A0A4W5M9U0_9TELE Loading...

Progestin and adipoQ receptor family member IIIb

AlphaFold DB , UniProt , Accession A0A4W5M9U0, Species 9TELE (Hucho hucho, huchen), Gene n/a, Length 315 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
1M43.4Very low45.8Very low214 Ų214112.8 Ų112.8100%1.05458%0.582SS**  0-27.60-65.5-171.4-166.800116.5H3M1-H3 VanDerWaalsContact C-N 3.33Å; M1-H3 PolarHBondContact O-N 3.39Å
2P50.3Low46.3Very low110 Ų110107.8 Ų107.871%0.71456%0.564SS**Hα-helixtrans-70.8-25.3-17726.7-32.9000114K4 L5 L6P2-K4 PolarHBondContact O-N 3.36Å; P2-L5 PolarHBondContact O-N 3Å; P2-L6 WeakPolarHBondContact O-CB 3.44Å; P2-L6 PolarHBondContact O-N 3.48Å
3H40.5Very low46.8Very low129 Ų129107.6 Ų107.660%0.59755%0.552SS**Hα-helixtrans-68.7-28.9-176.7-133.9-40.8000114.4M1 K7M1-H3 VanDerWaalsContact C-N 3.33Å; M1-H3 PolarHBondContact O-N 3.39Å; H3-K7 WeakPolarHBondContact O-CB 3.33Å; H3-K7 PolarHBondContact O-N 3.15Å; H3-K7 VanDerWaalsContact O-N 3.15Å
4K43.1Very low46.7Very low170 Ų170110.8 Ų110.874%0.73956%0.564SS**Hα-helixtrans-78.2-40.5177.4-82.7-174.4175.4-177.40111.6P2 K7 L8P2-K4 PolarHBondContact O-N 3.36Å; K4-K7 PolarHBondContact O-N 2.83Å; K4-L8 PolarHBondContact O-N 2.84Å
5L45.4Very low46.8Very low121 Ų121113.1 Ų113.163%0.63456%0.563SS**Hα-helixtrans-67.1-40.9176.2-157.178.7000111.1P2 L8 L9P2-L5 PolarHBondContact O-N 3Å; L5-L8 PolarHBondContact O-N 3.4Å; L5-L9 WeakPolarHBondContact O-CG 3.37Å; L5-L9 PolarHBondContact O-N 3.45Å
6L45.1Very low47Very low67 Ų67112.4 Ų112.435%0.35156%0.561SS.*Hα-helixtrans-63.2-42.1174.6-164.275.8000111.7P2 L8 L9 L10 F263P2-L6 WeakPolarHBondContact O-CB 3.44Å; P2-L6 PolarHBondContact O-N 3.48Å; L6-L8 VanDerWaalsContact C-N 3.33Å; L6-L8 PolarHBondContact O-N 2.96Å; L6-L9 PolarHBondContact O-N 3.25Å; L6-L10 HydrophobicContact CD2-CD1 4.23Å; L6-L10 HydrophobicContact CG-CD1 3.86Å; L6-L10 HydrophobicContact CG-CG 4.46Å; L6-L10 VanDerWaalsContact O-CB 3.25Å; L6-L10 WeakPolarHBondContact O-CB 3.14Å; L6-L10 WeakPolarHBondContact O-CD1 3.45Å; L6-L10 WeakPolarHBondContact O-CG 3.25Å; L6-L10 PolarHBondContact O-N 3.01Å; L6-F263 HydrophobicContact CD2-CE1 4.01Å; L6-F263 HydrophobicContact CD2-CE2 4.05Å; L6-F263 HydrophobicContact CD2-CZ 3.58Å
7K44.9Very low47.2Very low149 Ų149108.3 Ų108.365%0.64855%0.549SS*.Hα-helixtrans-63.5-36.6173.8-92.6-174.4173.1-1760113H3 K4 G11H3-K7 WeakPolarHBondContact O-CB 3.33Å; H3-K7 PolarHBondContact O-N 3.15Å; H3-K7 VanDerWaalsContact O-N 3.15Å; K4-K7 PolarHBondContact O-N 2.83Å; K7-G11 PolarHBondContact O-N 3.4Å
8L47.4Very low47.3Very low129 Ų129106.2 Ų106.268%0.67555%0.546SS*.Hα-helixtrans-66.9-45.3176.3-112.4128.3000111.3K4 L5 L6 G11 S12K4-L8 PolarHBondContact O-N 2.84Å; L5-L8 PolarHBondContact O-N 3.4Å; L6-L8 VanDerWaalsContact C-N 3.33Å; L6-L8 PolarHBondContact O-N 2.96Å; L8-G11 PolarHBondContact O-N 3.47Å; L8-S12 PolarHBondContact O-N 3.14Å; L8-S12 PolarHBondContact O-OG 3.16Å; L8-S12 VanDerWaalsContact O-OG 3.05Å
9L47.2Very low47.3Very low86 Ų86108.8 Ų108.845%0.4555%0.549SS..Hα-helixtrans-62.4-46.5174.4-71.9163.2000111.3L5 L6 G11 S12 Y13L5-L9 WeakPolarHBondContact O-CG 3.37Å; L5-L9 PolarHBondContact O-N 3.45Å; L6-L9 PolarHBondContact O-N 3.25Å; L9-G11 PolarHBondContact O-N 3.16Å; L9-S12 WeakPolarHBondContact CA-OG 3.47Å; L9-S12 PolarHBondContact O-N 3.1Å; L9-S12 PolarHBondContact O-OG 3.18Å; L9-Y13 VanDerWaalsContact C-CD2 3.5Å; L9-Y13 HydrophobicContact CB-CE2 4.23Å; L9-Y13 WeakPolarHBondContact O-CD2 3.39Å; L9-Y13 WeakPolarHBondContact O-CE2 3.19Å; L9-Y13 PolarHBondContact O-N 2.79Å
10L48.6Very low47.4Very low28 Ų28111.2 Ų111.215%0.14755%0.551CS.*Hα-helixtrans-61.8-39175.4-72.2164.9000113.1L6 Y13 Q14 Q266 L267L6-L10 HydrophobicContact CD2-CD1 4.23Å; L6-L10 HydrophobicContact CG-CD1 3.86Å; L6-L10 HydrophobicContact CG-CG 4.46Å; L6-L10 VanDerWaalsContact O-CB 3.25Å; L6-L10 WeakPolarHBondContact O-CB 3.14Å; L6-L10 WeakPolarHBondContact O-CD1 3.45Å; L6-L10 WeakPolarHBondContact O-CG 3.25Å; L6-L10 PolarHBondContact O-N 3.01Å; L10-Y13 PolarHBondContact O-N 2.92Å; L10-Q14 PolarHBondContact O-N 3.4Å; L10-Q14 VanDerWaalsContact O-N 3.07Å; L10-Q266 HydrophobicContact CD2-CB 4.48Å; L10-L267 HydrophobicContact CD2-CD2 4.1Å
11G47.8Very low47.3Very low38 Ų38109.8 Ų109.839%0.39255%0.55SS..Hα-helixtrans-64.5-39.7175.400000112.5K7 L8 L9 Y13 W15K7-G11 PolarHBondContact O-N 3.4Å; L8-G11 PolarHBondContact O-N 3.47Å; L9-G11 PolarHBondContact O-N 3.16Å; G11-Y13 VanDerWaalsContact C-N 3.32Å; G11-Y13 PolarHBondContact O-N 3.12Å; G11-W15 WeakPolarHBondContact O-CB 3.47Å; G11-W15 PolarHBondContact O-N 3.22Å; G11-W15 VanDerWaalsContact O-N 3.15Å
12S52.1Low47.4Very low52 Ų52105.6 Ų105.636%0.36454%0.536SS..Hα-helixtrans-67.4-28.917243.30000113.4L8 L9 W15 L16L8-S12 PolarHBondContact O-N 3.14Å; L8-S12 PolarHBondContact O-OG 3.16Å; L8-S12 VanDerWaalsContact O-OG 3.05Å; L9-S12 WeakPolarHBondContact CA-OG 3.47Å; L9-S12 PolarHBondContact O-N 3.1Å; L9-S12 PolarHBondContact O-OG 3.18Å; S12-W15 PolarHBondContact O-N 3.36Å; S12-L16 WeakPolarHBondContact O-CG 3.46Å; S12-L16 PolarHBondContact O-N 2.91Å
13Y52.2Low47.3Very low106 Ų106106.8 Ų106.842%0.41654%0.536SS..Hα-helixtrans-72.3-42.8175.6-71.9-57.8000113.2L9 L10 G11 W15 L16 A17 L270L9-Y13 VanDerWaalsContact C-CD2 3.5Å; L9-Y13 HydrophobicContact CB-CE2 4.23Å; L9-Y13 WeakPolarHBondContact O-CD2 3.39Å; L9-Y13 WeakPolarHBondContact O-CE2 3.19Å; L9-Y13 PolarHBondContact O-N 2.79Å; L10-Y13 PolarHBondContact O-N 2.92Å; G11-Y13 VanDerWaalsContact C-N 3.32Å; G11-Y13 PolarHBondContact O-N 3.12Å; Y13-W15 PolarHBondContact O-N 2.78Å; Y13-L16 PolarHBondContact O-N 3.44Å; Y13-A17 WeakPolarHBondContact O-CB 3.45Å; Y13-A17 PolarHBondContact O-N 3.24Å; Y13-L270 HydrophobicContact CD1-CD2 3.51Å; Y13-L270 HydrophobicContact CE1-CD2 3.13Å; Y13-L270 HydrophobicContact CE1-CG 4.26Å
14Q46Very low47.9Very low152 Ų152105.7 Ų105.771%0.7153%0.532SS*.Hα-helixtrans-62.1-34.5172.1-98.5170.5-20.500111.9L10 S18L10-Q14 PolarHBondContact O-N 3.4Å; L10-Q14 VanDerWaalsContact O-N 3.07Å; Q14-S18 PolarHBondContact O-N 3.19Å; Q14-S18 VanDerWaalsContact O-N 3.17Å; Q14-S18 PolarHBondContact O-OG 3.08Å
15W48.5Very low48.3Very low146 Ų14699.6 Ų99.655%0.55351%0.51SS*.Hα-helixtrans-67-47.1173.7-17088.4000112.1G11 S12 Y13 A17 S18 Y19G11-W15 WeakPolarHBondContact O-CB 3.47Å; G11-W15 PolarHBondContact O-N 3.22Å; G11-W15 VanDerWaalsContact O-N 3.15Å; S12-W15 PolarHBondContact O-N 3.36Å; Y13-W15 PolarHBondContact O-N 2.78Å; W15-A17 VanDerWaalsContact C-N 3.34Å; W15-A17 PolarHBondContact O-N 3.18Å; W15-S18 VanDerWaalsContact CA-OG 3.28Å; W15-S18 WeakPolarHBondContact CA-OG 3.36Å; W15-S18 PolarHBondContact O-N 3.41Å; W15-S18 VanDerWaalsContact O-N 3.11Å; W15-S18 PolarHBondContact O-OG 3.07Å; W15-Y19 AromaticContact CD1-CE2 3.9Å; W15-Y19 HydrophobicContact CD2-CD2 4.03Å; W15-Y19 AromaticContact CD2-CE2 3.97Å; W15-Y19 HydrophobicContact CD2-CE2 3.97Å; W15-Y19 AromaticContact CE2-CD2 3.83Å; W15-Y19 AromaticContact CE2-CE2 3.36Å; W15-Y19 HydrophobicContact CE3-CD2 4.42Å; W15-Y19 HydrophobicContact CG-CD2 4.47Å; W15-Y19 HydrophobicContact CG-CE2 4.27Å; W15-Y19 HydrophobicContact CH2-CD2 4.43Å; W15-Y19 HydrophobicContact CH2-CE2 4.44Å; W15-Y19 HydrophobicContact CZ2-CD2 4.05Å; W15-Y19 AromaticContact CZ2-CE2 3.64Å; W15-Y19 HydrophobicContact CZ2-CE2 3.64Å; W15-Y19 AromaticContact NE1-CE2 3.34Å; W15-Y19 VanDerWaalsContact NE1-CE2 3.34Å; W15-Y19 WeakPolarHBondContact O-CD2 3.16Å; W15-Y19 PolarHBondContact O-N 3.05Å
16L48.8Very low48.9Very low102 Ų102106.1 Ų106.153%0.53453%0.526SS..Hα-helixtrans-62.4-38.4175.5-75.6168000113.1S12 Y13 S18 Y19 W20S12-L16 WeakPolarHBondContact O-CG 3.46Å; S12-L16 PolarHBondContact O-N 2.91Å; Y13-L16 PolarHBondContact O-N 3.44Å; L16-S18 VanDerWaalsContact C-N 3.25Å; L16-S18 PolarHBondContact O-N 3.07Å; L16-Y19 PolarHBondContact O-N 3.38Å; L16-W20 PolarHBondContact O-N 3.48Å
17A50.4Low50.1Low42 Ų42106 Ų10635%0.34754%0.542SS..Hα-helixtrans-66-27175.600000113Y13 W15 L66Y13-A17 WeakPolarHBondContact O-CB 3.45Å; Y13-A17 PolarHBondContact O-N 3.24Å; W15-A17 VanDerWaalsContact C-N 3.34Å; W15-A17 PolarHBondContact O-N 3.18Å; A17-L66 HydrophobicContact CB-CD2 4.3Å
18S50.1Low52Low71 Ų7199.2 Ų99.250%0.49751%0.512SS..Hα-helixtrans-83.6-17.918033.90000114.3Q14 W15 L16 P21Q14-S18 PolarHBondContact O-N 3.19Å; Q14-S18 VanDerWaalsContact O-N 3.17Å; Q14-S18 PolarHBondContact O-OG 3.08Å; W15-S18 VanDerWaalsContact CA-OG 3.28Å; W15-S18 WeakPolarHBondContact CA-OG 3.36Å; W15-S18 PolarHBondContact O-N 3.41Å; W15-S18 VanDerWaalsContact O-N 3.11Å; W15-S18 PolarHBondContact O-OG 3.07Å; L16-S18 VanDerWaalsContact C-N 3.25Å; L16-S18 PolarHBondContact O-N 3.07Å; S18-P21 WeakPolarHBondContact O-CD 3.45Å; S18-P21 WeakPolarHBondContact O-CG 3.31Å
19Y47.4Very low54Low155 Ų155100.3 Ų100.361%0.60851%0.508SS*.Hα-helixtrans-99.2-5.3173.5-74.6-89.8000114.8W15 L16 P21W15-Y19 AromaticContact CD1-CE2 3.9Å; W15-Y19 HydrophobicContact CD2-CD2 4.03Å; W15-Y19 AromaticContact CD2-CE2 3.97Å; W15-Y19 HydrophobicContact CD2-CE2 3.97Å; W15-Y19 AromaticContact CE2-CD2 3.83Å; W15-Y19 AromaticContact CE2-CE2 3.36Å; W15-Y19 HydrophobicContact CE3-CD2 4.42Å; W15-Y19 HydrophobicContact CG-CD2 4.47Å; W15-Y19 HydrophobicContact CG-CE2 4.27Å; W15-Y19 HydrophobicContact CH2-CD2 4.43Å; W15-Y19 HydrophobicContact CH2-CE2 4.44Å; W15-Y19 HydrophobicContact CZ2-CD2 4.05Å; W15-Y19 AromaticContact CZ2-CE2 3.64Å; W15-Y19 HydrophobicContact CZ2-CE2 3.64Å; W15-Y19 AromaticContact NE1-CE2 3.34Å; W15-Y19 VanDerWaalsContact NE1-CE2 3.34Å; W15-Y19 WeakPolarHBondContact O-CD2 3.16Å; W15-Y19 PolarHBondContact O-N 3.05Å; L16-Y19 PolarHBondContact O-N 3.38Å; Y19-P21 WeakPolarHBondContact O-CD 3.45Å
20W48.3Very low56.3Low157 Ų15798.3 Ų98.360%0.59550%0.497SS*.G310 helixtrans-75.64.1170.4-156.5-91.9000117.7L16 V22 L66L16-W20 PolarHBondContact O-N 3.48Å; W20-V22 PolarHBondContact O-N 2.66Å; W20-L66 HydrophobicContact CB-CD2 4.16Å; W20-L66 HydrophobicContact CG-CB 4.35Å; W20-L66 HydrophobicContact CG-CD2 4.24Å
21P45.3Very low58.5Low81 Ų8198.6 Ų98.653%0.52650%0.497SS..G310 helixtrans-70.51.8-177.55.43000115.6S18 Y19 L23S18-P21 WeakPolarHBondContact O-CD 3.45Å; S18-P21 WeakPolarHBondContact O-CG 3.31Å; Y19-P21 WeakPolarHBondContact O-CD 3.45Å; P21-L23 VanDerWaalsContact C-N 3.32Å; P21-L23 PolarHBondContact O-N 2.94Å
22V46.9Very low60.8Low127 Ų12799.2 Ų99.277%0.7749%0.493SS*.G310 helixtrans-81-2.3-165.4-175.10000114.6W20W20-V22 PolarHBondContact O-N 2.66Å
23L48.1Very low62.9Low134 Ų13498 Ų9870%0.70248%0.481SS*.G310 helixtrans-136.830.7176.8-69.1172.7000114.6P21 P25P21-L23 VanDerWaalsContact C-N 3.32Å; P21-L23 PolarHBondContact O-N 2.94Å; L23-P25 WeakPolarHBondContact O-CD 3.37Å; L23-P25 VanDerWaalsContact O-N 3.09Å
24M52.4Low64.9Low106 Ų10699.6 Ų99.652%0.52249%0.492SS..  trans-61.9111.1168.9-77.6-92.5-74.700109.4R26 V65M24-R26 PolarHBondContact O-N 3.48Å; M24-V65 HydrophobicContact SD-CG1 4.17Å
25P52.4Low67.3Low43 Ų4396.3 Ų96.328%0.27948%0.477SS..  trans-60.7127.2169.6-14.530.7000106.8L23 G27 V65L23-P25 WeakPolarHBondContact O-CD 3.37Å; L23-P25 VanDerWaalsContact O-N 3.09Å; P25-G27 PolarHBondContact O-N 3.28Å; P25-V65 HydrophobicContact CG-CG2 4.2Å
26R56.2Low69.5Low257 Ų25789.7 Ų89.797%0.9745%0.452SS*.THydrogen-bonded Turntrans-47117174.5-70.9-179.3-178.7167.80.8108.6M24M24-R26 PolarHBondContact O-N 3.48Å
27G70.6Confident71.6Confident66 Ų6686.2 Ų86.268%0.6844%0.436SS*.THydrogen-bonded Turntrans115.72.3171.500000118.7P25P25-G27 PolarHBondContact O-N 3.28Å
28I85.4Confident73.5Confident5 Ų590.7 Ų90.73%0.02645%0.453CS..  trans-105.6107.7172.8-57.2-179.8000110L54 L58 K61 V65I28-L54 HydrophobicContact CG2-CD1 4.09Å; I28-L54 HydrophobicContact CG2-CD2 4.41Å; I28-L58 HydrophobicContact CG1-CD2 4.38Å; I28-K61 HydrophobicContact CD1-CB 4.32Å; I28-V65 HydrophobicContact CB-CG2 4.4Å; I28-V65 HydrophobicContact CD1-CG2 4.05Å; I28-V65 HydrophobicContact CG2-CG2 4.41Å
29R90.2Very high75.3Confident153 Ų15389.5 Ų89.558%0.57744%0.439SS*.  trans-89.7135.9175.4176177.2177.3-179.62.1110.4Y31R29-Y31 HydrophobicContact CB-CE2 4.43Å; R29-Y31 HydrophobicContact CG-CE1 4.39Å; R29-Y31 HydrophobicContact CG-CE2 4.39Å; R29-Y31 WeakPolarHBondContact O-CE2 3.44Å
30L94.3Very high77.4Confident43 Ų4383.4 Ų83.423%0.22542%0.417CS..EExtended strand (participates in β ladder)trans-90.1149.8168.3-59177.9000110.7Y50 R51 V65 L66 Y269L30-Y50 CarbonylContact C-O 3.59Å; L30-Y50 VanDerWaalsContact CA-O 3.31Å; L30-Y50 WeakPolarHBondContact CA-O 3.39Å; L30-R51 HydrophobicContact CD2-CG 3.79Å; L30-V65 HydrophobicContact CD2-CG1 4.17Å; L30-L66 WeakPolarHBondContact CD1-O 3.07Å; L30-Y269 HydrophobicContact CD1-CE1 4.44Å
31Y95.1Very high79.5Confident35 Ų3578 Ų7814%0.13740%0.397CS..EExtended strand (participates in β ladder)trans-124149.9-174.7-63.3-87.4000110.7R29 Q35 G49 Y50 A52 R53R29-Y31 HydrophobicContact CB-CE2 4.43Å; R29-Y31 HydrophobicContact CG-CE1 4.39Å; R29-Y31 HydrophobicContact CG-CE2 4.39Å; R29-Y31 WeakPolarHBondContact O-CE2 3.44Å; Y31-Q35 HydrophobicContact CD1-CB 3.92Å; Y31-Q35 HydrophobicContact CG-CB 4.47Å; Y31-G49 PolarHBondContact O-N 3.44Å; Y31-Y50 PolarHBondContact N-O 2.86Å; Y31-Y50 WeakPolarHBondContact O-CB 2.89Å; Y31-Y50 PolarHBondContact O-N 3.15Å; Y31-A52 HydrophobicContact CD2-CB 3.76Å; Y31-A52 HydrophobicContact CE2-CB 3.96Å; Y31-A52 WeakPolarHBondContact CE2-O 3.49Å; Y31-A52 HydrophobicContact CG-CB 4.48Å; Y31-R53 VanDerWaalsContact CE1-NH1 3.35Å
32T96Very high81.5Confident51 Ų5179.2 Ų79.231%0.31340%0.396SS..  trans-76.3161.4167.358.30000110.9E34 Q35 T47T32-E34 PolarHBondContact O-N 2.68Å; T32-E34 VanDerWaalsContact O-N 3.08Å; T32-Q35 VanDerWaalsContact N-OE1 3.13Å; T32-Q35 PolarHBondContact O-N 3.07Å; T32-Q35 VanDerWaalsContact OG1-CG 3.31Å; T32-Q35 WeakPolarHBondContact OG1-CG 3.28Å; T32-Q35 PolarHBondContact OG1-OE1 3.4Å; T32-Q35 VanDerWaalsContact OG1-OE1 3.12Å; T32-T47 CarbonylContact C-O 3.14Å; T32-T47 WeakPolarHBondContact CA-O 3.49Å
33F95.6Very high83.7Confident27 Ų2774.1 Ų74.112%0.11836%0.364CS..THydrogen-bonded Turntrans-53.5-30.3177.3-176.5-97.6000112.9I36 K41 N43 P44 I46 T47 Y50F33-I36 HydrophobicContact CD2-CD1 4.3Å; F33-I36 WeakPolarHBondContact O-CG1 3.31Å; F33-K41 HydrophobicContact CD1-CD 4.42Å; F33-K41 HydrophobicContact CE1-CB 4.42Å; F33-K41 HydrophobicContact CE1-CD 3.92Å; F33-K41 HydrophobicContact CE1-CG 4.29Å; F33-K41 HydrophobicContact CE2-CB 3.95Å; F33-K41 HydrophobicContact CE2-CG 4.15Å; F33-K41 HydrophobicContact CZ-CB 3.68Å; F33-K41 HydrophobicContact CZ-CD 4.05Å; F33-K41 HydrophobicContact CZ-CG 3.95Å; F33-K41 WeakPolarHBondContact O-CE 3.44Å; F33-K41 PolarHBondContact O-NZ 3.17Å; F33-N43 WeakPolarHBondContact CE2-O 3.27Å; F33-P44 HydrophobicContact CE1-CB 4.26Å; F33-P44 HydrophobicContact CZ-CB 4.06Å; F33-I46 WeakPolarHBondContact CD2-O 3.27Å; F33-T47 PolarHBondContact N-O 2.88Å; F33-Y50 HydrophobicContact CB-CE2 4.14Å; F33-Y50 HydrophobicContact CD2-CE2 4.07Å; F33-Y50 AromaticContact CD2-CZ 3.94Å
34E95.3Very high86Confident138 Ų13871.3 Ų71.365%0.64535%0.354SS*.THydrogen-bonded Turntrans-78-22.7179-62.6-53.115900114.4T32 K41T32-E34 PolarHBondContact O-N 2.68Å; T32-E34 VanDerWaalsContact O-N 3.08Å; E34-K41 PolarHBondContact O-NZ 3.31Å; E34-K41 IonicContact OE2-NZ 2.78Å; E34-K41 PolarHBondContact OE2-NZ 3.29Å
35Q95.1Very high88.1Confident83 Ų8369.3 Ų69.339%0.38834%0.341SS..THydrogen-bonded Turntrans-91-11.9-174.1-68.8168.7-20.700114Y31 T32 R53Y31-Q35 HydrophobicContact CD1-CB 3.92Å; Y31-Q35 HydrophobicContact CG-CB 4.47Å; T32-Q35 VanDerWaalsContact N-OE1 3.13Å; T32-Q35 PolarHBondContact O-N 3.07Å; T32-Q35 VanDerWaalsContact OG1-CG 3.31Å; T32-Q35 WeakPolarHBondContact OG1-CG 3.28Å; T32-Q35 PolarHBondContact OG1-OE1 3.4Å; T32-Q35 VanDerWaalsContact OG1-OE1 3.12Å; Q35-R53 PolarHBondContact O-NH1 2.98Å; Q35-R53 PolarHBondContact O-NH2 3.32Å
36I95.1Very high90.3Very high7 Ų767.7 Ų67.74%0.03633%0.33CS..SBendtrans-82.9154.2-18066.4-178.6000112.3F33 M40 K41 Y50 A52F33-I36 HydrophobicContact CD2-CD1 4.3Å; F33-I36 WeakPolarHBondContact O-CG1 3.31Å; I36-M40 HydrophobicContact CD1-CB 3.97Å; I36-M40 HydrophobicContact CG1-CB 4.37Å; I36-K41 HydrophobicContact CD1-CG 4.01Å; I36-K41 HydrophobicContact CG1-CG 3.74Å; I36-K41 WeakPolarHBondContact O-CE 3.41Å; I36-Y50 HydrophobicContact CD1-CD1 3.55Å; I36-Y50 HydrophobicContact CD1-CD2 4.26Å; I36-Y50 HydrophobicContact CD1-CE1 3.59Å; I36-Y50 HydrophobicContact CD1-CE2 4.3Å; I36-Y50 HydrophobicContact CD1-CG 3.91Å; I36-Y50 VanDerWaalsContact CG2-CB 3.48Å; I36-Y50 HydrophobicContact CG2-CD1 4.26Å; I36-Y50 HydrophobicContact CG2-CD2 4.46Å; I36-Y50 HydrophobicContact CG2-CG 3.84Å; I36-A52 HydrophobicContact CG2-CB 4.23Å
37P93.5Very high92.2Very high29 Ų2958.2 Ų58.219%0.18830%0.301CS..  trans-56.3149.3173.1-25.134.9000113.8F39 M40P37-F39 VanDerWaalsContact C-N 3.29Å; P37-F39 HydrophobicContact CB-CD1 3.57Å; P37-F39 HydrophobicContact CB-CE1 3.23Å; P37-F39 HydrophobicContact CB-CG 4.42Å; P37-F39 HydrophobicContact CB-CZ 3.87Å; P37-F39 HydrophobicContact CG-CE1 3.85Å; P37-F39 HydrophobicContact CG-CZ 4.11Å; P37-F39 PolarHBondContact O-N 2.87Å; P37-M40 HydrophobicContact CG-SD 4.28Å; P37-M40 WeakPolarHBondContact O-CB 3.38Å; P37-M40 PolarHBondContact O-N 3.41Å
38L91.1Very high93.4Very high137 Ų13757.7 Ų57.772%0.71728%0.282SS*.G310 helixtrans-58.3-35.3-176.8-69.6173000114.1M40 K41 K197L38-M40 PolarHBondContact O-N 3.17Å; L38-K41 HydrophobicContact CD2-CD 4.33Å; L38-K41 PolarHBondContact O-N 3.11Å; L38-K197 PolarHBondContact O-NZ 2.82Å
39F87.4Confident93.8Very high46 Ų4657.5 Ų57.520%0.20228%0.281CS..G310 helixtrans-64.4-24.2178.368-97.3000112.6P37 E134 C137P37-F39 VanDerWaalsContact C-N 3.29Å; P37-F39 HydrophobicContact CB-CD1 3.57Å; P37-F39 HydrophobicContact CB-CE1 3.23Å; P37-F39 HydrophobicContact CB-CG 4.42Å; P37-F39 HydrophobicContact CB-CZ 3.87Å; P37-F39 HydrophobicContact CG-CE1 3.85Å; P37-F39 HydrophobicContact CG-CZ 4.11Å; P37-F39 PolarHBondContact O-N 2.87Å; F39-E134 HydrophobicContact CB-CG 4.44Å; F39-E134 HydrophobicContact CD1-CB 4.32Å; F39-E134 HydrophobicContact CD1-CG 3.92Å; F39-E134 HydrophobicContact CD2-CG 4.24Å; F39-E134 HydrophobicContact CE1-CB 4.1Å; F39-E134 HydrophobicContact CE1-CG 4.19Å; F39-E134 HydrophobicContact CG-CG 3.96Å; F39-E134 HydrophobicContact CZ-CB 4.3Å; F39-E134 HydrophobicContact CZ-CG 4.49Å; F39-C137 HydrophobicContact CE2-CB 4.21Å
40M91.1Very high94.1Very high27 Ų2750.8 Ų50.813%0.13326%0.256CS..G310 helixtrans-89.2-16.1177.8-58.2-176.468.900113.9I36 P37 L38 E42 R51 A52 C130I36-M40 HydrophobicContact CD1-CB 3.97Å; I36-M40 HydrophobicContact CG1-CB 4.37Å; P37-M40 HydrophobicContact CG-SD 4.28Å; P37-M40 WeakPolarHBondContact O-CB 3.38Å; P37-M40 PolarHBondContact O-N 3.41Å; L38-M40 PolarHBondContact O-N 3.17Å; M40-E42 PolarHBondContact O-N 2.75Å; M40-R51 WeakPolarHBondContact CE-O 3.41Å; M40-A52 HydrophobicContact SD-CB 4.18Å; M40-C130 HydrophobicContact CE-CB 4.4Å
41K91.9Very high94.2Very high44 Ų4448.9 Ų48.919%0.19125%0.246CC..  trans-73.788.6-178.8-67-165-173.7-165.30110.5F33 E34 I36 L38 K197F33-K41 HydrophobicContact CD1-CD 4.42Å; F33-K41 HydrophobicContact CE1-CB 4.42Å; F33-K41 HydrophobicContact CE1-CD 3.92Å; F33-K41 HydrophobicContact CE1-CG 4.29Å; F33-K41 HydrophobicContact CE2-CB 3.95Å; F33-K41 HydrophobicContact CE2-CG 4.15Å; F33-K41 HydrophobicContact CZ-CB 3.68Å; F33-K41 HydrophobicContact CZ-CD 4.05Å; F33-K41 HydrophobicContact CZ-CG 3.95Å; F33-K41 WeakPolarHBondContact O-CE 3.44Å; F33-K41 PolarHBondContact O-NZ 3.17Å; E34-K41 PolarHBondContact O-NZ 3.31Å; E34-K41 IonicContact OE2-NZ 2.78Å; E34-K41 PolarHBondContact OE2-NZ 3.29Å; I36-K41 HydrophobicContact CD1-CG 4.01Å; I36-K41 HydrophobicContact CG1-CG 3.74Å; I36-K41 WeakPolarHBondContact O-CE 3.41Å; L38-K41 HydrophobicContact CD2-CD 4.33Å; L38-K41 PolarHBondContact O-N 3.11Å; K41-K197 PolarHBondContact O-NZ 3.35Å
42E87.8Confident94.1Very high106 Ų10647.3 Ų47.350%0.49524%0.24SC..  trans-107.5-46.3178.8-65-160.4159.800114.1M40M40-E42 PolarHBondContact O-N 2.75Å
43N93.9Very high94Very high20 Ų2051 Ų5111%0.10725%0.248CC..  trans-116.6101.7-174.4-171-6.2000110.2F33 Y45 I46 Y50 E260F33-N43 WeakPolarHBondContact CE2-O 3.27Å; N43-Y45 PolarHBondContact O-N 2.95Å; N43-Y45 WeakPolarHBondContact OD1-CD2 3.35Å; N43-Y45 PolarHBondContact OD1-N 3.32Å; N43-I46 HydrophobicContact CB-CG1 4.34Å; N43-I46 PolarHBondContact O-N 3.31Å; N43-Y50 PolarHBondContact O-OH 3.17Å; N43-E260 PolarHBondContact ND2-OE1 3.4Å
44P95.4Very high94Very high74 Ų7450.1 Ų50.148%0.48125%0.245SC..THydrogen-bonded Turntrans-69.5-12.3-176.729.9-36000113.6F33 I46F33-P44 HydrophobicContact CE1-CB 4.26Å; F33-P44 HydrophobicContact CZ-CB 4.06Å; P44-I46 VanDerWaalsContact C-N 3.34Å
45Y97.3Very high93.9Very high64 Ų6449.2 Ų49.225%0.25124%0.241SC..THydrogen-bonded Turntrans-81.3-16.8179.4-51.6-60.9000113.1N43 K257 E260 R261 P264 G265N43-Y45 PolarHBondContact O-N 2.95Å; N43-Y45 WeakPolarHBondContact OD1-CD2 3.35Å; N43-Y45 PolarHBondContact OD1-N 3.32Å; Y45-K257 HydrophobicContact CD2-CB 4.12Å; Y45-K257 HydrophobicContact CE2-CB 4.23Å; Y45-E260 WeakPolarHBondContact CB-O 3.45Å; Y45-E260 HydrophobicContact CD2-CG 4.47Å; Y45-R261 HydrophobicContact CD2-CB 3.84Å; Y45-R261 HydrophobicContact CD2-CG 4.33Å; Y45-R261 HydrophobicContact CE1-CB 4.39Å; Y45-R261 HydrophobicContact CE1-CG 4.01Å; Y45-R261 HydrophobicContact CE2-CB 3.74Å; Y45-R261 HydrophobicContact CE2-CG 3.76Å; Y45-R261 HydrophobicContact CG-CB 4.25Å; Y45-R261 PolarHBondContact OH-NE 3.25Å; Y45-P264 HydrophobicContact CD1-CB 4.41Å; Y45-P264 HydrophobicContact CD1-CG 4.01Å; Y45-P264 WeakPolarHBondContact O-CA 3.37Å; Y45-G265 PolarHBondContact O-N 3.42Å
46I97.4Very high93.9Very high9 Ų948 Ų485%0.04624%0.241CC..  trans-91.9109.9170.4-56-61.7000106.9F33 N43 P44 Y50 N68 E260 L267 N268 A272F33-I46 WeakPolarHBondContact CD2-O 3.27Å; N43-I46 HydrophobicContact CB-CG1 4.34Å; N43-I46 PolarHBondContact O-N 3.31Å; P44-I46 VanDerWaalsContact C-N 3.34Å; I46-Y50 HydrophobicContact CB-CE2 4.42Å; I46-Y50 WeakPolarHBondContact CB-OH 3.04Å; I46-Y50 HydrophobicContact CG2-CE2 3.82Å; I46-Y50 WeakPolarHBondContact O-CE2 3.1Å; I46-Y50 PolarHBondContact O-OH 3.06Å; I46-N68 HydrophobicContact CG2-CB 3.93Å; I46-E260 HydrophobicContact CD1-CB 3.95Å; I46-E260 HydrophobicContact CD1-CG 4.07Å; I46-L267 WeakPolarHBondContact CD1-O 3.3Å; I46-N268 WeakPolarHBondContact CA-OD1 3.43Å; I46-N268 HydrophobicContact CG2-CB 4.49Å; I46-A272 HydrophobicContact CD1-CB 3.91Å
47T96.5Very high93.8Very high58 Ų5855.6 Ų55.636%0.35627%0.274SS..  trans-101.4-17.2-166.561.20000113.9T32 F33 G265 N268T32-T47 CarbonylContact C-O 3.14Å; T32-T47 WeakPolarHBondContact CA-O 3.49Å; F33-T47 PolarHBondContact N-O 2.88Å; T47-G265 WeakPolarHBondContact OG1-CA 3.17Å; T47-N268 PolarHBondContact N-OD1 2.88Å; T47-N268 PolarHBondContact OG1-ND2 2.98Å; T47-N268 VanDerWaalsContact OG1-ND2 3.11Å
48D95.1Very high93.8Very high56 Ų5656.6 Ų56.630%0.29928%0.277SS..SBendtrans-151.7172.5-174.9-170.934.2000112N268 Y269D48-N268 WeakPolarHBondContact CB-ND2 3.45Å; D48-N268 PolarHBondContact N-ND2 3.45Å; D48-N268 VanDerWaalsContact N-ND2 3.17Å; D48-Y269 PolarHBondContact OD2-OH 3.27Å
49G94.4Very high94.1Very high0 Ų050.1 Ų50.10%024%0.243CC..  trans89.412.4175.400000114.1Y31 S67 N68 Y269Y31-G49 PolarHBondContact O-N 3.44Å; G49-S67 WeakPolarHBondContact O-CA 3.4Å; G49-S67 VanDerWaalsContact O-CB 3.3Å; G49-S67 WeakPolarHBondContact O-CB 3.35Å; G49-N68 PolarHBondContact O-N 3.08Å; G49-N68 PolarHBondContact O-OD1 2.95Å; G49-Y269 VanDerWaalsContact CA-OH 3.27Å; G49-Y269 WeakPolarHBondContact CA-OH 3.34Å
50Y96.7Very high94.4Very high13 Ų1352 Ų525%0.05126%0.255CS..EExtended strand (participates in β ladder)trans-77.4134.6-178.5-71.8-93.3000112.3L30 Y31 F33 I36 N43 I46 N68L30-Y50 CarbonylContact C-O 3.59Å; L30-Y50 VanDerWaalsContact CA-O 3.31Å; L30-Y50 WeakPolarHBondContact CA-O 3.39Å; Y31-Y50 PolarHBondContact N-O 2.86Å; Y31-Y50 WeakPolarHBondContact O-CB 2.89Å; Y31-Y50 PolarHBondContact O-N 3.15Å; F33-Y50 HydrophobicContact CB-CE2 4.14Å; F33-Y50 HydrophobicContact CD2-CE2 4.07Å; F33-Y50 AromaticContact CD2-CZ 3.94Å; I36-Y50 HydrophobicContact CD1-CD1 3.55Å; I36-Y50 HydrophobicContact CD1-CD2 4.26Å; I36-Y50 HydrophobicContact CD1-CE1 3.59Å; I36-Y50 HydrophobicContact CD1-CE2 4.3Å; I36-Y50 HydrophobicContact CD1-CG 3.91Å; I36-Y50 VanDerWaalsContact CG2-CB 3.48Å; I36-Y50 HydrophobicContact CG2-CD1 4.26Å; I36-Y50 HydrophobicContact CG2-CD2 4.46Å; I36-Y50 HydrophobicContact CG2-CG 3.84Å; N43-Y50 PolarHBondContact O-OH 3.17Å; I46-Y50 HydrophobicContact CB-CE2 4.42Å; I46-Y50 WeakPolarHBondContact CB-OH 3.04Å; I46-Y50 HydrophobicContact CG2-CE2 3.82Å; I46-Y50 WeakPolarHBondContact O-CE2 3.1Å; I46-Y50 PolarHBondContact O-OH 3.06Å; Y50-N68 WeakPolarHBondContact CD1-ND2 3.19Å; Y50-N68 WeakPolarHBondContact CE1-ND2 3.39Å
