; G157-C161 PolarHBondContact O-SG 2.8Å; A158-C161 PolarHBondContact O-N 2.88Å; C161-R163 VanDerWaalsContact C-N 3.34Å; C161-S164 CarbonylContact O-C 3.6Å; C161-S164 PolarHBondContact O-N 2.8Å; C161-S164 VanDerWaalsContact O-O 3.13Å
162R53.1Low58Low214 Ų21471.6 Ų71.681%0.80839%0.385SS*.Hα-helixtrans-68.8-31176.4-82.6179.1154.7144.7-3.8113.1A158 L159 F160A158-R162 VanDerWaalsContact O-CB 3.31Å; A158-R162 WeakPolarHBondContact O-CB 3.18Å; A158-R162 WeakPolarHBondContact O-CG 3.14Å; A158-R162 PolarHBondContact O-N 3.39Å; L159-R162 PolarHBondContact O-N 2.95Å; F160-R162 VanDerWaalsContact C-N 3.34Å; F160-R162 PolarHBondContact O-N 3.47Å
163R53.7Low55.7Low170 Ų17073.1 Ų73.164%0.64240%0.4SS*.Hα-helixtrans-84.1-12177.3-165.9170.9178155.5-2.7112.7L159 F160 C161L159-R163 VanDerWaalsContact O-CB 3.25Å; L159-R163 WeakPolarHBondContact O-CB 3.22Å; L159-R163 PolarHBondContact O-N 2.93Å; F160-R163 PolarHBondContact O-N 2.78Å; C161-R163 VanDerWaalsContact C-N 3.34Å
164S41.4Very low53.5Low57 Ų5775 Ų7540%0.39942%0.424SS..  trans-115.289.4-179.6-166.50000111.3F79 F160 C161F79-S164 WeakPolarHBondContact CZ-O 3.15Å; F160-S164 VanDerWaalsContact O-CB 3.23Å; F160-S164 WeakPolarHBondContact O-CB 3.46Å; F160-S164 PolarHBondContact O-N 2.92Å; C161-S164 CarbonylContact O-C 3.6Å; C161-S164 PolarHBondContact O-N 2.8Å; C161-S164 VanDerWaalsContact O-O 3.13Å
165V46.3Very low51.5Low82 Ų8282 Ų8250%0.49744%0.444SS..  trans-128.9108.3167.1175.40000103.7F224V165-F224 HydrophobicContact CB-CE1 4.26Å; V165-F224 WeakPolarHBondContact O-CD1 3.06Å; V165-F224 WeakPolarHBondContact O-CE1 3.45Å
166S41.2Very low49.2Very low43 Ų4384.2 Ų84.230%0.30145%0.445SS..  cis68.981.742.8-142.20000113.2H73H73-S166 PolarHBondContact O-OG 3.33Å
167K39Very low47.1Very low76 Ų7682.9 Ų82.933%0.3344%0.439SS..  trans96.6116.4157.3-141.2179176.1-176.40117.1F71 E72 V169F71-K167 WeakPolarHBondContact O-CG 3.44Å; E72-K167 HydrophobicContact CG-CD 4.5Å; E72-K167 VanDerWaalsContact CG-CE 3.46Å; E72-K167 IonicContact OE1-NZ 2.62Å; E72-K167 PolarHBondContact OE1-NZ 3.07Å; E72-K167 WeakPolarHBondContact OE2-CE 3.31Å; E72-K167 IonicContact OE2-NZ 2.76Å; E72-K167 PolarHBondContact OE2-NZ 3.45Å; K167-V169 HydrophobicContact CD-CG2 4.34Å; K167-V169 HydrophobicContact CG-CG2 4.22Å
168V38.3Very low45.2Very low89 Ų8983.6 Ų83.654%0.53944%0.443SS..  trans-116.7113.8165.8178.30000106.2V177V168-V177 HydrophobicContact CG1-CG1 4.26Å
169V38.4Very low43.9Very low33 Ų3385.3 Ų85.320%0.245%0.449CS..EExtended strand (participates in β ladder)trans-95.8117.3176.2-179.80000107.9K167K167-V169 HydrophobicContact CD-CG2 4.34Å; K167-V169 HydrophobicContact CG-CG2 4.22Å
