A0A087XEI0_POEFO Loading...

BEN domain containing 4

AlphaFold DB , UniProt , Accession A0A087XEI0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 407 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
1S44.9Very low45.7Very low136 Ų136100.4 Ų100.495%0.95161%0.607SS**  0-11.9031.40000112.8
2D41Very low46.7Very low123 Ų123101.9 Ų101.966%0.65860%0.603SS**THydrogen-bonded Turntrans-94-1.2-169.2-48.7-58.3000115.3L4 T5D2-L4 VanDerWaalsContact C-N 3.34Å; D2-T5 PolarHBondContact O-OG1 2.71Å
3F34.7Very low47.7Very low202 Ų202101.5 Ų101.589%0.88660%0.596SS**Hα-helixtrans-81.2-13172.7-111-90.8000113.6
4L41.5Very low49Very low141 Ų141107.1 Ų107.174%0.73860%0.602SS**Hα-helixtrans-95.4-17.6179.7-74.1167.6000113.4D2 S7D2-L4 VanDerWaalsContact C-N 3.34Å; L4-S7 PolarHBondContact O-OG 3.4Å
5T45.5Very low50.3Low92 Ų92108 Ų10856%0.56460%0.604SS**Hα-helixtrans-85.4-30.5179.541.10000112.8D2D2-T5 PolarHBondContact O-OG1 2.71Å
6S43.7Very low51.6Low84 Ų84107.6 Ų107.659%0.58760%0.599SS**Hα-helixtrans-69.3-38.6176.9-178.60000112.8S8 S9 A10S6-S8 VanDerWaalsContact C-N 3.33Å; S6-S8 PolarHBondContact O-N 3.16Å; S6-S9 PolarHBondContact O-N 3.38Å; S6-S9 PolarHBondContact O-OG 2.98Å; S6-A10 PolarHBondContact O-N 2.92Å
7S45.3Very low52.8Low64 Ų64108.1 Ų108.145%0.44860%0.599SS.*Hα-helixtrans-69.2-31.1178.574.10000112.9L4 A10 T11L4-S7 PolarHBondContact O-OG 3.4Å; S7-A10 PolarHBondContact O-N 2.92Å; S7-T11 WeakPolarHBondContact O-CG2 3.21Å; S7-T11 PolarHBondContact O-N 2.95Å; S7-T11 VanDerWaalsContact O-N 3.08Å; S7-T11 PolarHBondContact O-OG1 3.11Å
8S47.9Very low53.7Low63 Ų63106.8 Ų106.844%0.44159%0.591SS.*Hα-helixtrans-63.4-42.1176.5179.30000112.6S6 T11 E12S6-S8 VanDerWaalsContact C-N 3.33Å; S6-S8 PolarHBondContact O-N 3.16Å; S8-T11 WeakPolarHBondContact CA-OG1 3.29Å; S8-T11 PolarHBondContact O-OG1 2.92Å; S8-E12 WeakPolarHBondContact O-CB 3.49Å; S8-E12 PolarHBondContact O-N 3Å
9S50.5Low54.5Low59 Ų59103.6 Ų103.641%0.41358%0.58SS.*Hα-helixtrans-71.2-34-179.672.30000112.3S6 N13S6-S9 PolarHBondContact O-N 3.38Å; S6-S9 PolarHBondContact O-OG 2.98Å; S9-N13 WeakPolarHBondContact O-CB 3.21Å; S9-N13 PolarHBondContact O-N 2.91Å; S9-N13 PolarHBondContact O-ND2 3.23Å
10A51.7Low55.4Low61 Ų61103.7 Ų103.750%0.50457%0.574SS.*Hα-helixtrans-72.7-37.1178.200000112S6 S7 R14S6-A10 PolarHBondContact O-N 2.92Å; S7-A10 PolarHBondContact O-N 2.92Å; A10-R14 VanDerWaalsContact O-CB 3.29Å; A10-R14 WeakPolarHBondContact O-CB 3.48Å; A10-R14 PolarHBondContact O-N 3.23Å; A10-R14 VanDerWaalsContact O-N 3.11Å
11T56.1Low56.2Low79 Ų79100.9 Ų100.949%0.48556%0.564SS.*Hα-helixtrans-70.3-39.9174.547.20000111.8S7 S8 R14 L15S7-T11 WeakPolarHBondContact O-CG2 3.21Å; S7-T11 PolarHBondContact O-N 2.95Å; S7-T11 VanDerWaalsContact O-N 3.08Å; S7-T11 PolarHBondContact O-OG1 3.11Å; S8-T11 WeakPolarHBondContact CA-OG1 3.29Å; S8-T11 PolarHBondContact O-OG1 2.92Å; T11-R14 PolarHBondContact O-N 3.22Å; T11-L15 VanDerWaalsContact O-CG 3.26Å; T11-L15 WeakPolarHBondContact O-CG 3.39Å; T11-L15 PolarHBondContact O-N 3.41Å
12E57.8Low57.6Low119 Ų119100.4 Ų100.456%0.55655%0.547SS*.Hα-helixtrans-65-45.9176.9-167.9171.4-167.900112.1S8 R14 L15 I16S8-E12 WeakPolarHBondContact O-CB 3.49Å; S8-E12 PolarHBondContact O-N 3Å; E12-R14 VanDerWaalsContact C-N 3.27Å; E12-R14 PolarHBondContact O-N 3.4Å; E12-L15 PolarHBondContact O-N 3.45Å; E12-I16 HydrophobicContact CG-CD1 4.29Å; E12-I16 VanDerWaalsContact O-CG1 3.32Å; E12-I16 WeakPolarHBondContact O-CG1 3.48Å; E12-I16 PolarHBondContact O-N 3.41Å
13N59.6Low58.8Low96 Ų9699.3 Ų99.351%0.51354%0.538SS..Hα-helixtrans-60.4-36.6173.4-79.7-57.5000112.4S9 I16 L17S9-N13 WeakPolarHBondContact O-CB 3.21Å; S9-N13 PolarHBondContact O-N 2.91Å; S9-N13 PolarHBondContact O-ND2 3.23Å; N13-I16 PolarHBondContact O-N 3.5Å; N13-L17 WeakPolarHBondContact O-CB 3.36Å; N13-L17 VanDerWaalsContact O-CG 3.23Å; N13-L17 WeakPolarHBondContact O-CG 3.42Å; N13-L17 PolarHBondContact O-N 3.27Å
14R65.4Low60.2Low180 Ų18091.5 Ų91.568%0.67951%0.508SS*.Hα-helixtrans-69.4-37.2176.7-169.2172.7179.5-169.5-0.7112.4A10 T11 E12 L17 D18A10-R14 VanDerWaalsContact O-CB 3.29Å; A10-R14 WeakPolarHBondContact O-CB 3.48Å; A10-R14 PolarHBondContact O-N 3.23Å; A10-R14 VanDerWaalsContact O-N 3.11Å; T11-R14 PolarHBondContact O-N 3.22Å; E12-R14 VanDerWaalsContact C-N 3.27Å; E12-R14 PolarHBondContact O-N 3.4Å; R14-L17 PolarHBondContact O-N 2.93Å; R14-D18 WeakPolarHBondContact O-CB 3.41Å; R14-D18 PolarHBondContact O-N 2.81Å
15L69.2Low61.3Low121 Ų12187.9 Ų87.963%0.63450%0.495SS*.Hα-helixtrans-67.8-38.5175.3-71.4168000111.8T11 E12 D18 A19T11-L15 VanDerWaalsContact O-CG 3.26Å; T11-L15 WeakPolarHBondContact O-CG 3.39Å; T11-L15 PolarHBondContact O-N 3.41Å; E12-L15 PolarHBondContact O-N 3.45Å; L15-D18 PolarHBondContact O-N 2.91Å; L15-A19 VanDerWaalsContact O-CB 3.3Å; L15-A19 WeakPolarHBondContact O-CB 3.26Å; L15-A19 PolarHBondContact O-N 3.33Å
16I70Confident62.3Low102 Ų10291.4 Ų91.452%0.52350%0.498SS..Hα-helixtrans-65.7-44.3175-65.5164.2000110.6E12 N13 A19 F20E12-I16 HydrophobicContact CG-CD1 4.29Å; E12-I16 VanDerWaalsContact O-CG1 3.32Å; E12-I16 WeakPolarHBondContact O-CG1 3.48Å; E12-I16 PolarHBondContact O-N 3.41Å; N13-I16 PolarHBondContact O-N 3.5Å; I16-A19 PolarHBondContact O-N 2.87Å; I16-F20 WeakPolarHBondContact O-CB 3.44Å; I16-F20 PolarHBondContact O-N 3.41Å
17L72.8Confident63.2Low116 Ų11689.4 Ų89.461%0.60748%0.482SS*.Hα-helixtrans-66.3-38.2177-71.7169.7000112.4N13 R14 F20 A21N13-L17 WeakPolarHBondContact O-CB 3.36Å; N13-L17 VanDerWaalsContact O-CG 3.23Å; N13-L17 WeakPolarHBondContact O-CG 3.42Å; N13-L17 PolarHBondContact O-N 3.27Å; R14-L17 PolarHBondContact O-N 2.93Å; L17-F20 PolarHBondContact O-N 3.34Å; L17-A21 WeakPolarHBondContact O-CB 3.46Å; L17-A21 PolarHBondContact O-N 2.74Å
18D68.5Low64.1Low85 Ų8591.7 Ų91.746%0.45549%0.488SS..Hα-helixtrans-67.4-40.9174.2-90.2-3.7000111.5R14 L15 F20 A21 Q22R14-D18 WeakPolarHBondContact O-CB 3.41Å; R14-D18 PolarHBondContact O-N 2.81Å; L15-D18 PolarHBondContact O-N 2.91Å; D18-F20 VanDerWaalsContact C-N 3.34Å; D18-F20 PolarHBondContact O-N 2.86Å; D18-A21 PolarHBondContact O-N 2.86Å; D18-Q22 WeakPolarHBondContact O-CB 3.38Å; D18-Q22 VanDerWaalsContact O-CG 3.25Å; D18-Q22 WeakPolarHBondContact O-CG 3.47Å; D18-Q22 PolarHBondContact O-N 3.27Å
19A69.9Low64.9Low46 Ų4693.2 Ų93.238%0.3849%0.491SS..Hα-helixtrans-62.4-42.7174.100000111.2L15 I16 Q22 Q23L15-A19 VanDerWaalsContact O-CB 3.3Å; L15-A19 WeakPolarHBondContact O-CB 3.26Å; L15-A19 PolarHBondContact O-N 3.33Å; I16-A19 PolarHBondContact O-N 2.87Å; A19-Q22 PolarHBondContact O-N 3.28Å; A19-Q23 WeakPolarHBondContact O-CG 3.35Å; A19-Q23 PolarHBondContact O-N 3.15Å
20F72.8Confident65.3Low104 Ų10494.4 Ų94.446%0.45649%0.493SS..Hα-helixtrans-62.5-44.8175-177.4-98.9000111.9I16 L17 D18 Q22 Q23 C24 F100 L104I16-F20 WeakPolarHBondContact O-CB 3.44Å; I16-F20 PolarHBondContact O-N 3.41Å; L17-F20 PolarHBondContact O-N 3.34Å; D18-F20 VanDerWaalsContact C-N 3.34Å; D18-F20 PolarHBondContact O-N 2.86Å; F20-Q22 VanDerWaalsContact C-N 3.31Å; F20-Q22 PolarHBondContact O-N 3.5Å; F20-Q23 PolarHBondContact O-N 3.2Å; F20-C24 PolarHBondContact O-N 3.11Å; F20-C24 PolarHBondContact O-SG 3.27Å; F20-C24 VanDerWaalsContact O-SG 3.37Å; F20-F100 HydrophobicContact CE2-CZ 4.47Å; F20-L104 HydrophobicContact CE2-CD1 4.39Å
21A72.3Confident65.4Low45 Ų4596 Ų9637%0.37249%0.493SS..Hα-helixtrans-62.8-36.8176.700000112.3L17 D18 S25L17-A21 WeakPolarHBondContact O-CB 3.46Å; L17-A21 PolarHBondContact O-N 2.74Å; D18-A21 PolarHBondContact O-N 2.86Å; A21-S25 WeakPolarHBondContact O-CB 3.38Å; A21-S25 PolarHBondContact O-N 3.41Å; A21-S25 PolarHBondContact O-OG 2.95Å
22Q73.6Confident65.2Low127 Ų12798.6 Ų98.659%0.59350%0.503SS*.Hα-helixtrans-67.2-39.9174.4-73.6173.422.100112.3D18 A19 F20 S25 R26D18-Q22 WeakPolarHBondContact O-CB 3.38Å; D18-Q22 VanDerWaalsContact O-CG 3.25Å; D18-Q22 WeakPolarHBondContact O-CG 3.47Å; D18-Q22 PolarHBondContact O-N 3.27Å; A19-Q22 PolarHBondContact O-N 3.28Å; F20-Q22 VanDerWaalsContact C-N 3.31Å; F20-Q22 PolarHBondContact O-N 3.5Å; Q22-S25 PolarHBondContact O-N 2.98Å; Q22-R26 WeakPolarHBondContact O-CB 3.28Å; Q22-R26 PolarHBondContact O-N 3.17Å
23Q66.6Low64.9Low99 Ų9998.5 Ų98.546%0.46351%0.507SS..Hα-helixtrans-65.6-43.4174.8-64.9-47.7-43.500111.8A19 F20 S25 R26 V27A19-Q23 WeakPolarHBondContact O-CG 3.35Å; A19-Q23 PolarHBondContact O-N 3.15Å; F20-Q23 PolarHBondContact O-N 3.2Å; Q23-S25 VanDerWaalsContact C-N 3.29Å; Q23-S25 PolarHBondContact O-N 3.29Å; Q23-R26 PolarHBondContact O-N 3.03Å; Q23-V27 WeakPolarHBondContact O-CG2 3.27Å; Q23-V27 PolarHBondContact O-N 3.24Å
24C62.8Low64.7Low39 Ų3997.3 Ų97.326%0.26452%0.517SS..Hα-helixtrans-58.9-41.7173.8-71.10000111.5F20 V27 L28F20-C24 PolarHBondContact O-N 3.11Å; F20-C24 PolarHBondContact O-SG 3.27Å; F20-C24 VanDerWaalsContact O-SG 3.37Å; C24-V27 PolarHBondContact O-N 2.88Å; C24-L28 WeakPolarHBondContact O-CB 3.41Å; C24-L28 VanDerWaalsContact O-CG 3.27Å; C24-L28 WeakPolarHBondContact O-CG 3.16Å; C24-L28 PolarHBondContact O-N 3.4Å
25S65.4Low64.2Low65 Ų6599.1 Ų99.146%0.45552%0.524SS..Hα-helixtrans-66.5-37.5177.9-58.80000112.7A21 Q22 Q23 N29A21-S25 WeakPolarHBondContact O-CB 3.38Å; A21-S25 PolarHBondContact O-N 3.41Å; A21-S25 PolarHBondContact O-OG 2.95Å; Q22-S25 PolarHBondContact O-N 2.98Å; Q23-S25 VanDerWaalsContact C-N 3.29Å; Q23-S25 PolarHBondContact O-N 3.29Å; S25-N29 WeakPolarHBondContact O-CB 3.41Å; S25-N29 PolarHBondContact O-N 2.89Å; S25-N29 PolarHBondContact O-ND2 2.81Å
26R66.3Low63Low166 Ų16698.8 Ų98.863%0.62652%0.522SS*.Hα-helixtrans-67.2-40.4176.8-170173.2-176.7156-0.8112Q22 Q23 N29 L30Q22-R26 WeakPolarHBondContact O-CB 3.28Å; Q22-R26 PolarHBondContact O-N 3.17Å; Q23-R26 PolarHBondContact O-N 3.03Å; R26-N29 PolarHBondContact O-N 3.48Å; R26-L30 HydrophobicContact CG-CD1 4.43Å; R26-L30 WeakPolarHBondContact O-CD1 3.39Å; R26-L30 WeakPolarHBondContact O-CG 3.48Å; R26-L30 PolarHBondContact O-N 3.15Å
27V62Low61.5Low41 Ų41101 Ų10125%0.24853%0.534CS..Hα-helixtrans-68.8-43.5175.9173.70000111.1Q23 C24 N29 L30 L31 F100Q23-V27 WeakPolarHBondContact O-CG2 3.27Å; Q23-V27 PolarHBondContact O-N 3.24Å; C24-V27 PolarHBondContact O-N 2.88Å; V27-N29 VanDerWaalsContact C-N 3.3Å; V27-N29 PolarHBondContact O-N 3.47Å; V27-L30 WeakPolarHBondContact O-CB 3.3Å; V27-L30 PolarHBondContact O-N 3.49Å; V27-L30 VanDerWaalsContact O-N 3.12Å; V27-L31 HydrophobicContact CG1-CD1 3.96Å; V27-L31 HydrophobicContact CG1-CG 4.43Å; V27-L31 VanDerWaalsContact O-CG 3.32Å; V27-L31 WeakPolarHBondContact O-CG 3.32Å; V27-L31 PolarHBondContact O-N 2.92Å; V27-F100 HydrophobicContact CG2-CD2 4.46Å
28L65.5Low59.5Low112 Ų112104.1 Ų104.159%0.58655%0.546SS*.Hα-helixtrans-61.9-37.8174.9-73.4170.3000112C24 L31 N32C24-L28 WeakPolarHBondContact O-CB 3.41Å; C24-L28 VanDerWaalsContact O-CG 3.27Å; C24-L28 WeakPolarHBondContact O-CG 3.16Å; C24-L28 PolarHBondContact O-N 3.4Å; L28-L31 PolarHBondContact O-N 3.25Å; L28-N32 WeakPolarHBondContact O-CB 3.3Å; L28-N32 PolarHBondContact O-N 2.93Å
29N63.2Low57.8Low95 Ų95104.3 Ų104.351%0.50855%0.552SS.*Hα-helixtrans-68.7-34173.4-81.3-22000113S25 R26 V27 N33S25-N29 WeakPolarHBondContact O-CB 3.41Å; S25-N29 PolarHBondContact O-N 2.89Å; S25-N29 PolarHBondContact O-ND2 2.81Å; R26-N29 PolarHBondContact O-N 3.48Å; V27-N29 VanDerWaalsContact C-N 3.3Å; V27-N29 PolarHBondContact O-N 3.47Å; N29-N33 WeakPolarHBondContact O-CB 3.19Å; N29-N33 PolarHBondContact O-N 3.23Å; N29-N33 PolarHBondContact O-ND2 3.06Å
30L58.9Low56.2Low84 Ų84108 Ų10844%0.4457%0.572SS.*Hα-helixtrans-67.7-40.4173.4-77.2160.2000111.6R26 V27 G34 L36R26-L30 HydrophobicContact CG-CD1 4.43Å; R26-L30 WeakPolarHBondContact O-CD1 3.39Å; R26-L30 WeakPolarHBondContact O-CG 3.48Å; R26-L30 PolarHBondContact O-N 3.15Å; V27-L30 WeakPolarHBondContact O-CB 3.3Å; V27-L30 PolarHBondContact O-N 3.49Å; V27-L30 VanDerWaalsContact O-N 3.12Å; L30-G34 PolarHBondContact O-N 3.34Å; L30-L36 HydrophobicContact CD2-CD1 4.23Å
31L55.5Low54.1Low96 Ų96108.3 Ų108.350%0.50359%0.586SS.*Hα-helixtrans-66.9-39.6174.9-69.3167.3000111.9V27 L28V27-L31 HydrophobicContact CG1-CD1 3.96Å; V27-L31 HydrophobicContact CG1-CG 4.43Å; V27-L31 VanDerWaalsContact O-CG 3.32Å; V27-L31 WeakPolarHBondContact O-CG 3.32Å; V27-L31 PolarHBondContact O-N 2.92Å; L28-L31 PolarHBondContact O-N 3.25Å
32N51.8Low52Low133 Ų133111.9 Ų111.971%0.71161%0.609SS**Hα-helixtrans-76.7-22.1-178.5-16435.2000113.5L28L28-N32 WeakPolarHBondContact O-CB 3.3Å; L28-N32 PolarHBondContact O-N 2.93Å
33N51.6Low49.8Very low116 Ų116110.4 Ų110.462%0.6261%0.612SS**THydrogen-bonded Turntrans-99.21.6-179.7-73.8-67.7000114.5N29 R35N29-N33 WeakPolarHBondContact O-CB 3.19Å; N29-N33 PolarHBondContact O-N 3.23Å; N29-N33 PolarHBondContact O-ND2 3.06Å; N33-R35 PolarHBondContact O-N 3.45Å
34G54.2Low48.2Very low71 Ų71114.4 Ų114.473%0.73264%0.636SS**  trans57.14.5169.200000117.1L30L30-G34 PolarHBondContact O-N 3.34Å
35R54.8Low46.6Very low218 Ų218117.1 Ų117.182%0.82366%0.656SS**  trans-100.786.1175.4-78-161-154.6-111.94.5109.6N33N33-R35 PolarHBondContact O-N 3.45Å
36L43.8Very low44.8Very low114 Ų114119.2 Ų119.260%0.59767%0.67SS**  trans-133.2112.2152.2-152.483.2000108.3L30L30-L36 HydrophobicContact CD2-CD1 4.23Å
37L39.3Very low43Very low148 Ų148119.4 Ų119.478%0.77568%0.684SS**  trans100.480.2171.4-54.3165.6000116.5
38E30.1Very low41.4Very low183 Ų183124.8 Ų124.886%0.85571%0.709SS**  -98.9114.3126.8-168.7167.2-178.700105.7
39P34.5Very low39.9Very low89 Ų89129 Ų12958%0.57872%0.723SS**  trans-75.5151.3-179.128.6-31.4000110.8S41P39-S41 PolarHBondContact O-N 2.83Å
40P35.4Very low38.3Very low124 Ų124132.4 Ų132.481%0.80574%0.74SS**  trans-69.3105.5163.929.3-29.4000107.8S42P40-S42 PolarHBondContact O-N 2.79Å
41S28.3Very low36.9Very low109 Ų109136.9 Ų136.976%0.76276%0.759SS**  trans-63.4103.9171.8370000109.6P39 S43P39-S41 PolarHBondContact O-N 2.83Å; S41-S43 VanDerWaalsContact C-N 3.33Å; S41-S43 PolarHBondContact O-N 3.38Å
42S28.3Very low35.5Very low121 Ų121140 Ų14085%0.84678%0.777SS**  trans-86.376.6161.942.10000109P40P40-S42 PolarHBondContact O-N 2.79Å
43S27.1Very low34.4Very low95 Ų95136.5 Ų136.566%0.66477%0.772SS**  trans-94.1101.5157.118.70000108.3S41 S45S41-S43 VanDerWaalsContact C-N 3.33Å; S41-S43 PolarHBondContact O-N 3.38Å; S43-S45 PolarHBondContact O-N 3.46Å
44L33.5Very low33.2Very low183 Ų183143.6 Ų143.696%0.95879%0.79SS**  trans-62.698.6157.5-73.6165.7000108.3
45S29.5Very low31.9Very low97 Ų97143.4 Ų143.468%0.67879%0.787SS**  trans-142.796.7152.653.50000109.5S43S43-S45 PolarHBondContact O-N 3.46Å
46S27.1Very low30.6Very low108 Ų108140.9 Ų140.976%0.75579%0.79SS**  trans20.8118151.458.80000118.7I48S46-I48 PolarHBondContact O-N 2.88Å
47N27.7Very low29.9Very low170 Ų170138.9 Ų138.991%0.90979%0.79SS**  trans-50.6117.6149.5-78.3-80.8000110.2
48I29.2Very low29.5Very low154 Ų154141.2 Ų141.279%0.7980%0.797SS**  trans-142.6125.1145.2-103.8152.5000108.6S46S46-I48 PolarHBondContact O-N 2.88Å
49K33.1Very low29.3Very low200 Ų200136 Ų13687%0.8779%0.792SS**  trans-67.3125.2174.9177.2173.8174177.80109.6
50L30Very low29.1Very low167 Ų167139.7 Ų139.787%0.87481%0.806SS**  trans-148.9132.7152.8-125.5125000109.9
51E29.7Very low28.6Very low178 Ų178142.9 Ų142.983%0.83281%0.81SS**  trans-75171.2-175.4-113.4-153.6112.900113.9
52D26.9Very low28.3Very low163 Ų163143.4 Ų143.487%0.87281%0.812SS**  trans93.3126.7157.7-138.916.4000115.5
53G27.4Very low28.2Very low59 Ų59142.9 Ų142.961%0.60881%0.809SS**  cis173151.8100000109.8
54R27.1Very low28.3Very low265 Ų265143.2 Ų143.2100%181%0.811SS**  trans61.2140168.4-66.5177-175.7-116.7-1.5117.7
55G26.6Very low28.1Very low66 Ų66143.9 Ų143.968%0.6881%0.809SS**  cis155.9121.711.900000104.2
56D28.2Very low28Very low165 Ų165143.1 Ų143.188%0.88282%0.817SS**  162.1121.5101.3-97.8-43.1000104.8
57A29.6Very low28.3Very low72 Ų72147.7 Ų147.760%0.59582%0.823SS**  86.1125.984.200000115.5
58Q29.7Very low28.3Very low197 Ų197147.7 Ų147.792%0.92182%0.822SS**  trans71.2136.8167-82.3116.8-3.700119.1
59G26.8Very low28.2Very low73 Ų73149.7 Ų149.775%0.75383%0.825SS**  cis176.9142.15.600000110.1
60L29.1Very low28.1Very low168 Ų168145.6 Ų145.688%0.8882%0.819SS**  trans-61.1138.6169.8-76.4142.4000111.1
61H26Very low28.3Very low191 Ų191143.7 Ų143.788%0.88482%0.817SS**  trans-162.5112.7145.7-112.3-76.8000112.2
62C22.7Very low28.2Very low119 Ų119144 Ų14480%0.80482%0.818SS**  trans-84.5135.5152.8-73.60000108.7
63S25.8Very low28.5Very low111 Ų111142 Ų14278%0.77682%0.816SS**  trans176.5134.2135.2-1040000114.4
64S28.6Very low28.5Very low101 Ų101144.8 Ų144.871%0.70683%0.827SS**  trans59.8114.7138.268.10000122.5
65Q30.4Very low28.8Very low197 Ų197136.9 Ų136.992%0.92181%0.812SS**  66.398.2118.1-152.8171.73.400118.3
66G27.4Very low29.7Very low81 Ų81140.1 Ų140.184%0.83582%0.819SS**  trans-147.5101.1163.400000110.4
67K32.1Very low30.4Very low204 Ų204135.9 Ų135.989%0.88780%0.799SS**  trans-91.7115.6175-170.6174-175.9178.40106.4
68L28.9Very low31.2Very low171 Ų171136.8 Ų136.890%0.89579%0.794SS**  trans-173.4116.9155.1-96.8174000111.7
69K27.2Very low32.3Very low196 Ų196132.3 Ų132.385%0.85278%0.782SS**  trans76.4128.5150.4-136.4168.9-176.9-175.40120.1
70P31.1Very low33.5Very low113 Ų113135.2 Ų135.273%0.73478%0.776SS**PPolyproline II helixtrans-77.3141.6178.931.5-32.1000111
71P33.4Very low34.5Very low128 Ų128131.5 Ų131.583%0.83176%0.757SS**PPolyproline II helixtrans-74131.7169.930-30000109.5
72E27Very low35.8Very low185 Ų185127.7 Ų127.786%0.86474%0.739SS**PPolyproline II helixtrans-57.7142.9174.3-64.3168.3118.800110.6S74E72-S74 PolarHBondContact O-N 3.35Å
73S33.3Very low37.2Very low119 Ų119123.9 Ų123.983%0.83272%0.716SS**PPolyproline II helixtrans-48.6117.7176.8-49.40000112.2
74S27.8Very low38.4Very low118 Ų118124.3 Ų124.383%0.82571%0.706SS**  trans-121.184.2148-88.50000107.2E72 T76E72-S74 PolarHBondContact O-N 3.35Å; S74-T76 PolarHBondContact O-N 2.88Å
75S32.9Very low39.5Very low99 Ų99125.6 Ų125.669%0.69270%0.701SS**  trans-77.6101.7163.8171.30000106.7
76T44.9Very low40.6Very low134 Ų134119.4 Ų119.482%0.82268%0.679SS**  trans-126.360.315286.90000106.3S74 D78S74-T76 PolarHBondContact O-N 2.88Å; T76-D78 PolarHBondContact O-N 3.37Å
77T43.6Very low41.8Very low76 Ų76120.3 Ų120.347%0.46666%0.661SS.*  trans-78.5115.8165.4240000107E82T77-E82 HydrophobicContact CG2-CG 4.5Å
