A0A077ZD67_TRITR Loading...

Homeobox domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZD67, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 313 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
1M46.6Very low77.4Confident238 Ų238125.7 Ų125.7100%1.17267%0.671SS**  0106.90-65.8-177.7-170.700107.6T3M1-T3 PolarHBondContact O-N 2.63Å
2T59.3Low78.3Confident145 Ų145121.7 Ų121.789%0.8965%0.645SS**  trans-77.5104.2176.646.20000108.5S4T2-S4 PolarHBondContact O-N 3.48Å
3T59.5Low79.4Confident108 Ų108118.6 Ų118.666%0.66363%0.628SS**  trans-73.7104.1173.348.50000108.6M1 F5M1-T3 PolarHBondContact O-N 2.63Å; T3-F5 PolarHBondContact O-N 3.27Å
4S76.3Confident80.1Confident85 Ų85116.1 Ų116.159%0.59462%0.62SS**  trans-68122169.546.40000109.3T2 H6T2-S4 PolarHBondContact O-N 3.48Å; S4-H6 PolarHBondContact OG-NE2 3.21Å; S4-H6 VanDerWaalsContact OG-NE2 3.17Å
5F80.7Confident80.7Confident190 Ų190117.3 Ų117.383%0.83361%0.612SS**  trans-80.7125.5173.1-67.6-79.7000109.2T3T3-F5 PolarHBondContact O-N 3.27Å
6H86.8Confident81.4Confident118 Ų118118.9 Ų118.955%0.54661%0.607SS.*  trans-107.8141.8175.1-61.3-65.4000109.9S4 Q10 V11S4-H6 PolarHBondContact OG-NE2 3.21Å; S4-H6 VanDerWaalsContact OG-NE2 3.17Å; H6-Q10 VanDerWaalsContact CA-OE1 3.29Å; H6-Q10 HydrophobicContact CB-CB 4.42Å; H6-V11 HydrophobicContact CB-CG2 3.91Å
7T90.3Very high82Confident70 Ų70115.5 Ų115.543%0.42959%0.59SS.*  trans-70.3156174.470.80000110.3E9 Q10 V11T7-E9 PolarHBondContact O-N 3.12Å; T7-Q10 WeakPolarHBondContact O-CB 3.42Å; T7-Q10 PolarHBondContact O-N 3.12Å; T7-Q10 VanDerWaalsContact O-N 3.09Å; T7-Q10 VanDerWaalsContact OG1-CG 3.27Å; T7-Q10 WeakPolarHBondContact OG1-CG 3.49Å; T7-Q10 PolarHBondContact OG1-N 3.44Å; T7-Q10 VanDerWaalsContact OG1-N 3.13Å; T7-V11 WeakPolarHBondContact O-CG2 3.32Å; T7-V11 PolarHBondContact O-N 3.16Å
8V84.7Confident82.4Confident124 Ų124120.1 Ų120.175%0.75260%0.599SS**Hα-helixtrans-55.4-38.1174.9178.60000110.7V11 E12V8-V11 PolarHBondContact O-N 3.25Å; V8-E12 WeakPolarHBondContact O-CB 3.45Å; V8-E12 PolarHBondContact O-N 2.94Å
9E88.8Confident82.9Confident156 Ų156122.1 Ų122.173%0.72961%0.606SS**Hα-helixtrans-64.3-42.6177.3-61172.4176.300112.4T7 E12 L13T7-E9 PolarHBondContact O-N 3.12Å; E9-E12 PolarHBondContact O-N 3Å; E9-L13 WeakPolarHBondContact O-CB 2.93Å; E9-L13 PolarHBondContact O-N 3.03Å
10Q89.7Confident83.4Confident94 Ų94121.2 Ų121.244%0.43961%0.608SS.*Hα-helixtrans-63.4-44.3176.2-74.8169.8-17.300111.3H6 T7 L13 V14H6-Q10 VanDerWaalsContact CA-OE1 3.29Å; H6-Q10 HydrophobicContact CB-CB 4.42Å; T7-Q10 WeakPolarHBondContact O-CB 3.42Å; T7-Q10 PolarHBondContact O-N 3.12Å; T7-Q10 VanDerWaalsContact O-N 3.09Å; T7-Q10 VanDerWaalsContact OG1-CG 3.27Å; T7-Q10 WeakPolarHBondContact OG1-CG 3.49Å; T7-Q10 PolarHBondContact OG1-N 3.44Å; T7-Q10 VanDerWaalsContact OG1-N 3.13Å; Q10-L13 PolarHBondContact O-N 3.03Å; Q10-V14 WeakPolarHBondContact O-CG2 3.25Å; Q10-V14 PolarHBondContact O-N 3.28Å; Q10-V14 VanDerWaalsContact O-N 3.08Å
11V88.4Confident83.8Confident55 Ų55118.5 Ų118.533%0.33361%0.611SS.*Hα-helixtrans-64.1-43.1177.9176.30000110.9H6 T7 V8 V14 R15H6-V11 HydrophobicContact CB-CG2 3.91Å; T7-V11 WeakPolarHBondContact O-CG2 3.32Å; T7-V11 PolarHBondContact O-N 3.16Å; V8-V11 PolarHBondContact O-N 3.25Å; V11-V14 PolarHBondContact O-N 2.61Å; V11-R15 WeakPolarHBondContact O-CG 3.15Å; V11-R15 PolarHBondContact O-N 2.71Å
12E89Confident85.9Confident77 Ų77109.7 Ų109.736%0.3657%0.568SS.*Hα-helixtrans-69.6-33.2-179.7-164.156-147.900112.6V8 E9 R15 R16V8-E12 WeakPolarHBondContact O-CB 3.45Å; V8-E12 PolarHBondContact O-N 2.94Å; E9-E12 PolarHBondContact O-N 3Å; E12-R15 PolarHBondContact O-N 2.93Å; E12-R15 IonicContact OE2-CZ 3.63Å; E12-R15 IonicContact OE2-NH1 3.5Å; E12-R15 PolarHBondContact OE2-NH1 3.49Å; E12-R16 WeakPolarHBondContact O-CG 2.86Å; E12-R16 PolarHBondContact O-N 3.3Å
13L92.2Very high87.4Confident82 Ų82105.5 Ų105.543%0.42955%0.545SS..Hα-helixtrans-62-48.3170.5-176.865.7000111.2E9 Q10 R15 R16 L17E9-L13 WeakPolarHBondContact O-CB 2.93Å; E9-L13 PolarHBondContact O-N 3.03Å; Q10-L13 PolarHBondContact O-N 3.03Å; L13-R15 VanDerWaalsContact C-N 3.3Å; L13-R15 PolarHBondContact O-N 3.4Å; L13-R16 PolarHBondContact O-N 3.19Å; L13-L17 HydrophobicContact CG-CD1 4.37Å; L13-L17 WeakPolarHBondContact O-CG 2.88Å; L13-L17 PolarHBondContact O-N 3.4Å
14V89.6Confident88.9Confident83 Ų83107.6 Ų107.650%0.50355%0.551SS.*Hα-helixtrans-62.7-37.7178.1174.20000111.3Q10 V11 L17 R18Q10-V14 WeakPolarHBondContact O-CG2 3.25Å; Q10-V14 PolarHBondContact O-N 3.28Å; Q10-V14 VanDerWaalsContact O-N 3.08Å; V11-V14 PolarHBondContact O-N 2.61Å; V14-L17 PolarHBondContact O-N 3.09Å; V14-R18 WeakPolarHBondContact O-CG 3.36Å; V14-R18 PolarHBondContact O-N 2.96Å
15R89Confident89.6Confident135 Ų135107.9 Ų107.951%0.50955%0.55SS..Hα-helixtrans-60.8-48.4173.3-77.5-175.4-175.2133.2-0.8112.3V11 E12 L13 L17 R18 Q19V11-R15 WeakPolarHBondContact O-CG 3.15Å; V11-R15 PolarHBondContact O-N 2.71Å; E12-R15 PolarHBondContact O-N 2.93Å; E12-R15 IonicContact OE2-CZ 3.63Å; E12-R15 IonicContact OE2-NH1 3.5Å; E12-R15 PolarHBondContact OE2-NH1 3.49Å; L13-R15 VanDerWaalsContact C-N 3.3Å; L13-R15 PolarHBondContact O-N 3.4Å; R15-L17 VanDerWaalsContact C-N 3.33Å; R15-L17 PolarHBondContact O-N 3.05Å; R15-R18 PolarHBondContact O-N 3.49Å; R15-Q19 WeakPolarHBondContact O-CG 3.36Å; R15-Q19 PolarHBondContact O-N 2.8Å; R15-Q19 VanDerWaalsContact O-N 3.08Å
16R91.6Very high90.1Very high142 Ų142100 Ų10054%0.53652%0.519SS..Hα-helixtrans-60.7-42.2177-74.8-173.8-69.6162.1-2.5111.6E12 L13 R18 Q19 T20E12-R16 WeakPolarHBondContact O-CG 2.86Å; E12-R16 PolarHBondContact O-N 3.3Å; L13-R16 PolarHBondContact O-N 3.19Å; R16-R18 PolarHBondContact O-N 3.07Å; R16-Q19 WeakPolarHBondContact O-CB 3.41Å; R16-Q19 PolarHBondContact O-N 2.9Å; R16-T20 WeakPolarHBondContact O-CG2 3.47Å; R16-T20 PolarHBondContact O-N 3.49Å
17L92Very high90.3Very high61 Ų6195.7 Ų95.732%0.31950%0.501SS..Hα-helixtrans-59.4-46.7173.8-72.1172000111.2L13 V14 R15 Q19 T20 I22L13-L17 HydrophobicContact CG-CD1 4.37Å; L13-L17 WeakPolarHBondContact O-CG 2.88Å; L13-L17 PolarHBondContact O-N 3.4Å; V14-L17 PolarHBondContact O-N 3.09Å; R15-L17 VanDerWaalsContact C-N 3.33Å; R15-L17 PolarHBondContact O-N 3.05Å; L17-Q19 PolarHBondContact O-N 3.38Å; L17-T20 PolarHBondContact O-N 3.35Å; L17-T20 PolarHBondContact O-OG1 3.31Å; L17-I22 HydrophobicContact CB-CG2 4.05Å; L17-I22 HydrophobicContact CD2-CG2 4.4Å; L17-I22 WeakPolarHBondContact O-CG2 3.27Å
18R89.5Confident90.4Very high199 Ų19994.6 Ų94.675%0.75150%0.499SS*.Hα-helixtrans-60.4-33.2177.3-73.7-173.270.5-174.61.5113.4V14 R15 R16 T20 G21V14-R18 WeakPolarHBondContact O-CG 3.36Å; V14-R18 PolarHBondContact O-N 2.96Å; R15-R18 PolarHBondContact O-N 3.49Å; R16-R18 PolarHBondContact O-N 3.07Å; R18-T20 VanDerWaalsContact C-N 3.28Å; R18-T20 PolarHBondContact O-N 2.91Å; R18-G21 PolarHBondContact O-N 3.21Å
19Q90.9Very high90.7Very high157 Ų15794.7 Ų94.773%0.73449%0.492SS*.Hα-helixtrans-68.7-24.3177.2-71.8172.9-3.500113.2R15 R16 L17 G21R15-Q19 WeakPolarHBondContact O-CG 3.36Å; R15-Q19 PolarHBondContact O-N 2.8Å; R15-Q19 VanDerWaalsContact O-N 3.08Å; R16-Q19 WeakPolarHBondContact O-CB 3.41Å; R16-Q19 PolarHBondContact O-N 2.9Å; L17-Q19 PolarHBondContact O-N 3.38Å; Q19-G21 PolarHBondContact O-N 2.84Å
20T92.4Very high90.9Very high105 Ų10591 Ų9164%0.64448%0.476SS*.THydrogen-bonded Turntrans-75.5-10.3174.771.50000112.9R16 L17 R18 I22R16-T20 WeakPolarHBondContact O-CG2 3.47Å; R16-T20 PolarHBondContact O-N 3.49Å; L17-T20 PolarHBondContact O-N 3.35Å; L17-T20 PolarHBondContact O-OG1 3.31Å; R18-T20 VanDerWaalsContact C-N 3.28Å; R18-T20 PolarHBondContact O-N 2.91Å; T20-I22 VanDerWaalsContact C-N 3.31Å; T20-I22 PolarHBondContact OG1-N 3.03Å
21G91.8Very high91Very high65 Ų6593.5 Ų93.567%0.6748%0.482SS*.THydrogen-bonded Turntrans80.67.2-175.700000114.3R18 Q19 S23R18-G21 PolarHBondContact O-N 3.21Å; Q19-G21 PolarHBondContact O-N 2.84Å; G21-S23 PolarHBondContact O-N 2.84Å
22I91.6Very high91.1Very high52 Ų5295.3 Ų95.327%0.26749%0.49SS..  trans-63.7131176.5-161.9168000110.6L17 T20 A26 V27 I30L17-I22 HydrophobicContact CB-CG2 4.05Å; L17-I22 HydrophobicContact CD2-CG2 4.4Å; L17-I22 WeakPolarHBondContact O-CG2 3.27Å; T20-I22 VanDerWaalsContact C-N 3.31Å; T20-I22 PolarHBondContact OG1-N 3.03Å; I22-A26 HydrophobicContact CD1-CB 4.2Å; I22-A26 HydrophobicContact CG1-CB 3.67Å; I22-V27 HydrophobicContact CD1-CG2 4.08Å; I22-V27 HydrophobicContact CG1-CG2 4.13Å; I22-V27 HydrophobicContact CG2-CG2 3.75Å; I22-I30 HydrophobicContact CD1-CD1 3.58Å
23S90.9Very high91Very high58 Ų5893.9 Ų93.941%0.40649%0.492SS..  trans-73.8154.8177.367.40000110.9G21 T25 A26 V27G21-S23 PolarHBondContact O-N 2.84Å; S23-T25 PolarHBondContact O-N 2.93Å; S23-T25 PolarHBondContact OG-OG1 3.35Å; S23-A26 PolarHBondContact O-N 3.36Å; S23-A26 VanDerWaalsContact O-N 3.14Å; S23-A26 WeakPolarHBondContact OG-CB 3.29Å; S23-A26 PolarHBondContact OG-N 3.35Å; S23-A26 VanDerWaalsContact OG-N 3.12Å; S23-V27 PolarHBondContact O-N 3.18Å
24L90.6Very high90.7Very high151 Ų15195.8 Ų95.879%0.79150%0.497SS*.Hα-helixtrans-58-34.9173.7-17863.8000111.8V27 A28L24-V27 PolarHBondContact O-N 2.95Å; L24-A28 PolarHBondContact O-N 3.48Å
25T91.4Very high90.5Very high92 Ų9296 Ų9656%0.56450%0.495SS*.Hα-helixtrans-63.4-44.617654.70000111.7S23 V27 A28 E29S23-T25 PolarHBondContact O-N 2.93Å; S23-T25 PolarHBondContact OG-OG1 3.35Å; T25-V27 VanDerWaalsContact C-N 3.34Å; T25-V27 PolarHBondContact O-N 3.14Å; T25-A28 WeakPolarHBondContact O-CB 3.43Å; T25-A28 PolarHBondContact O-N 3.19Å; T25-A28 VanDerWaalsContact O-N 3.16Å; T25-E29 WeakPolarHBondContact O-CG 3.49Å; T25-E29 PolarHBondContact O-N 3.43Å
26A91.1Very high90.3Very high23 Ų2398 Ų9819%0.1950%0.502CS..Hα-helixtrans-65.2-37.1176.800000111.9I22 S23 A28 E29 I30I22-A26 HydrophobicContact CD1-CB 4.2Å; I22-A26 HydrophobicContact CG1-CB 3.67Å; S23-A26 PolarHBondContact O-N 3.36Å; S23-A26 VanDerWaalsContact O-N 3.14Å; S23-A26 WeakPolarHBondContact OG-CB 3.29Å; S23-A26 PolarHBondContact OG-N 3.35Å; S23-A26 VanDerWaalsContact OG-N 3.12Å; A26-A28 VanDerWaalsContact C-N 3.34Å; A26-E29 PolarHBondContact O-N 2.95Å; A26-I30 VanDerWaalsContact O-CG1 3.25Å; A26-I30 WeakPolarHBondContact O-CG1 3.41Å; A26-I30 PolarHBondContact O-N 3.23Å
27V91.2Very high89.8Confident28 Ų2894.7 Ų94.717%0.1750%0.495CS..Hα-helixtrans-61.7-43.8172.5176.20000110.7I22 S23 L24 T25 I30 Y31I22-V27 HydrophobicContact CD1-CG2 4.08Å; I22-V27 HydrophobicContact CG1-CG2 4.13Å; I22-V27 HydrophobicContact CG2-CG2 3.75Å; S23-V27 PolarHBondContact O-N 3.18Å; L24-V27 PolarHBondContact O-N 2.95Å; T25-V27 VanDerWaalsContact C-N 3.34Å; T25-V27 PolarHBondContact O-N 3.14Å; V27-I30 PolarHBondContact O-N 3.47Å; V27-Y31 HydrophobicContact CG1-CD2 3.9Å; V27-Y31 HydrophobicContact CG1-CE2 3.99Å; V27-Y31 WeakPolarHBondContact O-CD2 3.41Å; V27-Y31 PolarHBondContact O-N 3.11Å
28A91.8Very high89.1Confident47 Ų4796.8 Ų96.839%0.38851%0.507SS..Hα-helixtrans-64.7-39.7176.800000112.5L24 T25 A26 I30 Y31 N32L24-A28 PolarHBondContact O-N 3.48Å; T25-A28 WeakPolarHBondContact O-CB 3.43Å; T25-A28 PolarHBondContact O-N 3.19Å; T25-A28 VanDerWaalsContact O-N 3.16Å; A26-A28 VanDerWaalsContact C-N 3.34Å; A28-I30 VanDerWaalsContact C-N 3.35Å; A28-Y31 PolarHBondContact O-N 2.87Å; A28-N32 VanDerWaalsContact O-CG 3.32Å; A28-N32 PolarHBondContact O-N 3.05Å; A28-N32 PolarHBondContact O-ND2 3.38Å; A28-N32 VanDerWaalsContact O-ND2 3.07Å
29E91.7Very high88.5Confident127 Ų12792.8 Ų92.859%0.59350%0.5SS*.Hα-helixtrans-60.7-43.1173.7-73.3167.5-168.700111.8T25 A26 N32 A33T25-E29 WeakPolarHBondContact O-CG 3.49Å; T25-E29 PolarHBondContact O-N 3.43Å; A26-E29 PolarHBondContact O-N 2.95Å; E29-N32 PolarHBondContact O-N 3.44Å; E29-A33 WeakPolarHBondContact O-CB 3.27Å; E29-A33 PolarHBondContact O-N 3.29Å
30I91.6Very high87.8Confident77 Ų7792.7 Ų92.740%0.39550%0.5SS..Hα-helixtrans-62.4-45.3175.4-70.2165.9000110.8I22 A26 V27 A28 A33 F34I22-I30 HydrophobicContact CD1-CD1 3.58Å; A26-I30 VanDerWaalsContact O-CG1 3.25Å; A26-I30 WeakPolarHBondContact O-CG1 3.41Å; A26-I30 PolarHBondContact O-N 3.23Å; V27-I30 PolarHBondContact O-N 3.47Å; A28-I30 VanDerWaalsContact C-N 3.35Å; I30-A33 WeakPolarHBondContact O-CB 3.25Å; I30-A33 PolarHBondContact O-N 3.34Å; I30-A33 VanDerWaalsContact O-N 3.17Å; I30-F34 HydrophobicContact CG2-CD2 3.65Å; I30-F34 HydrophobicContact CG2-CE2 3.5Å; I30-F34 VanDerWaalsContact O-CD2 3.25Å; I30-F34 WeakPolarHBondContact O-CD2 3.5Å; I30-F34 PolarHBondContact O-N 3.49Å
31Y91.7Very high86.7Confident147 Ų14792.4 Ų92.458%0.57649%0.493SS*.Hα-helixtrans-59.6-46.9176.5-95.9-80.2000111.9V27 A28 A33 F34 D35V27-Y31 HydrophobicContact CG1-CD2 3.9Å; V27-Y31 HydrophobicContact CG1-CE2 3.99Å; V27-Y31 WeakPolarHBondContact O-CD2 3.41Å; V27-Y31 PolarHBondContact O-N 3.11Å; A28-Y31 PolarHBondContact O-N 2.87Å; Y31-A33 VanDerWaalsContact C-N 3.26Å; Y31-A33 PolarHBondContact O-N 3.33Å; Y31-F34 WeakPolarHBondContact O-CB 3.42Å; Y31-F34 PolarHBondContact O-N 2.83Å; Y31-F34 VanDerWaalsContact O-N 3.12Å; Y31-D35 PolarHBondContact O-N 2.95Å
32N90.5Very high85Confident93 Ų9397 Ų9750%0.49750%0.498SS..Hα-helixtrans-62.4-33.5175.9-69.7-41.4000112.4A28 E29 R36A28-N32 VanDerWaalsContact O-CG 3.32Å; A28-N32 PolarHBondContact O-N 3.05Å; A28-N32 PolarHBondContact O-ND2 3.38Å; A28-N32 VanDerWaalsContact O-ND2 3.07Å; E29-N32 PolarHBondContact O-N 3.44Å; N32-R36 VanDerWaalsContact O-CG 3.3Å; N32-R36 WeakPolarHBondContact O-CG 3.31Å; N32-R36 PolarHBondContact O-N 3.12Å; N32-R36 VanDerWaalsContact O-N 3.16Å
33A88Confident83.4Confident47 Ų4799.4 Ų99.439%0.38851%0.509SS..Hα-helixtrans-70-36.817500000111.9E29 I30 Y31 R36 L37E29-A33 WeakPolarHBondContact O-CB 3.27Å; E29-A33 PolarHBondContact O-N 3.29Å; I30-A33 WeakPolarHBondContact O-CB 3.25Å; I30-A33 PolarHBondContact O-N 3.34Å; I30-A33 VanDerWaalsContact O-N 3.17Å; Y31-A33 VanDerWaalsContact C-N 3.26Å; Y31-A33 PolarHBondContact O-N 3.33Å; A33-R36 PolarHBondContact O-N 2.82Å; A33-L37 WeakPolarHBondContact O-CG 3.47Å; A33-L37 PolarHBondContact O-N 3.43Å
34F86.2Confident81.2Confident123 Ų123105.4 Ų105.454%0.53953%0.531SS..Hα-helixtrans-63.8-45.5172.3-87.1-70.1000111.9I30 Y31 R36 L37 D38I30-F34 HydrophobicContact CG2-CD2 3.65Å; I30-F34 HydrophobicContact CG2-CE2 3.5Å; I30-F34 VanDerWaalsContact O-CD2 3.25Å; I30-F34 WeakPolarHBondContact O-CD2 3.5Å; I30-F34 PolarHBondContact O-N 3.49Å; Y31-F34 WeakPolarHBondContact O-CB 3.42Å; Y31-F34 PolarHBondContact O-N 2.83Å; Y31-F34 VanDerWaalsContact O-N 3.12Å; F34-R36 VanDerWaalsContact C-N 3.29Å; F34-R36 PolarHBondContact O-N 3.31Å; F34-L37 PolarHBondContact O-N 3.45Å; F34-L37 VanDerWaalsContact O-N 3.09Å; F34-D38 PolarHBondContact O-N 3.02Å
35D85.5Confident79.2Confident86 Ų86105.6 Ų105.646%0.4653%0.526SS..Hα-helixtrans-59.8-41.7178-67.7-24.5000111.1Y31 L37 D38 D39Y31-D35 PolarHBondContact O-N 2.95Å; D35-L37 PolarHBondContact O-N 2.84Å; D35-D38 PolarHBondContact O-N 2.94Å; D35-D39 PolarHBondContact O-N 3.14Å
36R83.6Confident76.5Confident178 Ų178107 Ų10767%0.67254%0.537SS*.Hα-helixtrans-63.3-39.8174.1-71.6173.2-173.8-131.12.5113.1N32 A33 F34 D39 E40N32-R36 VanDerWaalsContact O-CG 3.3Å; N32-R36 WeakPolarHBondContact O-CG 3.31Å; N32-R36 PolarHBondContact O-N 3.12Å; N32-R36 VanDerWaalsContact O-N 3.16Å; A33-R36 PolarHBondContact O-N 2.82Å; F34-R36 VanDerWaalsContact C-N 3.29Å; F34-R36 PolarHBondContact O-N 3.31Å; R36-D39 PolarHBondContact O-N 3.47Å; R36-E40 WeakPolarHBondContact O-CB 3.24Å; R36-E40 WeakPolarHBondContact O-CG 3.3Å; R36-E40 PolarHBondContact O-N 3.37Å
37L81.2Confident74.2Confident72 Ų72112.2 Ų112.238%0.37756%0.561SS.*Hα-helixtrans-68.3-38.1177.2-75.8170.6000111.5A33 F34 D35 D39 E40 L41A33-L37 WeakPolarHBondContact O-CG 3.47Å; A33-L37 PolarHBondContact O-N 3.43Å; F34-L37 PolarHBondContact O-N 3.45Å; F34-L37 VanDerWaalsContact O-N 3.09Å; D35-L37 PolarHBondContact O-N 2.84Å; L37-D39 VanDerWaalsContact C-N 3.34Å; L37-E40 PolarHBondContact O-N 3.16Å; L37-L41 VanDerWaalsContact O-CB 3.24Å; L37-L41 WeakPolarHBondContact O-CB 3.29Å; L37-L41 VanDerWaalsContact O-CG 3.27Å; L37-L41 WeakPolarHBondContact O-CG 3.48Å; L37-L41 PolarHBondContact O-N 3.34Å
38D77.9Confident71.5Confident106 Ų106116 Ų11657%0.56759%0.586SS**Hα-helixtrans-66.3-38.1175.2-77.7-16.9000111F34 D35 H42F34-D38 PolarHBondContact O-N 3.02Å; D35-D38 PolarHBondContact O-N 2.94Å; D38-H42 PolarHBondContact O-N 2.96Å