51R95.5Very high94.5Very high3 Ų356.5 Ų56.51%0.01127%0.274CS..EExtended strand (participates in β ladder)trans-88.1136.7163.8-61.6168.4-64.7150.115.6108.2L30 M40 L54 S62 S67 E69 H126 C130L30-R51 HydrophobicContact CD2-CG 3.79Å; M40-R51 WeakPolarHBondContact CE-O 3.41Å; R51-L54 HydrophobicContact CB-CD1 4.23Å; R51-S62 PolarHBondContact NH1-OG 3.35Å; R51-S67 PolarHBondContact NE-OG 2.86Å; R51-S67 VanDerWaalsContact NE-OG 3.16Å; R51-E69 VanDerWaalsContact NH2-CG 3.3Å; R51-H126 PolarHBondContact NH2-O 3.17Å; R51-C130 VanDerWaalsContact C-CB 3.46Å; R51-C130 HydrophobicContact CB-CB 3.57Å; R51-C130 WeakPolarHBondContact O-CB 3.32Å
52A94.6Very high94.5Very high1 Ų154.4 Ų54.41%0.00827%0.265CS..  trans-152.8157.8176.300000112.1Y31 I36 M40 L54 C130Y31-A52 HydrophobicContact CD2-CB 3.76Å; Y31-A52 HydrophobicContact CE2-CB 3.96Å; Y31-A52 WeakPolarHBondContact CE2-O 3.49Å; Y31-A52 HydrophobicContact CG-CB 4.48Å; I36-A52 HydrophobicContact CG2-CB 4.23Å; M40-A52 HydrophobicContact SD-CB 4.18Å; A52-L54 VanDerWaalsContact C-N 3.31Å; A52-L54 PolarHBondContact O-N 3.48Å; A52-C130 CarbonylContact C-O 3.52Å
53R93.6Very high94.8Very high129 Ų12950.6 Ų50.649%0.48725%0.248SC..SBendtrans60.235.9174.7-51179.9-175.794.13.3113.3Y31 Q35 C130Y31-R53 VanDerWaalsContact CE1-NH1 3.35Å; Q35-R53 PolarHBondContact O-NH1 2.98Å; Q35-R53 PolarHBondContact O-NH2 3.32Å; R53-C130 PolarHBondContact N-O 3.11Å; R53-C130 VanDerWaalsContact N-O 3.08Å
54L94.3Very high94.7Very high8 Ų855.9 Ų55.94%0.04227%0.27CS..BIsolated β-bridgetrans-93.6145.4-179.3-60.9-170.8000112.3I28 R51 A52 L58 C130 H131 L132I28-L54 HydrophobicContact CG2-CD1 4.09Å; I28-L54 HydrophobicContact CG2-CD2 4.41Å; R51-L54 HydrophobicContact CB-CD1 4.23Å; A52-L54 VanDerWaalsContact C-N 3.31Å; A52-L54 PolarHBondContact O-N 3.48Å; L54-L58 HydrophobicContact CB-CB 4.08Å; L54-L58 HydrophobicContact CD1-CB 4.37Å; L54-L58 HydrophobicContact CD2-CB 4.25Å; L54-L58 HydrophobicContact CD2-CD1 4.3Å; L54-L58 HydrophobicContact CG-CB 4.46Å; L54-C130 PolarHBondContact N-O 2.94Å; L54-C130 VanDerWaalsContact N-O 3.07Å; L54-H131 CarbonylContact O-C 3.55Å; L54-H131 VanDerWaalsContact O-CA 3.32Å; L54-H131 WeakPolarHBondContact O-CA 3.33Å; L54-H131 PolarHBondContact O-CD2 2.66Å; L54-L132 PolarHBondContact O-N 2.97Å
55Q94.4Very high94.5Very high120 Ų12052.5 Ų52.556%0.56125%0.248SC*.  trans-77.1157164.8-69.6-178.6-15.900110.3K57 L58 C59 L132Q55-K57 VanDerWaalsContact C-N 3.26Å; Q55-K57 PolarHBondContact O-N 3.48Å; Q55-K57 VanDerWaalsContact O-N 3.08Å; Q55-L58 WeakPolarHBondContact O-CA 3.43Å; Q55-L58 WeakPolarHBondContact O-CB 3.37Å; Q55-L58 PolarHBondContact O-N 3.2Å; Q55-C59 PolarHBondContact O-N 2.93Å; Q55-C59 PolarHBondContact O-SG 2.93Å; Q55-L132 HydrophobicContact CB-CD2 4.31Å; Q55-L132 HydrophobicContact CG-CD2 3.5Å
56S94.5Very high94.3Very high56 Ų5651.7 Ų51.739%0.39225%0.248SC..Hα-helixtrans-49.3-41.1-177.8-51.80000114.6L58 C59 L60 H131S56-L58 VanDerWaalsContact C-N 3.29Å; S56-L58 PolarHBondContact O-N 3.48Å; S56-C59 WeakPolarHBondContact O-CB 3.39Å; S56-C59 PolarHBondContact O-N 2.95Å; S56-L60 WeakPolarHBondContact O-CG 3.34Å; S56-L60 PolarHBondContact O-N 3.38Å; S56-L60 VanDerWaalsContact O-N 3.09Å; S56-H131 PolarHBondContact OG-NE2 3.19Å
57K93.8Very high94.2Very high167 Ų16751.3 Ų51.373%0.72625%0.245SC*.Hα-helixtrans-62.2-36.9177.1-67.4-176.9-179.5179.10112.4Q55 K61Q55-K57 VanDerWaalsContact C-N 3.26Å; Q55-K57 PolarHBondContact O-N 3.48Å; Q55-K57 VanDerWaalsContact O-N 3.08Å; K57-K61 WeakPolarHBondContact O-CG 3.49Å; K57-K61 PolarHBondContact O-N 3.37Å
58L93.9Very high94.2Very high51 Ų5149.1 Ų49.127%0.26723%0.232SC..Hα-helixtrans-77.5-33.8177-65.1177.1000111.6I28 L54 Q55 S56 L60 K61 S62I28-L58 HydrophobicContact CG1-CD2 4.38Å; L54-L58 HydrophobicContact CB-CB 4.08Å; L54-L58 HydrophobicContact CD1-CB 4.37Å; L54-L58 HydrophobicContact CD2-CB 4.25Å; L54-L58 HydrophobicContact CD2-CD1 4.3Å; L54-L58 HydrophobicContact CG-CB 4.46Å; Q55-L58 WeakPolarHBondContact O-CA 3.43Å; Q55-L58 WeakPolarHBondContact O-CB 3.37Å; Q55-L58 PolarHBondContact O-N 3.2Å; S56-L58 VanDerWaalsContact C-N 3.29Å; S56-L58 PolarHBondContact O-N 3.48Å; L58-L60 VanDerWaalsContact C-N 3.31Å; L58-L60 PolarHBondContact O-N 2.96Å; L58-K61 HydrophobicContact CD2-CD 4.49Å; L58-K61 PolarHBondContact O-N 3.35Å; L58-S62 VanDerWaalsContact O-CB 3.3Å; L58-S62 WeakPolarHBondContact O-CB 3.38Å; L58-S62 PolarHBondContact O-N 3.43Å
59C95.5Very high94.3Very high0 Ų047.9 Ų47.90%022%0.224CC..Hα-helixtrans-56.2-47.1170.5-59.10000110.8Q55 S56 S62 F128Q55-C59 PolarHBondContact O-N 2.93Å; Q55-C59 PolarHBondContact O-SG 2.93Å; S56-C59 WeakPolarHBondContact O-CB 3.39Å; S56-C59 PolarHBondContact O-N 2.95Å; C59-S62 WeakPolarHBondContact O-CB 3.15Å; C59-S62 PolarHBondContact O-N 2.77Å; C59-S62 PolarHBondContact O-OG 3.11Å; C59-F128 HydrophobicContact CB-CD1 3.59Å; C59-F128 HydrophobicContact CB-CE1 3.77Å; C59-F128 HydrophobicContact CB-CG 4.48Å
60L94.8Very high94.5Very high86 Ų8649 Ų4945%0.4523%0.231SC..Hα-helixtrans-61.8-45175.6-67.6172000112.6S56 L58 S62 I63 M127 F128S56-L60 WeakPolarHBondContact O-CG 3.34Å; S56-L60 PolarHBondContact O-N 3.38Å; S56-L60 VanDerWaalsContact O-N 3.09Å; L58-L60 VanDerWaalsContact C-N 3.31Å; L58-L60 PolarHBondContact O-N 2.96Å; L60-S62 PolarHBondContact O-N 3.38Å; L60-I63 WeakPolarHBondContact O-CD1 3.47Å; L60-I63 VanDerWaalsContact O-CG1 3.23Å; L60-I63 WeakPolarHBondContact O-CG1 3.39Å; L60-I63 PolarHBondContact O-N 2.88Å; L60-M127 HydrophobicContact CD2-CE 3.73Å; L60-M127 HydrophobicContact CD2-SD 3.71Å; L60-F128 HydrophobicContact CD2-CZ 3.91Å; L60-F128 HydrophobicContact CG-CZ 4.2Å
61K92.8Very high94.5Very high121 Ų12149.8 Ų49.853%0.52624%0.237SC..Hα-helixtrans-65.4-26.3177-72.5-177.9179-1730112.9I28 K57 L58 I63 F64I28-K61 HydrophobicContact CD1-CB 4.32Å; K57-K61 WeakPolarHBondContact O-CG 3.49Å; K57-K61 PolarHBondContact O-N 3.37Å; L58-K61 HydrophobicContact CD2-CD 4.49Å; L58-K61 PolarHBondContact O-N 3.35Å; K61-I63 PolarHBondContact O-N 3.46Å; K61-F64 PolarHBondContact O-N 3.42Å
62S93.1Very high94.6Very high0 Ų050 Ų500%024%0.238CC..G310 helixtrans-72-8.5-176.878.30000114.4R51 L58 C59 L60 F64 V65R51-S62 PolarHBondContact NH1-OG 3.35Å; L58-S62 VanDerWaalsContact O-CB 3.3Å; L58-S62 WeakPolarHBondContact O-CB 3.38Å; L58-S62 PolarHBondContact O-N 3.43Å; C59-S62 WeakPolarHBondContact O-CB 3.15Å; C59-S62 PolarHBondContact O-N 2.77Å; C59-S62 PolarHBondContact O-OG 3.11Å; L60-S62 PolarHBondContact O-N 3.38Å; S62-F64 PolarHBondContact O-N 3.25Å; S62-V65 WeakPolarHBondContact O-CB 3.36Å; S62-V65 PolarHBondContact O-N 3.13Å
63I94.3Very high94.8Very high27 Ų2750 Ų5014%0.13824%0.238CC..G310 helixtrans-57-32172-59.3169.7000111.2L60 K61 I73 W74 L77 M127L60-I63 WeakPolarHBondContact O-CD1 3.47Å; L60-I63 VanDerWaalsContact O-CG1 3.23Å; L60-I63 WeakPolarHBondContact O-CG1 3.39Å; L60-I63 PolarHBondContact O-N 2.88Å; K61-I63 PolarHBondContact O-N 3.46Å; I63-I73 HydrophobicContact CG2-CG2 4.31Å; I63-W74 HydrophobicContact CG2-CZ2 3.62Å; I63-W74 PolarHBondContact O-NE1 3.48Å; I63-L77 HydrophobicContact CG2-CD1 4.42Å; I63-M127 HydrophobicContact CD1-SD 3.38Å; I63-M127 WeakPolarHBondContact CD1-SD 3.48Å; I63-M127 HydrophobicContact CG1-CG 4.26Å; I63-M127 HydrophobicContact CG1-SD 3.65Å
64F91.4Very high95.1Very high130 Ų13048.3 Ų48.357%0.5723%0.232SC*.G310 helixtrans-90.31178.7-56.5-69.9000113.5K61 S62 W74K61-F64 PolarHBondContact O-N 3.42Å; S62-F64 PolarHBondContact O-N 3.25Å; F64-W74 HydrophobicContact CD1-CZ2 4.34Å; F64-W74 HydrophobicContact CE1-CH2 4.44Å; F64-W74 HydrophobicContact CE1-CZ2 4.12Å
65V90.7Very high95.3Very high4 Ų449.1 Ų49.12%0.02424%0.237CC..SBendtrans-95.6128.7175.2177.80000108.8M24 P25 I28 L30 S62 S67 T70M24-V65 HydrophobicContact SD-CG1 4.17Å; P25-V65 HydrophobicContact CG-CG2 4.2Å; I28-V65 HydrophobicContact CB-CG2 4.4Å; I28-V65 HydrophobicContact CD1-CG2 4.05Å; I28-V65 HydrophobicContact CG2-CG2 4.41Å; L30-V65 HydrophobicContact CD2-CG1 4.17Å; S62-V65 WeakPolarHBondContact O-CB 3.36Å; S62-V65 PolarHBondContact O-N 3.13Å; V65-S67 PolarHBondContact O-N 3.18Å; V65-T70 PolarHBondContact O-OG1 2.93Å
66L93.9Very high95.5Very high47 Ų4743.6 Ų43.625%0.24621%0.211CC..  trans-68.5117.3173.3-175.762.8000109.2A17 W20 L30 T70 Y269A17-L66 HydrophobicContact CB-CD2 4.3Å; W20-L66 HydrophobicContact CB-CD2 4.16Å; W20-L66 HydrophobicContact CG-CB 4.35Å; W20-L66 HydrophobicContact CG-CD2 4.24Å; L30-L66 WeakPolarHBondContact CD1-O 3.07Å; L66-T70 WeakPolarHBondContact CA-OG1 3.45Å; L66-T70 HydrophobicContact CD1-CG2 4.27Å; L66-Y269 HydrophobicContact CD1-CD1 4.31Å; L66-Y269 HydrophobicContact CD2-CD1 4.46Å; L66-Y269 HydrophobicContact CG-CD1 3.82Å; L66-Y269 HydrophobicContact CG-CE1 4.36Å; L66-Y269 HydrophobicContact CG-CG 4.44Å
67S95.3Very high95.7Very high0 Ų043.4 Ų43.40%021%0.206CC..  trans-144.8171-175.268.30000109.6G49 R51 V65 E69 T70G49-S67 WeakPolarHBondContact O-CA 3.4Å; G49-S67 VanDerWaalsContact O-CB 3.3Å; G49-S67 WeakPolarHBondContact O-CB 3.35Å; R51-S67 PolarHBondContact NE-OG 2.86Å; R51-S67 VanDerWaalsContact NE-OG 3.16Å; V65-S67 PolarHBondContact O-N 3.18Å; S67-E69 PolarHBondContact O-N 3.32Å; S67-E69 VanDerWaalsContact O-N 3.11Å; S67-E69 PolarHBondContact OG-N 3.02Å; S67-T70 PolarHBondContact N-OG1 3.18Å; S67-T70 WeakPolarHBondContact O-CB 3.25Å; S67-T70 PolarHBondContact O-N 2.9Å; S67-T70 VanDerWaalsContact O-N 3.13Å; S67-T70 PolarHBondContact O-OG1 2.97Å; S67-T70 PolarHBondContact OG-N 3.3Å; S67-T70 PolarHBondContact OG-OG1 2.75Å
68N96.3Very high95.9Very high12 Ų1240.2 Ų40.26%0.06420%0.196CC..THydrogen-bonded Turntrans-61.6-17.9175.270.3-41.5000114I46 G49 Y50 N268 Q275I46-N68 HydrophobicContact CG2-CB 3.93Å; G49-N68 PolarHBondContact O-N 3.08Å; G49-N68 PolarHBondContact O-OD1 2.95Å; Y50-N68 WeakPolarHBondContact CD1-ND2 3.19Å; Y50-N68 WeakPolarHBondContact CE1-ND2 3.39Å; N68-N268 WeakPolarHBondContact CA-O 3.31Å; N68-N268 WeakPolarHBondContact CB-O 3.46Å; N68-Q275 PolarHBondContact O-NE2 3.44Å
69E97.3Very high96.1Very high31 Ų3137.9 Ų37.915%0.14518%0.184CC..THydrogen-bonded Turntrans-99.4-5.7-179.8-65.3-61.5163.600113.8R51 S67 V71 N72 I73 H126R51-E69 VanDerWaalsContact NH2-CG 3.3Å; S67-E69 PolarHBondContact O-N 3.32Å; S67-E69 VanDerWaalsContact O-N 3.11Å; S67-E69 PolarHBondContact OG-N 3.02Å; E69-V71 PolarHBondContact O-N 3.47Å; E69-N72 PolarHBondContact O-N 3.22Å; E69-N72 PolarHBondContact OE2-ND2 3.01Å; E69-I73 HydrophobicContact CB-CD1 4.27Å; E69-I73 WeakPolarHBondContact O-CG1 3.19Å; E69-I73 PolarHBondContact O-N 2.97Å; E69-H126 IonicContact OE2-CE1 3.91Å; E69-H126 IonicContact OE2-CG 3.86Å; E69-H126 IonicContact OE2-ND1 3.81Å; E69-H126 PolarHBondContact OE2-ND1 2.8Å
70T96.9Very high96.3Very high22 Ų2240.6 Ų40.614%0.13520%0.196CC..Hα-helixtrans-58.2-47.8-173.1-63.60000111.4V65 L66 S67 I73 W74V65-T70 PolarHBondContact O-OG1 2.93Å; L66-T70 WeakPolarHBondContact CA-OG1 3.45Å; L66-T70 HydrophobicContact CD1-CG2 4.27Å; S67-T70 PolarHBondContact N-OG1 3.18Å; S67-T70 WeakPolarHBondContact O-CB 3.25Å; S67-T70 PolarHBondContact O-N 2.9Å; S67-T70 VanDerWaalsContact O-N 3.13Å; S67-T70 PolarHBondContact O-OG1 2.97Å; S67-T70 PolarHBondContact OG-N 3.3Å; S67-T70 PolarHBondContact OG-OG1 2.75Å; T70-I73 PolarHBondContact O-N 3.38Å; T70-W74 WeakPolarHBondContact O-CB 3.14Å; T70-W74 VanDerWaalsContact O-CD1 3.24Å; T70-W74 PolarHBondContact O-N 2.73Å
71V98Very high96.5Very high31 Ų3140.4 Ų40.419%0.18820%0.195CC..Hα-helixtrans-64.7-45.3178.7-178.30000110.5E69 I73 W74 T75 Y269 L270 Q275E69-V71 PolarHBondContact O-N 3.47Å; V71-I73 VanDerWaalsContact C-N 3.3Å; V71-I73 PolarHBondContact O-N 3.12Å; V71-W74 PolarHBondContact O-N 3.03Å; V71-T75 HydrophobicContact CG1-CG2 3.7Å; V71-T75 WeakPolarHBondContact O-CB 3.34Å; V71-T75 VanDerWaalsContact O-CG2 3.27Å; V71-T75 WeakPolarHBondContact O-CG2 3.48Å; V71-T75 PolarHBondContact O-N 3.3Å; V71-T75 PolarHBondContact O-OG1 2.82Å; V71-Y269 WeakPolarHBondContact CG2-O 3.29Å; V71-L270 HydrophobicContact CG2-CD1 3.65Å; V71-Q275 HydrophobicContact CB-CB 4.14Å; V71-Q275 HydrophobicContact CB-CG 3.78Å; V71-Q275 HydrophobicContact CG1-CB 3.75Å; V71-Q275 HydrophobicContact CG1-CG 3.99Å
72N98.3Very high96.8Very high6 Ų637.4 Ų37.43%0.03218%0.184CC..Hα-helixtrans-54.8-44.6178.9-58.4-28000112.1E69 T75 H126 Q275 H278E69-N72 PolarHBondContact O-N 3.22Å; E69-N72 PolarHBondContact OE2-ND2 3.01Å; N72-T75 PolarHBondContact O-OG1 3.28Å; N72-T75 VanDerWaalsContact O-OG1 3.11Å; N72-H126 HydrophobicContact CB-CB 4.16Å; N72-Q275 WeakPolarHBondContact OD1-CA 3.45Å; N72-Q275 WeakPolarHBondContact OD1-CG 3.35Å; N72-Q275 PolarHBondContact OD1-N 3.39Å; N72-H278 PolarHBondContact OD1-CD2 3.23Å; N72-H278 VanDerWaalsContact OD1-CD2 3.3Å
73I98.5Very high97Very high1 Ų137.4 Ų37.41%0.00518%0.184CC..Hα-helixtrans-65.1-55.9177.2-64.6165.8000110.3I63 E69 T70 V71 T75 H76 L77 H126 M127I63-I73 HydrophobicContact CG2-CG2 4.31Å; E69-I73 HydrophobicContact CB-CD1 4.27Å; E69-I73 WeakPolarHBondContact O-CG1 3.19Å; E69-I73 PolarHBondContact O-N 2.97Å; T70-I73 PolarHBondContact O-N 3.38Å; V71-I73 VanDerWaalsContact C-N 3.3Å; V71-I73 PolarHBondContact O-N 3.12Å; I73-T75 PolarHBondContact O-N 3.27Å; I73-H76 PolarHBondContact O-N 3.27Å; I73-L77 HydrophobicContact CG2-CD1 3.67Å; I73-L77 HydrophobicContact CG2-CG 4.15Å; I73-L77 WeakPolarHBondContact O-CG 3.16Å; I73-L77 PolarHBondContact O-N 3.23Å; I73-H126 HydrophobicContact CG1-CB 3.65Å; I73-M127 HydrophobicContact CD1-CB 4.41Å
74W98.5Very high97.3Very high95 Ų9540.7 Ų40.736%0.3620%0.198SC..Hα-helixtrans-69-34.7-171.2-81.5101000113I63 F64 T70 V71 H76 L77 L78I63-W74 HydrophobicContact CG2-CZ2 3.62Å; I63-W74 PolarHBondContact O-NE1 3.48Å; F64-W74 HydrophobicContact CD1-CZ2 4.34Å; F64-W74 HydrophobicContact CE1-CH2 4.44Å; F64-W74 HydrophobicContact CE1-CZ2 4.12Å; T70-W74 WeakPolarHBondContact O-CB 3.14Å; T70-W74 VanDerWaalsContact O-CD1 3.24Å; T70-W74 PolarHBondContact O-N 2.73Å; V71-W74 PolarHBondContact O-N 3.03Å; W74-H76 VanDerWaalsContact C-N 3.28Å; W74-H76 PolarHBondContact O-N 3.21Å; W74-L77 PolarHBondContact O-N 3.27Å; W74-L78 HydrophobicContact CE3-CG 4.46Å; W74-L78 VanDerWaalsContact O-CB 3.29Å; W74-L78 WeakPolarHBondContact O-CB 3.09Å; W74-L78 VanDerWaalsContact O-CG 3.23Å; W74-L78 WeakPolarHBondContact O-CG 3.47Å; W74-L78 PolarHBondContact O-N 2.97Å
75T98.6Very high97.6Very high25 Ų2539.1 Ų39.115%0.15320%0.195CC..Hα-helixtrans-59.6-40.9176.147.20000111.7V71 N72 I73 G79 H278 V279V71-T75 HydrophobicContact CG1-CG2 3.7Å; V71-T75 WeakPolarHBondContact O-CB 3.34Å; V71-T75 VanDerWaalsContact O-CG2 3.27Å; V71-T75 WeakPolarHBondContact O-CG2 3.48Å; V71-T75 PolarHBondContact O-N 3.3Å; V71-T75 PolarHBondContact O-OG1 2.82Å; N72-T75 PolarHBondContact O-OG1 3.28Å; N72-T75 VanDerWaalsContact O-OG1 3.11Å; I73-T75 PolarHBondContact O-N 3.27Å; T75-G79 PolarHBondContact O-N 2.99Å; T75-H278 VanDerWaalsContact OG1-CB 3.29Å; T75-H278 WeakPolarHBondContact OG1-CB 3.28Å; T75-V279 HydrophobicContact CG2-CG2 3.65Å
76H98.7Very high98Very high4 Ų440 Ų402%0.01920%0.199CC..Hα-helixtrans-85.4-29-179.4-80-161.3000113.1I73 W74 G79 F80 M119 S122 A123 H278I73-H76 PolarHBondContact O-N 3.27Å; W74-H76 VanDerWaalsContact C-N 3.28Å; W74-H76 PolarHBondContact O-N 3.21Å; H76-G79 PolarHBondContact O-N 3.26Å; H76-F80 PolarHBondContact O-N 3.47Å; H76-M119 HydrophobicContact CB-SD 3.99Å; H76-M119 VanDerWaalsContact CD2-SD 3.5Å; H76-M119 WeakPolarHBondContact O-CB 3.1Å; H76-S122 PolarHBondContact CE1-OG 3.32Å; H76-S122 WeakPolarHBondContact ND1-CB 3.13Å; H76-S122 PolarHBondContact ND1-OG 3.33Å; H76-A123 HydrophobicContact CB-CB 4.1Å; H76-H278 AromaticContact CD2-ND1 3.38Å; H76-H278 PolarHBondContact CD2-ND1 3.5Å; H76-H278 AromaticContact CE1-CE1 3.64Å; H76-H278 AromaticContact CE1-ND1 2.91Å; H76-H278 PolarHBondContact CE1-ND1 2.72Å; H76-H278 AromaticContact CG-ND1 3.52Å; H76-H278 AromaticContact ND1-CE1 3.7Å; H76-H278 AromaticContact ND1-ND1 3.18Å; H76-H278 PolarHBondContact ND1-ND1 2.82Å; H76-H278 VanDerWaalsContact ND1-ND1 3.18Å; H76-H278 AromaticContact NE2-CG 3.7Å; H76-H278 AromaticContact NE2-ND1 2.97Å; H76-H278 PolarHBondContact NE2-ND1 3.43Å
77L98.7Very high98.2Very high51 Ų5138.4 Ų38.427%0.26719%0.194SC..Hα-helixtrans-64.4-43.3168.3-71.4-179.3000112I63 I73 W74 G79 F80 L81 A123I63-L77 HydrophobicContact CG2-CD1 4.42Å; I73-L77 HydrophobicContact CG2-CD1 3.67Å; I73-L77 HydrophobicContact CG2-CG 4.15Å; I73-L77 WeakPolarHBondContact O-CG 3.16Å; I73-L77 PolarHBondContact O-N 3.23Å; W74-L77 PolarHBondContact O-N 3.27Å; L77-G79 VanDerWaalsContact C-N 3.35Å; L77-F80 WeakPolarHBondContact O-CB 3.5Å; L77-F80 PolarHBondContact O-N 3.44Å; L77-L81 PolarHBondContact O-N 3.19Å; L77-L81 VanDerWaalsContact O-N 3.1Å; L77-A123 HydrophobicContact CD2-CB 3.76Å; L77-A123 HydrophobicContact CG-CB 3.96Å
78L98.7Very high98.3Very high101 Ų10142 Ų4253%0.52922%0.216SC..Hα-helixtrans-67.9-36.8173.9-67.6174000111.3W74 L81 L82W74-L78 HydrophobicContact CE3-CG 4.46Å; W74-L78 VanDerWaalsContact O-CB 3.29Å; W74-L78 WeakPolarHBondContact O-CB 3.09Å; W74-L78 VanDerWaalsContact O-CG 3.23Å; W74-L78 WeakPolarHBondContact O-CG 3.47Å; W74-L78 PolarHBondContact O-N 2.97Å; L78-L81 PolarHBondContact O-N 2.75Å; L78-L82 WeakPolarHBondContact O-CB 3.31Å; L78-L82 PolarHBondContact O-N 3.16Å
79G98.8Very high98.4Very high1 Ų144.7 Ų44.71%0.0123%0.23CC..Hα-helixtrans-58-46.3170.900000112.4T75 H76 L77 L81 L82 F83T75-G79 PolarHBondContact O-N 2.99Å; H76-G79 PolarHBondContact O-N 3.26Å; L77-G79 VanDerWaalsContact C-N 3.35Å; G79-L81 PolarHBondContact O-N 3.19Å; G79-L82 WeakPolarHBondContact O-CB 3.33Å; G79-L82 PolarHBondContact O-N 2.8Å; G79-F83 WeakPolarHBondContact O-CD2 3.23Å; G79-F83 PolarHBondContact O-N 3.13Å
80F98.8Very high98.4Very high58 Ų5843.3 Ų43.325%0.25422%0.224SC..Hα-helixtrans-56.3-49.8173.6165.4-99.6000111.5H76 L77 L82 F83 F84 Q116 M119 L120H76-F80 PolarHBondContact O-N 3.47Å; L77-F80 WeakPolarHBondContact O-CB 3.5Å; L77-F80 PolarHBondContact O-N 3.44Å; F80-L82 VanDerWaalsContact C-N 3.31Å; F80-L82 PolarHBondContact O-N 2.93Å; F80-F83 PolarHBondContact O-N 3.41Å; F80-F84 WeakPolarHBondContact O-CB 3.4Å; F80-F84 PolarHBondContact O-N 3.36Å; F80-Q116 HydrophobicContact CD2-CB 3.77Å; F80-Q116 HydrophobicContact CD2-CG 3.83Å; F80-Q116 HydrophobicContact CE2-CB 3.93Å; F80-Q116 HydrophobicContact CE2-CG 3.95Å; F80-M119 HydrophobicContact CB-CB 3.92Å; F80-L120 HydrophobicContact CB-CD2 4.24Å; F80-L120 HydrophobicContact CB-CG 4.39Å; F80-L120 HydrophobicContact CD1-CD2 4.14Å; F80-L120 HydrophobicContact CD2-CD1 3.68Å; F80-L120 HydrophobicContact CD2-CD2 3.85Å; F80-L120 HydrophobicContact CD2-CG 3.52Å; F80-L120 HydrophobicContact CE2-CD1 3.57Å; F80-L120 HydrophobicContact CE2-CD2 4.27Å; F80-L120 HydrophobicContact CE2-CG 3.96Å; F80-L120 HydrophobicContact CG-CD1 4.46Å; F80-L120 HydrophobicContact CG-CD2 3.79Å; F80-L120 HydrophobicContact CG-CG 3.94Å; F80-L120 HydrophobicContact CZ-CD1 4.27Å
81L98.8Very high98.4Very high82 Ų8244.9 Ų44.943%0.42923%0.23SC..Hα-helixtrans-60.6-41.3178.6-178.961.5000111.7L77 L78 G79 F84 L85L77-L81 PolarHBondContact O-N 3.19Å; L77-L81 VanDerWaalsContact O-N 3.1Å; L78-L81 PolarHBondContact O-N 2.75Å; G79-L81 PolarHBondContact O-N 3.19Å; L81-F84 PolarHBondContact O-N 3.11Å; L81-L85 HydrophobicContact CD1-CD1 4.11Å; L81-L85 HydrophobicContact CD1-CG 4.09Å; L81-L85 HydrophobicContact CG-CD1 3.99Å; L81-L85 HydrophobicContact CG-CG 4.38Å; L81-L85 WeakPolarHBondContact O-CB 3.38Å; L81-L85 VanDerWaalsContact O-CG 3.26Å; L81-L85 WeakPolarHBondContact O-CG 3.5Å; L81-L85 PolarHBondContact O-N 2.9Å
82L98.8Very high98.3Very high58 Ų5846.9 Ų46.930%0.30425%0.246SC..Hα-helixtrans-57.6-52.6175.3172.164.8000111.4L78 G79 F80 F84 L85 L86 V282 Y286L78-L82 WeakPolarHBondContact O-CB 3.31Å; L78-L82 PolarHBondContact O-N 3.16Å; G79-L82 WeakPolarHBondContact O-CB 3.33Å; G79-L82 PolarHBondContact O-N 2.8Å; F80-L82 VanDerWaalsContact C-N 3.31Å; F80-L82 PolarHBondContact O-N 2.93Å; L82-F84 VanDerWaalsContact C-N 3.32Å; L82-F84 PolarHBondContact O-N 3.25Å; L82-L85 PolarHBondContact O-N 3.44Å; L82-L86 HydrophobicContact CD1-CD1 4.01Å; L82-L86 HydrophobicContact CD1-CG 4.17Å; L82-L86 HydrophobicContact CG-CD1 4.02Å; L82-L86 WeakPolarHBondContact O-CB 3.42Å; L82-L86 VanDerWaalsContact O-CG 3.3Å; L82-L86 WeakPolarHBondContact O-CG 3.14Å; L82-L86 PolarHBondContact O-N 3.36Å; L82-V282 HydrophobicContact CD2-CG1 4.17Å; L82-Y286 HydrophobicContact CD2-CD2 4.14Å
83F98.8Very high98.3Very high0 Ų049.8 Ų49.80%026%0.264CS..Hα-helixtrans-68.8-30.9-178.7-62.9-59.5000112.9G79 F80 L86 G87 L112 F115 Q116 M119 L285G79-F83 WeakPolarHBondContact O-CD2 3.23Å; G79-F83 PolarHBondContact O-N 3.13Å; F80-F83 PolarHBondContact O-N 3.41Å; F83-L86 HydrophobicContact CD1-CD1 4.11Å; F83-L86 HydrophobicContact CE1-CD1 4.48Å; F83-G87 PolarHBondContact O-N 3.47Å; F83-L112 HydrophobicContact CB-CD2 4.17Å; F83-L112 HydrophobicContact CD1-CD2 4.09Å; F83-F115 HydrophobicContact CB-CB 4.37Å; F83-F115 HydrophobicContact CD1-CB 4.17Å; F83-F115 AromaticContact CD1-CD2 3.87Å; F83-F115 HydrophobicContact CD1-CD2 3.87Å; F83-F115 HydrophobicContact CD2-CB 3.93Å; F83-F115 AromaticContact CE1-CD2 3.96Å; F83-F115 HydrophobicContact CE1-CD2 3.96Å; F83-F115 HydrophobicContact CE2-CB 4.36Å; F83-F115 HydrophobicContact CG-CB 3.87Å; F83-F115 HydrophobicContact CG-CD2 4.43Å; F83-Q116 HydrophobicContact CB-CG 3.92Å; F83-M119 HydrophobicContact CD2-CG 3.97Å; F83-M119 HydrophobicContact CE2-CE 3.98Å; F83-M119 HydrophobicContact CE2-CG 4Å; F83-M119 HydrophobicContact CE2-SD 4.42Å; F83-L285 HydrophobicContact CE1-CB 3.94Å; F83-L285 HydrophobicContact CE2-CB 4.2Å; F83-L285 HydrophobicContact CE2-CD1 4.26Å; F83-L285 HydrophobicContact CZ-CB 3.44Å; F83-L285 VanDerWaalsContact CZ-CB 3.44Å; F83-L285 HydrophobicContact CZ-CD1 4.32Å
84F98.7Very high98.1Very high96 Ų9650.8 Ų50.842%0.42127%0.27SS..Hα-helixtrans-63.4-49.6171.4177.5-96.8000111.4F80 L81 L82 L86 G87 V88F80-F84 WeakPolarHBondContact O-CB 3.4Å; F80-F84 PolarHBondContact O-N 3.36Å; L81-F84 PolarHBondContact O-N 3.11Å; L82-F84 VanDerWaalsContact C-N 3.32Å; L82-F84 PolarHBondContact O-N 3.25Å; F84-L86 VanDerWaalsContact C-N 3.35Å; F84-L86 PolarHBondContact O-N 3.5Å; F84-G87 PolarHBondContact O-N 3.28Å; F84-G87 VanDerWaalsContact O-N 3.13Å; F84-V88 HydrophobicContact CD1-CG2 4.46Å; F84-V88 HydrophobicContact CE1-CG2 4Å; F84-V88 HydrophobicContact CZ-CG2 4.08Å; F84-V88 PolarHBondContact O-N 2.98Å
85L98.6Very high98Very high97 Ų9746.3 Ų46.351%0.50825%0.253SS..Hα-helixtrans-65-38.3178.6-69.1174.9000112L81 L82 G87 V88 N89L81-L85 HydrophobicContact CD1-CD1 4.11Å; L81-L85 HydrophobicContact CD1-CG 4.09Å; L81-L85 HydrophobicContact CG-CD1 3.99Å; L81-L85 HydrophobicContact CG-CG 4.38Å; L81-L85 WeakPolarHBondContact O-CB 3.38Å; L81-L85 VanDerWaalsContact O-CG 3.26Å; L81-L85 WeakPolarHBondContact O-CG 3.5Å; L81-L85 PolarHBondContact O-N 2.9Å; L82-L85 PolarHBondContact O-N 3.44Å; L85-G87 VanDerWaalsContact C-N 3.33Å; L85-V88 PolarHBondContact O-N 2.9Å; L85-N89 VanDerWaalsContact O-CB 3.28Å; L85-N89 WeakPolarHBondContact O-CB 3.49Å; L85-N89 PolarHBondContact O-N 3.39Å
86L98.4Very high97.9Very high22 Ų2248 Ų4812%0.11527%0.265CS..Hα-helixtrans-60.6-42.6171-72.9172.6000111.2L82 F83 F84 V88 N89 D90 L112 Y286L82-L86 HydrophobicContact CD1-CD1 4.01Å; L82-L86 HydrophobicContact CD1-CG 4.17Å; L82-L86 HydrophobicContact CG-CD1 4.02Å; L82-L86 WeakPolarHBondContact O-CB 3.42Å; L82-L86 VanDerWaalsContact O-CG 3.3Å; L82-L86 WeakPolarHBondContact O-CG 3.14Å; L82-L86 PolarHBondContact O-N 3.36Å; F83-L86 HydrophobicContact CD1-CD1 4.11Å; F83-L86 HydrophobicContact CE1-CD1 4.48Å; F84-L86 VanDerWaalsContact C-N 3.35Å; F84-L86 PolarHBondContact O-N 3.5Å; L86-V88 PolarHBondContact O-N 2.94Å; L86-N89 PolarHBondContact O-N 3.48Å; L86-D90 VanDerWaalsContact O-CB 3.28Å; L86-D90 WeakPolarHBondContact O-CB 3.43Å; L86-D90 VanDerWaalsContact O-CG 3.25Å; L86-D90 PolarHBondContact O-N 3.24Å; L86-L112 HydrophobicContact CB-CD2 4.34Å; L86-Y286 HydrophobicContact CD1-CD2 3.88Å; L86-Y286 HydrophobicContact CD1-CE2 4.13Å