78D46.9Very low42.9Very low92 Ų92114 Ų11449%0.49264%0.643SS.*  trans-61128173.1-155.7-40.1000108T76 E80 D81T76-D78 PolarHBondContact O-N 3.37Å; D78-E80 PolarHBondContact O-N 2.91Å; D78-D81 PolarHBondContact O-N 3.42Å
79P52.4Low44.5Very low102 Ų102110.2 Ų110.266%0.66262%0.624SS**Hα-helixtrans-57.5-16.1-176.920.8-34.4000114.3A83P79-A83 PolarHBondContact O-N 3.34Å
80E51.5Low46.2Very low135 Ų135106.9 Ų106.963%0.63161%0.611SS**Hα-helixtrans-74.7-32.5173.3-73.5-172.779.800113.6D78 Q84D78-E80 PolarHBondContact O-N 2.91Å; E80-Q84 VanDerWaalsContact O-CG 3.28Å; E80-Q84 WeakPolarHBondContact O-CG 3.35Å; E80-Q84 PolarHBondContact O-N 2.96Å
81D51Low47.8Very low90 Ų90107.7 Ų107.748%0.48161%0.605SS.*Hα-helixtrans-76.1-35.3-178.8-93.7-32.5000112.4D78 Q84 Q85D78-D81 PolarHBondContact O-N 3.42Å; D81-Q84 PolarHBondContact O-N 3.34Å; D81-Q85 WeakPolarHBondContact O-CB 3.47Å; D81-Q85 WeakPolarHBondContact O-CG 3.34Å; D81-Q85 PolarHBondContact O-N 3.48Å
82E51.9Low49.2Very low111 Ų111106.9 Ų106.952%0.51959%0.59SS.*Hα-helixtrans-71-34.1174.4-71.3-171.5141.900112T77 S86T77-E82 HydrophobicContact CG2-CG 4.5Å; E82-S86 WeakPolarHBondContact O-CB 3.4Å; E82-S86 PolarHBondContact O-N 3.25Å; E82-S86 PolarHBondContact O-OG 3.01Å
83A52.6Low50.9Low38 Ų38101.4 Ų101.431%0.31457%0.569SS.*Hα-helixtrans-65.2-46171.800000110.6P79 Q85 S86 H87P79-A83 PolarHBondContact O-N 3.34Å; A83-Q85 PolarHBondContact O-N 2.8Å; A83-S86 WeakPolarHBondContact CA-OG 3.3Å; A83-S86 PolarHBondContact O-N 2.88Å; A83-S86 PolarHBondContact O-OG 3.42Å; A83-H87 WeakPolarHBondContact O-CB 3.49Å; A83-H87 PolarHBondContact O-CD2 2.97Å; A83-H87 VanDerWaalsContact O-CG 3.28Å; A83-H87 PolarHBondContact O-N 3.44Å
84Q52.2Low52.4Low121 Ų12198.1 Ų98.157%0.56555%0.546SS*.Hα-helixtrans-66.2-38.5178.7-72.6177.73.300113E80 D81 H87 S88E80-Q84 VanDerWaalsContact O-CG 3.28Å; E80-Q84 WeakPolarHBondContact O-CG 3.35Å; E80-Q84 PolarHBondContact O-N 2.96Å; D81-Q84 PolarHBondContact O-N 3.34Å; Q84-H87 PolarHBondContact O-N 3.39Å; Q84-S88 WeakPolarHBondContact O-CB 3.25Å; Q84-S88 PolarHBondContact O-N 3.23Å
85Q51.2Low54.3Low128 Ų12894.7 Ų94.760%0.59853%0.525SS*.Hα-helixtrans-68.3-37.2174.4-78.6-178.8-0.400112.9D81 A83 N89D81-Q85 WeakPolarHBondContact O-CB 3.47Å; D81-Q85 WeakPolarHBondContact O-CG 3.34Å; D81-Q85 PolarHBondContact O-N 3.48Å; A83-Q85 PolarHBondContact O-N 2.8Å; Q85-N89 WeakPolarHBondContact O-CB 3.35Å; Q85-N89 PolarHBondContact O-N 3.23Å; Q85-N89 PolarHBondContact O-ND2 3.31Å
86S52.5Low56.1Low67 Ų6791.9 Ų91.947%0.46950%0.504SS..Hα-helixtrans-70.7-37175.656.10000112E82 A83 Q90E82-S86 WeakPolarHBondContact O-CB 3.4Å; E82-S86 PolarHBondContact O-N 3.25Å; E82-S86 PolarHBondContact O-OG 3.01Å; A83-S86 WeakPolarHBondContact CA-OG 3.3Å; A83-S86 PolarHBondContact O-N 2.88Å; A83-S86 PolarHBondContact O-OG 3.42Å; S86-Q90 VanDerWaalsContact O-CB 3.22Å; S86-Q90 WeakPolarHBondContact O-CB 3.33Å; S86-Q90 PolarHBondContact O-N 3.18Å
87H54.3Low57.3Low99 Ų9990.2 Ų90.246%0.45849%0.489SS..Hα-helixtrans-65.1-43.6171.3-71.4-54.9000112.2A83 Q84 Q90 H91A83-H87 WeakPolarHBondContact O-CB 3.49Å; A83-H87 PolarHBondContact O-CD2 2.97Å; A83-H87 VanDerWaalsContact O-CG 3.28Å; A83-H87 PolarHBondContact O-N 3.44Å; Q84-H87 PolarHBondContact O-N 3.39Å; H87-Q90 PolarHBondContact O-N 3.33Å; H87-H91 WeakPolarHBondContact O-CB 3.48Å; H87-H91 PolarHBondContact O-CD2 2.74Å; H87-H91 PolarHBondContact O-N 2.98Å
88S55.4Low58.5Low71 Ų7194.2 Ų94.250%0.49750%0.496SS..Hα-helixtrans-62.5-45.7175.8-177.40000111.9Q84 Q90 H91 Q92Q84-S88 WeakPolarHBondContact O-CB 3.25Å; Q84-S88 PolarHBondContact O-N 3.23Å; S88-Q90 PolarHBondContact O-N 3.45Å; S88-H91 PolarHBondContact O-N 2.88Å; S88-Q92 WeakPolarHBondContact O-CB 3.22Å; S88-Q92 PolarHBondContact O-N 2.93Å
89N60.5Low59.7Low93 Ų9395 Ų9550%0.49750%0.499SS..Hα-helixtrans-62.9-41.6175.3-84.2-68.6000111.5Q85 Q92 T93Q85-N89 WeakPolarHBondContact O-CB 3.35Å; Q85-N89 PolarHBondContact O-N 3.23Å; Q85-N89 PolarHBondContact O-ND2 3.31Å; N89-Q92 PolarHBondContact O-N 3.3Å; N89-T93 WeakPolarHBondContact O-CB 3.44Å; N89-T93 PolarHBondContact O-N 2.88Å; N89-T93 PolarHBondContact O-OG1 3.04Å
90Q63.2Low60.6Low125 Ų12593 Ų9358%0.58448%0.48SS*.Hα-helixtrans-63.6-42.5177.1-172.217545.300112S86 H87 S88 T93 S94S86-Q90 VanDerWaalsContact O-CB 3.22Å; S86-Q90 WeakPolarHBondContact O-CB 3.33Å; S86-Q90 PolarHBondContact O-N 3.18Å; H87-Q90 PolarHBondContact O-N 3.33Å; S88-Q90 PolarHBondContact O-N 3.45Å; Q90-T93 PolarHBondContact O-N 3.03Å; Q90-S94 VanDerWaalsContact O-CB 3.25Å; Q90-S94 WeakPolarHBondContact O-CB 3.47Å; Q90-S94 PolarHBondContact O-N 2.86Å
91H64.7Low61.5Low130 Ų13090.1 Ų90.160%0.60247%0.472SS*.Hα-helixtrans-66.3-40.1175.9-74.4-54.1000112.4H87 S88 S94 A95H87-H91 WeakPolarHBondContact O-CB 3.48Å; H87-H91 PolarHBondContact O-CD2 2.74Å; H87-H91 PolarHBondContact O-N 2.98Å; S88-H91 PolarHBondContact O-N 2.88Å; H91-S94 PolarHBondContact O-N 2.84Å; H91-A95 WeakPolarHBondContact O-CB 3.36Å; H91-A95 PolarHBondContact O-N 2.92Å
92Q63.7Low62.3Low112 Ų11290.1 Ų90.152%0.52347%0.472SS..Hα-helixtrans-67.2-41.4176.6-156.2173.335.200111.4S88 N89 A95 V96S88-Q92 WeakPolarHBondContact O-CB 3.22Å; S88-Q92 PolarHBondContact O-N 2.93Å; N89-Q92 PolarHBondContact O-N 3.3Å; Q92-A95 PolarHBondContact O-N 3.45Å; Q92-V96 VanDerWaalsContact O-CG2 3.32Å; Q92-V96 WeakPolarHBondContact O-CG2 3.38Å; Q92-V96 PolarHBondContact O-N 3.44Å
93T62.7Low63Low69 Ų6988.3 Ų88.342%0.42347%0.471SS..Hα-helixtrans-65.5-42.1175.7-43.80000110.8N89 Q90 V96 L97N89-T93 WeakPolarHBondContact O-CB 3.44Å; N89-T93 PolarHBondContact O-N 2.88Å; N89-T93 PolarHBondContact O-OG1 3.04Å; Q90-T93 PolarHBondContact O-N 3.03Å; T93-V96 PolarHBondContact O-N 2.98Å; T93-L97 HydrophobicContact CG2-CD1 4.31Å; T93-L97 WeakPolarHBondContact O-CB 3.46Å; T93-L97 VanDerWaalsContact O-CG 3.24Å; T93-L97 WeakPolarHBondContact O-CG 3.45Å; T93-L97 PolarHBondContact O-N 3.05Å
94S63.6Low63.4Low50 Ų5089.2 Ų89.235%0.3547%0.47SS..Hα-helixtrans-63.7-39.9175.6-1770000112.2Q90 H91 L97 R98Q90-S94 VanDerWaalsContact O-CB 3.25Å; Q90-S94 WeakPolarHBondContact O-CB 3.47Å; Q90-S94 PolarHBondContact O-N 2.86Å; H91-S94 PolarHBondContact O-N 2.84Å; S94-L97 PolarHBondContact O-N 3.33Å; S94-R98 WeakPolarHBondContact O-CB 3.23Å; S94-R98 PolarHBondContact O-N 2.94Å
95A68.1Low63.8Low46 Ų4688.5 Ų88.538%0.3847%0.467SS..Hα-helixtrans-64.8-44.117600000111.7H91 Q92 R98 I99H91-A95 WeakPolarHBondContact O-CB 3.36Å; H91-A95 PolarHBondContact O-N 2.92Å; Q92-A95 PolarHBondContact O-N 3.45Å; A95-R98 PolarHBondContact O-N 3.05Å; A95-I99 VanDerWaalsContact O-CG1 3.27Å; A95-I99 WeakPolarHBondContact O-CG1 3.47Å; A95-I99 PolarHBondContact O-N 3.44Å
96V71.2Confident64.2Low40 Ų4085.8 Ų85.824%0.24246%0.462CS..Hα-helixtrans-63.9-43.5176.4171.90000111.2Q92 T93 R98 I99 F100Q92-V96 VanDerWaalsContact O-CG2 3.32Å; Q92-V96 WeakPolarHBondContact O-CG2 3.38Å; Q92-V96 PolarHBondContact O-N 3.44Å; T93-V96 PolarHBondContact O-N 2.98Å; V96-R98 VanDerWaalsContact C-N 3.32Å; V96-R98 PolarHBondContact O-N 3.17Å; V96-I99 PolarHBondContact O-N 3.44Å; V96-F100 WeakPolarHBondContact O-CB 3.3Å; V96-F100 PolarHBondContact O-N 3.32Å
97L70.8Confident64.4Low99 Ų9991.3 Ų91.352%0.51847%0.474SS..Hα-helixtrans-63-39.3176.3-72.3171.9000111.7T93 S94 F100 T101T93-L97 HydrophobicContact CG2-CD1 4.31Å; T93-L97 WeakPolarHBondContact O-CB 3.46Å; T93-L97 VanDerWaalsContact O-CG 3.24Å; T93-L97 WeakPolarHBondContact O-CG 3.45Å; T93-L97 PolarHBondContact O-N 3.05Å; S94-L97 PolarHBondContact O-N 3.33Å; L97-F100 WeakPolarHBondContact O-CB 3.32Å; L97-F100 PolarHBondContact O-N 3.08Å; L97-T101 WeakPolarHBondContact O-CB 3.34Å; L97-T101 PolarHBondContact O-N 2.8Å; L97-T101 PolarHBondContact O-OG1 2.86Å
98R68.9Low64.7Low161 Ų16193 Ų9361%0.60849%0.486SS*.Hα-helixtrans-64.3-47.1176.3-169.4175.1-63163.72.3111.8S94 A95 V96 F100 T101 D102S94-R98 WeakPolarHBondContact O-CB 3.23Å; S94-R98 PolarHBondContact O-N 2.94Å; A95-R98 PolarHBondContact O-N 3.05Å; V96-R98 VanDerWaalsContact C-N 3.32Å; V96-R98 PolarHBondContact O-N 3.17Å; R98-F100 VanDerWaalsContact C-N 3.27Å; R98-F100 PolarHBondContact O-N 3.46Å; R98-T101 PolarHBondContact O-N 2.98Å; R98-D102 WeakPolarHBondContact O-CB 3.46Å; R98-D102 VanDerWaalsContact O-CG 3.23Å; R98-D102 PolarHBondContact O-N 2.9Å
99I71.8Confident64.9Low107 Ų10796.2 Ų96.255%0.54950%0.497SS..Hα-helixtrans-61.3-38.9176.4-65.3163.1000110.9A95 V96 S103A95-I99 VanDerWaalsContact O-CG1 3.27Å; A95-I99 WeakPolarHBondContact O-CG1 3.47Å; A95-I99 PolarHBondContact O-N 3.44Å; V96-I99 PolarHBondContact O-N 3.44Å; I99-S103 VanDerWaalsContact O-CB 3.3Å; I99-S103 WeakPolarHBondContact O-CB 3.46Å; I99-S103 PolarHBondContact O-N 2.97Å; I99-S103 PolarHBondContact O-OG 3.4Å
100F71.9Confident64.5Low60 Ų6094.4 Ų94.426%0.26349%0.491SS..Hα-helixtrans-64.5-47.5175.6174.2-103.2000111.9F20 V27 V96 L97 R98 S103 L104F20-F100 HydrophobicContact CE2-CZ 4.47Å; V27-F100 HydrophobicContact CG2-CD2 4.46Å; V96-F100 WeakPolarHBondContact O-CB 3.3Å; V96-F100 PolarHBondContact O-N 3.32Å; L97-F100 WeakPolarHBondContact O-CB 3.32Å; L97-F100 PolarHBondContact O-N 3.08Å; R98-F100 VanDerWaalsContact C-N 3.27Å; R98-F100 PolarHBondContact O-N 3.46Å; F100-S103 PolarHBondContact O-N 2.88Å; F100-L104 HydrophobicContact CD1-CD1 3.93Å; F100-L104 HydrophobicContact CD2-CD1 4.38Å; F100-L104 HydrophobicContact CE1-CD1 3.29Å; F100-L104 HydrophobicContact CE2-CD1 3.81Å; F100-L104 HydrophobicContact CG-CD1 4.45Å; F100-L104 HydrophobicContact CZ-CD1 3.23Å; F100-L104 HydrophobicContact CZ-CG 4.38Å; F100-L104 WeakPolarHBondContact O-CB 3.4Å; F100-L104 PolarHBondContact O-N 2.85Å
101T70.4Confident63.6Low76 Ų7690.2 Ų90.247%0.46648%0.482SS..Hα-helixtrans-60.7-45.2176.7-59.90000111.2L97 R98 S103 L104 Q105L97-T101 WeakPolarHBondContact O-CB 3.34Å; L97-T101 PolarHBondContact O-N 2.8Å; L97-T101 PolarHBondContact O-OG1 2.86Å; R98-T101 PolarHBondContact O-N 2.98Å; T101-S103 VanDerWaalsContact C-N 3.33Å; T101-S103 PolarHBondContact O-N 3.34Å; T101-L104 PolarHBondContact O-N 3.43Å; T101-Q105 VanDerWaalsContact O-CB 3.27Å; T101-Q105 WeakPolarHBondContact O-CB 3.39Å; T101-Q105 PolarHBondContact O-N 3Å
102D66.5Low62.7Low90 Ų9090.1 Ų90.148%0.48149%0.493SS..Hα-helixtrans-64.5-38.7178.4-67.9-13000111.4R98 Q105 S106R98-D102 WeakPolarHBondContact O-CB 3.46Å; R98-D102 VanDerWaalsContact O-CG 3.23Å; R98-D102 PolarHBondContact O-N 2.9Å; D102-Q105 PolarHBondContact O-N 2.86Å; D102-S106 VanDerWaalsContact O-CB 3.28Å; D102-S106 WeakPolarHBondContact O-CB 3.48Å; D102-S106 PolarHBondContact O-N 3.33Å
103S66.1Low61.7Low72 Ų7292.7 Ų92.750%0.50351%0.505SS..Hα-helixtrans-67.6-41.3177-60.30000112.1I99 F100 T101 Y107I99-S103 VanDerWaalsContact O-CB 3.3Å; I99-S103 WeakPolarHBondContact O-CB 3.46Å; I99-S103 PolarHBondContact O-N 2.97Å; I99-S103 PolarHBondContact O-OG 3.4Å; F100-S103 PolarHBondContact O-N 2.88Å; T101-S103 VanDerWaalsContact C-N 3.33Å; T101-S103 PolarHBondContact O-N 3.34Å; S103-Y107 WeakPolarHBondContact O-CB 3.39Å; S103-Y107 PolarHBondContact O-N 3.04Å
104L62.3Low60.7Low57 Ų5796.1 Ų96.130%0.29852%0.516SS..Hα-helixtrans-64.8-44.3174-102161000111.5F20 F100 T101 S106 Y107 L108F20-L104 HydrophobicContact CE2-CD1 4.39Å; F100-L104 HydrophobicContact CD1-CD1 3.93Å; F100-L104 HydrophobicContact CD2-CD1 4.38Å; F100-L104 HydrophobicContact CE1-CD1 3.29Å; F100-L104 HydrophobicContact CE2-CD1 3.81Å; F100-L104 HydrophobicContact CG-CD1 4.45Å; F100-L104 HydrophobicContact CZ-CD1 3.23Å; F100-L104 HydrophobicContact CZ-CG 4.38Å; F100-L104 WeakPolarHBondContact O-CB 3.4Å; F100-L104 PolarHBondContact O-N 2.85Å; T101-L104 PolarHBondContact O-N 3.43Å; L104-S106 VanDerWaalsContact C-N 3.33Å; L104-S106 PolarHBondContact O-N 3.33Å; L104-Y107 PolarHBondContact O-N 3.45Å; L104-L108 WeakPolarHBondContact O-CB 3.28Å; L104-L108 VanDerWaalsContact O-CG 3.23Å; L104-L108 WeakPolarHBondContact O-CG 3.25Å; L104-L108 PolarHBondContact O-N 3.38Å
105Q61Low59.5Low106 Ų106102.1 Ų102.150%0.49554%0.538SS..Hα-helixtrans-64.5-40.4179.4-167.1174.712.800111T101 D102 L108 L109T101-Q105 VanDerWaalsContact O-CB 3.27Å; T101-Q105 WeakPolarHBondContact O-CB 3.39Å; T101-Q105 PolarHBondContact O-N 3Å; D102-Q105 PolarHBondContact O-N 2.86Å; Q105-L108 PolarHBondContact O-N 2.96Å; Q105-L109 HydrophobicContact CG-CD1 3.9Å; Q105-L109 HydrophobicContact CG-CG 4.44Å; Q105-L109 VanDerWaalsContact O-CB 3.29Å; Q105-L109 WeakPolarHBondContact O-CB 3.35Å; Q105-L109 WeakPolarHBondContact O-CG 3.35Å; Q105-L109 PolarHBondContact O-N 3.48Å
106S57.8Low58Low71 Ų71107.1 Ų107.150%0.49756%0.558SS.*Hα-helixtrans-64.9-38.3174.9-161.60000112.3D102 L104 S110D102-S106 VanDerWaalsContact O-CB 3.28Å; D102-S106 WeakPolarHBondContact O-CB 3.48Å; D102-S106 PolarHBondContact O-N 3.33Å; L104-S106 VanDerWaalsContact C-N 3.33Å; L104-S106 PolarHBondContact O-N 3.33Å; S106-S110 WeakPolarHBondContact O-CB 3.27Å; S106-S110 PolarHBondContact O-N 2.88Å; S106-S110 PolarHBondContact O-OG 2.8Å
107Y58.2Low56.2Low183 Ų183108.8 Ų108.872%0.71858%0.575SS**Hα-helixtrans-69.9-38176.5-153.1-93.4000112.5S103 L104S103-Y107 WeakPolarHBondContact O-CB 3.39Å; S103-Y107 PolarHBondContact O-N 3.04Å; L104-Y107 PolarHBondContact O-N 3.45Å
108L60.4Low54.5Low135 Ų135108.7 Ų108.771%0.70759%0.589SS**Hα-helixtrans-70.4-37.8176.2-70.6168.4000112.2L104 Q105L104-L108 WeakPolarHBondContact O-CB 3.28Å; L104-L108 VanDerWaalsContact O-CG 3.23Å; L104-L108 WeakPolarHBondContact O-CG 3.25Å; L104-L108 PolarHBondContact O-N 3.38Å; Q105-L108 PolarHBondContact O-N 2.96Å
109L59.8Low52.7Low139 Ų139104 Ų10473%0.72859%0.59SS**Hα-helixtrans-76.7-26.2176.9-71170.6000113Q105 G111Q105-L109 HydrophobicContact CG-CD1 3.9Å; Q105-L109 HydrophobicContact CG-CG 4.44Å; Q105-L109 VanDerWaalsContact O-CB 3.29Å; Q105-L109 WeakPolarHBondContact O-CB 3.35Å; Q105-L109 WeakPolarHBondContact O-CG 3.35Å; Q105-L109 PolarHBondContact O-N 3.48Å; L109-G111 VanDerWaalsContact C-N 3.35Å
110S50.6Low50.9Low55 Ų55106.7 Ų106.739%0.38561%0.605SS.*Hα-helixtrans-78.7-16.3179.7-62.50000113.7S106S106-S110 WeakPolarHBondContact O-CB 3.27Å; S106-S110 PolarHBondContact O-N 2.88Å; S106-S110 PolarHBondContact O-OG 2.8Å
111G45.1Very low49Very low37 Ų37113.1 Ų113.138%0.38164%0.636SS.*G310 helixtrans56.6172.8178.200000114.8L109 Q113L109-G111 VanDerWaalsContact C-N 3.35Å; G111-Q113 PolarHBondContact O-N 2.66Å
112P46.8Very low47.1Very low128 Ų128112.5 Ų112.583%0.83165%0.645SS**G310 helixtrans-70.58.6-179.3-14.229.2000114.8
113Q40.8Very low45.3Very low165 Ų165118 Ų11877%0.77167%0.668SS**G310 helixtrans-85.3-14.9-164.9-159.5163.3-19.300114.1G111G111-Q113 PolarHBondContact O-N 2.66Å
114Q43Very low43.6Very low142 Ų142123.1 Ų123.166%0.66468%0.684SS**G310 helixtrans-89.2-11.3-177.9-66.5-160.5-16.700115.3
115H38.7Very low41.8Very low175 Ų175126.2 Ų126.281%0.8171%0.709SS**SBendtrans-92.6-7.6176.9-91.5-162000114.7
116L36.4Very low40.3Very low152 Ų152125.4 Ų125.480%0.79672%0.72SS**SBendtrans-96.4-14.7170.5-78.4161.8000113.2
117A33Very low39.3Very low74 Ų74127.9 Ų127.961%0.61273%0.734SS**THydrogen-bonded Turntrans-93-4.9-175.300000115
118A35.3Very low38.1Very low97 Ų97123.5 Ų123.580%0.80274%0.736SS**THydrogen-bonded Turntrans-100.94.1179.700000114.3
119G31.1Very low36.7Very low62 Ų62126.6 Ų126.664%0.63975%0.747SS**SBendtrans-116.2-1-173.400000116.8
120L34.1Very low35.4Very low165 Ų165132 Ų13286%0.86476%0.758SS**  trans-138.136.7-174.5-72.5173.8000113.7
121E32Very low34.2Very low194 Ų194133 Ų13391%0.90778%0.776SS**  trans-102.693.4164.6-78.8-92.2125.700108.1
122G30.7Very low33.4Very low64 Ų64136.7 Ų136.766%0.6680%0.797SS**  trans167.551.917600000116.3
123E28.8Very low32.5Very low205 Ų205137.8 Ų137.896%0.95880%0.795SS**  trans-174.2137.2135.4-107.8165.283.400110.9
124Q29.8Very low31.9Very low180 Ų180136.3 Ų136.384%0.84180%0.797SS**  trans-118.9145.1-159175.9162.281.900110.3
125C24.8Very low31.3Very low122 Ų122134.8 Ų134.882%0.82480%0.803SS**  trans77.1141.8160.6-76.60000118.7
126A29.6Very low31.1Very low89 Ų89132.4 Ų132.474%0.73680%0.802SS**  cis-165.5-156100000109.7
127P37.4Very low30.6Very low122 Ų122129.9 Ų129.979%0.79280%0.798SS**  -118.3166.1-108.835.5-16000116.7
128A32.9Very low30.8Very low91 Ų91137.4 Ų137.475%0.75281%0.81SS**  trans45.8126.1152.300000120.8
129E29.4Very low30.5Very low201 Ų201140.5 Ų140.594%0.93981%0.808SS**  -163.9149.9129.6-83.1-129.1117.300111.6
130R34.2Very low30.6Very low252 Ų252144.1 Ų144.195%0.95181%0.813SS**  trans-86.3147.2178.2-70.9177.8-179.3134.3-1.9110.9
131G25.3Very low30.7Very low75 Ų75144.5 Ų144.577%0.77382%0.815SS**  trans119.2137.513500000118.7
132S27Very low30.9Very low116 Ų116138.3 Ų138.381%0.81180%0.803SS**  trans89.5119.9145.8-138.60000120.5
133D27.8Very low31Very low150 Ų150139.2 Ų139.280%0.80281%0.812SS**  trans22.1124.8139.5-88.1-34.4000119.2
134V28.1Very low31.6Very low134 Ų134141.7 Ų141.781%0.81281%0.813SS**  177.4123.1115.3148.20000108.8
135S30Very low31.9Very low111 Ų111136.4 Ų136.478%0.77681%0.807SS**  trans-67.6161.4164.7-66.60000110.9
136P36Very low32.3Very low124 Ų124136.1 Ų136.181%0.80581%0.806SS**  -143.4143.3112.428.4-9.6000116.8
137S26.3Very low33.1Very low100 Ų100138 Ų13870%0.69981%0.811SS**  trans70.3106.4137.2-136.90000122.1
138R35.8Very low33.2Very low231 Ų231135.9 Ų135.987%0.87280%0.804SS**  trans-52.9139.4154.3-63.6179.1159.7-167.3-6.3112.3
139H30.6Very low33.5Very low162 Ų162137.7 Ų137.775%0.7581%0.808SS**  trans-156137.1142.8-77.8-65.2000111.7
140N31.3Very low34Very low138 Ų138134 Ų13474%0.73880%0.804SS**  trans79.697.3164.7-53.5-52.8000117.1
141L36.9Very low34.1Very low174 Ų174131 Ų13191%0.91180%0.801SS**  67117.773.9-68.2172000113.8
142G36.3Very low35Very low64 Ų64132.5 Ų132.566%0.6680%0.8SS**  trans143.957.3160.600000115.9
143G32.6Very low35.7Very low83 Ų83138.5 Ų138.586%0.85681%0.806SS**  trans-74.1122166.500000110.4G145G143-G145 PolarHBondContact O-N 3.23Å
144W42.4Very low36.3Very low256 Ų256134.3 Ų134.397%0.9780%0.799SS**  trans-9190.7172.2-72.563.8000108
145G35.4Very low36.9Very low69 Ų69137 Ų13771%0.71180%0.802SS**  trans-79.7150.7162.700000110.2G143G143-G145 PolarHBondContact O-N 3.23Å
146S34.1Very low37.8Very low116 Ų116137.3 Ų137.381%0.81180%0.801SS**  trans-44.3146.1177.1-45.70000113.8A148S146-A148 PolarHBondContact O-N 2.76Å
147P45.9Very low38.2Very low130 Ų130137.2 Ų137.284%0.84480%0.804SS**  trans-74.6114.4169.629.7-27.7000109