170L36.8Very low42Very low98 Ų9889.8 Ų89.851%0.51346%0.459SS..EExtended strand (participates in β ladder)trans-90.1110.2173.9-149.678.5000108V177L170-V177 HydrophobicContact CD1-CG2 4.12Å
171H35.8Very low40.4Very low79 Ų7990.2 Ų90.237%0.36647%0.468SS..  trans-76.5143.5172.3-78.1-84.8000110.3G173 T178H171-G173 PolarHBondContact O-N 2.98Å; H171-T178 PolarHBondContact CD2-OG1 3.36Å
172K33.8Very low39.4Very low87 Ų8795.1 Ų95.138%0.37849%0.487SS..THydrogen-bonded Turntrans-64129.2178.6-81.3-171.6165.1-176.10111.3P64 K66 D67P64-K172 WeakPolarHBondContact O-CD 3.36Å; P64-K172 WeakPolarHBondContact O-CE 3.41Å; P64-K172 PolarHBondContact O-NZ 3.49Å; K66-K172 WeakPolarHBondContact O-CD 3.33Å; K66-K172 WeakPolarHBondContact O-CE 3.47Å; K66-K172 PolarHBondContact O-NZ 2.98Å; D67-K172 VanDerWaalsContact OD1-CB 3.29Å; D67-K172 WeakPolarHBondContact OD1-CB 3.2Å; D67-K172 PolarHBondContact OD1-N 3.42Å
173G38.8Very low38.7Very low73 Ų7387.6 Ų87.675%0.75347%0.467SS*.THydrogen-bonded Turntrans130.4-2.1175.700000114.8H171 R175H171-G173 PolarHBondContact O-N 2.98Å; G173-R175 PolarHBondContact O-N 2.91Å
174G39Very low37.9Very low60 Ų6085.8 Ų85.862%0.61948%0.477SS*.SBendtrans59.122.9168.100000115.1L197G174-L197 VanDerWaalsContact C-CD1 3.47Å
175R39Very low38Very low202 Ų20291.1 Ų91.176%0.76250%0.5SS*.SBendtrans-131.4-10.3-177.7-139168.771.2167.61.4115.8G173G173-R175 PolarHBondContact O-N 2.91Å
176M33.5Very low37.5Very low88 Ų8888.7 Ų88.743%0.43349%0.492SS..  trans-145127.2179.3-63.4-75.3-94.200110.7N194M176-N194 HydrophobicContact CE-CB 3.62Å; M176-N194 HydrophobicContact SD-CB 4.48Å
177V37.1Very low37.6Very low28 Ų2893.8 Ų93.817%0.1752%0.524CS..EExtended strand (participates in β ladder)trans-103.6120.3168.2177.40000107.4V168 L170 V179 V195 L197V168-V177 HydrophobicContact CG1-CG1 4.26Å; L170-V177 HydrophobicContact CD1-CG2 4.12Å; V177-V179 HydrophobicContact CG1-CG2 4.44Å; V177-V195 PolarHBondContact N-O 2.97Å; V177-V195 PolarHBondContact O-N 3.06Å; V177-L197 HydrophobicContact CG2-CD1 3.85Å; V177-L197 HydrophobicContact CG2-CD2 4.08Å; V177-L197 HydrophobicContact CG2-CG 3.8Å
178T37.5Very low37.9Very low23 Ų2397.6 Ų97.614%0.14155%0.548CS..EExtended strand (participates in β ladder)trans-96.2108179.3-52.60000108.5H171 R180 T192H171-T178 PolarHBondContact CD2-OG1 3.36Å; T178-R180 PolarHBondContact O-N 3.13Å; T178-T192 HydrophobicContact CG2-CG2 3.39Å
179V39Very low38.2Very low77 Ų77104 Ų10447%0.46756%0.563SS.*EExtended strand (participates in β ladder)trans-87.4105.8173.2-178.40000107.8V177V177-V179 HydrophobicContact CG1-CG2 4.44Å