39D77.3Confident68.8Low115 Ų115125.8 Ų125.862%0.61561%0.613SS**Hα-helixtrans-64.4-46.3171.9-74-23.1000112D35 R36 L37 H42D35-D39 PolarHBondContact O-N 3.14Å; R36-D39 PolarHBondContact O-N 3.47Å; L37-D39 VanDerWaalsContact C-N 3.34Å; D39-H42 PolarHBondContact O-N 3.27Å; D39-H42 PolarHBondContact O-ND1 3.25Å
40E75.7Confident66Low155 Ų155124.4 Ų124.472%0.72462%0.617SS**Hα-helixtrans-68.3-36.3179.9-80.1178.8-169.400113.1R36 L37 H42R36-E40 WeakPolarHBondContact O-CB 3.24Å; R36-E40 WeakPolarHBondContact O-CG 3.3Å; R36-E40 PolarHBondContact O-N 3.37Å; L37-E40 PolarHBondContact O-N 3.16Å; E40-H42 VanDerWaalsContact C-N 3.3Å; E40-H42 PolarHBondContact O-N 3.03Å
41L68.9Low63.1Low98 Ų98128.6 Ų128.651%0.51364%0.64SS.*Hα-helixtrans-80.6-9.9-178.1-71.9172000113.2L37 I43L37-L41 VanDerWaalsContact O-CB 3.24Å; L37-L41 WeakPolarHBondContact O-CB 3.29Å; L37-L41 VanDerWaalsContact O-CG 3.27Å; L37-L41 WeakPolarHBondContact O-CG 3.48Å; L37-L41 PolarHBondContact O-N 3.34Å; L41-I43 HydrophobicContact CB-CD1 4.22Å; L41-I43 HydrophobicContact CB-CG1 3.87Å; L41-I43 VanDerWaalsContact O-CG1 3.28Å; L41-I43 WeakPolarHBondContact O-CG1 3.44Å; L41-I43 PolarHBondContact O-N 2.87Å
42H56.8Low60.7Low163 Ų163128.7 Ų128.776%0.75565%0.649SS**THydrogen-bonded Turntrans32.646.5178.7-93.6-25.4000113D38 D39 E40 E44D38-H42 PolarHBondContact O-N 2.96Å; D39-H42 PolarHBondContact O-N 3.27Å; D39-H42 PolarHBondContact O-ND1 3.25Å; E40-H42 VanDerWaalsContact C-N 3.3Å; E40-H42 PolarHBondContact O-N 3.03Å; H42-E44 VanDerWaalsContact C-N 3.33Å; H42-E44 PolarHBondContact O-N 3.2Å
43I58Low58.1Low101 Ų101132.3 Ų132.352%0.51866%0.663SS.*  trans-82.892.9175.5-45.4-176.6000105.4L41 F45L41-I43 HydrophobicContact CB-CD1 4.22Å; L41-I43 HydrophobicContact CB-CG1 3.87Å; L41-I43 VanDerWaalsContact O-CG1 3.28Å; L41-I43 WeakPolarHBondContact O-CG1 3.44Å; L41-I43 PolarHBondContact O-N 2.87Å; I43-F45 HydrophobicContact CB-CD2 4.18Å; I43-F45 HydrophobicContact CG2-CD2 3.11Å; I43-F45 HydrophobicContact CG2-CE2 3.2Å; I43-F45 HydrophobicContact CG2-CG 4.05Å; I43-F45 HydrophobicContact CG2-CZ 4.19Å; I43-F45 PolarHBondContact O-N 2.81Å
44E44.5Very low55.9Low184 Ų184137.7 Ų137.786%0.8668%0.68SS**  trans-61.578.1166.1-71.1-162.9167.500109.5H42 P46H42-E44 VanDerWaalsContact C-N 3.33Å; H42-E44 PolarHBondContact O-N 3.2Å; E44-P46 WeakPolarHBondContact O-CD 3.26Å
45F48.1Very low53.7Low155 Ų155136.5 Ų136.568%0.6868%0.684SS**  trans-99.3106.1159.3-81.5-60.2000107.5I43 L47I43-F45 HydrophobicContact CB-CD2 4.18Å; I43-F45 HydrophobicContact CG2-CD2 3.11Å; I43-F45 HydrophobicContact CG2-CE2 3.2Å; I43-F45 HydrophobicContact CG2-CG 4.05Å; I43-F45 HydrophobicContact CG2-CZ 4.19Å; I43-F45 PolarHBondContact O-N 2.81Å; F45-L47 HydrophobicContact CB-CG 4.33Å; F45-L47 PolarHBondContact O-N 2.72Å
46P36.3Very low51.4Low122 Ų122140.4 Ų140.479%0.79270%0.698SS**  trans-68.790.8165.827.9-29.4000107.1E44 P48E44-P46 WeakPolarHBondContact O-CD 3.26Å; P46-P48 WeakPolarHBondContact O-CD 3.47Å
47L43Very low49.2Very low132 Ų132138.8 Ų138.869%0.69170%0.702SS**  trans-82118.3170-69.1-176.9000108.8F45 R49F45-L47 HydrophobicContact CB-CG 4.33Å; F45-L47 PolarHBondContact O-N 2.72Å; L47-R49 PolarHBondContact O-N 3.31Å
48P34.1Very low47.5Very low108 Ų108145.6 Ų145.670%0.70172%0.724SS**  trans-61.5122.3168.7-14.529000108.5P46 S50P46-P48 WeakPolarHBondContact O-CD 3.47Å; P48-S50 PolarHBondContact O-N 3.39Å
49R34.6Very low45.7Very low253 Ų253149.5 Ų149.596%0.95574%0.737SS**SBendtrans-65.680.9167.6-68.7178.9173.3-177.2-2.4109.2L47L47-R49 PolarHBondContact O-N 3.31Å
50S32.5Very low44.2Very low97 Ų97150.1 Ų150.168%0.67874%0.744SS**SBendtrans178.6131.4156.936.20000111.3P48P48-S50 PolarHBondContact O-N 3.39Å
51N31.2Very low42.5Very low166 Ų166148.5 Ų148.589%0.88875%0.748SS**  trans66.382.9172.5-77.6-7.3000117.7
52I40.6Very low40.9Very low149 Ų149155 Ų15576%0.76477%0.765SS**  trans-105.897.4156.8-59.5174.6000107.7
53Q37.1Very low40Very low168 Ų168154.6 Ų154.679%0.78577%0.768SS**  trans-94.9128.6154-144.2157.82.500104.5
54H41.6Very low38.8Very low160 Ų160153.4 Ų153.474%0.74178%0.781SS**  trans93.2110.9176.6-48.7-67.2000117.2
55P39.6Very low38.4Very low98 Ų98154.1 Ų154.164%0.63678%0.782SS**  trans-88.1154.6164.333.6-26.2000110.9
56F36.5Very low37.6Very low169 Ų169156.2 Ų156.274%0.74179%0.793SS**  trans8675.9168.4-45.9-72000117.6
57D38.1Very low37.9Very low144 Ų144157.9 Ų157.977%0.7779%0.794SS**  trans-133.1104.5145.2-90.3-39.3000109F59D57-F59 HydrophobicContact CB-CE2 4.26Å; D57-F59 PolarHBondContact O-N 3.45Å; D57-F59 VanDerWaalsContact O-N 3.07Å
58Y44.5Very low37.3Very low214 Ų214160.4 Ų160.484%0.83980%0.802SS**  trans-69.499.8170.3-77-88.1000108.7V60Y58-V60 PolarHBondContact O-N 3.45Å
59F41.8Very low37.7Very low189 Ų189160.1 Ų160.183%0.82980%0.799SS**  trans-71.7114165.8-75.7-84.8000109.4D57 P61D57-F59 HydrophobicContact CB-CE2 4.26Å; D57-F59 PolarHBondContact O-N 3.45Å; D57-F59 VanDerWaalsContact O-N 3.07Å; F59-P61 WeakPolarHBondContact O-CD 3.28Å
60V44.1Very low37.7Very low127 Ų127156.1 Ų156.177%0.7780%0.795SS**  trans-80120.9168.5177.80000108.2Y58 R62Y58-V60 PolarHBondContact O-N 3.45Å; V60-R62 PolarHBondContact O-N 3.35Å; V60-R62 VanDerWaalsContact O-N 3.15Å
61P41.8Very low37.9Very low122 Ų122156.1 Ų156.179%0.79279%0.793SS**  trans-67.3113.9176.2-1932.1000110.8F59 N63F59-P61 WeakPolarHBondContact O-CD 3.28Å; P61-N63 PolarHBondContact O-N 3.38Å
62R33.5Very low38.1Very low234 Ų234154 Ų15488%0.88379%0.786SS**  trans-81.193.6164.6-178.4-177.4-174.4171.81107V60V60-R62 PolarHBondContact O-N 3.35Å; V60-R62 VanDerWaalsContact O-N 3.15Å
63N38.9Very low37.8Very low154 Ų154153.1 Ų153.182%0.82479%0.787SS**  trans-174.9126.7144.2-90.4-16.8000110P61 K65P61-N63 PolarHBondContact O-N 3.38Å; N63-K65 PolarHBondContact O-N 3.45Å
64G31.9Very low37.9Very low76 Ų76152.1 Ų152.178%0.78479%0.786SS**  trans-68.4123.7177.300000110.9
65K37.9Very low37.5Very low200 Ų200152.9 Ų152.987%0.8779%0.79SS**  trans-167.3127.1146.1-100.7163-172.6-169.70107.1N63N63-K65 PolarHBondContact O-N 3.45Å
66E31Very low37.5Very low198 Ų198156.7 Ų156.793%0.92580%0.799SS**  trans-62.7125.1-176.3-64.3166.9150.300110.6
67I41.2Very low37.5Very low157 Ų157155.1 Ų155.181%0.80580%0.803SS**  trans-139.1121.2156.7-56.5-177.5000107.4
68E31.3Very low37.3Very low185 Ų185153.4 Ų153.486%0.86480%0.803SS**  trans-76.3119.3178.8-60.9176.8147.200110.4
69T41.3Very low36.9Very low103 Ų103150.8 Ų150.863%0.63280%0.803SS**  trans-146.7142.4162.448.90000112.3
70L34.6Very low36.4Very low169 Ų169152.5 Ų152.589%0.88580%0.804SS**PPolyproline II helixtrans-77.1154-158.6-61157.9000114.5
71P38.3Very low36Very low97 Ų97152.9 Ų152.963%0.6381%0.807SS**PPolyproline II helixtrans-90.8123.7178.433.9-28.7000112.9
72V35Very low35.5Very low122 Ų122155 Ų15574%0.73981%0.812SS**PPolyproline II helixtrans-73130.5164.5168.90000109.8
73V33.8Very low35.5Very low130 Ų130149.7 Ų149.779%0.78881%0.811SS**PPolyproline II helixtrans-90.9124.5-179.8174.90000109.8
74I40.2Very low35.1Very low147 Ų147147.5 Ų147.575%0.75481%0.807SS**  trans-118.4113.5166.4-58.9178.7000108.5
75Q33.1Very low35.3Very low176 Ų176151 Ų15182%0.82281%0.813SS**  trans-88.3119.8-179.3-167.8173.616.400109.2
76Q40Very low34.8Very low177 Ų177147.4 Ų147.483%0.82781%0.813SS**  trans-108.2123169.6-76.7-171.8-11.400110.6
77T36.1Very low34.9Very low137 Ų137142.2 Ų142.284%0.8480%0.804SS**  trans-72.6131.1178.643.80000110.8
78S32.5Very low34.5Very low108 Ų108140.2 Ų140.276%0.75580%0.804SS**  trans-75.9141.7176.8-46.90000111.8
79N36.4Very low34.3Very low158 Ų158137 Ų13785%0.84580%0.802SS**  trans-154.2105.9148.3-92.8-24.3000111.6
80R32.5Very low34Very low225 Ų225139.1 Ų139.185%0.84982%0.815SS**  trans31.2129.9139.3-69.9173.9148.1-163.1-5.7119.8
81T34Very low33.8Very low136 Ų136139.8 Ų139.883%0.83481%0.814SS**  -179.3135.188.937.90000112.1
82N32.5Very low33.4Very low166 Ų166140.4 Ų140.489%0.88882%0.82SS**  trans-71.8149.5173.4-66.7-20.1000112.4
83S34.3Very low33.3Very low123 Ų123140.9 Ų140.986%0.8682%0.823SS**  trans-151.2124.1144.942.50000110.8
84S29.9Very low33Very low108 Ų108140.5 Ų140.576%0.75582%0.821SS**  trans-104.4138.8177.848.80000109.4
85T34.7Very low32.6Very low149 Ų149139.2 Ų139.291%0.91482%0.822SS**  trans-144.1120.5161.746.30000111
86S27.6Very low32.5Very low124 Ų124136.8 Ų136.887%0.86782%0.819SS**  trans-106.3136.3169.5-43.40000108.6
87A34.3Very low32.3Very low89 Ų89135.9 Ų135.974%0.73682%0.82SS**  trans-167.710516100000107.2
88S31.4Very low32Very low115 Ų115139.8 Ų139.880%0.80482%0.819SS**  70.3117.183.974.60000115.3
89S27.1Very low32.1Very low118 Ų118141.9 Ų141.983%0.82582%0.822SS**  trans-18140.7165.2-49.30000119.8
90V36.3Very low31.7Very low147 Ų147137.9 Ų137.989%0.89182%0.818SS**  trans-155.3152.2137.6-84.10000111.2
91E30.3Very low31.7Very low184 Ų184132 Ų13286%0.8681%0.811SS**  trans-65.8159.6-170.5-81.1154.8118.500117.7
92S28.4Very low31.4Very low110 Ų110131.8 Ų131.877%0.76981%0.81SS**  trans52.5116.9135.7-165.20000119.6
93V33.9Very low31.4Very low132 Ų132134 Ų13480%0.881%0.806SS**  -166.8125.4119170.10000108.2
94V26.9Very low31.2Very low122 Ų122136.5 Ų136.574%0.73980%0.804SS**  trans-91.6145.8165.4173.70000108.9
95P32.3Very low31.3Very low120 Ų120138.9 Ų138.978%0.77981%0.805SS**  trans-123.4128.7142.5172.5000112.2
96T30.8Very low31.2Very low124 Ų124137.1 Ų137.176%0.76180%0.796SS**  trans-73.1139.9172-49.40000111.1
97D35.8Very low31.2Very low159 Ų159140.6 Ų140.685%0.8579%0.791SS**  trans-138.392.6160-128.9-3.8000106.6
98R31Very low31.3Very low218 Ų218142.8 Ų142.882%0.82380%0.796SS**  37.182.193.8-157.5178.1-173.9177.42115
99N34.6Very low31.1Very low152 Ų152144.7 Ų144.781%0.81379%0.792SS**  -176.9126.1125-93.1-12.1000111.6
100G27.1Very low31.2Very low74 Ų74144.4 Ų144.476%0.76379%0.79SS**  trans-74.4141.3175.600000112.4
101S32.8Very low31.3Very low101 Ų101143.3 Ų143.371%0.70679%0.785SS**  trans-155.9107.1145.4-870000109W103S101-W103 PolarHBondContact O-N 3.37Å
102V28.3Very low31.3Very low132 Ų132140.7 Ų140.780%0.878%0.782SS**  trans-67.3117167.5170.80000107.5Q104V102-Q104 HydrophobicContact CG1-CG 4.3Å
103W32.6Very low31.3Very low214 Ų214142.7 Ų142.781%0.81178%0.783SS**  trans-94.796166.6-72.399.2000109.1S101S101-W103 PolarHBondContact O-N 3.37Å
104Q29.6Very low31.3Very low174 Ų174142.8 Ų142.881%0.81378%0.779SS**PPolyproline II helixtrans-63127.2160.2-80172.4-42.200108.8V102V102-Q104 HydrophobicContact CG1-CG 4.3Å
105M30.6Very low31.8Very low158 Ų158147.4 Ų147.478%0.77878%0.783SS**PPolyproline II helixtrans-95128.1170-81.2-74.1126.300109.6
106P33.5Very low31.6Very low112 Ų112149.8 Ų149.873%0.72779%0.789SS**PPolyproline II helixtrans-80.2136.2176.131.3-30.6000111
107Y26.8Very low32Very low197 Ų197153.4 Ų153.477%0.77379%0.794SS**PPolyproline II helixtrans-88.1120.7173.8-166.6-96.3000108.6Q109Y107-Q109 HydrophobicContact CD1-CG 4.5Å; Y107-Q109 HydrophobicContact CE1-CG 3.77Å
108V36.7Very low32.1Very low136 Ų136154.6 Ų154.682%0.82480%0.797SS**  trans-139.4115.3165.5-168.50000109.3
109Q28.8Very low32.6Very low155 Ų155153.4 Ų153.472%0.72480%0.797SS**  trans-68.7143169.5-72.5163.7-61.200110.3Y107Y107-Q109 HydrophobicContact CD1-CG 4.5Å; Y107-Q109 HydrophobicContact CE1-CG 3.77Å
110S29.4Very low32.7Very low111 Ų111153.7 Ų153.778%0.77680%0.799SS**  trans-149.9132155.1-168.40000111.6
111P37.2Very low33.4Very low124 Ų124153.3 Ų153.381%0.80580%0.795SS**  trans-83.6161.3178.534.2-32.9000113.2
112V30.4Very low33.7Very low129 Ų129157 Ų15778%0.78281%0.807SS**  trans-89150-171.1171.60000112.3
113L29.4Very low34.3Very low153 Ų153154.2 Ų154.280%0.80181%0.805SS**  trans80.7117.6158-119.767.1000119
114D33.8Very low34.9Very low134 Ų134149.7 Ų149.772%0.71780%0.803SS**  -164.3144.5108.1-127.9-20.3000115.6
115R35.9Very low35.3Very low219 Ų219147.9 Ų147.983%0.82680%0.799SS**  trans67.4110.6149.4-84.8164.6-166-108.3-2.1125.2
116L29.6Very low35.5Very low170 Ų170147.5 Ų147.589%0.8980%0.798SS**  trans-49.7137143.9-68.1154.6000114.2
117K38.7Very low35.7Very low200 Ų200148.6 Ų148.687%0.8780%0.802SS**  trans-172.5109.5132.8-118.3177.1171.4-179.20113.9
118M38.3Very low36Very low184 Ų184145.1 Ų145.191%0.90681%0.807SS**  trans17135.4135.6-55.4-108.7147.200119.9
119K41.1Very low35.9Very low193 Ų193141.8 Ų141.884%0.83980%0.801SS**  168.4119.2104.4-172.2156.7177.1175.20114.7
120N37.3Very low36.2Very low158 Ų158143.6 Ų143.685%0.84581%0.809SS**  trans28.5139.8146.3-69.65.6000124.4
121G39.9Very low36.1Very low66 Ų66145.4 Ų145.468%0.6882%0.82SS**  159.2108.4129.500000118.4
122N39.6Very low36Very low179 Ų179150.8 Ų150.896%0.95782%0.824SS**  trans63.2139.2153.2-64.912.7000119.9
123G41.1Very low36Very low73 Ų73148.9 Ų148.975%0.75382%0.822SS**  cis168.8163.97.400000108.4
124P45.5Very low36.2Very low118 Ų118147.5 Ų147.577%0.76682%0.82SS**  trans-115.8165.4-147.339.9-30.1000116.9
125N37.7Very low36.2Very low137 Ų137146 Ų14673%0.73383%0.826SS**  trans153.5110.7140.3-87.7-46.9000111.9
126I35.1Very low36.1Very low149 Ų149141.4 Ų141.476%0.76482%0.822SS**  55.6108.3101.4-56.3175.3000114
127V37.6Very low36.2Very low135 Ų135139.4 Ų139.482%0.81881%0.812SS**  -173.3126.9125160.10000109.9
128S33Very low36.1Very low124 Ų124137.1 Ų137.187%0.86781%0.808SS**  trans-2134.4154.3-114.10000120.2
129G33.9Very low35.7Very low67 Ų67131.8 Ų131.869%0.69179%0.789SS**  trans154.1113.4154.100000114.5
130E35.6Very low35.4Very low193 Ų193130.5 Ų130.590%0.90279%0.791SS**  trans7091.9155.1-60.5179.6124.900118.1R132E130-R132 PolarHBondContact O-N 3.38Å
131C28.2Very low35.3Very low148 Ų148133.2 Ų133.2100%179%0.789SS**  trans-66.493.6161.3-64.50000110.3
132R34.8Very low35.1Very low237 Ų237137.5 Ų137.589%0.89479%0.792SS**  trans-129.7139.2161.3-160.6172.2173.3165.1-1.9108.3E130E130-R132 PolarHBondContact O-N 3.38Å
133A29.4Very low34.8Very low90 Ų90137.8 Ų137.874%0.74479%0.787SS**  trans82133.8-171.600000112.9
134V33.4Very low34.7Very low124 Ų124145 Ų14575%0.75279%0.792SS**  cis-152.1133.547.2-76.10000109.7V136V134-V136 PolarHBondContact O-N 2.93Å
135A33.5Very low34.5Very low103 Ų103148.9 Ų148.985%0.85179%0.791SS**  trans-60.4112160.700000106.6D137A135-D137 VanDerWaalsContact C-N 3.33Å; A135-D137 PolarHBondContact O-N 3.47Å
136V34.6Very low34.9Very low121 Ų121150.2 Ų150.273%0.73379%0.793SS**  trans-62.5100.7168.4-94.90000106.7V134 L138V134-V136 PolarHBondContact O-N 2.93Å; V136-L138 PolarHBondContact O-N 3.24Å
137D32.6Very low35.6Very low129 Ų129145.7 Ų145.769%0.6977%0.773SS**  trans-53.3104.5167.4175.924.8000107.3A135 S139A135-D137 VanDerWaalsContact C-N 3.33Å; A135-D137 PolarHBondContact O-N 3.47Å; D137-S139 PolarHBondContact O-N 3.34Å; D137-S139 PolarHBondContact OD1-N 3.4Å; D137-S139 PolarHBondContact OD1-OG 2.97Å; D137-S139 WeakPolarHBondContact OD2-CB 3.45Å; D137-S139 PolarHBondContact OD2-OG 3.37Å; D137-S139 VanDerWaalsContact OD2-OG 3.13Å
138L35.1Very low36.4Very low151 Ų151146.6 Ų146.679%0.79176%0.763SS**  trans-75.345.5174.8-137.383000109.4V136 L140V136-L138 PolarHBondContact O-N 3.24Å; L138-L140 PolarHBondContact O-N 3.23Å
139S31.4Very low37.3Very low72 Ų72145.1 Ų145.150%0.50375%0.75SS.*  trans-76.359.9163.2-80.60000109.5D137 R141D137-S139 PolarHBondContact O-N 3.34Å; D137-S139 PolarHBondContact OD1-N 3.4Å; D137-S139 PolarHBondContact OD1-OG 2.97Å; D137-S139 WeakPolarHBondContact OD2-CB 3.45Å; D137-S139 PolarHBondContact OD2-OG 3.37Å; D137-S139 VanDerWaalsContact OD2-OG 3.13Å; S139-R141 PolarHBondContact O-N 3.47Å
140L34Very low38.6Very low166 Ų166143.9 Ų143.987%0.86973%0.726SS**  trans-7359.9144.5-99.8154.7000107.2L138 Q142L138-L140 PolarHBondContact O-N 3.23Å; L140-Q142 PolarHBondContact O-N 3.34Å
141R34.2Very low39.8Very low216 Ų216141.9 Ų141.982%0.81572%0.717SS**  trans-75.581.5175.7-164.6-177.6-177.6-171.62.3106.1S139 E143S139-R141 PolarHBondContact O-N 3.47Å; R141-E143 PolarHBondContact O-N 3.04Å; R141-E143 VanDerWaalsContact O-N 3.09Å
142Q37.6Very low41.4Very low156 Ų156136.2 Ų136.273%0.72968%0.676SS**  trans42.366.5143.7-163.2166.3-18.500112.4L140 R144L140-Q142 PolarHBondContact O-N 3.34Å; Q142-R144 PolarHBondContact O-N 3.03Å
143E33.3Very low42.7Very low185 Ų185133.6 Ų133.686%0.86467%0.674SS**  trans-43.5111.4167.9-100.9-77.9155.500107.4R141 R145R141-E143 PolarHBondContact O-N 3.04Å; R141-E143 VanDerWaalsContact O-N 3.09Å; E143-R145 PolarHBondContact O-N 3.47Å