148A38.7Very low38.9Very low77 Ų77138.2 Ų138.264%0.63681%0.811SS**  trans-71.1150.7160.800000109.5S146 S150S146-A148 PolarHBondContact O-N 2.76Å; A148-S150 PolarHBondContact O-N 3.06Å
149P39.6Very low39.2Very low129 Ų129133.3 Ų133.384%0.83881%0.807SS**  trans-65.7128.4178.929.1-32.1000108.7
150S40Very low39.5Very low123 Ų123133.6 Ų133.686%0.8681%0.813SS**  trans-94.4112.7177.4-620000109.6A148A148-S150 PolarHBondContact O-N 3.06Å
151E36.3Very low40.2Very low190 Ų190132.1 Ų132.189%0.88881%0.811SS**  trans-74.5136.6165.6-80.7175116.600111.6
152S43.5Very low40.4Very low106 Ų106133 Ų13374%0.74181%0.81SS**  trans48.2108.5142.2-164.80000120.4
153Y43.3Very low40.5Very low241 Ų241139.1 Ų139.195%0.94582%0.822SS**  trans-107.1104.4141.3-97.9-87.9000108.7
154G39Very low41.1Very low63 Ų63143.8 Ų143.865%0.64982%0.821SS**  trans-66.9142179.100000113.9
155H40.3Very low41.5Very low190 Ų190141 Ų14188%0.8882%0.819SS**  trans-93.2133.4161.4-94.9-86.8000109.4S157H155-S157 PolarHBondContact O-N 3.39Å
156P50.5Low42.1Very low118 Ų118146.4 Ų146.477%0.76683%0.826SS**SBendtrans-88.299.3175.933.4-27.3000109
157S43.6Very low43Very low122 Ų122149.7 Ų149.785%0.85383%0.828SS**  trans161.896.5146.8-79.40000110H155H155-S157 PolarHBondContact O-N 3.39Å
158S40.2Very low43.5Very low121 Ų121152.3 Ų152.385%0.84683%0.829SS**  trans-157.3107.7140.2-149.60000107.9
159T43.6Very low44.7Very low128 Ų128153.6 Ų153.679%0.78583%0.833SS**  trans-69123.2162.143.90000108.1
160L36.7Very low46.3Very low168 Ų168149.9 Ų149.988%0.8881%0.81SS**  trans173.6159.5143.3-91.2167.5000110
161P44.8Very low48.6Very low107 Ų107147.2 Ų147.270%0.69579%0.791SS**  trans-83.9156.6-141.733.2-35000115E163P161-E163 PolarHBondContact O-N 2.97Å
162E42.7Very low50.9Low193 Ų193143 Ų14390%0.90278%0.779SS**  trans-6.9108.1172.1-71.3170.9122.900115.5E164E162-E164 PolarHBondContact O-N 3.46Å
163E38.3Very low53.1Low192 Ų192144.8 Ų144.890%0.89777%0.77SS**  trans-62.2110.7171.3-61175.6149.900108.7P161P161-E163 PolarHBondContact O-N 2.97Å
164E44Very low55.2Low180 Ų180135.9 Ų135.984%0.84174%0.743SS**  trans-59.5136.1154.9-71.7-179.4149.400107.4E162 E166E162-E164 PolarHBondContact O-N 3.46Å; E164-E166 VanDerWaalsContact C-N 3.31Å; E164-E166 PolarHBondContact O-N 2.91Å
165E50.8Low57.6Low198 Ų198137.2 Ų137.293%0.92573%0.734SS**  trans-53.584.6-179.4-63.1171159.100111.7E167E165-E167 PolarHBondContact O-N 3.3Å
166E47.8Very low60.1Low183 Ų183133.3 Ų133.386%0.85572%0.717SS**  trans-78.597.4158.8-72.2-174.4175.400106E164 E168E164-E166 VanDerWaalsContact C-N 3.31Å; E164-E166 PolarHBondContact O-N 2.91Å; E166-E168 VanDerWaalsContact C-N 3.3Å; E166-E168 PolarHBondContact O-N 3.36Å
167E53.8Low62.2Low185 Ų185131.3 Ų131.386%0.86470%0.699SS**  trans-44.7104.1158.6-78.5179.9157.200106.6E165 S169E165-E167 PolarHBondContact O-N 3.3Å; E167-S169 PolarHBondContact O-N 3.35Å
168E56.6Low64.6Low184 Ų184130.1 Ų130.186%0.8668%0.68SS**  trans-68.384.5-179.3-164165.3-16100106.3E166 C170E166-E168 VanDerWaalsContact C-N 3.3Å; E166-E168 PolarHBondContact O-N 3.36Å; E168-C170 PolarHBondContact O-N 3.01Å
169S62.7Low67.2Low104 Ų104130.3 Ų130.373%0.72767%0.667SS**  trans-58.9108-177.461.80000105.9E167 C171E167-S169 PolarHBondContact O-N 3.35Å; S169-C171 PolarHBondContact O-N 3.32Å
170C73.6Confident69.6Low52 Ų52129.1 Ų129.135%0.35165%0.653SS.*  trans-50.3139.8177.2-75.60000108.4E168 C174 L175E168-C170 PolarHBondContact O-N 3.01Å; C170-C174 HydrophobicContact CB-CB 3.75Å; C170-L175 HydrophobicContact CB-CD2 3.91Å; C170-L175 HydrophobicContact CB-CG 4.01Å; C170-L175 WeakPolarHBondContact O-CD1 3.41Å
171C88.3Confident72.4Confident67 Ų67124.6 Ų124.645%0.45363%0.632SS.*  trans-57.4156.6-178.778.50000109.8S169 R173 C174 L175S169-C171 PolarHBondContact O-N 3.32Å; C171-R173 PolarHBondContact O-N 3.5Å; C171-C174 WeakPolarHBondContact O-CA 3.32Å; C171-C174 WeakPolarHBondContact O-CB 3.48Å; C171-C174 PolarHBondContact O-N 2.88Å; C171-C174 PolarHBondContact SG-SG 2.89Å; C171-L175 PolarHBondContact O-N 3.37Å; C171-L175 VanDerWaalsContact O-N 3.13Å
172P84.5Confident74.8Confident100 Ų100124.3 Ų124.365%0.64962%0.624SS**Hα-helixtrans-51.9-33.9-173.6-28.834.6000113.6L175 E176P172-L175 PolarHBondContact O-N 3.48Å; P172-E176 WeakPolarHBondContact O-CG 3.3Å; P172-E176 PolarHBondContact O-N 3.23Å
173R89.6Confident77.3Confident144 Ų144118.3 Ų118.354%0.54360%0.603SS.*Hα-helixtrans-69.4-36.5176.9-17456.2176.6179.15.6113.5C171 E176 L177C171-R173 PolarHBondContact O-N 3.5Å; R173-E176 IonicContact CZ-OE2 3.95Å; R173-E176 IonicContact NH1-OE2 2.96Å; R173-E176 PolarHBondContact NH1-OE2 3.41Å; R173-L177 HydrophobicContact CG-CD1 4.29Å; R173-L177 VanDerWaalsContact O-CG 3.27Å; R173-L177 WeakPolarHBondContact O-CG 3.26Å; R173-L177 PolarHBondContact O-N 3.45Å; R173-L177 VanDerWaalsContact O-N 3.09Å
174C87.3Confident80.1Confident55 Ų55112.8 Ų112.837%0.37258%0.579SS.*Hα-helixtrans-68.6-40.9175.9-69.10000110.8C170 C171 E176 L177 E178C170-C174 HydrophobicContact CB-CB 3.75Å; C171-C174 WeakPolarHBondContact O-CA 3.32Å; C171-C174 WeakPolarHBondContact O-CB 3.48Å; C171-C174 PolarHBondContact O-N 2.88Å; C171-C174 PolarHBondContact SG-SG 2.89Å; C174-E176 PolarHBondContact O-N 2.9Å; C174-L177 PolarHBondContact O-N 2.94Å; C174-E178 WeakPolarHBondContact O-CG 3.36Å; C174-E178 PolarHBondContact O-N 3.47Å
175L90.9Very high82.4Confident91 Ų91109.9 Ų109.948%0.47657%0.565SS.*Hα-helixtrans-63.5-40.4175.1-66.3172.9000112.3C170 C171 P172 L177 E178 Q179C170-L175 HydrophobicContact CB-CD2 3.91Å; C170-L175 HydrophobicContact CB-CG 4.01Å; C170-L175 WeakPolarHBondContact O-CD1 3.41Å; C171-L175 PolarHBondContact O-N 3.37Å; C171-L175 VanDerWaalsContact O-N 3.13Å; P172-L175 PolarHBondContact O-N 3.48Å; L175-L177 VanDerWaalsContact C-N 3.34Å; L175-E178 PolarHBondContact O-N 2.99Å; L175-Q179 WeakPolarHBondContact O-CB 3.45Å; L175-Q179 PolarHBondContact O-N 2.92Å
176E91.4Very high84.6Confident108 Ų108106.1 Ų106.151%0.50555%0.548SS..Hα-helixtrans-60-43.9172.6-77.1174-173.700112P172 R173 C174 Q179 E180P172-E176 WeakPolarHBondContact O-CG 3.3Å; P172-E176 PolarHBondContact O-N 3.23Å; R173-E176 IonicContact CZ-OE2 3.95Å; R173-E176 IonicContact NH1-OE2 2.96Å; R173-E176 PolarHBondContact NH1-OE2 3.41Å; C174-E176 PolarHBondContact O-N 2.9Å; E176-Q179 WeakPolarHBondContact O-CB 3.37Å; E176-Q179 PolarHBondContact O-N 2.89Å; E176-E180 WeakPolarHBondContact O-CB 3.23Å; E176-E180 PolarHBondContact O-N 3.27Å
177L94.4Very high86.7Confident75 Ų75102.3 Ų102.339%0.39353%0.53SS..Hα-helixtrans-68.8-38.3179.4-73.8167.8000111.9R173 C174 L175 E180 V181R173-L177 HydrophobicContact CG-CD1 4.29Å; R173-L177 VanDerWaalsContact O-CG 3.27Å; R173-L177 WeakPolarHBondContact O-CG 3.26Å; R173-L177 PolarHBondContact O-N 3.45Å; R173-L177 VanDerWaalsContact O-N 3.09Å; C174-L177 PolarHBondContact O-N 2.94Å; L175-L177 VanDerWaalsContact C-N 3.34Å; L177-E180 PolarHBondContact O-N 2.85Å; L177-V181 VanDerWaalsContact O-CG2 3.28Å; L177-V181 WeakPolarHBondContact O-CG2 3.42Å; L177-V181 PolarHBondContact O-N 3.29Å
178E93.9Very high88.5Confident98 Ų9898 Ų9846%0.45851%0.513SS..Hα-helixtrans-62.4-44173.3-75.7170.9-172.400111.2C174 L175 E180 V181 L182C174-E178 WeakPolarHBondContact O-CG 3.36Å; C174-E178 PolarHBondContact O-N 3.47Å; L175-E178 PolarHBondContact O-N 2.99Å; E178-E180 VanDerWaalsContact C-N 3.35Å; E178-E180 PolarHBondContact O-N 3.49Å; E178-V181 PolarHBondContact O-N 2.88Å; E178-L182 WeakPolarHBondContact O-CG 3.29Å; E178-L182 PolarHBondContact O-N 3.37Å
179Q95.1Very high90.3Very high125 Ų12593.9 Ų93.958%0.58449%0.494SS*.Hα-helixtrans-60.4-44.2173.7-17286.688.900111.3L175 E176 L182 C183L175-Q179 WeakPolarHBondContact O-CB 3.45Å; L175-Q179 PolarHBondContact O-N 2.92Å; E176-Q179 WeakPolarHBondContact O-CB 3.37Å; E176-Q179 PolarHBondContact O-N 2.89Å; Q179-L182 PolarHBondContact O-N 3.3Å; Q179-C183 PolarHBondContact O-N 2.86Å; Q179-C183 PolarHBondContact O-SG 3.2Å; Q179-C183 VanDerWaalsContact O-SG 3.38Å
180E94.6Very high91.6Very high102 Ų10293 Ų9348%0.47748%0.478SS..Hα-helixtrans-63.9-42.3178.4-173.6176.2177.300111.8E176 L177 E178 L182 C183 L184E176-E180 WeakPolarHBondContact O-CB 3.23Å; E176-E180 PolarHBondContact O-N 3.27Å; L177-E180 PolarHBondContact O-N 2.85Å; E178-E180 VanDerWaalsContact C-N 3.35Å; E178-E180 PolarHBondContact O-N 3.49Å; E180-L182 VanDerWaalsContact C-N 3.33Å; E180-L182 PolarHBondContact O-N 3.43Å; E180-C183 PolarHBondContact O-N 3.11Å; E180-L184 HydrophobicContact CG-CD1 4.01Å; E180-L184 HydrophobicContact CG-CG 4.4Å; E180-L184 WeakPolarHBondContact O-CB 3.29Å; E180-L184 VanDerWaalsContact O-CG 3.29Å; E180-L184 WeakPolarHBondContact O-CG 3.43Å; E180-L184 PolarHBondContact O-N 3.48Å
181V96.3Very high92.3Very high74 Ų7494.6 Ų94.645%0.44848%0.483SS..Hα-helixtrans-61.3-42.9176168.50000110.9L177 E178 L184 Q185L177-V181 VanDerWaalsContact O-CG2 3.28Å; L177-V181 WeakPolarHBondContact O-CG2 3.42Å; L177-V181 PolarHBondContact O-N 3.29Å; E178-V181 PolarHBondContact O-N 2.88Å; V181-L184 PolarHBondContact O-N 3.38Å; V181-Q185 HydrophobicContact CG1-CG 4.41Å; V181-Q185 WeakPolarHBondContact O-CB 3.27Å; V181-Q185 WeakPolarHBondContact O-CG 3.49Å; V181-Q185 PolarHBondContact O-N 2.9Å
182L95.2Very high92.1Very high101 Ų10199 Ų9953%0.52949%0.49SS..Hα-helixtrans-64.4-43.5176.6-70.1172.1000111.8E178 Q179 E180 Q185 Q186E178-L182 WeakPolarHBondContact O-CG 3.29Å; E178-L182 PolarHBondContact O-N 3.37Å; Q179-L182 PolarHBondContact O-N 3.3Å; E180-L182 VanDerWaalsContact C-N 3.33Å; E180-L182 PolarHBondContact O-N 3.43Å; L182-Q185 PolarHBondContact O-N 3.4Å; L182-Q186 PolarHBondContact O-N 3.48Å
183C94.8Very high92.1Very high67 Ų6797.5 Ų97.545%0.45348%0.476SS..Hα-helixtrans-62.3-43.1175.6-72.30000112Q179 E180 Q185 Q186 E187Q179-C183 PolarHBondContact O-N 2.86Å; Q179-C183 PolarHBondContact O-SG 3.2Å; Q179-C183 VanDerWaalsContact O-SG 3.38Å; E180-C183 PolarHBondContact O-N 3.11Å; C183-Q185 VanDerWaalsContact C-N 3.35Å; C183-Q186 PolarHBondContact O-N 3.09Å; C183-E187 WeakPolarHBondContact O-CB 3.4Å; C183-E187 PolarHBondContact O-N 3.49Å
184L95.7Very high91.7Very high76 Ų7696.6 Ų96.640%0.39848%0.476SS..Hα-helixtrans-68.6-33.3177.8-72.7172.7000112.5E180 V181 N188E180-L184 HydrophobicContact CG-CD1 4.01Å; E180-L184 HydrophobicContact CG-CG 4.4Å; E180-L184 WeakPolarHBondContact O-CB 3.29Å; E180-L184 VanDerWaalsContact O-CG 3.29Å; E180-L184 WeakPolarHBondContact O-CG 3.43Å; E180-L184 PolarHBondContact O-N 3.48Å; V181-L184 PolarHBondContact O-N 3.38Å; L184-N188 WeakPolarHBondContact O-CB 3.46Å; L184-N188 PolarHBondContact O-N 3.13Å; L184-N188 PolarHBondContact O-ND2 3.42Å
185Q93.4Very high91.1Very high118 Ų11899.7 Ų99.755%0.55149%0.488SS*.Hα-helixtrans-66.3-43.7172.9-77.4173.5-6.500111V181 L182 C183 N188 E189V181-Q185 HydrophobicContact CG1-CG 4.41Å; V181-Q185 WeakPolarHBondContact O-CB 3.27Å; V181-Q185 WeakPolarHBondContact O-CG 3.49Å; V181-Q185 PolarHBondContact O-N 2.9Å; L182-Q185 PolarHBondContact O-N 3.4Å; C183-Q185 VanDerWaalsContact C-N 3.35Å; Q185-N188 PolarHBondContact O-N 2.96Å; Q185-E189 PolarHBondContact O-N 3.01Å
186Q95.9Very high90.2Very high120 Ų120102.8 Ų102.856%0.56150%0.501SS*.Hα-helixtrans-61.7-46.6173.9-178.1-179.6-800111.5L182 C183 N188 E189 E190L182-Q186 PolarHBondContact O-N 3.48Å; C183-Q186 PolarHBondContact O-N 3.09Å; Q186-N188 VanDerWaalsContact C-N 3.34Å; Q186-N188 PolarHBondContact O-N 3.04Å; Q186-E189 PolarHBondContact O-N 3.22Å; Q186-E190 PolarHBondContact NE2-OE1 2.99Å; Q186-E190 WeakPolarHBondContact O-CG 3.42Å; Q186-E190 PolarHBondContact O-N 3.31Å
187E92Very high89.1Confident103 Ų103103.6 Ų103.648%0.48151%0.508SS..Hα-helixtrans-62.5-40.9177.7-174.6179.9-17600111.6C183 E189 E190 L191C183-E187 WeakPolarHBondContact O-CB 3.4Å; C183-E187 PolarHBondContact O-N 3.49Å; E187-E189 VanDerWaalsContact C-N 3.3Å; E187-E189 PolarHBondContact O-N 2.94Å; E187-E190 PolarHBondContact O-N 3.34Å; E187-L191 HydrophobicContact CG-CD1 4.1Å; E187-L191 HydrophobicContact CG-CG 4.36Å; E187-L191 WeakPolarHBondContact O-CB 3.41Å; E187-L191 VanDerWaalsContact O-CG 3.25Å; E187-L191 WeakPolarHBondContact O-CG 3.48Å; E187-L191 PolarHBondContact O-N 2.9Å
188N91.9Very high87.6Confident94 Ų94104.8 Ų104.850%0.50351%0.514SS..Hα-helixtrans-61.6-39.5174.9-91.2-72000112.2L184 Q185 Q186 L191 R192L184-N188 WeakPolarHBondContact O-CB 3.46Å; L184-N188 PolarHBondContact O-N 3.13Å; L184-N188 PolarHBondContact O-ND2 3.42Å; Q185-N188 PolarHBondContact O-N 2.96Å; Q186-N188 VanDerWaalsContact C-N 3.34Å; Q186-N188 PolarHBondContact O-N 3.04Å; N188-L191 PolarHBondContact O-N 3.4Å; N188-R192 WeakPolarHBondContact O-CB 3.34Å; N188-R192 WeakPolarHBondContact O-CG 3.25Å; N188-R192 PolarHBondContact O-N 3.37Å
189E93.9Very high86Confident98 Ų98104.8 Ų104.846%0.45852%0.523SS..Hα-helixtrans-68.3-39.7176.2-169.756-145.600111.2Q185 Q186 E187 L191 R192 N193Q185-E189 PolarHBondContact O-N 3.01Å; Q186-E189 PolarHBondContact O-N 3.22Å; E187-E189 VanDerWaalsContact C-N 3.3Å; E187-E189 PolarHBondContact O-N 2.94Å; E189-L191 VanDerWaalsContact C-N 3.34Å; E189-L191 PolarHBondContact O-N 3.36Å; E189-R192 PolarHBondContact O-N 3.37Å; E189-N193 WeakPolarHBondContact O-CB 3.45Å; E189-N193 PolarHBondContact O-N 3.41Å; E189-N193 PolarHBondContact O-ND2 2.78Å; E189-N193 PolarHBondContact OE1-ND2 2.95Å
190E91.9Very high84.5Confident86 Ų86104.8 Ų104.840%0.40253%0.531SS..Hα-helixtrans-63.9-38.4172.1-74.2-178.2-161.400112.5Q186 E187 N193 K194Q186-E190 PolarHBondContact NE2-OE1 2.99Å; Q186-E190 WeakPolarHBondContact O-CG 3.42Å; Q186-E190 PolarHBondContact O-N 3.31Å; E187-E190 PolarHBondContact O-N 3.34Å; E190-N193 PolarHBondContact O-N 2.91Å; E190-K194 WeakPolarHBondContact O-CB 3.37Å; E190-K194 VanDerWaalsContact O-CG 3.25Å; E190-K194 WeakPolarHBondContact O-CG 3.32Å; E190-K194 PolarHBondContact O-N 2.87Å; E190-K194 IonicContact OE2-NZ 3.98Å
191L87.4Confident82.8Confident84 Ų84105.5 Ų105.544%0.4454%0.544SS..Hα-helixtrans-69.4-36.8176.5-73.6172.2000111.7E187 N188 E189 K194 L195E187-L191 HydrophobicContact CG-CD1 4.1Å; E187-L191 HydrophobicContact CG-CG 4.36Å; E187-L191 WeakPolarHBondContact O-CB 3.41Å; E187-L191 VanDerWaalsContact O-CG 3.25Å; E187-L191 WeakPolarHBondContact O-CG 3.48Å; E187-L191 PolarHBondContact O-N 2.9Å; N188-L191 PolarHBondContact O-N 3.4Å; E189-L191 VanDerWaalsContact C-N 3.34Å; E189-L191 PolarHBondContact O-N 3.36Å; L191-K194 HydrophobicContact CD2-CD 4.46Å; L191-K194 PolarHBondContact O-N 3.34Å; L191-L195 VanDerWaalsContact O-CB 3.3Å; L191-L195 WeakPolarHBondContact O-CB 3.38Å; L191-L195 PolarHBondContact O-N 3.37Å
192R84.4Confident80.9Confident161 Ų161103.9 Ų103.961%0.60854%0.536SS*.Hα-helixtrans-63.8-47.3171.2-78.9179167177.4-2.8111.4N188 E189 K194 L195 E196N188-R192 WeakPolarHBondContact O-CB 3.34Å; N188-R192 WeakPolarHBondContact O-CG 3.25Å; N188-R192 PolarHBondContact O-N 3.37Å; E189-R192 PolarHBondContact O-N 3.37Å; R192-K194 VanDerWaalsContact C-N 3.32Å; R192-K194 PolarHBondContact O-N 2.96Å; R192-L195 WeakPolarHBondContact O-CB 3.48Å; R192-L195 PolarHBondContact O-N 3.22Å; R192-L195 VanDerWaalsContact O-N 3.15Å; R192-E196 WeakPolarHBondContact O-CG 3.4Å; R192-E196 PolarHBondContact O-N 3.42Å
193N83.8Confident79.4Confident67 Ų67108 Ų10836%0.35855%0.552SS.*Hα-helixtrans-59.2-43.3173.1-80-64.7000111.4E189 E190 L195 E196 N197E189-N193 WeakPolarHBondContact O-CB 3.45Å; E189-N193 PolarHBondContact O-N 3.41Å; E189-N193 PolarHBondContact O-ND2 2.78Å; E189-N193 PolarHBondContact OE1-ND2 2.95Å; E190-N193 PolarHBondContact O-N 2.91Å; N193-L195 VanDerWaalsContact C-N 3.33Å; N193-L195 PolarHBondContact O-N 2.99Å; N193-E196 PolarHBondContact O-N 2.85Å; N193-N197 WeakPolarHBondContact O-CB 3.34Å; N193-N197 PolarHBondContact O-N 3.46Å; N193-N197 PolarHBondContact O-ND2 2.8Å
194K81.3Confident78Confident125 Ų125109 Ų10954%0.54355%0.553SS.*Hα-helixtrans-62.2-40.6175.6-78.4166.8-176.41600111.7E190 L191 R192 N197 I198E190-K194 WeakPolarHBondContact O-CB 3.37Å; E190-K194 VanDerWaalsContact O-CG 3.25Å; E190-K194 WeakPolarHBondContact O-CG 3.32Å; E190-K194 PolarHBondContact O-N 2.87Å; E190-K194 IonicContact OE2-NZ 3.98Å; L191-K194 HydrophobicContact CD2-CD 4.46Å; L191-K194 PolarHBondContact O-N 3.34Å; R192-K194 VanDerWaalsContact C-N 3.32Å; R192-K194 PolarHBondContact O-N 2.96Å; K194-N197 CarbonylContact O-C 3.53Å; K194-N197 PolarHBondContact O-N 2.9Å; K194-I198 WeakPolarHBondContact O-CG1 3.38Å; K194-I198 PolarHBondContact O-N 2.94Å
195L74.8Confident76.8Confident120 Ų120109.8 Ų109.863%0.62856%0.561SS**Hα-helixtrans-65.2-40.8177.1-175.159.7000111.9L191 R192 N193 N197 I198L191-L195 VanDerWaalsContact O-CB 3.3Å; L191-L195 WeakPolarHBondContact O-CB 3.38Å; L191-L195 PolarHBondContact O-N 3.37Å; R192-L195 WeakPolarHBondContact O-CB 3.48Å; R192-L195 PolarHBondContact O-N 3.22Å; R192-L195 VanDerWaalsContact O-N 3.15Å; N193-L195 VanDerWaalsContact C-N 3.33Å; N193-L195 PolarHBondContact O-N 2.99Å; L195-N197 VanDerWaalsContact C-N 3.29Å; L195-N197 PolarHBondContact O-N 2.96Å; L195-I198 HydrophobicContact CD1-CD1 3.73Å; L195-I198 HydrophobicContact CD1-CG1 4.49Å; L195-I198 PolarHBondContact O-N 2.89Å
196E72.8Confident75.7Confident157 Ų157109.7 Ų109.773%0.73456%0.564SS**Hα-helixtrans-68-29174.2-72.3-174.9179.900112.6R192 N193R192-E196 WeakPolarHBondContact O-CG 3.4Å; R192-E196 PolarHBondContact O-N 3.42Å; N193-E196 PolarHBondContact O-N 2.85Å
197N66.8Low74.5Confident124 Ų124107.4 Ų107.466%0.66356%0.556SS**THydrogen-bonded Turntrans-89.11.8175.2-72.7-67.1000113.8N193 K194 L195 P199N193-N197 WeakPolarHBondContact O-CB 3.34Å; N193-N197 PolarHBondContact O-N 3.46Å; N193-N197 PolarHBondContact O-ND2 2.8Å; K194-N197 CarbonylContact O-C 3.53Å; K194-N197 PolarHBondContact O-N 2.9Å; L195-N197 VanDerWaalsContact C-N 3.29Å; L195-N197 PolarHBondContact O-N 2.96Å; N197-P199 VanDerWaalsContact O-CD 3.3Å; N197-P199 WeakPolarHBondContact O-CD 3.44Å
198I63.6Low73.7Confident101 Ų101108.8 Ų108.852%0.51856%0.557SS.*SBendtrans-69120.8169.7-58-173.7000106.8K194 L195 V200K194-I198 WeakPolarHBondContact O-CG1 3.38Å; K194-I198 PolarHBondContact O-N 2.94Å; L195-I198 HydrophobicContact CD1-CD1 3.73Å; L195-I198 HydrophobicContact CD1-CG1 4.49Å; L195-I198 PolarHBondContact O-N 2.89Å; I198-V200 PolarHBondContact O-N 2.87Å