180R34.7Very low38.2Very low194 Ų194103.9 Ų103.973%0.73257%0.568SS**EExtended strand (participates in β ladder)trans-85.1109.1168.5-84.5-168.1171.1142.5-2.2109.2T178 Q182T178-R180 PolarHBondContact O-N 3.13Å; R180-Q182 PolarHBondContact O-N 3.24Å
181T33.6Very low38.3Very low85 Ų85109.1 Ų109.152%0.52158%0.581SS.*  trans-75.9114.4167.3-2.20000107.9S183 G190 R191T181-S183 PolarHBondContact O-N 2.9Å; T181-G190 WeakPolarHBondContact O-CA 3.3Å; T181-R191 PolarHBondContact OG1-O 3.35Å
182Q36.9Very low38.5Very low140 Ų140108.7 Ų108.765%0.65458%0.584SS**  trans-68117.6168.5-72.8-16840.200108.3R180R180-Q182 PolarHBondContact O-N 3.24Å
183S38.1Very low38.7Very low55 Ų55109 Ų10939%0.38559%0.589SS.*  trans-88.8132.3171.5-160.80000108.1T181 L185T181-S183 PolarHBondContact O-N 2.9Å; S183-L185 PolarHBondContact O-N 3.47Å
184P38.8Very low38.3Very low133 Ų133109.5 Ų109.586%0.86458%0.575SS**THydrogen-bonded Turntrans-68.15.6-176.626.4-33.8000114.8
185L42.7Very low38.4Very low168 Ų168110.8 Ų110.888%0.8857%0.57SS**THydrogen-bonded Turntrans-112.516-174.3-88.4158.9000114.6S183S183-L185 PolarHBondContact O-N 3.47Å
186G35.5Very low38.2Very low32 Ų32105.6 Ų105.633%0.3356%0.562SS.*  trans136.9150170.600000112.8D188G186-D188 PolarHBondContact O-N 3.48Å
187P44.3Very low38.4Very low149 Ų149105.2 Ų105.297%0.96856%0.562SS**THydrogen-bonded Turntrans-64.6-3.6-175.923.2-31.4000115.1
188D44.1Very low38.7Very low156 Ų156111.6 Ų111.683%0.83460%0.595SS**THydrogen-bonded Turntrans-117.23.3-167.6-162.553.5000115.9G186G186-D188 PolarHBondContact O-N 3.48Å
189R45.1Very low38.6Very low224 Ų224117.4 Ų117.485%0.84562%0.62SS**  trans-129.343.7179.5-94.4-172.6-173.3172.73.3114.5
190G38.3Very low38.4Very low31 Ų31117.6 Ų117.632%0.3262%0.622SS.*  trans-88.2113.8169.600000111.6T181 T192T181-G190 WeakPolarHBondContact O-CA 3.3Å; G190-T192 PolarHBondContact O-N 3.48Å
191R39.1Very low38.4Very low207 Ų207112.9 Ų112.978%0.78162%0.624SS**  trans-59.5121173.6-170.5173.1-176.4-172.20.8109.3T181T181-R191 PolarHBondContact OG1-O 3.35Å
192T38.7Very low38.5Very low71 Ų71113.8 Ų113.844%0.43663%0.633SS.*EExtended strand (participates in β ladder)trans-90.9119.9-179.4-620000109.1T178 G190T178-T192 HydrophobicContact CG2-CG2 3.39Å; G190-T192 PolarHBondContact O-N 3.48Å
193I39.8Very low38.4Very low94 Ų94116.3 Ų116.348%0.48264%0.644SS.*EExtended strand (participates in β ladder)trans-115.3118.1174.3-57176.9000107.8V195I193-V195 HydrophobicContact CG2-CG2 4.21Å
194N29.6Very low38.4Very low83 Ų83118.4 Ų118.444%0.44467%0.665SS.*EExtended strand (participates in β ladder)trans-89123.5178.9-66.9-35.2000109.1M176M176-N194 HydrophobicContact CE-CB 3.62Å; M176-N194 HydrophobicContact SD-CB 4.48Å