87G98.1Very high97.6Very high13 Ų1352.1 Ų52.113%0.13430%0.299CS..Hα-helixtrans-60.9-44.9174.800000113.4F83 F84 L85 N89 D90 M91 L112F83-G87 PolarHBondContact O-N 3.47Å; F84-G87 PolarHBondContact O-N 3.28Å; F84-G87 VanDerWaalsContact O-N 3.13Å; L85-G87 VanDerWaalsContact C-N 3.33Å; G87-N89 VanDerWaalsContact C-N 3.35Å; G87-N89 PolarHBondContact O-N 3.03Å; G87-D90 PolarHBondContact O-N 3.06Å; G87-M91 WeakPolarHBondContact O-CB 3.37Å; G87-M91 WeakPolarHBondContact O-CG 3.47Å; G87-M91 PolarHBondContact O-N 3.19Å; G87-L112 VanDerWaalsContact CA-CD1 3.48Å
88V98.3Very high97.3Very high76 Ų7651 Ų5146%0.46130%0.295SS..Hα-helixtrans-60.7-47.3174.4176.70000110.5F84 L85 L86 D90 S92F84-V88 HydrophobicContact CD1-CG2 4.46Å; F84-V88 HydrophobicContact CE1-CG2 4Å; F84-V88 HydrophobicContact CZ-CG2 4.08Å; F84-V88 PolarHBondContact O-N 2.98Å; L85-V88 PolarHBondContact O-N 2.9Å; L86-V88 PolarHBondContact O-N 2.94Å; V88-D90 PolarHBondContact O-N 3.08Å; V88-S92 VanDerWaalsContact O-CB 3.3Å; V88-S92 WeakPolarHBondContact O-CB 3.49Å; V88-S92 PolarHBondContact O-N 3.32Å; V88-S92 PolarHBondContact O-OG 2.65Å
89N98.1Very high96.9Very high69 Ų6949 Ų4937%0.36930%0.299SS..Hα-helixtrans-62-42179.7179.275000112.3L85 L86 G87 S92 T93 V94L85-N89 VanDerWaalsContact O-CB 3.28Å; L85-N89 WeakPolarHBondContact O-CB 3.49Å; L85-N89 PolarHBondContact O-N 3.39Å; L86-N89 PolarHBondContact O-N 3.48Å; G87-N89 VanDerWaalsContact C-N 3.35Å; G87-N89 PolarHBondContact O-N 3.03Å; N89-S92 PolarHBondContact O-OG 3.5Å; N89-T93 WeakPolarHBondContact O-CA 3.37Å; N89-T93 WeakPolarHBondContact O-CB 3.2Å; N89-T93 PolarHBondContact O-N 3.3Å; N89-T93 PolarHBondContact O-OG1 2.98Å; N89-T93 PolarHBondContact OD1-OG1 3.38Å; N89-T93 VanDerWaalsContact OD1-OG1 3.09Å; N89-V94 WeakPolarHBondContact ND2-CG2 3.46Å; N89-V94 PolarHBondContact O-N 3.16Å
90D97.4Very high96.6Very high2 Ų249.7 Ų49.71%0.01131%0.305CS..Iπ-helixtrans-67-46.9-178.5-79.19.9000111.5L86 G87 V88 S92 V94 L95 Y108 H289L86-D90 VanDerWaalsContact O-CB 3.28Å; L86-D90 WeakPolarHBondContact O-CB 3.43Å; L86-D90 VanDerWaalsContact O-CG 3.25Å; L86-D90 PolarHBondContact O-N 3.24Å; G87-D90 PolarHBondContact O-N 3.06Å; V88-D90 PolarHBondContact O-N 3.08Å; D90-S92 VanDerWaalsContact C-N 3.33Å; D90-S92 PolarHBondContact O-N 3.45Å; D90-V94 PolarHBondContact O-N 2.69Å; D90-V94 WeakPolarHBondContact OD1-CG2 3.3Å; D90-L95 WeakPolarHBondContact O-CB 3.26Å; D90-L95 WeakPolarHBondContact O-CG 3.47Å; D90-L95 PolarHBondContact O-N 2.76Å; D90-Y108 WeakPolarHBondContact OD2-CD1 3.44Å; D90-H289 IonicContact OD1-CE1 2.85Å; D90-H289 IonicContact OD1-NE2 3.72Å; D90-H289 IonicContact OD2-CD2 3.15Å; D90-H289 IonicContact OD2-CE1 3.25Å; D90-H289 IonicContact OD2-NE2 2.65Å; D90-H289 PolarHBondContact OD2-NE2 2.04Å
91M96.8Very high96.3Very high54 Ų5449.6 Ų49.627%0.26631%0.307SS..Iπ-helixtrans-67.6-33.7-180-62-61.3138.700112.4G87 L95 Y105 C109G87-M91 WeakPolarHBondContact O-CB 3.37Å; G87-M91 WeakPolarHBondContact O-CG 3.47Å; G87-M91 PolarHBondContact O-N 3.19Å; M91-L95 HydrophobicContact CE-CD1 3.62Å; M91-L95 HydrophobicContact SD-CD1 3.85Å; M91-Y105 HydrophobicContact SD-CD1 3.6Å; M91-Y105 VanDerWaalsContact SD-CD1 3.6Å; M91-Y105 HydrophobicContact SD-CE1 4.23Å; M91-C109 HydrophobicContact CE-CB 4.46Å; M91-C109 WeakPolarHBondContact CE-SG 3.27Å; M91-C109 VanDerWaalsContact SD-SG 3.63Å
92S97Very high96.1Very high74 Ų7456 Ų5652%0.51733%0.326SS..Iπ-helixtrans-92.5-27.9-176.1600000114.5V88 N89 D90V88-S92 VanDerWaalsContact O-CB 3.3Å; V88-S92 WeakPolarHBondContact O-CB 3.49Å; V88-S92 PolarHBondContact O-N 3.32Å; V88-S92 PolarHBondContact O-OG 2.65Å; N89-S92 PolarHBondContact O-OG 3.5Å; D90-S92 VanDerWaalsContact C-N 3.33Å; D90-S92 PolarHBondContact O-N 3.45Å
93T96.7Very high95.9Very high66 Ų6657.9 Ų57.941%0.40533%0.333SS..Iπ-helixtrans-129.6-53.7-17271.90000113.4N89 A97N89-T93 WeakPolarHBondContact O-CA 3.37Å; N89-T93 WeakPolarHBondContact O-CB 3.2Å; N89-T93 PolarHBondContact O-N 3.3Å; N89-T93 PolarHBondContact O-OG1 2.98Å; N89-T93 PolarHBondContact OD1-OG1 3.38Å; N89-T93 VanDerWaalsContact OD1-OG1 3.09Å; T93-A97 WeakPolarHBondContact O-CB 3.34Å; T93-A97 PolarHBondContact O-N 3.43Å
94V96Very high95.7Very high23 Ų2357.9 Ų57.914%0.13933%0.333CS..Iπ-helixtrans-71-48.3-168.1-176.70000111.6N89 D90 S98 V293N89-V94 WeakPolarHBondContact ND2-CG2 3.46Å; N89-V94 PolarHBondContact O-N 3.16Å; D90-V94 PolarHBondContact O-N 2.69Å; D90-V94 WeakPolarHBondContact OD1-CG2 3.3Å; V94-S98 VanDerWaalsContact O-CB 3.32Å; V94-S98 WeakPolarHBondContact O-CB 3.31Å; V94-S98 PolarHBondContact O-N 3.38Å; V94-S98 VanDerWaalsContact O-N 3.08Å; V94-S98 PolarHBondContact O-OG 3.19Å; V94-V293 HydrophobicContact CG1-CG1 3.82Å
95L95.8Very high95.6Very high0 Ų056.9 Ų56.90%033%0.327CS..Hα-helixtrans-67.4-48.1-178.8-64.2179.7000111.4D90 M91 A97 S98 G99 A100 D104 Y105 Y108 M296D90-L95 WeakPolarHBondContact O-CB 3.26Å; D90-L95 WeakPolarHBondContact O-CG 3.47Å; D90-L95 PolarHBondContact O-N 2.76Å; M91-L95 HydrophobicContact CE-CD1 3.62Å; M91-L95 HydrophobicContact SD-CD1 3.85Å; L95-A97 PolarHBondContact O-N 2.83Å; L95-S98 PolarHBondContact O-N 2.91Å; L95-G99 PolarHBondContact O-N 3.37Å; L95-A100 HydrophobicContact CB-CB 3.67Å; L95-A100 HydrophobicContact CD2-CB 3.85Å; L95-A100 HydrophobicContact CG-CB 4.31Å; L95-A100 WeakPolarHBondContact O-CB 3.35Å; L95-A100 PolarHBondContact O-N 3.14Å; L95-D104 HydrophobicContact CD2-CB 4.4Å; L95-Y105 HydrophobicContact CB-CD1 4.46Å; L95-Y105 HydrophobicContact CB-CE1 3.85Å; L95-Y105 HydrophobicContact CB-CE2 4.18Å; L95-Y105 HydrophobicContact CD1-CD1 3.64Å; L95-Y105 HydrophobicContact CD1-CD2 4.47Å; L95-Y105 HydrophobicContact CD1-CE1 3.85Å; L95-Y105 HydrophobicContact CD1-CG 3.96Å; L95-Y108 HydrophobicContact CD1-CD2 4.48Å; L95-Y108 HydrophobicContact CD1-CG 4.48Å; L95-Y108 HydrophobicContact CD2-CD2 3.79Å; L95-Y108 HydrophobicContact CD2-CE2 3.94Å; L95-Y108 HydrophobicContact CD2-CG 4.28Å; L95-M296 HydrophobicContact CD2-SD 3.7Å
96P95.7Very high95.6Very high62 Ų6255.8 Ų55.840%0.40332%0.324SS..Hα-helixtrans-57.6-46.8173.4-25.433.9000113.3S98 G99 Y105P96-S98 PolarHBondContact O-N 3.19Å; P96-G99 PolarHBondContact O-N 3.44Å; P96-G99 VanDerWaalsContact O-N 3.12Å; P96-Y105 WeakPolarHBondContact CD-OH 3.33Å; P96-Y105 WeakPolarHBondContact CG-OH 3.17Å
97A93.9Very high95.5Very high90 Ų9055.3 Ų55.374%0.74432%0.322SS*.Hα-helixtrans-66.4-21.4-178.600000113.4T93 L95T93-A97 WeakPolarHBondContact O-CB 3.34Å; T93-A97 PolarHBondContact O-N 3.43Å; L95-A97 PolarHBondContact O-N 2.83Å
98S91.1Very high95.4Very high26 Ų2654.9 Ų54.918%0.18232%0.316CS..THydrogen-bonded Turntrans-93.12.4178.4-51.80000113.2V94 L95 P96 A100 K297 H300V94-S98 VanDerWaalsContact O-CB 3.32Å; V94-S98 WeakPolarHBondContact O-CB 3.31Å; V94-S98 PolarHBondContact O-N 3.38Å; V94-S98 VanDerWaalsContact O-N 3.08Å; V94-S98 PolarHBondContact O-OG 3.19Å; L95-S98 PolarHBondContact O-N 2.91Å; P96-S98 PolarHBondContact O-N 3.19Å; S98-A100 VanDerWaalsContact C-N 3.25Å; S98-A100 PolarHBondContact O-N 2.92Å; S98-K297 WeakPolarHBondContact OG-CE 3.37Å; S98-H300 PolarHBondContact O-ND1 3.24Å
99G91Very high95.4Very high59 Ų5954.3 Ų54.361%0.60832%0.315SS*.THydrogen-bonded Turntrans60.636.7-173.200000112.3L95 P96L95-G99 PolarHBondContact O-N 3.37Å; P96-G99 PolarHBondContact O-N 3.44Å; P96-G99 VanDerWaalsContact O-N 3.12Å
100A92.3Very high95.4Very high17 Ų1754.6 Ų54.614%0.1432%0.315CS..  trans-60.6141.5-176.700000112L95 S98 D104 Y105L95-A100 HydrophobicContact CB-CB 3.67Å; L95-A100 HydrophobicContact CD2-CB 3.85Å; L95-A100 HydrophobicContact CG-CB 4.31Å; L95-A100 WeakPolarHBondContact O-CB 3.35Å; L95-A100 PolarHBondContact O-N 3.14Å; S98-A100 VanDerWaalsContact C-N 3.25Å; S98-A100 PolarHBondContact O-N 2.92Å; A100-D104 HydrophobicContact CB-CB 3.94Å; A100-Y105 HydrophobicContact CB-CD2 4.45Å; A100-Y105 HydrophobicContact CB-CE2 3.96Å
101N92.3Very high95.4Very high55 Ų5554.7 Ų54.729%0.29432%0.316SS..  trans-90.1173.2175.972.844000110.7E103 D104 Y105N101-E103 VanDerWaalsContact C-N 3.26Å; N101-E103 PolarHBondContact O-N 3.07Å; N101-E103 WeakPolarHBondContact OD1-CA 3.34Å; N101-E103 VanDerWaalsContact OD1-CB 3.29Å; N101-E103 WeakPolarHBondContact OD1-CB 3.48Å; N101-E103 PolarHBondContact OD1-N 3.43Å; N101-D104 VanDerWaalsContact CG-OD2 3.24Å; N101-D104 PolarHBondContact N-OD2 3.25Å; N101-D104 WeakPolarHBondContact O-CB 3.37Å; N101-D104 PolarHBondContact O-N 3.08Å; N101-D104 VanDerWaalsContact O-N 3.14Å; N101-D104 PolarHBondContact OD1-N 3Å; N101-D104 VanDerWaalsContact OD1-N 3.17Å; N101-D104 PolarHBondContact OD1-OD2 2.88Å; N101-Y105 VanDerWaalsContact O-CD2 3.26Å; N101-Y105 WeakPolarHBondContact O-CD2 3.42Å; N101-Y105 PolarHBondContact O-N 3.39Å
102R94.4Very high95.5Very high217 Ų21752.3 Ų52.382%0.81931%0.305SS*.Hα-helixtrans-58.3-34.5-177.5-174.1178.7179.5-175.90.4113.7D104 Y105 V106R102-D104 VanDerWaalsContact C-N 3.34Å; R102-Y105 PolarHBondContact O-N 3.39Å; R102-V106 WeakPolarHBondContact O-CG2 3.3Å; R102-V106 PolarHBondContact O-N 3.23Å
103E93.8Very high95.6Very high98 Ų9854.9 Ų54.946%0.45831%0.307SS..Hα-helixtrans-65.7-40.4179.4-57.1-172153.400110.7N101 Y105 V106 I107 F161N101-E103 VanDerWaalsContact C-N 3.26Å; N101-E103 PolarHBondContact O-N 3.07Å; N101-E103 WeakPolarHBondContact OD1-CA 3.34Å; N101-E103 VanDerWaalsContact OD1-CB 3.29Å; N101-E103 WeakPolarHBondContact OD1-CB 3.48Å; N101-E103 PolarHBondContact OD1-N 3.43Å; E103-Y105 PolarHBondContact O-N 2.98Å; E103-V106 PolarHBondContact O-N 2.87Å; E103-V106 VanDerWaalsContact O-N 3.15Å; E103-I107 HydrophobicContact CB-CD1 4.46Å; E103-I107 VanDerWaalsContact O-CD1 3.29Å; E103-I107 WeakPolarHBondContact O-CD1 3.4Å; E103-I107 VanDerWaalsContact O-CG1 3.28Å; E103-I107 WeakPolarHBondContact O-CG1 3.06Å; E103-I107 PolarHBondContact O-N 2.91Å; E103-F161 HydrophobicContact CB-CZ 4.09Å; E103-F161 WeakPolarHBondContact OE2-CZ 3.4Å
104D95.4Very high95.7Very high0 Ų052.1 Ų52.10%029%0.29CS..Hα-helixtrans-57.9-49.7175.8-57.7-52.2000110.9L95 A100 N101 R102 V106 I107 Y108 Y162 H300L95-D104 HydrophobicContact CD2-CB 4.4Å; A100-D104 HydrophobicContact CB-CB 3.94Å; N101-D104 VanDerWaalsContact CG-OD2 3.24Å; N101-D104 PolarHBondContact N-OD2 3.25Å; N101-D104 WeakPolarHBondContact O-CB 3.37Å; N101-D104 PolarHBondContact O-N 3.08Å; N101-D104 VanDerWaalsContact O-N 3.14Å; N101-D104 PolarHBondContact OD1-N 3Å; N101-D104 VanDerWaalsContact OD1-N 3.17Å; N101-D104 PolarHBondContact OD1-OD2 2.88Å; R102-D104 VanDerWaalsContact C-N 3.34Å; D104-V106 PolarHBondContact O-N 3.23Å; D104-I107 PolarHBondContact O-N 3.38Å; D104-I107 VanDerWaalsContact O-N 3.1Å; D104-Y108 VanDerWaalsContact O-CD2 3.28Å; D104-Y108 WeakPolarHBondContact O-CD2 3.4Å; D104-Y108 PolarHBondContact O-N 3.03Å; D104-Y162 WeakPolarHBondContact OD1-CE1 3.3Å; D104-Y162 PolarHBondContact OD1-OH 3.47Å; D104-H300 IonicContact OD1-NE2 2.98Å; D104-H300 IonicContact OD2-CE1 3.56Å; D104-H300 PolarHBondContact OD2-CE1 3.46Å; D104-H300 IonicContact OD2-NE2 3.83Å; D104-H300 PolarHBondContact OD2-NE2 3.43Å; D104-H300 VanDerWaalsContact OD2-NE2 3.15Å
105Y96.8Very high95.8Very high75 Ų7551.1 Ų51.129%0.29428%0.284SS..Hα-helixtrans-54.3-43.3176.7-76.8-91.2000112M91 L95 P96 A100 N101 R102 E103 C109M91-Y105 HydrophobicContact SD-CD1 3.6Å; M91-Y105 VanDerWaalsContact SD-CD1 3.6Å; M91-Y105 HydrophobicContact SD-CE1 4.23Å; L95-Y105 HydrophobicContact CB-CD1 4.46Å; L95-Y105 HydrophobicContact CB-CE1 3.85Å; L95-Y105 HydrophobicContact CB-CE2 4.18Å; L95-Y105 HydrophobicContact CD1-CD1 3.64Å; L95-Y105 HydrophobicContact CD1-CD2 4.47Å; L95-Y105 HydrophobicContact CD1-CE1 3.85Å; L95-Y105 HydrophobicContact CD1-CG 3.96Å; P96-Y105 WeakPolarHBondContact CD-OH 3.33Å; P96-Y105 WeakPolarHBondContact CG-OH 3.17Å; A100-Y105 HydrophobicContact CB-CD2 4.45Å; A100-Y105 HydrophobicContact CB-CE2 3.96Å; N101-Y105 VanDerWaalsContact O-CD2 3.26Å; N101-Y105 WeakPolarHBondContact O-CD2 3.42Å; N101-Y105 PolarHBondContact O-N 3.39Å; R102-Y105 PolarHBondContact O-N 3.39Å; E103-Y105 PolarHBondContact O-N 2.98Å; Y105-C109 WeakPolarHBondContact O-CB 3.4Å; Y105-C109 PolarHBondContact O-N 2.73Å; Y105-C109 PolarHBondContact O-SG 3.45Å
106V97.5Very high96Very high74 Ų7452.7 Ų52.745%0.44829%0.291SS..Hα-helixtrans-64.7-45.5178.8172.90000111R102 E103 D104 C109 I110R102-V106 WeakPolarHBondContact O-CG2 3.3Å; R102-V106 PolarHBondContact O-N 3.23Å; E103-V106 PolarHBondContact O-N 2.87Å; E103-V106 VanDerWaalsContact O-N 3.15Å; D104-V106 PolarHBondContact O-N 3.23Å; V106-C109 PolarHBondContact O-N 3.34Å; V106-I110 HydrophobicContact CG1-CD1 3.66Å; V106-I110 HydrophobicContact CG1-CG1 4.44Å; V106-I110 VanDerWaalsContact O-CG1 3.26Å; V106-I110 WeakPolarHBondContact O-CG1 3.35Å; V106-I110 PolarHBondContact O-N 3.44Å
107I97Very high96.1Very high12 Ų1251.4 Ų51.46%0.06228%0.282CS..Hα-helixtrans-64.2-47.1-177.7-69.7155.4000111.5E103 D104 I110 A111 I157 P158 F161 Y162E103-I107 HydrophobicContact CB-CD1 4.46Å; E103-I107 VanDerWaalsContact O-CD1 3.29Å; E103-I107 WeakPolarHBondContact O-CD1 3.4Å; E103-I107 VanDerWaalsContact O-CG1 3.28Å; E103-I107 WeakPolarHBondContact O-CG1 3.06Å; E103-I107 PolarHBondContact O-N 2.91Å; D104-I107 PolarHBondContact O-N 3.38Å; D104-I107 VanDerWaalsContact O-N 3.1Å; I107-I110 PolarHBondContact O-N 3.33Å; I107-A111 VanDerWaalsContact O-CB 3.29Å; I107-A111 WeakPolarHBondContact O-CB 3.49Å; I107-A111 PolarHBondContact O-N 3.18Å; I107-I157 HydrophobicContact CG2-CG2 4.06Å; I107-P158 HydrophobicContact CG2-CB 3.82Å; I107-F161 HydrophobicContact CD1-CB 4.21Å; I107-F161 HydrophobicContact CD1-CD1 3.22Å; I107-F161 HydrophobicContact CD1-CD2 3.48Å; I107-F161 VanDerWaalsContact CD1-CD2 3.48Å; I107-F161 HydrophobicContact CD1-CE1 3.22Å; I107-F161 HydrophobicContact CD1-CE2 3.52Å; I107-F161 HydrophobicContact CD1-CG 3.35Å; I107-F161 HydrophobicContact CD1-CZ 3.38Å; I107-F161 HydrophobicContact CG1-CD1 4.48Å; I107-F161 HydrophobicContact CG1-CD2 4.31Å; I107-F161 HydrophobicContact CG1-CG 4.28Å; I107-Y162 HydrophobicContact CG2-CE2 4.23Å
108Y96.8Very high96.3Very high4 Ų447.5 Ų47.52%0.01625%0.249CC..Hα-helixtrans-66-41.8178.5-82.1-90.8000111.8D90 L95 D104 I110 A111 L112 Y162 A292 V293 M296D90-Y108 WeakPolarHBondContact OD2-CD1 3.44Å; L95-Y108 HydrophobicContact CD1-CD2 4.48Å; L95-Y108 HydrophobicContact CD1-CG 4.48Å; L95-Y108 HydrophobicContact CD2-CD2 3.79Å; L95-Y108 HydrophobicContact CD2-CE2 3.94Å; L95-Y108 HydrophobicContact CD2-CG 4.28Å; D104-Y108 VanDerWaalsContact O-CD2 3.28Å; D104-Y108 WeakPolarHBondContact O-CD2 3.4Å; D104-Y108 PolarHBondContact O-N 3.03Å; Y108-I110 PolarHBondContact O-N 3.3Å; Y108-A111 PolarHBondContact O-N 2.89Å; Y108-L112 WeakPolarHBondContact O-CB 3.27Å; Y108-L112 WeakPolarHBondContact O-CG 3.16Å; Y108-L112 PolarHBondContact O-N 2.88Å; Y108-Y162 HydrophobicContact CE2-CE2 4.05Å; Y108-Y162 VanDerWaalsContact CE2-OH 3.29Å; Y108-Y162 WeakPolarHBondContact CE2-OH 3.44Å; Y108-A292 HydrophobicContact CE1-CB 4.32Å; Y108-A292 PolarHBondContact OH-O 3.06Å; Y108-V293 HydrophobicContact CE1-CG2 3.69Å; Y108-V293 WeakPolarHBondContact OH-CA 3.15Å; Y108-V293 PolarHBondContact OH-N 3.23Å; Y108-M296 HydrophobicContact CE2-CB 4.45Å; Y108-M296 HydrophobicContact CE2-CG 4.4Å; Y108-M296 HydrophobicContact CE2-SD 3.96Å
109C97.6Very high96.7Very high64 Ų6446.2 Ų46.243%0.43224%0.24SC..Hα-helixtrans-56.3-49174.1-82.20000111.6M91 Y105 V106 F113M91-C109 HydrophobicContact CE-CB 4.46Å; M91-C109 WeakPolarHBondContact CE-SG 3.27Å; M91-C109 VanDerWaalsContact SD-SG 3.63Å; Y105-C109 WeakPolarHBondContact O-CB 3.4Å; Y105-C109 PolarHBondContact O-N 2.73Å; Y105-C109 PolarHBondContact O-SG 3.45Å; V106-C109 PolarHBondContact O-N 3.34Å; C109-F113 WeakPolarHBondContact O-CB 3.27Å; C109-F113 PolarHBondContact O-N 3.06Å
110I98.1Very high97.1Very high74 Ų7447.1 Ų47.138%0.37923%0.231SC..Hα-helixtrans-67-47.6-179.3-63.7166.5000110.7V106 I107 Y108 L112 F113 C114 I157V106-I110 HydrophobicContact CG1-CD1 3.66Å; V106-I110 HydrophobicContact CG1-CG1 4.44Å; V106-I110 VanDerWaalsContact O-CG1 3.26Å; V106-I110 WeakPolarHBondContact O-CG1 3.35Å; V106-I110 PolarHBondContact O-N 3.44Å; I107-I110 PolarHBondContact O-N 3.33Å; Y108-I110 PolarHBondContact O-N 3.3Å; I110-L112 PolarHBondContact O-N 3.25Å; I110-F113 PolarHBondContact O-N 3Å; I110-C114 WeakPolarHBondContact O-CB 3.41Å; I110-C114 PolarHBondContact O-N 3.35Å; I110-C114 PolarHBondContact O-SG 2.92Å; I110-I157 HydrophobicContact CB-CD1 4.49Å; I110-I157 HydrophobicContact CG2-CD1 3.44Å; I110-I157 VanDerWaalsContact CG2-CD1 3.44Å
111A98Very high97.4Very high4 Ų447.3 Ų47.33%0.03323%0.231CC..Hα-helixtrans-59.9-47.6-178.100000112.1I107 Y108 C114 F115 P158I107-A111 VanDerWaalsContact O-CB 3.29Å; I107-A111 WeakPolarHBondContact O-CB 3.49Å; I107-A111 PolarHBondContact O-N 3.18Å; Y108-A111 PolarHBondContact O-N 2.89Å; A111-C114 WeakPolarHBondContact O-CB 3.32Å; A111-C114 PolarHBondContact O-N 2.85Å; A111-F115 WeakPolarHBondContact O-CD1 3.28Å; A111-F115 VanDerWaalsContact O-CG 3.31Å; A111-F115 WeakPolarHBondContact O-CG 3.06Å; A111-F115 PolarHBondContact O-N 3.46Å; A111-P158 HydrophobicContact CB-CG 4.03Å
112L98.4Very high97.7Very high4 Ų444.9 Ų44.92%0.02122%0.218CC..Hα-helixtrans-70.2-33.7178.9-73.5166.2000112.5F83 L86 G87 Y108 I110 C114 F115 Q116F83-L112 HydrophobicContact CB-CD2 4.17Å; F83-L112 HydrophobicContact CD1-CD2 4.09Å; L86-L112 HydrophobicContact CB-CD2 4.34Å; G87-L112 VanDerWaalsContact CA-CD1 3.48Å; Y108-L112 WeakPolarHBondContact O-CB 3.27Å; Y108-L112 WeakPolarHBondContact O-CG 3.16Å; Y108-L112 PolarHBondContact O-N 2.88Å; I110-L112 PolarHBondContact O-N 3.25Å; L112-C114 VanDerWaalsContact C-N 3.35Å; L112-F115 HydrophobicContact CD2-CD2 4.3Å; L112-F115 PolarHBondContact O-N 2.88Å; L112-Q116 WeakPolarHBondContact O-CB 3.27Å; L112-Q116 VanDerWaalsContact O-CG 3.25Å; L112-Q116 WeakPolarHBondContact O-CG 3.28Å; L112-Q116 PolarHBondContact O-N 3.33Å; L112-Q116 PolarHBondContact O-NE2 3.29Å
113F98.6Very high97.9Very high128 Ų12834.6 Ų34.656%0.56118%0.18SC*.Hα-helixtrans-61.7-45.2170.8177.5-101.7000110.9C109 I110 F115 Q116 V117C109-F113 WeakPolarHBondContact O-CB 3.27Å; C109-F113 PolarHBondContact O-N 3.06Å; I110-F113 PolarHBondContact O-N 3Å; F113-F115 VanDerWaalsContact C-N 3.34Å; F113-F115 PolarHBondContact O-N 3.24Å; F113-Q116 PolarHBondContact O-N 3Å; F113-V117 HydrophobicContact CD1-CG2 4.2Å; F113-V117 HydrophobicContact CD2-CG2 4.43Å; F113-V117 HydrophobicContact CE1-CG2 3.76Å; F113-V117 HydrophobicContact CE2-CG2 4.01Å; F113-V117 HydrophobicContact CZ-CG2 3.66Å; F113-V117 WeakPolarHBondContact O-CG2 3.26Å; F113-V117 PolarHBondContact O-N 3.06Å
114C98.8Very high98.1Very high8 Ų830.2 Ų30.25%0.05416%0.161CC..Hα-helixtrans-58.5-43.6175.6-73.20000112.3I110 A111 L112 V117 C118 V150I110-C114 WeakPolarHBondContact O-CB 3.41Å; I110-C114 PolarHBondContact O-N 3.35Å; I110-C114 PolarHBondContact O-SG 2.92Å; A111-C114 WeakPolarHBondContact O-CB 3.32Å; A111-C114 PolarHBondContact O-N 2.85Å; L112-C114 VanDerWaalsContact C-N 3.35Å; C114-V117 PolarHBondContact O-N 3.43Å; C114-C118 WeakPolarHBondContact O-CB 3.47Å; C114-C118 PolarHBondContact O-N 3.23Å; C114-V150 HydrophobicContact CB-CG1 3.79Å; C114-V150 WeakPolarHBondContact CB-O 3.32Å
115F98.8Very high98.2Very high3 Ų331.5 Ų31.51%0.01317%0.166CC..Hα-helixtrans-64.5-42.8177.2-62-10.9000111.8F83 A111 L112 F113 C118 M119 L285 H289F83-F115 HydrophobicContact CB-CB 4.37Å; F83-F115 HydrophobicContact CD1-CB 4.17Å; F83-F115 AromaticContact CD1-CD2 3.87Å; F83-F115 HydrophobicContact CD1-CD2 3.87Å; F83-F115 HydrophobicContact CD2-CB 3.93Å; F83-F115 AromaticContact CE1-CD2 3.96Å; F83-F115 HydrophobicContact CE1-CD2 3.96Å; F83-F115 HydrophobicContact CE2-CB 4.36Å; F83-F115 HydrophobicContact CG-CB 3.87Å; F83-F115 HydrophobicContact CG-CD2 4.43Å; A111-F115 WeakPolarHBondContact O-CD1 3.28Å; A111-F115 VanDerWaalsContact O-CG 3.31Å; A111-F115 WeakPolarHBondContact O-CG 3.06Å; A111-F115 PolarHBondContact O-N 3.46Å; L112-F115 HydrophobicContact CD2-CD2 4.3Å; L112-F115 PolarHBondContact O-N 2.88Å; F113-F115 VanDerWaalsContact C-N 3.34Å; F113-F115 PolarHBondContact O-N 3.24Å; F115-C118 WeakPolarHBondContact O-CB 3.33Å; F115-C118 PolarHBondContact O-N 3.38Å; F115-M119 VanDerWaalsContact O-CG 3.26Å; F115-M119 WeakPolarHBondContact O-CG 3.41Å; F115-M119 PolarHBondContact O-N 3.5Å; F115-L285 HydrophobicContact CB-CD1 4.1Å; F115-L285 HydrophobicContact CD1-CD1 3.95Å; F115-L285 HydrophobicContact CD1-CD2 3.82Å; F115-L285 HydrophobicContact CD1-CG 4.34Å; F115-L285 HydrophobicContact CD2-CB 4.22Å; F115-L285 HydrophobicContact CE1-CD2 3.66Å; F115-L285 HydrophobicContact CE2-CB 4.35Å; F115-L285 HydrophobicContact CG-CB 4.34Å; F115-L285 HydrophobicContact CG-CD1 4Å; F115-L285 HydrophobicContact CG-CD2 4.42Å; F115-L285 HydrophobicContact CZ-CD2 4.12Å; F115-H289 HydrophobicContact CE2-CB 4.43Å
116Q98.8Very high98.3Very high32 Ų3228.1 Ų28.115%0.1515%0.153CC..Hα-helixtrans-61.6-44.3176.2-75169.982.900112.3F80 F83 L112 F113 M119 L120F80-Q116 HydrophobicContact CD2-CB 3.77Å; F80-Q116 HydrophobicContact CD2-CG 3.83Å; F80-Q116 HydrophobicContact CE2-CB 3.93Å; F80-Q116 HydrophobicContact CE2-CG 3.95Å; F83-Q116 HydrophobicContact CB-CG 3.92Å; L112-Q116 WeakPolarHBondContact O-CB 3.27Å; L112-Q116 VanDerWaalsContact O-CG 3.25Å; L112-Q116 WeakPolarHBondContact O-CG 3.28Å; L112-Q116 PolarHBondContact O-N 3.33Å; L112-Q116 PolarHBondContact O-NE2 3.29Å; F113-Q116 PolarHBondContact O-N 3Å; Q116-M119 PolarHBondContact O-N 2.89Å; Q116-L120 WeakPolarHBondContact O-CB 3.4Å; Q116-L120 WeakPolarHBondContact O-CG 3.48Å; Q116-L120 PolarHBondContact O-N 2.82Å
117V98.8Very high98.3Very high35 Ų3525.9 Ų25.921%0.21214%0.138CC..Hα-helixtrans-61.6-45.9176.3170.80000110.8F113 C114 M119 L120 C121 V150F113-V117 HydrophobicContact CD1-CG2 4.2Å; F113-V117 HydrophobicContact CD2-CG2 4.43Å; F113-V117 HydrophobicContact CE1-CG2 3.76Å; F113-V117 HydrophobicContact CE2-CG2 4.01Å; F113-V117 HydrophobicContact CZ-CG2 3.66Å; F113-V117 WeakPolarHBondContact O-CG2 3.26Å; F113-V117 PolarHBondContact O-N 3.06Å; C114-V117 PolarHBondContact O-N 3.43Å; V117-M119 VanDerWaalsContact C-N 3.31Å; V117-M119 PolarHBondContact O-N 3.46Å; V117-L120 PolarHBondContact O-N 2.84Å; V117-C121 VanDerWaalsContact O-CB 3.31Å; V117-C121 WeakPolarHBondContact O-CB 3.48Å; V117-C121 PolarHBondContact O-N 3.36Å; V117-C121 PolarHBondContact O-SG 2.99Å; V117-V150 HydrophobicContact CB-CG1 4.15Å; V117-V150 HydrophobicContact CG1-CB 4.44Å; V117-V150 HydrophobicContact CG1-CG1 4.08Å
118C98.7Very high98.3Very high8 Ų826.3 Ų26.35%0.05414%0.139CC..Hα-helixtrans-54.3-47.7175.6-178.50000111.7C114 F115 S122 G147C114-C118 WeakPolarHBondContact O-CB 3.47Å; C114-C118 PolarHBondContact O-N 3.23Å; F115-C118 WeakPolarHBondContact O-CB 3.33Å; F115-C118 PolarHBondContact O-N 3.38Å; C118-S122 WeakPolarHBondContact O-CB 3.29Å; C118-S122 PolarHBondContact O-N 3.43Å; C118-G147 VanDerWaalsContact CB-O 3.31Å; C118-G147 WeakPolarHBondContact CB-O 3.48Å; C118-G147 PolarHBondContact SG-O 3.24Å
119M98.7Very high98.2Very high0 Ų026.4 Ų26.40%014%0.141CC..Hα-helixtrans-64-47.1179.8-69.2-60.4142.800112.4H76 F80 F83 F115 Q116 V117 S122 A123 V281 V282 L285H76-M119 HydrophobicContact CB-SD 3.99Å; H76-M119 VanDerWaalsContact CD2-SD 3.5Å; H76-M119 WeakPolarHBondContact O-CB 3.1Å; F80-M119 HydrophobicContact CB-CB 3.92Å; F83-M119 HydrophobicContact CD2-CG 3.97Å; F83-M119 HydrophobicContact CE2-CE 3.98Å; F83-M119 HydrophobicContact CE2-CG 4Å; F83-M119 HydrophobicContact CE2-SD 4.42Å; F115-M119 VanDerWaalsContact O-CG 3.26Å; F115-M119 WeakPolarHBondContact O-CG 3.41Å; F115-M119 PolarHBondContact O-N 3.5Å; Q116-M119 PolarHBondContact O-N 2.89Å; V117-M119 VanDerWaalsContact C-N 3.31Å; V117-M119 PolarHBondContact O-N 3.46Å; M119-S122 PolarHBondContact O-N 3.08Å; M119-A123 WeakPolarHBondContact O-CB 3.3Å; M119-A123 PolarHBondContact O-N 3.32Å; M119-V281 HydrophobicContact CE-CG1 4.03Å; M119-V282 HydrophobicContact CE-CG2 3.84Å; M119-V282 HydrophobicContact SD-CG2 3.77Å; M119-L285 HydrophobicContact CE-CD1 3.49Å; M119-L285 VanDerWaalsContact CE-CD1 3.49Å
120L98.6Very high98.1Very high78 Ų7823.4 Ų23.441%0.40812%0.12SC..Hα-helixtrans-67.8-42.8-178.7-74175.9000113F80 Q116 V117 S122 G124F80-L120 HydrophobicContact CB-CD2 4.24Å; F80-L120 HydrophobicContact CB-CG 4.39Å; F80-L120 HydrophobicContact CD1-CD2 4.14Å; F80-L120 HydrophobicContact CD2-CD1 3.68Å; F80-L120 HydrophobicContact CD2-CD2 3.85Å; F80-L120 HydrophobicContact CD2-CG 3.52Å; F80-L120 HydrophobicContact CE2-CD1 3.57Å; F80-L120 HydrophobicContact CE2-CD2 4.27Å; F80-L120 HydrophobicContact CE2-CG 3.96Å; F80-L120 HydrophobicContact CG-CD1 4.46Å; F80-L120 HydrophobicContact CG-CD2 3.79Å; F80-L120 HydrophobicContact CG-CG 3.94Å; F80-L120 HydrophobicContact CZ-CD1 4.27Å; Q116-L120 WeakPolarHBondContact O-CB 3.4Å; Q116-L120 WeakPolarHBondContact O-CG 3.48Å; Q116-L120 PolarHBondContact O-N 2.82Å; V117-L120 PolarHBondContact O-N 2.84Å; L120-S122 VanDerWaalsContact C-N 3.26Å; L120-S122 PolarHBondContact O-N 3.2Å; L120-G124 PolarHBondContact O-N 3.12Å