199P59.9Low73.1Confident98 Ų98110 Ų11064%0.63656%0.558SS**PPolyproline II helixtrans-54.6131.1174.4-21.131.6000108.8N197N197-P199 VanDerWaalsContact O-CD 3.3Å; N197-P199 WeakPolarHBondContact O-CD 3.44Å
200V65.1Low72.2Confident125 Ų125111.3 Ų111.376%0.75856%0.562SS**PPolyproline II helixtrans-46.3134.2177.9178.90000108.7I198 C202I198-V200 PolarHBondContact O-N 2.87Å; V200-C202 PolarHBondContact O-N 3.39Å
201P57.8Low71.4Confident116 Ų116109 Ų10975%0.75356%0.559SS**  trans-48.3115.6177-26.933.6000109.3Q203P201-Q203 PolarHBondContact O-N 3.32Å; P201-Q203 VanDerWaalsContact O-N 3.11Å
202C57.6Low70.9Confident41 Ų41108.1 Ų108.128%0.27756%0.556SS.*  trans-65.6119.9-173.9-27.40000106.2V200 N204 D207 Y208V200-C202 PolarHBondContact O-N 3.39Å; C202-N204 PolarHBondContact O-N 2.75Å; C202-D207 HydrophobicContact CB-CB 3.88Å; C202-Y208 WeakPolarHBondContact SG-CA 3.25Å; C202-Y208 WeakPolarHBondContact SG-CB 3.24Å
203Q61.7Low70.6Confident188 Ų188106.3 Ų106.388%0.87956%0.558SS**SBendtrans-57.1-18-175.9-169.962.354.900112.3P201P201-Q203 PolarHBondContact O-N 3.32Å; P201-Q203 VanDerWaalsContact O-N 3.11Å
204N65.4Low70.2Confident87 Ų87108.8 Ų108.847%0.46557%0.567SS.*SBendtrans-141.9147.6174.6-168.2-13.8000111C202 L206 D207 Y208C202-N204 PolarHBondContact O-N 2.75Å; N204-L206 PolarHBondContact O-N 3.07Å; N204-L206 VanDerWaalsContact O-N 3.16Å; N204-D207 WeakPolarHBondContact O-CB 3.41Å; N204-D207 PolarHBondContact O-N 2.89Å; N204-Y208 PolarHBondContact O-N 3.43Å
205T71.3Confident69.9Low93 Ų93109.1 Ų109.157%0.57157%0.569SS**Hα-helixtrans-56.1-30.8178.7-46.40000112.9D207 Y208 F209T205-D207 VanDerWaalsContact C-N 3.33Å; T205-D207 PolarHBondContact O-N 3.44Å; T205-Y208 WeakPolarHBondContact O-CB 3.37Å; T205-Y208 PolarHBondContact O-N 3.12Å; T205-F209 HydrophobicContact CG2-CD2 4.06Å; T205-F209 HydrophobicContact CG2-CE2 3.61Å; T205-F209 WeakPolarHBondContact O-CD2 3.27Å; T205-F209 PolarHBondContact O-N 2.99Å; T205-F209 VanDerWaalsContact O-N 3.15Å
206L70.4Confident69.8Low115 Ų115110 Ų11060%0.60257%0.57SS**Hα-helixtrans-66.5-33.6175.8-71.1175000113N204 Y208 F209 K210N204-L206 PolarHBondContact O-N 3.07Å; N204-L206 VanDerWaalsContact O-N 3.16Å; L206-Y208 VanDerWaalsContact C-N 3.33Å; L206-F209 PolarHBondContact O-N 3.46Å; L206-K210 WeakPolarHBondContact O-CG 3.39Å; L206-K210 PolarHBondContact O-N 2.94Å
207D71.1Confident69.7Low73 Ų73107.2 Ų107.239%0.3956%0.56SS.*Hα-helixtrans-74.3-29.9178.1-61.8-35000110.9C202 N204 T205 K210 A211C202-D207 HydrophobicContact CB-CB 3.88Å; N204-D207 WeakPolarHBondContact O-CB 3.41Å; N204-D207 PolarHBondContact O-N 2.89Å; T205-D207 VanDerWaalsContact C-N 3.33Å; T205-D207 PolarHBondContact O-N 3.44Å; D207-K210 PolarHBondContact O-N 3.36Å; D207-A211 WeakPolarHBondContact O-CB 2.98Å; D207-A211 PolarHBondContact O-N 2.96Å
208Y75.1Confident69.8Low131 Ų131106.8 Ų106.851%0.51455%0.554SS.*Hα-helixtrans-62.5-49.2169.3178.3-101000111.5C202 N204 T205 L206 K210 A211 V212C202-Y208 WeakPolarHBondContact SG-CA 3.25Å; C202-Y208 WeakPolarHBondContact SG-CB 3.24Å; N204-Y208 PolarHBondContact O-N 3.43Å; T205-Y208 WeakPolarHBondContact O-CB 3.37Å; T205-Y208 PolarHBondContact O-N 3.12Å; L206-Y208 VanDerWaalsContact C-N 3.33Å; Y208-K210 VanDerWaalsContact C-N 3.3Å; Y208-K210 PolarHBondContact O-N 3.49Å; Y208-A211 PolarHBondContact O-N 3.39Å; Y208-V212 HydrophobicContact CD1-CG2 4.24Å; Y208-V212 HydrophobicContact CD2-CG2 4.38Å; Y208-V212 HydrophobicContact CE1-CG2 3.86Å; Y208-V212 HydrophobicContact CE2-CG2 4Å; Y208-V212 HydrophobicContact CG-CG2 4.49Å; Y208-V212 VanDerWaalsContact O-CG2 3.3Å; Y208-V212 WeakPolarHBondContact O-CG2 3.4Å; Y208-V212 PolarHBondContact O-N 3.49Å
209F78.6Confident69.6Low119 Ų119106.3 Ų106.352%0.52255%0.552SS.*Hα-helixtrans-63.6-37178-74.1-61.3000112.4T205 L206 L213T205-F209 HydrophobicContact CG2-CD2 4.06Å; T205-F209 HydrophobicContact CG2-CE2 3.61Å; T205-F209 WeakPolarHBondContact O-CD2 3.27Å; T205-F209 PolarHBondContact O-N 2.99Å; T205-F209 VanDerWaalsContact O-N 3.15Å; L206-F209 PolarHBondContact O-N 3.46Å; F209-L213 WeakPolarHBondContact O-CB 3.32Å; F209-L213 WeakPolarHBondContact O-CD1 3.42Å; F209-L213 WeakPolarHBondContact O-CG 3.41Å; F209-L213 PolarHBondContact O-N 2.87Å
210K74.9Confident69.6Low126 Ų126104.7 Ų104.755%0.54855%0.546SS..Hα-helixtrans-62.3-48.4172.2-78.6-179.3179.8176.60112.1L206 D207 Y208 V212 L213 E214L206-K210 WeakPolarHBondContact O-CG 3.39Å; L206-K210 PolarHBondContact O-N 2.94Å; D207-K210 PolarHBondContact O-N 3.36Å; Y208-K210 VanDerWaalsContact C-N 3.3Å; Y208-K210 PolarHBondContact O-N 3.49Å; K210-V212 VanDerWaalsContact C-N 3.32Å; K210-V212 PolarHBondContact O-N 2.92Å; K210-L213 PolarHBondContact O-N 2.9Å; K210-E214 WeakPolarHBondContact O-CB 3.48Å; K210-E214 WeakPolarHBondContact O-CG 3.39Å; K210-E214 PolarHBondContact O-N 2.88Å
211A75.7Confident68.8Low39 Ų39105.6 Ų105.632%0.32254%0.543SS..Hα-helixtrans-61.8-40.217900000112.2D207 Y208 F215D207-A211 WeakPolarHBondContact O-CB 2.98Å; D207-A211 PolarHBondContact O-N 2.96Å; Y208-A211 PolarHBondContact O-N 3.39Å; A211-F215 VanDerWaalsContact O-CB 3.26Å; A211-F215 WeakPolarHBondContact O-CB 3.35Å; A211-F215 PolarHBondContact O-N 3.32Å
212V77.7Confident68Low65 Ų65107.6 Ų107.639%0.39454%0.542SS..Hα-helixtrans-65.8-42.9175.5171.80000111.4Y208 K210 H216Y208-V212 HydrophobicContact CD1-CG2 4.24Å; Y208-V212 HydrophobicContact CD2-CG2 4.38Å; Y208-V212 HydrophobicContact CE1-CG2 3.86Å; Y208-V212 HydrophobicContact CE2-CG2 4Å; Y208-V212 HydrophobicContact CG-CG2 4.49Å; Y208-V212 VanDerWaalsContact O-CG2 3.3Å; Y208-V212 WeakPolarHBondContact O-CG2 3.4Å; Y208-V212 PolarHBondContact O-N 3.49Å; K210-V212 VanDerWaalsContact C-N 3.32Å; K210-V212 PolarHBondContact O-N 2.92Å; V212-H216 WeakPolarHBondContact O-CB 3.27Å; V212-H216 PolarHBondContact O-N 3.35Å
213L77.9Confident66.8Low122 Ų122112.3 Ų112.364%0.63956%0.562SS**Hα-helixtrans-65.2-43.6176.3-83.5161.8000111.9F209 K210 H216 N217F209-L213 WeakPolarHBondContact O-CB 3.32Å; F209-L213 WeakPolarHBondContact O-CD1 3.42Å; F209-L213 WeakPolarHBondContact O-CG 3.41Å; F209-L213 PolarHBondContact O-N 2.87Å; K210-L213 PolarHBondContact O-N 2.9Å; L213-H216 PolarHBondContact O-N 2.84Å; L213-N217 WeakPolarHBondContact O-CB 3.27Å; L213-N217 PolarHBondContact O-N 3.11Å
214E75.9Confident65.6Low120 Ų120108.1 Ų108.156%0.56155%0.55SS**Hα-helixtrans-64.1-41.7176.8-77.8175.6-178.100111.8K210 N217 Q218K210-E214 WeakPolarHBondContact O-CB 3.48Å; K210-E214 WeakPolarHBondContact O-CG 3.39Å; K210-E214 PolarHBondContact O-N 2.88Å; E214-N217 PolarHBondContact O-N 2.59Å; E214-Q218 WeakPolarHBondContact O-CG 3.22Å; E214-Q218 PolarHBondContact O-N 2.79Å
215F74.6Confident64.3Low132 Ų132111.9 Ų111.958%0.57957%0.565SS**Hα-helixtrans-62.7-43.9174.3-176.4-106.7000111.7A211 N217 Q218 L219A211-F215 VanDerWaalsContact O-CB 3.26Å; A211-F215 WeakPolarHBondContact O-CB 3.35Å; A211-F215 PolarHBondContact O-N 3.32Å; F215-N217 VanDerWaalsContact C-N 3.29Å; F215-N217 PolarHBondContact O-N 3.11Å; F215-Q218 PolarHBondContact O-N 2.83Å; F215-L219 HydrophobicContact CD1-CD1 3.53Å; F215-L219 HydrophobicContact CD2-CD1 4.38Å; F215-L219 HydrophobicContact CE1-CD1 3.15Å; F215-L219 HydrophobicContact CE2-CD1 4.07Å; F215-L219 HydrophobicContact CG-CD1 4.14Å; F215-L219 HydrophobicContact CZ-CD1 3.46Å; F215-L219 VanDerWaalsContact CZ-CD1 3.46Å; F215-L219 WeakPolarHBondContact O-CD1 3.35Å; F215-L219 PolarHBondContact O-N 2.8Å
216H71.1Confident62.8Low138 Ų138116 Ų11664%0.63958%0.578SS**Hα-helixtrans-64-36176.2-157.979.6000112.1V212 L213 A220V212-H216 WeakPolarHBondContact O-CB 3.27Å; V212-H216 PolarHBondContact O-N 3.35Å; L213-H216 PolarHBondContact O-N 2.84Å; H216-A220 WeakPolarHBondContact O-CB 3.21Å; H216-A220 PolarHBondContact O-N 3.01Å
217N71.8Confident61.2Low99 Ų99119 Ų11953%0.52959%0.589SS.*Hα-helixtrans-73-36.2177.8-144.5-9.6000112.1L213 E214 F215 A220 Q221L213-N217 WeakPolarHBondContact O-CB 3.27Å; L213-N217 PolarHBondContact O-N 3.11Å; E214-N217 PolarHBondContact O-N 2.59Å; F215-N217 VanDerWaalsContact C-N 3.29Å; F215-N217 PolarHBondContact O-N 3.11Å; N217-A220 WeakPolarHBondContact O-CB 3.35Å; N217-A220 PolarHBondContact O-N 3.02Å; N217-Q221 WeakPolarHBondContact O-CG 3.33Å; N217-Q221 PolarHBondContact O-N 3.02Å
218Q68.7Low59.4Low115 Ų115121.3 Ų121.354%0.53760%0.601SS.*Hα-helixtrans-66.8-39.2172.2-76.1172.628.700112.3E214 F215 A220 Q221 Q222E214-Q218 WeakPolarHBondContact O-CG 3.22Å; E214-Q218 PolarHBondContact O-N 2.79Å; F215-Q218 PolarHBondContact O-N 2.83Å; Q218-A220 VanDerWaalsContact C-N 3.31Å; Q218-A220 PolarHBondContact O-N 3.18Å; Q218-Q221 PolarHBondContact O-N 3.07Å; Q218-Q222 PolarHBondContact O-N 3.26Å
219L59.5Low57.5Low91 Ų91122.9 Ų122.948%0.47662%0.618SS.*Hα-helixtrans-63.5-36.1171-94.1140.3000112.3F215 Q221F215-L219 HydrophobicContact CD1-CD1 3.53Å; F215-L219 HydrophobicContact CD2-CD1 4.38Å; F215-L219 HydrophobicContact CE1-CD1 3.15Å; F215-L219 HydrophobicContact CE2-CD1 4.07Å; F215-L219 HydrophobicContact CG-CD1 4.14Å; F215-L219 HydrophobicContact CZ-CD1 3.46Å; F215-L219 VanDerWaalsContact CZ-CD1 3.46Å; F215-L219 WeakPolarHBondContact O-CD1 3.35Å; F215-L219 PolarHBondContact O-N 2.8Å; L219-Q221 VanDerWaalsContact C-N 3.33Å
220A59.6Low55.4Low63 Ų63125.1 Ų125.152%0.52163%0.63SS.*Hα-helixtrans-68.8-31.3173.200000112.6H216 N217 Q218H216-A220 WeakPolarHBondContact O-CB 3.21Å; H216-A220 PolarHBondContact O-N 3.01Å; N217-A220 WeakPolarHBondContact O-CB 3.35Å; N217-A220 PolarHBondContact O-N 3.02Å; Q218-A220 VanDerWaalsContact C-N 3.31Å; Q218-A220 PolarHBondContact O-N 3.18Å
221Q48.7Very low53.4Low145 Ų145124.2 Ų124.268%0.67864%0.638SS**Hα-helixtrans-83.7-18.1178.4-74.5179.3-15.700114.4N217 Q218 L219 M223N217-Q221 WeakPolarHBondContact O-CG 3.33Å; N217-Q221 PolarHBondContact O-N 3.02Å; Q218-Q221 PolarHBondContact O-N 3.07Å; L219-Q221 VanDerWaalsContact C-N 3.33Å; Q221-M223 PolarHBondContact O-N 3.39Å
222Q40.5Very low51.5Low157 Ų157129.9 Ų129.973%0.73466%0.663SS**THydrogen-bonded Turntrans-77.33.1176.5-83.9-167.2-37.800114.4Q218 P224Q218-Q222 PolarHBondContact O-N 3.26Å; Q222-P224 WeakPolarHBondContact O-CD 3.44Å
223M32Very low49.7Very low141 Ų141133.8 Ų133.870%0.69568%0.682SS**SBendtrans-71.4118165-70.9-81.266.800109.2Q221 E225Q221-M223 PolarHBondContact O-N 3.39Å; M223-E225 PolarHBondContact O-N 2.79Å; M223-E225 VanDerWaalsContact O-N 3.11Å
224P37.9Very low48Very low99 Ų99133.9 Ų133.964%0.64368%0.681SS**  trans-54.1121.8-173.5-25.833.7000111.8Q222 E226Q222-P224 WeakPolarHBondContact O-CD 3.44Å; P224-E226 PolarHBondContact O-N 2.86Å
225E38Very low46.6Very low166 Ų166137.5 Ų137.578%0.77670%0.697SS**SBendtrans-66.542.4176.7-127.2175.4169.400112.4M223 L228M223-E225 PolarHBondContact O-N 2.79Å; M223-E225 VanDerWaalsContact O-N 3.11Å; E225-L228 HydrophobicContact CG-CD1 4.09Å
226E39.4Very low45.4Very low181 Ų181139.1 Ų139.185%0.84671%0.711SS**  trans-95.61.7175.2-83.7-172.8147.900113.5P224P224-E226 PolarHBondContact O-N 2.86Å
227Q36.4Very low43.7Very low178 Ų178140.7 Ų140.783%0.83272%0.716SS**SBendtrans-115.711.8179.5-69.4-1732.500115.2
228L34.1Very low42.3Very low121 Ų121142.6 Ų142.663%0.63473%0.726SS**SBendtrans-103.95.2-175.5-82.9169000116.3E225E225-L228 HydrophobicContact CG-CD1 4.09Å
229N33.7Very low41.2Very low164 Ų164142.6 Ų142.688%0.87773%0.734SS**SBendtrans-110.14.8-178.7-72-14.3000115.9
230E36Very low40.3Very low165 Ų165142.7 Ų142.777%0.77174%0.743SS**  trans-110.68.1178.6-86.8-172.5167.200115.2D232E230-D232 VanDerWaalsContact C-N 3.25Å; E230-D232 PolarHBondContact O-N 2.87Å
231C32.5Very low39.8Very low107 Ų107147.3 Ų147.372%0.72376%0.758SS**THydrogen-bonded Turntrans-75.73.1-177.1-73.70000116.3
232D36Very low39.2Very low159 Ų159147.2 Ų147.285%0.8576%0.757SS**THydrogen-bonded Turntrans-95.83.9175.2-80.4-25.2000114.4E230E230-D232 VanDerWaalsContact C-N 3.25Å; E230-D232 PolarHBondContact O-N 2.87Å
233N40.6Very low39.4Very low147 Ų147145.9 Ų145.979%0.78675%0.751SS**SBendtrans-143.333-175.2-96.7-81.6000117.4
234M40.2Very low39.9Very low123 Ų123146.8 Ų146.861%0.60675%0.753SS**  trans-144.154.6172.7-131.8173-74.300115.5L236 K237M234-L236 PolarHBondContact O-N 3.04Å; M234-K237 HydrophobicContact CG-CB 4.38Å; M234-K237 HydrophobicContact CG-CD 4.47Å; M234-K237 HydrophobicContact SD-CB 4.19Å; M234-K237 HydrophobicContact SD-CD 3.7Å; M234-K237 HydrophobicContact SD-CG 4.48Å
235E46.8Very low40.1Very low196 Ų196150.6 Ų150.692%0.91676%0.762SS**THydrogen-bonded Turntrans-69.552.8162-165.7-172.216000111.6
236L49.1Very low40.1Very low166 Ų166148.5 Ų148.587%0.86975%0.753SS**THydrogen-bonded Turntrans-167.812.2172-108.9152.4000117.2M234M234-L236 PolarHBondContact O-N 3.04Å
237K36.3Very low39.9Very low172 Ų172143.9 Ų143.975%0.74874%0.737SS**  trans-132.857.9179.1-86174.3173.2173.60112.8M234M234-K237 HydrophobicContact CG-CB 4.38Å; M234-K237 HydrophobicContact CG-CD 4.47Å; M234-K237 HydrophobicContact SD-CB 4.19Å; M234-K237 HydrophobicContact SD-CD 3.7Å; M234-K237 HydrophobicContact SD-CG 4.48Å
238D41.6Very low40.2Very low138 Ų138141 Ų14174%0.73873%0.732SS**  trans-104.331.4-177.8-164.124.5000113.8
239V45.8Very low40.8Very low116 Ų116141.2 Ų141.270%0.70373%0.727SS**SBendtrans-143.517.8-175.3-155.80000114.9
240S42.2Very low41.5Very low93 Ų93140.1 Ų140.165%0.6572%0.717SS**SBendtrans-142.3-0.8-177.2-57.20000117.8
241L47.1Very low42.4Very low160 Ų160133.9 Ų133.984%0.83870%0.697SS**SBendtrans-121.27174.8-68.3173.9000113.8
242Q36.7Very low43.6Very low143 Ų143130.3 Ų130.367%0.66867%0.673SS**SBendtrans-85.1-13.2164.9-107.5173.917.500112.7Q246Q242-Q246 VanDerWaalsContact O-CB 3.27Å; Q242-Q246 WeakPolarHBondContact O-CB 3.4Å
243E44.3Very low45.4Very low129 Ų129126.9 Ų126.960%0.60365%0.651SS**Hα-helixtrans-83.1-22.9-173.7-70.1-177145.900114T247E243-T247 WeakPolarHBondContact O-CB 3.44Å; E243-T247 WeakPolarHBondContact O-CG2 3.28Å; E243-T247 PolarHBondContact O-N 3.44Å; E243-T247 PolarHBondContact O-OG1 3.5Å
244E43.7Very low47.3Very low160 Ų160123.6 Ų123.675%0.74863%0.631SS**Hα-helixtrans-88.8-19.8-176.7-74.5-162.6138.300115T247E244-T247 PolarHBondContact O-OG1 2.9Å
245E41.7Very low49.1Very low178 Ų178118.5 Ų118.583%0.83261%0.606SS**Hα-helixtrans-94.5-23.6172-155.5173.3138.600112.4
246Q37Very low50.4Low123 Ų123110.8 Ų110.858%0.57557%0.57SS**Hα-helixtrans-75.5-27.6174.5-156.486.531.800112.5Q242 V248 F249 E250Q242-Q246 VanDerWaalsContact O-CB 3.27Å; Q242-Q246 WeakPolarHBondContact O-CB 3.4Å; Q246-V248 VanDerWaalsContact C-N 3.34Å; Q246-V248 PolarHBondContact O-N 2.88Å; Q246-F249 PolarHBondContact O-N 2.83Å; Q246-E250 WeakPolarHBondContact O-CB 3.33Å; Q246-E250 PolarHBondContact O-N 3.48Å
247T36Very low51.5Low83 Ų83111.1 Ų111.151%0.50957%0.568SS.*Hα-helixtrans-75.7-14.8-176.345.40000114.8E243 E244E243-T247 WeakPolarHBondContact O-CB 3.44Å; E243-T247 WeakPolarHBondContact O-CG2 3.28Å; E243-T247 PolarHBondContact O-N 3.44Å; E243-T247 PolarHBondContact O-OG1 3.5Å; E244-T247 PolarHBondContact O-OG1 2.9Å
248V42.4Very low53.4Low119 Ų119109.9 Ų109.972%0.72157%0.569SS**Hα-helixtrans-80.1-29.7171.2-177.40000111.2Q246Q246-V248 VanDerWaalsContact C-N 3.34Å; Q246-V248 PolarHBondContact O-N 2.88Å
249F47Very low55.1Low124 Ų124106.2 Ų106.254%0.54455%0.546SS..Hα-helixtrans-90.8-25.9-179.5-138.6-96.7000113.3Q246 G251 S252 F262Q246-F249 PolarHBondContact O-N 2.83Å; F249-G251 PolarHBondContact O-N 3.33Å; F249-G251 VanDerWaalsContact O-N 3.07Å; F249-S252 PolarHBondContact O-N 2.97Å; F249-F262 HydrophobicContact CE1-CE1 4.24Å; F249-F262 HydrophobicContact CE2-CE1 4.29Å; F249-F262 HydrophobicContact CZ-CD1 4.16Å; F249-F262 AromaticContact CZ-CE1 3.53Å; F249-F262 HydrophobicContact CZ-CE1 3.53Å; F249-F262 HydrophobicContact CZ-CZ 4.05Å
250E48.3Very low56.8Low142 Ų142105.4 Ų105.466%0.66454%0.543SS*.THydrogen-bonded Turntrans-65.7-11-178.8-165.1162.7-163.800114.3Q246 N265Q246-E250 WeakPolarHBondContact O-CB 3.33Å; Q246-E250 PolarHBondContact O-N 3.48Å; E250-N265 PolarHBondContact O-ND2 2.94Å
251G54.8Low58.7Low34 Ų34102 Ų10235%0.35152%0.517SS..THydrogen-bonded Turntrans-101.7-1.6177.300000115.6F249 T264 N265F249-G251 PolarHBondContact O-N 3.33Å; F249-G251 VanDerWaalsContact O-N 3.07Å; G251-T264 CarbonylContact O-C 3.47Å; G251-T264 VanDerWaalsContact O-CA 3.3Å; G251-T264 WeakPolarHBondContact O-CA 3.33Å; G251-N265 PolarHBondContact O-N 2.87Å
252S57.3Low60.5Low31 Ų3198.7 Ų98.722%0.21750%0.496CS..EExtended strand (participates in β ladder)trans-125.5132.2-172.475.80000113.6F249 I263F249-S252 PolarHBondContact O-N 2.97Å; S252-I263 CarbonylContact C-O 3.43Å; S252-I263 WeakPolarHBondContact CA-O 3.38Å
253K73.8Confident62.9Low87 Ų8792.1 Ų92.138%0.37847%0.465SS..EExtended strand (participates in β ladder)trans-96123.1173.2-83.4167.3-179.4173.70109.1I263 N265 W268K253-I263 PolarHBondContact N-O 2.7Å; K253-I263 PolarHBondContact O-N 2.93Å; K253-N265 WeakPolarHBondContact CD-OD1 3.36Å; K253-N265 WeakPolarHBondContact CE-OD1 3.21Å; K253-N265 WeakPolarHBondContact CG-OD1 3.27Å; K253-W268 HydrophobicContact CD-CB 4.41Å; K253-W268 HydrophobicContact CD-CG 4.05Å
254Q81.4Confident65Low79 Ų7988.7 Ų88.737%0.36945%0.454SS..EExtended strand (participates in β ladder)trans-67130.6162.3-164.3178.61.400108.5L256 E257 Y259 L261 F262Q254-L256 WeakPolarHBondContact CG-O 3.26Å; Q254-L256 PolarHBondContact NE2-O 3.22Å; Q254-E257 PolarHBondContact NE2-O 2.92Å; Q254-E257 VanDerWaalsContact NE2-O 3.11Å; Q254-Y259 PolarHBondContact NE2-O 3.26Å; Q254-L261 WeakPolarHBondContact CA-O 3.39Å; Q254-F262 HydrophobicContact CB-CD1 3.79Å; Q254-F262 HydrophobicContact CB-CE1 3.67Å; Q254-F262 HydrophobicContact CG-CD1 4.06Å; Q254-F262 HydrophobicContact CG-CE1 3.7Å; Q254-F262 HydrophobicContact CG-CZ 4.18Å
255L77.1Confident67Low15 Ų1583.4 Ų83.48%0.07943%0.43CS..SBendtrans-68.3-44.9-180-76.9175.1000111.8L261 I263 L286 V290 L329 F332L255-L261 PolarHBondContact N-O 2.97Å; L255-I263 HydrophobicContact CD1-CD1 3.75Å; L255-I263 HydrophobicContact CD1-CG1 4.14Å; L255-I263 HydrophobicContact CD2-CD1 3.95Å; L255-I263 HydrophobicContact CD2-CG1 4.47Å; L255-I263 HydrophobicContact CG-CD1 4.02Å; L255-I263 HydrophobicContact CG-CG1 4.18Å; L255-L286 HydrophobicContact CD2-CD2 4.05Å; L255-V290 HydrophobicContact CD1-CG2 3.89Å; L255-L329 HydrophobicContact CD1-CD2 3.84Å; L255-F332 HydrophobicContact CB-CD2 4.12Å; L255-F332 HydrophobicContact CB-CE2 4.42Å; L255-F332 HydrophobicContact CD2-CD1 4.26Å; L255-F332 HydrophobicContact CD2-CD2 4.13Å; L255-F332 HydrophobicContact CD2-CE1 4.04Å; L255-F332 HydrophobicContact CD2-CE2 3.87Å; L255-F332 HydrophobicContact CD2-CG 4.31Å; L255-F332 HydrophobicContact CD2-CZ 3.82Å; L255-F332 WeakPolarHBondContact O-CD2 3.36Å; L255-F332 VanDerWaalsContact O-CE2 3.26Å; L255-F332 WeakPolarHBondContact O-CE2 3.44Å