144R37.1Very low44.7Very low224 Ų224132.8 Ų132.885%0.84566%0.66SS**  trans-62.6107.6-171-74.9-170.4-166.8109.3-3.9107.8Q142 Q146Q142-R144 PolarHBondContact O-N 3.03Å; R144-Q146 PolarHBondContact O-N 2.92Å
145R42.2Very low46.6Very low200 Ų200130.9 Ų130.976%0.75566%0.657SS**  trans-15.3101152.1-59.5-174.1178.4164.21.2111.1E143 P147E143-R145 PolarHBondContact O-N 3.47Å; R145-P147 VanDerWaalsContact O-CD 3.25Å; R145-P147 WeakPolarHBondContact O-CD 3.34Å
146Q45.4Very low48.6Very low165 Ų165132.9 Ų132.977%0.77165%0.649SS**  trans-83.9106.6153.4-81.1-69.3-400105.5R144 Y148R144-Q146 PolarHBondContact O-N 2.92Å; Q146-Y148 PolarHBondContact O-N 2.93Å
147P51Low50.7Low54 Ų54127.9 Ų127.935%0.35162%0.618SS.*  trans-56131.5162.1-16.532.6000106.8R145 P149R145-P147 VanDerWaalsContact O-CD 3.25Å; R145-P147 WeakPolarHBondContact O-CD 3.34Å; P147-P149 WeakPolarHBondContact O-CD 3.45Å; P147-P149 VanDerWaalsContact O-N 3.17Å
148Y53.6Low52.8Low153 Ų153126.1 Ų126.160%0.661%0.605SS**  trans-70.2105.4158.2-85.4-93.8000105.2Q146 F150Q146-Y148 PolarHBondContact O-N 2.93Å; Y148-F150 VanDerWaalsContact C-N 3.34Å; Y148-F150 PolarHBondContact O-N 3.41Å
149P52.7Low54.9Low93 Ų93124.2 Ų124.260%0.60459%0.592SS**  trans-72.3101.9175.129.2-21.6000105.4P147 Q151P147-P149 WeakPolarHBondContact O-CD 3.45Å; P147-P149 VanDerWaalsContact O-N 3.17Å; P149-Q151 PolarHBondContact O-N 3.33Å
150F61.1Low57.3Low42 Ų42123.2 Ų123.218%0.18458%0.58CS.*  trans-58.7108.7166.7-71.4-83.2000107.1Y148 M193 T222 V226 F227 F237Y148-F150 VanDerWaalsContact C-N 3.34Å; Y148-F150 PolarHBondContact O-N 3.41Å; F150-M193 WeakPolarHBondContact CD2-O 3.44Å; F150-M193 HydrophobicContact CE2-CB 3.75Å; F150-M193 HydrophobicContact CE2-CG 4.48Å; F150-M193 WeakPolarHBondContact CE2-O 3.31Å; F150-M193 HydrophobicContact CZ-CB 4.31Å; F150-T222 HydrophobicContact CB-CG2 4.38Å; F150-T222 WeakPolarHBondContact O-CG2 3.43Å; F150-V226 HydrophobicContact CD1-CG1 3.91Å; F150-V226 HydrophobicContact CE1-CG1 4.31Å; F150-F227 HydrophobicContact CD1-CE2 4.44Å; F150-F227 AromaticContact CE1-CE2 3.78Å; F150-F227 HydrophobicContact CE1-CE2 3.78Å; F150-F227 HydrophobicContact CE1-CZ 4.24Å; F150-F227 HydrophobicContact CE2-CE2 4.11Å; F150-F227 AromaticContact CZ-CE2 3.57Å; F150-F227 HydrophobicContact CZ-CE2 3.57Å; F150-F227 AromaticContact CZ-CZ 3.84Å; F150-F227 HydrophobicContact CZ-CZ 3.84Å; F150-F237 AromaticContact CE1-CE2 3.94Å; F150-F237 HydrophobicContact CE1-CE2 3.94Å; F150-F237 HydrophobicContact CE1-CZ 4.04Å; F150-F237 HydrophobicContact CE2-CZ 4.46Å; F150-F237 HydrophobicContact CZ-CD2 4.48Å; F150-F237 HydrophobicContact CZ-CE1 4.32Å; F150-F237 AromaticContact CZ-CE2 3.54Å; F150-F237 HydrophobicContact CZ-CE2 3.54Å; F150-F237 AromaticContact CZ-CZ 3.46Å; F150-F237 HydrophobicContact CZ-CZ 3.46Å; F150-F237 VanDerWaalsContact CZ-CZ 3.46Å
151Q60.1Low59.6Low151 Ų151115.9 Ų115.971%0.70654%0.541SS*.  trans-92.4134.3166.4-73174.8-24.300106.6P149 Q153P149-Q151 PolarHBondContact O-N 3.33Å; Q151-Q153 WeakPolarHBondContact O-CG 3.33Å; Q151-Q153 PolarHBondContact O-N 3.47Å
152L62.3Low61.8Low29 Ų29110.6 Ų110.615%0.15253%0.526CS..  trans-61.1118.9169.5-63.7165.5000106.5Q157 L161 T222 I225 V226L152-Q157 HydrophobicContact CB-CB 4.03Å; L152-Q157 HydrophobicContact CD2-CB 3.71Å; L152-Q157 HydrophobicContact CG-CB 4.36Å; L152-L161 HydrophobicContact CD1-CB 3.96Å; L152-L161 HydrophobicContact CD1-CD2 3.59Å; L152-L161 HydrophobicContact CD1-CG 4.35Å; L152-T222 HydrophobicContact CD1-CG2 4.36Å; L152-T222 HydrophobicContact CD2-CG2 3.9Å; L152-T222 HydrophobicContact CG-CG2 3.81Å; L152-I225 HydrophobicContact CD2-CB 4.23Å; L152-I225 HydrophobicContact CD2-CD1 4.47Å; L152-I225 HydrophobicContact CD2-CG2 4.04Å; L152-V226 HydrophobicContact CD2-CG2 3.88Å
153Q61.5Low64Low181 Ų181107.6 Ų107.685%0.84651%0.512SS*.  trans-88.2-24.1-170.4-64.1-175-0.600111.6Q151Q151-Q153 WeakPolarHBondContact O-CG 3.33Å; Q151-Q153 PolarHBondContact O-N 3.47Å
154T71.1Confident66.2Low74 Ų7499.1 Ų99.145%0.45447%0.473SS..SBendtrans-114.3143.1-174.4-44.80000110.8E156 Q157 Q158T154-E156 HydrophobicContact CG2-CB 3.94Å; T154-E156 PolarHBondContact O-N 2.75Å; T154-Q157 WeakPolarHBondContact O-CB 3.48Å; T154-Q157 PolarHBondContact O-N 2.97Å; T154-Q158 PolarHBondContact O-N 3.43Å
155A73.3Confident68.3Low84 Ų8492.9 Ų92.969%0.69445%0.452SS*.Hα-helixtrans-55.8-36.1174.100000112.2Q157 Q158 E159A155-Q157 VanDerWaalsContact C-N 3.34Å; A155-Q157 PolarHBondContact O-N 2.85Å; A155-Q158 WeakPolarHBondContact O-CB 3.43Å; A155-Q158 PolarHBondContact O-N 3.25Å; A155-E159 PolarHBondContact O-N 3.46Å
156E76.2Confident70.1Confident145 Ų14591.7 Ų91.768%0.67845%0.452SS*.Hα-helixtrans-58.8-40.9174.3-172.7178.2-171.900112.6T154 Q158 E159 E160T154-E156 HydrophobicContact CG2-CB 3.94Å; T154-E156 PolarHBondContact O-N 2.75Å; E156-Q158 VanDerWaalsContact C-N 3.33Å; E156-Q158 PolarHBondContact O-N 3.12Å; E156-E159 PolarHBondContact O-N 3.44Å; E156-E160 WeakPolarHBondContact O-CB 3.39Å; E156-E160 PolarHBondContact O-N 2.85Å
157Q78.4Confident71.8Confident16 Ų1689.5 Ų89.58%0.07544%0.44CS..Hα-helixtrans-69.9-32.4178.2-65.7-178-4000112.2L152 T154 A155 L161 I225L152-Q157 HydrophobicContact CB-CB 4.03Å; L152-Q157 HydrophobicContact CD2-CB 3.71Å; L152-Q157 HydrophobicContact CG-CB 4.36Å; T154-Q157 WeakPolarHBondContact O-CB 3.48Å; T154-Q157 PolarHBondContact O-N 2.97Å; A155-Q157 VanDerWaalsContact C-N 3.34Å; A155-Q157 PolarHBondContact O-N 2.85Å; Q157-L161 PolarHBondContact O-N 3.36Å; Q157-I225 HydrophobicContact CB-CG2 3.9Å; Q157-I225 HydrophobicContact CG-CG2 4Å
158Q76.3Confident73.4Confident91 Ų9191.4 Ų91.443%0.42545%0.447SS..Hα-helixtrans-71-40.8174.8-173.168.111.200111.1T154 A155 E156 L161 E162T154-Q158 PolarHBondContact O-N 3.43Å; A155-Q158 WeakPolarHBondContact O-CB 3.43Å; A155-Q158 PolarHBondContact O-N 3.25Å; E156-Q158 VanDerWaalsContact C-N 3.33Å; E156-Q158 PolarHBondContact O-N 3.12Å; Q158-L161 WeakPolarHBondContact O-CB 3.41Å; Q158-L161 PolarHBondContact O-N 3.47Å; Q158-E162 PolarHBondContact O-N 2.8Å
159E80Confident74.8Confident111 Ų11186 Ų8652%0.51943%0.427SS..Hα-helixtrans-64.7-42.9173.3-168.4-178.2167.500111.3A155 E156 L161 E162 Q163A155-E159 PolarHBondContact O-N 3.46Å; E156-E159 PolarHBondContact O-N 3.44Å; E159-L161 VanDerWaalsContact C-N 3.27Å; E159-L161 PolarHBondContact O-N 3.12Å; E159-E162 PolarHBondContact O-N 3.31Å; E159-E162 VanDerWaalsContact O-N 3.09Å; E159-Q163 HydrophobicContact CG-CG 4.5Å; E159-Q163 WeakPolarHBondContact O-CG 3.38Å; E159-Q163 PolarHBondContact O-N 3.17Å; E159-Q163 PolarHBondContact OE1-NE2 3.14Å; E159-Q163 VanDerWaalsContact OE1-NE2 3.16Å
160E81.6Confident76.4Confident51 Ų5186.6 Ų86.624%0.23842%0.422CS..Hα-helixtrans-60-38.5175-168-179.8-179.500111.1E156 Q163 L164 I225E156-E160 WeakPolarHBondContact O-CB 3.39Å; E156-E160 PolarHBondContact O-N 2.85Å; E160-Q163 PolarHBondContact O-N 3.25Å; E160-L164 HydrophobicContact CG-CD1 4.08Å; E160-L164 VanDerWaalsContact O-CB 3.29Å; E160-L164 WeakPolarHBondContact O-CB 3.42Å; E160-L164 WeakPolarHBondContact O-CD1 3.46Å; E160-L164 VanDerWaalsContact O-CG 3.27Å; E160-L164 WeakPolarHBondContact O-CG 3.35Å; E160-L164 PolarHBondContact O-N 3.17Å; E160-I225 HydrophobicContact CG-CG1 4.46Å; E160-I225 WeakPolarHBondContact OE2-CG2 3.44Å
161L82.1Confident77.6Confident12 Ų1290.6 Ų90.66%0.06344%0.441CS..Hα-helixtrans-63.3-42.9173.6-179.164.8000112L152 Q157 Q158 E159 L164 K165 F221 I225L152-L161 HydrophobicContact CD1-CB 3.96Å; L152-L161 HydrophobicContact CD1-CD2 3.59Å; L152-L161 HydrophobicContact CD1-CG 4.35Å; Q157-L161 PolarHBondContact O-N 3.36Å; Q158-L161 WeakPolarHBondContact O-CB 3.41Å; Q158-L161 PolarHBondContact O-N 3.47Å; E159-L161 VanDerWaalsContact C-N 3.27Å; E159-L161 PolarHBondContact O-N 3.12Å; L161-L164 PolarHBondContact O-N 3.19Å; L161-K165 WeakPolarHBondContact O-CG 2.97Å; L161-K165 PolarHBondContact O-N 2.93Å; L161-F221 HydrophobicContact CD1-CB 3.43Å; L161-F221 VanDerWaalsContact CD1-CB 3.43Å; L161-F221 HydrophobicContact CD1-CD2 4.48Å; L161-F221 HydrophobicContact CD1-CG 4.4Å; L161-I225 HydrophobicContact CB-CD1 3.58Å; L161-I225 HydrophobicContact CD1-CD1 3.92Å; L161-I225 HydrophobicContact CG-CD1 4.35Å
162E81.9Confident79Confident105 Ų10583.5 Ų83.549%0.49141%0.408SS..Hα-helixtrans-66.7-37.5176.8-72.3-173.6-176.200112.3Q158 E159 K165 K166Q158-E162 PolarHBondContact O-N 2.8Å; E159-E162 PolarHBondContact O-N 3.31Å; E159-E162 VanDerWaalsContact O-N 3.09Å; E162-K165 PolarHBondContact O-N 3.05Å; E162-K166 WeakPolarHBondContact O-CG 3.38Å; E162-K166 PolarHBondContact O-N 3.33Å
163Q83Confident80.3Confident94 Ų9482.4 Ų82.444%0.43940%0.402SS..Hα-helixtrans-67.4-41.7173.8-68.817915.400111.4E159 E160 K165 K166 K167E159-Q163 HydrophobicContact CG-CG 4.5Å; E159-Q163 WeakPolarHBondContact O-CG 3.38Å; E159-Q163 PolarHBondContact O-N 3.17Å; E159-Q163 PolarHBondContact OE1-NE2 3.14Å; E159-Q163 VanDerWaalsContact OE1-NE2 3.16Å; E160-Q163 PolarHBondContact O-N 3.25Å; Q163-K165 VanDerWaalsContact C-N 3.34Å; Q163-K165 PolarHBondContact O-N 3.06Å; Q163-K166 WeakPolarHBondContact O-CB 3.25Å; Q163-K166 PolarHBondContact O-N 3.4Å; Q163-K166 VanDerWaalsContact O-N 3.12Å; Q163-K167 PolarHBondContact O-N 3.26Å
164L80.3Confident81.7Confident7 Ų779.3 Ų79.34%0.03739%0.386CS..Hα-helixtrans-60.4-44.5173.5-80.5160.8000110.6E160 L161 K166 K167 I172 I225E160-L164 HydrophobicContact CG-CD1 4.08Å; E160-L164 VanDerWaalsContact O-CB 3.29Å; E160-L164 WeakPolarHBondContact O-CB 3.42Å; E160-L164 WeakPolarHBondContact O-CD1 3.46Å; E160-L164 VanDerWaalsContact O-CG 3.27Å; E160-L164 WeakPolarHBondContact O-CG 3.35Å; E160-L164 PolarHBondContact O-N 3.17Å; L161-L164 PolarHBondContact O-N 3.19Å; L164-K166 PolarHBondContact O-N 2.96Å; L164-K166 VanDerWaalsContact O-N 3.12Å; L164-K167 PolarHBondContact O-N 3.1Å; L164-K167 VanDerWaalsContact O-N 3.07Å; L164-I172 HydrophobicContact CB-CD1 3.82Å; L164-I172 HydrophobicContact CD2-CB 4.35Å; L164-I172 HydrophobicContact CD2-CD1 3.46Å; L164-I172 VanDerWaalsContact CD2-CD1 3.46Å; L164-I172 HydrophobicContact CD2-CG1 3.57Å; L164-I172 HydrophobicContact CD2-CG2 3.85Å; L164-I172 HydrophobicContact CG-CD1 4.26Å; L164-I172 WeakPolarHBondContact O-CD1 3.45Å; L164-I225 HydrophobicContact CD1-CD1 3.53Å; L164-I225 HydrophobicContact CD1-CG1 3.48Å; L164-I225 VanDerWaalsContact CD1-CG1 3.48Å
165K79.5Confident82.7Confident93 Ų9378.9 Ų78.940%0.40438%0.379SS..Hα-helixtrans-61.1-22.2175.7-77-174.7172.7-157.30114.5L161 E162 Q163 E214 N218L161-K165 WeakPolarHBondContact O-CG 2.97Å; L161-K165 PolarHBondContact O-N 2.93Å; E162-K165 PolarHBondContact O-N 3.05Å; Q163-K165 VanDerWaalsContact C-N 3.34Å; Q163-K165 PolarHBondContact O-N 3.06Å; K165-E214 IonicContact NZ-OE1 2.66Å; K165-E214 PolarHBondContact NZ-OE1 3.46Å; K165-N218 WeakPolarHBondContact CE-OD1 3.4Å; K165-N218 VanDerWaalsContact NZ-CG 3.3Å; K165-N218 PolarHBondContact NZ-ND2 3.48Å; K165-N218 PolarHBondContact NZ-OD1 2.95Å
166K80.8Confident83.5Confident174 Ų17474.9 Ų74.976%0.75735%0.346SS*.Hα-helixtrans-85.5-22.7176.5-71.8172.2-176.3171.40113.2E162 Q163 L164E162-K166 WeakPolarHBondContact O-CG 3.38Å; E162-K166 PolarHBondContact O-N 3.33Å; Q163-K166 WeakPolarHBondContact O-CB 3.25Å; Q163-K166 PolarHBondContact O-N 3.4Å; Q163-K166 VanDerWaalsContact O-N 3.12Å; L164-K166 PolarHBondContact O-N 2.96Å; L164-K166 VanDerWaalsContact O-N 3.12Å
167K80.6Confident84.3Confident119 Ų11972.3 Ų72.352%0.51733%0.33SS..SBendtrans-76.6166.2176.9-70.6179.2-179.7-179.50110.7Q163 L164 E169 I172Q163-K167 PolarHBondContact O-N 3.26Å; L164-K167 PolarHBondContact O-N 3.1Å; L164-K167 VanDerWaalsContact O-N 3.07Å; K167-E169 PolarHBondContact O-N 3.35Å; K167-I172 HydrophobicContact CB-CD1 3.79Å; K167-I172 HydrophobicContact CB-CG1 4.31Å
168D85Confident84.8Confident94 Ų9475.7 Ų75.750%0.50335%0.346SS..  trans-61.9123.6173.2-171.512.2000109.8E170 E171 I172D168-E170 PolarHBondContact O-N 3.06Å; D168-E170 PolarHBondContact OD1-N 3.22Å; D168-E171 HydrophobicContact CB-CB 4.34Å; D168-E171 PolarHBondContact O-N 2.94Å; D168-I172 PolarHBondContact O-N 3.07Å
169E84Confident85.4Confident40 Ų4072.1 Ų72.119%0.18733%0.329CS..Hα-helixtrans-62.9-33.8-174.6-161.5-173.8144.300111K167 E171 I172 I173 R217 F221K167-E169 PolarHBondContact O-N 3.35Å; E169-E171 VanDerWaalsContact C-N 3.35Å; E169-E171 PolarHBondContact O-N 3.16Å; E169-I172 PolarHBondContact O-N 3.47Å; E169-I173 HydrophobicContact CG-CD1 3.93Å; E169-I173 WeakPolarHBondContact O-CB 3.33Å; E169-I173 VanDerWaalsContact O-CD1 3.25Å; E169-I173 WeakPolarHBondContact O-CD1 3.47Å; E169-I173 WeakPolarHBondContact O-CG1 3.28Å; E169-I173 PolarHBondContact O-N 3.32Å; E169-R217 WeakPolarHBondContact OE1-CD 3.46Å; E169-R217 IonicContact OE1-CZ 3.35Å; E169-R217 IonicContact OE1-NE 2.81Å; E169-R217 IonicContact OE1-NH1 3.07Å; E169-R217 PolarHBondContact OE1-NH1 2.68Å; E169-R217 IonicContact OE2-CZ 2.71Å; E169-R217 IonicContact OE2-NH1 2.94Å; E169-R217 PolarHBondContact OE2-NH1 3.4Å; E169-F221 HydrophobicContact CG-CZ 3.85Å
170E85.2Confident85.9Confident105 Ų10567.5 Ų67.549%0.49131%0.308SS..Hα-helixtrans-66.2-37179.3-65.3-171.7-173.900112.4D168 I173 K174 K210D168-E170 PolarHBondContact O-N 3.06Å; D168-E170 PolarHBondContact OD1-N 3.22Å; E170-I173 PolarHBondContact O-N 3.4Å; E170-K174 WeakPolarHBondContact O-CB 3.25Å; E170-K174 PolarHBondContact O-N 3.26Å; E170-K210 WeakPolarHBondContact OE1-CE 3.24Å; E170-K210 IonicContact OE1-NZ 2.63Å; E170-K210 PolarHBondContact OE1-NZ 2.97Å
171E87.1Confident86.1Confident127 Ų12769.4 Ų69.459%0.59333%0.327SS*.Hα-helixtrans-65.9-44.7176.9-170.9176.1-165.900110.7D168 E169 K174 E175D168-E171 HydrophobicContact CB-CB 4.34Å; D168-E171 PolarHBondContact O-N 2.94Å; E169-E171 VanDerWaalsContact C-N 3.35Å; E169-E171 PolarHBondContact O-N 3.16Å; E171-K174 WeakPolarHBondContact O-CB 3.29Å; E171-K174 PolarHBondContact O-N 2.82Å; E171-E175 PolarHBondContact O-N 2.95Å
172I88.4Confident86.2Confident2 Ų275.8 Ų75.81%0.0135%0.35CS..Hα-helixtrans-65.3-43.8177.2-64.5166.4000111L164 K167 D168 E169 K174 E175 I176 F221L164-I172 HydrophobicContact CB-CD1 3.82Å; L164-I172 HydrophobicContact CD2-CB 4.35Å; L164-I172 HydrophobicContact CD2-CD1 3.46Å; L164-I172 VanDerWaalsContact CD2-CD1 3.46Å; L164-I172 HydrophobicContact CD2-CG1 3.57Å; L164-I172 HydrophobicContact CD2-CG2 3.85Å; L164-I172 HydrophobicContact CG-CD1 4.26Å; L164-I172 WeakPolarHBondContact O-CD1 3.45Å; K167-I172 HydrophobicContact CB-CD1 3.79Å; K167-I172 HydrophobicContact CB-CG1 4.31Å; D168-I172 PolarHBondContact O-N 3.07Å; E169-I172 PolarHBondContact O-N 3.47Å; I172-K174 PolarHBondContact O-N 2.92Å; I172-E175 WeakPolarHBondContact O-CB 3.44Å; I172-E175 PolarHBondContact O-N 2.93Å; I172-E175 VanDerWaalsContact O-N 3.16Å; I172-I176 HydrophobicContact CG2-CD1 3.8Å; I172-I176 HydrophobicContact CG2-CG1 4.29Å; I172-I176 VanDerWaalsContact O-CG1 3.28Å; I172-I176 WeakPolarHBondContact O-CG1 3.23Å; I172-I176 PolarHBondContact O-N 3.34Å; I172-F221 HydrophobicContact CB-CE1 4.49Å; I172-F221 HydrophobicContact CG2-CD1 3.89Å; I172-F221 HydrophobicContact CG2-CE1 3.71Å
173I90.4Very high86.2Confident6 Ų673.4 Ų73.43%0.03134%0.341CS..Hα-helixtrans-61.3-38.2177.2-68.2158.4000110.1E169 E170 I176 R177 F204 A209E169-I173 HydrophobicContact CG-CD1 3.93Å; E169-I173 WeakPolarHBondContact O-CB 3.33Å; E169-I173 VanDerWaalsContact O-CD1 3.25Å; E169-I173 WeakPolarHBondContact O-CD1 3.47Å; E169-I173 WeakPolarHBondContact O-CG1 3.28Å; E169-I173 PolarHBondContact O-N 3.32Å; E170-I173 PolarHBondContact O-N 3.4Å; I173-I176 PolarHBondContact O-N 3.23Å; I173-R177 VanDerWaalsContact O-CG 3.26Å; I173-R177 WeakPolarHBondContact O-CG 2.97Å; I173-R177 PolarHBondContact O-N 2.92Å; I173-F204 HydrophobicContact CG1-CE1 4.27Å; I173-F204 HydrophobicContact CG1-CE2 4.35Å; I173-F204 HydrophobicContact CG1-CZ 3.91Å; I173-A209 HydrophobicContact CD1-CB 3.35Å; I173-A209 HydrophobicContact CG1-CB 4.21Å