195V40.8Very low38.2Very low87 Ų87120.4 Ų120.453%0.52766%0.662SS.*EExtended strand (participates in β ladder)trans-124.9126.5173.9-173.80000110V177 I193V177-V195 PolarHBondContact N-O 2.97Å; V177-V195 PolarHBondContact O-N 3.06Å; I193-V195 HydrophobicContact CG2-CG2 4.21Å
196P34.7Very low38.4Very low92 Ų92122.9 Ų122.960%0.59766%0.66SS**  trans-84.5154.7-174.830.7-32.9000114.7N198P196-N198 PolarHBondContact O-N 3.11Å
197L38.8Very low38.6Very low81 Ų81128.7 Ų128.742%0.42468%0.679SS.*SBendtrans-80.326-159.6-93.2147.8000117.7G174 V177G174-L197 VanDerWaalsContact C-CD1 3.47Å; V177-L197 HydrophobicContact CG2-CD1 3.85Å; V177-L197 HydrophobicContact CG2-CD2 4.08Å; V177-L197 HydrophobicContact CG2-CG 3.8Å
198N41.8Very low38Very low161 Ų161131 Ų13186%0.86168%0.677SS**SBendtrans-99.99.6-170.9-105.812.3000116.8P196P196-N198 PolarHBondContact O-N 3.11Å
199Q36.7Very low37.4Very low145 Ų145129 Ų12968%0.67868%0.675SS**SBendtrans-139.318.2-174.4-68.8-169.6-7.300116.4K218Q199-K218 VanDerWaalsContact O-CD 3.3Å; Q199-K218 WeakPolarHBondContact O-CD 3.45Å
200V35.2Very low37.3Very low81 Ų81123.5 Ų123.549%0.49167%0.668SS.*  trans-120.989177.3-166.50000110.4
201A34.5Very low37.2Very low96 Ų96125.3 Ų125.379%0.79368%0.676SS**  trans-82.2122.5161.900000108.4
202C34.7Very low37.1Very low104 Ų104120.1 Ų120.170%0.70366%0.659SS**  trans-106.198.1170.7-81.10000109.5
203H35.8Very low37.3Very low192 Ų192122.5 Ų122.589%0.88967%0.668SS**  trans-69.4123.5151.4-97.8-92.1000108.1
204A36.7Very low37.2Very low99 Ų99121.3 Ų121.382%0.81867%0.667SS**  172135.2122.500000111.9
205H34.6Very low37.7Very low175 Ų175121.1 Ų121.181%0.8167%0.665SS**  trans-75.8135.7-173.6-177.663.9000111.4Q207H205-Q207 PolarHBondContact O-N 2.93Å; H205-Q207 VanDerWaalsContact O-N 3.14Å
206R48.4Very low37.6Very low220 Ų220125.1 Ų125.183%0.8367%0.671SS**SBendtrans-8173.1-175.3-178.2-165.2-178.8173.50.3111
207Q40.1Very low37.8Very low154 Ų154125 Ų12572%0.7266%0.664SS**  trans-160.673.8165-77.2-51.9-24.200110.8H205H205-Q207 PolarHBondContact O-N 2.93Å; H205-Q207 VanDerWaalsContact O-N 3.14Å
208E31Very low37.5Very low198 Ų198128.8 Ų128.893%0.92568%0.677SS**SBendtrans-172.3131.9141.2-108.1171.6174.600109
209S30.2Very low37.3Very low115 Ų115124.3 Ų124.380%0.80467%0.669SS**  trans-61.5167.8-179.2-1490000112.4
210P43Very low37.2Very low107 Ų107125.5 Ų125.570%0.69567%0.674SS**  cis-133.6167.1-4.326.7-2.1000115.5F212P210-F212 PolarHBondContact O-N 3.07Å
211S37.7Very low37.1Very low69 Ų69133.1 Ų133.148%0.48369%0.694SS.*SBendtrans50.12.3152.4-140.70000125.4