256L75.8Confident69.3Low34 Ų3482.9 Ų82.918%0.17843%0.425CS..  trans-143.6132.7179.2-81.2164.7000108.6Q254 N258 Y259 C328 E331 F332Q254-L256 WeakPolarHBondContact CG-O 3.26Å; Q254-L256 PolarHBondContact NE2-O 3.22Å; L256-N258 PolarHBondContact O-N 3.29Å; L256-N258 VanDerWaalsContact O-N 3.11Å; L256-Y259 HydrophobicContact CB-CD2 3.86Å; L256-Y259 HydrophobicContact CD1-CD2 3.94Å; L256-Y259 HydrophobicContact CD1-CE2 4.18Å; L256-Y259 PolarHBondContact O-N 3.42Å; L256-C328 HydrophobicContact CD1-CB 4.49Å; L256-C328 WeakPolarHBondContact CD1-O 3.11Å; L256-E331 HydrophobicContact CD1-CB 4.11Å; L256-E331 HydrophobicContact CD1-CG 4.35Å; L256-F332 HydrophobicContact CD1-CB 3.93Å; L256-F332 HydrophobicContact CG-CB 4.27Å; L256-F332 HydrophobicContact CG-CD2 4.24Å
257E71.3Confident71.9Confident174 Ų17479.8 Ų79.881%0.81341%0.411SS*.THydrogen-bonded Turntrans-55.6-31.1-179.7-68.8177.2173.300112.9Q254 Y259Q254-E257 PolarHBondContact NE2-O 2.92Å; Q254-E257 VanDerWaalsContact NE2-O 3.11Å; E257-Y259 VanDerWaalsContact C-N 3.28Å; E257-Y259 PolarHBondContact O-N 3.29Å
258N76.1Confident74.5Confident146 Ų14677.6 Ų77.678%0.78139%0.393SS*.THydrogen-bonded Turntrans-80.4-1-179-62.5-32.3000114.6L256L256-N258 PolarHBondContact O-N 3.29Å; L256-N258 VanDerWaalsContact O-N 3.11Å
259Y78.4Confident76.8Confident61 Ų6175.5 Ų75.524%0.23938%0.378CS..SBendtrans-134.3135.7-176.7-67.3-85.8000111.2Q254 L256 E257 L261 V324 C328Q254-Y259 PolarHBondContact NE2-O 3.26Å; L256-Y259 HydrophobicContact CB-CD2 3.86Å; L256-Y259 HydrophobicContact CD1-CD2 3.94Å; L256-Y259 HydrophobicContact CD1-CE2 4.18Å; L256-Y259 PolarHBondContact O-N 3.42Å; E257-Y259 VanDerWaalsContact C-N 3.28Å; E257-Y259 PolarHBondContact O-N 3.29Å; Y259-L261 PolarHBondContact O-N 2.94Å; Y259-V324 HydrophobicContact CD1-CG1 3.5Å; Y259-V324 HydrophobicContact CE1-CG1 3.73Å; Y259-C328 HydrophobicContact CD1-CB 3.77Å; Y259-C328 HydrophobicContact CD2-CB 3.82Å; Y259-C328 HydrophobicContact CE1-CB 4.12Å; Y259-C328 HydrophobicContact CE2-CB 4.19Å; Y259-C328 HydrophobicContact CG-CB 3.6Å
260P79.8Confident79Confident99 Ų9974 Ų7464%0.64337%0.373SS*.  trans-78.556.7178.134.5-36.7000111F262P260-F262 HydrophobicContact CB-CE2 4.46Å
261L82.4Confident81.1Confident22 Ų2267.3 Ų67.312%0.11534%0.341CS..  trans-121.1114.3-179.6-71.3179.8000110.8Q254 L255 Y259 V290 K325 C328Q254-L261 WeakPolarHBondContact CA-O 3.39Å; L255-L261 PolarHBondContact N-O 2.97Å; Y259-L261 PolarHBondContact O-N 2.94Å; L261-V290 HydrophobicContact CD1-CG1 4.06Å; L261-V290 HydrophobicContact CD2-CG1 4.08Å; L261-K325 HydrophobicContact CD1-CB 4.3Å; L261-K325 HydrophobicContact CD1-CG 4.17Å; L261-K325 HydrophobicContact CD2-CG 4.11Å; L261-C328 HydrophobicContact CD1-CB 3.61Å; L261-C328 VanDerWaalsContact CD1-SG 3.55Å
262F85Confident82.9Confident90 Ų9067.2 Ų67.240%0.39533%0.334SS..EExtended strand (participates in β ladder)trans-115.3138.9-175.9-56.2-87.9000110F249 Q254 P260F249-F262 HydrophobicContact CE1-CE1 4.24Å; F249-F262 HydrophobicContact CE2-CE1 4.29Å; F249-F262 HydrophobicContact CZ-CD1 4.16Å; F249-F262 AromaticContact CZ-CE1 3.53Å; F249-F262 HydrophobicContact CZ-CE1 3.53Å; F249-F262 HydrophobicContact CZ-CZ 4.05Å; Q254-F262 HydrophobicContact CB-CD1 3.79Å; Q254-F262 HydrophobicContact CB-CE1 3.67Å; Q254-F262 HydrophobicContact CG-CD1 4.06Å; Q254-F262 HydrophobicContact CG-CE1 3.7Å; Q254-F262 HydrophobicContact CG-CZ 4.18Å; P260-F262 HydrophobicContact CB-CE2 4.46Å
263I87.6Confident84.6Confident4 Ų471.8 Ų71.82%0.02136%0.356CS..EExtended strand (participates in β ladder)trans-128140.3172.3-65.6-171.9000107.3S252 K253 L255 Q267 L286 V290S252-I263 CarbonylContact C-O 3.43Å; S252-I263 WeakPolarHBondContact CA-O 3.38Å; K253-I263 PolarHBondContact N-O 2.7Å; K253-I263 PolarHBondContact O-N 2.93Å; L255-I263 HydrophobicContact CD1-CD1 3.75Å; L255-I263 HydrophobicContact CD1-CG1 4.14Å; L255-I263 HydrophobicContact CD2-CD1 3.95Å; L255-I263 HydrophobicContact CD2-CG1 4.47Å; L255-I263 HydrophobicContact CG-CD1 4.02Å; L255-I263 HydrophobicContact CG-CG1 4.18Å; I263-Q267 HydrophobicContact CG2-CB 3.4Å; I263-Q267 VanDerWaalsContact CG2-CB 3.4Å; I263-Q267 HydrophobicContact CG2-CG 4.43Å; I263-L286 HydrophobicContact CD1-CD2 3.52Å; I263-V290 HydrophobicContact CD1-CG2 3.8Å; I263-V290 HydrophobicContact CG1-CG2 4.13Å
264T88.1Confident85.4Confident58 Ų5869.8 Ų69.836%0.35635%0.353SS..EExtended strand (participates in β ladder)trans-64.7148.9176.764.10000111.7G251 K266 Q267 W268G251-T264 CarbonylContact O-C 3.47Å; G251-T264 VanDerWaalsContact O-CA 3.3Å; G251-T264 WeakPolarHBondContact O-CA 3.33Å; T264-K266 PolarHBondContact O-N 3.28Å; T264-Q267 PolarHBondContact O-N 3.02Å; T264-Q267 WeakPolarHBondContact OG1-CB 3.33Å; T264-Q267 WeakPolarHBondContact OG1-CG 3.47Å; T264-Q267 PolarHBondContact OG1-N 2.99Å; T264-Q267 PolarHBondContact OG1-OE1 2.89Å; T264-W268 PolarHBondContact O-N 3.43Å
265N86.8Confident85.9Confident48 Ų4866 Ų6626%0.25734%0.336SS..Hα-helixtrans-51.4-41.9175.3-80.5-32.7000111.5E250 G251 K253 Q267 W268 D269E250-N265 PolarHBondContact O-ND2 2.94Å; G251-N265 PolarHBondContact O-N 2.87Å; K253-N265 WeakPolarHBondContact CD-OD1 3.36Å; K253-N265 WeakPolarHBondContact CE-OD1 3.21Å; K253-N265 WeakPolarHBondContact CG-OD1 3.27Å; N265-Q267 PolarHBondContact O-N 2.77Å; N265-W268 WeakPolarHBondContact O-CB 3.44Å; N265-W268 PolarHBondContact O-N 2.96Å; N265-D269 WeakPolarHBondContact O-CB 3.22Å; N265-D269 PolarHBondContact O-N 2.74Å
266K89.6Confident86.7Confident168 Ų16872.8 Ų72.873%0.7336%0.364SS*.Hα-helixtrans-59.6-46.6176.2-174.7179.4178.3-179.20112.9T264 W268 D269 E270T264-K266 PolarHBondContact O-N 3.28Å; K266-W268 VanDerWaalsContact C-N 3.34Å; K266-D269 PolarHBondContact O-N 3.38Å; K266-E270 WeakPolarHBondContact O-CB 3.37Å; K266-E270 PolarHBondContact O-N 3.48Å
267Q90.9Very high87.5Confident58 Ų5876 Ų7627%0.27138%0.377SS..Hα-helixtrans-66.7-38178.2-73.3165.3-33.300111.5I263 T264 N265 A271 Y289I263-Q267 HydrophobicContact CG2-CB 3.4Å; I263-Q267 VanDerWaalsContact CG2-CB 3.4Å; I263-Q267 HydrophobicContact CG2-CG 4.43Å; T264-Q267 PolarHBondContact O-N 3.02Å; T264-Q267 WeakPolarHBondContact OG1-CB 3.33Å; T264-Q267 WeakPolarHBondContact OG1-CG 3.47Å; T264-Q267 PolarHBondContact OG1-N 2.99Å; T264-Q267 PolarHBondContact OG1-OE1 2.89Å; N265-Q267 PolarHBondContact O-N 2.77Å; Q267-A271 VanDerWaalsContact O-CB 3.25Å; Q267-A271 WeakPolarHBondContact O-CB 3.45Å; Q267-A271 PolarHBondContact O-N 3.09Å; Q267-Y289 HydrophobicContact CB-CD1 4.07Å; Q267-Y289 HydrophobicContact CB-CD2 4.03Å; Q267-Y289 HydrophobicContact CB-CE1 4.05Å; Q267-Y289 HydrophobicContact CB-CE2 4.03Å; Q267-Y289 HydrophobicContact CB-CG 4.06Å; Q267-Y289 HydrophobicContact CG-CD1 3.66Å; Q267-Y289 HydrophobicContact CG-CE1 3.65Å; Q267-Y289 HydrophobicContact CG-CG 4.13Å
268W90.6Very high88.6Confident37 Ų3769.3 Ų69.314%0.1435%0.346CS..Hα-helixtrans-61.5-51.8174.5170.4-100000111.6K253 T264 N265 K266 E270 A271 V272 L282 L286 F332 H336K253-W268 HydrophobicContact CD-CB 4.41Å; K253-W268 HydrophobicContact CD-CG 4.05Å; T264-W268 PolarHBondContact O-N 3.43Å; N265-W268 WeakPolarHBondContact O-CB 3.44Å; N265-W268 PolarHBondContact O-N 2.96Å; K266-W268 VanDerWaalsContact C-N 3.34Å; W268-E270 VanDerWaalsContact C-N 3.33Å; W268-E270 PolarHBondContact O-N 2.97Å; W268-A271 WeakPolarHBondContact O-CB 3.32Å; W268-A271 PolarHBondContact O-N 2.9Å; W268-V272 HydrophobicContact CD2-CG2 3.92Å; W268-V272 VanDerWaalsContact CE2-CG2 3.47Å; W268-V272 HydrophobicContact CE3-CG2 4.18Å; W268-V272 HydrophobicContact CH2-CG2 3.64Å; W268-V272 HydrophobicContact CZ2-CG2 3.36Å; W268-V272 HydrophobicContact CZ3-CG2 4.04Å; W268-V272 WeakPolarHBondContact O-CG2 3.28Å; W268-V272 PolarHBondContact O-N 2.74Å; W268-L282 HydrophobicContact CZ3-CD1 4.36Å; W268-L286 HydrophobicContact CE3-CD2 4.46Å; W268-L286 HydrophobicContact CZ3-CD2 4.44Å; W268-F332 HydrophobicContact CE3-CZ 4.39Å; W268-F332 AromaticContact CH2-CE1 3.95Å; W268-F332 HydrophobicContact CH2-CE1 3.95Å; W268-F332 AromaticContact CH2-CZ 3.54Å; W268-F332 HydrophobicContact CH2-CZ 3.54Å; W268-F332 AromaticContact CZ3-CE1 3.6Å; W268-F332 HydrophobicContact CZ3-CE1 3.6Å; W268-F332 AromaticContact CZ3-CZ 3.38Å; W268-F332 HydrophobicContact CZ3-CZ 3.38Å; W268-H336 AromaticContact CH2-CE1 3.6Å; W268-H336 AromaticContact CH2-ND1 3.87Å; W268-H336 AromaticContact CH2-NE2 3.99Å; W268-H336 AromaticContact CZ2-CE1 3.76Å
269D90.8Very high89.5Confident75 Ų7562.3 Ų62.340%0.40131%0.309SS..Hα-helixtrans-63.7-40.6-178.6-65.3-27.3000111.1N265 K266 N273N265-D269 WeakPolarHBondContact O-CB 3.22Å; N265-D269 PolarHBondContact O-N 2.74Å; K266-D269 PolarHBondContact O-N 3.38Å; D269-N273 WeakPolarHBondContact O-CB 3.36Å; D269-N273 PolarHBondContact O-N 2.93Å; D269-N273 PolarHBondContact O-ND2 2.97Å
270E93.4Very high90.3Very high93 Ų9362.9 Ų62.944%0.43531%0.311SS..Hα-helixtrans-60.4-46.6173.6-172.8-171.5165.600111.5K266 W268 S274 Y289K266-E270 WeakPolarHBondContact O-CB 3.37Å; K266-E270 PolarHBondContact O-N 3.48Å; W268-E270 VanDerWaalsContact C-N 3.33Å; W268-E270 PolarHBondContact O-N 2.97Å; E270-S274 WeakPolarHBondContact O-CB 3.17Å; E270-S274 PolarHBondContact O-N 2.86Å; E270-S274 PolarHBondContact O-OG 2.64Å; E270-Y289 PolarHBondContact OE1-OH 3.41Å; E270-Y289 PolarHBondContact OE2-OH 3.12Å
271A92.6Very high91.1Very high0 Ų062.9 Ų62.90%030%0.298CS..Hα-helixtrans-61.5-48-179.900000111.5Q267 W268 S275 L282 Y285 Y289Q267-A271 VanDerWaalsContact O-CB 3.25Å; Q267-A271 WeakPolarHBondContact O-CB 3.45Å; Q267-A271 PolarHBondContact O-N 3.09Å; W268-A271 WeakPolarHBondContact O-CB 3.32Å; W268-A271 PolarHBondContact O-N 2.9Å; A271-S275 WeakPolarHBondContact O-CB 3.4Å; A271-S275 PolarHBondContact O-N 3.32Å; A271-L282 HydrophobicContact CB-CD1 3.78Å; A271-Y285 HydrophobicContact CB-CG 4.18Å; A271-Y289 HydrophobicContact CB-CE2 4.09Å
272V91.2Very high91.7Very high33 Ų3361.8 Ų61.820%0.229%0.292CS..Hα-helixtrans-64.8-50.5-179.41680000110.8W268 S274 S275 L282 W343W268-V272 HydrophobicContact CD2-CG2 3.92Å; W268-V272 VanDerWaalsContact CE2-CG2 3.47Å; W268-V272 HydrophobicContact CE3-CG2 4.18Å; W268-V272 HydrophobicContact CH2-CG2 3.64Å; W268-V272 HydrophobicContact CZ2-CG2 3.36Å; W268-V272 HydrophobicContact CZ3-CG2 4.04Å; W268-V272 WeakPolarHBondContact O-CG2 3.28Å; W268-V272 PolarHBondContact O-N 2.74Å; V272-S274 VanDerWaalsContact C-N 3.32Å; V272-S274 PolarHBondContact O-N 3.08Å; V272-S275 PolarHBondContact O-N 3.25Å; V272-S275 PolarHBondContact O-OG 3.34Å; V272-L282 HydrophobicContact CG2-CD1 4.24Å; V272-W343 HydrophobicContact CB-CH2 4.37Å; V272-W343 HydrophobicContact CG1-CH2 4.03Å; V272-W343 HydrophobicContact CG1-CZ2 3.84Å; V272-W343 HydrophobicContact CG2-CH2 4.16Å; V272-W343 HydrophobicContact CG2-CZ2 4.43Å
273N92.9Very high92.2Very high127 Ų12757.5 Ų57.568%0.67927%0.274SS*.Hα-helixtrans-63.9-38.3-178.6-70.9-36.1000112D269D269-N273 WeakPolarHBondContact O-CB 3.36Å; D269-N273 PolarHBondContact O-N 2.93Å; D269-N273 PolarHBondContact O-ND2 2.97Å
274S92.6Very high92.6Very high45 Ų4561.3 Ų61.332%0.31529%0.288SS..Hα-helixtrans-80.1-19.9179.7-54.20000113.3E270 V272 K276 Y285E270-S274 WeakPolarHBondContact O-CB 3.17Å; E270-S274 PolarHBondContact O-N 2.86Å; E270-S274 PolarHBondContact O-OG 2.64Å; V272-S274 VanDerWaalsContact C-N 3.32Å; V272-S274 PolarHBondContact O-N 3.08Å; S274-K276 VanDerWaalsContact C-N 3.25Å; S274-K276 PolarHBondContact O-N 2.92Å; S274-Y285 VanDerWaalsContact CB-CZ 3.48Å; S274-Y285 VanDerWaalsContact CB-OH 3.3Å; S274-Y285 WeakPolarHBondContact CB-OH 3.07Å
275S92Very high92.9Very high0 Ų061.8 Ų61.80%028%0.283CS..Hα-helixtrans-69.1-22.2-178.771.50000113.5A271 V272 K277 D278 R281 W343A271-S275 WeakPolarHBondContact O-CB 3.4Å; A271-S275 PolarHBondContact O-N 3.32Å; V272-S275 PolarHBondContact O-N 3.25Å; V272-S275 PolarHBondContact O-OG 3.34Å; S275-K277 PolarHBondContact O-N 2.81Å; S275-K277 PolarHBondContact OG-N 2.96Å; S275-D278 WeakPolarHBondContact O-CB 3.21Å; S275-D278 PolarHBondContact O-N 2.73Å; S275-D278 VanDerWaalsContact O-N 3.17Å; S275-R281 WeakPolarHBondContact O-CB 3.22Å; S275-R281 WeakPolarHBondContact O-CD 3.4Å; S275-W343 VanDerWaalsContact OG-CH2 3.28Å; S275-W343 WeakPolarHBondContact OG-CH2 3.38Å; S275-W343 WeakPolarHBondContact OG-CZ3 3.36Å
276K93.4Very high93.3Very high156 Ų15659.5 Ų59.568%0.67827%0.271SS*.THydrogen-bonded Turntrans5538.1-173-50.5-171.8-176.7-175.70112.5S274 D278S274-K276 VanDerWaalsContact C-N 3.25Å; S274-K276 PolarHBondContact O-N 2.92Å; K276-D278 PolarHBondContact O-N 2.79Å
277K92.6Very high93.5Very high103 Ų10351.5 Ų51.545%0.44824%0.237SC..THydrogen-bonded Turntrans58.922.2-176.5-50-172.3180-179.10114.5S275 D342 W343 W344S275-K277 PolarHBondContact O-N 2.81Å; S275-K277 PolarHBondContact OG-N 2.96Å; K277-D342 HydrophobicContact CD-CB 3.76Å; K277-D342 IonicContact NZ-OD2 2.76Å; K277-D342 PolarHBondContact NZ-OD2 2.87Å; K277-W343 HydrophobicContact CB-CD2 4.2Å; K277-W343 HydrophobicContact CB-CE3 4.48Å; K277-W343 HydrophobicContact CB-CG 4.38Å; K277-W343 WeakPolarHBondContact O-CA 3.46Å; K277-W344 PolarHBondContact O-N 3.11Å
278D94.4Very high93.6Very high32 Ų3257.6 Ų57.617%0.17126%0.257CS..BIsolated β-bridgetrans-97.3113.1173.3171.9-1.1000109.5S275 K276 R280 R281 L282S275-D278 WeakPolarHBondContact O-CB 3.21Å; S275-D278 PolarHBondContact O-N 2.73Å; S275-D278 VanDerWaalsContact O-N 3.17Å; K276-D278 PolarHBondContact O-N 2.79Å; D278-R280 PolarHBondContact O-N 3.49Å; D278-R280 WeakPolarHBondContact OD1-CA 3.38Å; D278-R280 WeakPolarHBondContact OD1-CB 3.35Å; D278-R280 PolarHBondContact OD1-N 3.32Å; D278-R281 HydrophobicContact CB-CB 4.08Å; D278-R281 HydrophobicContact CB-CG 4.16Å; D278-R281 WeakPolarHBondContact O-CA 3.39Å; D278-R281 WeakPolarHBondContact O-CB 3.37Å; D278-R281 PolarHBondContact O-N 3.33Å; D278-R281 PolarHBondContact OD1-N 2.86Å; D278-R281 WeakPolarHBondContact OD2-CG 3.18Å; D278-L282 PolarHBondContact O-N 3.44Å
279G94.1Very high93.6Very high0 Ų058.4 Ų58.40%026%0.26CS..Hα-helixtrans-59.7-28.8-179.600000113.7L283 W344G279-L283 WeakPolarHBondContact O-CB 3.41Å; G279-L283 PolarHBondContact O-N 2.86Å; G279-W344 WeakPolarHBondContact CA-O 3.5Å; G279-W344 PolarHBondContact N-O 3.4Å
280R95.6Very high93.7Very high73 Ų7355.5 Ų55.528%0.27525%0.246SC..Hα-helixtrans-69.3-37.5173.7-171.5-167.5169.2-165.2-5.5111.6D278 R284 W344 P346 V354D278-R280 PolarHBondContact O-N 3.49Å; D278-R280 WeakPolarHBondContact OD1-CA 3.38Å; D278-R280 WeakPolarHBondContact OD1-CB 3.35Å; D278-R280 PolarHBondContact OD1-N 3.32Å; R280-R284 PolarHBondContact O-N 3.1Å; R280-W344 HydrophobicContact CB-CZ3 3.97Å; R280-P346 HydrophobicContact CB-CB 4.31Å; R280-V354 HydrophobicContact CG-CG2 3.38Å
281R95.4Very high93.6Very high98 Ų9851.5 Ų51.537%0.3723%0.227SC..Hα-helixtrans-68.6-46.5174.2-81.2177.5167.3147.83.4110.8S275 D278 L283 R284 Y285S275-R281 WeakPolarHBondContact O-CB 3.22Å; S275-R281 WeakPolarHBondContact O-CD 3.4Å; D278-R281 HydrophobicContact CB-CB 4.08Å; D278-R281 HydrophobicContact CB-CG 4.16Å; D278-R281 WeakPolarHBondContact O-CA 3.39Å; D278-R281 WeakPolarHBondContact O-CB 3.37Å; D278-R281 PolarHBondContact O-N 3.33Å; D278-R281 PolarHBondContact OD1-N 2.86Å; D278-R281 WeakPolarHBondContact OD2-CG 3.18Å; R281-L283 VanDerWaalsContact C-N 3.32Å; R281-L283 PolarHBondContact O-N 3.31Å; R281-R284 WeakPolarHBondContact O-CB 3.49Å; R281-R284 PolarHBondContact O-N 2.92Å; R281-R284 VanDerWaalsContact O-N 3.12Å; R281-Y285 WeakPolarHBondContact O-CD2 3.38Å; R281-Y285 PolarHBondContact O-N 3.42Å
282L95.7Very high93.5Very high0 Ų055.1 Ų55.10%025%0.249CC..Hα-helixtrans-56.3-47.9176.8179.662.6000111.1W268 A271 V272 D278 R284 Y285 L286 I333 W343W268-L282 HydrophobicContact CZ3-CD1 4.36Å; A271-L282 HydrophobicContact CB-CD1 3.78Å; V272-L282 HydrophobicContact CG2-CD1 4.24Å; D278-L282 PolarHBondContact O-N 3.44Å; L282-R284 VanDerWaalsContact C-N 3.27Å; L282-R284 PolarHBondContact O-N 2.98Å; L282-Y285 WeakPolarHBondContact O-CB 3.07Å; L282-Y285 PolarHBondContact O-N 3.08Å; L282-L286 HydrophobicContact CD1-CD1 4.46Å; L282-L286 HydrophobicContact CD1-CG 4.28Å; L282-L286 HydrophobicContact CG-CD1 4.04Å; L282-L286 HydrophobicContact CG-CG 4.3Å; L282-L286 WeakPolarHBondContact O-CG 3.15Å; L282-L286 PolarHBondContact O-N 3.43Å; L282-I333 HydrophobicContact CB-CD1 4.14Å; L282-I333 HydrophobicContact CD2-CD1 3.74Å; L282-I333 HydrophobicContact CG-CD1 3.83Å; L282-W343 HydrophobicContact CB-CZ3 3.9Å; L282-W343 HydrophobicContact CD2-CE3 4.29Å; L282-W343 HydrophobicContact CD2-CH2 3.83Å; L282-W343 HydrophobicContact CD2-CZ3 3.51Å; L282-W343 HydrophobicContact CG-CZ3 4.19Å
283L96.1Very high93.4Very high0 Ų057.6 Ų57.60%026%0.264CS..Hα-helixtrans-57.1-38.7177.4-178.658.2000112.7G279 R281 Y285 L286 I287 L329 I333 I351 V354 F355G279-L283 WeakPolarHBondContact O-CB 3.41Å; G279-L283 PolarHBondContact O-N 2.86Å; R281-L283 VanDerWaalsContact C-N 3.32Å; R281-L283 PolarHBondContact O-N 3.31Å; L283-Y285 VanDerWaalsContact C-N 3.35Å; L283-Y285 PolarHBondContact O-N 3.05Å; L283-L286 PolarHBondContact O-N 3.45Å; L283-I287 HydrophobicContact CD1-CD1 4.11Å; L283-I287 HydrophobicContact CD1-CG1 4.15Å; L283-I287 HydrophobicContact CG-CD1 3.99Å; L283-I287 HydrophobicContact CG-CG1 4.47Å; L283-I287 VanDerWaalsContact O-CG1 3.27Å; L283-I287 WeakPolarHBondContact O-CG1 3.38Å; L283-I287 PolarHBondContact O-N 3.42Å; L283-L329 HydrophobicContact CD1-CB 4.02Å; L283-L329 HydrophobicContact CD1-CD1 4.45Å; L283-I333 HydrophobicContact CB-CD1 4.05Å; L283-I333 HydrophobicContact CB-CG1 3.98Å; L283-I333 HydrophobicContact CD1-CG1 3.93Å; L283-I333 HydrophobicContact CG-CG1 4.4Å; L283-I351 HydrophobicContact CD2-CB 4.21Å; L283-I351 HydrophobicContact CD2-CG1 4.19Å; L283-I351 HydrophobicContact CD2-CG2 3.8Å; L283-V354 HydrophobicContact CB-CG1 4.34Å; L283-V354 HydrophobicContact CD2-CB 4.04Å; L283-V354 HydrophobicContact CD2-CG1 3.88Å; L283-V354 HydrophobicContact CG-CG1 3.83Å; L283-F355 HydrophobicContact CD1-CE2 4.41Å; L283-F355 HydrophobicContact CD1-CZ 4.14Å; L283-F355 HydrophobicContact CD2-CE2 4.29Å