174K90.6Very high86.1Confident115 Ų11574.4 Ų74.450%0.535%0.346SS..Hα-helixtrans-62.5-47.7173.3-171.5-174.5172.3-166.50111.4E170 E171 I172 I176 R177 E178E170-K174 WeakPolarHBondContact O-CB 3.25Å; E170-K174 PolarHBondContact O-N 3.26Å; E171-K174 WeakPolarHBondContact O-CB 3.29Å; E171-K174 PolarHBondContact O-N 2.82Å; I172-K174 PolarHBondContact O-N 2.92Å; K174-I176 VanDerWaalsContact C-N 3.31Å; K174-I176 PolarHBondContact O-N 3.25Å; K174-R177 WeakPolarHBondContact O-CB 3.23Å; K174-R177 PolarHBondContact O-N 3.47Å; K174-R177 VanDerWaalsContact O-N 3.12Å; K174-E178 VanDerWaalsContact CE-OE1 3.31Å; K174-E178 WeakPolarHBondContact CE-OE1 3.33Å; K174-E178 WeakPolarHBondContact O-CG 3.34Å; K174-E178 PolarHBondContact O-N 3.37Å
175E91.4Very high86.2Confident65 Ų6574.7 Ų74.730%0.30435%0.347SS..Hα-helixtrans-57.2-42.9175.6-169.1-177.2177.800111.7E171 I172 E178 F179 Y224 K228E171-E175 PolarHBondContact O-N 2.95Å; I172-E175 WeakPolarHBondContact O-CB 3.44Å; I172-E175 PolarHBondContact O-N 2.93Å; I172-E175 VanDerWaalsContact O-N 3.16Å; E175-E178 PolarHBondContact O-N 2.9Å; E175-F179 WeakPolarHBondContact O-CB 3.44Å; E175-F179 PolarHBondContact O-N 3.03Å; E175-Y224 WeakPolarHBondContact CG-OH 3.48Å; E175-Y224 PolarHBondContact OE1-OH 2.84Å; E175-K228 IonicContact OE1-NZ 3.57Å; E175-K228 PolarHBondContact OE1-NZ 3.13Å
176I91.9Very high86.4Confident0 Ų074 Ų740%034%0.342CS..Hα-helixtrans-63.7-42.7176.1-67.5169.8000111.2I172 I173 K174 E178 F179 V180 F204 L205 F221 W223 Y224I172-I176 HydrophobicContact CG2-CD1 3.8Å; I172-I176 HydrophobicContact CG2-CG1 4.29Å; I172-I176 VanDerWaalsContact O-CG1 3.28Å; I172-I176 WeakPolarHBondContact O-CG1 3.23Å; I172-I176 PolarHBondContact O-N 3.34Å; I173-I176 PolarHBondContact O-N 3.23Å; K174-I176 VanDerWaalsContact C-N 3.31Å; K174-I176 PolarHBondContact O-N 3.25Å; I176-E178 VanDerWaalsContact C-N 3.31Å; I176-E178 PolarHBondContact O-N 3.15Å; I176-F179 WeakPolarHBondContact O-CB 3.46Å; I176-F179 PolarHBondContact O-N 3.24Å; I176-V180 HydrophobicContact CG2-CG2 4.29Å; I176-V180 WeakPolarHBondContact O-CB 2.92Å; I176-V180 VanDerWaalsContact O-CG2 3.28Å; I176-V180 WeakPolarHBondContact O-CG2 3.4Å; I176-V180 PolarHBondContact O-N 3.2Å; I176-F204 HydrophobicContact CD1-CE1 3.98Å; I176-F204 HydrophobicContact CD1-CZ 3.96Å; I176-F204 HydrophobicContact CG2-CE1 4.19Å; I176-L205 HydrophobicContact CG2-CD2 4.21Å; I176-F221 HydrophobicContact CD1-CD1 3.79Å; I176-F221 HydrophobicContact CD1-CE1 4.07Å; I176-W223 HydrophobicContact CG2-CZ3 4.08Å; I176-Y224 HydrophobicContact CB-CD2 4.4Å; I176-Y224 HydrophobicContact CD1-CD1 4.28Å; I176-Y224 HydrophobicContact CD1-CG 4.01Å; I176-Y224 HydrophobicContact CG1-CD1 3.91Å; I176-Y224 HydrophobicContact CG1-CD2 3.61Å; I176-Y224 HydrophobicContact CG1-CE1 4.35Å; I176-Y224 HydrophobicContact CG1-CE2 4.06Å; I176-Y224 HydrophobicContact CG1-CG 3.52Å
177R91.2Very high86.9Confident92 Ų9268.7 Ų68.735%0.34732%0.32SS..Hα-helixtrans-62.7-41177.2-74.2-178.6-60.4-171.5-6.3111.6I173 K174 S181 L205I173-R177 VanDerWaalsContact O-CG 3.26Å; I173-R177 WeakPolarHBondContact O-CG 2.97Å; I173-R177 PolarHBondContact O-N 2.92Å; K174-R177 WeakPolarHBondContact O-CB 3.23Å; K174-R177 PolarHBondContact O-N 3.47Å; K174-R177 VanDerWaalsContact O-N 3.12Å; R177-S181 WeakPolarHBondContact O-CB 3.36Å; R177-S181 PolarHBondContact O-N 3.34Å; R177-S181 PolarHBondContact O-OG 3.28Å; R177-L205 WeakPolarHBondContact CD-O 3.43Å; R177-L205 HydrophobicContact CG-CD2 3.98Å
178E90.1Very high87.2Confident86 Ų8668.7 Ų68.740%0.40232%0.322SS..Hα-helixtrans-64.6-42.2174.7-70.4175.5-166.500111.3K174 E175 I176 S181 R182K174-E178 VanDerWaalsContact CE-OE1 3.31Å; K174-E178 WeakPolarHBondContact CE-OE1 3.33Å; K174-E178 WeakPolarHBondContact O-CG 3.34Å; K174-E178 PolarHBondContact O-N 3.37Å; E175-E178 PolarHBondContact O-N 2.9Å; I176-E178 VanDerWaalsContact C-N 3.31Å; I176-E178 PolarHBondContact O-N 3.15Å; E178-S181 PolarHBondContact O-N 3.21Å; E178-R182 VanDerWaalsContact O-CB 3.23Å; E178-R182 WeakPolarHBondContact O-CB 3.29Å; E178-R182 PolarHBondContact O-N 3.24Å
179F89.3Confident87.1Confident16 Ų1664.9 Ų64.97%0.0730%0.302CS..Hα-helixtrans-61-49174.8178.1-93.5000112.4E175 I176 S181 R182 N183 L185 W223 Y224 F227E175-F179 WeakPolarHBondContact O-CB 3.44Å; E175-F179 PolarHBondContact O-N 3.03Å; I176-F179 WeakPolarHBondContact O-CB 3.46Å; I176-F179 PolarHBondContact O-N 3.24Å; F179-S181 VanDerWaalsContact C-N 3.27Å; F179-S181 PolarHBondContact O-N 2.89Å; F179-R182 PolarHBondContact O-N 3.35Å; F179-N183 WeakPolarHBondContact CD2-ND2 3.15Å; F179-N183 WeakPolarHBondContact CE2-ND2 3.37Å; F179-N183 WeakPolarHBondContact CZ-ND2 3.43Å; F179-N183 WeakPolarHBondContact O-CB 3.23Å; F179-N183 PolarHBondContact O-N 3.49Å; F179-N183 PolarHBondContact O-ND2 3.34Å; F179-L185 HydrophobicContact CD1-CD1 4.23Å; F179-L185 HydrophobicContact CE1-CD1 3.82Å; F179-W223 HydrophobicContact CD1-CH2 4.38Å; F179-W223 HydrophobicContact CE1-CH2 4.34Å; F179-Y224 HydrophobicContact CB-CD2 4.41Å; F179-Y224 HydrophobicContact CB-CE2 3.83Å; F179-Y224 HydrophobicContact CD1-CD2 4.14Å; F179-Y224 HydrophobicContact CD1-CE2 4.24Å; F179-Y224 HydrophobicContact CD2-CE2 4.08Å; F179-Y224 HydrophobicContact CG-CD2 4.18Å; F179-Y224 AromaticContact CG-CE2 3.8Å; F179-Y224 HydrophobicContact CG-CE2 3.8Å; F179-F227 HydrophobicContact CE1-CB 4.21Å; F179-F227 HydrophobicContact CZ-CB 4.01Å
180V89.2Confident87.3Confident15 Ų1563 Ų639%0.09129%0.293CS..Hα-helixtrans-57.2-43.3175.6167.60000110.8I176 Q184 L185 I190 L205 W223I176-V180 HydrophobicContact CG2-CG2 4.29Å; I176-V180 WeakPolarHBondContact O-CB 2.92Å; I176-V180 VanDerWaalsContact O-CG2 3.28Å; I176-V180 WeakPolarHBondContact O-CG2 3.4Å; I176-V180 PolarHBondContact O-N 3.2Å; V180-Q184 PolarHBondContact O-N 3.15Å; V180-L185 HydrophobicContact CG1-CB 4.23Å; V180-L185 PolarHBondContact O-N 2.9Å; V180-I190 HydrophobicContact CG1-CD1 4.16Å; V180-I190 HydrophobicContact CG2-CD1 3.71Å; V180-L205 HydrophobicContact CG2-CD2 4.24Å; V180-W223 HydrophobicContact CG2-CH2 3.79Å; V180-W223 HydrophobicContact CG2-CZ3 4.21Å
181S86.3Confident87.6Confident90 Ų9058.4 Ų58.463%0.62927%0.274SS*.Hα-helixtrans-69.2-40.3179.2-57.80000112.4R177 E178 F179 Q184R177-S181 WeakPolarHBondContact O-CB 3.36Å; R177-S181 PolarHBondContact O-N 3.34Å; R177-S181 PolarHBondContact O-OG 3.28Å; E178-S181 PolarHBondContact O-N 3.21Å; F179-S181 VanDerWaalsContact C-N 3.27Å; F179-S181 PolarHBondContact O-N 2.89Å; S181-Q184 PolarHBondContact O-N 2.9Å
182R84.2Confident87.4Confident146 Ų14657.7 Ų57.755%0.55127%0.266SS*.Hα-helixtrans-65.5-45.7179.2-170.6-176.3-59.3125.13.4111.3E178 F179 Q184E178-R182 VanDerWaalsContact O-CB 3.23Å; E178-R182 WeakPolarHBondContact O-CB 3.29Å; E178-R182 PolarHBondContact O-N 3.24Å; F179-R182 PolarHBondContact O-N 3.35Å; R182-Q184 VanDerWaalsContact C-N 3.32Å
183N82.3Confident87.2Confident56 Ų5657.9 Ų57.930%0.29927%0.267SS..THydrogen-bonded Turntrans-87.63.1-178.8-65.7-39.6000113.8F179 L185 L234F179-N183 WeakPolarHBondContact CD2-ND2 3.15Å; F179-N183 WeakPolarHBondContact CE2-ND2 3.37Å; F179-N183 WeakPolarHBondContact CZ-ND2 3.43Å; F179-N183 WeakPolarHBondContact O-CB 3.23Å; F179-N183 PolarHBondContact O-N 3.49Å; F179-N183 PolarHBondContact O-ND2 3.34Å; N183-L185 VanDerWaalsContact C-N 3.26Å; N183-L185 HydrophobicContact CB-CD1 4.05Å; N183-L185 HydrophobicContact CB-CD2 3.91Å; N183-L185 HydrophobicContact CB-CG 3.72Å; N183-L185 WeakPolarHBondContact O-CD2 3.11Å; N183-L185 PolarHBondContact O-N 3.1Å; N183-L234 HydrophobicContact CB-CD1 3.97Å
184Q79.5Confident87.1Confident115 Ų11558 Ų5854%0.53727%0.268SS..THydrogen-bonded Turntrans56.238.6176.7-60.31675300113.2V180 S181 R182 K263V180-Q184 PolarHBondContact O-N 3.15Å; S181-Q184 PolarHBondContact O-N 2.9Å; R182-Q184 VanDerWaalsContact C-N 3.32Å; Q184-K263 VanDerWaalsContact OE1-CE 3.28Å
185L83.5Confident86.9Confident13 Ų1354.3 Ų54.37%0.06826%0.263CS..  trans-80.2129.4-174.6-52.9-179000110.5F179 V180 N183 I190 W223 L234F179-L185 HydrophobicContact CD1-CD1 4.23Å; F179-L185 HydrophobicContact CE1-CD1 3.82Å; V180-L185 HydrophobicContact CG1-CB 4.23Å; V180-L185 PolarHBondContact O-N 2.9Å; N183-L185 VanDerWaalsContact C-N 3.26Å; N183-L185 HydrophobicContact CB-CD1 4.05Å; N183-L185 HydrophobicContact CB-CD2 3.91Å; N183-L185 HydrophobicContact CB-CG 3.72Å; N183-L185 WeakPolarHBondContact O-CD2 3.11Å; N183-L185 PolarHBondContact O-N 3.1Å; L185-I190 HydrophobicContact CB-CD1 4.29Å; L185-I190 HydrophobicContact CB-CG1 4.39Å; L185-W223 HydrophobicContact CD1-CH2 3.93Å; L185-W223 HydrophobicContact CD1-CZ2 3.77Å; L185-L234 HydrophobicContact CD1-CD2 3.93Å; L185-L234 HydrophobicContact CD2-CD1 4.21Å; L185-L234 HydrophobicContact CD2-CD2 3.44Å; L185-L234 VanDerWaalsContact CD2-CD2 3.44Å; L185-L234 HydrophobicContact CD2-CG 4.41Å; L185-L234 HydrophobicContact CG-CD2 4.35Å
186R83.8Confident86.9Confident78 Ų7851.7 Ų51.729%0.29425%0.251SS..  trans-79.7139173.5-66.1-157-62.9-85.6-2110.4Q188 S189 I190 T239 E258R186-Q188 PolarHBondContact O-N 3.25Å; R186-Q188 VanDerWaalsContact O-N 3.1Å; R186-S189 WeakPolarHBondContact O-CA 3.36Å; R186-S189 WeakPolarHBondContact O-CB 3.46Å; R186-S189 PolarHBondContact O-N 2.99Å; R186-I190 PolarHBondContact O-N 2.85Å; R186-I190 VanDerWaalsContact O-N 3.1Å; R186-T239 PolarHBondContact NH2-O 3.4Å; R186-E258 IonicContact CZ-OE1 3.83Å; R186-E258 VanDerWaalsContact NH1-CD 3.33Å; R186-E258 IonicContact NH1-OE1 2.94Å; R186-E258 PolarHBondContact NH1-OE1 3.05Å; R186-E258 IonicContact NH1-OE2 2.61Å; R186-E258 IonicContact NH2-OE1 3.95Å; R186-E258 PolarHBondContact NH2-OE1 2.93Å
187Q90.6Very high86.9Confident63 Ų6353.6 Ų53.629%0.29426%0.264SS..Hα-helixtrans-53.2-35.2174.8-60.4-173.86.300112.2S189 I190 A191 V201 L205Q187-S189 VanDerWaalsContact C-N 3.35Å; Q187-S189 PolarHBondContact O-N 3.48Å; Q187-I190 PolarHBondContact O-N 3.32Å; Q187-A191 WeakPolarHBondContact O-CB 3.38Å; Q187-A191 PolarHBondContact O-N 3.1Å; Q187-V201 HydrophobicContact CB-CG1 4.12Å; Q187-V201 HydrophobicContact CG-CG1 4.48Å; Q187-L205 HydrophobicContact CG-CD1 3.91Å
188Q86.4Confident86.8Confident118 Ų11852.8 Ų52.855%0.55127%0.265SS*.Hα-helixtrans-63-40.4176.5-172.560.331.900112.5R186 A191 Y192R186-Q188 PolarHBondContact O-N 3.25Å; R186-Q188 VanDerWaalsContact O-N 3.1Å; Q188-A191 PolarHBondContact O-N 2.78Å; Q188-Y192 WeakPolarHBondContact O-CB 3.4Å; Q188-Y192 PolarHBondContact O-N 3.37Å
189S83.9Confident86.9Confident14 Ų1452.2 Ų52.210%0.09827%0.268CS..Hα-helixtrans-67.3-42.2176.8-52.20000110.2R186 Q187 A191 Y192 M193R186-S189 WeakPolarHBondContact O-CA 3.36Å; R186-S189 WeakPolarHBondContact O-CB 3.46Å; R186-S189 PolarHBondContact O-N 2.99Å; Q187-S189 VanDerWaalsContact C-N 3.35Å; Q187-S189 PolarHBondContact O-N 3.48Å; S189-A191 PolarHBondContact O-N 3.14Å; S189-Y192 WeakPolarHBondContact O-CB 3.24Å; S189-Y192 PolarHBondContact O-N 3.19Å; S189-M193 WeakPolarHBondContact O-CB 3.26Å; S189-M193 WeakPolarHBondContact O-CE 3.35Å; S189-M193 VanDerWaalsContact O-CG 3.25Å; S189-M193 WeakPolarHBondContact O-CG 3.45Å; S189-M193 PolarHBondContact O-N 3.46Å
190I88.9Confident87.2Confident0 Ų056.9 Ų56.90%029%0.286CS..Hα-helixtrans-61.3-45.6175.2-57.2172.2000110.8V180 L185 R186 Q187 Y192 M193 T194 V201 L205 M220 W223V180-I190 HydrophobicContact CG1-CD1 4.16Å; V180-I190 HydrophobicContact CG2-CD1 3.71Å; L185-I190 HydrophobicContact CB-CD1 4.29Å; L185-I190 HydrophobicContact CB-CG1 4.39Å; R186-I190 PolarHBondContact O-N 2.85Å; R186-I190 VanDerWaalsContact O-N 3.1Å; Q187-I190 PolarHBondContact O-N 3.32Å; I190-Y192 VanDerWaalsContact C-N 3.3Å; I190-Y192 PolarHBondContact O-N 2.9Å; I190-M193 HydrophobicContact CG1-CE 4.34Å; I190-M193 PolarHBondContact O-N 3.27Å; I190-T194 HydrophobicContact CG2-CG2 3.87Å; I190-T194 WeakPolarHBondContact O-CB 3.07Å; I190-T194 VanDerWaalsContact O-CG2 3.29Å; I190-T194 WeakPolarHBondContact O-CG2 3.48Å; I190-T194 PolarHBondContact O-N 2.98Å; I190-T194 PolarHBondContact O-OG1 3.02Å; I190-V201 HydrophobicContact CB-CG1 4.05Å; I190-V201 HydrophobicContact CG2-CG1 3.9Å; I190-V201 HydrophobicContact CG2-CG2 4.35Å; I190-L205 HydrophobicContact CD1-CD1 4.3Å; I190-M220 HydrophobicContact CG2-CE 4.09Å; I190-M220 HydrophobicContact CG2-SD 4.16Å; I190-W223 HydrophobicContact CB-CZ2 4.46Å; I190-W223 HydrophobicContact CD1-CH2 3.75Å; I190-W223 HydrophobicContact CD1-CZ2 4.12Å; I190-W223 HydrophobicContact CD1-CZ3 4.37Å; I190-W223 HydrophobicContact CG1-CH2 3.88Å; I190-W223 HydrophobicContact CG1-CZ2 3.7Å; I190-W223 HydrophobicContact CG2-CD2 4.17Å; I190-W223 HydrophobicContact CG2-CE3 4.25Å; I190-W223 HydrophobicContact CG2-CH2 4.28Å; I190-W223 HydrophobicContact CG2-CZ2 4.19Å; I190-W223 HydrophobicContact CG2-CZ3 4.3Å
191A89.9Confident87.4Confident9 Ų956.1 Ų56.17%0.07428%0.282CS..Hα-helixtrans-59.6-41.6176.700000112.1Q187 Q188 S189 G195 I196 Q198 V201Q187-A191 WeakPolarHBondContact O-CB 3.38Å; Q187-A191 PolarHBondContact O-N 3.1Å; Q188-A191 PolarHBondContact O-N 2.78Å; S189-A191 PolarHBondContact O-N 3.14Å; A191-G195 WeakPolarHBondContact O-CA 3.49Å; A191-G195 PolarHBondContact O-N 3.45Å; A191-I196 CarbonylContact C-O 3.57Å; A191-I196 VanDerWaalsContact CA-O 3.26Å; A191-I196 WeakPolarHBondContact CA-O 3.25Å; A191-I196 VanDerWaalsContact CB-O 3.24Å; A191-I196 WeakPolarHBondContact CB-O 3.44Å; A191-I196 PolarHBondContact O-N 2.87Å; A191-Q198 HydrophobicContact CB-CB 4.09Å; A191-V201 HydrophobicContact CB-CG2 3.95Å
192Y84.3Confident87.8Confident112 Ų11253.2 Ų53.244%0.43926%0.261SS..Hα-helixtrans-63.9-47175.5178-96.3000111.9Q188 S189 I190 I243Q188-Y192 WeakPolarHBondContact O-CB 3.4Å; Q188-Y192 PolarHBondContact O-N 3.37Å; S189-Y192 WeakPolarHBondContact O-CB 3.24Å; S189-Y192 PolarHBondContact O-N 3.19Å; I190-Y192 VanDerWaalsContact C-N 3.3Å; I190-Y192 PolarHBondContact O-N 2.9Å; Y192-I243 HydrophobicContact CE2-CD1 4.28Å
193M83.6Confident88.3Confident6 Ų650.8 Ų50.83%0.0325%0.254CS..Hα-helixtrans-66.6-51.3-178.8-71.3-177.2-57.500111.5F150 S189 I190 G195 W223 F227 F237F150-M193 WeakPolarHBondContact CD2-O 3.44Å; F150-M193 HydrophobicContact CE2-CB 3.75Å; F150-M193 HydrophobicContact CE2-CG 4.48Å; F150-M193 WeakPolarHBondContact CE2-O 3.31Å; F150-M193 HydrophobicContact CZ-CB 4.31Å; S189-M193 WeakPolarHBondContact O-CB 3.26Å; S189-M193 WeakPolarHBondContact O-CE 3.35Å; S189-M193 VanDerWaalsContact O-CG 3.25Å; S189-M193 WeakPolarHBondContact O-CG 3.45Å; S189-M193 PolarHBondContact O-N 3.46Å; I190-M193 HydrophobicContact CG1-CE 4.34Å; I190-M193 PolarHBondContact O-N 3.27Å; M193-G195 VanDerWaalsContact C-N 3.31Å; M193-G195 PolarHBondContact O-N 3.12Å; M193-W223 HydrophobicContact CE-CZ2 4.11Å; M193-F227 HydrophobicContact CE-CE1 4.3Å; M193-F227 HydrophobicContact CE-CZ 4.14Å; M193-F227 HydrophobicContact CG-CZ 4.36Å; M193-F227 HydrophobicContact SD-CE1 3.65Å; M193-F227 HydrophobicContact SD-CE2 4.11Å; M193-F227 HydrophobicContact SD-CZ 3.23Å; M193-F227 WeakPolarHBondContact SD-CZ 3.46Å; M193-F237 HydrophobicContact CG-CD1 3.97Å; M193-F237 HydrophobicContact CG-CD2 4.48Å; M193-F237 HydrophobicContact CG-CE1 4.39Å; M193-F237 HydrophobicContact CG-CG 4.04Å; M193-F237 HydrophobicContact SD-CB 3.88Å; M193-F237 HydrophobicContact SD-CD1 4.29Å; M193-F237 HydrophobicContact SD-CD2 3.94Å; M193-F237 HydrophobicContact SD-CG 3.74Å
194T88.4Confident88.8Confident9 Ų948.1 Ų48.16%0.05524%0.24CC..Hα-helixtrans-73.7-20.2-176.457.40000114I190 I196 M220 W223I190-T194 HydrophobicContact CG2-CG2 3.87Å; I190-T194 WeakPolarHBondContact O-CB 3.07Å; I190-T194 VanDerWaalsContact O-CG2 3.29Å; I190-T194 WeakPolarHBondContact O-CG2 3.48Å; I190-T194 PolarHBondContact O-N 2.98Å; I190-T194 PolarHBondContact O-OG1 3.02Å; T194-I196 HydrophobicContact CG2-CD1 4.16Å; T194-I196 PolarHBondContact O-N 2.92Å; T194-I196 WeakPolarHBondContact OG1-CB 3.49Å; T194-I196 PolarHBondContact OG1-N 3.12Å; T194-I196 VanDerWaalsContact OG1-N 3.16Å; T194-M220 HydrophobicContact CG2-SD 4.17Å; T194-W223 HydrophobicContact CG2-CB 3.58Å; T194-W223 HydrophobicContact CG2-CD2 4.13Å; T194-W223 HydrophobicContact CG2-CG 3.52Å
195G87.1Confident89.5Confident38 Ų3843.4 Ų43.439%0.39222%0.219SC..  trans75.5-0.9-167.600000114.9A191 M193A191-G195 WeakPolarHBondContact O-CA 3.49Å; A191-G195 PolarHBondContact O-N 3.45Å; M193-G195 VanDerWaalsContact C-N 3.31Å; M193-G195 PolarHBondContact O-N 3.12Å