212F36.3Very low37.3Very low98 Ų98134.6 Ų134.643%0.4369%0.688SS.*  trans-146.6124.5167.2-92.8-78.1000111P210 P214 L225P210-F212 PolarHBondContact O-N 3.07Å; F212-P214 WeakPolarHBondContact O-CD 2.96Å; F212-L225 HydrophobicContact CD1-CB 3.78Å; F212-L225 HydrophobicContact CD1-CD2 3.65Å; F212-L225 HydrophobicContact CD1-CG 3.46Å; F212-L225 VanDerWaalsContact CD1-CG 3.46Å; F212-L225 HydrophobicContact CE1-CB 3.65Å; F212-L225 HydrophobicContact CE1-CD2 3.51Å; F212-L225 HydrophobicContact CE1-CG 3.66Å; F212-L225 HydrophobicContact CG-CD2 4.29Å; F212-L225 HydrophobicContact CG-CG 4.31Å; F212-L225 HydrophobicContact CZ-CD2 4.02Å
213I43.6Very low37.4Very low121 Ų121135 Ų13562%0.62168%0.676SS**EExtended strand (participates in β ladder)trans-103.895.1173.2-61.5170.9000107.3L215I213-L215 PolarHBondContact O-N 3.11Å
214P37.6Very low37.8Very low70 Ų70129.2 Ų129.246%0.45565%0.648SS.*EExtended strand (participates in β ladder)trans-76.6112.7175.529.4-32.9000110.1F212 R216 F224F212-P214 WeakPolarHBondContact O-CD 2.96Å; P214-R216 PolarHBondContact O-N 3.33Å; P214-F224 WeakPolarHBondContact CA-O 3.43Å
215L39.2Very low38.2Very low79 Ų79127.9 Ų127.941%0.41463%0.627SS.*EExtended strand (participates in β ladder)trans-82.7108.2171.8-71.7171.1000109I213 F224 L226I213-L215 PolarHBondContact O-N 3.11Å; L215-F224 PolarHBondContact N-O 3.19Å; L215-L226 HydrophobicContact CD1-CD1 3.85Å; L215-L226 HydrophobicContact CD1-CD2 4.36Å; L215-L226 HydrophobicContact CG-CD1 4.37Å
216R39.9Very low38.6Very low171 Ų171123 Ų12365%0.64561%0.606SS**  trans-88.3113.6170-70.9-167.7-172.5-167.3-0.4109.5P214 Y223P214-R216 PolarHBondContact O-N 3.33Å; R216-Y223 HydrophobicContact CG-CD1 4.25Å; R216-Y223 HydrophobicContact CG-CE1 4.01Å; R216-Y223 VanDerWaalsContact CZ-CE1 3.44Å; R216-Y223 PolarHBondContact NE-OH 3.49Å; R216-Y223 PolarHBondContact NH1-OH 3.11Å; R216-Y223 PolarHBondContact NH2-OH 2.84Å
217I38.3Very low38.2Very low89 Ų89118.2 Ų118.246%0.45660%0.597SS.*  trans-94125.8171-58.8167.5000107.6G219 F224I217-G219 PolarHBondContact O-N 2.91Å; I217-F224 HydrophobicContact CD1-CD2 4.26Å; I217-F224 HydrophobicContact CD1-CE2 4Å
218K31.4Very low38Very low160 Ų160118.4 Ų118.470%0.69660%0.595SS**THydrogen-bonded Turntrans-64.4116.5176.8-158.5177.6-174.4178.10108.7Q199Q199-K218 VanDerWaalsContact O-CD 3.3Å; Q199-K218 WeakPolarHBondContact O-CD 3.45Å
219G38.5Very low38.5Very low67 Ų67114.6 Ų114.669%0.69158%0.582SS**THydrogen-bonded Turntrans127.4-13.6171.800000117I217I217-G219 PolarHBondContact O-N 2.91Å
220H35.4Very low38.8Very low170 Ų170110.5 Ų110.579%0.78756%0.557SS**  trans-141.6140.9174.5-77-68.9000112.7L222H220-L222 PolarHBondContact O-N 3.38Å
221R33.2Very low38.4Very low242 Ų242112.4 Ų112.491%0.91357%0.567SS**SBendtrans-65.99.9-173.8-93.1-174.2177.2176-0.4116.1