284R95.6Very high93Very high83 Ų8355.7 Ų55.731%0.31325%0.254SS..Hα-helixtrans-61.2-42.2175-79.7-171.8-71.8-92-0.5112.3R280 R281 L282 R288 V354R280-R284 PolarHBondContact O-N 3.1Å; R281-R284 WeakPolarHBondContact O-CB 3.49Å; R281-R284 PolarHBondContact O-N 2.92Å; R281-R284 VanDerWaalsContact O-N 3.12Å; L282-R284 VanDerWaalsContact C-N 3.27Å; L282-R284 PolarHBondContact O-N 2.98Å; R284-R288 WeakPolarHBondContact O-CG 2.97Å; R284-R288 PolarHBondContact O-N 2.69Å; R284-V354 HydrophobicContact CG-CG1 3.59Å; R284-V354 HydrophobicContact CG-CG2 4.36Å
285Y95.2Very high92.9Very high68 Ų6856.7 Ų56.727%0.26725%0.254SS..Hα-helixtrans-65.9-47.2176.4-75-73.9000111.1A271 S274 R281 L282 L283 I287 R288 Y289A271-Y285 HydrophobicContact CB-CG 4.18Å; S274-Y285 VanDerWaalsContact CB-CZ 3.48Å; S274-Y285 VanDerWaalsContact CB-OH 3.3Å; S274-Y285 WeakPolarHBondContact CB-OH 3.07Å; R281-Y285 WeakPolarHBondContact O-CD2 3.38Å; R281-Y285 PolarHBondContact O-N 3.42Å; L282-Y285 WeakPolarHBondContact O-CB 3.07Å; L282-Y285 PolarHBondContact O-N 3.08Å; L283-Y285 VanDerWaalsContact C-N 3.35Å; L283-Y285 PolarHBondContact O-N 3.05Å; Y285-I287 VanDerWaalsContact C-N 3.33Å; Y285-I287 PolarHBondContact O-N 3.39Å; Y285-R288 WeakPolarHBondContact O-CB 3.45Å; Y285-R288 PolarHBondContact O-N 3.16Å; Y285-Y289 HydrophobicContact CD1-CE2 4.45Å; Y285-Y289 WeakPolarHBondContact O-CD2 3.13Å; Y285-Y289 PolarHBondContact O-N 2.9Å
286L94.1Very high92.7Very high0 Ų057.3 Ų57.30%026%0.257CS..Hα-helixtrans-59-42179-64.8176.8000112.5L255 I263 W268 L282 L283 R288 Y289 V290 L329 F332 I333L255-L286 HydrophobicContact CD2-CD2 4.05Å; I263-L286 HydrophobicContact CD1-CD2 3.52Å; W268-L286 HydrophobicContact CE3-CD2 4.46Å; W268-L286 HydrophobicContact CZ3-CD2 4.44Å; L282-L286 HydrophobicContact CD1-CD1 4.46Å; L282-L286 HydrophobicContact CD1-CG 4.28Å; L282-L286 HydrophobicContact CG-CD1 4.04Å; L282-L286 HydrophobicContact CG-CG 4.3Å; L282-L286 WeakPolarHBondContact O-CG 3.15Å; L282-L286 PolarHBondContact O-N 3.43Å; L283-L286 PolarHBondContact O-N 3.45Å; L286-R288 VanDerWaalsContact C-N 3.26Å; L286-R288 PolarHBondContact O-N 3.29Å; L286-Y289 PolarHBondContact O-N 3.24Å; L286-Y289 VanDerWaalsContact O-N 3.14Å; L286-V290 WeakPolarHBondContact O-CB 3.3Å; L286-V290 WeakPolarHBondContact O-CG2 3.4Å; L286-V290 PolarHBondContact O-N 3.16Å; L286-L329 HydrophobicContact CB-CD2 3.73Å; L286-L329 HydrophobicContact CD1-CD2 4.19Å; L286-F332 HydrophobicContact CD1-CD1 3.59Å; L286-F332 HydrophobicContact CD1-CE1 3.7Å; L286-I333 HydrophobicContact CD1-CD1 3.83Å; L286-I333 HydrophobicContact CD1-CG1 4.35Å
287I94.1Very high92.3Very high1 Ų153.7 Ų53.71%0.00524%0.241CC..Hα-helixtrans-59.2-39.4175.5-70.4166.6000111.3L283 Y285 Y289 F291 L296 L329 V354 F355 A358L283-I287 HydrophobicContact CD1-CD1 4.11Å; L283-I287 HydrophobicContact CD1-CG1 4.15Å; L283-I287 HydrophobicContact CG-CD1 3.99Å; L283-I287 HydrophobicContact CG-CG1 4.47Å; L283-I287 VanDerWaalsContact O-CG1 3.27Å; L283-I287 WeakPolarHBondContact O-CG1 3.38Å; L283-I287 PolarHBondContact O-N 3.42Å; Y285-I287 VanDerWaalsContact C-N 3.33Å; Y285-I287 PolarHBondContact O-N 3.39Å; I287-Y289 VanDerWaalsContact C-N 3.28Å; I287-Y289 PolarHBondContact O-N 3.19Å; I287-F291 HydrophobicContact CB-CD2 4.5Å; I287-F291 HydrophobicContact CG2-CD2 3.99Å; I287-F291 WeakPolarHBondContact O-CB 3.24Å; I287-F291 PolarHBondContact O-N 3.26Å; I287-L296 HydrophobicContact CG2-CD1 4.19Å; I287-L296 HydrophobicContact CG2-CD2 4.1Å; I287-L329 HydrophobicContact CG1-CD1 3.75Å; I287-V354 HydrophobicContact CD1-CG1 3.64Å; I287-F355 HydrophobicContact CD1-CD1 3.58Å; I287-F355 HydrophobicContact CD1-CE1 3.67Å; I287-F355 HydrophobicContact CD1-CG 4.11Å; I287-F355 HydrophobicContact CD1-CZ 4.26Å; I287-F355 HydrophobicContact CG1-CD1 4.11Å; I287-F355 HydrophobicContact CG1-CE1 3.78Å; I287-F355 HydrophobicContact CG1-CZ 4.45Å; I287-A358 HydrophobicContact CD1-CB 4.43Å; I287-A358 HydrophobicContact CG2-CB 3.75Å
288R92.4Very high91.9Very high186 Ų18654 Ų5470%0.70224%0.243SC*.Hα-helixtrans-67.9-26.4179.1-69.1173.662.477.75113.5R284 Y285 L286R284-R288 WeakPolarHBondContact O-CG 2.97Å; R284-R288 PolarHBondContact O-N 2.69Å; Y285-R288 WeakPolarHBondContact O-CB 3.45Å; Y285-R288 PolarHBondContact O-N 3.16Å; L286-R288 VanDerWaalsContact C-N 3.26Å; L286-R288 PolarHBondContact O-N 3.29Å
289Y92.2Very high91.3Very high53 Ų5352.7 Ų52.721%0.20824%0.236CC..Hα-helixtrans-91.6-32.3179.1-59.1-53000112.4Q267 E270 A271 Y285 L286 I287Q267-Y289 HydrophobicContact CB-CD1 4.07Å; Q267-Y289 HydrophobicContact CB-CD2 4.03Å; Q267-Y289 HydrophobicContact CB-CE1 4.05Å; Q267-Y289 HydrophobicContact CB-CE2 4.03Å; Q267-Y289 HydrophobicContact CB-CG 4.06Å; Q267-Y289 HydrophobicContact CG-CD1 3.66Å; Q267-Y289 HydrophobicContact CG-CE1 3.65Å; Q267-Y289 HydrophobicContact CG-CG 4.13Å; E270-Y289 PolarHBondContact OE1-OH 3.41Å; E270-Y289 PolarHBondContact OE2-OH 3.12Å; A271-Y289 HydrophobicContact CB-CE2 4.09Å; Y285-Y289 HydrophobicContact CD1-CE2 4.45Å; Y285-Y289 WeakPolarHBondContact O-CD2 3.13Å; Y285-Y289 PolarHBondContact O-N 2.9Å; L286-Y289 PolarHBondContact O-N 3.24Å; L286-Y289 VanDerWaalsContact O-N 3.14Å; I287-Y289 VanDerWaalsContact C-N 3.28Å; I287-Y289 PolarHBondContact O-N 3.19Å
290V91.9Very high90.5Very high15 Ų1554.9 Ų54.99%0.09125%0.251CS..Hα-helixtrans-86.8-31.7-177.7170.90000113.2L255 L261 I263 L286 K325 L329L255-V290 HydrophobicContact CD1-CG2 3.89Å; L261-V290 HydrophobicContact CD1-CG1 4.06Å; L261-V290 HydrophobicContact CD2-CG1 4.08Å; I263-V290 HydrophobicContact CD1-CG2 3.8Å; I263-V290 HydrophobicContact CG1-CG2 4.13Å; L286-V290 WeakPolarHBondContact O-CB 3.3Å; L286-V290 WeakPolarHBondContact O-CG2 3.4Å; L286-V290 PolarHBondContact O-N 3.16Å; V290-K325 HydrophobicContact CG1-CB 4.18Å; V290-K325 HydrophobicContact CG1-CD 3.96Å; V290-K325 HydrophobicContact CG1-CG 4.21Å; V290-K325 PolarHBondContact O-NZ 3.48Å; V290-K325 VanDerWaalsContact O-NZ 3.09Å; V290-L329 HydrophobicContact CB-CD1 4.36Å; V290-L329 HydrophobicContact CG1-CD1 4.37Å; V290-L329 HydrophobicContact CG2-CD2 4.08Å
291F91.6Very high89.8Confident8 Ų851.7 Ų51.74%0.03524%0.241CC..SBendtrans-108.1134.9177.7-67.2-88.1000111.2I287 E295 L296 L321 N322 K325 V326 L329 F355I287-F291 HydrophobicContact CB-CD2 4.5Å; I287-F291 HydrophobicContact CG2-CD2 3.99Å; I287-F291 WeakPolarHBondContact O-CB 3.24Å; I287-F291 PolarHBondContact O-N 3.26Å; F291-E295 WeakPolarHBondContact CA-OE2 3.42Å; F291-E295 HydrophobicContact CD1-CB 4.24Å; F291-L296 HydrophobicContact CB-CD1 4.26Å; F291-L296 HydrophobicContact CB-CD2 3.85Å; F291-L296 HydrophobicContact CB-CG 3.82Å; F291-L296 HydrophobicContact CD1-CD2 4.44Å; F291-L296 HydrophobicContact CG-CD2 4.04Å; F291-L321 HydrophobicContact CD1-CD2 4.11Å; F291-L321 HydrophobicContact CE1-CD2 3.86Å; F291-L321 HydrophobicContact CZ-CD2 4.4Å; F291-N322 HydrophobicContact CE1-CB 4.42Å; F291-K325 HydrophobicContact CD1-CD 3.97Å; F291-K325 HydrophobicContact CE1-CB 3.78Å; F291-K325 HydrophobicContact CE1-CD 3.64Å; F291-K325 HydrophobicContact CE1-CG 4.31Å; F291-K325 HydrophobicContact CE2-CB 4.02Å; F291-K325 HydrophobicContact CZ-CB 3.34Å; F291-K325 HydrophobicContact CZ-CD 4.02Å; F291-K325 HydrophobicContact CZ-CG 4.3Å; F291-V326 HydrophobicContact CZ-CG2 4.07Å; F291-L329 HydrophobicContact CD2-CD1 4.37Å; F291-L329 HydrophobicContact CE2-CD1 3.82Å; F291-F355 HydrophobicContact CE2-CE1 4.27Å
292T90.4Very high88.8Confident77 Ų7748.9 Ų48.947%0.47223%0.233SC..  trans-70.5158.1168.175.40000110.1D294 E295 L296T292-D294 PolarHBondContact O-N 2.88Å; T292-E295 PolarHBondContact N-OE2 3.47Å; T292-E295 PolarHBondContact O-N 2.95Å; T292-E295 WeakPolarHBondContact OG1-CG 3.33Å; T292-E295 PolarHBondContact OG1-N 2.87Å; T292-E295 VanDerWaalsContact OG1-N 3.12Å; T292-L296 PolarHBondContact O-N 3.19Å; T292-L296 VanDerWaalsContact O-N 3.16Å
293T88.5Confident87.4Confident85 Ų8551.1 Ų51.152%0.52126%0.256SS..Hα-helixtrans-60.5-34.3177.8-60.60000111.2L296 K297T293-L296 PolarHBondContact O-N 3.45Å; T293-K297 HydrophobicContact CG2-CD 3.99Å; T293-K297 VanDerWaalsContact CG2-CE 3.49Å; T293-K297 HydrophobicContact CG2-CG 4.35Å; T293-K297 WeakPolarHBondContact O-CB 3.11Å; T293-K297 VanDerWaalsContact O-CG 3.28Å; T293-K297 WeakPolarHBondContact O-CG 3.19Å; T293-K297 PolarHBondContact O-N 2.81Å
294D85.9Confident85.9Confident87 Ų8758.1 Ų58.147%0.46529%0.286SS..Hα-helixtrans-72.7-42.1179.9-63.4-26.3000111.4T292 L296 K297 F298T292-D294 PolarHBondContact O-N 2.88Å; D294-L296 PolarHBondContact O-N 3.04Å; D294-K297 PolarHBondContact O-N 3.02Å; D294-K297 VanDerWaalsContact O-N 3.16Å; D294-K297 IonicContact OD1-NZ 3.96Å; D294-F298 HydrophobicContact CB-CD2 3.94Å; D294-F298 HydrophobicContact CB-CE2 3.86Å; D294-F298 WeakPolarHBondContact O-CB 3.32Å; D294-F298 WeakPolarHBondContact O-CD2 3.42Å; D294-F298 PolarHBondContact O-N 2.79Å
295E89.1Confident84.1Confident66 Ų6664.4 Ų64.431%0.30831%0.31SS..Hα-helixtrans-54-42.3171.7-76.3-179.4124.800111.3F291 T292 S299 K325F291-E295 WeakPolarHBondContact CA-OE2 3.42Å; F291-E295 HydrophobicContact CD1-CB 4.24Å; T292-E295 PolarHBondContact N-OE2 3.47Å; T292-E295 PolarHBondContact O-N 2.95Å; T292-E295 WeakPolarHBondContact OG1-CG 3.33Å; T292-E295 PolarHBondContact OG1-N 2.87Å; T292-E295 VanDerWaalsContact OG1-N 3.12Å; E295-S299 VanDerWaalsContact O-CB 3.22Å; E295-S299 WeakPolarHBondContact O-CB 3.29Å; E295-S299 PolarHBondContact O-N 3.37Å; E295-K325 VanDerWaalsContact CD-NZ 3.29Å; E295-K325 IonicContact OE1-NZ 2.77Å; E295-K325 PolarHBondContact OE1-NZ 3.39Å; E295-K325 IonicContact OE2-NZ 2.99Å; E295-K325 PolarHBondContact OE2-NZ 2.96Å
296L88.7Confident81.7Confident13 Ų1371.2 Ų71.27%0.06834%0.341CS..Hα-helixtrans-69.6-46.8176.7-65.1175.3000112.3I287 F291 T292 T293 D294 F298 S299 L321 V359 A362I287-L296 HydrophobicContact CG2-CD1 4.19Å; I287-L296 HydrophobicContact CG2-CD2 4.1Å; F291-L296 HydrophobicContact CB-CD1 4.26Å; F291-L296 HydrophobicContact CB-CD2 3.85Å; F291-L296 HydrophobicContact CB-CG 3.82Å; F291-L296 HydrophobicContact CD1-CD2 4.44Å; F291-L296 HydrophobicContact CG-CD2 4.04Å; T292-L296 PolarHBondContact O-N 3.19Å; T292-L296 VanDerWaalsContact O-N 3.16Å; T293-L296 PolarHBondContact O-N 3.45Å; D294-L296 PolarHBondContact O-N 3.04Å; L296-F298 PolarHBondContact O-N 2.95Å; L296-S299 PolarHBondContact O-N 2.63Å; L296-S299 PolarHBondContact O-OG 3.11Å; L296-L321 HydrophobicContact CD2-CD2 3.89Å; L296-V359 HydrophobicContact CD2-CG2 4.08Å; L296-A362 HydrophobicContact CB-CB 3.45Å; L296-A362 VanDerWaalsContact CB-CB 3.45Å; L296-A362 HydrophobicContact CD1-CB 4.31Å
297K85.7Confident79.8Confident79 Ų7979 Ų7934%0.34337%0.37SS..Hα-helixtrans-59.3-46.4-179.3-81.7170.9178170.70112.8T293 D294 A362 R363T293-K297 HydrophobicContact CG2-CD 3.99Å; T293-K297 VanDerWaalsContact CG2-CE 3.49Å; T293-K297 HydrophobicContact CG2-CG 4.35Å; T293-K297 WeakPolarHBondContact O-CB 3.11Å; T293-K297 VanDerWaalsContact O-CG 3.28Å; T293-K297 WeakPolarHBondContact O-CG 3.19Å; T293-K297 PolarHBondContact O-N 2.81Å; D294-K297 PolarHBondContact O-N 3.02Å; D294-K297 VanDerWaalsContact O-N 3.16Å; D294-K297 IonicContact OD1-NZ 3.96Å; K297-A362 WeakPolarHBondContact CE-O 3.49Å; K297-A362 HydrophobicContact CG-CB 3.98Å; K297-A362 WeakPolarHBondContact CG-O 3.16Å; K297-R363 VanDerWaalsContact O-CZ 3.23Å; K297-R363 PolarHBondContact O-NE 3.17Å; K297-R363 PolarHBondContact O-NH2 3.21Å
298F82.1Confident77.4Confident110 Ų11083.1 Ų83.148%0.48240%0.4SS..Hα-helixtrans-83.7-14.6-175.6-62.7-65.7000112.7D294 L296 L316 R318D294-F298 HydrophobicContact CB-CD2 3.94Å; D294-F298 HydrophobicContact CB-CE2 3.86Å; D294-F298 WeakPolarHBondContact O-CB 3.32Å; D294-F298 WeakPolarHBondContact O-CD2 3.42Å; D294-F298 PolarHBondContact O-N 2.79Å; L296-F298 PolarHBondContact O-N 2.95Å; F298-L316 HydrophobicContact CE1-CD1 4.42Å; F298-R318 VanDerWaalsContact O-CB 3.28Å; F298-R318 WeakPolarHBondContact O-CB 3.41Å; F298-R318 WeakPolarHBondContact O-CG 3.27Å
299S82.8Confident75.1Confident5 Ų580.6 Ų80.64%0.03541%0.405CS..  trans-70.9146176.775.70000113.8E295 L296 G301 R319 L321 V359 R363E295-S299 VanDerWaalsContact O-CB 3.22Å; E295-S299 WeakPolarHBondContact O-CB 3.29Å; E295-S299 PolarHBondContact O-N 3.37Å; L296-S299 PolarHBondContact O-N 2.63Å; L296-S299 PolarHBondContact O-OG 3.11Å; S299-G301 PolarHBondContact O-N 2.96Å; S299-G301 PolarHBondContact OG-N 2.69Å; S299-R319 CarbonylContact C-O 3.47Å; S299-R319 WeakPolarHBondContact CA-O 3.14Å; S299-L321 WeakPolarHBondContact OG-CD2 3.45Å; S299-V359 WeakPolarHBondContact OG-CG2 3.27Å; S299-R363 PolarHBondContact O-NH2 3.49Å
300C77.7Confident72.8Confident45 Ų4586.6 Ų86.630%0.30443%0.434SS..  trans-81.514167.970.90000113.4R318 R319 P320C300-R318 HydrophobicContact CB-CB 4.18Å; C300-R319 PolarHBondContact N-O 3.14Å; C300-R319 VanDerWaalsContact SG-C 3.58Å; C300-P320 WeakPolarHBondContact SG-CA 3.1Å; C300-P320 VanDerWaalsContact SG-N 3.36Å
301G80.9Confident70.6Confident7 Ų790.1 Ų90.17%0.07246%0.46CS..  trans77.5-144.3-174.700000112.3S299 G303 L321S299-G301 PolarHBondContact O-N 2.96Å; S299-G301 PolarHBondContact OG-N 2.69Å; G301-G303 PolarHBondContact O-N 3.32Å; G301-L321 PolarHBondContact O-N 3.44Å
302L74.8Confident68.3Low39 Ų3994.3 Ų94.320%0.20450%0.504CS..SBendtrans-80.19.1-175.5-64.2176.7000114.5K304 L321 V326 N352 F355L302-K304 HydrophobicContact CB-CG 4.4Å; L302-K304 PolarHBondContact O-N 3.49Å; L302-L321 HydrophobicContact CD2-CD1 4.26Å; L302-V326 HydrophobicContact CD2-CG1 3.84Å; L302-V326 HydrophobicContact CD2-CG2 4.17Å; L302-N352 HydrophobicContact CD1-CB 4.12Å; L302-N352 VanDerWaalsContact CD1-OD1 3.24Å; L302-N352 WeakPolarHBondContact CD1-OD1 3.43Å; L302-F355 HydrophobicContact CD1-CB 3.98Å; L302-F355 HydrophobicContact CD2-CB 4.03Å; L302-F355 HydrophobicContact CD2-CD2 4.43Å; L302-F355 HydrophobicContact CD2-CG 4.14Å; L302-F355 HydrophobicContact CG-CB 4.05Å
303G66.3Low65.9Low46 Ų4696.7 Ų96.747%0.47451%0.514SS..SBendtrans67-2.6178.100000116.1G301 R305G301-G303 PolarHBondContact O-N 3.32Å; G303-R305 PolarHBondContact O-N 3.08Å; G303-R305 VanDerWaalsContact O-N 3.08Å
304K63.3Low63.8Low148 Ų14899 Ų9964%0.64353%0.531SS*.  trans-69-3.6-175.4-67.3-169.5175.51770115.3L302 N352L302-K304 HydrophobicContact CB-CG 4.4Å; L302-K304 PolarHBondContact O-N 3.49Å; K304-N352 PolarHBondContact NZ-ND2 3.32Å; K304-N352 PolarHBondContact NZ-OD1 2.89Å; K304-N352 VanDerWaalsContact NZ-OD1 3.11Å
305R57.7Low62Low214 Ų21497.4 Ų97.481%0.80854%0.535SS*.SBendtrans-123.9117.8176.2-63.7-173.1-154.81385.6110.1G303 R307G303-R305 PolarHBondContact O-N 3.08Å; G303-R305 VanDerWaalsContact O-N 3.08Å; R305-R307 PolarHBondContact O-N 3.44Å
306K46.4Very low60.2Low212 Ų212100.6 Ų100.692%0.92255%0.554SS**  trans-6699.4165-173.1-178.7-178.2-178.80107.5S308K306-S308 PolarHBondContact O-N 3.16Å
307R54.1Low58.6Low162 Ų162107.4 Ų107.461%0.61159%0.585SS**  trans-77.5117.6163.7-78.7-165.7-72.9-155.7-4.7107.1R305 V309R305-R307 PolarHBondContact O-N 3.44Å; R307-V309 PolarHBondContact O-N 3.23Å
308S42.3Very low57.8Low89 Ų89109.7 Ų109.762%0.62259%0.591SS**  trans-56.8126.2160.152.40000107.7K306 H310K306-S308 PolarHBondContact O-N 3.16Å; S308-H310 PolarHBondContact O-N 3.45Å
309V44.7Very low57.5Low133 Ų133112.4 Ų112.481%0.80660%0.599SS**  trans-61.299.2171.51800000107.5R307R307-V309 PolarHBondContact O-N 3.23Å
310H43.7Very low57.4Low179 Ų179115.7 Ų115.783%0.82962%0.62SS**  trans-135.541.2170.4-91.591.7000110.1S308S308-H310 PolarHBondContact O-N 3.45Å
311S44.8Very low57.7Low89 Ų89114 Ų11462%0.62261%0.607SS**  trans-132.398.2164.754.30000106.6D313S311-D313 PolarHBondContact O-N 2.94Å
312G44.9Very low58Low95 Ų95116.8 Ų116.898%0.97962%0.621SS**  trans-7151175.100000112.3
313D39Very low58.5Low127 Ų127119.3 Ų119.368%0.67964%0.639SS**  trans-110.7127.9169.5-16312.6000106.1S311 G315S311-D313 PolarHBondContact O-N 2.94Å; D313-G315 PolarHBondContact O-N 3.48Å
314P45.6Very low59.6Low135 Ų135120.6 Ų120.688%0.87764%0.638SS**  trans-67.835.4178.9-14.629.2000113.5L316P314-L316 PolarHBondContact O-N 3.49Å
315G47.1Very low60.9Low53 Ų53115.2 Ų115.255%0.54661%0.614SS.*  trans-84.8111.2-170.800000112.6D313D313-G315 PolarHBondContact O-N 3.48Å
316L51.4Low62.6Low133 Ų133105.5 Ų105.570%0.69658%0.579SS**  trans17.7101.7158.6-62.5173.2000114.9F298 P314 R318F298-L316 HydrophobicContact CE1-CD1 4.42Å; P314-L316 PolarHBondContact O-N 3.49Å; L316-R318 VanDerWaalsContact O-CG 3.32Å; L316-R318 WeakPolarHBondContact O-CG 3.47Å; L316-R318 PolarHBondContact O-N 3.03Å
317E55.9Low64.7Low155 Ų15597.9 Ų97.972%0.72455%0.552SS**  trans-50.9108.5178.6-162.2-174-146.700111.1R319E317-R319 PolarHBondContact O-N 3.42Å; E317-R319 IonicContact OE2-CZ 3.56Å; E317-R319 IonicContact OE2-NE 3.61Å; E317-R319 IonicContact OE2-NH2 2.79Å; E317-R319 PolarHBondContact OE2-NH2 3.41Å
318R67.9Low66.5Low127 Ų12790.1 Ų90.148%0.47952%0.523SS..  trans-79.6107.8-172.7-64-159.8179.8133-3.5111F298 C300 L316 R363F298-R318 VanDerWaalsContact O-CB 3.28Å; F298-R318 WeakPolarHBondContact O-CB 3.41Å; F298-R318 WeakPolarHBondContact O-CG 3.27Å; C300-R318 HydrophobicContact CB-CB 4.18Å; L316-R318 VanDerWaalsContact O-CG 3.32Å; L316-R318 WeakPolarHBondContact O-CG 3.47Å; L316-R318 PolarHBondContact O-N 3.03Å; R318-R363 VanDerWaalsContact CZ-NH1 3.3Å
319R75.1Confident69Low168 Ų16885.9 Ų85.963%0.63449%0.493SS*.PPolyproline II helixtrans-71.8152.2177.6-64.1-72.3167151.3-9.3111.9S299 C300 E317S299-R319 CarbonylContact C-O 3.47Å; S299-R319 WeakPolarHBondContact CA-O 3.14Å; C300-R319 PolarHBondContact N-O 3.14Å; C300-R319 VanDerWaalsContact SG-C 3.58Å; E317-R319 PolarHBondContact O-N 3.42Å; E317-R319 IonicContact OE2-CZ 3.56Å; E317-R319 IonicContact OE2-NE 3.61Å; E317-R319 IonicContact OE2-NH2 2.79Å; E317-R319 PolarHBondContact OE2-NH2 3.41Å
320P80.9Confident71.3Confident74 Ų7481.5 Ų81.548%0.48146%0.462SS..PPolyproline II helixtrans-62.8160.1171.727.3-33.7000111.2C300C300-P320 WeakPolarHBondContact SG-CA 3.1Å; C300-P320 VanDerWaalsContact SG-N 3.36Å