196I90.3Very high89.8Confident10 Ų1047.8 Ų47.85%0.05124%0.242CC..  trans-77.4139.8178.6-60.3165.5000108.1A191 T194 Y200 V201 V216 L219 M220A191-I196 CarbonylContact C-O 3.57Å; A191-I196 VanDerWaalsContact CA-O 3.26Å; A191-I196 WeakPolarHBondContact CA-O 3.25Å; A191-I196 VanDerWaalsContact CB-O 3.24Å; A191-I196 WeakPolarHBondContact CB-O 3.44Å; A191-I196 PolarHBondContact O-N 2.87Å; T194-I196 HydrophobicContact CG2-CD1 4.16Å; T194-I196 PolarHBondContact O-N 2.92Å; T194-I196 WeakPolarHBondContact OG1-CB 3.49Å; T194-I196 PolarHBondContact OG1-N 3.12Å; T194-I196 VanDerWaalsContact OG1-N 3.16Å; I196-Y200 VanDerWaalsContact CG2-CB 3.41Å; I196-Y200 HydrophobicContact CG2-CD2 4.38Å; I196-Y200 HydrophobicContact CG2-CG 4.36Å; I196-V201 HydrophobicContact CB-CG2 4Å; I196-V201 HydrophobicContact CG2-CG2 3.87Å; I196-V216 HydrophobicContact CD1-CG1 4.12Å; I196-V216 HydrophobicContact CG2-CG1 4.02Å; I196-L219 HydrophobicContact CD1-CB 3.72Å; I196-L219 HydrophobicContact CD1-CD1 4.45Å; I196-L219 HydrophobicContact CG1-CB 4.13Å; I196-L219 HydrophobicContact CG1-CD1 3.96Å; I196-M220 HydrophobicContact CD1-CG 3.63Å; I196-M220 HydrophobicContact CD1-SD 3.54Å; I196-M220 VanDerWaalsContact CD1-SD 3.54Å
197S91.2Very high89.9Confident39 Ų3946.2 Ų46.227%0.27325%0.25SS..  trans-63142.7174.478.50000110.9P199 Y200 V201S197-P199 VanDerWaalsContact C-CD 3.42Å; S197-P199 VanDerWaalsContact C-N 3.31Å; S197-P199 VanDerWaalsContact O-N 3.15Å; S197-Y200 PolarHBondContact O-N 3.16Å; S197-Y200 WeakPolarHBondContact OG-CD2 3.22Å; S197-Y200 WeakPolarHBondContact OG-CE2 3.38Å; S197-V201 PolarHBondContact O-N 3.23Å
198Q89.9Confident89.8Confident76 Ų7645.8 Ų45.836%0.35525%0.252SS..Hα-helixtrans-50.5-39.3-178.9-178.7-81.3-31.200114.7A191 Y200 V201 S202A191-Q198 HydrophobicContact CB-CB 4.09Å; Q198-Y200 VanDerWaalsContact C-N 3.3Å; Q198-Y200 PolarHBondContact O-N 3.05Å; Q198-V201 PolarHBondContact O-N 3.24Å; Q198-S202 PolarHBondContact O-N 3.36Å
199P92.9Very high89.9Confident73 Ų7340.2 Ų40.247%0.47423%0.226SC..Hα-helixtrans-59.1-37.3175.6-27.535.6000114.1S197 S202 K203S197-P199 VanDerWaalsContact C-CD 3.42Å; S197-P199 VanDerWaalsContact C-N 3.31Å; S197-P199 VanDerWaalsContact O-N 3.15Å; P199-S202 WeakPolarHBondContact O-CB 3.45Å; P199-S202 PolarHBondContact O-N 3.3Å; P199-K203 WeakPolarHBondContact O-CG 3.42Å; P199-K203 PolarHBondContact O-N 2.89Å
200Y95Very high90Very high114 Ų11445.4 Ų45.445%0.44725%0.247SC..Hα-helixtrans-72.8-37177.8-68.7-51.3000111.9I196 S197 Q198 S202 K203 F204 L212I196-Y200 VanDerWaalsContact CG2-CB 3.41Å; I196-Y200 HydrophobicContact CG2-CD2 4.38Å; I196-Y200 HydrophobicContact CG2-CG 4.36Å; S197-Y200 PolarHBondContact O-N 3.16Å; S197-Y200 WeakPolarHBondContact OG-CD2 3.22Å; S197-Y200 WeakPolarHBondContact OG-CE2 3.38Å; Q198-Y200 VanDerWaalsContact C-N 3.3Å; Q198-Y200 PolarHBondContact O-N 3.05Å; Y200-S202 VanDerWaalsContact C-N 3.29Å; Y200-S202 PolarHBondContact O-N 2.93Å; Y200-K203 PolarHBondContact O-N 3.45Å; Y200-F204 WeakPolarHBondContact O-CB 3.47Å; Y200-F204 PolarHBondContact O-N 3.43Å; Y200-L212 HydrophobicContact CD1-CD2 3.57Å; Y200-L212 HydrophobicContact CE1-CD2 4.28Å; Y200-L212 HydrophobicContact CG-CD2 4.45Å
201V94.2Very high89.9Confident0 Ų052.5 Ų52.50%028%0.28CS..Hα-helixtrans-60.9-42.5171.3178.10000110.4Q187 I190 A191 I196 S197 Q198 F204 L205 M220Q187-V201 HydrophobicContact CB-CG1 4.12Å; Q187-V201 HydrophobicContact CG-CG1 4.48Å; I190-V201 HydrophobicContact CB-CG1 4.05Å; I190-V201 HydrophobicContact CG2-CG1 3.9Å; I190-V201 HydrophobicContact CG2-CG2 4.35Å; A191-V201 HydrophobicContact CB-CG2 3.95Å; I196-V201 HydrophobicContact CB-CG2 4Å; I196-V201 HydrophobicContact CG2-CG2 3.87Å; S197-V201 PolarHBondContact O-N 3.23Å; Q198-V201 PolarHBondContact O-N 3.24Å; V201-F204 PolarHBondContact O-N 3.35Å; V201-L205 HydrophobicContact CG1-CD1 3.97Å; V201-L205 WeakPolarHBondContact O-CG 3.44Å; V201-L205 PolarHBondContact O-N 3.23Å; V201-L205 VanDerWaalsContact O-N 3.07Å; V201-M220 HydrophobicContact CG1-CE 4.46Å; V201-M220 HydrophobicContact CG2-SD 4.44Å
202S93.9Very high90Very high28 Ų2852.6 Ų52.620%0.19628%0.279CS..Hα-helixtrans-61.8-49.7176.8-169.20000111.9Q198 P199 Y200 F204 L205 N206Q198-S202 PolarHBondContact O-N 3.36Å; P199-S202 WeakPolarHBondContact O-CB 3.45Å; P199-S202 PolarHBondContact O-N 3.3Å; Y200-S202 VanDerWaalsContact C-N 3.29Å; Y200-S202 PolarHBondContact O-N 2.93Å; S202-F204 VanDerWaalsContact C-N 3.3Å; S202-F204 PolarHBondContact O-N 3.29Å; S202-L205 PolarHBondContact O-N 3.25Å; S202-N206 WeakPolarHBondContact O-CB 3.37Å; S202-N206 PolarHBondContact O-N 3.09Å; S202-N206 PolarHBondContact O-ND2 3.16Å; S202-N206 PolarHBondContact OG-ND2 3.33Å
203K94Very high90.2Very high95 Ų9550.5 Ų50.541%0.41328%0.281SS..Hα-helixtrans-56.4-43.1175.7-76.9-171173.5-158.30112.5P199 Y200 N206 V208 L212P199-K203 WeakPolarHBondContact O-CG 3.42Å; P199-K203 PolarHBondContact O-N 2.89Å; Y200-K203 PolarHBondContact O-N 3.45Å; K203-N206 PolarHBondContact O-N 3.12Å; K203-V208 CarbonylContact O-C 3.59Å; K203-V208 PolarHBondContact O-N 2.93Å; K203-V208 VanDerWaalsContact O-N 3.11Å; K203-L212 HydrophobicContact CB-CD1 4.28Å; K203-L212 HydrophobicContact CB-CD2 3.98Å; K203-L212 HydrophobicContact CB-CG 4.46Å; K203-L212 HydrophobicContact CD-CD2 3.99Å
204F94.1Very high90.4Very high0 Ų055.5 Ų55.50%030%0.304CS..Hα-helixtrans-60-48.6178.3-173.9-86.9000111.4I173 I176 Y200 V201 S202 N206 G207 A209 L212 R217 M220 F221I173-F204 HydrophobicContact CG1-CE1 4.27Å; I173-F204 HydrophobicContact CG1-CE2 4.35Å; I173-F204 HydrophobicContact CG1-CZ 3.91Å; I176-F204 HydrophobicContact CD1-CE1 3.98Å; I176-F204 HydrophobicContact CD1-CZ 3.96Å; I176-F204 HydrophobicContact CG2-CE1 4.19Å; Y200-F204 WeakPolarHBondContact O-CB 3.47Å; Y200-F204 PolarHBondContact O-N 3.43Å; V201-F204 PolarHBondContact O-N 3.35Å; S202-F204 VanDerWaalsContact C-N 3.3Å; S202-F204 PolarHBondContact O-N 3.29Å; F204-N206 VanDerWaalsContact C-N 3.35Å; F204-N206 PolarHBondContact O-N 3.36Å; F204-G207 PolarHBondContact O-N 3.09Å; F204-A209 HydrophobicContact CD2-CB 3.73Å; F204-A209 HydrophobicContact CE2-CB 4.08Å; F204-A209 HydrophobicContact CG-CB 4.27Å; F204-L212 HydrophobicContact CB-CD1 3.67Å; F204-L212 HydrophobicContact CD2-CD1 4.06Å; F204-L212 HydrophobicContact CG-CD1 4.38Å; F204-R217 HydrophobicContact CD2-CG 4.42Å; F204-R217 HydrophobicContact CE2-CB 4.39Å; F204-R217 HydrophobicContact CE2-CG 4.25Å; F204-M220 HydrophobicContact CB-CE 4.41Å; F204-M220 HydrophobicContact CB-CG 4.47Å; F204-M220 HydrophobicContact CD1-CB 4.29Å; F204-M220 HydrophobicContact CD1-CE 3.39Å; F204-M220 HydrophobicContact CD1-CG 4.06Å; F204-M220 HydrophobicContact CD2-CB 4.01Å; F204-M220 HydrophobicContact CD2-CG 3.73Å; F204-M220 HydrophobicContact CE1-CB 3.9Å; F204-M220 HydrophobicContact CE1-CE 3.73Å; F204-M220 HydrophobicContact CE1-CG 4.19Å; F204-M220 HydrophobicContact CE2-CB 3.6Å; F204-M220 HydrophobicContact CE2-CG 3.88Å; F204-M220 HydrophobicContact CG-CB 4.34Å; F204-M220 HydrophobicContact CG-CE 3.95Å; F204-M220 HydrophobicContact CG-CG 3.82Å; F204-M220 HydrophobicContact CZ-CB 3.53Å; F204-M220 HydrophobicContact CZ-CG 4.1Å; F204-F221 HydrophobicContact CE2-CE1 4.19Å; F204-F221 HydrophobicContact CE2-CZ 4.43Å; F204-F221 HydrophobicContact CZ-CD1 4.25Å; F204-F221 AromaticContact CZ-CE1 3.78Å; F204-F221 HydrophobicContact CZ-CE1 3.78Å; F204-F221 HydrophobicContact CZ-CZ 4.44Å
205L92.9Very high90.4Very high17 Ų1764.1 Ų64.19%0.08934%0.335CS..Hα-helixtrans-76.6-17.7-178.1-63.4173.1000114I176 R177 V180 Q187 I190 V201 S202 G207I176-L205 HydrophobicContact CG2-CD2 4.21Å; R177-L205 WeakPolarHBondContact CD-O 3.43Å; R177-L205 HydrophobicContact CG-CD2 3.98Å; V180-L205 HydrophobicContact CG2-CD2 4.24Å; Q187-L205 HydrophobicContact CG-CD1 3.91Å; I190-L205 HydrophobicContact CD1-CD1 4.3Å; V201-L205 HydrophobicContact CG1-CD1 3.97Å; V201-L205 WeakPolarHBondContact O-CG 3.44Å; V201-L205 PolarHBondContact O-N 3.23Å; V201-L205 VanDerWaalsContact O-N 3.07Å; S202-L205 PolarHBondContact O-N 3.25Å; L205-G207 VanDerWaalsContact C-N 3.27Å; L205-G207 PolarHBondContact O-N 2.98Å
206N90.9Very high90.6Very high105 Ų10563 Ų6356%0.56132%0.321SS*.THydrogen-bonded Turntrans-84.71.6176.3-69.4-20.4000113.3S202 K203 F204S202-N206 WeakPolarHBondContact O-CB 3.37Å; S202-N206 PolarHBondContact O-N 3.09Å; S202-N206 PolarHBondContact O-ND2 3.16Å; S202-N206 PolarHBondContact OG-ND2 3.33Å; K203-N206 PolarHBondContact O-N 3.12Å; F204-N206 VanDerWaalsContact C-N 3.35Å; F204-N206 PolarHBondContact O-N 3.36Å
207G85.9Confident90.6Very high45 Ų4565 Ų6546%0.46433%0.328SS..THydrogen-bonded Turntrans88.76.3-179.800000114.5F204 L205 A209F204-G207 PolarHBondContact O-N 3.09Å; L205-G207 VanDerWaalsContact C-N 3.27Å; L205-G207 PolarHBondContact O-N 2.98Å; G207-A209 VanDerWaalsContact C-N 3.27Å; G207-A209 PolarHBondContact O-N 2.65Å
208V89.1Confident90.6Very high54 Ų5464.7 Ų64.733%0.32732%0.323SS..  trans-97.729.1177.1-157.80000110.6K203 K210 E211K203-V208 CarbonylContact O-C 3.59Å; K203-V208 PolarHBondContact O-N 2.93Å; K203-V208 VanDerWaalsContact O-N 3.11Å; V208-K210 VanDerWaalsContact C-N 3.27Å; V208-K210 PolarHBondContact O-N 3Å; V208-E211 HydrophobicContact CG1-CB 4.1Å; V208-E211 HydrophobicContact CG1-CG 3.71Å; V208-E211 VanDerWaalsContact CG1-OE2 3.27Å; V208-E211 WeakPolarHBondContact CG1-OE2 3.33Å; V208-E211 PolarHBondContact O-N 2.66Å
209A86.9Confident90.6Very high0 Ų063.5 Ų63.50%032%0.319CS..G310 helixtrans-66.3-29.8-175.300000112.7I173 F204 G207 E211 L212 R217I173-A209 HydrophobicContact CD1-CB 3.35Å; I173-A209 HydrophobicContact CG1-CB 4.21Å; F204-A209 HydrophobicContact CD2-CB 3.73Å; F204-A209 HydrophobicContact CE2-CB 4.08Å; F204-A209 HydrophobicContact CG-CB 4.27Å; G207-A209 VanDerWaalsContact C-N 3.27Å; G207-A209 PolarHBondContact O-N 2.65Å; A209-E211 PolarHBondContact O-N 2.7Å; A209-L212 VanDerWaalsContact O-CB 3.25Å; A209-L212 WeakPolarHBondContact O-CB 3.48Å; A209-L212 PolarHBondContact O-N 3.26Å; A209-R217 WeakPolarHBondContact O-CD 3.26Å
210K85.7Confident90.6Very high124 Ų12460 Ų6054%0.53930%0.297SS..G310 helixtrans-62-24.6179.3-70.8-179.9172.7173.70113.6E170 V208 L212E170-K210 WeakPolarHBondContact OE1-CE 3.24Å; E170-K210 IonicContact OE1-NZ 2.63Å; E170-K210 PolarHBondContact OE1-NZ 2.97Å; V208-K210 VanDerWaalsContact C-N 3.27Å; V208-K210 PolarHBondContact O-N 3Å; K210-L212 VanDerWaalsContact C-N 3.3Å
211E88.5Confident90.4Very high148 Ų14855 Ų5569%0.69228%0.277SS*.G310 helixtrans-82.4-8.2175.1-62.6-177.9-177.200113.1V208 A209V208-E211 HydrophobicContact CG1-CB 4.1Å; V208-E211 HydrophobicContact CG1-CG 3.71Å; V208-E211 VanDerWaalsContact CG1-OE2 3.27Å; V208-E211 WeakPolarHBondContact CG1-OE2 3.33Å; V208-E211 PolarHBondContact O-N 2.66Å; A209-E211 PolarHBondContact O-N 2.7Å
212L90.3Very high90.2Very high11 Ų1155.8 Ų55.86%0.05828%0.282CS..SBendtrans-85.1150.7179.4-57.3178.1000110.8Y200 K203 F204 A209 K210 V216 R217Y200-L212 HydrophobicContact CD1-CD2 3.57Å; Y200-L212 HydrophobicContact CE1-CD2 4.28Å; Y200-L212 HydrophobicContact CG-CD2 4.45Å; K203-L212 HydrophobicContact CB-CD1 4.28Å; K203-L212 HydrophobicContact CB-CD2 3.98Å; K203-L212 HydrophobicContact CB-CG 4.46Å; K203-L212 HydrophobicContact CD-CD2 3.99Å; F204-L212 HydrophobicContact CB-CD1 3.67Å; F204-L212 HydrophobicContact CD2-CD1 4.06Å; F204-L212 HydrophobicContact CG-CD1 4.38Å; A209-L212 VanDerWaalsContact O-CB 3.25Å; A209-L212 WeakPolarHBondContact O-CB 3.48Å; A209-L212 PolarHBondContact O-N 3.26Å; K210-L212 VanDerWaalsContact C-N 3.3Å; L212-V216 HydrophobicContact CB-CB 4.37Å; L212-V216 HydrophobicContact CB-CG1 4.28Å; L212-V216 HydrophobicContact CD1-CG1 4Å; L212-R217 HydrophobicContact CB-CG 4.22Å
213S90.5Very high90.1Very high69 Ų6954.5 Ų54.548%0.48327%0.273SS..  trans-61.5148.4175.466.80000111.2R215 V216 R217S213-R215 PolarHBondContact O-N 2.68Å; S213-R215 VanDerWaalsContact O-N 3.14Å; S213-V216 PolarHBondContact O-N 3.41Å; S213-V216 WeakPolarHBondContact OG-CG2 3.48Å; S213-R217 PolarHBondContact O-N 3.12Å
214E87.1Confident89.9Confident111 Ų11150.2 Ų50.252%0.51925%0.254SS..Hα-helixtrans-53.9-37.3177.7-159.3-156.1142.300111.7K165 V216 R217 N218K165-E214 IonicContact NZ-OE1 2.66Å; K165-E214 PolarHBondContact NZ-OE1 3.46Å; E214-V216 VanDerWaalsContact C-N 3.35Å; E214-V216 PolarHBondContact O-N 3.4Å; E214-R217 PolarHBondContact O-N 3.41Å; E214-N218 VanDerWaalsContact O-CB 3.31Å; E214-N218 WeakPolarHBondContact O-CB 3.25Å; E214-N218 PolarHBondContact O-N 2.89Å; E214-N218 PolarHBondContact O-ND2 3.24Å; E214-N218 PolarHBondContact O-OD1 3.05Å; E214-N218 PolarHBondContact OE1-ND2 3.34Å
215R88.6Confident89.6Confident189 Ų18950.2 Ų50.271%0.71325%0.254SS*.Hα-helixtrans-54.6-47.2174.2-178.2-177174.2102.11.9112.6S213 N218 L219S213-R215 PolarHBondContact O-N 2.68Å; S213-R215 VanDerWaalsContact O-N 3.14Å; R215-N218 PolarHBondContact O-N 3.25Å; R215-L219 HydrophobicContact CG-CD1 4.44Å; R215-L219 WeakPolarHBondContact O-CG 3.44Å; R215-L219 PolarHBondContact O-N 3.47Å
216V90.7Very high89.2Confident16 Ų1649.9 Ų49.910%0.09725%0.253CS..Hα-helixtrans-67.2-43-178.41710000110.5I196 L212 S213 E214 L219 M220I196-V216 HydrophobicContact CD1-CG1 4.12Å; I196-V216 HydrophobicContact CG2-CG1 4.02Å; L212-V216 HydrophobicContact CB-CB 4.37Å; L212-V216 HydrophobicContact CB-CG1 4.28Å; L212-V216 HydrophobicContact CD1-CG1 4Å; S213-V216 PolarHBondContact O-N 3.41Å; S213-V216 WeakPolarHBondContact OG-CG2 3.48Å; E214-V216 VanDerWaalsContact C-N 3.35Å; E214-V216 PolarHBondContact O-N 3.4Å; V216-L219 PolarHBondContact O-N 3.17Å; V216-M220 WeakPolarHBondContact O-CG 3.3Å; V216-M220 PolarHBondContact O-N 2.85Å
217R91.2Very high88.8Confident50 Ų5044.9 Ų44.919%0.18923%0.226CC..Hα-helixtrans-63.1-44.4176.4-63.4-169.9-72-179.79.3112E169 F204 A209 L212 S213 E214 L219 M220 F221E169-R217 WeakPolarHBondContact OE1-CD 3.46Å; E169-R217 IonicContact OE1-CZ 3.35Å; E169-R217 IonicContact OE1-NE 2.81Å; E169-R217 IonicContact OE1-NH1 3.07Å; E169-R217 PolarHBondContact OE1-NH1 2.68Å; E169-R217 IonicContact OE2-CZ 2.71Å; E169-R217 IonicContact OE2-NH1 2.94Å; E169-R217 PolarHBondContact OE2-NH1 3.4Å; F204-R217 HydrophobicContact CD2-CG 4.42Å; F204-R217 HydrophobicContact CE2-CB 4.39Å; F204-R217 HydrophobicContact CE2-CG 4.25Å; A209-R217 WeakPolarHBondContact O-CD 3.26Å; L212-R217 HydrophobicContact CB-CG 4.22Å; S213-R217 PolarHBondContact O-N 3.12Å; E214-R217 PolarHBondContact O-N 3.41Å; R217-L219 VanDerWaalsContact C-N 3.31Å; R217-L219 PolarHBondContact O-N 3.12Å; R217-M220 WeakPolarHBondContact O-CA 3.48Å; R217-M220 WeakPolarHBondContact O-CB 3.4Å; R217-M220 PolarHBondContact O-N 3.46Å; R217-F221 HydrophobicContact CB-CD2 4.48Å; R217-F221 HydrophobicContact CB-CE2 3.93Å; R217-F221 HydrophobicContact CB-CZ 4.34Å; R217-F221 VanDerWaalsContact O-CD2 3.24Å; R217-F221 WeakPolarHBondContact O-CD2 3.44Å; R217-F221 VanDerWaalsContact O-CG 3.3Å; R217-F221 WeakPolarHBondContact O-CG 3.46Å; R217-F221 PolarHBondContact O-N 3.17Å
218N90Very high88.7Confident33 Ų3347 Ų4718%0.17622%0.222CC..Hα-helixtrans-58.9-43.3176.3-67.5-13.3000111.3K165 E214 R215 M220 F221 T222K165-N218 WeakPolarHBondContact CE-OD1 3.4Å; K165-N218 VanDerWaalsContact NZ-CG 3.3Å; K165-N218 PolarHBondContact NZ-ND2 3.48Å; K165-N218 PolarHBondContact NZ-OD1 2.95Å; E214-N218 VanDerWaalsContact O-CB 3.31Å; E214-N218 WeakPolarHBondContact O-CB 3.25Å; E214-N218 PolarHBondContact O-N 2.89Å; E214-N218 PolarHBondContact O-ND2 3.24Å; E214-N218 PolarHBondContact O-OD1 3.05Å; E214-N218 PolarHBondContact OE1-ND2 3.34Å; R215-N218 PolarHBondContact O-N 3.25Å; N218-M220 VanDerWaalsContact C-N 3.33Å; N218-M220 PolarHBondContact O-N 2.96Å; N218-F221 PolarHBondContact O-N 3.37Å; N218-T222 VanDerWaalsContact O-CB 3.29Å; N218-T222 WeakPolarHBondContact O-CB 3Å; N218-T222 PolarHBondContact O-N 2.9Å; N218-T222 PolarHBondContact O-OG1 3.48Å
219L91.3Very high88Confident51 Ų5147.3 Ų47.327%0.26723%0.227SC..Hα-helixtrans-62.1-39.3174.4-73.7170.9000112.5I196 R215 V216 R217 W223I196-L219 HydrophobicContact CD1-CB 3.72Å; I196-L219 HydrophobicContact CD1-CD1 4.45Å; I196-L219 HydrophobicContact CG1-CB 4.13Å; I196-L219 HydrophobicContact CG1-CD1 3.96Å; R215-L219 HydrophobicContact CG-CD1 4.44Å; R215-L219 WeakPolarHBondContact O-CG 3.44Å; R215-L219 PolarHBondContact O-N 3.47Å; V216-L219 PolarHBondContact O-N 3.17Å; R217-L219 VanDerWaalsContact C-N 3.31Å; R217-L219 PolarHBondContact O-N 3.12Å; L219-W223 VanDerWaalsContact O-CB 3.25Å; L219-W223 WeakPolarHBondContact O-CB 3.18Å; L219-W223 PolarHBondContact O-N 3.09Å