222L37.2Very low38.4Very low127 Ų127114.3 Ų114.367%0.66558%0.575SS**  trans-107.6108.4-168.8-63.1172.5000110.9H220 F224H220-L222 PolarHBondContact O-N 3.38Å; L222-F224 WeakPolarHBondContact O-CD2 3.22Å; L222-F224 PolarHBondContact O-N 2.82Å
223Y37.7Very low38.3Very low113 Ų113116.7 Ų116.744%0.44359%0.593SS.*  trans-76113.3176.9-75.4-109.3000109.9R216 L225R216-Y223 HydrophobicContact CG-CD1 4.25Å; R216-Y223 HydrophobicContact CG-CE1 4.01Å; R216-Y223 VanDerWaalsContact CZ-CE1 3.44Å; R216-Y223 PolarHBondContact NE-OH 3.49Å; R216-Y223 PolarHBondContact NH1-OH 3.11Å; R216-Y223 PolarHBondContact NH2-OH 2.84Å; Y223-L225 PolarHBondContact O-N 3.5Å
224F44.3Very low38.1Very low69 Ų69115.5 Ų115.530%0.30359%0.588SS.*EExtended strand (participates in β ladder)trans-81110.6175.4-71.7-89.2000109.7V165 P214 L215 I217 L222 L226V165-F224 HydrophobicContact CB-CE1 4.26Å; V165-F224 WeakPolarHBondContact O-CD1 3.06Å; V165-F224 WeakPolarHBondContact O-CE1 3.45Å; P214-F224 WeakPolarHBondContact CA-O 3.43Å; L215-F224 PolarHBondContact N-O 3.19Å; I217-F224 HydrophobicContact CD1-CD2 4.26Å; I217-F224 HydrophobicContact CD1-CE2 4Å; L222-F224 WeakPolarHBondContact O-CD2 3.22Å; L222-F224 PolarHBondContact O-N 2.82Å; F224-L226 HydrophobicContact CB-CD1 4.26Å
225L44.3Very low38.5Very low72 Ų72115 Ų11538%0.37759%0.589SS.*EExtended strand (participates in β ladder)trans-91.1107.4171.3-101.871.7000108.3F212 Y223F212-L225 HydrophobicContact CD1-CB 3.78Å; F212-L225 HydrophobicContact CD1-CD2 3.65Å; F212-L225 HydrophobicContact CD1-CG 3.46Å; F212-L225 VanDerWaalsContact CD1-CG 3.46Å; F212-L225 HydrophobicContact CE1-CB 3.65Å; F212-L225 HydrophobicContact CE1-CD2 3.51Å; F212-L225 HydrophobicContact CE1-CG 3.66Å; F212-L225 HydrophobicContact CG-CD2 4.29Å; F212-L225 HydrophobicContact CG-CG 4.31Å; F212-L225 HydrophobicContact CZ-CD2 4.02Å; Y223-L225 PolarHBondContact O-N 3.5Å
226L43.3Very low38.6Very low72 Ų72121.1 Ų121.138%0.37761%0.607SS.*EExtended strand (participates in β ladder)trans-84.7116.2174.3-87.576.4000109.7L215 F224L215-L226 HydrophobicContact CD1-CD1 3.85Å; L215-L226 HydrophobicContact CD1-CD2 4.36Å; L215-L226 HydrophobicContact CG-CD1 4.37Å; F224-L226 HydrophobicContact CB-CD1 4.26Å
227D39.6Very low38.9Very low120 Ų120118.5 Ų118.564%0.64261%0.605SS**  trans-79.5146173.6-166.58.8000111.2D229D227-D229 PolarHBondContact O-N 3.05Å
228K36.9Very low39.1Very low157 Ų157119 Ų11968%0.68360%0.604SS**SBendtrans-92.721.1-152-140.1-159.8-178.7-168.30115.7
229D41.7Very low39.8Very low119 Ų119116.8 Ų116.864%0.63660%0.6SS**  trans-116.975.2-179.6-79.3-29.6000112.5H73 D227H73-D229 PolarHBondContact CE1-O 3.13Å; D227-D229 PolarHBondContact O-N 3.05Å