321L84.7Confident73.7Confident9 Ų976.2 Ų76.25%0.04744%0.438CS..PPolyproline II helixtrans-54144.4170.8-78170.5000109.9F291 L296 S299 G301 L302 P323 V326 F355 V359F291-L321 HydrophobicContact CD1-CD2 4.11Å; F291-L321 HydrophobicContact CE1-CD2 3.86Å; F291-L321 HydrophobicContact CZ-CD2 4.4Å; L296-L321 HydrophobicContact CD2-CD2 3.89Å; S299-L321 WeakPolarHBondContact OG-CD2 3.45Å; G301-L321 PolarHBondContact O-N 3.44Å; L302-L321 HydrophobicContact CD2-CD1 4.26Å; L321-P323 WeakPolarHBondContact O-CD 3.42Å; L321-V326 HydrophobicContact CB-CG2 3.77Å; L321-V326 HydrophobicContact CD1-CG2 4.31Å; L321-F355 HydrophobicContact CD1-CB 4.47Å; L321-F355 HydrophobicContact CD1-CD1 4.21Å; L321-V359 HydrophobicContact CD1-CG2 3.82Å; L321-V359 HydrophobicContact CD2-CG2 4.21Å; L321-V359 HydrophobicContact CG-CG2 4.21Å
322N86.4Confident76Confident66 Ų6673.1 Ų73.135%0.35341%0.414SS..  trans-53.8115.3-179.9-176.7-43.1000110F291 V324 K325 V326F291-N322 HydrophobicContact CE1-CB 4.42Å; N322-V324 PolarHBondContact O-N 3.25Å; N322-V324 VanDerWaalsContact OD1-CB 3.27Å; N322-V324 WeakPolarHBondContact OD1-CB 3.45Å; N322-V324 PolarHBondContact OD1-N 3.46Å; N322-K325 HydrophobicContact CB-CB 4.19Å; N322-K325 HydrophobicContact CB-CD 4.18Å; N322-K325 HydrophobicContact CB-CG 4.05Å; N322-K325 PolarHBondContact O-N 2.81Å; N322-K325 PolarHBondContact OD1-N 3.28Å; N322-V326 WeakPolarHBondContact O-CG2 3.28Å; N322-V326 PolarHBondContact O-N 3.41Å
323P87.1Confident78.4Confident91 Ų9168.7 Ų68.759%0.59137%0.367SS*.Hα-helixtrans-66.6-27.7-172.426.2-34.4000112.3L321 S327L321-P323 WeakPolarHBondContact O-CD 3.42Å; P323-S327 VanDerWaalsContact O-CB 3.27Å; P323-S327 WeakPolarHBondContact O-CB 3.25Å; P323-S327 PolarHBondContact O-N 3.34Å; P323-S327 PolarHBondContact O-OG 3.25Å
324V88.9Confident80.9Confident73 Ų7368.1 Ų68.144%0.44236%0.356SS..Hα-helixtrans-68-50176.6-179.80000109.8Y259 N322 V326 S327 C328Y259-V324 HydrophobicContact CD1-CG1 3.5Å; Y259-V324 HydrophobicContact CE1-CG1 3.73Å; N322-V324 PolarHBondContact O-N 3.25Å; N322-V324 VanDerWaalsContact OD1-CB 3.27Å; N322-V324 WeakPolarHBondContact OD1-CB 3.45Å; N322-V324 PolarHBondContact OD1-N 3.46Å; V324-V326 VanDerWaalsContact C-N 3.34Å; V324-V326 PolarHBondContact O-N 3.49Å; V324-S327 PolarHBondContact O-N 3.03Å; V324-C328 WeakPolarHBondContact O-CB 3.46Å; V324-C328 PolarHBondContact O-N 3.02Å
325K91.1Very high83.1Confident35 Ų3565.6 Ų65.615%0.15233%0.333CS..Hα-helixtrans-61.6-42.1177.4-64.8-172.1171.2-175.10112.1L261 V290 F291 E295 N322 L329L261-K325 HydrophobicContact CD1-CB 4.3Å; L261-K325 HydrophobicContact CD1-CG 4.17Å; L261-K325 HydrophobicContact CD2-CG 4.11Å; V290-K325 HydrophobicContact CG1-CB 4.18Å; V290-K325 HydrophobicContact CG1-CD 3.96Å; V290-K325 HydrophobicContact CG1-CG 4.21Å; V290-K325 PolarHBondContact O-NZ 3.48Å; V290-K325 VanDerWaalsContact O-NZ 3.09Å; F291-K325 HydrophobicContact CD1-CD 3.97Å; F291-K325 HydrophobicContact CE1-CB 3.78Å; F291-K325 HydrophobicContact CE1-CD 3.64Å; F291-K325 HydrophobicContact CE1-CG 4.31Å; F291-K325 HydrophobicContact CE2-CB 4.02Å; F291-K325 HydrophobicContact CZ-CB 3.34Å; F291-K325 HydrophobicContact CZ-CD 4.02Å; F291-K325 HydrophobicContact CZ-CG 4.3Å; E295-K325 VanDerWaalsContact CD-NZ 3.29Å; E295-K325 IonicContact OE1-NZ 2.77Å; E295-K325 PolarHBondContact OE1-NZ 3.39Å; E295-K325 IonicContact OE2-NZ 2.99Å; E295-K325 PolarHBondContact OE2-NZ 2.96Å; N322-K325 HydrophobicContact CB-CB 4.19Å; N322-K325 HydrophobicContact CB-CD 4.18Å; N322-K325 HydrophobicContact CB-CG 4.05Å; N322-K325 PolarHBondContact O-N 2.81Å; N322-K325 PolarHBondContact OD1-N 3.28Å; K325-L329 WeakPolarHBondContact O-CG 3.05Å; K325-L329 PolarHBondContact O-N 3.41Å; K325-L329 VanDerWaalsContact O-N 3.1Å
326V91.4Very high85.2Confident10 Ų1064.5 Ų64.56%0.06131%0.314CS..Hα-helixtrans-63.8-45.8177.3171.50000111.1F291 L302 L321 N322 V324 L329 R330 F355F291-V326 HydrophobicContact CZ-CG2 4.07Å; L302-V326 HydrophobicContact CD2-CG1 3.84Å; L302-V326 HydrophobicContact CD2-CG2 4.17Å; L321-V326 HydrophobicContact CB-CG2 3.77Å; L321-V326 HydrophobicContact CD1-CG2 4.31Å; N322-V326 WeakPolarHBondContact O-CG2 3.28Å; N322-V326 PolarHBondContact O-N 3.41Å; V324-V326 VanDerWaalsContact C-N 3.34Å; V324-V326 PolarHBondContact O-N 3.49Å; V326-L329 PolarHBondContact O-N 2.95Å; V326-R330 HydrophobicContact CG1-CG 4.48Å; V326-R330 VanDerWaalsContact CG1-NE 3.3Å; V326-R330 WeakPolarHBondContact O-CG 3.48Å; V326-R330 PolarHBondContact O-N 3.14Å; V326-F355 HydrophobicContact CG1-CE1 4.42Å; V326-F355 HydrophobicContact CG1-CE2 4.25Å; V326-F355 HydrophobicContact CG1-CZ 4.11Å; V326-F355 HydrophobicContact CG2-CD1 4.38Å; V326-F355 HydrophobicContact CG2-CE1 4.07Å
327S91.3Very high87.2Confident52 Ų5258.5 Ų58.536%0.36428%0.283SS..Hα-helixtrans-65.9-43.2-179.4-580000111.7P323 V324 L329 R330 E331P323-S327 VanDerWaalsContact O-CB 3.27Å; P323-S327 WeakPolarHBondContact O-CB 3.25Å; P323-S327 PolarHBondContact O-N 3.34Å; P323-S327 PolarHBondContact O-OG 3.25Å; V324-S327 PolarHBondContact O-N 3.03Å; S327-L329 PolarHBondContact O-N 3.34Å; S327-R330 PolarHBondContact O-N 3.19Å; S327-E331 WeakPolarHBondContact O-CB 3.43Å; S327-E331 PolarHBondContact O-N 3.33Å
328C92.4Very high88.9Confident0 Ų054.3 Ų54.30%028%0.275CS..Hα-helixtrans-55.3-50.8173.8-179.80000111.7L256 Y259 L261 V324 R330 E331 F332L256-C328 HydrophobicContact CD1-CB 4.49Å; L256-C328 WeakPolarHBondContact CD1-O 3.11Å; Y259-C328 HydrophobicContact CD1-CB 3.77Å; Y259-C328 HydrophobicContact CD2-CB 3.82Å; Y259-C328 HydrophobicContact CE1-CB 4.12Å; Y259-C328 HydrophobicContact CE2-CB 4.19Å; Y259-C328 HydrophobicContact CG-CB 3.6Å; L261-C328 HydrophobicContact CD1-CB 3.61Å; L261-C328 VanDerWaalsContact CD1-SG 3.55Å; V324-C328 WeakPolarHBondContact O-CB 3.46Å; V324-C328 PolarHBondContact O-N 3.02Å; C328-R330 VanDerWaalsContact C-N 3.35Å; C328-R330 PolarHBondContact O-N 2.93Å; C328-E331 PolarHBondContact O-N 3.01Å; C328-F332 WeakPolarHBondContact O-CB 3.38Å; C328-F332 PolarHBondContact O-N 2.87Å
329L93.9Very high90Very high0 Ų052.3 Ų52.30%028%0.28CS..Hα-helixtrans-66.3-35.9-178.3-73.4-177.8000113.2L255 L283 L286 I287 V290 F291 K325 V326 S327 I333 F355L255-L329 HydrophobicContact CD1-CD2 3.84Å; L283-L329 HydrophobicContact CD1-CB 4.02Å; L283-L329 HydrophobicContact CD1-CD1 4.45Å; L286-L329 HydrophobicContact CB-CD2 3.73Å; L286-L329 HydrophobicContact CD1-CD2 4.19Å; I287-L329 HydrophobicContact CG1-CD1 3.75Å; V290-L329 HydrophobicContact CB-CD1 4.36Å; V290-L329 HydrophobicContact CG1-CD1 4.37Å; V290-L329 HydrophobicContact CG2-CD2 4.08Å; F291-L329 HydrophobicContact CD2-CD1 4.37Å; F291-L329 HydrophobicContact CE2-CD1 3.82Å; K325-L329 WeakPolarHBondContact O-CG 3.05Å; K325-L329 PolarHBondContact O-N 3.41Å; K325-L329 VanDerWaalsContact O-N 3.1Å; V326-L329 PolarHBondContact O-N 2.95Å; S327-L329 PolarHBondContact O-N 3.34Å; L329-I333 WeakPolarHBondContact O-CG1 3.42Å; L329-I333 PolarHBondContact O-N 2.92Å; L329-I333 VanDerWaalsContact O-N 3.08Å; L329-F355 HydrophobicContact CB-CZ 4Å; L329-F355 HydrophobicContact CD1-CE1 4.09Å; L329-F355 HydrophobicContact CD1-CZ 4.23Å
330R94Very high90.7Very high40 Ų4047.1 Ų47.115%0.15127%0.265CS..Hα-helixtrans-62.2-51.9175.4-75.9172178.5-78.92.8111.3V326 S327 C328 F332 I333 R334 E348 I351 N352 F355V326-R330 HydrophobicContact CG1-CG 4.48Å; V326-R330 VanDerWaalsContact CG1-NE 3.3Å; V326-R330 WeakPolarHBondContact O-CG 3.48Å; V326-R330 PolarHBondContact O-N 3.14Å; S327-R330 PolarHBondContact O-N 3.19Å; C328-R330 VanDerWaalsContact C-N 3.35Å; C328-R330 PolarHBondContact O-N 2.93Å; R330-F332 VanDerWaalsContact C-N 3.31Å; R330-F332 PolarHBondContact O-N 3.5Å; R330-I333 PolarHBondContact O-N 3.45Å; R330-R334 WeakPolarHBondContact O-CB 3.43Å; R330-R334 PolarHBondContact O-N 2.99Å; R330-E348 IonicContact CZ-OE1 3.52Å; R330-E348 IonicContact NH1-OE1 2.63Å; R330-E348 PolarHBondContact NH1-OE1 2.84Å; R330-E348 IonicContact NH1-OE2 2.96Å; R330-E348 PolarHBondContact NH1-OE2 3.47Å; R330-E348 IonicContact NH2-OE1 3.83Å; R330-I351 HydrophobicContact CG-CG2 3.96Å; R330-N352 PolarHBondContact NH2-OD1 3.45Å; R330-F355 HydrophobicContact CG-CE2 4.08Å
331E93.6Very high91Very high69 Ų6949.6 Ų49.632%0.32228%0.281SS..Hα-helixtrans-67-38.4-177.3-172.156.4-160.400111L256 S327 C328 R334 M335L256-E331 HydrophobicContact CD1-CB 4.11Å; L256-E331 HydrophobicContact CD1-CG 4.35Å; S327-E331 WeakPolarHBondContact O-CB 3.43Å; S327-E331 PolarHBondContact O-N 3.33Å; C328-E331 PolarHBondContact O-N 3.01Å; E331-R334 PolarHBondContact O-N 3.43Å; E331-R334 IonicContact OE1-CZ 3.39Å; E331-R334 IonicContact OE1-NE 3.34Å; E331-R334 PolarHBondContact OE1-NE 2.95Å; E331-R334 IonicContact OE1-NH2 2.64Å; E331-R334 PolarHBondContact OE1-NH2 3.47Å; E331-R334 IonicContact OE2-CZ 3.77Å; E331-R334 IonicContact OE2-NE 2.96Å; E331-R334 PolarHBondContact OE2-NE 3.3Å; E331-R334 IonicContact OE2-NH2 3.72Å; E331-M335 WeakPolarHBondContact O-CB 3.46Å; E331-M335 WeakPolarHBondContact O-CG 3.5Å; E331-M335 PolarHBondContact O-N 2.97Å
332F93.1Very high91.3Very high24 Ų2454.5 Ų54.511%0.10531%0.307CS..Hα-helixtrans-60.4-49.9175.9-179.8-95.9000112.2L255 L256 W268 L286 C328 R330 R334 M335 H336L255-F332 HydrophobicContact CB-CD2 4.12Å; L255-F332 HydrophobicContact CB-CE2 4.42Å; L255-F332 HydrophobicContact CD2-CD1 4.26Å; L255-F332 HydrophobicContact CD2-CD2 4.13Å; L255-F332 HydrophobicContact CD2-CE1 4.04Å; L255-F332 HydrophobicContact CD2-CE2 3.87Å; L255-F332 HydrophobicContact CD2-CG 4.31Å; L255-F332 HydrophobicContact CD2-CZ 3.82Å; L255-F332 WeakPolarHBondContact O-CD2 3.36Å; L255-F332 VanDerWaalsContact O-CE2 3.26Å; L255-F332 WeakPolarHBondContact O-CE2 3.44Å; L256-F332 HydrophobicContact CD1-CB 3.93Å; L256-F332 HydrophobicContact CG-CB 4.27Å; L256-F332 HydrophobicContact CG-CD2 4.24Å; W268-F332 HydrophobicContact CE3-CZ 4.39Å; W268-F332 AromaticContact CH2-CE1 3.95Å; W268-F332 HydrophobicContact CH2-CE1 3.95Å; W268-F332 AromaticContact CH2-CZ 3.54Å; W268-F332 HydrophobicContact CH2-CZ 3.54Å; W268-F332 AromaticContact CZ3-CE1 3.6Å; W268-F332 HydrophobicContact CZ3-CE1 3.6Å; W268-F332 AromaticContact CZ3-CZ 3.38Å; W268-F332 HydrophobicContact CZ3-CZ 3.38Å; L286-F332 HydrophobicContact CD1-CD1 3.59Å; L286-F332 HydrophobicContact CD1-CE1 3.7Å; C328-F332 WeakPolarHBondContact O-CB 3.38Å; C328-F332 PolarHBondContact O-N 2.87Å; R330-F332 VanDerWaalsContact C-N 3.31Å; R330-F332 PolarHBondContact O-N 3.5Å; F332-R334 VanDerWaalsContact C-N 3.31Å; F332-R334 PolarHBondContact O-N 2.92Å; F332-M335 PolarHBondContact O-N 3.18Å; F332-H336 HydrophobicContact CE1-CB 4.22Å; F332-H336 HydrophobicContact CZ-CB 4.38Å; F332-H336 WeakPolarHBondContact O-CB 3.33Å; F332-H336 PolarHBondContact O-N 3.26Å
333I94.5Very high91.6Very high1 Ų152.7 Ų52.71%0.00530%0.295CS..Hα-helixtrans-63.3-41.2178.7-71.6-66.3000110.9L282 L283 L286 L329 R330 M335 H336 C337 P346L282-I333 HydrophobicContact CB-CD1 4.14Å; L282-I333 HydrophobicContact CD2-CD1 3.74Å; L282-I333 HydrophobicContact CG-CD1 3.83Å; L283-I333 HydrophobicContact CB-CD1 4.05Å; L283-I333 HydrophobicContact CB-CG1 3.98Å; L283-I333 HydrophobicContact CD1-CG1 3.93Å; L283-I333 HydrophobicContact CG-CG1 4.4Å; L286-I333 HydrophobicContact CD1-CD1 3.83Å; L286-I333 HydrophobicContact CD1-CG1 4.35Å; L329-I333 WeakPolarHBondContact O-CG1 3.42Å; L329-I333 PolarHBondContact O-N 2.92Å; L329-I333 VanDerWaalsContact O-N 3.08Å; R330-I333 PolarHBondContact O-N 3.45Å; I333-M335 PolarHBondContact O-N 3.33Å; I333-H336 PolarHBondContact O-N 3.2Å; I333-C337 WeakPolarHBondContact O-CB 3.5Å; I333-C337 PolarHBondContact O-N 2.91Å; I333-P346 HydrophobicContact CG2-CG 3.76Å
334R93.3Very high92Very high116 Ų11654.2 Ų54.244%0.43829%0.289SS..Hα-helixtrans-60.5-45.4177.2-167.7-168.572.474.20.2111.4R330 E331 F332 A338 M345R330-R334 WeakPolarHBondContact O-CB 3.43Å; R330-R334 PolarHBondContact O-N 2.99Å; E331-R334 PolarHBondContact O-N 3.43Å; E331-R334 IonicContact OE1-CZ 3.39Å; E331-R334 IonicContact OE1-NE 3.34Å; E331-R334 PolarHBondContact OE1-NE 2.95Å; E331-R334 IonicContact OE1-NH2 2.64Å; E331-R334 PolarHBondContact OE1-NH2 3.47Å; E331-R334 IonicContact OE2-CZ 3.77Å; E331-R334 IonicContact OE2-NE 2.96Å; E331-R334 PolarHBondContact OE2-NE 3.3Å; E331-R334 IonicContact OE2-NH2 3.72Å; F332-R334 VanDerWaalsContact C-N 3.31Å; F332-R334 PolarHBondContact O-N 2.92Å; R334-A338 WeakPolarHBondContact O-CB 3.43Å; R334-A338 PolarHBondContact O-N 3.42Å; R334-A338 VanDerWaalsContact O-N 3.16Å; R334-M345 WeakPolarHBondContact O-CE 3.39Å
335M91.7Very high92.2Very high82 Ų8254.2 Ų54.240%0.40429%0.285SS..Hα-helixtrans-69.4-48.2177.7-74-64.4-65.600111.5E331 F332 I333 C337 A338 S339E331-M335 WeakPolarHBondContact O-CB 3.46Å; E331-M335 WeakPolarHBondContact O-CG 3.5Å; E331-M335 PolarHBondContact O-N 2.97Å; F332-M335 PolarHBondContact O-N 3.18Å; I333-M335 PolarHBondContact O-N 3.33Å; M335-C337 PolarHBondContact O-N 3.36Å; M335-A338 PolarHBondContact O-N 2.93Å; M335-S339 WeakPolarHBondContact O-CB 3.37Å; M335-S339 PolarHBondContact O-N 3.38Å; M335-S339 PolarHBondContact O-OG 2.96Å; M335-S339 VanDerWaalsContact O-OG 3.08Å
336H90.7Very high92.4Very high30 Ų3052.7 Ų52.714%0.13928%0.279CS..Hα-helixtrans-62.6-45.4-176.7-173.475000112.4W268 F332 I333 N340 W343W268-H336 AromaticContact CH2-CE1 3.6Å; W268-H336 AromaticContact CH2-ND1 3.87Å; W268-H336 AromaticContact CH2-NE2 3.99Å; W268-H336 AromaticContact CZ2-CE1 3.76Å; F332-H336 HydrophobicContact CE1-CB 4.22Å; F332-H336 HydrophobicContact CZ-CB 4.38Å; F332-H336 WeakPolarHBondContact O-CB 3.33Å; F332-H336 PolarHBondContact O-N 3.26Å; I333-H336 PolarHBondContact O-N 3.2Å; H336-N340 PolarHBondContact O-N 3.42Å; H336-N340 PolarHBondContact O-ND2 2.86Å; H336-W343 AromaticContact CD2-CD2 3.97Å; H336-W343 AromaticContact NE2-CD2 3.81Å; H336-W343 AromaticContact NE2-CE2 3.39Å; H336-W343 AromaticContact NE2-CH2 3.62Å; H336-W343 AromaticContact NE2-CZ2 3.27Å; H336-W343 VanDerWaalsContact NE2-CZ2 3.27Å; H336-W343 WeakPolarHBondContact NE2-CZ2 3.3Å; H336-W343 AromaticContact NE2-NE1 3.97Å
337C92.9Very high92.5Very high7 Ų754.9 Ų54.95%0.04730%0.295CS..Hα-helixtrans-76-22178.6-64.30000112.8I333 M335 W343 M345I333-C337 WeakPolarHBondContact O-CB 3.5Å; I333-C337 PolarHBondContact O-N 2.91Å; M335-C337 PolarHBondContact O-N 3.36Å; C337-W343 HydrophobicContact CB-CB 4.19Å; C337-M345 HydrophobicContact CB-CB 4.31Å; C337-M345 HydrophobicContact CB-CE 3.36Å; C337-M345 HydrophobicContact CB-SD 3.74Å
338A91.8Very high92.6Very high67 Ų6757 Ų5755%0.55430%0.299SS*.Hα-helixtrans-77.9-38.7172.900000112.3R334 M335 N340 M345R334-A338 WeakPolarHBondContact O-CB 3.43Å; R334-A338 PolarHBondContact O-N 3.42Å; R334-A338 VanDerWaalsContact O-N 3.16Å; M335-A338 PolarHBondContact O-N 2.93Å; A338-N340 VanDerWaalsContact C-N 3.28Å; A338-N340 PolarHBondContact O-N 2.97Å; A338-M345 HydrophobicContact CB-CE 4.12Å
339S91.3Very high92.6Very high84 Ų8464.5 Ų64.559%0.58733%0.334SS*.Hα-helixtrans-74.5-16.4179.1-60.90000113.7M335M335-S339 WeakPolarHBondContact O-CB 3.37Å; M335-S339 PolarHBondContact O-N 3.38Å; M335-S339 PolarHBondContact O-OG 2.96Å; M335-S339 VanDerWaalsContact O-OG 3.08Å
340N89.8Confident92.6Very high60 Ų6067.4 Ų67.432%0.32135%0.348SS..  trans-121.9104-179.3-62.2-86.8000110.5H336 A338 D342 W343H336-N340 PolarHBondContact O-N 3.42Å; H336-N340 PolarHBondContact O-ND2 2.86Å; A338-N340 VanDerWaalsContact C-N 3.28Å; A338-N340 PolarHBondContact O-N 2.97Å; N340-D342 PolarHBondContact O-N 3.3Å; N340-D342 VanDerWaalsContact O-N 3.16Å; N340-W343 HydrophobicContact CB-CB 4.38Å; N340-W343 HydrophobicContact CB-CG 3.96Å; N340-W343 WeakPolarHBondContact O-CB 3.4Å; N340-W343 PolarHBondContact O-N 3.19Å
341P86.3Confident92.6Very high125 Ų12566 Ų6681%0.81234%0.343SS*.THydrogen-bonded Turntrans-66.1-21.1-17325.5-34.5000114.2W343P341-W343 PolarHBondContact O-N 3.11Å
342D91.4Very high92.6Very high112 Ų11263.8 Ų63.860%0.59933%0.334SS*.THydrogen-bonded Turntrans-74.5-8.2175.7-70.9-10.6000113.6K277 N340K277-D342 HydrophobicContact CD-CB 3.76Å; K277-D342 IonicContact NZ-OD2 2.76Å; K277-D342 PolarHBondContact NZ-OD2 2.87Å; N340-D342 PolarHBondContact O-N 3.3Å; N340-D342 VanDerWaalsContact O-N 3.16Å
343W93.7Very high92.6Very high28 Ų2868.1 Ų68.111%0.10635%0.352CS..SBendtrans-94.8133.1-176.1-7568.8000111.5V272 S275 K277 L282 H336 C337 N340 P341 M345V272-W343 HydrophobicContact CB-CH2 4.37Å; V272-W343 HydrophobicContact CG1-CH2 4.03Å; V272-W343 HydrophobicContact CG1-CZ2 3.84Å; V272-W343 HydrophobicContact CG2-CH2 4.16Å; V272-W343 HydrophobicContact CG2-CZ2 4.43Å; S275-W343 VanDerWaalsContact OG-CH2 3.28Å; S275-W343 WeakPolarHBondContact OG-CH2 3.38Å; S275-W343 WeakPolarHBondContact OG-CZ3 3.36Å; K277-W343 HydrophobicContact CB-CD2 4.2Å; K277-W343 HydrophobicContact CB-CE3 4.48Å; K277-W343 HydrophobicContact CB-CG 4.38Å; K277-W343 WeakPolarHBondContact O-CA 3.46Å; L282-W343 HydrophobicContact CB-CZ3 3.9Å; L282-W343 HydrophobicContact CD2-CE3 4.29Å; L282-W343 HydrophobicContact CD2-CH2 3.83Å; L282-W343 HydrophobicContact CD2-CZ3 3.51Å; L282-W343 HydrophobicContact CG-CZ3 4.19Å; H336-W343 AromaticContact CD2-CD2 3.97Å; H336-W343 AromaticContact NE2-CD2 3.81Å; H336-W343 AromaticContact NE2-CE2 3.39Å; H336-W343 AromaticContact NE2-CH2 3.62Å; H336-W343 AromaticContact NE2-CZ2 3.27Å; H336-W343 VanDerWaalsContact NE2-CZ2 3.27Å; H336-W343 WeakPolarHBondContact NE2-CZ2 3.3Å; H336-W343 AromaticContact NE2-NE1 3.97Å; C337-W343 HydrophobicContact CB-CB 4.19Å; N340-W343 HydrophobicContact CB-CB 4.38Å; N340-W343 HydrophobicContact CB-CG 3.96Å; N340-W343 WeakPolarHBondContact O-CB 3.4Å; N340-W343 PolarHBondContact O-N 3.19Å; P341-W343 PolarHBondContact O-N 3.11Å; W343-M345 PolarHBondContact O-N 2.98Å
344W94.7Very high92.6Very high124 Ų12468.1 Ų68.147%0.4735%0.352SS..BIsolated β-bridgetrans-77.8121.1175-175.685000110.9K277 G279 R280 P346K277-W344 PolarHBondContact O-N 3.11Å; G279-W344 WeakPolarHBondContact CA-O 3.5Å; G279-W344 PolarHBondContact N-O 3.4Å; R280-W344 HydrophobicContact CB-CZ3 3.97Å; W344-P346 HydrophobicContact CE3-CB 4.43Å; W344-P346 HydrophobicContact CH2-CB 4.3Å; W344-P346 VanDerWaalsContact CZ3-CA 3.5Å; W344-P346 HydrophobicContact CZ3-CB 3.72Å; W344-P346 WeakPolarHBondContact O-CD 3.48Å
345M94.4Very high92.6Very high72 Ų7262.7 Ų62.736%0.35533%0.332SS..PPolyproline II helixtrans-82.2117.4179.1-179.463.376.600111.4R334 C337 A338 W343R334-M345 WeakPolarHBondContact O-CE 3.39Å; C337-M345 HydrophobicContact CB-CB 4.31Å; C337-M345 HydrophobicContact CB-CE 3.36Å; C337-M345 HydrophobicContact CB-SD 3.74Å; A338-M345 HydrophobicContact CB-CE 4.12Å; W343-M345 PolarHBondContact O-N 2.98Å