121C98.6Very high98.1Very high20 Ų2020.7 Ų20.714%0.13511%0.106CC..Hα-helixtrans-57.5-44.4176.7-77.60000111.1V117 G124 Y125 L143V117-C121 VanDerWaalsContact O-CB 3.31Å; V117-C121 WeakPolarHBondContact O-CB 3.48Å; V117-C121 PolarHBondContact O-N 3.36Å; V117-C121 PolarHBondContact O-SG 2.99Å; C121-G124 PolarHBondContact O-N 2.96Å; C121-Y125 PolarHBondContact O-N 3.31Å; C121-L143 VanDerWaalsContact CB-O 3.28Å; C121-L143 WeakPolarHBondContact CB-O 3.36Å
122S98.6Very high97.9Very high4 Ų425.4 Ų25.43%0.02813%0.13CC..Hα-helixtrans-71.4-46.6-179-172.70000113.3H76 C118 M119 L120 G124 Y125 H126 D144 H278H76-S122 PolarHBondContact CE1-OG 3.32Å; H76-S122 WeakPolarHBondContact ND1-CB 3.13Å; H76-S122 PolarHBondContact ND1-OG 3.33Å; C118-S122 WeakPolarHBondContact O-CB 3.29Å; C118-S122 PolarHBondContact O-N 3.43Å; M119-S122 PolarHBondContact O-N 3.08Å; L120-S122 VanDerWaalsContact C-N 3.26Å; L120-S122 PolarHBondContact O-N 3.2Å; S122-G124 PolarHBondContact O-N 3.27Å; S122-Y125 PolarHBondContact O-N 3.45Å; S122-Y125 VanDerWaalsContact O-N 3.17Å; S122-H126 PolarHBondContact O-CD2 3.4Å; S122-H126 VanDerWaalsContact O-CD2 3.25Å; S122-H126 PolarHBondContact O-N 3.1Å; S122-D144 WeakPolarHBondContact CA-OD1 3.2Å; S122-D144 WeakPolarHBondContact CB-OD1 3.47Å; S122-D144 PolarHBondContact OG-OD1 2.9Å; S122-D144 VanDerWaalsContact OG-OD1 3.1Å; S122-H278 PolarHBondContact OG-CE1 3.14Å
123A98.6Very high97.7Very high2 Ų227 Ų272%0.01714%0.141CC..Hα-helixtrans-59.2-39172.600000111.6H76 L77 M119 H126 M127H76-A123 HydrophobicContact CB-CB 4.1Å; L77-A123 HydrophobicContact CD2-CB 3.76Å; L77-A123 HydrophobicContact CG-CB 3.96Å; M119-A123 WeakPolarHBondContact O-CB 3.3Å; M119-A123 PolarHBondContact O-N 3.32Å; A123-H126 PolarHBondContact O-N 3.45Å; A123-M127 WeakPolarHBondContact O-CB 3.39Å; A123-M127 PolarHBondContact O-N 2.97Å
124G98.4Very high97.5Very high6 Ų625.3 Ų25.36%0.06214%0.135CC..Hα-helixtrans-58.6-48.2173.700000112.4L120 C121 S122 M127 F128L120-G124 PolarHBondContact O-N 3.12Å; C121-G124 PolarHBondContact O-N 2.96Å; S122-G124 PolarHBondContact O-N 3.27Å; G124-M127 PolarHBondContact O-N 2.91Å; G124-F128 VanDerWaalsContact O-CD2 3.27Å; G124-F128 WeakPolarHBondContact O-CD2 3.41Å; G124-F128 PolarHBondContact O-N 3.38Å
125Y98.1Very high97.2Very high26 Ų2632.3 Ų32.310%0.10217%0.165CC..Hα-helixtrans-58.8-53.6174.9169.4-112.7000112.7C121 S122 M127 F128 S129 W140 L141 D144C121-Y125 PolarHBondContact O-N 3.31Å; S122-Y125 PolarHBondContact O-N 3.45Å; S122-Y125 VanDerWaalsContact O-N 3.17Å; Y125-M127 PolarHBondContact O-N 3.18Å; Y125-F128 CarbonylContact O-C 3.51Å; Y125-F128 PolarHBondContact O-N 2.8Å; Y125-F128 VanDerWaalsContact O-N 3.1Å; Y125-S129 WeakPolarHBondContact O-CA 3.44Å; Y125-S129 VanDerWaalsContact O-CB 3.3Å; Y125-S129 WeakPolarHBondContact O-CB 3.44Å; Y125-S129 PolarHBondContact O-N 3.21Å; Y125-W140 HydrophobicContact CD2-CB 4.12Å; Y125-L141 HydrophobicContact CD2-CB 3.89Å; Y125-L141 HydrophobicContact CD2-CD1 4.37Å; Y125-L141 HydrophobicContact CE1-CD1 4.12Å; Y125-L141 HydrophobicContact CE2-CB 3.64Å; Y125-L141 HydrophobicContact CE2-CD1 3.87Å; Y125-L141 HydrophobicContact CE2-CG 4.29Å; Y125-D144 HydrophobicContact CD1-CB 4.36Å; Y125-D144 HydrophobicContact CG-CB 4.15Å
126H97.9Very high97Very high4 Ų433.6 Ų33.62%0.01917%0.173CC..Hα-helixtrans-63.5-26.7-179.1-72.8-71.1000112.6R51 E69 N72 I73 S122 A123 S129 H274 H278R51-H126 PolarHBondContact NH2-O 3.17Å; E69-H126 IonicContact OE2-CE1 3.91Å; E69-H126 IonicContact OE2-CG 3.86Å; E69-H126 IonicContact OE2-ND1 3.81Å; E69-H126 PolarHBondContact OE2-ND1 2.8Å; N72-H126 HydrophobicContact CB-CB 4.16Å; I73-H126 HydrophobicContact CG1-CB 3.65Å; S122-H126 PolarHBondContact O-CD2 3.4Å; S122-H126 VanDerWaalsContact O-CD2 3.25Å; S122-H126 PolarHBondContact O-N 3.1Å; A123-H126 PolarHBondContact O-N 3.45Å; H126-S129 PolarHBondContact O-OG 3.35Å; H126-H274 AromaticContact CE1-CD2 3.63Å; H126-H274 AromaticContact CE1-NE2 3.19Å; H126-H274 PolarHBondContact CE1-NE2 3.33Å; H126-H274 AromaticContact NE2-CD2 3.98Å; H126-H274 AromaticContact NE2-NE2 3.24Å; H126-H274 PolarHBondContact NE2-NE2 3.11Å; H126-H278 AromaticContact CD2-CE1 3.54Å; H126-H278 AromaticContact CD2-NE2 3.6Å; H126-H278 AromaticContact CE1-NE2 3.75Å; H126-H278 AromaticContact NE2-CE1 3.32Å; H126-H278 PolarHBondContact NE2-CE1 3.01Å; H126-H278 VanDerWaalsContact NE2-CE1 3.32Å; H126-H278 AromaticContact NE2-NE2 3.07Å; H126-H278 PolarHBondContact NE2-NE2 3.38Å
127M97.7Very high96.8Very high27 Ų2732.4 Ų32.413%0.13317%0.168CC..Hα-helixtrans-73.3-42.1173-179.3164.264.700113.1L60 I63 I73 A123 G124 Y125 C130L60-M127 HydrophobicContact CD2-CE 3.73Å; L60-M127 HydrophobicContact CD2-SD 3.71Å; I63-M127 HydrophobicContact CD1-SD 3.38Å; I63-M127 WeakPolarHBondContact CD1-SD 3.48Å; I63-M127 HydrophobicContact CG1-CG 4.26Å; I63-M127 HydrophobicContact CG1-SD 3.65Å; I73-M127 HydrophobicContact CD1-CB 4.41Å; A123-M127 WeakPolarHBondContact O-CB 3.39Å; A123-M127 PolarHBondContact O-N 2.97Å; G124-M127 PolarHBondContact O-N 2.91Å; Y125-M127 PolarHBondContact O-N 3.18Å; M127-C130 PolarHBondContact O-SG 3.32Å
128F97.7Very high96.5Very high21 Ų2134.1 Ų34.19%0.09217%0.174CC..Hα-helixtrans-100.3-0.5-174.2-70.2-73.4000114.9C59 L60 G124 Y125 C130 H131 W140C59-F128 HydrophobicContact CB-CD1 3.59Å; C59-F128 HydrophobicContact CB-CE1 3.77Å; C59-F128 HydrophobicContact CB-CG 4.48Å; L60-F128 HydrophobicContact CD2-CZ 3.91Å; L60-F128 HydrophobicContact CG-CZ 4.2Å; G124-F128 VanDerWaalsContact O-CD2 3.27Å; G124-F128 WeakPolarHBondContact O-CD2 3.41Å; G124-F128 PolarHBondContact O-N 3.38Å; Y125-F128 CarbonylContact O-C 3.51Å; Y125-F128 PolarHBondContact O-N 2.8Å; Y125-F128 VanDerWaalsContact O-N 3.1Å; F128-C130 PolarHBondContact O-N 2.87Å; F128-C130 VanDerWaalsContact O-N 3.14Å; F128-H131 WeakPolarHBondContact O-CB 3.49Å; F128-H131 PolarHBondContact O-N 2.62Å; F128-W140 HydrophobicContact CB-CD2 4.18Å; F128-W140 HydrophobicContact CB-CG 3.79Å; F128-W140 AromaticContact CD2-CD2 3.89Å; F128-W140 HydrophobicContact CD2-CD2 3.89Å; F128-W140 AromaticContact CD2-CE2 3.28Å; F128-W140 HydrophobicContact CD2-CE3 4.47Å; F128-W140 HydrophobicContact CD2-CG 4.4Å; F128-W140 HydrophobicContact CD2-CH2 4.05Å; F128-W140 AromaticContact CD2-CZ2 3.38Å; F128-W140 HydrophobicContact CD2-CZ2 3.38Å; F128-W140 AromaticContact CD2-NE1 3.45Å; F128-W140 AromaticContact CE2-CE2 3.84Å; F128-W140 HydrophobicContact CE2-CH2 4.03Å; F128-W140 AromaticContact CE2-CZ2 3.43Å; F128-W140 HydrophobicContact CE2-CZ2 3.43Å; F128-W140 VanDerWaalsContact CE2-CZ2 3.43Å; F128-W140 AromaticContact CG-CD1 3.87Å; F128-W140 HydrophobicContact CG-CD2 4.37Å; F128-W140 AromaticContact CG-CE2 3.79Å; F128-W140 HydrophobicContact CG-CG 4.43Å; F128-W140 HydrophobicContact CG-CZ2 4.26Å; F128-W140 AromaticContact CG-NE1 3.43Å; F128-W140 HydrophobicContact CZ-CZ2 4.37Å
129S95.5Very high96.3Very high7 Ų742 Ų425%0.04920%0.202CC..THydrogen-bonded Turntrans-59.4-26.6177.663.10000112.9Y125 H126 H131 C137Y125-S129 WeakPolarHBondContact O-CA 3.44Å; Y125-S129 VanDerWaalsContact O-CB 3.3Å; Y125-S129 WeakPolarHBondContact O-CB 3.44Å; Y125-S129 PolarHBondContact O-N 3.21Å; H126-S129 PolarHBondContact O-OG 3.35Å; S129-H131 VanDerWaalsContact C-N 3.32Å; S129-C137 PolarHBondContact O-SG 3.07Å
130C95.1Very high96.2Very high0 Ų045.3 Ų45.30%022%0.215CC..THydrogen-bonded Turntrans-84.73.3177.364.50000115.2M40 R51 A52 R53 L54 M127 F128M40-C130 HydrophobicContact CE-CB 4.4Å; R51-C130 VanDerWaalsContact C-CB 3.46Å; R51-C130 HydrophobicContact CB-CB 3.57Å; R51-C130 WeakPolarHBondContact O-CB 3.32Å; A52-C130 CarbonylContact C-O 3.52Å; R53-C130 PolarHBondContact N-O 3.11Å; R53-C130 VanDerWaalsContact N-O 3.08Å; L54-C130 PolarHBondContact N-O 2.94Å; L54-C130 VanDerWaalsContact N-O 3.07Å; M127-C130 PolarHBondContact O-SG 3.32Å; F128-C130 PolarHBondContact O-N 2.87Å; F128-C130 VanDerWaalsContact O-N 3.14Å
131H96.8Very high96Very high18 Ų1842.4 Ų42.48%0.08320%0.2CC..BIsolated β-bridgetrans-63.7144.8-175.7-170.6-91.1000111.8L54 S56 F128 S129 S133 T136L54-H131 CarbonylContact O-C 3.55Å; L54-H131 VanDerWaalsContact O-CA 3.32Å; L54-H131 WeakPolarHBondContact O-CA 3.33Å; L54-H131 PolarHBondContact O-CD2 2.66Å; S56-H131 PolarHBondContact OG-NE2 3.19Å; F128-H131 WeakPolarHBondContact O-CB 3.49Å; F128-H131 PolarHBondContact O-N 2.62Å; S129-H131 VanDerWaalsContact C-N 3.32Å; H131-S133 WeakPolarHBondContact ND1-CB 3.32Å; H131-S133 PolarHBondContact ND1-N 2.86Å; H131-S133 PolarHBondContact O-N 2.72Å; H131-T136 HydrophobicContact CB-CG2 4.2Å; H131-T136 WeakPolarHBondContact ND1-CB 3.32Å
132L94.6Very high95.8Very high102 Ų10242.5 Ų42.553%0.53420%0.202SC..SBendtrans-62.2-28.5-177.77293000113.7L54 Q55L54-L132 PolarHBondContact O-N 2.97Å; Q55-L132 HydrophobicContact CB-CD2 4.31Å; Q55-L132 HydrophobicContact CG-CD2 3.5Å
133S95.2Very high95.7Very high37 Ų3745.9 Ų45.926%0.25922%0.219SC..  trans-90.6114.4176.2174.20000110.3H131 K135 T136 C137H131-S133 WeakPolarHBondContact ND1-CB 3.32Å; H131-S133 PolarHBondContact ND1-N 2.86Å; H131-S133 PolarHBondContact O-N 2.72Å; S133-K135 PolarHBondContact O-N 3.3Å; S133-T136 WeakPolarHBondContact O-CB 3.12Å; S133-T136 PolarHBondContact O-N 3.26Å; S133-T136 PolarHBondContact OG-N 2.95Å; S133-T136 PolarHBondContact OG-OG1 3.39Å; S133-C137 PolarHBondContact O-N 2.83Å
134E93.4Very high95.7Very high94 Ų9446.5 Ų46.544%0.43922%0.222SC..Hα-helixtrans-56.2-38.5173.3-176.1177.2167.500111.9F39 T136 C137 H138F39-E134 HydrophobicContact CB-CG 4.44Å; F39-E134 HydrophobicContact CD1-CB 4.32Å; F39-E134 HydrophobicContact CD1-CG 3.92Å; F39-E134 HydrophobicContact CD2-CG 4.24Å; F39-E134 HydrophobicContact CE1-CB 4.1Å; F39-E134 HydrophobicContact CE1-CG 4.19Å; F39-E134 HydrophobicContact CG-CG 3.96Å; F39-E134 HydrophobicContact CZ-CB 4.3Å; F39-E134 HydrophobicContact CZ-CG 4.49Å; E134-T136 VanDerWaalsContact C-N 3.26Å; E134-T136 PolarHBondContact O-N 3.26Å; E134-C137 WeakPolarHBondContact O-CB 3.39Å; E134-C137 PolarHBondContact O-N 3.47Å; E134-C137 VanDerWaalsContact O-N 3.11Å; E134-H138 PolarHBondContact O-N 3.32Å; E134-H138 IonicContact OE1-CE1 3.58Å; E134-H138 PolarHBondContact OE1-CE1 3.25Å; E134-H138 VanDerWaalsContact OE1-CE1 3.25Å; E134-H138 IonicContact OE1-NE2 3.49Å
135K92.9Very high95.5Very high154 Ų15447.1 Ų47.167%0.6722%0.223SC*.Hα-helixtrans-58.5-39.2175.5-63.2-176.9-178.71800112S133 R139S133-K135 PolarHBondContact O-N 3.3Å; K135-R139 VanDerWaalsContact O-CG 3.28Å; K135-R139 WeakPolarHBondContact O-CG 3.39Å; K135-R139 PolarHBondContact O-N 3.1Å
136T94.4Very high95.4Very high31 Ų3147.9 Ų47.919%0.1923%0.231CC..Hα-helixtrans-67.8-44176.7-59.70000110.6H131 S133 E134 H138 R139 W140H131-T136 HydrophobicContact CB-CG2 4.2Å; H131-T136 WeakPolarHBondContact ND1-CB 3.32Å; S133-T136 WeakPolarHBondContact O-CB 3.12Å; S133-T136 PolarHBondContact O-N 3.26Å; S133-T136 PolarHBondContact OG-N 2.95Å; S133-T136 PolarHBondContact OG-OG1 3.39Å; E134-T136 VanDerWaalsContact C-N 3.26Å; E134-T136 PolarHBondContact O-N 3.26Å; T136-H138 PolarHBondContact O-N 3.34Å; T136-R139 PolarHBondContact O-N 3.17Å; T136-W140 PolarHBondContact O-N 3.44Å
137C93.7Very high95.5Very high7 Ų747.7 Ų47.75%0.04723%0.23CC..Hα-helixtrans-57.3-48.3175.4-178.50000111.5F39 S129 S133 E134 R139 W140 L141F39-C137 HydrophobicContact CE2-CB 4.21Å; S129-C137 PolarHBondContact O-SG 3.07Å; S133-C137 PolarHBondContact O-N 2.83Å; E134-C137 WeakPolarHBondContact O-CB 3.39Å; E134-C137 PolarHBondContact O-N 3.47Å; E134-C137 VanDerWaalsContact O-N 3.11Å; C137-R139 PolarHBondContact O-N 3.05Å; C137-W140 PolarHBondContact O-N 2.93Å; C137-L141 PolarHBondContact O-N 3.17Å
138H92.4Very high95.5Very high70 Ų7048.5 Ų48.532%0.32423%0.234SC..Hα-helixtrans-64.3-37.7179-68.9178000113.3E134 T136 L141 A142E134-H138 PolarHBondContact O-N 3.32Å; E134-H138 IonicContact OE1-CE1 3.58Å; E134-H138 PolarHBondContact OE1-CE1 3.25Å; E134-H138 VanDerWaalsContact OE1-CE1 3.25Å; E134-H138 IonicContact OE1-NE2 3.49Å; T136-H138 PolarHBondContact O-N 3.34Å; H138-L141 PolarHBondContact O-N 3.29Å; H138-A142 PolarHBondContact O-N 2.92Å
139R94.4Very high95.4Very high173 Ų17347.5 Ų47.565%0.65323%0.229SC*.Hα-helixtrans-63.2-43174.6-75.7171.4-179.4175.7-1.5112K135 T136 C137 A142 L143K135-R139 VanDerWaalsContact O-CG 3.28Å; K135-R139 WeakPolarHBondContact O-CG 3.39Å; K135-R139 PolarHBondContact O-N 3.1Å; T136-R139 PolarHBondContact O-N 3.17Å; C137-R139 PolarHBondContact O-N 3.05Å; R139-A142 WeakPolarHBondContact O-CB 3.45Å; R139-A142 PolarHBondContact O-N 3.47Å; R139-L143 WeakPolarHBondContact O-CG 3.32Å; R139-L143 PolarHBondContact O-N 2.75Å
140W96.6Very high95.6Very high70 Ų7048.3 Ų48.327%0.26523%0.234SC..Hα-helixtrans-67.5-37.6176.1-81110.5000112.4Y125 F128 T136 C137 A142 L143 D144Y125-W140 HydrophobicContact CD2-CB 4.12Å; F128-W140 HydrophobicContact CB-CD2 4.18Å; F128-W140 HydrophobicContact CB-CG 3.79Å; F128-W140 AromaticContact CD2-CD2 3.89Å; F128-W140 HydrophobicContact CD2-CD2 3.89Å; F128-W140 AromaticContact CD2-CE2 3.28Å; F128-W140 HydrophobicContact CD2-CE3 4.47Å; F128-W140 HydrophobicContact CD2-CG 4.4Å; F128-W140 HydrophobicContact CD2-CH2 4.05Å; F128-W140 AromaticContact CD2-CZ2 3.38Å; F128-W140 HydrophobicContact CD2-CZ2 3.38Å; F128-W140 AromaticContact CD2-NE1 3.45Å; F128-W140 AromaticContact CE2-CE2 3.84Å; F128-W140 HydrophobicContact CE2-CH2 4.03Å; F128-W140 AromaticContact CE2-CZ2 3.43Å; F128-W140 HydrophobicContact CE2-CZ2 3.43Å; F128-W140 VanDerWaalsContact CE2-CZ2 3.43Å; F128-W140 AromaticContact CG-CD1 3.87Å; F128-W140 HydrophobicContact CG-CD2 4.37Å; F128-W140 AromaticContact CG-CE2 3.79Å; F128-W140 HydrophobicContact CG-CG 4.43Å; F128-W140 HydrophobicContact CG-CZ2 4.26Å; F128-W140 AromaticContact CG-NE1 3.43Å; F128-W140 HydrophobicContact CZ-CZ2 4.37Å; T136-W140 PolarHBondContact O-N 3.44Å; C137-W140 PolarHBondContact O-N 2.93Å; W140-A142 VanDerWaalsContact C-N 3.3Å; W140-A142 PolarHBondContact O-N 3.33Å; W140-L143 HydrophobicContact CD2-CD1 4.34Å; W140-L143 HydrophobicContact CE3-CD1 3.87Å; W140-L143 HydrophobicContact CZ3-CD1 4.05Å; W140-L143 PolarHBondContact O-N 3.01Å; W140-D144 PolarHBondContact O-N 2.94Å
141L94.8Very high95.7Very high18 Ų1848.4 Ų48.49%0.09424%0.235CC..Hα-helixtrans-60.7-40.2172.2179.361.4000111.6Y125 C137 H138 D144 F145Y125-L141 HydrophobicContact CD2-CB 3.89Å; Y125-L141 HydrophobicContact CD2-CD1 4.37Å; Y125-L141 HydrophobicContact CE1-CD1 4.12Å; Y125-L141 HydrophobicContact CE2-CB 3.64Å; Y125-L141 HydrophobicContact CE2-CD1 3.87Å; Y125-L141 HydrophobicContact CE2-CG 4.29Å; C137-L141 PolarHBondContact O-N 3.17Å; H138-L141 PolarHBondContact O-N 3.29Å; L141-D144 PolarHBondContact O-N 3.43Å; L141-F145 HydrophobicContact CD1-CD2 4.45Å; L141-F145 HydrophobicContact CD1-CE2 3.76Å; L141-F145 HydrophobicContact CD1-CZ 3.77Å; L141-F145 HydrophobicContact CD2-CE2 4.21Å; L141-F145 HydrophobicContact CG-CD2 4.27Å; L141-F145 HydrophobicContact CG-CE2 3.67Å; L141-F145 HydrophobicContact CG-CZ 4.2Å; L141-F145 WeakPolarHBondContact O-CD2 3.37Å; L141-F145 PolarHBondContact O-N 2.84Å; L141-F145 VanDerWaalsContact O-N 3.16Å
142A94.9Very high95.8Very high21 Ų2148.9 Ų48.917%0.17424%0.238CC..Hα-helixtrans-62.7-44.3173.900000111.7H138 R139 W140 D144 F145 V146 Q189 H195H138-A142 PolarHBondContact O-N 2.92Å; R139-A142 WeakPolarHBondContact O-CB 3.45Å; R139-A142 PolarHBondContact O-N 3.47Å; W140-A142 VanDerWaalsContact C-N 3.3Å; W140-A142 PolarHBondContact O-N 3.33Å; A142-D144 VanDerWaalsContact C-N 3.3Å; A142-D144 PolarHBondContact O-N 3.08Å; A142-F145 PolarHBondContact O-N 2.93Å; A142-V146 WeakPolarHBondContact O-CG2 3.24Å; A142-V146 PolarHBondContact O-N 3.34Å; A142-Q189 PolarHBondContact O-OE1 3.11Å; A142-H195 WeakPolarHBondContact CB-CE1 3.44Å
143L96.8Very high96Very high76 Ų7645.6 Ų45.640%0.39822%0.221SC..Hα-helixtrans-61.5-36.6175.6-70.3173.7000112.5C121 R139 W140 V146 G147C121-L143 VanDerWaalsContact CB-O 3.28Å; C121-L143 WeakPolarHBondContact CB-O 3.36Å; R139-L143 WeakPolarHBondContact O-CG 3.32Å; R139-L143 PolarHBondContact O-N 2.75Å; W140-L143 HydrophobicContact CD2-CD1 4.34Å; W140-L143 HydrophobicContact CE3-CD1 3.87Å; W140-L143 HydrophobicContact CZ3-CD1 4.05Å; W140-L143 PolarHBondContact O-N 3.01Å; L143-V146 WeakPolarHBondContact O-CB 3.45Å; L143-V146 PolarHBondContact O-N 3.1Å; L143-G147 PolarHBondContact O-N 3.19Å
144D97.6Very high96.1Very high15 Ų1543.8 Ų43.88%0.0821%0.209CC..Hα-helixtrans-61.7-45.2173.8-171.432.4000111.6S122 Y125 W140 L141 A142 V146 G147 I148S122-D144 WeakPolarHBondContact CA-OD1 3.2Å; S122-D144 WeakPolarHBondContact CB-OD1 3.47Å; S122-D144 PolarHBondContact OG-OD1 2.9Å; S122-D144 VanDerWaalsContact OG-OD1 3.1Å; Y125-D144 HydrophobicContact CD1-CB 4.36Å; Y125-D144 HydrophobicContact CG-CB 4.15Å; W140-D144 PolarHBondContact O-N 2.94Å; L141-D144 PolarHBondContact O-N 3.43Å; A142-D144 VanDerWaalsContact C-N 3.3Å; A142-D144 PolarHBondContact O-N 3.08Å; D144-V146 PolarHBondContact O-N 3.45Å; D144-G147 WeakPolarHBondContact O-CA 3.2Å; D144-G147 PolarHBondContact O-N 3.16Å; D144-I148 PolarHBondContact O-N 3.25Å
145F95.7Very high96.3Very high19 Ų1940.2 Ų40.28%0.08319%0.193CC..Hα-helixtrans-64.1-36.9174.4-67.9-42.2000113.4L141 A142 G147 I148 S149 Y194 H195 F207L141-F145 HydrophobicContact CD1-CD2 4.45Å; L141-F145 HydrophobicContact CD1-CE2 3.76Å; L141-F145 HydrophobicContact CD1-CZ 3.77Å; L141-F145 HydrophobicContact CD2-CE2 4.21Å; L141-F145 HydrophobicContact CG-CD2 4.27Å; L141-F145 HydrophobicContact CG-CE2 3.67Å; L141-F145 HydrophobicContact CG-CZ 4.2Å; L141-F145 WeakPolarHBondContact O-CD2 3.37Å; L141-F145 PolarHBondContact O-N 2.84Å; L141-F145 VanDerWaalsContact O-N 3.16Å; A142-F145 PolarHBondContact O-N 2.93Å; F145-G147 VanDerWaalsContact C-N 3.32Å; F145-I148 HydrophobicContact CD1-CD1 4.27Å; F145-I148 PolarHBondContact O-N 3.43Å; F145-S149 PolarHBondContact O-N 3.08Å; F145-S149 PolarHBondContact O-OG 2.93Å; F145-Y194 HydrophobicContact CD2-CE1 4.02Å; F145-Y194 HydrophobicContact CE2-CE1 4.5Å; F145-Y194 HydrophobicContact CG-CE1 4.44Å; F145-H195 AromaticContact CD2-CE1 3.98Å; F145-H195 AromaticContact CD2-ND1 3.76Å; F145-H195 AromaticContact CE2-ND1 3.85Å; F145-F207 HydrophobicContact CB-CE2 4.43Å; F145-F207 HydrophobicContact CB-CZ 4.04Å; F145-F207 AromaticContact CD1-CE2 3.75Å; F145-F207 HydrophobicContact CD1-CE2 3.75Å; F145-F207 HydrophobicContact CD1-CZ 4.11Å; F145-F207 HydrophobicContact CE1-CE2 4.4Å; F145-F207 HydrophobicContact CG-CE2 4.3Å; F145-F207 HydrophobicContact CG-CZ 4.39Å
146V96.4Very high96.6Very high42 Ų4233.8 Ų33.826%0.25517%0.165SC..Hα-helixtrans-60.7-45.2169.2171.40000110.1A142 L143 D144 I148 S149 V150 F186A142-V146 WeakPolarHBondContact O-CG2 3.24Å; A142-V146 PolarHBondContact O-N 3.34Å; L143-V146 WeakPolarHBondContact O-CB 3.45Å; L143-V146 PolarHBondContact O-N 3.1Å; D144-V146 PolarHBondContact O-N 3.45Å; V146-I148 PolarHBondContact O-N 3.03Å; V146-S149 WeakPolarHBondContact O-CB 3.28Å; V146-S149 PolarHBondContact O-N 3.32Å; V146-S149 VanDerWaalsContact O-N 3.11Å; V146-V150 HydrophobicContact CG1-CG2 4.18Å; V146-V150 WeakPolarHBondContact O-CG2 3.15Å; V146-V150 PolarHBondContact O-N 3.49Å; V146-F186 HydrophobicContact CB-CE1 4.28Å; V146-F186 HydrophobicContact CG1-CE1 3.92Å; V146-F186 HydrophobicContact CG1-CZ 4.17Å; V146-F186 HydrophobicContact CG2-CD1 4.34Å; V146-F186 HydrophobicContact CG2-CE1 4.16Å
147G98.1Very high96.7Very high0 Ų033.7 Ų33.70%016%0.163CC..Hα-helixtrans-54.5-47.9176.600000112.9C118 L143 D144 F145 S149 V150 G151C118-G147 VanDerWaalsContact CB-O 3.31Å; C118-G147 WeakPolarHBondContact CB-O 3.48Å; C118-G147 PolarHBondContact SG-O 3.24Å; L143-G147 PolarHBondContact O-N 3.19Å; D144-G147 WeakPolarHBondContact O-CA 3.2Å; D144-G147 PolarHBondContact O-N 3.16Å; F145-G147 VanDerWaalsContact C-N 3.32Å; G147-S149 VanDerWaalsContact C-N 3.32Å; G147-S149 PolarHBondContact O-N 2.79Å; G147-V150 PolarHBondContact O-N 2.9Å; G147-G151 PolarHBondContact O-N 3.34Å
148I97.6Very high96.9Very high43 Ų4333.6 Ų33.622%0.22116%0.163CC..Hα-helixtrans-58-45.6175.7-64.8172.3000110.9D144 F145 V146 V150 G151 I152 F207D144-I148 PolarHBondContact O-N 3.25Å; F145-I148 HydrophobicContact CD1-CD1 4.27Å; F145-I148 PolarHBondContact O-N 3.43Å; V146-I148 PolarHBondContact O-N 3.03Å; I148-V150 PolarHBondContact O-N 3.2Å; I148-G151 PolarHBondContact O-N 2.89Å; I148-I152 HydrophobicContact CG2-CD1 4.01Å; I148-I152 WeakPolarHBondContact O-CG1 3.23Å; I148-I152 PolarHBondContact O-N 3.47Å; I148-F207 HydrophobicContact CB-CE1 4.13Å; I148-F207 HydrophobicContact CB-CZ 4.41Å; I148-F207 HydrophobicContact CG2-CD1 3.81Å; I148-F207 HydrophobicContact CG2-CE1 3.74Å; I148-F207 HydrophobicContact CG2-CG 4.47Å; I148-F207 HydrophobicContact CG2-CZ 4.35Å
149S97.5Very high97.1Very high0 Ų030.8 Ų30.80%015%0.153CC..Hα-helixtrans-61.7-45.7179.4-49.90000111.3F145 V146 G147 G151 I152 L153 I182 F207F145-S149 PolarHBondContact O-N 3.08Å; F145-S149 PolarHBondContact O-OG 2.93Å; V146-S149 WeakPolarHBondContact O-CB 3.28Å; V146-S149 PolarHBondContact O-N 3.32Å; V146-S149 VanDerWaalsContact O-N 3.11Å; G147-S149 VanDerWaalsContact C-N 3.32Å; G147-S149 PolarHBondContact O-N 2.79Å; S149-G151 PolarHBondContact O-N 3.38Å; S149-I152 PolarHBondContact O-N 3.22Å; S149-L153 PolarHBondContact O-N 3.3Å; S149-I182 VanDerWaalsContact O-CD1 3.25Å; S149-I182 WeakPolarHBondContact O-CD1 3.45Å; S149-F207 WeakPolarHBondContact OG-CE1 3.38Å
150V98.2Very high97.2Very high24 Ų2422.9 Ų22.915%0.14512%0.124CC..Hα-helixtrans-63.8-40.2176.8173.20000111.1C114 V117 V146 G147 I148 L153 G154 F186C114-V150 HydrophobicContact CB-CG1 3.79Å; C114-V150 WeakPolarHBondContact CB-O 3.32Å; V117-V150 HydrophobicContact CB-CG1 4.15Å; V117-V150 HydrophobicContact CG1-CB 4.44Å; V117-V150 HydrophobicContact CG1-CG1 4.08Å; V146-V150 HydrophobicContact CG1-CG2 4.18Å; V146-V150 WeakPolarHBondContact O-CG2 3.15Å; V146-V150 PolarHBondContact O-N 3.49Å; G147-V150 PolarHBondContact O-N 2.9Å; I148-V150 PolarHBondContact O-N 3.2Å; V150-L153 WeakPolarHBondContact O-CB 3.3Å; V150-L153 PolarHBondContact O-N 2.92Å; V150-G154 PolarHBondContact O-N 3.07Å; V150-F186 HydrophobicContact CG2-CZ 4.2Å
151G98.4Very high97.2Very high3 Ų320.4 Ų20.43%0.03112%0.115CC..Hα-helixtrans-61.7-42.2175.200000113G147 I148 S149 G154 C155G147-G151 PolarHBondContact O-N 3.34Å; I148-G151 PolarHBondContact O-N 2.89Å; S149-G151 PolarHBondContact O-N 3.38Å; G151-G154 PolarHBondContact O-N 2.98Å; G151-C155 PolarHBondContact O-N 3.47Å; G151-C155 VanDerWaalsContact O-N 3.11Å; G151-C155 PolarHBondContact O-SG 3.29Å
152I98.3Very high97.2Very high28 Ų2819.5 Ų19.514%0.14411%0.11CC..Hα-helixtrans-62.8-44174.7-67.3166.1000110.7I148 S149 G154 C155 Y156 I182 F207 V210I148-I152 HydrophobicContact CG2-CD1 4.01Å; I148-I152 WeakPolarHBondContact O-CG1 3.23Å; I148-I152 PolarHBondContact O-N 3.47Å; S149-I152 PolarHBondContact O-N 3.22Å; I152-G154 VanDerWaalsContact C-N 3.3Å; I152-G154 PolarHBondContact O-N 3.45Å; I152-C155 WeakPolarHBondContact O-CB 3.25Å; I152-C155 PolarHBondContact O-N 2.89Å; I152-Y156 HydrophobicContact CG2-CD2 3.7Å; I152-Y156 HydrophobicContact CG2-CE2 3.39Å; I152-Y156 WeakPolarHBondContact O-CD2 3.23Å; I152-Y156 PolarHBondContact O-N 3.46Å; I152-I182 HydrophobicContact CB-CD1 4.45Å; I152-I182 HydrophobicContact CG2-CD1 4.43Å; I152-F207 HydrophobicContact CD1-CD1 4.23Å; I152-V210 HydrophobicContact CG2-CG1 4.1Å
153L98.2Very high97.1Very high32 Ų3219 Ų1917%0.16811%0.105CC..Hα-helixtrans-57.8-44.5174.2-177.761000111.5S149 V150 C155 Y156 I157 L179 I182S149-L153 PolarHBondContact O-N 3.3Å; V150-L153 WeakPolarHBondContact O-CB 3.3Å; V150-L153 PolarHBondContact O-N 2.92Å; L153-C155 PolarHBondContact O-N 3.11Å; L153-Y156 PolarHBondContact O-N 3.04Å; L153-Y156 VanDerWaalsContact O-N 3.08Å; L153-I157 HydrophobicContact CD1-CD1 4.37Å; L153-I157 HydrophobicContact CD1-CG1 4.35Å; L153-I157 HydrophobicContact CG-CD1 4.03Å; L153-I157 HydrophobicContact CG-CG1 4.46Å; L153-I157 WeakPolarHBondContact O-CG1 3.38Å; L153-I157 PolarHBondContact O-N 3.32Å; L153-L179 HydrophobicContact CD2-CD1 4.43Å; L153-I182 HydrophobicContact CB-CG1 4.24Å
154G98.1Very high97Very high0 Ų015.5 Ų15.50%09%0.087CC..Hα-helixtrans-59.8-25.1174.800000114V150 G151 I152 P158V150-G154 PolarHBondContact O-N 3.07Å; G151-G154 PolarHBondContact O-N 2.98Å; I152-G154 VanDerWaalsContact C-N 3.3Å; I152-G154 PolarHBondContact O-N 3.45Å; G154-P158 WeakPolarHBondContact O-CD 3.43Å; G154-P158 WeakPolarHBondContact O-CG 3.29Å