230G35.3Very low40.2Very low28 Ų28120.1 Ų120.129%0.28960%0.6SS.*  trans-143.4118.4167.800000110.4V232G230-V232 PolarHBondContact O-N 2.88Å
231T34.6Very low40.7Very low148 Ų148117 Ų11791%0.90859%0.594SS**  trans-59.3113.1178.430.80000111.3N233T231-N233 PolarHBondContact O-N 2.99Å; T231-N233 VanDerWaalsContact O-N 3.13Å
232V37.7Very low41.3Very low108 Ų108110 Ų11066%0.65558%0.577SS**  trans-77.196.3175.6-177.10000108.7G230 N234G230-V232 PolarHBondContact O-N 2.88Å; V232-N234 PolarHBondContact O-N 2.9Å
233N34.8Very low41.4Very low148 Ų148106.9 Ų106.979%0.79158%0.576SS**SBendtrans-82116169.6-152.6-42.2000108.9T231T231-N233 PolarHBondContact O-N 2.99Å; T231-N233 VanDerWaalsContact O-N 3.13Å
234N40Very low41.4Very low97 Ų97105.6 Ų105.652%0.51959%0.588SS.*  trans7765.2178-82-42.1000119.1V232 R236 L237V232-N234 PolarHBondContact O-N 2.9Å; N234-R236 PolarHBondContact O-N 2.77Å; N234-L237 HydrophobicContact CB-CD1 4.38Å
235A45.1Very low41Very low58 Ų58111.9 Ų111.948%0.47961%0.612SS.*Hα-helixtrans-57.4-26.916200000114.1L237 F238 D239A235-L237 PolarHBondContact O-N 3.46Å; A235-F238 PolarHBondContact O-N 2.93Å; A235-D239 PolarHBondContact O-N 2.93Å
236R41.6Very low40.7Very low209 Ų209118.4 Ų118.479%0.78963%0.631SS**Hα-helixtrans-69.2-26.2-176-76.2-170.2178.7-1670.7114.8N234 I240N234-R236 PolarHBondContact O-N 2.77Å; R236-I240 WeakPolarHBondContact O-CD1 3.45Å; R236-I240 WeakPolarHBondContact O-CG1 3.15Å
237L45.3Very low40.3Very low116 Ų116119.5 Ų119.561%0.60764%0.643SS**Hα-helixtrans-82-20.5178.2-74.5169.2000112.5N234 A235 T241N234-L237 HydrophobicContact CB-CD1 4.38Å; A235-L237 PolarHBondContact O-N 3.46Å; L237-T241 PolarHBondContact O-OG1 3.34Å
238F43.7Very low40.2Very low100 Ų100126.7 Ų126.744%0.43967%0.669SS.*Hα-helixtrans-79.3-40.3178.4-149-97.4000111.4L70 A235 I240 T241 V242L70-F238 HydrophobicContact CD1-CD2 4.31Å; L70-F238 HydrophobicContact CD1-CE2 4.5Å; L70-F238 HydrophobicContact CD2-CD2 4.01Å; L70-F238 HydrophobicContact CD2-CE2 3.69Å; A235-F238 PolarHBondContact O-N 2.93Å; F238-I240 VanDerWaalsContact C-N 3.29Å; F238-I240 PolarHBondContact O-N 2.74Å; F238-T241 PolarHBondContact O-N 2.81Å; F238-V242 HydrophobicContact CD1-CB 4.38Å; F238-V242 HydrophobicContact CD1-CG2 3.78Å; F238-V242 HydrophobicContact CD2-CG2 4.38Å; F238-V242 HydrophobicContact CE1-CB 4.33Å; F238-V242 HydrophobicContact CE1-CG1 4.45Å; F238-V242 HydrophobicContact CE1-CG2 3.69Å; F238-V242 HydrophobicContact CE2-CG2 4.28Å; F238-V242 HydrophobicContact CG-CG2 4.14Å; F238-V242 HydrophobicContact CZ-CG2 3.95Å; F238-V242 WeakPolarHBondContact O-CB 3.35Å; F238-V242 VanDerWaalsContact O-CG2 3.3Å; F238-V242 WeakPolarHBondContact O-CG2 3.49Å; F238-V242 PolarHBondContact O-N 2.95Å