346P93.8Very high92.6Very high4 Ų461.3 Ų61.33%0.02633%0.33CS..PPolyproline II helixtrans-72.2140.4171.628.8-33000111.5R280 I333 W344 Q350 I351R280-P346 HydrophobicContact CB-CB 4.31Å; I333-P346 HydrophobicContact CG2-CG 3.76Å; W344-P346 HydrophobicContact CE3-CB 4.43Å; W344-P346 HydrophobicContact CH2-CB 4.3Å; W344-P346 VanDerWaalsContact CZ3-CA 3.5Å; W344-P346 HydrophobicContact CZ3-CB 3.72Å; W344-P346 WeakPolarHBondContact O-CD 3.48Å; P346-Q350 HydrophobicContact CB-CB 4.16Å; P346-I351 HydrophobicContact CB-CG1 4Å; P346-I351 HydrophobicContact CG-CD1 4.19Å; P346-I351 HydrophobicContact CG-CG1 3.83Å
347S94.4Very high92.7Very high56 Ų5662.5 Ų62.539%0.39234%0.338SS..PPolyproline II helixtrans-64.5158.3168.1610000111.8E349 Q350 I351S347-E349 PolarHBondContact O-N 2.91Å; S347-Q350 WeakPolarHBondContact O-CA 3.41Å; S347-Q350 WeakPolarHBondContact O-CB 3.35Å; S347-Q350 PolarHBondContact O-N 3.44Å; S347-Q350 VanDerWaalsContact OG-CG 3.27Å; S347-Q350 WeakPolarHBondContact OG-CG 3.41Å; S347-Q350 PolarHBondContact OG-N 2.77Å; S347-Q350 PolarHBondContact OG-OE1 2.83Å; S347-I351 WeakPolarHBondContact O-CG1 3.39Å; S347-I351 PolarHBondContact O-N 3.13Å
348E92.3Very high92.7Very high97 Ų9763 Ų6345%0.45334%0.343SS..Hα-helixtrans-55-37.217717751.1-143.900112.3R330 I351 N352R330-E348 IonicContact CZ-OE1 3.52Å; R330-E348 IonicContact NH1-OE1 2.63Å; R330-E348 PolarHBondContact NH1-OE1 2.84Å; R330-E348 IonicContact NH1-OE2 2.96Å; R330-E348 PolarHBondContact NH1-OE2 3.47Å; R330-E348 IonicContact NH2-OE1 3.83Å; E348-I351 PolarHBondContact O-N 2.97Å; E348-N352 WeakPolarHBondContact O-CB 3.37Å; E348-N352 VanDerWaalsContact O-CG 3.27Å; E348-N352 PolarHBondContact O-N 2.95Å; E348-N352 PolarHBondContact O-ND2 3.42Å; E348-N352 PolarHBondContact OE1-ND2 3.22Å; E348-N352 PolarHBondContact OE1-OD1 3.21Å
349E92.8Very high92.6Very high156 Ų15660.3 Ų60.373%0.72932%0.319SS*.Hα-helixtrans-64.6-41.1174.2-66.8-177.8179.800112.8S347 N352 K353S347-E349 PolarHBondContact O-N 2.91Å; E349-N352 WeakPolarHBondContact O-CB 3.37Å; E349-N352 PolarHBondContact O-N 2.95Å; E349-K353 WeakPolarHBondContact O-CB 3.45Å; E349-K353 PolarHBondContact O-N 3.36Å
350Q94Very high92.5Very high62 Ų6257.4 Ų57.429%0.2930%0.302SS..Hα-helixtrans-69.3-36.5177.7-71163.7-34.600111.6P346 S347 K353 V354P346-Q350 HydrophobicContact CB-CB 4.16Å; S347-Q350 WeakPolarHBondContact O-CA 3.41Å; S347-Q350 WeakPolarHBondContact O-CB 3.35Å; S347-Q350 PolarHBondContact O-N 3.44Å; S347-Q350 VanDerWaalsContact OG-CG 3.27Å; S347-Q350 WeakPolarHBondContact OG-CG 3.41Å; S347-Q350 PolarHBondContact OG-N 2.77Å; S347-Q350 PolarHBondContact OG-OE1 2.83Å; Q350-K353 PolarHBondContact O-N 3.2Å; Q350-V354 WeakPolarHBondContact O-CG2 3.49Å; Q350-V354 PolarHBondContact O-N 2.72Å
351I94.3Very high92.5Very high9 Ų960.9 Ų60.95%0.04632%0.316CS..Hα-helixtrans-61-51.1171-66173.5000109.8L283 R330 P346 S347 E348 K353 V354 F355L283-I351 HydrophobicContact CD2-CB 4.21Å; L283-I351 HydrophobicContact CD2-CG1 4.19Å; L283-I351 HydrophobicContact CD2-CG2 3.8Å; R330-I351 HydrophobicContact CG-CG2 3.96Å; P346-I351 HydrophobicContact CB-CG1 4Å; P346-I351 HydrophobicContact CG-CD1 4.19Å; P346-I351 HydrophobicContact CG-CG1 3.83Å; S347-I351 WeakPolarHBondContact O-CG1 3.39Å; S347-I351 PolarHBondContact O-N 3.13Å; E348-I351 PolarHBondContact O-N 2.97Å; I351-K353 VanDerWaalsContact C-N 3.26Å; I351-K353 PolarHBondContact O-N 3.04Å; I351-V354 PolarHBondContact O-N 3.03Å; I351-V354 VanDerWaalsContact O-N 3.11Å; I351-F355 HydrophobicContact CG2-CD2 4.05Å; I351-F355 HydrophobicContact CG2-CE2 3.73Å; I351-F355 VanDerWaalsContact O-CD2 3.3Å; I351-F355 WeakPolarHBondContact O-CD2 3.19Å; I351-F355 PolarHBondContact O-N 3.16Å
352N93.1Very high92.5Very high24 Ų2455.5 Ų55.513%0.12828%0.282CS..Hα-helixtrans-56.1-41.1176.3-76.3-57.7000112.3L302 K304 R330 E348 E349 S356L302-N352 HydrophobicContact CD1-CB 4.12Å; L302-N352 VanDerWaalsContact CD1-OD1 3.24Å; L302-N352 WeakPolarHBondContact CD1-OD1 3.43Å; K304-N352 PolarHBondContact NZ-ND2 3.32Å; K304-N352 PolarHBondContact NZ-OD1 2.89Å; K304-N352 VanDerWaalsContact NZ-OD1 3.11Å; R330-N352 PolarHBondContact NH2-OD1 3.45Å; E348-N352 WeakPolarHBondContact O-CB 3.37Å; E348-N352 VanDerWaalsContact O-CG 3.27Å; E348-N352 PolarHBondContact O-N 2.95Å; E348-N352 PolarHBondContact O-ND2 3.42Å; E348-N352 PolarHBondContact OE1-ND2 3.22Å; E348-N352 PolarHBondContact OE1-OD1 3.21Å; E349-N352 WeakPolarHBondContact O-CB 3.37Å; E349-N352 PolarHBondContact O-N 2.95Å; N352-S356 PolarHBondContact O-N 2.98Å; N352-S356 VanDerWaalsContact O-N 3.11Å; N352-S356 PolarHBondContact O-OG 3.12Å
353K93Very high92.2Very high115 Ų11554.1 Ų54.150%0.527%0.269SS..Hα-helixtrans-64.3-42.5176.9-175.3173-178.7173.90111.6E349 Q350 I351 F355 S356 D357E349-K353 WeakPolarHBondContact O-CB 3.45Å; E349-K353 PolarHBondContact O-N 3.36Å; Q350-K353 PolarHBondContact O-N 3.2Å; I351-K353 VanDerWaalsContact C-N 3.26Å; I351-K353 PolarHBondContact O-N 3.04Å; K353-F355 PolarHBondContact O-N 3.36Å; K353-S356 PolarHBondContact O-N 3.45Å; K353-D357 WeakPolarHBondContact O-CB 3.28Å; K353-D357 PolarHBondContact O-N 3.37Å
354V95.1Very high91.5Very high1 Ų159.3 Ų59.31%0.00629%0.294CS..Hα-helixtrans-62.1-43.1178.6167.80000112.3R280 L283 R284 I287 Q350 I351 S356 D357 A358R280-V354 HydrophobicContact CG-CG2 3.38Å; L283-V354 HydrophobicContact CB-CG1 4.34Å; L283-V354 HydrophobicContact CD2-CB 4.04Å; L283-V354 HydrophobicContact CD2-CG1 3.88Å; L283-V354 HydrophobicContact CG-CG1 3.83Å; R284-V354 HydrophobicContact CG-CG1 3.59Å; R284-V354 HydrophobicContact CG-CG2 4.36Å; I287-V354 HydrophobicContact CD1-CG1 3.64Å; Q350-V354 WeakPolarHBondContact O-CG2 3.49Å; Q350-V354 PolarHBondContact O-N 2.72Å; I351-V354 PolarHBondContact O-N 3.03Å; I351-V354 VanDerWaalsContact O-N 3.11Å; V354-S356 VanDerWaalsContact C-N 3.34Å; V354-D357 PolarHBondContact O-N 3.13Å; V354-A358 WeakPolarHBondContact O-CB 3.16Å; V354-A358 PolarHBondContact O-N 3.4Å
355F93.6Very high89.5Confident1 Ų156 Ų560%0.00430%0.298CS..Hα-helixtrans-62.2-42.4173.6-76.9-72.6000112.1L283 I287 F291 L302 L321 V326 L329 R330 I351 K353 A358 V359L283-F355 HydrophobicContact CD1-CE2 4.41Å; L283-F355 HydrophobicContact CD1-CZ 4.14Å; L283-F355 HydrophobicContact CD2-CE2 4.29Å; I287-F355 HydrophobicContact CD1-CD1 3.58Å; I287-F355 HydrophobicContact CD1-CE1 3.67Å; I287-F355 HydrophobicContact CD1-CG 4.11Å; I287-F355 HydrophobicContact CD1-CZ 4.26Å; I287-F355 HydrophobicContact CG1-CD1 4.11Å; I287-F355 HydrophobicContact CG1-CE1 3.78Å; I287-F355 HydrophobicContact CG1-CZ 4.45Å; F291-F355 HydrophobicContact CE2-CE1 4.27Å; L302-F355 HydrophobicContact CD1-CB 3.98Å; L302-F355 HydrophobicContact CD2-CB 4.03Å; L302-F355 HydrophobicContact CD2-CD2 4.43Å; L302-F355 HydrophobicContact CD2-CG 4.14Å; L302-F355 HydrophobicContact CG-CB 4.05Å; L321-F355 HydrophobicContact CD1-CB 4.47Å; L321-F355 HydrophobicContact CD1-CD1 4.21Å; V326-F355 HydrophobicContact CG1-CE1 4.42Å; V326-F355 HydrophobicContact CG1-CE2 4.25Å; V326-F355 HydrophobicContact CG1-CZ 4.11Å; V326-F355 HydrophobicContact CG2-CD1 4.38Å; V326-F355 HydrophobicContact CG2-CE1 4.07Å; L329-F355 HydrophobicContact CB-CZ 4Å; L329-F355 HydrophobicContact CD1-CE1 4.09Å; L329-F355 HydrophobicContact CD1-CZ 4.23Å; R330-F355 HydrophobicContact CG-CE2 4.08Å; I351-F355 HydrophobicContact CG2-CD2 4.05Å; I351-F355 HydrophobicContact CG2-CE2 3.73Å; I351-F355 VanDerWaalsContact O-CD2 3.3Å; I351-F355 WeakPolarHBondContact O-CD2 3.19Å; I351-F355 PolarHBondContact O-N 3.16Å; K353-F355 PolarHBondContact O-N 3.36Å; F355-A358 PolarHBondContact O-N 2.93Å; F355-V359 WeakPolarHBondContact O-CG2 3.27Å; F355-V359 PolarHBondContact O-N 2.83Å; F355-V359 VanDerWaalsContact O-N 3.14Å
356S91.2Very high87.3Confident53 Ų5364.4 Ų64.437%0.37133%0.326SS..Hα-helixtrans-64.9-43.7178.3-57.30000111.7N352 K353 V354 V359 G360N352-S356 PolarHBondContact O-N 2.98Å; N352-S356 VanDerWaalsContact O-N 3.11Å; N352-S356 PolarHBondContact O-OG 3.12Å; K353-S356 PolarHBondContact O-N 3.45Å; V354-S356 VanDerWaalsContact C-N 3.34Å; S356-V359 PolarHBondContact O-N 2.92Å; S356-G360 PolarHBondContact O-N 3.02Å
357D92.3Very high84.5Confident55 Ų5568.2 Ų68.229%0.29436%0.358SS..Hα-helixtrans-62-45.4176.4-71.4-11.7000109.9K353 V354 V359 G360 H361K353-D357 WeakPolarHBondContact O-CB 3.28Å; K353-D357 PolarHBondContact O-N 3.37Å; V354-D357 PolarHBondContact O-N 3.13Å; D357-V359 PolarHBondContact O-N 2.94Å; D357-G360 WeakPolarHBondContact O-CA 3.22Å; D357-G360 PolarHBondContact O-N 2.68Å; D357-G360 VanDerWaalsContact O-N 3.13Å; D357-H361 PolarHBondContact O-N 3.36Å; D357-H361 PolarHBondContact O-ND1 3.23Å
358A92.9Very high82.3Confident19 Ų1972.5 Ų72.516%0.15738%0.381CS..Hα-helixtrans-59.8-43.5179.700000112.5I287 V354 F355 H361 A362I287-A358 HydrophobicContact CD1-CB 4.43Å; I287-A358 HydrophobicContact CG2-CB 3.75Å; V354-A358 WeakPolarHBondContact O-CB 3.16Å; V354-A358 PolarHBondContact O-N 3.4Å; F355-A358 PolarHBondContact O-N 2.93Å; A358-H361 PolarHBondContact O-N 3.38Å; A358-A362 WeakPolarHBondContact O-CB 3.41Å; A358-A362 PolarHBondContact O-N 2.91Å
359V90.6Very high79.5Confident10 Ų1070.3 Ų70.36%0.06139%0.385CS..Hα-helixtrans-64.4-41.5174.3171.10000111.2L296 S299 L321 F355 S356 D357 A362 R363L296-V359 HydrophobicContact CD2-CG2 4.08Å; S299-V359 WeakPolarHBondContact OG-CG2 3.27Å; L321-V359 HydrophobicContact CD1-CG2 3.82Å; L321-V359 HydrophobicContact CD2-CG2 4.21Å; L321-V359 HydrophobicContact CG-CG2 4.21Å; F355-V359 WeakPolarHBondContact O-CG2 3.27Å; F355-V359 PolarHBondContact O-N 2.83Å; F355-V359 VanDerWaalsContact O-N 3.14Å; S356-V359 PolarHBondContact O-N 2.92Å; D357-V359 PolarHBondContact O-N 2.94Å; V359-A362 PolarHBondContact O-N 2.94Å; V359-R363 WeakPolarHBondContact O-CD 3.33Å; V359-R363 VanDerWaalsContact O-CG 3.29Å; V359-R363 WeakPolarHBondContact O-CG 3.13Å; V359-R363 PolarHBondContact O-N 2.78Å
360G88.6Confident76.6Confident22 Ų2268.6 Ų68.623%0.22739%0.386CS..Hα-helixtrans-58.9-50.1174.600000112.5S356 D357 A362 R363 Q364S356-G360 PolarHBondContact O-N 3.02Å; D357-G360 WeakPolarHBondContact O-CA 3.22Å; D357-G360 PolarHBondContact O-N 2.68Å; D357-G360 VanDerWaalsContact O-N 3.13Å; G360-A362 VanDerWaalsContact C-N 3.34Å; G360-A362 PolarHBondContact O-N 3.35Å; G360-R363 WeakPolarHBondContact O-CB 3.3Å; G360-R363 PolarHBondContact O-N 3.14Å; G360-R363 VanDerWaalsContact O-N 3.13Å; G360-Q364 VanDerWaalsContact C-OE1 3.32Å; G360-Q364 WeakPolarHBondContact O-CB 3.19Å; G360-Q364 WeakPolarHBondContact O-CG 3.45Å; G360-Q364 PolarHBondContact O-N 3.2Å; G360-Q364 PolarHBondContact O-OE1 2.76Å; G360-Q364 VanDerWaalsContact O-OE1 3.14Å
361H89.9Confident73.7Confident133 Ų13376 Ų7662%0.61642%0.417SS*.Hα-helixtrans-62.2-39.7179.9-76.175.7000112.3D357 A358 R363 Q364D357-H361 PolarHBondContact O-N 3.36Å; D357-H361 PolarHBondContact O-ND1 3.23Å; A358-H361 PolarHBondContact O-N 3.38Å; H361-R363 PolarHBondContact O-N 2.93Å; H361-Q364 PolarHBondContact O-N 2.83Å
362A87.4Confident71.1Confident12 Ų1282.8 Ų82.810%0.09945%0.453CS..Hα-helixtrans-63-34.417800000111.8L296 K297 A358 V359 G360L296-A362 HydrophobicContact CB-CB 3.45Å; L296-A362 VanDerWaalsContact CB-CB 3.45Å; L296-A362 HydrophobicContact CD1-CB 4.31Å; K297-A362 WeakPolarHBondContact CE-O 3.49Å; K297-A362 HydrophobicContact CG-CB 3.98Å; K297-A362 WeakPolarHBondContact CG-O 3.16Å; A358-A362 WeakPolarHBondContact O-CB 3.41Å; A358-A362 PolarHBondContact O-N 2.91Å; V359-A362 PolarHBondContact O-N 2.94Å; G360-A362 VanDerWaalsContact C-N 3.34Å; G360-A362 PolarHBondContact O-N 3.35Å
363R83.5Confident68.3Low84 Ų8485 Ų8532%0.31748%0.481SS..Hα-helixtrans-79.1-33.9177.7-68162.6169.3-89.7-9.1113.2K297 S299 R318 V359 G360 H361 G365K297-R363 VanDerWaalsContact O-CZ 3.23Å; K297-R363 PolarHBondContact O-NE 3.17Å; K297-R363 PolarHBondContact O-NH2 3.21Å; S299-R363 PolarHBondContact O-NH2 3.49Å; R318-R363 VanDerWaalsContact CZ-NH1 3.3Å; V359-R363 WeakPolarHBondContact O-CD 3.33Å; V359-R363 VanDerWaalsContact O-CG 3.29Å; V359-R363 WeakPolarHBondContact O-CG 3.13Å; V359-R363 PolarHBondContact O-N 2.78Å; G360-R363 WeakPolarHBondContact O-CB 3.3Å; G360-R363 PolarHBondContact O-N 3.14Å; G360-R363 VanDerWaalsContact O-N 3.13Å; H361-R363 PolarHBondContact O-N 2.93Å; R363-G365 PolarHBondContact O-N 3.38Å
364Q78.8Confident65.3Low136 Ų13685.8 Ų85.864%0.63650%0.501SS*.SBendtrans-78.426.7-178.6-77.8159.9-31.400113.4G360 H361 R366G360-Q364 VanDerWaalsContact C-OE1 3.32Å; G360-Q364 WeakPolarHBondContact O-CB 3.19Å; G360-Q364 WeakPolarHBondContact O-CG 3.45Å; G360-Q364 PolarHBondContact O-N 3.2Å; G360-Q364 PolarHBondContact O-OE1 2.76Å; G360-Q364 VanDerWaalsContact O-OE1 3.14Å; H361-Q364 PolarHBondContact O-N 2.83Å; Q364-R366 PolarHBondContact O-N 3.11Å; Q364-R366 VanDerWaalsContact O-N 3.11Å
365G53.1Low62.3Low54 Ų5492 Ų9256%0.55755%0.545SS*.THydrogen-bonded Turntrans-25.1108.9-171.300000114.1R363 A367R363-G365 PolarHBondContact O-N 3.38Å; G365-A367 PolarHBondContact O-N 3.34Å
366R48.4Very low59.3Low249 Ų24995.3 Ų95.394%0.9458%0.579SS**THydrogen-bonded Turntrans2455.5170.4-134.2-174.6-154.8-159.17115.4Q364 V368Q364-R366 PolarHBondContact O-N 3.11Å; Q364-R366 VanDerWaalsContact O-N 3.11Å; R366-V368 PolarHBondContact O-N 3.12Å; R366-V368 VanDerWaalsContact O-N 3.12Å
367A36.3Very low56.4Low85 Ų8598.8 Ų98.870%0.70260%0.603SS**  trans-73.9101160.700000107.5G365 G369G365-A367 PolarHBondContact O-N 3.34Å; A367-G369 PolarHBondContact O-N 2.93Å
368V47.7Very low53.7Low145 Ų145101.7 Ų101.788%0.87963%0.628SS**  trans-65.885.5150176.40000105R366R366-V368 PolarHBondContact O-N 3.12Å; R366-V368 VanDerWaalsContact O-N 3.12Å
369G32.6Very low50.9Low51 Ų51107.2 Ų107.253%0.52666%0.66SS.*  trans-129.486.9-177.500000108.7A367A367-G369 PolarHBondContact O-N 2.93Å
370T31.9Very low48Very low121 Ų121112.3 Ų112.374%0.74270%0.696SS**  trans30.294.9144.7-12.90000115.9L372T370-L372 HydrophobicContact CG2-CD1 4.21Å; T370-L372 HydrophobicContact CG2-CG 4.01Å; T370-L372 PolarHBondContact O-N 2.91Å
371F34Very low45.1Very low217 Ų217116.5 Ų116.595%0.95272%0.722SS**  trans-6685.7149.5-81-90000107.7
372L38.2Very low42.6Very low151 Ų151116.9 Ų116.979%0.79173%0.728SS**  trans-90118.8149.4-79.1168.5000106.3T370T370-L372 HydrophobicContact CG2-CD1 4.21Å; T370-L372 HydrophobicContact CG2-CG 4.01Å; T370-L372 PolarHBondContact O-N 2.91Å
373G36Very low40.1Very low71 Ų71126.1 Ų126.173%0.73276%0.761SS**  trans-56.3149.1-172.400000113.1
374S29.5Very low37.7Very low131 Ų131129.9 Ų129.992%0.91678%0.784SS**  trans-139.884.1154.6-78.50000107.4
375S32.8Very low35.7Very low133 Ų133131 Ų13193%0.9380%0.795SS**  trans-85124150.3-150.50000105.8
376G30.1Very low34.6Very low70 Ų70130.9 Ų130.972%0.72279%0.794SS**  trans132.5113.3161.200000117.6
377S29.7Very low33.7Very low125 Ų125129 Ų12987%0.87479%0.793SS**  trans80.9108.9142.3-70.50000121.5
378S36Very low33.6Very low116 Ų116132.4 Ų132.481%0.81180%0.8SS**  trans-45.4131.2145.7-43.60000112.9
379T32.9Very low32.8Very low136 Ų136128.5 Ų128.583%0.83479%0.789SS**  trans-174.6125131.144.10000110.2
380S29.6Very low32.7Very low116 Ų116135 Ų13581%0.81181%0.805SS**  trans14.5127140.2169.80000119.3
381S29.1Very low32.7Very low110 Ų110137.2 Ų137.277%0.76981%0.811SS**  176.9137.3109.1-170.60000111.8
382L37.5Very low32.6Very low141 Ų141132.1 Ų132.174%0.73880%0.803SS**  trans-71166.1165.5-68.8159.9000111.2
383Y34.1Very low32.2Very low207 Ų207133 Ų13381%0.81280%0.802SS**  trans117.3128.8153.1-69.8-79.2000118.8
384M34Very low31.9Very low162 Ų162136.8 Ų136.880%0.79881%0.806SS**  trans87.293.9153.1-70.5-65167.500121.3
385D35.5Very low32Very low159 Ų159137.9 Ų137.985%0.8580%0.797SS**  12.2143.8115.1-158.326.5000120.2
386G30Very low32Very low53 Ų53137.6 Ų137.655%0.54678%0.784SS.*  trans120.9116.3144.800000119.3
387F29.5Very low32.1Very low209 Ų209143.7 Ų143.792%0.91779%0.791SS**  trans94.9100.3148.1-70.3-81.8000121.9
388D35.1Very low32.4Very low157 Ų157145 Ų14584%0.8479%0.788SS**  -8.1141.9122.4-158.311.2000117.8
389G29.9Very low32.2Very low63 Ų63149.7 Ų149.765%0.64979%0.794SS**  trans155.686.917000000117.7
390H31.6Very low32.1Very low186 Ų186146.7 Ų146.786%0.86179%0.789SS**  trans58.7121.4137.2-87.8-91.6000122.9
391L30.8Very low32.2Very low168 Ų168146.9 Ų146.988%0.8879%0.789SS**  trans-41.7132.5143.7-63.7156.7000111.8
392S33.4Very low32.6Very low111 Ų111151.2 Ų151.278%0.77680%0.798SS**  -179.5128.5119.3-156.70000112.5
393Q30Very low32.5Very low168 Ų168152.8 Ų152.879%0.78581%0.807SS**  trans-13.2126.7143.8-165.4172.556.500115.7
394D29.6Very low32.4Very low151 Ų151146.6 Ų146.681%0.80781%0.805SS**  -172.2162.2123.2-99.8-27.9000115.3
395E31Very low32.5Very low154 Ų154147.9 Ų147.972%0.7281%0.81SS**  trans-63.7158-155.2-66.3-166.2128.300121.1
396L33.7Very low32.4Very low128 Ų128145.8 Ų145.867%0.6781%0.807SS**  trans34.8128.6130.4-56.6161.3000118.5
397F31.9Very low32.8Very low197 Ų197154.5 Ų154.586%0.86484%0.841SS**  -176.5139.2112.9-105.6-80.5000111.6
398L34.7Very low32.9Very low154 Ų154151.8 Ų151.881%0.80684%0.838SS**  trans-49.5140.3175.3-73.676.2000114
399K33.1Very low32.8Very low214 Ų214151.5 Ų151.593%0.9384%0.837SS**  trans-169.2132.7131.7-148.7128.5176.8-179.70114.1
400G30.2Very low33Very low72 Ų72156.4 Ų156.474%0.74285%0.848SS**  trans114.786.613500000117.9
401C31.6Very low33.1Very low121 Ų121154.6 Ų154.682%0.81885%0.847SS**  trans-54.2145.2157.5-50.20000111.8
402Q37.8Very low33.2Very low201 Ų201153.8 Ų153.894%0.93985%0.845SS**  trans-164.7133.2133.9-108.8165.8102.800113.1
403N34.4Very low33.2Very low174 Ų174156.7 Ų156.793%0.9385%0.85SS**  trans-54.8163.2177.1-78.7-11000115.2
404G31.7Very low33.4Very low76 Ų76155.9 Ų155.978%0.78485%0.854SS**  trans169.5100.4143.900000114.9
405Q36.7Very low33.7Very low190 Ų190156.2 Ų156.289%0.88886%0.858SS**  trans-49.6152.8160-71.4170.6-67.500111.1
406S34.1Very low34Very low115 Ų115156.4 Ų156.480%0.80487%0.869SS**  167.1152.687.5-41.30000104
407D37.8Very low34Very low235 Ų235159 Ų159100%1.25789%0.888SS**  cis-162.7017.7-152.50.7000105.7

Retrieved 407 of 407 residues in 326.1 ms (Link to these results)