155C98.3Very high96.7Very high18 Ų1817.1 Ų17.112%0.1229%0.092CC..Hα-helixtrans-78.8-42.4172.2-61.10000111.7G151 I152 L153 I157 G159 L285 W288G151-C155 PolarHBondContact O-N 3.47Å; G151-C155 VanDerWaalsContact O-N 3.11Å; G151-C155 PolarHBondContact O-SG 3.29Å; I152-C155 WeakPolarHBondContact O-CB 3.25Å; I152-C155 PolarHBondContact O-N 2.89Å; L153-C155 PolarHBondContact O-N 3.11Å; C155-I157 PolarHBondContact O-N 3.17Å; C155-G159 PolarHBondContact O-N 3.06Å; C155-L285 WeakPolarHBondContact SG-CD2 3.48Å; C155-W288 PolarHBondContact O-NE1 2.94Å
156Y98.3Very high96.5Very high19 Ų1917 Ų178%0.0759%0.094CC..Hα-helixtrans-63.3-39.8-179.7-81.5-60.3000113.2I152 L153 G159 V160 A178 V210 A211 Y213 G214I152-Y156 HydrophobicContact CG2-CD2 3.7Å; I152-Y156 HydrophobicContact CG2-CE2 3.39Å; I152-Y156 WeakPolarHBondContact O-CD2 3.23Å; I152-Y156 PolarHBondContact O-N 3.46Å; L153-Y156 PolarHBondContact O-N 3.04Å; L153-Y156 VanDerWaalsContact O-N 3.08Å; Y156-G159 PolarHBondContact O-N 3.32Å; Y156-V160 HydrophobicContact CD1-CG2 4.13Å; Y156-V160 VanDerWaalsContact O-CB 3.3Å; Y156-V160 WeakPolarHBondContact O-CB 3.46Å; Y156-V160 WeakPolarHBondContact O-CG2 3.16Å; Y156-V160 PolarHBondContact O-N 3.12Å; Y156-A178 HydrophobicContact CD1-CB 4.46Å; Y156-A178 HydrophobicContact CD2-CB 3.97Å; Y156-A178 HydrophobicContact CG-CB 3.93Å; Y156-V210 WeakPolarHBondContact CE2-O 3.36Å; Y156-V210 PolarHBondContact OH-O 3.33Å; Y156-A211 PolarHBondContact OH-O 2.95Å; Y156-Y213 AromaticContact CE1-CD1 3.74Å; Y156-Y213 HydrophobicContact CE1-CD1 3.74Å; Y156-Y213 HydrophobicContact CE1-CE1 4.11Å; Y156-Y213 HydrophobicContact CE2-CD1 4.24Å; Y156-Y213 AromaticContact CZ-CD1 3.56Å; Y156-Y213 WeakPolarHBondContact OH-CD1 3.43Å; Y156-G214 PolarHBondContact OH-N 2.86Å
157I97.5Very high96.3Very high29 Ų2916.1 Ų16.115%0.1499%0.088CC..Hα-helixtrans-55.2-64.8-175.4-68.8167.8000112.1I107 I110 L153 C155 G159 F161I107-I157 HydrophobicContact CG2-CG2 4.06Å; I110-I157 HydrophobicContact CB-CD1 4.49Å; I110-I157 HydrophobicContact CG2-CD1 3.44Å; I110-I157 VanDerWaalsContact CG2-CD1 3.44Å; L153-I157 HydrophobicContact CD1-CD1 4.37Å; L153-I157 HydrophobicContact CD1-CG1 4.35Å; L153-I157 HydrophobicContact CG-CD1 4.03Å; L153-I157 HydrophobicContact CG-CG1 4.46Å; L153-I157 WeakPolarHBondContact O-CG1 3.38Å; L153-I157 PolarHBondContact O-N 3.32Å; C155-I157 PolarHBondContact O-N 3.17Å; I157-G159 PolarHBondContact O-N 3.31Å; I157-F161 WeakPolarHBondContact O-CB 3.23Å; I157-F161 PolarHBondContact O-N 2.81Å
158P96.8Very high96Very high6 Ų619.7 Ų19.74%0.03911%0.109CC..Hα-helixtrans-68-36179.527.3-33.9000112I107 A111 G154 F161 Y162 A292I107-P158 HydrophobicContact CG2-CB 3.82Å; A111-P158 HydrophobicContact CB-CG 4.03Å; G154-P158 WeakPolarHBondContact O-CD 3.43Å; G154-P158 WeakPolarHBondContact O-CG 3.29Å; P158-F161 PolarHBondContact O-N 3.49Å; P158-Y162 HydrophobicContact CB-CD2 4.24Å; P158-Y162 HydrophobicContact CB-CE2 4.26Å; P158-Y162 WeakPolarHBondContact O-CD2 3.4Å; P158-Y162 PolarHBondContact O-N 3.27Å; P158-A292 HydrophobicContact CB-CB 3.95Å
159G96Very high95.9Very high11 Ų1124 Ų2411%0.11313%0.127CC..Hα-helixtrans-59.8-54.9-178.600000112.8C155 Y156 I157 A163C155-G159 PolarHBondContact O-N 3.06Å; Y156-G159 PolarHBondContact O-N 3.32Å; I157-G159 PolarHBondContact O-N 3.31Å; G159-A163 WeakPolarHBondContact O-CB 3.4Å; G159-A163 PolarHBondContact O-N 3.4Å; G159-A163 VanDerWaalsContact O-N 3.1Å
160V97.2Very high95.9Very high7 Ų728.2 Ų28.24%0.04214%0.143CC..Hα-helixtrans-70.7-39.9179.2175.90000110.5Y156 Y162 A163 F164 R171 L175Y156-V160 HydrophobicContact CD1-CG2 4.13Å; Y156-V160 VanDerWaalsContact O-CB 3.3Å; Y156-V160 WeakPolarHBondContact O-CB 3.46Å; Y156-V160 WeakPolarHBondContact O-CG2 3.16Å; Y156-V160 PolarHBondContact O-N 3.12Å; V160-Y162 PolarHBondContact O-N 3.44Å; V160-A163 PolarHBondContact O-N 2.92Å; V160-F164 HydrophobicContact CG1-CD2 3.97Å; V160-F164 WeakPolarHBondContact O-CD2 3.43Å; V160-F164 PolarHBondContact O-N 2.9Å; V160-R171 HydrophobicContact CG1-CG 4.44Å; V160-L175 HydrophobicContact CB-CD2 3.82Å; V160-L175 HydrophobicContact CB-CG 4.16Å; V160-L175 HydrophobicContact CG1-CD2 4.08Å; V160-L175 HydrophobicContact CG1-CG 3.84Å; V160-L175 HydrophobicContact CG2-CD2 4.41Å
161F96.5Very high95.8Very high17 Ų1728.1 Ų28.18%0.07514%0.14CC..Hα-helixtrans-58.6-50.3-179.1-178-86000112.2E103 I107 I157 P158 F164 Y165E103-F161 HydrophobicContact CB-CZ 4.09Å; E103-F161 WeakPolarHBondContact OE2-CZ 3.4Å; I107-F161 HydrophobicContact CD1-CB 4.21Å; I107-F161 HydrophobicContact CD1-CD1 3.22Å; I107-F161 HydrophobicContact CD1-CD2 3.48Å; I107-F161 VanDerWaalsContact CD1-CD2 3.48Å; I107-F161 HydrophobicContact CD1-CE1 3.22Å; I107-F161 HydrophobicContact CD1-CE2 3.52Å; I107-F161 HydrophobicContact CD1-CG 3.35Å; I107-F161 HydrophobicContact CD1-CZ 3.38Å; I107-F161 HydrophobicContact CG1-CD1 4.48Å; I107-F161 HydrophobicContact CG1-CD2 4.31Å; I107-F161 HydrophobicContact CG1-CG 4.28Å; I157-F161 WeakPolarHBondContact O-CB 3.23Å; I157-F161 PolarHBondContact O-N 2.81Å; P158-F161 PolarHBondContact O-N 3.49Å; F161-F164 CarbonylContact O-C 3.5Å; F161-Y165 HydrophobicContact CD1-CD2 4.18Å; F161-Y165 AromaticContact CE1-CD2 3.62Å; F161-Y165 HydrophobicContact CE1-CD2 3.62Å; F161-Y165 AromaticContact CE1-CE2 3.71Å; F161-Y165 HydrophobicContact CE1-CE2 3.71Å; F161-Y165 HydrophobicContact CZ-CD2 4.28Å; F161-Y165 HydrophobicContact CZ-CE2 4.23Å; F161-Y165 VanDerWaalsContact O-CA 3.22Å; F161-Y165 WeakPolarHBondContact O-CA 3.26Å; F161-Y165 PolarHBondContact O-N 3.42Å
162Y94.4Very high95.7Very high0 Ų032.5 Ų32.50%016%0.16CC..Hα-helixtrans-80.4-27.1-177.6-68.8-60.8000113.7D104 I107 Y108 P158 V160 Y165 I295 M296 R299D104-Y162 WeakPolarHBondContact OD1-CE1 3.3Å; D104-Y162 PolarHBondContact OD1-OH 3.47Å; I107-Y162 HydrophobicContact CG2-CE2 4.23Å; Y108-Y162 HydrophobicContact CE2-CE2 4.05Å; Y108-Y162 VanDerWaalsContact CE2-OH 3.29Å; Y108-Y162 WeakPolarHBondContact CE2-OH 3.44Å; P158-Y162 HydrophobicContact CB-CD2 4.24Å; P158-Y162 HydrophobicContact CB-CE2 4.26Å; P158-Y162 WeakPolarHBondContact O-CD2 3.4Å; P158-Y162 PolarHBondContact O-N 3.27Å; V160-Y162 PolarHBondContact O-N 3.44Å; Y162-Y165 AromaticContact CD1-CD2 3.98Å; Y162-Y165 HydrophobicContact CD1-CD2 3.98Å; Y162-Y165 HydrophobicContact CD1-CE2 4.42Å; Y162-Y165 HydrophobicContact CE1-CD2 4.38Å; Y162-Y165 HydrophobicContact CE1-CE2 4.4Å; Y162-I295 HydrophobicContact CG-CG2 4.44Å; Y162-M296 HydrophobicContact CD1-CB 4.28Å; Y162-M296 HydrophobicContact CE1-CB 3.74Å; Y162-M296 HydrophobicContact CE1-CG 3.86Å; Y162-M296 HydrophobicContact CE2-CB 4.12Å; Y162-R299 PolarHBondContact O-NE 2.83Å; Y162-R299 PolarHBondContact O-NH2 3.28Å
163A93.6Very high95.7Very high9 Ų933.5 Ų33.57%0.07417%0.167CC..Hα-helixtrans-62.2-52.2171.400000110.4G159 V160 Y165 W221 F236 R299G159-A163 WeakPolarHBondContact O-CB 3.4Å; G159-A163 PolarHBondContact O-N 3.4Å; G159-A163 VanDerWaalsContact O-N 3.1Å; V160-A163 PolarHBondContact O-N 2.92Å; A163-Y165 VanDerWaalsContact C-N 3.33Å; A163-Y165 PolarHBondContact O-N 3.36Å; A163-W221 HydrophobicContact CB-CG 4.17Å; A163-W221 PolarHBondContact O-NE1 3.29Å; A163-F236 HydrophobicContact CB-CE1 3.9Å; A163-R299 PolarHBondContact O-NH2 3.14Å; A163-R299 VanDerWaalsContact O-NH2 3.13Å
164F94.3Very high95.7Very high4 Ų432.9 Ų32.92%0.01816%0.162CC..THydrogen-bonded Turntrans-98.232.1-178.2-61.5-88.5000112.5V160 F161 C166 I167 W170 R171 Y174 P217 W221 L224V160-F164 HydrophobicContact CG1-CD2 3.97Å; V160-F164 WeakPolarHBondContact O-CD2 3.43Å; V160-F164 PolarHBondContact O-N 2.9Å; F161-F164 CarbonylContact O-C 3.5Å; F164-C166 PolarHBondContact O-N 3.04Å; F164-I167 CarbonylContact O-C 3.6Å; F164-I167 PolarHBondContact O-N 2.95Å; F164-W170 HydrophobicContact CD1-CB 3.66Å; F164-W170 HydrophobicContact CE1-CB 3.94Å; F164-W170 HydrophobicContact CG-CB 4.39Å; F164-R171 HydrophobicContact CB-CB 3.71Å; F164-R171 HydrophobicContact CB-CG 4.38Å; F164-Y174 HydrophobicContact CD2-CD2 4.11Å; F164-Y174 HydrophobicContact CE1-CD2 4.19Å; F164-Y174 AromaticContact CE1-CE2 3.76Å; F164-Y174 HydrophobicContact CE1-CE2 3.76Å; F164-Y174 AromaticContact CE2-CD2 3.61Å; F164-Y174 HydrophobicContact CE2-CD2 3.61Å; F164-Y174 AromaticContact CE2-CE2 3.8Å; F164-Y174 HydrophobicContact CE2-CE2 3.8Å; F164-Y174 AromaticContact CZ-CD2 3.65Å; F164-Y174 HydrophobicContact CZ-CD2 3.65Å; F164-Y174 AromaticContact CZ-CE2 3.32Å; F164-Y174 HydrophobicContact CZ-CE2 3.32Å; F164-P217 HydrophobicContact CE2-CB 3.94Å; F164-P217 HydrophobicContact CZ-CB 4.25Å; F164-P217 WeakPolarHBondContact CZ-O 3.32Å; F164-W221 HydrophobicContact CE1-CB 4.32Å; F164-W221 HydrophobicContact CE2-CB 4.23Å; F164-W221 HydrophobicContact CZ-CB 3.76Å; F164-L224 HydrophobicContact CD1-CD1 4.36Å; F164-L224 HydrophobicContact CE1-CD1 3.89Å
165Y91.9Very high95.7Very high48 Ų4834.5 Ų34.519%0.18817%0.171CC..THydrogen-bonded Turntrans-53.3-41.6-175.1-171.9-96.2000112.6F161 Y162 A163 R171 R299F161-Y165 HydrophobicContact CD1-CD2 4.18Å; F161-Y165 AromaticContact CE1-CD2 3.62Å; F161-Y165 HydrophobicContact CE1-CD2 3.62Å; F161-Y165 AromaticContact CE1-CE2 3.71Å; F161-Y165 HydrophobicContact CE1-CE2 3.71Å; F161-Y165 HydrophobicContact CZ-CD2 4.28Å; F161-Y165 HydrophobicContact CZ-CE2 4.23Å; F161-Y165 VanDerWaalsContact O-CA 3.22Å; F161-Y165 WeakPolarHBondContact O-CA 3.26Å; F161-Y165 PolarHBondContact O-N 3.42Å; Y162-Y165 AromaticContact CD1-CD2 3.98Å; Y162-Y165 HydrophobicContact CD1-CD2 3.98Å; Y162-Y165 HydrophobicContact CD1-CE2 4.42Å; Y162-Y165 HydrophobicContact CE1-CD2 4.38Å; Y162-Y165 HydrophobicContact CE1-CE2 4.4Å; A163-Y165 VanDerWaalsContact C-N 3.33Å; A163-Y165 PolarHBondContact O-N 3.36Å; Y165-R171 PolarHBondContact O-NH1 3.36Å; Y165-R299 HydrophobicContact CD1-CB 4.47Å; Y165-R299 HydrophobicContact CG-CB 4.48Å; Y165-R299 HydrophobicContact CG-CG 4.26Å
166C90.3Very high95.7Very high18 Ų1837.9 Ų37.912%0.12219%0.191CC..THydrogen-bonded Turntrans-89.3-8.2-179.2-550000114.3F164 C304 Y308F164-C166 PolarHBondContact O-N 3.04Å; C166-C304 WeakPolarHBondContact CA-SG 3.41Å; C166-C304 HydrophobicContact CB-CB 3.7Å; C166-C304 WeakPolarHBondContact CB-SG 3.44Å; C166-C304 WeakPolarHBondContact SG-CA 3.4Å; C166-C304 WeakPolarHBondContact SG-CB 3.38Å; C166-C304 CovalentContact SG-SG 2.04Å; C166-C304 PolarHBondContact SG-SG 3.48Å; C166-Y308 HydrophobicContact CB-CD2 4.22Å; C166-Y308 HydrophobicContact CB-CG 4.16Å; C166-Y308 WeakPolarHBondContact O-CB 3.47Å
167I92.5Very high95.7Very high23 Ų2339.6 Ų39.612%0.11820%0.203CC..  trans-126.978.6-171.6-45.3175.5000109.3F164 F169 W170 R171 L224 Y308F164-I167 CarbonylContact O-C 3.6Å; F164-I167 PolarHBondContact O-N 2.95Å; I167-F169 VanDerWaalsContact C-N 3.28Å; I167-F169 PolarHBondContact O-N 2.9Å; I167-W170 HydrophobicContact CG2-CB 4.46Å; I167-W170 HydrophobicContact CG2-CG 4.45Å; I167-W170 PolarHBondContact O-N 3.12Å; I167-R171 PolarHBondContact O-N 3.31Å; I167-R171 VanDerWaalsContact O-N 3.15Å; I167-L224 HydrophobicContact CD1-CD1 3.9Å; I167-Y308 HydrophobicContact CD1-CD1 4.29Å; I167-Y308 HydrophobicContact CD1-CE1 3.55Å; I167-Y308 HydrophobicContact CG1-CD1 3.73Å; I167-Y308 HydrophobicContact CG1-CE1 3.51Å
168T92.6Very high95.7Very high74 Ų7438.3 Ų38.345%0.45420%0.197SC..Hα-helixtrans-57.7-37-171.4-580000113.4R171 Q172T168-R171 WeakPolarHBondContact O-CB 3.35Å; T168-R171 PolarHBondContact O-N 3.2Å; T168-R171 PolarHBondContact OG1-NH2 3.02Å; T168-Q172 HydrophobicContact CG2-CG 4.27Å; T168-Q172 WeakPolarHBondContact O-CG 3.41Å; T168-Q172 PolarHBondContact O-N 3.36Å
169F95.5Very high95.7Very high134 Ų13442.8 Ų42.859%0.58822%0.22SC*.Hα-helixtrans-56.9-57.3179.7176.3-100000111.8I167 R171 Q172 V173I167-F169 VanDerWaalsContact C-N 3.28Å; I167-F169 PolarHBondContact O-N 2.9Å; F169-R171 VanDerWaalsContact C-N 3.31Å; F169-R171 PolarHBondContact O-N 3.29Å; F169-Q172 PolarHBondContact O-N 2.88Å; F169-Q172 VanDerWaalsContact O-N 3.14Å; F169-V173 HydrophobicContact CD1-CG2 4.37Å; F169-V173 HydrophobicContact CE1-CG2 3.98Å; F169-V173 HydrophobicContact CE2-CG2 4.33Å; F169-V173 HydrophobicContact CZ-CG2 3.96Å; F169-V173 WeakPolarHBondContact O-CG2 3.47Å; F169-V173 PolarHBondContact O-N 3.4Å
170W96.5Very high95.8Very high88 Ų8844.8 Ų44.833%0.33324%0.236SC..Hα-helixtrans-66.1-34-179.8-70.4119.6000112.8F164 I167 Q172 V173 Y174 H220F164-W170 HydrophobicContact CD1-CB 3.66Å; F164-W170 HydrophobicContact CE1-CB 3.94Å; F164-W170 HydrophobicContact CG-CB 4.39Å; I167-W170 HydrophobicContact CG2-CB 4.46Å; I167-W170 HydrophobicContact CG2-CG 4.45Å; I167-W170 PolarHBondContact O-N 3.12Å; W170-Q172 VanDerWaalsContact C-N 3.33Å; W170-Q172 PolarHBondContact O-N 3.23Å; W170-V173 HydrophobicContact CE3-CB 4.26Å; W170-V173 HydrophobicContact CE3-CG1 4.26Å; W170-V173 HydrophobicContact CE3-CG2 4.4Å; W170-V173 HydrophobicContact CZ3-CG1 4.34Å; W170-V173 PolarHBondContact O-N 2.89Å; W170-Y174 HydrophobicContact CB-CD2 4.4Å; W170-Y174 HydrophobicContact CB-CE2 4.25Å; W170-Y174 HydrophobicContact CE3-CE2 4.28Å; W170-Y174 WeakPolarHBondContact O-CD2 3.49Å; W170-Y174 PolarHBondContact O-N 3.46Å; W170-H220 AromaticContact CD1-CE1 3.82Å; W170-H220 AromaticContact CD2-CE1 3.43Å; W170-H220 VanDerWaalsContact CD2-CE1 3.43Å; W170-H220 AromaticContact CE2-CE1 3.44Å; W170-H220 VanDerWaalsContact CE2-CE1 3.44Å; W170-H220 AromaticContact CE3-CE1 3.85Å; W170-H220 AromaticContact CG-CE1 3.72Å; W170-H220 AromaticContact CZ2-CE1 3.88Å; W170-H220 AromaticContact NE1-CE1 3.69Å
171R96.8Very high95.8Very high23 Ų2347.2 Ų47.29%0.08725%0.248CC..Hα-helixtrans-54.6-49.5171-174174.267-165.63.2111.4V160 F164 Y165 I167 T168 F169 L175V160-R171 HydrophobicContact CG1-CG 4.44Å; F164-R171 HydrophobicContact CB-CB 3.71Å; F164-R171 HydrophobicContact CB-CG 4.38Å; Y165-R171 PolarHBondContact O-NH1 3.36Å; I167-R171 PolarHBondContact O-N 3.31Å; I167-R171 VanDerWaalsContact O-N 3.15Å; T168-R171 WeakPolarHBondContact O-CB 3.35Å; T168-R171 PolarHBondContact O-N 3.2Å; T168-R171 PolarHBondContact OG1-NH2 3.02Å; F169-R171 VanDerWaalsContact C-N 3.31Å; F169-R171 PolarHBondContact O-N 3.29Å; R171-L175 HydrophobicContact CG-CD1 4.05Å; R171-L175 WeakPolarHBondContact O-CB 3.23Å; R171-L175 VanDerWaalsContact O-CG 3.31Å; R171-L175 WeakPolarHBondContact O-CG 3.49Å; R171-L175 PolarHBondContact O-N 2.96Å; R171-L175 VanDerWaalsContact O-N 3.11Å
172Q97Very high95.9Very high95 Ų9546.5 Ų46.544%0.44425%0.245SC..Hα-helixtrans-67.9-44.7-179.7-65.3-55.3-22.200112.2T168 F169 W170 Y174 L175 V176T168-Q172 HydrophobicContact CG2-CG 4.27Å; T168-Q172 WeakPolarHBondContact O-CG 3.41Å; T168-Q172 PolarHBondContact O-N 3.36Å; F169-Q172 PolarHBondContact O-N 2.88Å; F169-Q172 VanDerWaalsContact O-N 3.14Å; W170-Q172 VanDerWaalsContact C-N 3.33Å; W170-Q172 PolarHBondContact O-N 3.23Å; Q172-Y174 VanDerWaalsContact C-N 3.29Å; Q172-Y174 PolarHBondContact O-N 2.95Å; Q172-L175 PolarHBondContact O-N 3.01Å; Q172-V176 WeakPolarHBondContact O-CB 3.45Å; Q172-V176 VanDerWaalsContact O-CG2 3.29Å; Q172-V176 WeakPolarHBondContact O-CG2 3.48Å; Q172-V176 PolarHBondContact O-N 2.84Å
173V97.9Very high95.9Very high49 Ų4951.2 Ų51.230%0.29727%0.27SS..Hα-helixtrans-51.8-52.1176.4170.20000110.1F169 W170 V176 T177F169-V173 HydrophobicContact CD1-CG2 4.37Å; F169-V173 HydrophobicContact CE1-CG2 3.98Å; F169-V173 HydrophobicContact CE2-CG2 4.33Å; F169-V173 HydrophobicContact CZ-CG2 3.96Å; F169-V173 WeakPolarHBondContact O-CG2 3.47Å; F169-V173 PolarHBondContact O-N 3.4Å; W170-V173 HydrophobicContact CE3-CB 4.26Å; W170-V173 HydrophobicContact CE3-CG1 4.26Å; W170-V173 HydrophobicContact CE3-CG2 4.4Å; W170-V173 HydrophobicContact CZ3-CG1 4.34Å; W170-V173 PolarHBondContact O-N 2.89Å; V173-V176 PolarHBondContact O-N 3.18Å; V173-T177 WeakPolarHBondContact O-CB 3.31Å; V173-T177 PolarHBondContact O-N 3.09Å; V173-T177 PolarHBondContact O-OG1 3.14Å
174Y98.4Very high96Very high18 Ų1853.4 Ų53.47%0.07129%0.287CS..Hα-helixtrans-71.1-36.2-175-69.9-48.2000114.2F164 W170 Q172 A178 Y213 I216 P217 H220F164-Y174 HydrophobicContact CD2-CD2 4.11Å; F164-Y174 HydrophobicContact CE1-CD2 4.19Å; F164-Y174 AromaticContact CE1-CE2 3.76Å; F164-Y174 HydrophobicContact CE1-CE2 3.76Å; F164-Y174 AromaticContact CE2-CD2 3.61Å; F164-Y174 HydrophobicContact CE2-CD2 3.61Å; F164-Y174 AromaticContact CE2-CE2 3.8Å; F164-Y174 HydrophobicContact CE2-CE2 3.8Å; F164-Y174 AromaticContact CZ-CD2 3.65Å; F164-Y174 HydrophobicContact CZ-CD2 3.65Å; F164-Y174 AromaticContact CZ-CE2 3.32Å; F164-Y174 HydrophobicContact CZ-CE2 3.32Å; W170-Y174 HydrophobicContact CB-CD2 4.4Å; W170-Y174 HydrophobicContact CB-CE2 4.25Å; W170-Y174 HydrophobicContact CE3-CE2 4.28Å; W170-Y174 WeakPolarHBondContact O-CD2 3.49Å; W170-Y174 PolarHBondContact O-N 3.46Å; Q172-Y174 VanDerWaalsContact C-N 3.29Å; Q172-Y174 PolarHBondContact O-N 2.95Å; Y174-A178 WeakPolarHBondContact O-CB 3.35Å; Y174-A178 PolarHBondContact O-N 3.4Å; Y174-Y213 WeakPolarHBondContact CA-OH 3.45Å; Y174-Y213 VanDerWaalsContact CD1-OH 3.26Å; Y174-Y213 WeakPolarHBondContact CD1-OH 3.49Å; Y174-Y213 PolarHBondContact O-OH 3.25Å; Y174-Y213 VanDerWaalsContact O-OH 3.05Å; Y174-I216 HydrophobicContact CE1-CG2 4.36Å; Y174-P217 HydrophobicContact CD1-CB 3.94Å; Y174-P217 HydrophobicContact CD1-CG 4.48Å; Y174-P217 HydrophobicContact CD2-CB 3.72Å; Y174-P217 HydrophobicContact CE1-CB 4Å; Y174-P217 HydrophobicContact CE2-CB 3.8Å; Y174-P217 HydrophobicContact CG-CB 3.78Å; Y174-H220 AromaticContact CE2-ND1 3.57Å; Y174-H220 AromaticContact CZ-ND1 3.56Å; Y174-H220 WeakPolarHBondContact OH-CB 3.38Å; Y174-H220 VanDerWaalsContact OH-CG 3.24Å; Y174-H220 PolarHBondContact OH-ND1 3.18Å
175L97.6Very high96.1Very high35 Ų3553.3 Ų53.318%0.18329%0.288CS..Hα-helixtrans-69.4-41.7176-72.1176.2000112.1V160 R171 Q172 A178 L179V160-L175 HydrophobicContact CB-CD2 3.82Å; V160-L175 HydrophobicContact CB-CG 4.16Å; V160-L175 HydrophobicContact CG1-CD2 4.08Å; V160-L175 HydrophobicContact CG1-CG 3.84Å; V160-L175 HydrophobicContact CG2-CD2 4.41Å; R171-L175 HydrophobicContact CG-CD1 4.05Å; R171-L175 WeakPolarHBondContact O-CB 3.23Å; R171-L175 VanDerWaalsContact O-CG 3.31Å; R171-L175 WeakPolarHBondContact O-CG 3.49Å; R171-L175 PolarHBondContact O-N 2.96Å; R171-L175 VanDerWaalsContact O-N 3.11Å; Q172-L175 PolarHBondContact O-N 3.01Å; L175-A178 PolarHBondContact O-N 3.45Å; L175-L179 WeakPolarHBondContact O-CB 3.34Å; L175-L179 PolarHBondContact O-N 3.29Å
176V98.1Very high96.2Very high88 Ų8854.2 Ų54.253%0.53329%0.293SS..Hα-helixtrans-65-43.7176.3169.90000110.5Q172 V173 L179 A180Q172-V176 WeakPolarHBondContact O-CB 3.45Å; Q172-V176 VanDerWaalsContact O-CG2 3.29Å; Q172-V176 WeakPolarHBondContact O-CG2 3.48Å; Q172-V176 PolarHBondContact O-N 2.84Å; V173-V176 PolarHBondContact O-N 3.18Å; V176-L179 PolarHBondContact O-N 3.03Å; V176-A180 WeakPolarHBondContact O-CB 3.06Å; V176-A180 PolarHBondContact O-N 3.46Å
177T98.1Very high96.3Very high55 Ų5558.5 Ų58.534%0.33731%0.313SS..Hα-helixtrans-63.3-42.3174.9-61.20000111.6V173 L179 A180 L181 Y213V173-T177 WeakPolarHBondContact O-CB 3.31Å; V173-T177 PolarHBondContact O-N 3.09Å; V173-T177 PolarHBondContact O-OG1 3.14Å; T177-L179 VanDerWaalsContact C-N 3.34Å; T177-L179 PolarHBondContact O-N 3.36Å; T177-A180 PolarHBondContact O-N 3.25Å; T177-L181 HydrophobicContact CG2-CD1 4.32Å; T177-L181 HydrophobicContact CG2-CG 4.46Å; T177-L181 VanDerWaalsContact O-CG 3.32Å; T177-L181 WeakPolarHBondContact O-CG 3.27Å; T177-L181 PolarHBondContact O-N 3.44Å; T177-Y213 VanDerWaalsContact CB-OH 3.24Å; T177-Y213 WeakPolarHBondContact CB-OH 3.4Å; T177-Y213 HydrophobicContact CG2-CE1 4.44Å; T177-Y213 HydrophobicContact CG2-CE2 3.68Å; T177-Y213 WeakPolarHBondContact CG2-OH 2.95Å
178A97.8Very high96.3Very high2 Ų258.8 Ų58.82%0.01732%0.319CS..Hα-helixtrans-59-45.7174.800000111.4Y156 Y174 L175 A180 L181 I182 Y213Y156-A178 HydrophobicContact CD1-CB 4.46Å; Y156-A178 HydrophobicContact CD2-CB 3.97Å; Y156-A178 HydrophobicContact CG-CB 3.93Å; Y174-A178 WeakPolarHBondContact O-CB 3.35Å; Y174-A178 PolarHBondContact O-N 3.4Å; L175-A178 PolarHBondContact O-N 3.45Å; A178-A180 PolarHBondContact O-N 3.21Å; A178-L181 PolarHBondContact O-N 3.3Å; A178-I182 VanDerWaalsContact O-CG1 3.31Å; A178-I182 WeakPolarHBondContact O-CG1 3Å; A178-I182 PolarHBondContact O-N 3.3Å; A178-Y213 HydrophobicContact CB-CE1 4.07Å
179L97.4Very high96.3Very high100 Ų10056.1 Ų56.152%0.52430%0.302SS..Hα-helixtrans-61.5-43.5176.4-178.763.5000112L153 L175 V176 T177 L181 I182 L183L153-L179 HydrophobicContact CD2-CD1 4.43Å; L175-L179 WeakPolarHBondContact O-CB 3.34Å; L175-L179 PolarHBondContact O-N 3.29Å; V176-L179 PolarHBondContact O-N 3.03Å; T177-L179 VanDerWaalsContact C-N 3.34Å; T177-L179 PolarHBondContact O-N 3.36Å; L179-L181 PolarHBondContact O-N 2.96Å; L179-I182 PolarHBondContact O-N 2.91Å; L179-L183 PolarHBondContact O-N 2.83Å
180A97.8Very high96.1Very high54 Ų5456 Ų5645%0.44631%0.306SS..Hα-helixtrans-62.9-40.8177.500000112V176 T177 A178 L183 A184V176-A180 WeakPolarHBondContact O-CB 3.06Å; V176-A180 PolarHBondContact O-N 3.46Å; T177-A180 PolarHBondContact O-N 3.25Å; A178-A180 PolarHBondContact O-N 3.21Å; A180-L183 PolarHBondContact O-N 2.93Å; A180-A184 WeakPolarHBondContact O-CB 3.27Å; A180-A184 PolarHBondContact O-N 3.39Å
181L97.5Very high95.8Very high57 Ų5755.3 Ų55.330%0.29831%0.306SS..Hα-helixtrans-61.5-44.6173.9-71.5174.2000111.3T177 A178 L179 A184 V185 V210 Y213T177-L181 HydrophobicContact CG2-CD1 4.32Å; T177-L181 HydrophobicContact CG2-CG 4.46Å; T177-L181 VanDerWaalsContact O-CG 3.32Å; T177-L181 WeakPolarHBondContact O-CG 3.27Å; T177-L181 PolarHBondContact O-N 3.44Å; A178-L181 PolarHBondContact O-N 3.3Å; L179-L181 PolarHBondContact O-N 2.96Å; L181-A184 WeakPolarHBondContact O-CB 3.35Å; L181-A184 PolarHBondContact O-N 3.43Å; L181-V185 WeakPolarHBondContact O-CG2 3.38Å; L181-V185 PolarHBondContact O-N 2.88Å; L181-V210 HydrophobicContact CB-CG1 4.41Å; L181-V210 HydrophobicContact CB-CG2 4.32Å; L181-Y213 HydrophobicContact CD1-CD1 3.77Å; L181-Y213 HydrophobicContact CD1-CD2 3.96Å; L181-Y213 HydrophobicContact CD1-CE1 4.31Å; L181-Y213 HydrophobicContact CD1-CE2 4.46Å; L181-Y213 HydrophobicContact CD1-CG 3.58Å
182I96.9Very high95.3Very high3 Ų359.6 Ų59.62%0.01534%0.337CS..Hα-helixtrans-63.7-41.6176.9-65.6-62.9000111.6S149 I152 L153 A178 L179 A184 V185 F186 V210S149-I182 VanDerWaalsContact O-CD1 3.25Å; S149-I182 WeakPolarHBondContact O-CD1 3.45Å; I152-I182 HydrophobicContact CB-CD1 4.45Å; I152-I182 HydrophobicContact CG2-CD1 4.43Å; L153-I182 HydrophobicContact CB-CG1 4.24Å; A178-I182 VanDerWaalsContact O-CG1 3.31Å; A178-I182 WeakPolarHBondContact O-CG1 3Å; A178-I182 PolarHBondContact O-N 3.3Å; L179-I182 PolarHBondContact O-N 2.91Å; I182-A184 VanDerWaalsContact C-N 3.32Å; I182-A184 PolarHBondContact O-N 3.3Å; I182-V185 WeakPolarHBondContact O-CB 3.25Å; I182-V185 PolarHBondContact O-N 2.98Å; I182-F186 HydrophobicContact CG2-CD2 4.36Å; I182-F186 HydrophobicContact CG2-CE1 4.23Å; I182-F186 HydrophobicContact CG2-CE2 3.76Å; I182-F186 HydrophobicContact CG2-CZ 3.69Å; I182-F186 PolarHBondContact O-N 3.38Å; I182-V210 HydrophobicContact CD1-CG1 3.81Å
183L95.9Very high94.7Very high99 Ų9959.7 Ų59.752%0.51834%0.337SS..Hα-helixtrans-62.3-40.8174.6-178.261.2000111.5L179 A180 V185 F186 L187L179-L183 PolarHBondContact O-N 2.83Å; A180-L183 PolarHBondContact O-N 2.93Å; L183-V185 VanDerWaalsContact C-N 3.31Å; L183-V185 PolarHBondContact O-N 3.34Å; L183-F186 WeakPolarHBondContact O-CB 3.4Å; L183-F186 PolarHBondContact O-N 3.07Å; L183-F186 VanDerWaalsContact O-N 3.13Å; L183-L187 WeakPolarHBondContact O-CG 3.36Å; L183-L187 PolarHBondContact O-N 3.06Å
184A95.9Very high94.3Very high54 Ų5457.3 Ų57.345%0.44632%0.323SS..Hα-helixtrans-62-37.8174.600000112.1A180 L181 I182 L187 A188A180-A184 WeakPolarHBondContact O-CB 3.27Å; A180-A184 PolarHBondContact O-N 3.39Å; L181-A184 WeakPolarHBondContact O-CB 3.35Å; L181-A184 PolarHBondContact O-N 3.43Å; I182-A184 VanDerWaalsContact C-N 3.32Å; I182-A184 PolarHBondContact O-N 3.3Å; A184-L187 PolarHBondContact O-N 3.48Å; A184-A188 WeakPolarHBondContact O-CB 3.28Å; A184-A188 PolarHBondContact O-N 3.3Å