220M92.1Very high87.3Confident0 Ų050.7 Ų50.70%025%0.245CC..Hα-helixtrans-65.8-42.5175.5-70.9-62.7-68.100112I190 T194 I196 V201 F204 V216 R217 N218 W223 Y224I190-M220 HydrophobicContact CG2-CE 4.09Å; I190-M220 HydrophobicContact CG2-SD 4.16Å; T194-M220 HydrophobicContact CG2-SD 4.17Å; I196-M220 HydrophobicContact CD1-CG 3.63Å; I196-M220 HydrophobicContact CD1-SD 3.54Å; I196-M220 VanDerWaalsContact CD1-SD 3.54Å; V201-M220 HydrophobicContact CG1-CE 4.46Å; V201-M220 HydrophobicContact CG2-SD 4.44Å; F204-M220 HydrophobicContact CB-CE 4.41Å; F204-M220 HydrophobicContact CB-CG 4.47Å; F204-M220 HydrophobicContact CD1-CB 4.29Å; F204-M220 HydrophobicContact CD1-CE 3.39Å; F204-M220 HydrophobicContact CD1-CG 4.06Å; F204-M220 HydrophobicContact CD2-CB 4.01Å; F204-M220 HydrophobicContact CD2-CG 3.73Å; F204-M220 HydrophobicContact CE1-CB 3.9Å; F204-M220 HydrophobicContact CE1-CE 3.73Å; F204-M220 HydrophobicContact CE1-CG 4.19Å; F204-M220 HydrophobicContact CE2-CB 3.6Å; F204-M220 HydrophobicContact CE2-CG 3.88Å; F204-M220 HydrophobicContact CG-CB 4.34Å; F204-M220 HydrophobicContact CG-CE 3.95Å; F204-M220 HydrophobicContact CG-CG 3.82Å; F204-M220 HydrophobicContact CZ-CB 3.53Å; F204-M220 HydrophobicContact CZ-CG 4.1Å; V216-M220 WeakPolarHBondContact O-CG 3.3Å; V216-M220 PolarHBondContact O-N 2.85Å; R217-M220 WeakPolarHBondContact O-CA 3.48Å; R217-M220 WeakPolarHBondContact O-CB 3.4Å; R217-M220 PolarHBondContact O-N 3.46Å; N218-M220 VanDerWaalsContact C-N 3.33Å; N218-M220 PolarHBondContact O-N 2.96Å; M220-W223 HydrophobicContact CE-CE3 4.38Å; M220-W223 HydrophobicContact CE-CZ3 4.47Å; M220-W223 PolarHBondContact O-N 3.39Å; M220-Y224 WeakPolarHBondContact O-CB 3.41Å; M220-Y224 PolarHBondContact O-N 2.9Å
221F91.4Very high86.6Confident8 Ų848.5 Ų48.54%0.03524%0.244CC..Hα-helixtrans-67.4-45.4177.1-59.9-37.9000112L161 E169 I172 I176 F204 R217 N218 W223 Y224 I225L161-F221 HydrophobicContact CD1-CB 3.43Å; L161-F221 VanDerWaalsContact CD1-CB 3.43Å; L161-F221 HydrophobicContact CD1-CD2 4.48Å; L161-F221 HydrophobicContact CD1-CG 4.4Å; E169-F221 HydrophobicContact CG-CZ 3.85Å; I172-F221 HydrophobicContact CB-CE1 4.49Å; I172-F221 HydrophobicContact CG2-CD1 3.89Å; I172-F221 HydrophobicContact CG2-CE1 3.71Å; I176-F221 HydrophobicContact CD1-CD1 3.79Å; I176-F221 HydrophobicContact CD1-CE1 4.07Å; F204-F221 HydrophobicContact CE2-CE1 4.19Å; F204-F221 HydrophobicContact CE2-CZ 4.43Å; F204-F221 HydrophobicContact CZ-CD1 4.25Å; F204-F221 AromaticContact CZ-CE1 3.78Å; F204-F221 HydrophobicContact CZ-CE1 3.78Å; F204-F221 HydrophobicContact CZ-CZ 4.44Å; R217-F221 HydrophobicContact CB-CD2 4.48Å; R217-F221 HydrophobicContact CB-CE2 3.93Å; R217-F221 HydrophobicContact CB-CZ 4.34Å; R217-F221 VanDerWaalsContact O-CD2 3.24Å; R217-F221 WeakPolarHBondContact O-CD2 3.44Å; R217-F221 VanDerWaalsContact O-CG 3.3Å; R217-F221 WeakPolarHBondContact O-CG 3.46Å; R217-F221 PolarHBondContact O-N 3.17Å; N218-F221 PolarHBondContact O-N 3.37Å; F221-W223 VanDerWaalsContact C-N 3.31Å; F221-W223 PolarHBondContact O-N 2.9Å; F221-Y224 WeakPolarHBondContact O-CB 3.2Å; F221-Y224 PolarHBondContact O-N 2.91Å; F221-Y224 VanDerWaalsContact O-N 3.14Å; F221-I225 WeakPolarHBondContact O-CG1 3.44Å; F221-I225 PolarHBondContact O-N 2.9Å
222T89.5Confident85.6Confident17 Ų1748.5 Ų48.510%0.10424%0.244CC..Hα-helixtrans-55.9-47.5173.5-68.80000111.1F150 L152 N218 Y224 I225 V226F150-T222 HydrophobicContact CB-CG2 4.38Å; F150-T222 WeakPolarHBondContact O-CG2 3.43Å; L152-T222 HydrophobicContact CD1-CG2 4.36Å; L152-T222 HydrophobicContact CD2-CG2 3.9Å; L152-T222 HydrophobicContact CG-CG2 3.81Å; N218-T222 VanDerWaalsContact O-CB 3.29Å; N218-T222 WeakPolarHBondContact O-CB 3Å; N218-T222 PolarHBondContact O-N 2.9Å; N218-T222 PolarHBondContact O-OG1 3.48Å; T222-Y224 VanDerWaalsContact C-N 3.34Å; T222-Y224 PolarHBondContact O-N 3.49Å; T222-I225 PolarHBondContact O-N 2.81Å; T222-V226 VanDerWaalsContact O-CG2 3.29Å; T222-V226 WeakPolarHBondContact O-CG2 3.42Å; T222-V226 PolarHBondContact O-N 3.36Å; T222-V226 VanDerWaalsContact O-N 3.12Å
223W90.5Very high84.6Confident2 Ų249.6 Ų49.61%0.00825%0.249CC..Hα-helixtrans-59.5-45.7175.616776.6000111.9I176 F179 V180 L185 I190 M193 T194 L219 M220 F221 I225 V226 F227I176-W223 HydrophobicContact CG2-CZ3 4.08Å; F179-W223 HydrophobicContact CD1-CH2 4.38Å; F179-W223 HydrophobicContact CE1-CH2 4.34Å; V180-W223 HydrophobicContact CG2-CH2 3.79Å; V180-W223 HydrophobicContact CG2-CZ3 4.21Å; L185-W223 HydrophobicContact CD1-CH2 3.93Å; L185-W223 HydrophobicContact CD1-CZ2 3.77Å; I190-W223 HydrophobicContact CB-CZ2 4.46Å; I190-W223 HydrophobicContact CD1-CH2 3.75Å; I190-W223 HydrophobicContact CD1-CZ2 4.12Å; I190-W223 HydrophobicContact CD1-CZ3 4.37Å; I190-W223 HydrophobicContact CG1-CH2 3.88Å; I190-W223 HydrophobicContact CG1-CZ2 3.7Å; I190-W223 HydrophobicContact CG2-CD2 4.17Å; I190-W223 HydrophobicContact CG2-CE3 4.25Å; I190-W223 HydrophobicContact CG2-CH2 4.28Å; I190-W223 HydrophobicContact CG2-CZ2 4.19Å; I190-W223 HydrophobicContact CG2-CZ3 4.3Å; M193-W223 HydrophobicContact CE-CZ2 4.11Å; T194-W223 HydrophobicContact CG2-CB 3.58Å; T194-W223 HydrophobicContact CG2-CD2 4.13Å; T194-W223 HydrophobicContact CG2-CG 3.52Å; L219-W223 VanDerWaalsContact O-CB 3.25Å; L219-W223 WeakPolarHBondContact O-CB 3.18Å; L219-W223 PolarHBondContact O-N 3.09Å; M220-W223 HydrophobicContact CE-CE3 4.38Å; M220-W223 HydrophobicContact CE-CZ3 4.47Å; M220-W223 PolarHBondContact O-N 3.39Å; F221-W223 VanDerWaalsContact C-N 3.31Å; F221-W223 PolarHBondContact O-N 2.9Å; W223-I225 PolarHBondContact O-N 3.14Å; W223-V226 PolarHBondContact O-N 2.95Å; W223-F227 AromaticContact CD1-CD2 3.36Å; W223-F227 AromaticContact CD1-CE2 3.33Å; W223-F227 HydrophobicContact CG-CD2 4.18Å; W223-F227 HydrophobicContact CG-CE2 4.46Å; W223-F227 AromaticContact NE1-CD2 3.27Å; W223-F227 VanDerWaalsContact NE1-CD2 3.27Å; W223-F227 AromaticContact NE1-CE2 3.29Å; W223-F227 VanDerWaalsContact NE1-CE2 3.29Å; W223-F227 AromaticContact NE1-CG 3.8Å; W223-F227 AromaticContact NE1-CZ 3.85Å; W223-F227 VanDerWaalsContact O-CD2 3.24Å; W223-F227 WeakPolarHBondContact O-CD2 3.34Å; W223-F227 PolarHBondContact O-N 3.29Å; W223-F227 VanDerWaalsContact O-N 3.12Å
224Y91.1Very high83.3Confident4 Ų447.2 Ų47.22%0.01623%0.231CC..Hα-helixtrans-58.9-48.1179.1171.1-111.1000112.6E175 I176 F179 M220 F221 T222 F227 K228E175-Y224 WeakPolarHBondContact CG-OH 3.48Å; E175-Y224 PolarHBondContact OE1-OH 2.84Å; I176-Y224 HydrophobicContact CB-CD2 4.4Å; I176-Y224 HydrophobicContact CD1-CD1 4.28Å; I176-Y224 HydrophobicContact CD1-CG 4.01Å; I176-Y224 HydrophobicContact CG1-CD1 3.91Å; I176-Y224 HydrophobicContact CG1-CD2 3.61Å; I176-Y224 HydrophobicContact CG1-CE1 4.35Å; I176-Y224 HydrophobicContact CG1-CE2 4.06Å; I176-Y224 HydrophobicContact CG1-CG 3.52Å; F179-Y224 HydrophobicContact CB-CD2 4.41Å; F179-Y224 HydrophobicContact CB-CE2 3.83Å; F179-Y224 HydrophobicContact CD1-CD2 4.14Å; F179-Y224 HydrophobicContact CD1-CE2 4.24Å; F179-Y224 HydrophobicContact CD2-CE2 4.08Å; F179-Y224 HydrophobicContact CG-CD2 4.18Å; F179-Y224 AromaticContact CG-CE2 3.8Å; F179-Y224 HydrophobicContact CG-CE2 3.8Å; M220-Y224 WeakPolarHBondContact O-CB 3.41Å; M220-Y224 PolarHBondContact O-N 2.9Å; F221-Y224 WeakPolarHBondContact O-CB 3.2Å; F221-Y224 PolarHBondContact O-N 2.91Å; F221-Y224 VanDerWaalsContact O-N 3.14Å; T222-Y224 VanDerWaalsContact C-N 3.34Å; T222-Y224 PolarHBondContact O-N 3.49Å; Y224-F227 PolarHBondContact O-N 2.72Å; Y224-K228 HydrophobicContact CE1-CD 4.02Å; Y224-K228 VanDerWaalsContact O-CB 3.25Å; Y224-K228 WeakPolarHBondContact O-CB 3.49Å; Y224-K228 PolarHBondContact O-N 2.88Å; Y224-K228 WeakPolarHBondContact OH-CD 3.42Å; Y224-K228 WeakPolarHBondContact OH-CE 3.49Å; Y224-K228 PolarHBondContact OH-NZ 3.01Å
225I87.5Confident82.2Confident0 Ų048.8 Ų48.80%024%0.243CC..Hα-helixtrans-59.1-51179.2-66.4163.1000110.7L152 Q157 E160 L161 L164 F221 T222 W223 F227 K228 S229L152-I225 HydrophobicContact CD2-CB 4.23Å; L152-I225 HydrophobicContact CD2-CD1 4.47Å; L152-I225 HydrophobicContact CD2-CG2 4.04Å; Q157-I225 HydrophobicContact CB-CG2 3.9Å; Q157-I225 HydrophobicContact CG-CG2 4Å; E160-I225 HydrophobicContact CG-CG1 4.46Å; E160-I225 WeakPolarHBondContact OE2-CG2 3.44Å; L161-I225 HydrophobicContact CB-CD1 3.58Å; L161-I225 HydrophobicContact CD1-CD1 3.92Å; L161-I225 HydrophobicContact CG-CD1 4.35Å; L164-I225 HydrophobicContact CD1-CD1 3.53Å; L164-I225 HydrophobicContact CD1-CG1 3.48Å; L164-I225 VanDerWaalsContact CD1-CG1 3.48Å; F221-I225 WeakPolarHBondContact O-CG1 3.44Å; F221-I225 PolarHBondContact O-N 2.9Å; T222-I225 PolarHBondContact O-N 2.81Å; W223-I225 PolarHBondContact O-N 3.14Å; I225-F227 VanDerWaalsContact C-N 3.27Å; I225-F227 PolarHBondContact O-N 3.29Å; I225-K228 PolarHBondContact O-N 3.05Å; I225-S229 PolarHBondContact O-N 2.91Å; I225-S229 PolarHBondContact O-OG 3.35Å; I225-S229 VanDerWaalsContact O-OG 3.14Å
226V84.2Confident81Confident11 Ų1147 Ų477%0.06724%0.243CC..Hα-helixtrans-57.4-42.5-177.9170.80000111.6F150 L152 T222 W223 N230 I233F150-V226 HydrophobicContact CD1-CG1 3.91Å; F150-V226 HydrophobicContact CE1-CG1 4.31Å; L152-V226 HydrophobicContact CD2-CG2 3.88Å; T222-V226 VanDerWaalsContact O-CG2 3.29Å; T222-V226 WeakPolarHBondContact O-CG2 3.42Å; T222-V226 PolarHBondContact O-N 3.36Å; T222-V226 VanDerWaalsContact O-N 3.12Å; W223-V226 PolarHBondContact O-N 2.95Å; V226-N230 PolarHBondContact O-N 3.18Å; V226-N230 PolarHBondContact O-ND2 3.21Å; V226-I233 HydrophobicContact CG1-CD1 4.14Å
227F83Confident79.5Confident0 Ų048 Ų480%025%0.246CC..Hα-helixtrans-81.4-24.6-178.3-83-96.6000113.7F150 F179 M193 W223 Y224 I225 N230 I233 L234 F237F150-F227 HydrophobicContact CD1-CE2 4.44Å; F150-F227 AromaticContact CE1-CE2 3.78Å; F150-F227 HydrophobicContact CE1-CE2 3.78Å; F150-F227 HydrophobicContact CE1-CZ 4.24Å; F150-F227 HydrophobicContact CE2-CE2 4.11Å; F150-F227 AromaticContact CZ-CE2 3.57Å; F150-F227 HydrophobicContact CZ-CE2 3.57Å; F150-F227 AromaticContact CZ-CZ 3.84Å; F150-F227 HydrophobicContact CZ-CZ 3.84Å; F179-F227 HydrophobicContact CE1-CB 4.21Å; F179-F227 HydrophobicContact CZ-CB 4.01Å; M193-F227 HydrophobicContact CE-CE1 4.3Å; M193-F227 HydrophobicContact CE-CZ 4.14Å; M193-F227 HydrophobicContact CG-CZ 4.36Å; M193-F227 HydrophobicContact SD-CE1 3.65Å; M193-F227 HydrophobicContact SD-CE2 4.11Å; M193-F227 HydrophobicContact SD-CZ 3.23Å; M193-F227 WeakPolarHBondContact SD-CZ 3.46Å; W223-F227 AromaticContact CD1-CD2 3.36Å; W223-F227 AromaticContact CD1-CE2 3.33Å; W223-F227 HydrophobicContact CG-CD2 4.18Å; W223-F227 HydrophobicContact CG-CE2 4.46Å; W223-F227 AromaticContact NE1-CD2 3.27Å; W223-F227 VanDerWaalsContact NE1-CD2 3.27Å; W223-F227 AromaticContact NE1-CE2 3.29Å; W223-F227 VanDerWaalsContact NE1-CE2 3.29Å; W223-F227 AromaticContact NE1-CG 3.8Å; W223-F227 AromaticContact NE1-CZ 3.85Å; W223-F227 VanDerWaalsContact O-CD2 3.24Å; W223-F227 WeakPolarHBondContact O-CD2 3.34Å; W223-F227 PolarHBondContact O-N 3.29Å; W223-F227 VanDerWaalsContact O-N 3.12Å; Y224-F227 PolarHBondContact O-N 2.72Å; I225-F227 VanDerWaalsContact C-N 3.27Å; I225-F227 PolarHBondContact O-N 3.29Å; F227-N230 CarbonylContact O-C 3.59Å; F227-I233 HydrophobicContact CD1-CB 4.46Å; F227-I233 HydrophobicContact CD1-CG2 4.28Å; F227-I233 HydrophobicContact CE1-CB 4.12Å; F227-I233 HydrophobicContact CE1-CG2 3.55Å; F227-I233 HydrophobicContact CE2-CG2 4.26Å; F227-I233 HydrophobicContact CZ-CG2 3.54Å; F227-L234 HydrophobicContact CD1-CD2 3.32Å; F227-L234 HydrophobicContact CD1-CG 3.72Å; F227-L234 HydrophobicContact CE1-CD2 3.51Å; F227-L234 HydrophobicContact CE1-CG 4.1Å; F227-F237 HydrophobicContact CE1-CD2 4.06Å; F227-F237 AromaticContact CZ-CD2 3.68Å; F227-F237 HydrophobicContact CZ-CD2 3.68Å; F227-F237 AromaticContact CZ-CE2 3.89Å; F227-F237 HydrophobicContact CZ-CE2 3.89Å
228K82.9Confident77.6Confident88 Ų8848.2 Ų48.238%0.38325%0.254SS..Hα-helixtrans-68.2-44.7172.2-173.4-176-172.41660110.7E175 Y224 I225E175-K228 IonicContact OE1-NZ 3.57Å; E175-K228 PolarHBondContact OE1-NZ 3.13Å; Y224-K228 HydrophobicContact CE1-CD 4.02Å; Y224-K228 VanDerWaalsContact O-CB 3.25Å; Y224-K228 WeakPolarHBondContact O-CB 3.49Å; Y224-K228 PolarHBondContact O-N 2.88Å; Y224-K228 WeakPolarHBondContact OH-CD 3.42Å; Y224-K228 WeakPolarHBondContact OH-CE 3.49Å; Y224-K228 PolarHBondContact OH-NZ 3.01Å; I225-K228 PolarHBondContact O-N 3.05Å
229S75.4Confident75.7Confident61 Ų6148.5 Ų48.543%0.42726%0.257SS..Hα-helixtrans-72.7-29178.9-46.20000113I225I225-S229 PolarHBondContact O-N 2.91Å; I225-S229 PolarHBondContact O-OG 3.35Å; I225-S229 VanDerWaalsContact O-OG 3.14Å
230N72.6Confident73.4Confident72 Ų7247.4 Ų47.439%0.38525%0.253SS..  trans-130.779.5-174.7-57.7-70.9000111.1V226 F227 E232 I233V226-N230 PolarHBondContact O-N 3.18Å; V226-N230 PolarHBondContact O-ND2 3.21Å; F227-N230 CarbonylContact O-C 3.59Å; N230-E232 PolarHBondContact O-N 3.02Å; N230-I233 HydrophobicContact CB-CD1 3.39Å; N230-I233 HydrophobicContact CB-CG1 3.66Å; N230-I233 WeakPolarHBondContact O-CB 3.2Å; N230-I233 PolarHBondContact O-N 3.23Å
231P70.7Confident71.1Confident78 Ų7851.1 Ų51.151%0.50628%0.28SS..THydrogen-bonded Turntrans-64.4-23.6179.126.2-34.4000112.8I233 L234P231-I233 PolarHBondContact O-N 2.89Å; P231-L234 VanDerWaalsContact O-CB 3.26Å; P231-L234 WeakPolarHBondContact O-CB 3.05Å; P231-L234 PolarHBondContact O-N 3.48Å
232E67.6Low68.7Low147 Ų14757.5 Ų57.569%0.68730%0.304SS*.THydrogen-bonded Turntrans-61.9-27.3177.8-59.6-161.6170.200113.1N230 L234 N235 E236N230-E232 PolarHBondContact O-N 3.02Å; E232-L234 PolarHBondContact O-N 2.92Å; E232-L234 VanDerWaalsContact O-N 3.16Å; E232-N235 WeakPolarHBondContact O-CB 3.12Å; E232-N235 PolarHBondContact O-N 2.86Å; E232-E236 PolarHBondContact O-N 3.12Å
233I68.3Low66.7Low34 Ų3462.5 Ų62.517%0.17433%0.329CS..Hα-helixtrans-60.1-28.5176.5-63.2-177.9000110.5V226 F227 N230 P231 N235 E236 F237V226-I233 HydrophobicContact CG1-CD1 4.14Å; F227-I233 HydrophobicContact CD1-CB 4.46Å; F227-I233 HydrophobicContact CD1-CG2 4.28Å; F227-I233 HydrophobicContact CE1-CB 4.12Å; F227-I233 HydrophobicContact CE1-CG2 3.55Å; F227-I233 HydrophobicContact CE2-CG2 4.26Å; F227-I233 HydrophobicContact CZ-CG2 3.54Å; N230-I233 HydrophobicContact CB-CD1 3.39Å; N230-I233 HydrophobicContact CB-CG1 3.66Å; N230-I233 WeakPolarHBondContact O-CB 3.2Å; N230-I233 PolarHBondContact O-N 3.23Å; P231-I233 PolarHBondContact O-N 2.89Å; I233-N235 PolarHBondContact O-N 3.22Å; I233-E236 PolarHBondContact O-N 3.01Å; I233-F237 HydrophobicContact CG2-CD2 3.34Å; I233-F237 HydrophobicContact CG2-CE2 3.22Å; I233-F237 VanDerWaalsContact O-CD2 3.22Å; I233-F237 WeakPolarHBondContact O-CD2 3.47Å; I233-F237 PolarHBondContact O-N 3.22Å
234L64.5Low64.5Low20 Ų2071.6 Ų71.611%0.10537%0.369CS..Hα-helixtrans-64.7-24.9173.9-66.7174.3000113.8N183 L185 F227 P231 E232N183-L234 HydrophobicContact CB-CD1 3.97Å; L185-L234 HydrophobicContact CD1-CD2 3.93Å; L185-L234 HydrophobicContact CD2-CD1 4.21Å; L185-L234 HydrophobicContact CD2-CD2 3.44Å; L185-L234 VanDerWaalsContact CD2-CD2 3.44Å; L185-L234 HydrophobicContact CD2-CG 4.41Å; L185-L234 HydrophobicContact CG-CD2 4.35Å; F227-L234 HydrophobicContact CD1-CD2 3.32Å; F227-L234 HydrophobicContact CD1-CG 3.72Å; F227-L234 HydrophobicContact CE1-CD2 3.51Å; F227-L234 HydrophobicContact CE1-CG 4.1Å; P231-L234 VanDerWaalsContact O-CB 3.26Å; P231-L234 WeakPolarHBondContact O-CB 3.05Å; P231-L234 PolarHBondContact O-N 3.48Å; E232-L234 PolarHBondContact O-N 2.92Å; E232-L234 VanDerWaalsContact O-N 3.16Å
235N63.4Low61.9Low143 Ų14376 Ų7677%0.76540%0.401SS*.Hα-helixtrans-82.8-33176.4-63.2-33000111.4E232 I233E232-N235 WeakPolarHBondContact O-CB 3.12Å; E232-N235 PolarHBondContact O-N 2.86Å; I233-N235 PolarHBondContact O-N 3.22Å
236E61.9Low59.6Low153 Ų15387 Ų8772%0.71544%0.442SS*.Hα-helixtrans-74.9-39.5177.3-65.8-169.3168.400112.4E232 I233 P238E232-E236 PolarHBondContact O-N 3.12Å; I233-E236 PolarHBondContact O-N 3.01Å; E236-P238 WeakPolarHBondContact O-CD 3.47Å