239D44.8Very low40.3Very low112 Ų112125.2 Ų125.260%0.59967%0.668SS**Hα-helixtrans-65.4-31.5178.5-75.4-15.9000112.8A235 G243A235-D239 PolarHBondContact O-N 2.93Å; D239-G243 PolarHBondContact O-N 3.14Å
240I46.9Very low40.2Very low138 Ų138125.5 Ų125.571%0.70867%0.67SS**Hα-helixtrans-79.5-25.1-177.8-62.2171.6000112.3R236 F238R236-I240 WeakPolarHBondContact O-CD1 3.45Å; R236-I240 WeakPolarHBondContact O-CG1 3.15Å; F238-I240 VanDerWaalsContact C-N 3.29Å; F238-I240 PolarHBondContact O-N 2.74Å
241T47.5Very low40.5Very low105 Ų105130.9 Ų130.964%0.64469%0.691SS**Hα-helixtrans-101.9-24.6-176.645.50000114.1L237 F238L237-T241 PolarHBondContact O-OG1 3.34Å; F238-T241 PolarHBondContact O-N 2.81Å
242V45.7Very low40.9Very low93 Ų93129.9 Ų129.956%0.56468%0.678SS**Hα-helixtrans-101-13-177-163.80000112.2F238 A244F238-V242 HydrophobicContact CD1-CB 4.38Å; F238-V242 HydrophobicContact CD1-CG2 3.78Å; F238-V242 HydrophobicContact CD2-CG2 4.38Å; F238-V242 HydrophobicContact CE1-CB 4.33Å; F238-V242 HydrophobicContact CE1-CG1 4.45Å; F238-V242 HydrophobicContact CE1-CG2 3.69Å; F238-V242 HydrophobicContact CE2-CG2 4.28Å; F238-V242 HydrophobicContact CG-CG2 4.14Å; F238-V242 HydrophobicContact CZ-CG2 3.95Å; F238-V242 WeakPolarHBondContact O-CB 3.35Å; F238-V242 VanDerWaalsContact O-CG2 3.3Å; F238-V242 WeakPolarHBondContact O-CG2 3.49Å; F238-V242 PolarHBondContact O-N 2.95Å; V242-A244 PolarHBondContact O-N 2.76Å
243G38.2Very low41.1Very low62 Ų62131.3 Ų131.364%0.63968%0.679SS**  trans-78.4-5.6178.200000116.3D239 Y245D239-G243 PolarHBondContact O-N 3.14Å; G243-Y245 VanDerWaalsContact C-N 3.27Å; G243-Y245 PolarHBondContact O-N 3Å
244A38.3Very low41.5Very low86 Ų86130.1 Ų130.171%0.71167%0.672SS**  trans-87.667.2177.600000111.2V242 R246V242-A244 PolarHBondContact O-N 2.76Å; A244-R246 PolarHBondContact O-N 3.47Å
245Y35.1Very low41.6Very low202 Ų202132.5 Ų132.579%0.79268%0.683SS**  trans-55.1113.3165.5-167.3-97.1000109.1G243 P247G243-Y245 VanDerWaalsContact C-N 3.27Å; G243-Y245 PolarHBondContact O-N 3Å; Y245-P247 HydrophobicContact CE1-CB 4.08Å
246R37.9Very low41.3Very low209 Ų209138.2 Ų138.279%0.78970%0.699SS**  trans-104115.4159.7-88.8-174.6-178.31781.8107.5A244A244-R246 PolarHBondContact O-N 3.47Å
247P36Very low41.3Very low95 Ų95132.3 Ų132.362%0.61769%0.691SS**  trans-67.6140.1170.428.3-30.7000109.2Y245Y245-P247 HydrophobicContact CE1-CB 4.08Å
248F36.1Very low40.9Very low270 Ų270133.8 Ų133.8100%1.18470%0.699SS**  trans-106.40151.8-51.6-75.7000106.6

Retrieved 248 of 248 residues in 33.7 ms (Link to these results)