185V95.3Very high93.7Very high3 Ų358.8 Ų58.82%0.01833%0.33CS..Hα-helixtrans-61.8-44.7171.7179.50000110.8L181 I182 L183 L187 A188 Q189 I206 F207 V210L181-V185 WeakPolarHBondContact O-CG2 3.38Å; L181-V185 PolarHBondContact O-N 2.88Å; I182-V185 WeakPolarHBondContact O-CB 3.25Å; I182-V185 PolarHBondContact O-N 2.98Å; L183-V185 VanDerWaalsContact C-N 3.31Å; L183-V185 PolarHBondContact O-N 3.34Å; V185-L187 VanDerWaalsContact C-N 3.33Å; V185-L187 PolarHBondContact O-N 3.47Å; V185-A188 WeakPolarHBondContact O-CB 3.36Å; V185-A188 PolarHBondContact O-N 3.14Å; V185-Q189 WeakPolarHBondContact O-CG 3.47Å; V185-Q189 PolarHBondContact O-N 2.98Å; V185-I206 HydrophobicContact CG1-CG2 4.43Å; V185-I206 HydrophobicContact CG2-CG2 3.64Å; V185-F207 HydrophobicContact CG1-CE1 4.08Å; V185-F207 HydrophobicContact CG1-CZ 4.24Å; V185-V210 HydrophobicContact CG2-CG2 3.75Å
186F93.8Very high93.1Very high67 Ų6758.7 Ų58.729%0.29433%0.333SS..Hα-helixtrans-61.5-40.3177.1-65-22.2000112.7V146 V150 I182 L183 Q189V146-F186 HydrophobicContact CB-CE1 4.28Å; V146-F186 HydrophobicContact CG1-CE1 3.92Å; V146-F186 HydrophobicContact CG1-CZ 4.17Å; V146-F186 HydrophobicContact CG2-CD1 4.34Å; V146-F186 HydrophobicContact CG2-CE1 4.16Å; V150-F186 HydrophobicContact CG2-CZ 4.2Å; I182-F186 HydrophobicContact CG2-CD2 4.36Å; I182-F186 HydrophobicContact CG2-CE1 4.23Å; I182-F186 HydrophobicContact CG2-CE2 3.76Å; I182-F186 HydrophobicContact CG2-CZ 3.69Å; I182-F186 PolarHBondContact O-N 3.38Å; L183-F186 WeakPolarHBondContact O-CB 3.4Å; L183-F186 PolarHBondContact O-N 3.07Å; L183-F186 VanDerWaalsContact O-N 3.13Å; F186-Q189 WeakPolarHBondContact O-CB 3.38Å; F186-Q189 PolarHBondContact O-N 3.33Å
187L93.4Very high92.4Very high107 Ų10760 Ų6056%0.5633%0.331SS*.Hα-helixtrans-64.6-40.8174-66.8174.4000111.7L183 A184 V185 Q189 I190L183-L187 WeakPolarHBondContact O-CG 3.36Å; L183-L187 PolarHBondContact O-N 3.06Å; A184-L187 PolarHBondContact O-N 3.48Å; V185-L187 VanDerWaalsContact C-N 3.33Å; V185-L187 PolarHBondContact O-N 3.47Å; L187-Q189 PolarHBondContact O-N 3.19Å; L187-I190 HydrophobicContact CD2-CD1 4.08Å; L187-I190 WeakPolarHBondContact O-CB 3.36Å; L187-I190 PolarHBondContact O-N 2.99Å; L187-I190 VanDerWaalsContact O-N 3.12Å
188A93Very high91.9Very high29 Ų2964.3 Ų64.324%0.2435%0.348CS..Hα-helixtrans-61.5-33.1175.300000112.3A184 V185 I190 H191 Y194A184-A188 WeakPolarHBondContact O-CB 3.28Å; A184-A188 PolarHBondContact O-N 3.3Å; V185-A188 WeakPolarHBondContact O-CB 3.36Å; V185-A188 PolarHBondContact O-N 3.14Å; A188-I190 PolarHBondContact O-N 3.45Å; A188-H191 WeakPolarHBondContact O-CB 3.49Å; A188-H191 PolarHBondContact O-N 3.5Å; A188-H191 VanDerWaalsContact O-N 3.12Å; A188-Y194 HydrophobicContact CB-CD2 4.19Å; A188-Y194 HydrophobicContact CB-CE2 3.98Å; A188-Y194 WeakPolarHBondContact O-CD2 3.41Å
189Q91.9Very high91.5Very high18 Ų1867.9 Ų67.98%0.08436%0.36CS..Hα-helixtrans-64.7-24.3176.3-69.4-170.144.600113.8A142 V185 F186 L187 H191 Y194A142-Q189 PolarHBondContact O-OE1 3.11Å; V185-Q189 WeakPolarHBondContact O-CG 3.47Å; V185-Q189 PolarHBondContact O-N 2.98Å; F186-Q189 WeakPolarHBondContact O-CB 3.38Å; F186-Q189 PolarHBondContact O-N 3.33Å; L187-Q189 PolarHBondContact O-N 3.19Å; Q189-H191 PolarHBondContact O-N 3.41Å; Q189-Y194 HydrophobicContact CB-CD1 4.28Å; Q189-Y194 HydrophobicContact CB-CE1 4.36Å; Q189-Y194 HydrophobicContact CG-CD1 3.92Å; Q189-Y194 HydrophobicContact CG-CE1 3.51Å; Q189-Y194 HydrophobicContact CG-CE2 4.35Å
190I90.4Very high91.1Very high132 Ų13266.9 Ų66.968%0.67735%0.35SS*.THydrogen-bonded Turntrans-68.6-22.2176.9-57.3172.2000110.7L187 A188L187-I190 HydrophobicContact CD2-CD1 4.08Å; L187-I190 WeakPolarHBondContact O-CB 3.36Å; L187-I190 PolarHBondContact O-N 2.99Å; L187-I190 VanDerWaalsContact O-N 3.12Å; A188-I190 PolarHBondContact O-N 3.45Å
191H90.3Very high90.7Very high74 Ų7471.3 Ų71.334%0.34336%0.361SS..SBendtrans-61.1129.7-178.4-172.2-96000111.2A188 Q189 H193 Y194 W199A188-H191 WeakPolarHBondContact O-CB 3.49Å; A188-H191 PolarHBondContact O-N 3.5Å; A188-H191 VanDerWaalsContact O-N 3.12Å; Q189-H191 PolarHBondContact O-N 3.41Å; H191-H193 AromaticContact CE1-CD2 3.63Å; H191-H193 PolarHBondContact ND1-N 3.49Å; H191-H193 PolarHBondContact O-N 3.27Å; H191-Y194 VanDerWaalsContact O-CB 3.24Å; H191-Y194 WeakPolarHBondContact O-CB 3.03Å; H191-Y194 PolarHBondContact O-N 3.41Å; H191-W199 AromaticContact CE1-CE2 3.94Å; H191-W199 AromaticContact CE1-CH2 3.6Å; H191-W199 AromaticContact CE1-CZ2 3.32Å; H191-W199 WeakPolarHBondContact CE1-CZ2 3.46Å; H191-W199 AromaticContact ND1-CH2 3.56Å; H191-W199 AromaticContact ND1-CZ2 3.62Å; H191-W199 AromaticContact ND1-CZ3 3.96Å
192P86Confident90.5Very high113 Ų11373 Ų7373%0.73437%0.367SS*.THydrogen-bonded Turntrans-56.4-32.7-173.1-27.634.3000114.7
193H85.9Confident90.4Very high96 Ų9673.7 Ų73.744%0.44437%0.37SS..THydrogen-bonded Turntrans-88.3-5.4179.5-62.1-83.3000113.6H191 H195 S196 W199H191-H193 AromaticContact CE1-CD2 3.63Å; H191-H193 PolarHBondContact ND1-N 3.49Å; H191-H193 PolarHBondContact O-N 3.27Å; H193-H195 PolarHBondContact O-N 2.94Å; H193-S196 VanDerWaalsContact O-CB 3.26Å; H193-S196 WeakPolarHBondContact O-CB 3.43Å; H193-S196 PolarHBondContact O-N 3.5Å; H193-S196 PolarHBondContact O-OG 3.05Å; H193-W199 HydrophobicContact CB-CD2 4.26Å; H193-W199 HydrophobicContact CB-CG 4.13Å; H193-W199 VanDerWaalsContact O-CB 3.32Å; H193-W199 WeakPolarHBondContact O-CB 3.5Å
194Y87.8Confident90.2Very high0 Ų070.4 Ų70.40%035%0.354CS..THydrogen-bonded Turntrans-55.7-42.3-173.9-172.3-90.3000111.9F145 A188 Q189 H191 S196 W199 R203 I206F145-Y194 HydrophobicContact CD2-CE1 4.02Å; F145-Y194 HydrophobicContact CE2-CE1 4.5Å; F145-Y194 HydrophobicContact CG-CE1 4.44Å; A188-Y194 HydrophobicContact CB-CD2 4.19Å; A188-Y194 HydrophobicContact CB-CE2 3.98Å; A188-Y194 WeakPolarHBondContact O-CD2 3.41Å; Q189-Y194 HydrophobicContact CB-CD1 4.28Å; Q189-Y194 HydrophobicContact CB-CE1 4.36Å; Q189-Y194 HydrophobicContact CG-CD1 3.92Å; Q189-Y194 HydrophobicContact CG-CE1 3.51Å; Q189-Y194 HydrophobicContact CG-CE2 4.35Å; H191-Y194 VanDerWaalsContact O-CB 3.24Å; H191-Y194 WeakPolarHBondContact O-CB 3.03Å; H191-Y194 PolarHBondContact O-N 3.41Å; Y194-S196 VanDerWaalsContact C-N 3.31Å; Y194-S196 PolarHBondContact O-N 2.85Å; Y194-W199 HydrophobicContact CD2-CE3 4.44Å; Y194-R203 HydrophobicContact CD1-CG 4.11Å; Y194-R203 HydrophobicContact CD2-CG 4.14Å; Y194-R203 HydrophobicContact CE1-CG 3.74Å; Y194-R203 HydrophobicContact CE2-CG 3.8Å; Y194-R203 HydrophobicContact CG-CG 4.3Å; Y194-R203 WeakPolarHBondContact O-CD 3.45Å; Y194-R203 PolarHBondContact O-NH1 3Å; Y194-I206 HydrophobicContact CE2-CD1 4.2Å
195H85.8Confident90.1Very high49 Ų4970.3 Ų70.323%0.22735%0.353CS..THydrogen-bonded Turntrans-83.90.6179.9-57.1-69.6000114.2A142 F145 H193A142-H195 WeakPolarHBondContact CB-CE1 3.44Å; F145-H195 AromaticContact CD2-CE1 3.98Å; F145-H195 AromaticContact CD2-ND1 3.76Å; F145-H195 AromaticContact CE2-ND1 3.85Å; H193-H195 PolarHBondContact O-N 2.94Å
196S85.6Confident90.1Very high33 Ų3372.4 Ų72.423%0.23136%0.364CS..SBendtrans-72.4161179.686.10000111.7H193 Y194 E198 W199 R203H193-S196 VanDerWaalsContact O-CB 3.26Å; H193-S196 WeakPolarHBondContact O-CB 3.43Å; H193-S196 PolarHBondContact O-N 3.5Å; H193-S196 PolarHBondContact O-OG 3.05Å; Y194-S196 VanDerWaalsContact C-N 3.31Å; Y194-S196 PolarHBondContact O-N 2.85Å; S196-E198 VanDerWaalsContact C-N 3.26Å; S196-E198 PolarHBondContact O-N 2.9Å; S196-E198 PolarHBondContact OG-N 3.43Å; S196-W199 PolarHBondContact OG-N 3.39Å; S196-R203 PolarHBondContact O-NH1 3.28Å
197K83.6Confident90.2Very high114 Ų11470.6 Ų70.650%0.49636%0.356SS..SBendtrans-65.8-31.4174-66.2-173.8-175.7179.30112L38 K41 W199 R200L38-K197 PolarHBondContact O-NZ 2.82Å; K41-K197 PolarHBondContact O-NZ 3.35Å; K197-W199 VanDerWaalsContact C-N 3.35Å; K197-W199 PolarHBondContact O-N 3.34Å; K197-R200 WeakPolarHBondContact O-CB 3.34Å; K197-R200 PolarHBondContact O-N 2.94Å
198E87.2Confident90.3Very high147 Ų14768 Ų6869%0.68735%0.346SS*.THydrogen-bonded Turntrans-64.5-38.5-178.9-61169.9172.800112S196 R200 Q202S196-E198 VanDerWaalsContact C-N 3.26Å; S196-E198 PolarHBondContact O-N 2.9Å; S196-E198 PolarHBondContact OG-N 3.43Å; E198-R200 PolarHBondContact O-N 3.32Å; E198-Q202 PolarHBondContact O-OE1 2.86Å
199W90.4Very high90.4Very high76 Ų7670.6 Ų70.629%0.28836%0.362SS..THydrogen-bonded Turntrans-81.67.1-179.5-84.853.3000114.1H191 H193 Y194 S196 K197 H201 Q202 R203H191-W199 AromaticContact CE1-CE2 3.94Å; H191-W199 AromaticContact CE1-CH2 3.6Å; H191-W199 AromaticContact CE1-CZ2 3.32Å; H191-W199 WeakPolarHBondContact CE1-CZ2 3.46Å; H191-W199 AromaticContact ND1-CH2 3.56Å; H191-W199 AromaticContact ND1-CZ2 3.62Å; H191-W199 AromaticContact ND1-CZ3 3.96Å; H193-W199 HydrophobicContact CB-CD2 4.26Å; H193-W199 HydrophobicContact CB-CG 4.13Å; H193-W199 VanDerWaalsContact O-CB 3.32Å; H193-W199 WeakPolarHBondContact O-CB 3.5Å; Y194-W199 HydrophobicContact CD2-CE3 4.44Å; S196-W199 PolarHBondContact OG-N 3.39Å; K197-W199 VanDerWaalsContact C-N 3.35Å; K197-W199 PolarHBondContact O-N 3.34Å; W199-H201 VanDerWaalsContact C-N 3.29Å; W199-H201 PolarHBondContact O-N 2.94Å; W199-Q202 VanDerWaalsContact CA-OE1 3.29Å; W199-Q202 HydrophobicContact CE3-CB 4.25Å; W199-Q202 PolarHBondContact O-N 2.96Å; W199-Q202 PolarHBondContact O-OE1 2.61Å; W199-R203 WeakPolarHBondContact O-CG 3.46Å; W199-R203 PolarHBondContact O-N 2.88Å
200R88.3Confident90.7Very high80 Ų8070.2 Ų70.230%0.30236%0.361SS..Hα-helixtrans-57.4-41.9-177.5179.8177.5174.4-167.4-6.7112.5K197 E198 T204K197-R200 WeakPolarHBondContact O-CB 3.34Å; K197-R200 PolarHBondContact O-N 2.94Å; E198-R200 PolarHBondContact O-N 3.32Å; R200-T204 WeakPolarHBondContact O-CB 3.45Å; R200-T204 PolarHBondContact O-N 3.2Å; R200-T204 PolarHBondContact O-OG1 3.45Å
201H90.4Very high91Very high147 Ų14765.8 Ų65.868%0.68134%0.344SS*.Hα-helixtrans-68.8-40.7179.9-66.7-68.8000111.7W199 T204 A205W199-H201 VanDerWaalsContact C-N 3.29Å; W199-H201 PolarHBondContact O-N 2.94Å; H201-T204 WeakPolarHBondContact O-CB 3.39Å; H201-T204 PolarHBondContact O-N 3Å; H201-A205 WeakPolarHBondContact O-CB 3.43Å; H201-A205 PolarHBondContact O-N 3Å
202Q93.6Very high91.3Very high91 Ų9163.4 Ų63.443%0.42534%0.34SS..Hα-helixtrans-65.3-47.3177.7-67.276.60.900110.8E198 W199 T204 A205 I206E198-Q202 PolarHBondContact O-OE1 2.86Å; W199-Q202 VanDerWaalsContact CA-OE1 3.29Å; W199-Q202 HydrophobicContact CE3-CB 4.25Å; W199-Q202 PolarHBondContact O-N 2.96Å; W199-Q202 PolarHBondContact O-OE1 2.61Å; Q202-T204 VanDerWaalsContact C-N 3.29Å; Q202-T204 PolarHBondContact O-N 3.43Å; Q202-A205 PolarHBondContact O-N 3.33Å; Q202-I206 VanDerWaalsContact O-CG1 3.27Å; Q202-I206 WeakPolarHBondContact O-CG1 3.32Å; Q202-I206 PolarHBondContact O-N 3.43Å
203R92.9Very high91.9Very high19 Ų1959.2 Ų59.27%0.07231%0.31CS..Hα-helixtrans-56-46.1173.3-71.2-160.4-56.3-77.91.7111.9Y194 S196 W199 I206 F207Y194-R203 HydrophobicContact CD1-CG 4.11Å; Y194-R203 HydrophobicContact CD2-CG 4.14Å; Y194-R203 HydrophobicContact CE1-CG 3.74Å; Y194-R203 HydrophobicContact CE2-CG 3.8Å; Y194-R203 HydrophobicContact CG-CG 4.3Å; Y194-R203 WeakPolarHBondContact O-CD 3.45Å; Y194-R203 PolarHBondContact O-NH1 3Å; S196-R203 PolarHBondContact O-NH1 3.28Å; W199-R203 WeakPolarHBondContact O-CG 3.46Å; W199-R203 PolarHBondContact O-N 2.88Å; R203-I206 PolarHBondContact O-N 2.92Å; R203-F207 VanDerWaalsContact O-CD2 3.27Å; R203-F207 WeakPolarHBondContact O-CD2 3.42Å; R203-F207 PolarHBondContact O-N 3.32Å
204T92.4Very high92.4Very high30 Ų3055 Ų5518%0.18429%0.293CS..Hα-helixtrans-60.5-47.5178.8-59.10000110.7R200 H201 Q202 I206 F207 C208 F251R200-T204 WeakPolarHBondContact O-CB 3.45Å; R200-T204 PolarHBondContact O-N 3.2Å; R200-T204 PolarHBondContact O-OG1 3.45Å; H201-T204 WeakPolarHBondContact O-CB 3.39Å; H201-T204 PolarHBondContact O-N 3Å; Q202-T204 VanDerWaalsContact C-N 3.29Å; Q202-T204 PolarHBondContact O-N 3.43Å; T204-I206 VanDerWaalsContact C-N 3.35Å; T204-I206 PolarHBondContact O-N 3.18Å; T204-F207 PolarHBondContact O-N 3.24Å; T204-C208 WeakPolarHBondContact O-CB 3.1Å; T204-C208 PolarHBondContact O-N 3.25Å; T204-C208 PolarHBondContact O-SG 3.37Å; T204-F251 HydrophobicContact CG2-CE2 3.44Å; T204-F251 VanDerWaalsContact CG2-CE2 3.44Å; T204-F251 HydrophobicContact CG2-CZ 3.4Å
205A94.8Very high92.8Very high52 Ų5260.2 Ų60.243%0.4332%0.319SS..Hα-helixtrans-60.2-42.617700000112.2H201 Q202 C208 S209H201-A205 WeakPolarHBondContact O-CB 3.43Å; H201-A205 PolarHBondContact O-N 3Å; Q202-A205 PolarHBondContact O-N 3.33Å; A205-C208 PolarHBondContact O-N 3.13Å; A205-S209 WeakPolarHBondContact O-CB 3.43Å; A205-S209 PolarHBondContact O-N 3.01Å; A205-S209 PolarHBondContact O-OG 3.17Å
206I94.9Very high93.4Very high47 Ų4762.9 Ų62.924%0.24133%0.334CS..Hα-helixtrans-58.2-52.6176.4-70.1164.1000110.6V185 Y194 Q202 R203 T204 C208 S209 V210V185-I206 HydrophobicContact CG1-CG2 4.43Å; V185-I206 HydrophobicContact CG2-CG2 3.64Å; Y194-I206 HydrophobicContact CE2-CD1 4.2Å; Q202-I206 VanDerWaalsContact O-CG1 3.27Å; Q202-I206 WeakPolarHBondContact O-CG1 3.32Å; Q202-I206 PolarHBondContact O-N 3.43Å; R203-I206 PolarHBondContact O-N 2.92Å; T204-I206 VanDerWaalsContact C-N 3.35Å; T204-I206 PolarHBondContact O-N 3.18Å; I206-C208 PolarHBondContact O-N 2.9Å; I206-S209 PolarHBondContact O-N 3.12Å; I206-V210 WeakPolarHBondContact O-CG2 3.45Å; I206-V210 PolarHBondContact O-N 3.25Å
207F94.8Very high93.9Very high28 Ų2861.6 Ų61.612%0.12333%0.325CS..Hα-helixtrans-63.7-40.5179.7-77.7-61.1000112.7F145 I148 S149 I152 V185 R203 T204 S209 V210 A211F145-F207 HydrophobicContact CB-CE2 4.43Å; F145-F207 HydrophobicContact CB-CZ 4.04Å; F145-F207 AromaticContact CD1-CE2 3.75Å; F145-F207 HydrophobicContact CD1-CE2 3.75Å; F145-F207 HydrophobicContact CD1-CZ 4.11Å; F145-F207 HydrophobicContact CE1-CE2 4.4Å; F145-F207 HydrophobicContact CG-CE2 4.3Å; F145-F207 HydrophobicContact CG-CZ 4.39Å; I148-F207 HydrophobicContact CB-CE1 4.13Å; I148-F207 HydrophobicContact CB-CZ 4.41Å; I148-F207 HydrophobicContact CG2-CD1 3.81Å; I148-F207 HydrophobicContact CG2-CE1 3.74Å; I148-F207 HydrophobicContact CG2-CG 4.47Å; I148-F207 HydrophobicContact CG2-CZ 4.35Å; S149-F207 WeakPolarHBondContact OG-CE1 3.38Å; I152-F207 HydrophobicContact CD1-CD1 4.23Å; V185-F207 HydrophobicContact CG1-CE1 4.08Å; V185-F207 HydrophobicContact CG1-CZ 4.24Å; R203-F207 VanDerWaalsContact O-CD2 3.27Å; R203-F207 WeakPolarHBondContact O-CD2 3.42Å; R203-F207 PolarHBondContact O-N 3.32Å; T204-F207 PolarHBondContact O-N 3.24Å; F207-S209 VanDerWaalsContact C-N 3.33Å; F207-S209 PolarHBondContact O-N 3.26Å; F207-V210 PolarHBondContact O-N 2.91Å; F207-A211 WeakPolarHBondContact O-CB 3.37Å; F207-A211 PolarHBondContact O-N 3.06Å
208C95.8Very high94.6Very high54 Ų5457.3 Ų57.337%0.36531%0.311SS..Hα-helixtrans-61.4-41174.6-71.30000111.9T204 A205 I206 G212 F251T204-C208 WeakPolarHBondContact O-CB 3.1Å; T204-C208 PolarHBondContact O-N 3.25Å; T204-C208 PolarHBondContact O-SG 3.37Å; A205-C208 PolarHBondContact O-N 3.13Å; I206-C208 PolarHBondContact O-N 2.9Å; C208-G212 WeakPolarHBondContact O-CA 3.38Å; C208-G212 PolarHBondContact O-N 3.36Å; C208-F251 VanDerWaalsContact SG-CZ 3.6Å
209S96.6Very high95Very high83 Ų8352.4 Ų52.458%0.5830%0.299SS*.Hα-helixtrans-65.7-43.7176.9-65.40000112A205 I206 F207 G212 Y213A205-S209 WeakPolarHBondContact O-CB 3.43Å; A205-S209 PolarHBondContact O-N 3.01Å; A205-S209 PolarHBondContact O-OG 3.17Å; I206-S209 PolarHBondContact O-N 3.12Å; F207-S209 VanDerWaalsContact C-N 3.33Å; F207-S209 PolarHBondContact O-N 3.26Å; S209-G212 PolarHBondContact O-N 3.28Å; S209-Y213 PolarHBondContact O-N 3.4Å
210V97.1Very high95.4Very high9 Ų950.3 Ų50.36%0.05529%0.293CS..Hα-helixtrans-68.2-36.6179.2177.20000111.7I152 Y156 L181 I182 V185 I206 F207I152-V210 HydrophobicContact CG2-CG1 4.1Å; Y156-V210 WeakPolarHBondContact CE2-O 3.36Å; Y156-V210 PolarHBondContact OH-O 3.33Å; L181-V210 HydrophobicContact CB-CG1 4.41Å; L181-V210 HydrophobicContact CB-CG2 4.32Å; I182-V210 HydrophobicContact CD1-CG1 3.81Å; V185-V210 HydrophobicContact CG2-CG2 3.75Å; I206-V210 WeakPolarHBondContact O-CG2 3.45Å; I206-V210 PolarHBondContact O-N 3.25Å; F207-V210 PolarHBondContact O-N 2.91Å
211A96.5Very high95.7Very high39 Ų3946.7 Ų46.732%0.32228%0.279SS..Hα-helixtrans-72.8-36.9172.600000112.4Y156 F207 Y213 Y244Y156-A211 PolarHBondContact OH-O 2.95Å; F207-A211 WeakPolarHBondContact O-CB 3.37Å; F207-A211 PolarHBondContact O-N 3.06Å; A211-Y213 VanDerWaalsContact C-N 3.32Å; A211-Y213 PolarHBondContact O-N 3.38Å; A211-Y244 PolarHBondContact O-OH 3.26Å
212G96.8Very high96Very high25 Ų2540.8 Ų40.826%0.25825%0.253SS..Hα-helixtrans-71-24.117900000113.7C208 S209 G214 I215C208-G212 WeakPolarHBondContact O-CA 3.38Å; C208-G212 PolarHBondContact O-N 3.36Å; S209-G212 PolarHBondContact O-N 3.28Å; G212-G214 PolarHBondContact O-N 3.01Å; G212-G214 VanDerWaalsContact O-N 3.08Å; G212-I215 WeakPolarHBondContact O-CB 3.47Å; G212-I215 WeakPolarHBondContact O-CG1 3.2Å; G212-I215 PolarHBondContact O-N 3.46Å
213Y97.8Very high96Very high25 Ų2545.2 Ų45.210%0.09827%0.266CS..THydrogen-bonded Turntrans-49.8-36174.5163.3-109.7000112.4Y156 Y174 T177 A178 L181 S209 A211 I215 I216 P217Y156-Y213 AromaticContact CE1-CD1 3.74Å; Y156-Y213 HydrophobicContact CE1-CD1 3.74Å; Y156-Y213 HydrophobicContact CE1-CE1 4.11Å; Y156-Y213 HydrophobicContact CE2-CD1 4.24Å; Y156-Y213 AromaticContact CZ-CD1 3.56Å; Y156-Y213 WeakPolarHBondContact OH-CD1 3.43Å; Y174-Y213 WeakPolarHBondContact CA-OH 3.45Å; Y174-Y213 VanDerWaalsContact CD1-OH 3.26Å; Y174-Y213 WeakPolarHBondContact CD1-OH 3.49Å; Y174-Y213 PolarHBondContact O-OH 3.25Å; Y174-Y213 VanDerWaalsContact O-OH 3.05Å; T177-Y213 VanDerWaalsContact CB-OH 3.24Å; T177-Y213 WeakPolarHBondContact CB-OH 3.4Å; T177-Y213 HydrophobicContact CG2-CE1 4.44Å; T177-Y213 HydrophobicContact CG2-CE2 3.68Å; T177-Y213 WeakPolarHBondContact CG2-OH 2.95Å; A178-Y213 HydrophobicContact CB-CE1 4.07Å; L181-Y213 HydrophobicContact CD1-CD1 3.77Å; L181-Y213 HydrophobicContact CD1-CD2 3.96Å; L181-Y213 HydrophobicContact CD1-CE1 4.31Å; L181-Y213 HydrophobicContact CD1-CE2 4.46Å; L181-Y213 HydrophobicContact CD1-CG 3.58Å; S209-Y213 PolarHBondContact O-N 3.4Å; A211-Y213 VanDerWaalsContact C-N 3.32Å; A211-Y213 PolarHBondContact O-N 3.38Å; Y213-I215 PolarHBondContact O-N 3.29Å; Y213-I216 HydrophobicContact CD2-CD1 4.21Å; Y213-I216 WeakPolarHBondContact O-CB 3.2Å; Y213-I216 PolarHBondContact O-N 3.38Å; Y213-P217 WeakPolarHBondContact O-CD 3.38Å
214G96.5Very high96Very high8 Ų846.3 Ų46.38%0.08227%0.273CS..THydrogen-bonded Turntrans-61.1-14.7178.800000115.8Y156 G212 I216 P217 A218 Y244Y156-G214 PolarHBondContact OH-N 2.86Å; G212-G214 PolarHBondContact O-N 3.01Å; G212-G214 VanDerWaalsContact O-N 3.08Å; G214-I216 VanDerWaalsContact C-N 3.29Å; G214-I216 PolarHBondContact O-N 2.91Å; G214-P217 WeakPolarHBondContact O-CD 3.38Å; G214-P217 WeakPolarHBondContact O-CG 3.48Å; G214-A218 VanDerWaalsContact O-CB 3.27Å; G214-A218 WeakPolarHBondContact O-CB 2.88Å; G214-A218 PolarHBondContact O-N 3.07Å; G214-A218 VanDerWaalsContact O-N 3.14Å; G214-Y244 VanDerWaalsContact C-OH 3.31Å; G214-Y244 VanDerWaalsContact CA-OH 3.25Å; G214-Y244 WeakPolarHBondContact CA-OH 3.31Å
215I97.3Very high95.9Very high108 Ų10846.6 Ų46.655%0.55427%0.273SS*.Hα-helixtrans-65.2-35.7170.7-62170.7000110.8G212 Y213 A218 G219 Y244G212-I215 WeakPolarHBondContact O-CB 3.47Å; G212-I215 WeakPolarHBondContact O-CG1 3.2Å; G212-I215 PolarHBondContact O-N 3.46Å; Y213-I215 PolarHBondContact O-N 3.29Å; I215-A218 PolarHBondContact O-N 3.29Å; I215-G219 PolarHBondContact O-N 2.86Å; I215-Y244 HydrophobicContact CG1-CE1 4.4Å; I215-Y244 PolarHBondContact N-OH 3.1Å
216I97.9Very high95.8Very high105 Ų10552.7 Ų52.754%0.53829%0.293SS..Hα-helixtrans-64-57.1179.8-58.8176.1000111.7Y174 Y213 G214 A218 G219 H220Y174-I216 HydrophobicContact CE1-CG2 4.36Å; Y213-I216 HydrophobicContact CD2-CD1 4.21Å; Y213-I216 WeakPolarHBondContact O-CB 3.2Å; Y213-I216 PolarHBondContact O-N 3.38Å; G214-I216 VanDerWaalsContact C-N 3.29Å; G214-I216 PolarHBondContact O-N 2.91Å; I216-A218 VanDerWaalsContact C-N 3.28Å; I216-A218 PolarHBondContact O-N 3.14Å; I216-G219 PolarHBondContact O-N 3.11Å; I216-H220 WeakPolarHBondContact O-CB 3.39Å; I216-H220 PolarHBondContact O-N 2.9Å
217P97.2Very high95.7Very high7 Ų751.4 Ų51.45%0.04529%0.291CS..Hα-helixtrans-64.2-32.1176.825-32.3000112.2F164 Y174 Y213 G214 W221F164-P217 HydrophobicContact CE2-CB 3.94Å; F164-P217 HydrophobicContact CZ-CB 4.25Å; F164-P217 WeakPolarHBondContact CZ-O 3.32Å; Y174-P217 HydrophobicContact CD1-CB 3.94Å; Y174-P217 HydrophobicContact CD1-CG 4.48Å; Y174-P217 HydrophobicContact CD2-CB 3.72Å; Y174-P217 HydrophobicContact CE1-CB 4Å; Y174-P217 HydrophobicContact CE2-CB 3.8Å; Y174-P217 HydrophobicContact CG-CB 3.78Å; Y213-P217 WeakPolarHBondContact O-CD 3.38Å; G214-P217 WeakPolarHBondContact O-CD 3.38Å; G214-P217 WeakPolarHBondContact O-CG 3.48Å; P217-W221 WeakPolarHBondContact O-CB 3.43Å; P217-W221 PolarHBondContact O-N 3.18Å
218A96.6Very high95.6Very high24 Ų2455.5 Ų55.520%0.19831%0.314CS..Hα-helixtrans-63.6-47.5174.200000111.9G214 I215 I216 W221 V222G214-A218 VanDerWaalsContact O-CB 3.27Å; G214-A218 WeakPolarHBondContact O-CB 2.88Å; G214-A218 PolarHBondContact O-N 3.07Å; G214-A218 VanDerWaalsContact O-N 3.14Å; I215-A218 PolarHBondContact O-N 3.29Å; I216-A218 VanDerWaalsContact C-N 3.28Å; I216-A218 PolarHBondContact O-N 3.14Å; A218-W221 PolarHBondContact O-N 3.03Å; A218-V222 WeakPolarHBondContact O-CG2 3.36Å; A218-V222 PolarHBondContact O-N 3.29Å
219G97.3Very high95.4Very high43 Ų4356 Ų5644%0.44333%0.328SS..Hα-helixtrans-63.7-43.6177.400000112.4I215 I216 W221 V222 W223I215-G219 PolarHBondContact O-N 2.86Å; I216-G219 PolarHBondContact O-N 3.11Å; G219-W221 VanDerWaalsContact C-N 3.34Å; G219-W221 PolarHBondContact O-N 2.86Å; G219-V222 PolarHBondContact O-N 3.48Å; G219-W223 PolarHBondContact O-N 3Å
220H97.1Very high95.2Very high32 Ų3253.4 Ų53.415%0.14831%0.31CS..Hα-helixtrans-63.4-41.1175.5-178.1-148.6000112.1W170 Y174 I216 V222 W223 L224W170-H220 AromaticContact CD1-CE1 3.82Å; W170-H220 AromaticContact CD2-CE1 3.43Å; W170-H220 VanDerWaalsContact CD2-CE1 3.43Å; W170-H220 AromaticContact CE2-CE1 3.44Å; W170-H220 VanDerWaalsContact CE2-CE1 3.44Å; W170-H220 AromaticContact CE3-CE1 3.85Å; W170-H220 AromaticContact CG-CE1 3.72Å; W170-H220 AromaticContact CZ2-CE1 3.88Å; W170-H220 AromaticContact NE1-CE1 3.69Å; Y174-H220 AromaticContact CE2-ND1 3.57Å; Y174-H220 AromaticContact CZ-ND1 3.56Å; Y174-H220 WeakPolarHBondContact OH-CB 3.38Å; Y174-H220 VanDerWaalsContact OH-CG 3.24Å; Y174-H220 PolarHBondContact OH-ND1 3.18Å; I216-H220 WeakPolarHBondContact O-CB 3.39Å; I216-H220 PolarHBondContact O-N 2.9Å; H220-V222 PolarHBondContact O-N 3.21Å; H220-W223 AromaticContact CD2-CE3 3.61Å; H220-W223 AromaticContact NE2-CE3 3.78Å; H220-W223 AromaticContact NE2-CZ3 3.82Å; H220-W223 WeakPolarHBondContact O-CB 3.31Å; H220-W223 PolarHBondContact O-N 3.02Å; H220-L224 WeakPolarHBondContact O-CG 3.01Å; H220-L224 PolarHBondContact O-N 3Å
221W95.5Very high94.8Very high5 Ų556.8 Ų56.82%0.01934%0.339CS..Hα-helixtrans-61.5-42.3175.5-179.982.3000112.3A163 F164 P217 A218 G219 W223 L224 N225 V232 V233 F236A163-W221 HydrophobicContact CB-CG 4.17Å; A163-W221 PolarHBondContact O-NE1 3.29Å; F164-W221 HydrophobicContact CE1-CB 4.32Å; F164-W221 HydrophobicContact CE2-CB 4.23Å; F164-W221 HydrophobicContact CZ-CB 3.76Å; P217-W221 WeakPolarHBondContact O-CB 3.43Å; P217-W221 PolarHBondContact O-N 3.18Å; A218-W221 PolarHBondContact O-N 3.03Å; G219-W221 VanDerWaalsContact C-N 3.34Å; G219-W221 PolarHBondContact O-N 2.86Å; W221-W223 VanDerWaalsContact C-N 3.32Å; W221-W223 PolarHBondContact O-N 3.11Å; W221-L224 PolarHBondContact O-N 3.41Å; W221-N225 PolarHBondContact NE1-ND2 3.46Å; W221-N225 PolarHBondContact O-N 3.34Å; W221-N225 VanDerWaalsContact O-N 3.15Å; W221-N225 PolarHBondContact O-ND2 2.8Å; W221-V232 HydrophobicContact CH2-CG1 4.35Å; W221-V232 HydrophobicContact CH2-CG2 4.16Å; W221-V232 HydrophobicContact CZ2-CG1 4.3Å; W221-V232 HydrophobicContact CZ2-CG2 3.92Å; W221-V233 HydrophobicContact CE3-CG2 4.45Å; W221-V233 HydrophobicContact CH2-CB 4.37Å; W221-V233 HydrophobicContact CH2-CG2 3.95Å; W221-V233 HydrophobicContact CZ3-CB 4.15Å; W221-V233 HydrophobicContact CZ3-CG1 4.28Å; W221-V233 HydrophobicContact CZ3-CG2 3.76Å; W221-F236 HydrophobicContact CD2-CD1 4.2Å; W221-F236 AromaticContact CE3-CD1 3.98Å; W221-F236 HydrophobicContact CE3-CD1 3.98Å; W221-F236 HydrophobicContact CH2-CB 3.66Å; W221-F236 AromaticContact CH2-CD1 3.59Å; W221-F236 HydrophobicContact CH2-CD1 3.59Å; W221-F236 HydrophobicContact CH2-CG 4.12Å; W221-F236 HydrophobicContact CZ2-CB 4.35Å; W221-F236 AromaticContact CZ2-CD1 3.8Å; W221-F236 HydrophobicContact CZ2-CD1 3.8Å; W221-F236 HydrophobicContact CZ3-CB 4.13Å; W221-F236 AromaticContact CZ3-CD1 3.66Å; W221-F236 HydrophobicContact CZ3-CD1 3.66Å; W221-F236 HydrophobicContact CZ3-CG 4.38Å