237F59.5Low57.7Low36 Ų3692.4 Ų92.416%0.15848%0.475CS..SBendtrans-71.7123.2170-75.9-73.3000107.9F150 M193 F227 I233 T239F150-F237 AromaticContact CE1-CE2 3.94Å; F150-F237 HydrophobicContact CE1-CE2 3.94Å; F150-F237 HydrophobicContact CE1-CZ 4.04Å; F150-F237 HydrophobicContact CE2-CZ 4.46Å; F150-F237 HydrophobicContact CZ-CD2 4.48Å; F150-F237 HydrophobicContact CZ-CE1 4.32Å; F150-F237 AromaticContact CZ-CE2 3.54Å; F150-F237 HydrophobicContact CZ-CE2 3.54Å; F150-F237 AromaticContact CZ-CZ 3.46Å; F150-F237 HydrophobicContact CZ-CZ 3.46Å; F150-F237 VanDerWaalsContact CZ-CZ 3.46Å; M193-F237 HydrophobicContact CG-CD1 3.97Å; M193-F237 HydrophobicContact CG-CD2 4.48Å; M193-F237 HydrophobicContact CG-CE1 4.39Å; M193-F237 HydrophobicContact CG-CG 4.04Å; M193-F237 HydrophobicContact SD-CB 3.88Å; M193-F237 HydrophobicContact SD-CD1 4.29Å; M193-F237 HydrophobicContact SD-CD2 3.94Å; M193-F237 HydrophobicContact SD-CG 3.74Å; F227-F237 HydrophobicContact CE1-CD2 4.06Å; F227-F237 AromaticContact CZ-CD2 3.68Å; F227-F237 HydrophobicContact CZ-CD2 3.68Å; F227-F237 AromaticContact CZ-CE2 3.89Å; F227-F237 HydrophobicContact CZ-CE2 3.89Å; I233-F237 HydrophobicContact CG2-CD2 3.34Å; I233-F237 HydrophobicContact CG2-CE2 3.22Å; I233-F237 VanDerWaalsContact O-CD2 3.22Å; I233-F237 WeakPolarHBondContact O-CD2 3.47Å; I233-F237 PolarHBondContact O-N 3.22Å; F237-T239 PolarHBondContact O-N 2.97Å
238P52.7Low55.7Low55 Ų5598.1 Ų98.136%0.35751%0.51SS..  trans-72.694.3178.838.1-38.1000103.6E236 S240E236-P238 WeakPolarHBondContact O-CD 3.47Å; P238-S240 CarbonylContact C-O 3.11Å; P238-S240 WeakPolarHBondContact CA-O 3.19Å; P238-S240 WeakPolarHBondContact CB-O 3.48Å; P238-S240 CarbonylContact O-C 3.57Å; P238-S240 PolarHBondContact O-N 3.07Å
239T50.4Low53.7Low38 Ų38102.2 Ų102.223%0.23353%0.53CS..SBendtrans-52.9-36162.6-51.30000106.1R186 F237R186-T239 PolarHBondContact NH2-O 3.4Å; F237-T239 PolarHBondContact O-N 2.97Å
240S41.8Very low52.2Low28 Ų28105.8 Ų105.820%0.19655%0.55CS..SBendtrans-64.2141.7162.3-171.10000114.6P238 Y242 E258P238-S240 CarbonylContact C-O 3.11Å; P238-S240 WeakPolarHBondContact CA-O 3.19Å; P238-S240 WeakPolarHBondContact CB-O 3.48Å; P238-S240 CarbonylContact O-C 3.57Å; P238-S240 PolarHBondContact O-N 3.07Å; S240-Y242 PolarHBondContact O-N 3.36Å; S240-Y242 WeakPolarHBondContact OG-CD2 3.44Å; S240-Y242 WeakPolarHBondContact OG-CE2 3.46Å; S240-E258 VanDerWaalsContact CA-CG 3.49Å; S240-E258 WeakPolarHBondContact CA-OE1 3.31Å; S240-E258 PolarHBondContact N-OE1 3.05Å; S240-E258 WeakPolarHBondContact OG-CG 3.46Å
241S43.7Very low50.9Low79 Ų79112 Ų11255%0.55257%0.573SS**  trans-70.239.8-177.8-57.40000114.5I243S241-I243 PolarHBondContact O-N 3.23Å
242Y40.8Very low49.6Very low141 Ų141116.9 Ų116.955%0.55359%0.589SS**  trans-78.957.6172.2-68.3-72.6000111.4S240 K244S240-Y242 PolarHBondContact O-N 3.36Å; S240-Y242 WeakPolarHBondContact OG-CD2 3.44Å; S240-Y242 WeakPolarHBondContact OG-CE2 3.46Å; Y242-K244 VanDerWaalsContact C-N 3.27Å; Y242-K244 PolarHBondContact O-N 3.03Å; Y242-K244 VanDerWaalsContact O-N 3.12Å
243I48.4Very low48.6Very low123 Ų123121.2 Ų121.263%0.63160%0.599SS**  trans-77.492.3153.8-59.7-176.1000106.1Y192 S241 S245Y192-I243 HydrophobicContact CE2-CD1 4.28Å; S241-I243 PolarHBondContact O-N 3.23Å; I243-S245 PolarHBondContact O-N 2.95Å
244K43.3Very low48Very low192 Ų192127.4 Ų127.484%0.83563%0.632SS**  trans-8.891.2163.1-61.1169.5-177.3173.90114.9Y242 R246Y242-K244 VanDerWaalsContact C-N 3.27Å; Y242-K244 PolarHBondContact O-N 3.03Å; Y242-K244 VanDerWaalsContact O-N 3.12Å; K244-R246 PolarHBondContact O-N 3.3Å
245S38.1Very low47.4Very low98 Ų98132.5 Ų132.569%0.68566%0.655SS**  trans-85.573.2150.2-62.80000108.3I243 T247I243-S245 PolarHBondContact O-N 2.95Å; S245-T247 PolarHBondContact O-N 2.92Å
246R38.2Very low46.9Very low231 Ų231136.5 Ų136.587%0.87266%0.659SS**  trans-85.769163.6-170.2-178.8-81.6-141.2-1.1107.3K244K244-R246 PolarHBondContact O-N 3.3Å
247T43.7Very low46.7Very low124 Ų124139.7 Ų139.776%0.76167%0.665SS**  trans-127111.2165.238.90000107.7S245S245-T247 PolarHBondContact O-N 2.92Å
248V41.9Very low46.6Very low119 Ų119141.6 Ų141.672%0.72167%0.674SS**  trans-63.2144.9-175.2-154.70000109.3
249Q41.5Very low47.4Very low175 Ų175149.4 Ų149.482%0.81870%0.697SS**  trans75.860.9157.9-42.5-169.11400119.4
250T41.9Very low49Very low136 Ų136153.6 Ų153.683%0.83471%0.712SS**SBendtrans-162.3122.1146.1-13.70000111.4E252T250-E252 PolarHBondContact O-N 2.86Å
251K47.1Very low50.9Low201 Ų201156 Ų15687%0.87473%0.729SS**THydrogen-bonded Turntrans5.798.7167.7-71178.9174.2-1790116.4R253K251-R253 PolarHBondContact O-N 3.22Å
252E42.4Very low53.1Low182 Ų182158.2 Ų158.285%0.8573%0.729SS**THydrogen-bonded Turntrans3060148.3-65.5-175.4146.100117.6T250 L254T250-E252 PolarHBondContact O-N 2.86Å; E252-L254 VanDerWaalsContact C-N 3.34Å; E252-L254 PolarHBondContact O-N 2.99Å
253R46.5Very low55.3Low238 Ų238153.9 Ų153.990%0.89871%0.713SS**  trans-73.598154.1-83.6-173.9159127.8-2.6107.7K251 Q255K251-R253 PolarHBondContact O-N 3.22Å; R253-Q255 PolarHBondContact O-N 3.33Å
254L55.3Low57.3Low164 Ų164153.6 Ų153.686%0.85971%0.709SS**  trans-45.9114.1172.5-67.7172.7000108.6E252 R256E252-L254 VanDerWaalsContact C-N 3.34Å; E252-L254 PolarHBondContact O-N 2.99Å; L254-R256 PolarHBondContact O-N 3.29Å
255Q53.6Low59.6Low127 Ų127146.7 Ų146.759%0.59368%0.68SS**  trans-54.2124.9177.8-70173.6-2.600108R253 R257R253-Q255 PolarHBondContact O-N 3.33Å; Q255-R257 PolarHBondContact O-N 2.93Å
256R52.1Low62.3Low226 Ų226142.3 Ų142.385%0.85365%0.648SS**  trans-61.4105-177177.8172.1-91.7120.7-5.3108.6L254L254-R256 PolarHBondContact O-N 3.29Å
257R56.8Low64.9Low221 Ų221133.8 Ų133.883%0.83462%0.619SS**  trans-64.9153.9175.3-65.6177.979.6-162.64.9109.7Q255 R259Q255-R257 PolarHBondContact O-N 2.93Å; R257-R259 PolarHBondContact O-N 3.39Å
258E58.5Low67.3Low75 Ų75132 Ų13235%0.3561%0.605SS.*  trans-56.9139.1173.5-62.7-162.5114.300111.6R186 S240 F260R186-E258 IonicContact CZ-OE1 3.83Å; R186-E258 VanDerWaalsContact NH1-CD 3.33Å; R186-E258 IonicContact NH1-OE1 2.94Å; R186-E258 PolarHBondContact NH1-OE1 3.05Å; R186-E258 IonicContact NH1-OE2 2.61Å; R186-E258 IonicContact NH2-OE1 3.95Å; R186-E258 PolarHBondContact NH2-OE1 2.93Å; S240-E258 VanDerWaalsContact CA-CG 3.49Å; S240-E258 WeakPolarHBondContact CA-OE1 3.31Å; S240-E258 PolarHBondContact N-OE1 3.05Å; S240-E258 WeakPolarHBondContact OG-CG 3.46Å; E258-F260 PolarHBondContact O-N 3.21Å
259R69.8Low69.8Low220 Ų220127.3 Ų127.383%0.8358%0.577SS**  trans-74.4115.9172.6-165.5173.3-172.6-111.23.2108.7R257R257-R259 PolarHBondContact O-N 3.39Å
260F83.8Confident72.4Confident126 Ų126121.7 Ų121.755%0.55355%0.552SS**  trans-58.4138170.4177.5-99.6000110.4E258 F262 H266E258-F260 PolarHBondContact O-N 3.21Å; F260-F262 HydrophobicContact CD1-CD2 4.17Å; F260-F262 HydrophobicContact CD1-CE1 4.44Å; F260-F262 HydrophobicContact CD1-CE2 4.08Å; F260-F262 HydrophobicContact CD1-CG 4.39Å; F260-F262 HydrophobicContact CD1-CZ 4.22Å; F260-F262 HydrophobicContact CE1-CB 4.49Å; F260-F262 AromaticContact CE1-CD1 3.63Å; F260-F262 HydrophobicContact CE1-CD1 3.63Å; F260-F262 HydrophobicContact CE1-CD2 4Å; F260-F262 AromaticContact CE1-CE1 3.68Å; F260-F262 HydrophobicContact CE1-CE1 3.68Å; F260-F262 HydrophobicContact CE1-CE2 4.06Å; F260-F262 AromaticContact CE1-CG 3.78Å; F260-F262 HydrophobicContact CE1-CG 3.78Å; F260-F262 AromaticContact CE1-CZ 3.89Å; F260-F262 HydrophobicContact CE1-CZ 3.89Å; F260-F262 HydrophobicContact CZ-CD1 4.44Å; F260-H266 AromaticContact CZ-CE1 3.64Å; F260-H266 AromaticContact CZ-ND1 3.62Å
261S82.1Confident75Confident79 Ų79119.9 Ų119.955%0.55253%0.534SS*.  trans-117124.2174.8-60.50000109
262F88.6Confident77.3Confident124 Ų124116.6 Ų116.654%0.54452%0.522SS..  trans-67134175.6-71.6-88.3000109.8F260 H266 I267 L270F260-F262 HydrophobicContact CD1-CD2 4.17Å; F260-F262 HydrophobicContact CD1-CE1 4.44Å; F260-F262 HydrophobicContact CD1-CE2 4.08Å; F260-F262 HydrophobicContact CD1-CG 4.39Å; F260-F262 HydrophobicContact CD1-CZ 4.22Å; F260-F262 HydrophobicContact CE1-CB 4.49Å; F260-F262 AromaticContact CE1-CD1 3.63Å; F260-F262 HydrophobicContact CE1-CD1 3.63Å; F260-F262 HydrophobicContact CE1-CD2 4Å; F260-F262 AromaticContact CE1-CE1 3.68Å; F260-F262 HydrophobicContact CE1-CE1 3.68Å; F260-F262 HydrophobicContact CE1-CE2 4.06Å; F260-F262 AromaticContact CE1-CG 3.78Å; F260-F262 HydrophobicContact CE1-CG 3.78Å; F260-F262 AromaticContact CE1-CZ 3.89Å; F260-F262 HydrophobicContact CE1-CZ 3.89Å; F260-F262 HydrophobicContact CZ-CD1 4.44Å; F262-H266 HydrophobicContact CB-CB 4.43Å; F262-H266 HydrophobicContact CD1-CB 3.78Å; F262-I267 HydrophobicContact CB-CD1 3.58Å; F262-I267 HydrophobicContact CB-CG1 4.2Å; F262-I267 HydrophobicContact CG-CD1 4.21Å; F262-L270 HydrophobicContact CD1-CD1 3.67Å; F262-L270 HydrophobicContact CE1-CD1 3.68Å
263K88.1Confident79.8Confident50 Ų50110.3 Ų110.322%0.21749%0.49CS..  trans-89.7161.8173.1-54.4-175.5-175171.50109.2Q184 Q265 H266 I267 L296Q184-K263 VanDerWaalsContact OE1-CE 3.28Å; K263-Q265 PolarHBondContact O-N 3.35Å; K263-Q265 VanDerWaalsContact O-N 3.12Å; K263-H266 PolarHBondContact N-ND1 3.5Å; K263-H266 WeakPolarHBondContact O-CB 3.39Å; K263-H266 PolarHBondContact O-N 3.48Å; K263-I267 WeakPolarHBondContact O-CG1 3.33Å; K263-I267 PolarHBondContact O-N 3.07Å; K263-L296 HydrophobicContact CD-CD1 3.77Å
264Q90.8Very high82.1Confident118 Ų118105.4 Ų105.455%0.55148%0.476SS*.Hα-helixtrans-54-36.8179.7-168.459.243.300112.5H266 I267 N268Q264-H266 PolarHBondContact O-N 2.79Å; Q264-I267 PolarHBondContact O-N 3.34Å; Q264-N268 PolarHBondContact NE2-OD1 3.01Å; Q264-N268 PolarHBondContact O-N 3.06Å; Q264-N268 PolarHBondContact O-OD1 3.07Å; Q264-N268 VanDerWaalsContact O-OD1 3.12Å
265Q90.8Very high84Confident47 Ų47105.7 Ų105.722%0.2247%0.47CS..Hα-helixtrans-57.4-47.1174.6-63.483.5-1100112.3K263 I267 N268 V269 E295 C299K263-Q265 PolarHBondContact O-N 3.35Å; K263-Q265 VanDerWaalsContact O-N 3.12Å; Q265-I267 VanDerWaalsContact C-N 3.34Å; Q265-N268 PolarHBondContact O-N 2.93Å; Q265-V269 WeakPolarHBondContact O-CG2 3.49Å; Q265-V269 PolarHBondContact O-N 3.23Å; Q265-E295 HydrophobicContact CB-CG 4.11Å; Q265-C299 HydrophobicContact CG-CB 4.19Å; Q265-C299 WeakPolarHBondContact CG-SG 3.42Å
266H94Very high85.8Confident5 Ų5103.5 Ų103.52%0.02347%0.474CS..Hα-helixtrans-65.1-42.5177.2-50.1152.4000110.3F260 F262 K263 Q264 N268 V269 L270F260-H266 AromaticContact CZ-CE1 3.64Å; F260-H266 AromaticContact CZ-ND1 3.62Å; F262-H266 HydrophobicContact CB-CB 4.43Å; F262-H266 HydrophobicContact CD1-CB 3.78Å; K263-H266 PolarHBondContact N-ND1 3.5Å; K263-H266 WeakPolarHBondContact O-CB 3.39Å; K263-H266 PolarHBondContact O-N 3.48Å; Q264-H266 PolarHBondContact O-N 2.79Å; H266-N268 VanDerWaalsContact C-N 3.34Å; H266-N268 PolarHBondContact O-N 3.41Å; H266-V269 PolarHBondContact O-N 3.08Å; H266-L270 WeakPolarHBondContact O-CB 3.47Å; H266-L270 WeakPolarHBondContact O-CG 3.49Å; H266-L270 PolarHBondContact O-N 3.22Å
267I94.3Very high87.5Confident53 Ų5397 Ų9727%0.27245%0.453SS..Hα-helixtrans-59.8-44.8178.3-59.2-56.5000110.9F262 K263 Q264 Q265 V269 L270 E271F262-I267 HydrophobicContact CB-CD1 3.58Å; F262-I267 HydrophobicContact CB-CG1 4.2Å; F262-I267 HydrophobicContact CG-CD1 4.21Å; K263-I267 WeakPolarHBondContact O-CG1 3.33Å; K263-I267 PolarHBondContact O-N 3.07Å; Q264-I267 PolarHBondContact O-N 3.34Å; Q265-I267 VanDerWaalsContact C-N 3.34Å; I267-V269 VanDerWaalsContact C-N 3.33Å; I267-V269 PolarHBondContact O-N 3.15Å; I267-L270 HydrophobicContact CD1-CD1 4.42Å; I267-L270 CarbonylContact O-C 3.54Å; I267-L270 PolarHBondContact O-N 3.3Å; I267-L270 VanDerWaalsContact O-N 3.14Å; I267-E271 HydrophobicContact CG2-CG 4.08Å; I267-E271 WeakPolarHBondContact CG2-OE1 3.45Å; I267-E271 WeakPolarHBondContact O-CB 3.46Å; I267-E271 WeakPolarHBondContact O-CG 3.49Å; I267-E271 PolarHBondContact O-N 2.94Å
268N94.3Very high89.2Confident86 Ų8689.2 Ų89.246%0.4643%0.431SS..Hα-helixtrans-59.4-43.1178.6-65.6-4.4000112.2Q264 Q265 H266 H272Q264-N268 PolarHBondContact NE2-OD1 3.01Å; Q264-N268 PolarHBondContact O-N 3.06Å; Q264-N268 PolarHBondContact O-OD1 3.07Å; Q264-N268 VanDerWaalsContact O-OD1 3.12Å; Q265-N268 PolarHBondContact O-N 2.93Å; H266-N268 VanDerWaalsContact C-N 3.34Å; H266-N268 PolarHBondContact O-N 3.41Å; N268-H272 PolarHBondContact O-N 3.41Å; N268-H272 VanDerWaalsContact O-N 3.16Å
269V94.6Very high90.9Very high21 Ų2195.4 Ų95.413%0.12745%0.453CS..Hα-helixtrans-63-49174.4175.50000109.9Q265 H266 I267 E271 H272 Y273 A291 E295Q265-V269 WeakPolarHBondContact O-CG2 3.49Å; Q265-V269 PolarHBondContact O-N 3.23Å; H266-V269 PolarHBondContact O-N 3.08Å; I267-V269 VanDerWaalsContact C-N 3.33Å; I267-V269 PolarHBondContact O-N 3.15Å; V269-E271 PolarHBondContact O-N 3.45Å; V269-H272 WeakPolarHBondContact O-CB 3.48Å; V269-H272 PolarHBondContact O-N 3.2Å; V269-Y273 HydrophobicContact CG1-CD2 3.88Å; V269-Y273 HydrophobicContact CG1-CE2 3.85Å; V269-Y273 WeakPolarHBondContact O-CD2 3.48Å; V269-Y273 PolarHBondContact O-N 3.46Å; V269-Y273 VanDerWaalsContact O-N 3.12Å; V269-A291 HydrophobicContact CG1-CB 3.81Å; V269-E295 HydrophobicContact CG2-CB 4.02Å; V269-E295 HydrophobicContact CG2-CG 4.18Å
270L96Very high92Very high57 Ų5786.3 Ų86.330%0.29842%0.422SS..Hα-helixtrans-61-42-179.1-69.6168000112.5F262 H266 I267 H272 Y273 F274 I288F262-L270 HydrophobicContact CD1-CD1 3.67Å; F262-L270 HydrophobicContact CE1-CD1 3.68Å; H266-L270 WeakPolarHBondContact O-CB 3.47Å; H266-L270 WeakPolarHBondContact O-CG 3.49Å; H266-L270 PolarHBondContact O-N 3.22Å; I267-L270 HydrophobicContact CD1-CD1 4.42Å; I267-L270 CarbonylContact O-C 3.54Å; I267-L270 PolarHBondContact O-N 3.3Å; I267-L270 VanDerWaalsContact O-N 3.14Å; L270-H272 VanDerWaalsContact C-N 3.32Å; L270-H272 PolarHBondContact O-N 2.93Å; L270-Y273 PolarHBondContact O-N 3.4Å; L270-F274 WeakPolarHBondContact O-CB 3.35Å; L270-F274 PolarHBondContact O-N 2.91Å; L270-I288 HydrophobicContact CD2-CG2 3.54Å
271E96.4Very high92.4Very high97 Ų9784.4 Ų84.445%0.45342%0.418SS..Hα-helixtrans-63.9-35.9176.4-76-178.6-175.100112.4I267 V269 K275I267-E271 HydrophobicContact CG2-CG 4.08Å; I267-E271 WeakPolarHBondContact CG2-OE1 3.45Å; I267-E271 WeakPolarHBondContact O-CB 3.46Å; I267-E271 WeakPolarHBondContact O-CG 3.49Å; I267-E271 PolarHBondContact O-N 2.94Å; V269-E271 PolarHBondContact O-N 3.45Å; E271-K275 VanDerWaalsContact O-CG 3.3Å; E271-K275 WeakPolarHBondContact O-CG 3.44Å; E271-K275 PolarHBondContact O-N 3.22Å
272H94.7Very high92.9Very high133 Ų13384.5 Ų84.562%0.61642%0.415SS*.Hα-helixtrans-64-50.4175.6178.975.6000111.3N268 V269 L270 K275 A276N268-H272 PolarHBondContact O-N 3.41Å; N268-H272 VanDerWaalsContact O-N 3.16Å; V269-H272 WeakPolarHBondContact O-CB 3.48Å; V269-H272 PolarHBondContact O-N 3.2Å; L270-H272 VanDerWaalsContact C-N 3.32Å; L270-H272 PolarHBondContact O-N 2.93Å; H272-K275 PolarHBondContact O-N 3.02Å; H272-A276 PolarHBondContact O-N 3.44Å
273Y94.7Very high93.1Very high49 Ų4985.5 Ų85.519%0.19242%0.416CS..Hα-helixtrans-66.3-39178.1-81-88000112.3V269 L270 K275 A276 E277 M284 I288 A291V269-Y273 HydrophobicContact CG1-CD2 3.88Å; V269-Y273 HydrophobicContact CG1-CE2 3.85Å; V269-Y273 WeakPolarHBondContact O-CD2 3.48Å; V269-Y273 PolarHBondContact O-N 3.46Å; V269-Y273 VanDerWaalsContact O-N 3.12Å; L270-Y273 PolarHBondContact O-N 3.4Å; Y273-K275 VanDerWaalsContact C-N 3.28Å; Y273-K275 PolarHBondContact O-N 3.4Å; Y273-A276 PolarHBondContact O-N 3.08Å; Y273-A276 VanDerWaalsContact O-N 3.12Å; Y273-E277 PolarHBondContact O-N 2.91Å; Y273-M284 HydrophobicContact CD1-CG 4.45Å; Y273-M284 HydrophobicContact CD1-SD 3.9Å; Y273-M284 HydrophobicContact CE1-SD 3.69Å; Y273-I288 HydrophobicContact CD1-CD1 3.94Å; Y273-I288 HydrophobicContact CD1-CG1 3.48Å; Y273-I288 VanDerWaalsContact CD1-CG1 3.48Å; Y273-I288 HydrophobicContact CD2-CG1 3.77Å; Y273-I288 HydrophobicContact CE1-CG1 3.83Å; Y273-I288 HydrophobicContact CE2-CG1 4.11Å; Y273-I288 HydrophobicContact CG-CD1 3.92Å; Y273-I288 HydrophobicContact CG-CG1 3.45Å; Y273-I288 VanDerWaalsContact CG-CG1 3.45Å; Y273-A291 HydrophobicContact CE2-CB 4.2Å
274F95.4Very high93.3Very high135 Ų13586 Ų8659%0.59242%0.42SS*.Hα-helixtrans-62.1-34.7178.9-177.2-101.7000112.8L270 A276 P278L270-F274 WeakPolarHBondContact O-CB 3.35Å; L270-F274 PolarHBondContact O-N 2.91Å; F274-A276 VanDerWaalsContact C-N 3.34Å; F274-P278 HydrophobicContact CD2-CB 4.19Å; F274-P278 HydrophobicContact CE2-CB 3.88Å; F274-P278 HydrophobicContact CZ-CB 4.4Å; F274-P278 WeakPolarHBondContact O-CG 3.37Å