222V96Very high94.4Very high22 Ų2255.9 Ų55.913%0.13333%0.329CS..Hα-helixtrans-59.8-43.9174.7169.60000110.9A218 G219 H220 N225 G227 L228 V233 L237A218-V222 WeakPolarHBondContact O-CG2 3.36Å; A218-V222 PolarHBondContact O-N 3.29Å; G219-V222 PolarHBondContact O-N 3.48Å; H220-V222 PolarHBondContact O-N 3.21Å; V222-N225 PolarHBondContact O-N 3Å; V222-G227 WeakPolarHBondContact O-CA 3.42Å; V222-G227 PolarHBondContact O-N 2.94Å; V222-L228 HydrophobicContact CG1-CD2 4.04Å; V222-V233 HydrophobicContact CG1-CG1 4.2Å; V222-V233 HydrophobicContact CG2-CG1 3.97Å; V222-L237 HydrophobicContact CG2-CD1 4.13Å; V222-L237 HydrophobicContact CG2-CD2 4.07Å
223W95.3Very high94.2Very high185 Ų18554.7 Ų54.770%0.70132%0.317SS*.Hα-helixtrans-62-44.4177.817676.8000112.5G219 H220 W221 N225 E226G219-W223 PolarHBondContact O-N 3Å; H220-W223 AromaticContact CD2-CE3 3.61Å; H220-W223 AromaticContact NE2-CE3 3.78Å; H220-W223 AromaticContact NE2-CZ3 3.82Å; H220-W223 WeakPolarHBondContact O-CB 3.31Å; H220-W223 PolarHBondContact O-N 3.02Å; W221-W223 VanDerWaalsContact C-N 3.32Å; W221-W223 PolarHBondContact O-N 3.11Å; W223-N225 PolarHBondContact O-N 3.24Å; W223-E226 PolarHBondContact O-N 2.92Å
224L92.7Very high93.9Very high42 Ų4259.3 Ų59.322%0.2234%0.339CS..Hα-helixtrans-65.3-24.2177.8-72174.9000113.9F164 I167 H220 W221F164-L224 HydrophobicContact CD1-CD1 4.36Å; F164-L224 HydrophobicContact CE1-CD1 3.89Å; I167-L224 HydrophobicContact CD1-CD1 3.9Å; H220-L224 WeakPolarHBondContact O-CG 3.01Å; H220-L224 PolarHBondContact O-N 3Å; W221-L224 PolarHBondContact O-N 3.41Å
225N90.4Very high93.6Very high35 Ų3561.3 Ų61.319%0.18735%0.348CS..THydrogen-bonded Turntrans-103.136-179.1-68.9-95.9000111.7W221 V222 W223 G227 S230 V232 V233W221-N225 PolarHBondContact NE1-ND2 3.46Å; W221-N225 PolarHBondContact O-N 3.34Å; W221-N225 VanDerWaalsContact O-N 3.15Å; W221-N225 PolarHBondContact O-ND2 2.8Å; V222-N225 PolarHBondContact O-N 3Å; W223-N225 PolarHBondContact O-N 3.24Å; N225-G227 PolarHBondContact O-N 3.43Å; N225-S230 WeakPolarHBondContact O-CB 3.42Å; N225-S230 PolarHBondContact O-OG 3.32Å; N225-V232 HydrophobicContact CB-CG1 3.93Å; N225-V232 WeakPolarHBondContact OD1-CG1 3.37Å; N225-V233 HydrophobicContact CB-CG2 3.58Å
226E92Very high93.3Very high180 Ų18057 Ų5784%0.84133%0.326SS*.THydrogen-bonded Turntrans63.620.7173.7-54.8175.6-167.600114.7W223W223-E226 PolarHBondContact O-N 2.92Å
227G92.7Very high93.1Very high20 Ų2053.7 Ų53.721%0.20631%0.309CS..SBendtrans80.3-166.7173.800000115.1V222 N225 G229 S230 V233V222-G227 WeakPolarHBondContact O-CA 3.42Å; V222-G227 PolarHBondContact O-N 2.94Å; N225-G227 PolarHBondContact O-N 3.43Å; G227-G229 PolarHBondContact O-N 3.32Å; G227-G229 VanDerWaalsContact O-N 3.14Å; G227-S230 PolarHBondContact O-N 3.25Å; G227-V233 WeakPolarHBondContact O-CB 3.5Å; G227-V233 WeakPolarHBondContact O-CG2 3.31Å
228L93.3Very high93.1Very high115 Ų11556.4 Ų56.460%0.60233%0.326SS*.THydrogen-bonded Turntrans-67.1-15-170.5-61.2178.3000114.6V222 S230 V233 Q234 L237V222-L228 HydrophobicContact CG1-CD2 4.04Å; L228-S230 VanDerWaalsContact C-N 3.32Å; L228-V233 HydrophobicContact CD2-CG1 4.12Å; L228-Q234 VanDerWaalsContact O-CG 3.25Å; L228-Q234 WeakPolarHBondContact O-CG 3.13Å; L228-Q234 PolarHBondContact O-NE2 2.98Å; L228-L237 HydrophobicContact CD2-CD2 3.32Å
229G91.5Very high93.1Very high64 Ų6457.8 Ų57.866%0.6633%0.326SS*.THydrogen-bonded Turntrans-76.9-18.5177.400000113.7G227 Q234G227-G229 PolarHBondContact O-N 3.32Å; G227-G229 VanDerWaalsContact O-N 3.14Å; G229-Q234 PolarHBondContact O-NE2 3.46Å
230S91.2Very high93Very high28 Ų2856.3 Ų56.320%0.19631%0.308CS..SBendtrans-73.6137.6-175.4177.50000112.7N225 G227 L228 V232 V233 Q234N225-S230 WeakPolarHBondContact O-CB 3.42Å; N225-S230 PolarHBondContact O-OG 3.32Å; G227-S230 PolarHBondContact O-N 3.25Å; L228-S230 VanDerWaalsContact C-N 3.32Å; S230-V232 VanDerWaalsContact C-N 3.29Å; S230-V232 PolarHBondContact O-N 3.39Å; S230-V233 PolarHBondContact O-N 3.29Å; S230-V233 VanDerWaalsContact O-N 3.07Å; S230-Q234 WeakPolarHBondContact O-CG 3.43Å; S230-Q234 PolarHBondContact O-N 3.34Å
231A88.5Confident93.1Very high80 Ų8058.9 Ų58.966%0.66132%0.323SS*.Hα-helixtrans-58.9-38.6-17800000112.6L235A231-L235 WeakPolarHBondContact O-CB 3.37Å; A231-L235 PolarHBondContact O-N 2.94Å; A231-L235 VanDerWaalsContact O-N 3.14Å
232V88.4Confident93.2Very high20 Ų2061 Ų6112%0.12134%0.336CS..Hα-helixtrans-68.3-37.1177.869.40000111.5W221 N225 S230 L235 F236 F298W221-V232 HydrophobicContact CH2-CG1 4.35Å; W221-V232 HydrophobicContact CH2-CG2 4.16Å; W221-V232 HydrophobicContact CZ2-CG1 4.3Å; W221-V232 HydrophobicContact CZ2-CG2 3.92Å; N225-V232 HydrophobicContact CB-CG1 3.93Å; N225-V232 WeakPolarHBondContact OD1-CG1 3.37Å; S230-V232 VanDerWaalsContact C-N 3.29Å; S230-V232 PolarHBondContact O-N 3.39Å; V232-L235 WeakPolarHBondContact O-CB 3.25Å; V232-L235 PolarHBondContact O-N 3.22Å; V232-F236 PolarHBondContact O-N 2.79Å; V232-F298 HydrophobicContact CB-CE1 4.37Å; V232-F298 HydrophobicContact CB-CZ 4.22Å; V232-F298 HydrophobicContact CG2-CD1 4.46Å; V232-F298 HydrophobicContact CG2-CE1 3.53Å; V232-F298 HydrophobicContact CG2-CZ 3.85Å
233V92.7Very high93.3Very high1 Ų160.9 Ų60.91%0.00633%0.334CS..Hα-helixtrans-67.1-46.2177.7175.30000110.8W221 V222 N225 G227 L228 S230 L235 F236 L237W221-V233 HydrophobicContact CE3-CG2 4.45Å; W221-V233 HydrophobicContact CH2-CB 4.37Å; W221-V233 HydrophobicContact CH2-CG2 3.95Å; W221-V233 HydrophobicContact CZ3-CB 4.15Å; W221-V233 HydrophobicContact CZ3-CG1 4.28Å; W221-V233 HydrophobicContact CZ3-CG2 3.76Å; V222-V233 HydrophobicContact CG1-CG1 4.2Å; V222-V233 HydrophobicContact CG2-CG1 3.97Å; N225-V233 HydrophobicContact CB-CG2 3.58Å; G227-V233 WeakPolarHBondContact O-CB 3.5Å; G227-V233 WeakPolarHBondContact O-CG2 3.31Å; L228-V233 HydrophobicContact CD2-CG1 4.12Å; S230-V233 PolarHBondContact O-N 3.29Å; S230-V233 VanDerWaalsContact O-N 3.07Å; V233-L235 PolarHBondContact O-N 3.28Å; V233-F236 PolarHBondContact O-N 3.15Å; V233-L237 HydrophobicContact CG1-CB 4.1Å; V233-L237 HydrophobicContact CG1-CD2 4.11Å; V233-L237 WeakPolarHBondContact O-CB 3.36Å; V233-L237 PolarHBondContact O-N 3.47Å
234Q92.8Very high93.4Very high121 Ų12155.1 Ų55.157%0.56531%0.313SS*.Hα-helixtrans-62.9-23.4176.7-68.6-179.35.700112.9L228 G229 S230 P238L228-Q234 VanDerWaalsContact O-CG 3.25Å; L228-Q234 WeakPolarHBondContact O-CG 3.13Å; L228-Q234 PolarHBondContact O-NE2 2.98Å; G229-Q234 PolarHBondContact O-NE2 3.46Å; S230-Q234 WeakPolarHBondContact O-CG 3.43Å; S230-Q234 PolarHBondContact O-N 3.34Å; Q234-P238 VanDerWaalsContact O-CD 3.23Å; Q234-P238 WeakPolarHBondContact O-CD 3.1Å; Q234-P238 VanDerWaalsContact O-CG 3.23Å; Q234-P238 WeakPolarHBondContact O-CG 3.2Å
235L89.2Confident93.7Very high51 Ų5158.7 Ų58.727%0.26733%0.332SS..Hα-helixtrans-82-44.9176.6-169.568.5000112.9A231 V232 V233 Y294 F298A231-L235 WeakPolarHBondContact O-CB 3.37Å; A231-L235 PolarHBondContact O-N 2.94Å; A231-L235 VanDerWaalsContact O-N 3.14Å; V232-L235 WeakPolarHBondContact O-CB 3.25Å; V232-L235 PolarHBondContact O-N 3.22Å; V233-L235 PolarHBondContact O-N 3.28Å; L235-Y294 HydrophobicContact CD1-CE1 3.7Å; L235-Y294 WeakPolarHBondContact CD1-OH 3.41Å; L235-Y294 HydrophobicContact CD2-CE1 3.71Å; L235-Y294 HydrophobicContact CG-CE1 3.66Å; L235-F298 HydrophobicContact CD2-CD2 3.51Å; L235-F298 HydrophobicContact CD2-CE2 3.75Å; L235-F298 HydrophobicContact CD2-CG 4.02Å; L235-F298 HydrophobicContact CD2-CZ 4.44Å
236F90.8Very high94Very high18 Ų1857.8 Ų57.88%0.07933%0.327CS..Hα-helixtrans-91.5-43.3-172.1-179.2-136.5000113.4A163 W221 V232 V233 R239 V240 W288 T291 I295A163-F236 HydrophobicContact CB-CE1 3.9Å; W221-F236 HydrophobicContact CD2-CD1 4.2Å; W221-F236 AromaticContact CE3-CD1 3.98Å; W221-F236 HydrophobicContact CE3-CD1 3.98Å; W221-F236 HydrophobicContact CH2-CB 3.66Å; W221-F236 AromaticContact CH2-CD1 3.59Å; W221-F236 HydrophobicContact CH2-CD1 3.59Å; W221-F236 HydrophobicContact CH2-CG 4.12Å; W221-F236 HydrophobicContact CZ2-CB 4.35Å; W221-F236 AromaticContact CZ2-CD1 3.8Å; W221-F236 HydrophobicContact CZ2-CD1 3.8Å; W221-F236 HydrophobicContact CZ3-CB 4.13Å; W221-F236 AromaticContact CZ3-CD1 3.66Å; W221-F236 HydrophobicContact CZ3-CD1 3.66Å; W221-F236 HydrophobicContact CZ3-CG 4.38Å; V232-F236 PolarHBondContact O-N 2.79Å; V233-F236 PolarHBondContact O-N 3.15Å; F236-R239 WeakPolarHBondContact O-CB 3.26Å; F236-R239 PolarHBondContact O-N 3.41Å; F236-V240 HydrophobicContact CD1-CG2 4.38Å; F236-V240 HydrophobicContact CD2-CG2 4.06Å; F236-V240 HydrophobicContact CE1-CG2 3.99Å; F236-V240 HydrophobicContact CE2-CG2 3.56Å; F236-V240 HydrophobicContact CG-CG2 4.44Å; F236-V240 HydrophobicContact CZ-CG2 3.57Å; F236-V240 PolarHBondContact O-N 3.28Å; F236-W288 HydrophobicContact CZ-CH2 4.46Å; F236-T291 HydrophobicContact CD2-CG2 4.38Å; F236-T291 HydrophobicContact CE2-CG2 4.01Å; F236-I295 HydrophobicContact CD2-CD1 3.24Å; F236-I295 HydrophobicContact CD2-CG1 3.73Å; F236-I295 HydrophobicContact CE2-CD1 3.02Å; F236-I295 HydrophobicContact CE2-CG1 4.04Å; F236-I295 HydrophobicContact CG-CD1 4.26Å; F236-I295 HydrophobicContact CG-CG1 4.49Å; F236-I295 HydrophobicContact CZ-CD1 3.86Å
237L94.9Very high94.3Very high35 Ų3550.9 Ų50.918%0.18330%0.3CS..Hα-helixtrans-58.4-42-173.6-177.564.6000113.3V222 L228 V233 R239 V240 I241V222-L237 HydrophobicContact CG2-CD1 4.13Å; V222-L237 HydrophobicContact CG2-CD2 4.07Å; L228-L237 HydrophobicContact CD2-CD2 3.32Å; V233-L237 HydrophobicContact CG1-CB 4.1Å; V233-L237 HydrophobicContact CG1-CD2 4.11Å; V233-L237 WeakPolarHBondContact O-CB 3.36Å; V233-L237 PolarHBondContact O-N 3.47Å; L237-R239 PolarHBondContact O-N 2.85Å; L237-V240 WeakPolarHBondContact O-CB 3.5Å; L237-V240 PolarHBondContact O-N 3.08Å; L237-V240 VanDerWaalsContact O-N 3.12Å; L237-I241 HydrophobicContact CD1-CD1 4.49Å; L237-I241 HydrophobicContact CD1-CG1 4.44Å; L237-I241 HydrophobicContact CD2-CD1 4.48Å; L237-I241 HydrophobicContact CG-CD1 3.96Å; L237-I241 HydrophobicContact CG-CG1 4.36Å; L237-I241 WeakPolarHBondContact O-CG1 3.47Å; L237-I241 PolarHBondContact O-N 3.06Å
238P96.1Very high94.6Very high63 Ų6351.8 Ų51.841%0.40931%0.31SS..Hα-helixtrans-58.9-33.7176.2-26.937.3000113.3Q234 I241 V242Q234-P238 VanDerWaalsContact O-CD 3.23Å; Q234-P238 WeakPolarHBondContact O-CD 3.1Å; Q234-P238 VanDerWaalsContact O-CG 3.23Å; Q234-P238 WeakPolarHBondContact O-CG 3.2Å; P238-I241 PolarHBondContact O-N 3.06Å; P238-V242 VanDerWaalsContact O-CG2 3.28Å; P238-V242 WeakPolarHBondContact O-CG2 3.33Å; P238-V242 PolarHBondContact O-N 3.05Å
239R96.3Very high94.8Very high53 Ų5348.1 Ų48.120%0.230%0.296CS..Hα-helixtrans-69.2-37.7177.7-62.4178.5169.6-89.62112F236 L237 V242 M243 W287 T291 Y294F236-R239 WeakPolarHBondContact O-CB 3.26Å; F236-R239 PolarHBondContact O-N 3.41Å; L237-R239 PolarHBondContact O-N 2.85Å; R239-V242 PolarHBondContact O-N 2.93Å; R239-M243 PolarHBondContact O-N 3.01Å; R239-M243 VanDerWaalsContact O-N 3.08Å; R239-W287 HydrophobicContact CB-CZ2 4.26Å; R239-W287 HydrophobicContact CG-CZ2 4.19Å; R239-W287 PolarHBondContact O-NE1 2.92Å; R239-T291 HydrophobicContact CB-CG2 3.73Å; R239-T291 HydrophobicContact CG-CG2 4.43Å; R239-Y294 VanDerWaalsContact NH2-CD2 3.34Å
240V96.6Very high95.1Very high12 Ų1245.2 Ų45.27%0.07327%0.265CS..Hα-helixtrans-64.9-44.8172.2-177.80000110.6F236 L237 V242 M243 Y244 W288F236-V240 HydrophobicContact CD1-CG2 4.38Å; F236-V240 HydrophobicContact CD2-CG2 4.06Å; F236-V240 HydrophobicContact CE1-CG2 3.99Å; F236-V240 HydrophobicContact CE2-CG2 3.56Å; F236-V240 HydrophobicContact CG-CG2 4.44Å; F236-V240 HydrophobicContact CZ-CG2 3.57Å; F236-V240 PolarHBondContact O-N 3.28Å; L237-V240 WeakPolarHBondContact O-CB 3.5Å; L237-V240 PolarHBondContact O-N 3.08Å; L237-V240 VanDerWaalsContact O-N 3.12Å; V240-V242 PolarHBondContact O-N 3.33Å; V240-M243 WeakPolarHBondContact O-CB 3.38Å; V240-M243 PolarHBondContact O-N 2.9Å; V240-Y244 HydrophobicContact CG1-CD2 3.88Å; V240-Y244 HydrophobicContact CG1-CE2 3.84Å; V240-Y244 WeakPolarHBondContact O-CD2 3.34Å; V240-Y244 PolarHBondContact O-N 2.9Å; V240-W288 HydrophobicContact CG2-CH2 4.04Å; V240-W288 HydrophobicContact CG2-CZ3 4.12Å
241I97.7Very high95.4Very high87 Ų8746.8 Ų46.845%0.44627%0.269SS..Hα-helixtrans-58.8-47.6176-68.6168.5000110.5L237 P238 M243 Y244 L245L237-I241 HydrophobicContact CD1-CD1 4.49Å; L237-I241 HydrophobicContact CD1-CG1 4.44Å; L237-I241 HydrophobicContact CD2-CD1 4.48Å; L237-I241 HydrophobicContact CG-CD1 3.96Å; L237-I241 HydrophobicContact CG-CG1 4.36Å; L237-I241 WeakPolarHBondContact O-CG1 3.47Å; L237-I241 PolarHBondContact O-N 3.06Å; P238-I241 PolarHBondContact O-N 3.06Å; I241-M243 VanDerWaalsContact C-N 3.3Å; I241-M243 PolarHBondContact O-N 3.02Å; I241-Y244 PolarHBondContact O-N 3.5Å; I241-Y244 VanDerWaalsContact O-N 3.12Å; I241-L245 HydrophobicContact CG2-CD1 3.93Å; I241-L245 HydrophobicContact CG2-CG 4.18Å; I241-L245 WeakPolarHBondContact O-CG 3.46Å; I241-L245 PolarHBondContact O-N 2.74Å
242V98.2Very high95.8Very high50 Ų5048 Ų4830%0.30326%0.264SS..Hα-helixtrans-59-41.6177.6171.10000111.3P238 R239 V240 Y244 L245 I246 W287P238-V242 VanDerWaalsContact O-CG2 3.28Å; P238-V242 WeakPolarHBondContact O-CG2 3.33Å; P238-V242 PolarHBondContact O-N 3.05Å; R239-V242 PolarHBondContact O-N 2.93Å; V240-V242 PolarHBondContact O-N 3.33Å; V242-Y244 PolarHBondContact O-N 3.49Å; V242-L245 PolarHBondContact O-N 3.02Å; V242-I246 HydrophobicContact CG1-CD1 3.86Å; V242-I246 HydrophobicContact CG1-CG1 4.41Å; V242-I246 VanDerWaalsContact O-CG1 3.28Å; V242-I246 WeakPolarHBondContact O-CG1 3.41Å; V242-I246 PolarHBondContact O-N 3.46Å; V242-W287 HydrophobicContact CB-CZ2 3.74Å; V242-W287 HydrophobicContact CG1-CD2 3.95Å; V242-W287 VanDerWaalsContact CG1-CE2 3.43Å; V242-W287 HydrophobicContact CG1-CG 4.4Å; V242-W287 HydrophobicContact CG1-CH2 4.22Å; V242-W287 HydrophobicContact CG1-CZ2 3.59Å; V242-W287 HydrophobicContact CG2-CZ2 4.14Å
243M97.2Very high96.2Very high19 Ų1950.4 Ų50.49%0.09427%0.273CS..Hα-helixtrans-57.6-48.5174.4-176.6-169.164.100111.4R239 V240 I241 L245 I246 A247 L284 W288R239-M243 PolarHBondContact O-N 3.01Å; R239-M243 VanDerWaalsContact O-N 3.08Å; V240-M243 WeakPolarHBondContact O-CB 3.38Å; V240-M243 PolarHBondContact O-N 2.9Å; I241-M243 VanDerWaalsContact C-N 3.3Å; I241-M243 PolarHBondContact O-N 3.02Å; M243-L245 VanDerWaalsContact C-N 3.34Å; M243-L245 PolarHBondContact O-N 2.86Å; M243-I246 PolarHBondContact O-N 2.92Å; M243-A247 WeakPolarHBondContact O-CB 3.24Å; M243-A247 PolarHBondContact O-N 3.49Å; M243-L284 HydrophobicContact CG-CD1 4.25Å; M243-L284 HydrophobicContact CG-CD2 4.22Å; M243-L284 HydrophobicContact CG-CG 3.98Å; M243-W288 HydrophobicContact CB-CE3 3.95Å; M243-W288 HydrophobicContact CB-CZ3 4.1Å; M243-W288 HydrophobicContact CE-CE3 4.13Å; M243-W288 HydrophobicContact CE-CH2 3.87Å; M243-W288 HydrophobicContact CE-CZ2 4.29Å; M243-W288 HydrophobicContact CE-CZ3 3.79Å; M243-W288 HydrophobicContact CG-CD2 4.49Å; M243-W288 HydrophobicContact CG-CE3 3.94Å; M243-W288 HydrophobicContact CG-CZ3 4.36Å; M243-W288 HydrophobicContact SD-CB 4.38Å; M243-W288 HydrophobicContact SD-CD2 3.35Å; M243-W288 HydrophobicContact SD-CE3 3.16Å; M243-W288 HydrophobicContact SD-CG 3.92Å; M243-W288 HydrophobicContact SD-CH2 3.93Å; M243-W288 HydrophobicContact SD-CZ2 4.1Å; M243-W288 HydrophobicContact SD-CZ3 3.49Å; M243-W288 WeakPolarHBondContact SD-CZ3 3.22Å
244Y97.9Very high96.3Very high64 Ų6452.6 Ų52.625%0.25128%0.281SS..Hα-helixtrans-67.5-31.6179-83.6-71.9000113.2A211 G214 I215 V240 I241 V242 A247 G248A211-Y244 PolarHBondContact O-OH 3.26Å; G214-Y244 VanDerWaalsContact C-OH 3.31Å; G214-Y244 VanDerWaalsContact CA-OH 3.25Å; G214-Y244 WeakPolarHBondContact CA-OH 3.31Å; I215-Y244 HydrophobicContact CG1-CE1 4.4Å; I215-Y244 PolarHBondContact N-OH 3.1Å; V240-Y244 HydrophobicContact CG1-CD2 3.88Å; V240-Y244 HydrophobicContact CG1-CE2 3.84Å; V240-Y244 WeakPolarHBondContact O-CD2 3.34Å; V240-Y244 PolarHBondContact O-N 2.9Å; I241-Y244 PolarHBondContact O-N 3.5Å; I241-Y244 VanDerWaalsContact O-N 3.12Å; V242-Y244 PolarHBondContact O-N 3.49Å; Y244-A247 PolarHBondContact O-N 3.36Å; Y244-G248 PolarHBondContact O-N 3.25Å
245L98.5Very high96.4Very high117 Ų11750.7 Ų50.761%0.61327%0.274SS*.Hα-helixtrans-65.7-43.9172.7-71.8175.1000111.4I241 V242 M243 A247 G248 A249I241-L245 HydrophobicContact CG2-CD1 3.93Å; I241-L245 HydrophobicContact CG2-CG 4.18Å; I241-L245 WeakPolarHBondContact O-CG 3.46Å; I241-L245 PolarHBondContact O-N 2.74Å; V242-L245 PolarHBondContact O-N 3.02Å; M243-L245 VanDerWaalsContact C-N 3.34Å; M243-L245 PolarHBondContact O-N 2.86Å; L245-A247 VanDerWaalsContact C-N 3.34Å; L245-G248 PolarHBondContact O-N 3.44Å; L245-A249 VanDerWaalsContact O-CB 3.31Å; L245-A249 WeakPolarHBondContact O-CB 3.41Å; L245-A249 PolarHBondContact O-N 3.3Å
246I98.5Very high96.7Very high16 Ų1649.3 Ų49.38%0.08227%0.269CS..Hα-helixtrans-62.5-44.8174.5-61.6159.6000109.8V242 M243 G248 A249 A250 L280 F283 L284 W287V242-I246 HydrophobicContact CG1-CD1 3.86Å; V242-I246 HydrophobicContact CG1-CG1 4.41Å; V242-I246 VanDerWaalsContact O-CG1 3.28Å; V242-I246 WeakPolarHBondContact O-CG1 3.41Å; V242-I246 PolarHBondContact O-N 3.46Å; M243-I246 PolarHBondContact O-N 2.92Å; I246-G248 PolarHBondContact O-N 2.89Å; I246-A249 PolarHBondContact O-N 3.26Å; I246-A250 WeakPolarHBondContact O-CB 3.4Å; I246-A250 PolarHBondContact O-N 3.12Å; I246-L280 HydrophobicContact CG2-CB 4.36Å; I246-L280 HydrophobicContact CG2-CD2 4.4Å; I246-L280 WeakPolarHBondContact CG2-O 3.48Å; I246-F283 HydrophobicContact CD1-CD1 3.62Å; I246-F283 HydrophobicContact CD1-CE1 3.5Å; I246-F283 VanDerWaalsContact CD1-CE1 3.5Å; I246-F283 HydrophobicContact CG1-CD1 4.06Å; I246-F283 HydrophobicContact CG1-CE1 4.07Å; I246-F283 HydrophobicContact CG2-CD1 4.12Å; I246-L284 HydrophobicContact CB-CB 4.46Å; I246-L284 HydrophobicContact CB-CD1 4.44Å; I246-L284 HydrophobicContact CG2-CB 3.75Å; I246-L284 HydrophobicContact CG2-CD1 4.31Å; I246-L284 HydrophobicContact CG2-CG 4.45Å; I246-W287 HydrophobicContact CD1-CB 4.15Å; I246-W287 HydrophobicContact CD1-CG 4.11Å
247A98Very high97Very high34 Ų3449.7 Ų49.728%0.28127%0.27SS..Hα-helixtrans-60.2-47.2178.300000111.8M243 Y244 L245 A250 F251 L284M243-A247 WeakPolarHBondContact O-CB 3.24Å; M243-A247 PolarHBondContact O-N 3.49Å; Y244-A247 PolarHBondContact O-N 3.36Å; L245-A247 VanDerWaalsContact C-N 3.34Å; A247-A250 PolarHBondContact O-N 2.85Å; A247-F251 WeakPolarHBondContact O-CB 3.49Å; A247-F251 PolarHBondContact O-N 3.13Å; A247-L284 HydrophobicContact CB-CD1 3.54Å
248G98Very high97.1Very high40 Ų4051.7 Ų51.741%0.41228%0.28SS..Hα-helixtrans-63.9-42.1178.200000112.3Y244 L245 I246 F251 L252Y244-G248 PolarHBondContact O-N 3.25Å; L245-G248 PolarHBondContact O-N 3.44Å; I246-G248 PolarHBondContact O-N 2.89Å; G248-F251 PolarHBondContact O-N 2.93Å; G248-L252 WeakPolarHBondContact O-CB 3.06Å; G248-L252 PolarHBondContact O-N 3.48Å
249A98.4Very high97.1Very high38 Ų3850.4 Ų50.431%0.31427%0.272SS..Hα-helixtrans-62.3-47.5174.900000111.5L245 I246 F251 L252 F253 L280L245-A249 VanDerWaalsContact O-CB 3.31Å; L245-A249 WeakPolarHBondContact O-CB 3.41Å; L245-A249 PolarHBondContact O-N 3.3Å; I246-A249 PolarHBondContact O-N 3.26Å; A249-F251 VanDerWaalsContact C-N 3.32Å; A249-F251 PolarHBondContact O-N 3.04Å; A249-L252 WeakPolarHBondContact O-CB 3.26Å; A249-L252 PolarHBondContact O-N 3.35Å; A249-F253 WeakPolarHBondContact O-CD2 3.44Å; A249-F253 PolarHBondContact O-N 3.28Å; A249-F253 VanDerWaalsContact O-N 3.13Å; A249-L280 HydrophobicContact CB-CD1 4.43Å
250A97.6Very high97.2Very high2 Ų247.9 Ų47.92%0.01726%0.262CS..Hα-helixtrans-55.1-52.6175.400000110I246 A247 L252 F253 Y254 W277 L280I246-A250 WeakPolarHBondContact O-CB 3.4Å; I246-A250 PolarHBondContact O-N 3.12Å; A247-A250 PolarHBondContact O-N 2.85Å; A250-L252 VanDerWaalsContact C-N 3.28Å; A250-L252 PolarHBondContact O-N 2.87Å; A250-F253 WeakPolarHBondContact O-CB 3.42Å; A250-F253 PolarHBondContact O-N 2.89Å; A250-F253 VanDerWaalsContact O-N 3.12Å; A250-Y254 PolarHBondContact O-N 2.92Å; A250-W277 HydrophobicContact CB-CD2 4.4Å; A250-W277 HydrophobicContact CB-CE3 3.55Å; A250-W277 HydrophobicContact CB-CZ3 3.8Å; A250-W277 VanDerWaalsContact O-CE3 3.31Å; A250-L280 HydrophobicContact CB-CB 3.7Å; A250-L280 HydrophobicContact CB-CD1 3.99Å
251F96.4Very high97.2Very high61 Ų6154 Ų5427%0.26828%0.284SS..Hα-helixtrans-59.1-40.1-178.3-174.8-113.9000112.4T204 C208 A247 G248 A249 F253 Y254 I255 W277T204-F251 HydrophobicContact CG2-CE2 3.44Å; T204-F251 VanDerWaalsContact CG2-CE2 3.44Å; T204-F251 HydrophobicContact CG2-CZ 3.4Å; C208-F251 VanDerWaalsContact SG-CZ 3.6Å; A247-F251 WeakPolarHBondContact O-CB 3.49Å; A247-F251 PolarHBondContact O-N 3.13Å; G248-F251 PolarHBondContact O-N 2.93Å; A249-F251 VanDerWaalsContact C-N 3.32Å; A249-F251 PolarHBondContact O-N 3.04Å; F251-F253 PolarHBondContact O-N 3.36Å; F251-Y254 HydrophobicContact CD2-CD1 4.43Å; F251-Y254 HydrophobicContact CE2-CD1 4.38Å; F251-Y254 WeakPolarHBondContact O-CB 3.3Å; F251-Y254 PolarHBondContact O-N 2.97Å; F251-I255 HydrophobicContact CD1-CD1 4.3Å; F251-I255 HydrophobicContact CD1-CG2 4.36Å; F251-I255 HydrophobicContact CD2-CG2 4.07Å; F251-I255 HydrophobicContact CE1-CD1 3.98Å; F251-I255 HydrophobicContact CE1-CG2 3.88Å; F251-I255 HydrophobicContact CE2-CG2 3.53Å; F251-I255 HydrophobicContact CG-CG2 4.45Å; F251-I255 HydrophobicContact CZ-CG2 3.44Å; F251-I255 VanDerWaalsContact CZ-CG2 3.44Å; F251-I255 WeakPolarHBondContact O-CG1 3.39Å; F251-I255 PolarHBondContact O-N 3.44Å; F251-W277 HydrophobicContact CB-CZ3 4.12Å; F251-W277 HydrophobicContact CD2-CZ3 4.39Å
252L97.3Very high97.2Very high106 Ų10653.4 Ų53.456%0.55529%0.287SS*.Hα-helixtrans-59.5-45.6176-177.462.5000112G248 A249 A250 S256G248-L252 WeakPolarHBondContact O-CB 3.06Å; G248-L252 PolarHBondContact O-N 3.48Å; A249-L252 WeakPolarHBondContact O-CB 3.26Å; A249-L252 PolarHBondContact O-N 3.35Å; A250-L252 VanDerWaalsContact C-N 3.28Å; A250-L252 PolarHBondContact O-N 2.87Å; L252-S256 WeakPolarHBondContact O-CB 3.46Å; L252-S256 PolarHBondContact O-N 2.88Å; L252-S256 PolarHBondContact O-OG 2.81Å
253F97.2Very high97Very high71 Ų7153.7 Ų53.731%0.31128%0.284SS..Hα-helixtrans-61-46.3173.5-75.2-68.3000111.2A249 A250 F251 I255 K257 I258 S273 V276 L280A249-F253 WeakPolarHBondContact O-CD2 3.44Å; A249-F253 PolarHBondContact O-N 3.28Å; A249-F253 VanDerWaalsContact O-N 3.13Å; A250-F253 WeakPolarHBondContact O-CB 3.42Å; A250-F253 PolarHBondContact O-N 2.89Å; A250-F253 VanDerWaalsContact O-N 3.12Å; F251-F253 PolarHBondContact O-N 3.36Å; F253-I255 PolarHBondContact O-N 3.4Å; F253-K257 PolarHBondContact O-N 3.21Å; F253-K257 VanDerWaalsContact O-N 3.17Å; F253-I258 WeakPolarHBondContact CD1-O 3.48Å; F253-S273 WeakPolarHBondContact O-CB 3.46Å; F253-S273 PolarHBondContact O-OG 3.3Å; F253-V276 HydrophobicContact CB-CG1 4.42Å; F253-V276 HydrophobicContact CD1-CG1 4.23Å; F253-V276 HydrophobicContact CD2-CG1 3.61Å; F253-V276 HydrophobicContact CE1-CG1 4.43Å; F253-V276 HydrophobicContact CE2-CG1 3.84Å; F253-V276 HydrophobicContact CG-CB 4.37Å; F253-V276 HydrophobicContact CG-CG1 3.84Å; F253-V276 HydrophobicContact CZ-CG1 4.25Å; F253-L280 HydrophobicContact CD2-CD1 3.78Å; F253-L280 HydrophobicContact CE2-CD1 4.08Å
254Y94.6Very high97Very high46 Ų4656.1 Ų56.118%0.1830%0.302CS..Hα-helixtrans-59.2-44-179173.7-98000113A250 F251 K257 H274 W277A250-Y254 PolarHBondContact O-N 2.92Å; F251-Y254 HydrophobicContact CD2-CD1 4.43Å; F251-Y254 HydrophobicContact CE2-CD1 4.38Å; F251-Y254 WeakPolarHBondContact O-CB 3.3Å; F251-Y254 PolarHBondContact O-N 2.97Å; Y254-K257 WeakPolarHBondContact O-CD 3.41Å; Y254-K257 WeakPolarHBondContact O-CE 3.47Å; Y254-K257 PolarHBondContact O-NZ 2.96Å; Y254-H274 AromaticContact CD2-ND1 3.7Å; Y254-H274 AromaticContact CE2-ND1 3.79Å; Y254-W277 HydrophobicContact CG-CD2 4.48Å; Y254-W277 HydrophobicContact CG-CE3 4.33Å
255I95.2Very high96.8Very high81 Ų8154.2 Ų54.242%0.41530%0.302SS..Hα-helixtrans-80.2-39.7-178.467.7177.6000112.9F251 F253 K257F251-I255 HydrophobicContact CD1-CD1 4.3Å; F251-I255 HydrophobicContact CD1-CG2 4.36Å; F251-I255 HydrophobicContact CD2-CG2 4.07Å; F251-I255 HydrophobicContact CE1-CD1 3.98Å; F251-I255 HydrophobicContact CE1-CG2 3.88Å; F251-I255 HydrophobicContact CE2-CG2 3.53Å; F251-I255 HydrophobicContact CG-CG2 4.45Å; F251-I255 HydrophobicContact CZ-CG2 3.44Å; F251-I255 VanDerWaalsContact CZ-CG2 3.44Å; F251-I255 WeakPolarHBondContact O-CG1 3.39Å; F251-I255 PolarHBondContact O-N 3.44Å; F253-I255 PolarHBondContact O-N 3.4Å; I255-K257 VanDerWaalsContact C-N 3.34Å; I255-K257 PolarHBondContact O-N 3.02Å