275K94Very high93.5Very high170 Ų17087 Ų8774%0.73942%0.419SS*.Hα-helixtrans-69-31.9175.7-75.2170.9-176.1172.30113E271 H272 Y273E271-K275 VanDerWaalsContact O-CG 3.3Å; E271-K275 WeakPolarHBondContact O-CG 3.44Å; E271-K275 PolarHBondContact O-N 3.22Å; H272-K275 PolarHBondContact O-N 3.02Å; Y273-K275 VanDerWaalsContact C-N 3.28Å; Y273-K275 PolarHBondContact O-N 3.4Å
276A91.4Very high93.7Very high82 Ų8291.1 Ų91.168%0.67844%0.436SS*.Hα-helixtrans-83.2-48.9-179.500000111.8H272 Y273 F274H272-A276 PolarHBondContact O-N 3.44Å; Y273-A276 PolarHBondContact O-N 3.08Å; Y273-A276 VanDerWaalsContact O-N 3.12Å; F274-A276 VanDerWaalsContact C-N 3.34Å
277E89.2Confident93.7Very high89 Ų8995.8 Ų95.842%0.41646%0.458SS..  trans-144.499.1-178.6-179.551.1-106.900109.9Y273 Y279Y273-E277 PolarHBondContact O-N 2.91Å; E277-Y279 PolarHBondContact O-N 3.42Å; E277-Y279 PolarHBondContact OE1-N 3.42Å
278P92.9Very high93.8Very high58 Ų5894.1 Ų94.138%0.37745%0.449SS..SBendtrans-63-21.2178.7-22.733000114F274 P280F274-P278 HydrophobicContact CD2-CB 4.19Å; F274-P278 HydrophobicContact CE2-CB 3.88Å; F274-P278 HydrophobicContact CZ-CB 4.4Å; F274-P278 WeakPolarHBondContact O-CG 3.37Å; P278-P280 VanDerWaalsContact C-CD 3.46Å; P278-P280 VanDerWaalsContact O-CD 3.31Å; P278-P280 WeakPolarHBondContact O-CD 3.42Å
279Y92.8Very high93.8Very high205 Ų20592.3 Ų92.380%0.80445%0.446SS*.SBendtrans-122.270.6-175.2-59.8-76.2000112E277 N281E277-Y279 PolarHBondContact O-N 3.42Å; E277-Y279 PolarHBondContact OE1-N 3.42Å; Y279-N281 PolarHBondContact O-N 3.34Å
280P92.2Very high93.9Very high28 Ų2895.8 Ų95.818%0.18247%0.468CS..  trans-67.3135.1-175.827.5-35.3000112.3P278 M284 R285 I288P278-P280 VanDerWaalsContact C-CD 3.46Å; P278-P280 VanDerWaalsContact O-CD 3.31Å; P278-P280 WeakPolarHBondContact O-CD 3.42Å; P280-M284 HydrophobicContact CB-CB 3.75Å; P280-M284 HydrophobicContact CB-CG 3.6Å; P280-R285 HydrophobicContact CB-CG 3.92Å; P280-R285 HydrophobicContact CG-CG 3.75Å; P280-R285 PolarHBondContact O-NH1 3.42Å; P280-I288 HydrophobicContact CB-CD1 3.94Å; P280-I288 HydrophobicContact CG-CD1 4.03Å
281N92.5Very high93.8Very high87 Ų8794.3 Ų94.347%0.46546%0.464SS..  trans-67.8176170.571.930.3000111.8Y279 Y283 M284 R285Y279-N281 PolarHBondContact O-N 3.34Å; N281-Y283 VanDerWaalsContact C-N 3.29Å; N281-Y283 PolarHBondContact O-N 2.94Å; N281-Y283 PolarHBondContact OD1-N 3.09Å; N281-M284 PolarHBondContact O-N 3.3Å; N281-M284 WeakPolarHBondContact OD1-CB 3.48Å; N281-M284 PolarHBondContact OD1-N 3.23Å; N281-R285 WeakPolarHBondContact O-CG 3.27Å; N281-R285 PolarHBondContact O-N 3.04Å
282V92.8Very high93.8Very high80 Ų8090.2 Ų90.249%0.48545%0.446SS..Hα-helixtrans-59.4-37.6-176.4-179.50000112.9K286V282-K286 WeakPolarHBondContact O-CG 3.36Å; V282-K286 PolarHBondContact O-N 2.8Å
283Y93.8Very high93.7Very high146 Ų14688.2 Ų88.257%0.57344%0.439SS*.Hα-helixtrans-69.8-47.5179.4-62.2-81.3000111.3N281 R285 K286 E287N281-Y283 VanDerWaalsContact C-N 3.29Å; N281-Y283 PolarHBondContact O-N 2.94Å; N281-Y283 PolarHBondContact OD1-N 3.09Å; Y283-R285 VanDerWaalsContact C-N 3.3Å; Y283-R285 PolarHBondContact O-N 3.13Å; Y283-K286 WeakPolarHBondContact O-CB 3.5Å; Y283-K286 PolarHBondContact O-N 3.12Å; Y283-K286 VanDerWaalsContact O-N 3.07Å; Y283-E287 PolarHBondContact O-N 3.37Å
284M91.3Very high93.6Very high59 Ų5991 Ų9129%0.29145%0.454SS..Hα-helixtrans-60.5-39.6176.5-170.367.876.100111.2Y273 P280 N281 K286 E287 I288Y273-M284 HydrophobicContact CD1-CG 4.45Å; Y273-M284 HydrophobicContact CD1-SD 3.9Å; Y273-M284 HydrophobicContact CE1-SD 3.69Å; P280-M284 HydrophobicContact CB-CB 3.75Å; P280-M284 HydrophobicContact CB-CG 3.6Å; N281-M284 PolarHBondContact O-N 3.3Å; N281-M284 WeakPolarHBondContact OD1-CB 3.48Å; N281-M284 PolarHBondContact OD1-N 3.23Å; M284-K286 VanDerWaalsContact C-N 3.33Å; M284-K286 PolarHBondContact O-N 3.46Å; M284-E287 WeakPolarHBondContact O-CB 3.37Å; M284-E287 PolarHBondContact O-N 3.36Å; M284-I288 HydrophobicContact CG-CD1 4.11Å; M284-I288 WeakPolarHBondContact O-CB 3.25Å; M284-I288 WeakPolarHBondContact O-CG1 3.47Å; M284-I288 PolarHBondContact O-N 3.16Å
285R95.7Very high93.4Very high140 Ų14087.2 Ų87.253%0.52844%0.438SS..Hα-helixtrans-62.1-37.5174.4-72.4-166-63.4-110.914.7113.2P280 N281 Y283 A289P280-R285 HydrophobicContact CB-CG 3.92Å; P280-R285 HydrophobicContact CG-CG 3.75Å; P280-R285 PolarHBondContact O-NH1 3.42Å; N281-R285 WeakPolarHBondContact O-CG 3.27Å; N281-R285 PolarHBondContact O-N 3.04Å; Y283-R285 VanDerWaalsContact C-N 3.3Å; Y283-R285 PolarHBondContact O-N 3.13Å; R285-A289 WeakPolarHBondContact O-CB 3.38Å; R285-A289 PolarHBondContact O-N 3.26Å
286K94.9Very high93Very high133 Ų13380.8 Ų80.858%0.57841%0.411SS*.Hα-helixtrans-67.2-41.8174.2-72.3176.8178.6178.90111V282 Y283 M284 A289 T290V282-K286 WeakPolarHBondContact O-CG 3.36Å; V282-K286 PolarHBondContact O-N 2.8Å; Y283-K286 WeakPolarHBondContact O-CB 3.5Å; Y283-K286 PolarHBondContact O-N 3.12Å; Y283-K286 VanDerWaalsContact O-N 3.07Å; M284-K286 VanDerWaalsContact C-N 3.33Å; M284-K286 PolarHBondContact O-N 3.46Å; K286-A289 PolarHBondContact O-N 3Å; K286-T290 PolarHBondContact O-N 3.32Å; K286-T290 PolarHBondContact O-OG1 3.04Å
287E94.8Very high92.8Very high104 Ų10482.1 Ų82.149%0.48640%0.404SS..Hα-helixtrans-61.2-47.4175.6-171.1178.5173.900111.8Y283 M284 A289 T290 A291Y283-E287 PolarHBondContact O-N 3.37Å; M284-E287 WeakPolarHBondContact O-CB 3.37Å; M284-E287 PolarHBondContact O-N 3.36Å; E287-A289 VanDerWaalsContact C-N 3.3Å; E287-A289 PolarHBondContact O-N 2.95Å; E287-T290 WeakPolarHBondContact O-CB 3.39Å; E287-T290 PolarHBondContact O-N 3.14Å; E287-T290 VanDerWaalsContact O-N 3.14Å; E287-A291 WeakPolarHBondContact O-CB 3.43Å; E287-A291 PolarHBondContact O-N 2.89Å
288I95.3Very high92.6Very high17 Ų1785 Ų859%0.08741%0.411CS..Hα-helixtrans-55.5-45.5173.8-69.6165.5000111.1L270 Y273 P280 M284 A291 C292L270-I288 HydrophobicContact CD2-CG2 3.54Å; Y273-I288 HydrophobicContact CD1-CD1 3.94Å; Y273-I288 HydrophobicContact CD1-CG1 3.48Å; Y273-I288 VanDerWaalsContact CD1-CG1 3.48Å; Y273-I288 HydrophobicContact CD2-CG1 3.77Å; Y273-I288 HydrophobicContact CE1-CG1 3.83Å; Y273-I288 HydrophobicContact CE2-CG1 4.11Å; Y273-I288 HydrophobicContact CG-CD1 3.92Å; Y273-I288 HydrophobicContact CG-CG1 3.45Å; Y273-I288 VanDerWaalsContact CG-CG1 3.45Å; P280-I288 HydrophobicContact CB-CD1 3.94Å; P280-I288 HydrophobicContact CG-CD1 4.03Å; M284-I288 HydrophobicContact CG-CD1 4.11Å; M284-I288 WeakPolarHBondContact O-CB 3.25Å; M284-I288 WeakPolarHBondContact O-CG1 3.47Å; M284-I288 PolarHBondContact O-N 3.16Å; I288-A291 PolarHBondContact O-N 2.92Å; I288-C292 WeakPolarHBondContact O-CB 3.25Å; I288-C292 PolarHBondContact O-N 3.32Å; I288-C292 PolarHBondContact O-SG 3.39Å
289A95.4Very high91.9Very high48 Ų4884 Ų8440%0.39741%0.405SS..Hα-helixtrans-62.9-43.9178.300000111.6R285 K286 E287 C292 N293R285-A289 WeakPolarHBondContact O-CB 3.38Å; R285-A289 PolarHBondContact O-N 3.26Å; K286-A289 PolarHBondContact O-N 3Å; E287-A289 VanDerWaalsContact C-N 3.3Å; E287-A289 PolarHBondContact O-N 2.95Å; A289-C292 PolarHBondContact O-N 3.17Å; A289-N293 VanDerWaalsContact O-CG 3.31Å; A289-N293 PolarHBondContact O-N 2.91Å; A289-N293 PolarHBondContact O-ND2 2.98Å
290T95.7Very high90.9Very high95 Ų9579.2 Ų79.258%0.58339%0.39SS*.Hα-helixtrans-61.9-44.7175.2-57.70000111.4K286 E287 C292 N293 H294K286-T290 PolarHBondContact O-N 3.32Å; K286-T290 PolarHBondContact O-OG1 3.04Å; E287-T290 WeakPolarHBondContact O-CB 3.39Å; E287-T290 PolarHBondContact O-N 3.14Å; E287-T290 VanDerWaalsContact O-N 3.14Å; T290-C292 PolarHBondContact O-N 3.32Å; T290-N293 PolarHBondContact O-N 3.12Å; T290-H294 WeakPolarHBondContact O-CB 3.38Å; T290-H294 PolarHBondContact O-N 3.36Å
291A95.1Very high89.9Confident26 Ų2682.6 Ų82.622%0.21541%0.406CS..Hα-helixtrans-61.9-42.2177.100000112.1V269 Y273 E287 I288 N293 H294 E295V269-A291 HydrophobicContact CG1-CB 3.81Å; Y273-A291 HydrophobicContact CE2-CB 4.2Å; E287-A291 WeakPolarHBondContact O-CB 3.43Å; E287-A291 PolarHBondContact O-N 2.89Å; I288-A291 PolarHBondContact O-N 2.92Å; A291-N293 PolarHBondContact O-N 2.85Å; A291-H294 PolarHBondContact O-N 3.09Å; A291-E295 WeakPolarHBondContact O-CB 3.33Å; A291-E295 PolarHBondContact O-N 3.02Å
292C95.3Very high88.4Confident11 Ų1180.3 Ų80.37%0.07440%0.403CS..Hα-helixtrans-61.5-43.2175.1-72.10000111.9I288 A289 T290 L296I288-C292 WeakPolarHBondContact O-CB 3.25Å; I288-C292 PolarHBondContact O-N 3.32Å; I288-C292 PolarHBondContact O-SG 3.39Å; A289-C292 PolarHBondContact O-N 3.17Å; T290-C292 PolarHBondContact O-N 3.32Å; C292-L296 WeakPolarHBondContact O-CB 3.46Å; C292-L296 PolarHBondContact O-N 3.48Å; C292-L296 VanDerWaalsContact O-N 3.09Å
293N93.1Very high86.8Confident90 Ų9083 Ų8348%0.48141%0.409SS..Hα-helixtrans-66.7-40.4178.1-70.2-30.4000111.9A289 T290 A291 L296 Q297A289-N293 VanDerWaalsContact O-CG 3.31Å; A289-N293 PolarHBondContact O-N 2.91Å; A289-N293 PolarHBondContact O-ND2 2.98Å; T290-N293 PolarHBondContact O-N 3.12Å; A291-N293 PolarHBondContact O-N 2.85Å; N293-L296 WeakPolarHBondContact O-CB 3.27Å; N293-L296 PolarHBondContact O-N 3.35Å; N293-Q297 WeakPolarHBondContact O-CG 3.47Å; N293-Q297 PolarHBondContact O-N 2.87Å; N293-Q297 VanDerWaalsContact O-N 3.09Å
294H92.3Very high84.7Confident108 Ų10882.4 Ų82.450%0.541%0.409SS..Hα-helixtrans-64.2-45.5177.1-176.2-103.2000111.6T290 A291 L296 Q297 R298T290-H294 WeakPolarHBondContact O-CB 3.38Å; T290-H294 PolarHBondContact O-N 3.36Å; A291-H294 PolarHBondContact O-N 3.09Å; H294-L296 VanDerWaalsContact C-N 3.25Å; H294-L296 PolarHBondContact O-N 3.41Å; H294-Q297 PolarHBondContact O-N 3.49Å; H294-Q297 VanDerWaalsContact O-N 3.12Å; H294-R298 WeakPolarHBondContact O-CG 3.28Å; H294-R298 PolarHBondContact O-N 2.95Å
295E90.7Very high82.9Confident56 Ų5685.4 Ų85.426%0.26243%0.426SS..Hα-helixtrans-64.2-33.2177.9-165.258.5-153.300112.1Q265 V269 A291 R298 C299Q265-E295 HydrophobicContact CB-CG 4.11Å; V269-E295 HydrophobicContact CG2-CB 4.02Å; V269-E295 HydrophobicContact CG2-CG 4.18Å; A291-E295 WeakPolarHBondContact O-CB 3.33Å; A291-E295 PolarHBondContact O-N 3.02Å; E295-R298 IonicContact OE2-NH1 2.65Å; E295-R298 PolarHBondContact OE2-NH1 3.49Å; E295-C299 PolarHBondContact O-N 2.84Å; E295-C299 VanDerWaalsContact O-N 3.15Å
296L86Confident80.8Confident34 Ų3481.9 Ų81.918%0.17843%0.426CS..Hα-helixtrans-65.2-39.8173.5-17965.1000112.6K263 C292 N293 H294 Q300K263-L296 HydrophobicContact CD-CD1 3.77Å; C292-L296 WeakPolarHBondContact O-CB 3.46Å; C292-L296 PolarHBondContact O-N 3.48Å; C292-L296 VanDerWaalsContact O-N 3.09Å; N293-L296 WeakPolarHBondContact O-CB 3.27Å; N293-L296 PolarHBondContact O-N 3.35Å; H294-L296 VanDerWaalsContact C-N 3.25Å; H294-L296 PolarHBondContact O-N 3.41Å; L296-Q300 WeakPolarHBondContact O-CG 3.24Å; L296-Q300 PolarHBondContact O-N 3.07Å
297Q86.7Confident78.9Confident111 Ų11178.3 Ų78.352%0.51942%0.422SS..Hα-helixtrans-67.8-46.8176.9-71.5171.28.700110.9N293 H294 C299 Q300 D301N293-Q297 WeakPolarHBondContact O-CG 3.47Å; N293-Q297 PolarHBondContact O-N 2.87Å; N293-Q297 VanDerWaalsContact O-N 3.09Å; H294-Q297 PolarHBondContact O-N 3.49Å; H294-Q297 VanDerWaalsContact O-N 3.12Å; Q297-C299 VanDerWaalsContact C-N 3.26Å; Q297-C299 PolarHBondContact O-N 2.84Å; Q297-Q300 WeakPolarHBondContact O-CA 3.34Å; Q297-Q300 WeakPolarHBondContact O-CB 3.43Å; Q297-Q300 PolarHBondContact O-N 2.96Å; Q297-D301 PolarHBondContact O-N 2.72Å
298R84.5Confident76.8Confident148 Ų14879.1 Ų79.156%0.55842%0.424SS*.Hα-helixtrans-54.8-41.1176.3-69.6-178.472.8-167.57.5113.1H294 E295 Q300 G302H294-R298 WeakPolarHBondContact O-CG 3.28Å; H294-R298 PolarHBondContact O-N 2.95Å; E295-R298 IonicContact OE2-NH1 2.65Å; E295-R298 PolarHBondContact OE2-NH1 3.49Å; R298-Q300 VanDerWaalsContact C-N 3.32Å; R298-G302 PolarHBondContact O-N 3.16Å
299C78.7Confident74.8Confident39 Ų3986 Ų8626%0.26446%0.456SS..Hα-helixtrans-72.4-22.1177.2-81.80000114Q265 E295 Q297 K303Q265-C299 HydrophobicContact CG-CB 4.19Å; Q265-C299 WeakPolarHBondContact CG-SG 3.42Å; E295-C299 PolarHBondContact O-N 2.84Å; E295-C299 VanDerWaalsContact O-N 3.15Å; Q297-C299 VanDerWaalsContact C-N 3.26Å; Q297-C299 PolarHBondContact O-N 2.84Å; C299-K303 WeakPolarHBondContact O-CG 3.41Å
300Q72.5Confident72.9Confident104 Ų10490.3 Ų90.349%0.48647%0.472SS..Hα-helixtrans-80-44.5172.3-72.3176.244.900110.5L296 Q297 R298 K303 F304L296-Q300 WeakPolarHBondContact O-CG 3.24Å; L296-Q300 PolarHBondContact O-N 3.07Å; Q297-Q300 WeakPolarHBondContact O-CA 3.34Å; Q297-Q300 WeakPolarHBondContact O-CB 3.43Å; Q297-Q300 PolarHBondContact O-N 2.96Å; R298-Q300 VanDerWaalsContact C-N 3.32Å; Q300-K303 PolarHBondContact O-N 2.94Å; Q300-F304 PolarHBondContact O-N 2.97Å; Q300-F304 VanDerWaalsContact O-N 3.15Å
301D71.3Confident71Confident98 Ų9894 Ų9452%0.52448%0.482SS..Hα-helixtrans-67.3-39.4179.6-61.9-23.9000112Q297 K303 F304 L305Q297-D301 PolarHBondContact O-N 2.72Å; D301-K303 VanDerWaalsContact C-N 3.26Å; D301-K303 PolarHBondContact O-N 2.9Å; D301-F304 WeakPolarHBondContact O-CB 3.43Å; D301-F304 PolarHBondContact O-N 3.34Å; D301-L305 PolarHBondContact O-N 3.04Å
302G61.5Low69Low39 Ų3997.7 Ų97.740%0.40251%0.507SS..Hα-helixtrans-62.4-32.7175.200000113.1R298 A306R298-G302 PolarHBondContact O-N 3.16Å; G302-A306 WeakPolarHBondContact O-CB 3.3Å; G302-A306 PolarHBondContact O-N 3.43Å; G302-A306 VanDerWaalsContact O-N 3.1Å
303K57.5Low66.4Low137 Ų137109.3 Ų109.360%0.59656%0.556SS**Hα-helixtrans-72.1-33172.9-72.8178.8-178.4-172.40112C299 Q300 D301 A307C299-K303 WeakPolarHBondContact O-CG 3.41Å; Q300-K303 PolarHBondContact O-N 2.94Å; D301-K303 VanDerWaalsContact C-N 3.26Å; D301-K303 PolarHBondContact O-N 2.9Å; K303-A307 PolarHBondContact O-N 2.83Å; K303-A307 VanDerWaalsContact O-N 3.17Å
304F51.3Low65Low134 Ų134110.3 Ų110.359%0.58856%0.56SS**Hα-helixtrans-70.8-37.3176.3-165-102.5000112.3Q300 D301 K308Q300-F304 PolarHBondContact O-N 2.97Å; Q300-F304 VanDerWaalsContact O-N 3.15Å; D301-F304 WeakPolarHBondContact O-CB 3.43Å; D301-F304 PolarHBondContact O-N 3.34Å; F304-K308 HydrophobicContact CE1-CD 4.39Å; F304-K308 PolarHBondContact O-N 3.49Å
305L52.7Low63.6Low121 Ų121110.4 Ų110.463%0.63456%0.563SS**Hα-helixtrans-72.2-36.9175.3-69.8174.2000112.8D301 A307 K308 H309D301-L305 PolarHBondContact O-N 3.04Å; L305-A307 VanDerWaalsContact C-N 3.34Å; L305-K308 PolarHBondContact O-N 3.4Å; L305-H309 PolarHBondContact O-N 3.17Å
306A52.5Low62.1Low66 Ų66113.4 Ų113.455%0.54558%0.58SS.*Hα-helixtrans-64.2-38.417400000112.1G302 K308 H309G302-A306 WeakPolarHBondContact O-CB 3.3Å; G302-A306 PolarHBondContact O-N 3.43Å; G302-A306 VanDerWaalsContact O-N 3.1Å; A306-K308 VanDerWaalsContact C-N 3.34Å; A306-K308 PolarHBondContact O-N 3.36Å; A306-H309 PolarHBondContact O-N 3.2Å
307A53.4Low60.7Low59 Ų59118.1 Ų118.149%0.48860%0.603SS.*Hα-helixtrans-64.7-35.517700000112.9K303 L305 H309K303-A307 PolarHBondContact O-N 2.83Å; K303-A307 VanDerWaalsContact O-N 3.17Å; L305-A307 VanDerWaalsContact C-N 3.34Å; A307-H309 VanDerWaalsContact C-N 3.32Å; A307-H309 PolarHBondContact O-N 3.21Å
308K51.7Low59.1Low121 Ų121118.6 Ų118.653%0.52661%0.609SS.*Hα-helixtrans-71.5-24.5177.6-76.2-169.7173.6-175.40114.2F304 L305 A306 D310 S312F304-K308 HydrophobicContact CE1-CD 4.39Å; F304-K308 PolarHBondContact O-N 3.49Å; L305-K308 PolarHBondContact O-N 3.4Å; A306-K308 VanDerWaalsContact C-N 3.34Å; A306-K308 PolarHBondContact O-N 3.36Å; K308-D310 VanDerWaalsContact C-N 3.34Å; K308-S312 PolarHBondContact O-OG 3.29Å
309H52.6Low57.4Low162 Ų162116.6 Ų116.675%0.7561%0.612SS**Hα-helixtrans-82.9-15.2-177.9-139.5-68.1000113.1L305 A306 A307L305-H309 PolarHBondContact O-N 3.17Å; A306-H309 PolarHBondContact O-N 3.2Å; A307-H309 VanDerWaalsContact C-N 3.32Å; A307-H309 PolarHBondContact O-N 3.21Å
310D55.5Low55.9Low138 Ų138122.1 Ų122.174%0.73864%0.637SS**Hα-helixtrans-92.9-20.3177.8-1367.7000112.6K308 S312K308-D310 VanDerWaalsContact C-N 3.34Å; D310-S312 VanDerWaalsContact C-N 3.33Å
311E55.6Low54.6Low171 Ų171123.5 Ų123.580%0.79965%0.648SS**THydrogen-bonded Turntrans-82.9-4.5173.8-76.5-174.9159.200114.1
312S53.4Low53.2Low104 Ų104125.7 Ų125.773%0.72766%0.659SS**THydrogen-bonded Turntrans-108.423.7-176-59.50000114K308 D310K308-S312 PolarHBondContact O-OG 3.29Å; D310-S312 VanDerWaalsContact C-N 3.33Å
313K40.8Very low52.4Low256 Ų256133.5 Ų133.5100%1.11368%0.682SS**  trans-130.20177.8-137.9-174.1-172.7-171.50112.1

Retrieved 313 of 313 residues in 123 ms (Link to these results)

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