256S96.1Very high96.6Very high22 Ų2253.8 Ų53.815%0.15430%0.297CS..Hα-helixtrans-75.2-25.9-172.464.30000112.9L252 I258 R261L252-S256 WeakPolarHBondContact O-CB 3.46Å; L252-S256 PolarHBondContact O-N 2.88Å; L252-S256 PolarHBondContact O-OG 2.81Å; S256-I258 PolarHBondContact O-N 2.99Å; S256-I258 PolarHBondContact OG-N 2.98Å; S256-R261 WeakPolarHBondContact O-CD 3.37Å
257K96.7Very high96.5Very high26 Ų2653.9 Ų53.911%0.11330%0.297CS..  trans58.724.2-171.3-53-54.9-174.1-168.20112.9Y45 F253 Y254 I255 E260 R261 S273Y45-K257 HydrophobicContact CD2-CB 4.12Å; Y45-K257 HydrophobicContact CE2-CB 4.23Å; F253-K257 PolarHBondContact O-N 3.21Å; F253-K257 VanDerWaalsContact O-N 3.17Å; Y254-K257 WeakPolarHBondContact O-CD 3.41Å; Y254-K257 WeakPolarHBondContact O-CE 3.47Å; Y254-K257 PolarHBondContact O-NZ 2.96Å; I255-K257 VanDerWaalsContact C-N 3.34Å; I255-K257 PolarHBondContact O-N 3.02Å; K257-E260 WeakPolarHBondContact O-CG 3.12Å; K257-E260 PolarHBondContact O-N 2.97Å; K257-E260 VanDerWaalsContact O-OE2 3.1Å; K257-R261 HydrophobicContact CB-CB 4.35Å; K257-R261 WeakPolarHBondContact O-CB 3.38Å; K257-R261 PolarHBondContact O-N 3.05Å; K257-S273 WeakPolarHBondContact CA-OG 3.4Å
258I96.4Very high96.3Very high77 Ų7752.8 Ų52.840%0.39529%0.286SS..THydrogen-bonded Turntrans-85.3134.8171.2-65175.5000106.9F253 S256 S273F253-I258 WeakPolarHBondContact CD1-O 3.48Å; S256-I258 PolarHBondContact O-N 2.99Å; S256-I258 PolarHBondContact OG-N 2.98Å; I258-S273 WeakPolarHBondContact O-CB 3.32Å
259P96.9Very high96.1Very high36 Ų3653.6 Ų53.623%0.23428%0.277CS..THydrogen-bonded Turncis-96.2-8.714.421.2-6.9000116R261 C262 F263 L267 G271P259-R261 PolarHBondContact O-N 2.83Å; P259-C262 WeakPolarHBondContact O-CB 3.47Å; P259-C262 PolarHBondContact O-N 3.1Å; P259-F263 HydrophobicContact CB-CD2 4.27Å; P259-F263 WeakPolarHBondContact O-CD2 3.36Å; P259-F263 PolarHBondContact O-N 3.46Å; P259-F263 VanDerWaalsContact O-N 3.1Å; P259-L267 HydrophobicContact CB-CD1 3.67Å; P259-L267 HydrophobicContact CG-CD1 3.61Å; P259-G271 VanDerWaalsContact CD-O 3.25Å; P259-G271 WeakPolarHBondContact CD-O 3.19Å; P259-G271 WeakPolarHBondContact CG-O 3.25Å
260E97.4Very high96Very high0 Ų055.5 Ų55.50%028%0.282CS..THydrogen-bonded Turntrans-61.5-29.9-175.669.4-85.6-15800113N43 Y45 I46 K257 C262 F263 P264 L267 S273N43-E260 PolarHBondContact ND2-OE1 3.4Å; Y45-E260 WeakPolarHBondContact CB-O 3.45Å; Y45-E260 HydrophobicContact CD2-CG 4.47Å; I46-E260 HydrophobicContact CD1-CB 3.95Å; I46-E260 HydrophobicContact CD1-CG 4.07Å; K257-E260 WeakPolarHBondContact O-CG 3.12Å; K257-E260 PolarHBondContact O-N 2.97Å; K257-E260 VanDerWaalsContact O-OE2 3.1Å; E260-C262 VanDerWaalsContact C-N 3.27Å; E260-C262 PolarHBondContact O-N 3.48Å; E260-F263 CarbonylContact O-C 3.37Å; E260-F263 PolarHBondContact O-N 3.02Å; E260-P264 WeakPolarHBondContact O-CA 3.48Å; E260-L267 HydrophobicContact CB-CB 4.2Å; E260-L267 HydrophobicContact CB-CD1 4.41Å; E260-S273 WeakPolarHBondContact OE1-CB 3.19Å; E260-S273 PolarHBondContact OE1-OG 3.13Å; E260-S273 VanDerWaalsContact OE2-CB 3.27Å; E260-S273 WeakPolarHBondContact OE2-CB 3.29Å; E260-S273 PolarHBondContact OE2-N 3.44Å
261R97Very high95.8Very high140 Ų14056.6 Ų56.653%0.52829%0.294SS..THydrogen-bonded Turntrans-60.4-35.3171.8178.5169.4-171.5174.71.1113.2Y45 S256 K257 P259Y45-R261 HydrophobicContact CD2-CB 3.84Å; Y45-R261 HydrophobicContact CD2-CG 4.33Å; Y45-R261 HydrophobicContact CE1-CB 4.39Å; Y45-R261 HydrophobicContact CE1-CG 4.01Å; Y45-R261 HydrophobicContact CE2-CB 3.74Å; Y45-R261 HydrophobicContact CE2-CG 3.76Å; Y45-R261 HydrophobicContact CG-CB 4.25Å; Y45-R261 PolarHBondContact OH-NE 3.25Å; S256-R261 WeakPolarHBondContact O-CD 3.37Å; K257-R261 HydrophobicContact CB-CB 4.35Å; K257-R261 WeakPolarHBondContact O-CB 3.38Å; K257-R261 PolarHBondContact O-N 3.05Å; P259-R261 PolarHBondContact O-N 2.83Å
262C96.8Very high95.9Very high76 Ų7654 Ų5451%0.51428%0.284SS..THydrogen-bonded Turntrans-84.4-23.8178.7-610000112.1P259 E260P259-C262 WeakPolarHBondContact O-CB 3.47Å; P259-C262 PolarHBondContact O-N 3.1Å; E260-C262 VanDerWaalsContact C-N 3.27Å; E260-C262 PolarHBondContact O-N 3.48Å
263F95.4Very high95.9Very high55 Ų5549 Ų4924%0.24126%0.257CS..SBendtrans-132.365.9-179.1-52.5-77.5000111.8L6 P259 E260 G265 Q266 L267L6-F263 HydrophobicContact CD2-CE1 4.01Å; L6-F263 HydrophobicContact CD2-CE2 4.05Å; L6-F263 HydrophobicContact CD2-CZ 3.58Å; P259-F263 HydrophobicContact CB-CD2 4.27Å; P259-F263 WeakPolarHBondContact O-CD2 3.36Å; P259-F263 PolarHBondContact O-N 3.46Å; P259-F263 VanDerWaalsContact O-N 3.1Å; E260-F263 CarbonylContact O-C 3.37Å; E260-F263 PolarHBondContact O-N 3.02Å; F263-G265 PolarHBondContact O-N 3.48Å; F263-Q266 HydrophobicContact CB-CB 4.08Å; F263-Q266 HydrophobicContact CB-CG 4.34Å; F263-Q266 PolarHBondContact O-N 3.26Å; F263-Q266 VanDerWaalsContact O-N 3.16Å; F263-L267 HydrophobicContact CB-CD1 4.44Å
264P96.2Very high95.9Very high70 Ų7047.5 Ų47.546%0.45525%0.251SS..THydrogen-bonded Turntrans-58135.8-176.2-24.134.9000111.8Y45 E260 Q266Y45-P264 HydrophobicContact CD1-CB 4.41Å; Y45-P264 HydrophobicContact CD1-CG 4.01Å; Y45-P264 WeakPolarHBondContact O-CA 3.37Å; E260-P264 WeakPolarHBondContact O-CA 3.48Å; P264-Q266 PolarHBondContact O-N 2.88Å; P264-Q266 VanDerWaalsContact O-N 3.14Å
265G93.4Very high96.1Very high25 Ų2545.6 Ų45.626%0.25824%0.244SC..THydrogen-bonded Turntrans75.2-13.9-179.500000116.2Y45 T47 F263 N268Y45-G265 PolarHBondContact O-N 3.42Å; T47-G265 WeakPolarHBondContact OG1-CA 3.17Å; F263-G265 PolarHBondContact O-N 3.48Å; G265-N268 WeakPolarHBondContact CA-OD1 3.47Å; G265-N268 PolarHBondContact O-ND2 3.49Å; G265-N268 VanDerWaalsContact O-ND2 3.16Å
266Q94.6Very high96.3Very high108 Ų10843.6 Ų43.651%0.50524%0.235SC..THydrogen-bonded Turntrans-84-24.4179.6-59.3-176.13200112.5L10 F263 P264L10-Q266 HydrophobicContact CD2-CB 4.48Å; F263-Q266 HydrophobicContact CB-CB 4.08Å; F263-Q266 HydrophobicContact CB-CG 4.34Å; F263-Q266 PolarHBondContact O-N 3.26Å; F263-Q266 VanDerWaalsContact O-N 3.16Å; P264-Q266 PolarHBondContact O-N 2.88Å; P264-Q266 VanDerWaalsContact O-N 3.14Å
267L96.1Very high96.4Very high17 Ų1745.1 Ų45.19%0.08924%0.238CC..THydrogen-bonded Turntrans-111.532.5-176-59.6173.9000111.9L10 I46 P259 E260 F263 Y269 L270L10-L267 HydrophobicContact CD2-CD2 4.1Å; I46-L267 WeakPolarHBondContact CD1-O 3.3Å; P259-L267 HydrophobicContact CB-CD1 3.67Å; P259-L267 HydrophobicContact CG-CD1 3.61Å; E260-L267 HydrophobicContact CB-CB 4.2Å; E260-L267 HydrophobicContact CB-CD1 4.41Å; F263-L267 HydrophobicContact CB-CD1 4.44Å; L267-Y269 VanDerWaalsContact C-N 3.32Å; L267-Y269 PolarHBondContact O-N 3.28Å; L267-L270 VanDerWaalsContact CD2-O 3.31Å; L267-L270 WeakPolarHBondContact CD2-O 3.06Å
268N94.3Very high96.5Very high11 Ų1144 Ų446%0.05923%0.233CC..SBendtrans-62.7-38.3-177.7-74.9-14.7000112.6I46 T47 D48 N68 G265I46-N268 WeakPolarHBondContact CA-OD1 3.43Å; I46-N268 HydrophobicContact CG2-CB 4.49Å; T47-N268 PolarHBondContact N-OD1 2.88Å; T47-N268 PolarHBondContact OG1-ND2 2.98Å; T47-N268 VanDerWaalsContact OG1-ND2 3.11Å; D48-N268 WeakPolarHBondContact CB-ND2 3.45Å; D48-N268 PolarHBondContact N-ND2 3.45Å; D48-N268 VanDerWaalsContact N-ND2 3.17Å; N68-N268 WeakPolarHBondContact CA-O 3.31Å; N68-N268 WeakPolarHBondContact CB-O 3.46Å; G265-N268 WeakPolarHBondContact CA-OD1 3.47Å; G265-N268 PolarHBondContact O-ND2 3.49Å; G265-N268 VanDerWaalsContact O-ND2 3.16Å
269Y94.6Very high96.6Very high57 Ų5743.9 Ų43.922%0.22424%0.236CC..SBendtrans-107.5-29.2-172.7-60.7-84.7000113.6L30 D48 G49 L66 V71 L267 Q275L30-Y269 HydrophobicContact CD1-CE1 4.44Å; D48-Y269 PolarHBondContact OD2-OH 3.27Å; G49-Y269 VanDerWaalsContact CA-OH 3.27Å; G49-Y269 WeakPolarHBondContact CA-OH 3.34Å; L66-Y269 HydrophobicContact CD1-CD1 4.31Å; L66-Y269 HydrophobicContact CD2-CD1 4.46Å; L66-Y269 HydrophobicContact CG-CD1 3.82Å; L66-Y269 HydrophobicContact CG-CE1 4.36Å; L66-Y269 HydrophobicContact CG-CG 4.44Å; V71-Y269 WeakPolarHBondContact CG2-O 3.29Å; L267-Y269 VanDerWaalsContact C-N 3.32Å; L267-Y269 PolarHBondContact O-N 3.28Å; Y269-Q275 PolarHBondContact O-NE2 3.42Å
270L96.4Very high96.6Very high78 Ų7844 Ų4441%0.40823%0.234SC..SBendtrans-147.3141.4-175-174.861.9000111.6Y13 V71 L267 Q275Y13-L270 HydrophobicContact CD1-CD2 3.51Å; Y13-L270 HydrophobicContact CE1-CD2 3.13Å; Y13-L270 HydrophobicContact CE1-CG 4.26Å; V71-L270 HydrophobicContact CG2-CD1 3.65Å; L267-L270 VanDerWaalsContact CD2-O 3.31Å; L267-L270 WeakPolarHBondContact CD2-O 3.06Å; L270-Q275 VanDerWaalsContact C-OE1 3.23Å
271G93.6Very high96.7Very high26 Ų2645.1 Ų45.127%0.26824%0.241SC..SBendtrans85.66.1175.700000115P259P259-G271 VanDerWaalsContact CD-O 3.25Å; P259-G271 WeakPolarHBondContact CD-O 3.19Å; P259-G271 WeakPolarHBondContact CG-O 3.25Å
272A97.3Very high96.8Very high6 Ų639.5 Ų39.55%0.0522%0.222CC..  trans-67.1150.6174.800000111.4I46 H274 Q275 V276I46-A272 HydrophobicContact CD1-CB 3.91Å; A272-H274 PolarHBondContact O-N 3.36Å; A272-Q275 HydrophobicContact CB-CG 4.17Å; A272-Q275 WeakPolarHBondContact O-CA 3.25Å; A272-Q275 VanDerWaalsContact O-CB 3.27Å; A272-Q275 WeakPolarHBondContact O-CB 3.28Å; A272-Q275 PolarHBondContact O-N 3.43Å; A272-V276 PolarHBondContact O-N 3Å; A272-V276 VanDerWaalsContact O-N 3.08Å
273S98.1Very high96.9Very high0 Ų040.6 Ų40.60%022%0.219CC..Hα-helixtrans-59.8-34.4-173.993.80000113.4F253 K257 I258 E260 Q275 V276 W277F253-S273 WeakPolarHBondContact O-CB 3.46Å; F253-S273 PolarHBondContact O-OG 3.3Å; K257-S273 WeakPolarHBondContact CA-OG 3.4Å; I258-S273 WeakPolarHBondContact O-CB 3.32Å; E260-S273 WeakPolarHBondContact OE1-CB 3.19Å; E260-S273 PolarHBondContact OE1-OG 3.13Å; E260-S273 VanDerWaalsContact OE2-CB 3.27Å; E260-S273 WeakPolarHBondContact OE2-CB 3.29Å; E260-S273 PolarHBondContact OE2-N 3.44Å; S273-Q275 VanDerWaalsContact C-N 3.32Å; S273-V276 PolarHBondContact O-N 3.03Å; S273-W277 PolarHBondContact O-N 2.86Å
274H97.7Very high97Very high41 Ų4139.1 Ų39.119%0.1921%0.213CC..Hα-helixtrans-66.1-37.4176.5-160.373.5000111.4H126 Y254 A272 W277 H278H126-H274 AromaticContact CE1-CD2 3.63Å; H126-H274 AromaticContact CE1-NE2 3.19Å; H126-H274 PolarHBondContact CE1-NE2 3.33Å; H126-H274 AromaticContact NE2-CD2 3.98Å; H126-H274 AromaticContact NE2-NE2 3.24Å; H126-H274 PolarHBondContact NE2-NE2 3.11Å; Y254-H274 AromaticContact CD2-ND1 3.7Å; Y254-H274 AromaticContact CE2-ND1 3.79Å; A272-H274 PolarHBondContact O-N 3.36Å; H274-W277 VanDerWaalsContact O-CB 3.3Å; H274-W277 WeakPolarHBondContact O-CB 3.46Å; H274-W277 PolarHBondContact O-N 3.01Å; H274-H278 AromaticContact CD2-CD2 3.5Å; H274-H278 PolarHBondContact CD2-CD2 2.7Å; H274-H278 VanDerWaalsContact CD2-CD2 3.5Å; H274-H278 AromaticContact CD2-NE2 3.19Å; H274-H278 PolarHBondContact CD2-NE2 3.02Å; H274-H278 AromaticContact CE1-NE2 3.95Å; H274-H278 AromaticContact NE2-CD2 3.66Å; H274-H278 AromaticContact NE2-CE1 3.92Å; H274-H278 AromaticContact NE2-NE2 2.92Å; H274-H278 PolarHBondContact NE2-NE2 3.37Å; H274-H278 PolarHBondContact O-CD2 3.09Å; H274-H278 PolarHBondContact O-N 2.88Å
275Q98.4Very high97.2Very high5 Ų536.1 Ų36.12%0.02319%0.193CC..Hα-helixtrans-66.2-42.2174.8-57.5176.5-11.200111.1N68 V71 N72 Y269 L270 A272 S273 W277 H278 V279N68-Q275 PolarHBondContact O-NE2 3.44Å; V71-Q275 HydrophobicContact CB-CB 4.14Å; V71-Q275 HydrophobicContact CB-CG 3.78Å; V71-Q275 HydrophobicContact CG1-CB 3.75Å; V71-Q275 HydrophobicContact CG1-CG 3.99Å; N72-Q275 WeakPolarHBondContact OD1-CA 3.45Å; N72-Q275 WeakPolarHBondContact OD1-CG 3.35Å; N72-Q275 PolarHBondContact OD1-N 3.39Å; Y269-Q275 PolarHBondContact O-NE2 3.42Å; L270-Q275 VanDerWaalsContact C-OE1 3.23Å; A272-Q275 HydrophobicContact CB-CG 4.17Å; A272-Q275 WeakPolarHBondContact O-CA 3.25Å; A272-Q275 VanDerWaalsContact O-CB 3.27Å; A272-Q275 WeakPolarHBondContact O-CB 3.28Å; A272-Q275 PolarHBondContact O-N 3.43Å; S273-Q275 VanDerWaalsContact C-N 3.32Å; Q275-W277 VanDerWaalsContact C-N 3.31Å; Q275-W277 PolarHBondContact O-N 2.97Å; Q275-H278 PolarHBondContact O-N 3.33Å; Q275-V279 WeakPolarHBondContact O-CG2 3.14Å; Q275-V279 PolarHBondContact O-N 3.15Å; Q275-V279 VanDerWaalsContact O-N 3.08Å
276V98.4Very high97.4Very high39 Ų3939 Ų3924%0.23620%0.197CC..Hα-helixtrans-62.1-40.6174.6178.80000110.8F253 A272 S273 H278 V279 L280F253-V276 HydrophobicContact CB-CG1 4.42Å; F253-V276 HydrophobicContact CD1-CG1 4.23Å; F253-V276 HydrophobicContact CD2-CG1 3.61Å; F253-V276 HydrophobicContact CE1-CG1 4.43Å; F253-V276 HydrophobicContact CE2-CG1 3.84Å; F253-V276 HydrophobicContact CG-CB 4.37Å; F253-V276 HydrophobicContact CG-CG1 3.84Å; F253-V276 HydrophobicContact CZ-CG1 4.25Å; A272-V276 PolarHBondContact O-N 3Å; A272-V276 VanDerWaalsContact O-N 3.08Å; S273-V276 PolarHBondContact O-N 3.03Å; V276-H278 PolarHBondContact O-N 3.33Å; V276-V279 PolarHBondContact O-N 2.91Å; V276-L280 HydrophobicContact CG1-CD1 3.85Å; V276-L280 HydrophobicContact CG1-CG 4.28Å; V276-L280 WeakPolarHBondContact O-CB 3.29Å; V276-L280 WeakPolarHBondContact O-CG 3.35Å; V276-L280 PolarHBondContact O-N 3.34Å
277W97.9Very high97.6Very high55 Ų5537 Ų3721%0.20818%0.184CC..Hα-helixtrans-54.4-51.4172.2161.5-88.1000111.4A250 F251 Y254 S273 H274 Q275 V279 L280 V281A250-W277 HydrophobicContact CB-CD2 4.4Å; A250-W277 HydrophobicContact CB-CE3 3.55Å; A250-W277 HydrophobicContact CB-CZ3 3.8Å; A250-W277 VanDerWaalsContact O-CE3 3.31Å; F251-W277 HydrophobicContact CB-CZ3 4.12Å; F251-W277 HydrophobicContact CD2-CZ3 4.39Å; Y254-W277 HydrophobicContact CG-CD2 4.48Å; Y254-W277 HydrophobicContact CG-CE3 4.33Å; S273-W277 PolarHBondContact O-N 2.86Å; H274-W277 VanDerWaalsContact O-CB 3.3Å; H274-W277 WeakPolarHBondContact O-CB 3.46Å; H274-W277 PolarHBondContact O-N 3.01Å; Q275-W277 VanDerWaalsContact C-N 3.31Å; Q275-W277 PolarHBondContact O-N 2.97Å; W277-V279 PolarHBondContact O-N 3.49Å; W277-L280 PolarHBondContact O-N 3.49Å; W277-V281 HydrophobicContact CD2-CG2 4.09Å; W277-V281 HydrophobicContact CG-CG2 4.48Å; W277-V281 HydrophobicContact CH2-CG2 4.47Å; W277-V281 HydrophobicContact CZ2-CG2 3.93Å; W277-V281 WeakPolarHBondContact O-CG2 3.32Å; W277-V281 PolarHBondContact O-N 2.89Å
278H98.6Very high97.7Very high1 Ų137 Ų371%0.00518%0.183CC..Hα-helixtrans-57.8-45.8178.2-76.4-78.8000112.8N72 T75 H76 S122 H126 H274 Q275 V276 L280 V281 V282N72-H278 PolarHBondContact OD1-CD2 3.23Å; N72-H278 VanDerWaalsContact OD1-CD2 3.3Å; T75-H278 VanDerWaalsContact OG1-CB 3.29Å; T75-H278 WeakPolarHBondContact OG1-CB 3.28Å; H76-H278 AromaticContact CD2-ND1 3.38Å; H76-H278 PolarHBondContact CD2-ND1 3.5Å; H76-H278 AromaticContact CE1-CE1 3.64Å; H76-H278 AromaticContact CE1-ND1 2.91Å; H76-H278 PolarHBondContact CE1-ND1 2.72Å; H76-H278 AromaticContact CG-ND1 3.52Å; H76-H278 AromaticContact ND1-CE1 3.7Å; H76-H278 AromaticContact ND1-ND1 3.18Å; H76-H278 PolarHBondContact ND1-ND1 2.82Å; H76-H278 VanDerWaalsContact ND1-ND1 3.18Å; H76-H278 AromaticContact NE2-CG 3.7Å; H76-H278 AromaticContact NE2-ND1 2.97Å; H76-H278 PolarHBondContact NE2-ND1 3.43Å; S122-H278 PolarHBondContact OG-CE1 3.14Å; H126-H278 AromaticContact CD2-CE1 3.54Å; H126-H278 AromaticContact CD2-NE2 3.6Å; H126-H278 AromaticContact CE1-NE2 3.75Å; H126-H278 AromaticContact NE2-CE1 3.32Å; H126-H278 PolarHBondContact NE2-CE1 3.01Å; H126-H278 VanDerWaalsContact NE2-CE1 3.32Å; H126-H278 AromaticContact NE2-NE2 3.07Å; H126-H278 PolarHBondContact NE2-NE2 3.38Å; H274-H278 AromaticContact CD2-CD2 3.5Å; H274-H278 PolarHBondContact CD2-CD2 2.7Å; H274-H278 VanDerWaalsContact CD2-CD2 3.5Å; H274-H278 AromaticContact CD2-NE2 3.19Å; H274-H278 PolarHBondContact CD2-NE2 3.02Å; H274-H278 AromaticContact CE1-NE2 3.95Å; H274-H278 AromaticContact NE2-CD2 3.66Å; H274-H278 AromaticContact NE2-CE1 3.92Å; H274-H278 AromaticContact NE2-NE2 2.92Å; H274-H278 PolarHBondContact NE2-NE2 3.37Å; H274-H278 PolarHBondContact O-CD2 3.09Å; H274-H278 PolarHBondContact O-N 2.88Å; Q275-H278 PolarHBondContact O-N 3.33Å; V276-H278 PolarHBondContact O-N 3.33Å; H278-L280 VanDerWaalsContact C-N 3.34Å; H278-L280 PolarHBondContact O-N 3.44Å; H278-V281 PolarHBondContact O-N 3.45Å; H278-V282 WeakPolarHBondContact O-CG2 3.44Å; H278-V282 PolarHBondContact O-N 3.05Å; H278-V282 VanDerWaalsContact O-N 3.1Å
279V98.7Very high97.9Very high76 Ų7636.8 Ų36.846%0.46118%0.182SC..Hα-helixtrans-60.3-45.2177.7174.80000111.1T75 Q275 V276 W277 V282 F283T75-V279 HydrophobicContact CG2-CG2 3.65Å; Q275-V279 WeakPolarHBondContact O-CG2 3.14Å; Q275-V279 PolarHBondContact O-N 3.15Å; Q275-V279 VanDerWaalsContact O-N 3.08Å; V276-V279 PolarHBondContact O-N 2.91Å; W277-V279 PolarHBondContact O-N 3.49Å; V279-V282 PolarHBondContact O-N 3.16Å; V279-F283 PolarHBondContact O-N 3.29Å
280L98.7Very high98Very high37 Ų3737.1 Ų37.119%0.19419%0.186CC..Hα-helixtrans-68.7-33-179.9-70.1173.7000112.6I246 A249 A250 F253 V276 W277 H278 F283 L284I246-L280 HydrophobicContact CG2-CB 4.36Å; I246-L280 HydrophobicContact CG2-CD2 4.4Å; I246-L280 WeakPolarHBondContact CG2-O 3.48Å; A249-L280 HydrophobicContact CB-CD1 4.43Å; A250-L280 HydrophobicContact CB-CB 3.7Å; A250-L280 HydrophobicContact CB-CD1 3.99Å; F253-L280 HydrophobicContact CD2-CD1 3.78Å; F253-L280 HydrophobicContact CE2-CD1 4.08Å; V276-L280 HydrophobicContact CG1-CD1 3.85Å; V276-L280 HydrophobicContact CG1-CG 4.28Å; V276-L280 WeakPolarHBondContact O-CB 3.29Å; V276-L280 WeakPolarHBondContact O-CG 3.35Å; V276-L280 PolarHBondContact O-N 3.34Å; W277-L280 PolarHBondContact O-N 3.49Å; H278-L280 VanDerWaalsContact C-N 3.34Å; H278-L280 PolarHBondContact O-N 3.44Å; L280-F283 PolarHBondContact O-N 3.47Å; L280-L284 VanDerWaalsContact O-CB 3.26Å; L280-L284 WeakPolarHBondContact O-CB 3.28Å; L280-L284 PolarHBondContact O-N 2.67Å
281V98.6Very high98Very high24 Ų2433.5 Ų33.515%0.14517%0.167CC..Hα-helixtrans-65-44.1173.5172.50000110.9M119 W277 H278 F283 L284 L285M119-V281 HydrophobicContact CE-CG1 4.03Å; W277-V281 HydrophobicContact CD2-CG2 4.09Å; W277-V281 HydrophobicContact CG-CG2 4.48Å; W277-V281 HydrophobicContact CH2-CG2 4.47Å; W277-V281 HydrophobicContact CZ2-CG2 3.93Å; W277-V281 WeakPolarHBondContact O-CG2 3.32Å; W277-V281 PolarHBondContact O-N 2.89Å; H278-V281 PolarHBondContact O-N 3.45Å; V281-F283 VanDerWaalsContact C-N 3.34Å; V281-F283 PolarHBondContact O-N 3.41Å; V281-L284 WeakPolarHBondContact O-CB 3.43Å; V281-L284 PolarHBondContact O-N 3.48Å; V281-L285 WeakPolarHBondContact O-CG 3.41Å; V281-L285 PolarHBondContact O-N 3.03Å
282V98.8Very high98Very high22 Ų2232.5 Ų32.513%0.13316%0.156CC..Hα-helixtrans-60.1-46.3174.4175.10000110.6L82 M119 H278 V279 L284 L285 Y286L82-V282 HydrophobicContact CD2-CG1 4.17Å; M119-V282 HydrophobicContact CE-CG2 3.84Å; M119-V282 HydrophobicContact SD-CG2 3.77Å; H278-V282 WeakPolarHBondContact O-CG2 3.44Å; H278-V282 PolarHBondContact O-N 3.05Å; H278-V282 VanDerWaalsContact O-N 3.1Å; V279-V282 PolarHBondContact O-N 3.16Å; V282-L284 VanDerWaalsContact C-N 3.33Å; V282-L284 PolarHBondContact O-N 3.25Å; V282-L285 PolarHBondContact O-N 3.49Å; V282-Y286 WeakPolarHBondContact O-CB 3.29Å; V282-Y286 PolarHBondContact O-N 3.44Å
283F98.7Very high97.9Very high100 Ų10033 Ų3344%0.43916%0.158SC..Hα-helixtrans-62.9-39.1178-174.8-110.8000112.5I246 V279 L280 V281 Y286 W287I246-F283 HydrophobicContact CD1-CD1 3.62Å; I246-F283 HydrophobicContact CD1-CE1 3.5Å; I246-F283 VanDerWaalsContact CD1-CE1 3.5Å; I246-F283 HydrophobicContact CG1-CD1 4.06Å; I246-F283 HydrophobicContact CG1-CE1 4.07Å; I246-F283 HydrophobicContact CG2-CD1 4.12Å; V279-F283 PolarHBondContact O-N 3.29Å; L280-F283 PolarHBondContact O-N 3.47Å; V281-F283 VanDerWaalsContact C-N 3.34Å; V281-F283 PolarHBondContact O-N 3.41Å; F283-Y286 PolarHBondContact O-N 2.75Å; F283-W287 VanDerWaalsContact O-CB 3.3Å; F283-W287 WeakPolarHBondContact O-CB 3.26Å; F283-W287 PolarHBondContact O-N 3.17Å
284L98.7Very high97.7Very high24 Ų2437.5 Ų37.513%0.12618%0.176CC..Hα-helixtrans-60.4-51.4175.8-178.8150.6000111.5M243 I246 A247 L280 V281 V282 Y286 W287 W288M243-L284 HydrophobicContact CG-CD1 4.25Å; M243-L284 HydrophobicContact CG-CD2 4.22Å; M243-L284 HydrophobicContact CG-CG 3.98Å; I246-L284 HydrophobicContact CB-CB 4.46Å; I246-L284 HydrophobicContact CB-CD1 4.44Å; I246-L284 HydrophobicContact CG2-CB 3.75Å; I246-L284 HydrophobicContact CG2-CD1 4.31Å; I246-L284 HydrophobicContact CG2-CG 4.45Å; A247-L284 HydrophobicContact CB-CD1 3.54Å; L280-L284 VanDerWaalsContact O-CB 3.26Å; L280-L284 WeakPolarHBondContact O-CB 3.28Å; L280-L284 PolarHBondContact O-N 2.67Å; V281-L284 WeakPolarHBondContact O-CB 3.43Å; V281-L284 PolarHBondContact O-N 3.48Å; V282-L284 VanDerWaalsContact C-N 3.33Å; V282-L284 PolarHBondContact O-N 3.25Å; L284-Y286 VanDerWaalsContact C-N 3.31Å; L284-Y286 PolarHBondContact O-N 2.99Å; L284-W287 PolarHBondContact O-N 3.23Å; L284-W288 WeakPolarHBondContact O-CB 3Å; L284-W288 PolarHBondContact O-N 2.61Å
285L98.7Very high97.5Very high6 Ų636.1 Ų36.13%0.03117%0.17CC..Hα-helixtrans-65.8-37.4-179.2-65.3-174.5000111.2F83 F115 M119 C155 V281 V282 W288 H289F83-L285 HydrophobicContact CE1-CB 3.94Å; F83-L285 HydrophobicContact CE2-CB 4.2Å; F83-L285 HydrophobicContact CE2-CD1 4.26Å; F83-L285 HydrophobicContact CZ-CB 3.44Å; F83-L285 VanDerWaalsContact CZ-CB 3.44Å; F83-L285 HydrophobicContact CZ-CD1 4.32Å; F115-L285 HydrophobicContact CB-CD1 4.1Å; F115-L285 HydrophobicContact CD1-CD1 3.95Å; F115-L285 HydrophobicContact CD1-CD2 3.82Å; F115-L285 HydrophobicContact CD1-CG 4.34Å; F115-L285 HydrophobicContact CD2-CB 4.22Å; F115-L285 HydrophobicContact CE1-CD2 3.66Å; F115-L285 HydrophobicContact CE2-CB 4.35Å; F115-L285 HydrophobicContact CG-CB 4.34Å; F115-L285 HydrophobicContact CG-CD1 4Å; F115-L285 HydrophobicContact CG-CD2 4.42Å; F115-L285 HydrophobicContact CZ-CD2 4.12Å; M119-L285 HydrophobicContact CE-CD1 3.49Å; M119-L285 VanDerWaalsContact CE-CD1 3.49Å; C155-L285 WeakPolarHBondContact SG-CD2 3.48Å; V281-L285 WeakPolarHBondContact O-CG 3.41Å; V281-L285 PolarHBondContact O-N 3.03Å; V282-L285 PolarHBondContact O-N 3.49Å; L285-W288 PolarHBondContact O-N 3.44Å; L285-H289 WeakPolarHBondContact O-CB 3.48Å; L285-H289 PolarHBondContact O-N 3.42Å
286Y98.7Very high97.2Very high85 Ų8535.9 Ų35.933%0.33317%0.169SC..Hα-helixtrans-63-47.3172.3177.1-102.1000112.1L82 L86 V282 F283 L284 W288 H289 Q290L82-Y286 HydrophobicContact CD2-CD2 4.14Å; L86-Y286 HydrophobicContact CD1-CD2 3.88Å; L86-Y286 HydrophobicContact CD1-CE2 4.13Å; V282-Y286 WeakPolarHBondContact O-CB 3.29Å; V282-Y286 PolarHBondContact O-N 3.44Å; F283-Y286 PolarHBondContact O-N 2.75Å; L284-Y286 VanDerWaalsContact C-N 3.31Å; L284-Y286 PolarHBondContact O-N 2.99Å; Y286-W288 VanDerWaalsContact C-N 3.27Å; Y286-W288 PolarHBondContact O-N 3.38Å; Y286-H289 WeakPolarHBondContact O-CB 3.28Å; Y286-H289 PolarHBondContact O-N 2.94Å; Y286-Q290 HydrophobicContact CD1-CG 4.28Å; Y286-Q290 HydrophobicContact CE1-CG 3.82Å; Y286-Q290 HydrophobicContact CE2-CG 4.11Å; Y286-Q290 WeakPolarHBondContact O-CG 3.37Å; Y286-Q290 PolarHBondContact O-N 2.95Å
287W98.5Very high96.9Very high66 Ų6639 Ų3925%0.2518%0.179CC..Hα-helixtrans-58-42.1175.8174.9-99000111.7R239 V242 I246 F283 L284 Q290 T291R239-W287 HydrophobicContact CB-CZ2 4.26Å; R239-W287 HydrophobicContact CG-CZ2 4.19Å; R239-W287 PolarHBondContact O-NE1 2.92Å; V242-W287 HydrophobicContact CB-CZ2 3.74Å; V242-W287 HydrophobicContact CG1-CD2 3.95Å; V242-W287 VanDerWaalsContact CG1-CE2 3.43Å; V242-W287 HydrophobicContact CG1-CG 4.4Å; V242-W287 HydrophobicContact CG1-CH2 4.22Å; V242-W287 HydrophobicContact CG1-CZ2 3.59Å; V242-W287 HydrophobicContact CG2-CZ2 4.14Å; I246-W287 HydrophobicContact CD1-CB 4.15Å; I246-W287 HydrophobicContact CD1-CG 4.11Å; F283-W287 VanDerWaalsContact O-CB 3.3Å; F283-W287 WeakPolarHBondContact O-CB 3.26Å; F283-W287 PolarHBondContact O-N 3.17Å; L284-W287 PolarHBondContact O-N 3.23Å; W287-Q290 PolarHBondContact O-N 3.38Å; W287-T291 VanDerWaalsContact O-CB 3.32Å; W287-T291 WeakPolarHBondContact O-CB 3.37Å; W287-T291 PolarHBondContact O-N 2.92Å; W287-T291 PolarHBondContact O-OG1 3Å
288W97.9Very high96.6Very high18 Ų1838.9 Ų38.97%0.06818%0.18CC..Hα-helixtrans-68-39.9179.1-163.1-117.1000112.4C155 F236 V240 M243 L284 L285 Y286 T291 A292C155-W288 PolarHBondContact O-NE1 2.94Å; F236-W288 HydrophobicContact CZ-CH2 4.46Å; V240-W288 HydrophobicContact CG2-CH2 4.04Å; V240-W288 HydrophobicContact CG2-CZ3 4.12Å; M243-W288 HydrophobicContact CB-CE3 3.95Å; M243-W288 HydrophobicContact CB-CZ3 4.1Å; M243-W288 HydrophobicContact CE-CE3 4.13Å; M243-W288 HydrophobicContact CE-CH2 3.87Å; M243-W288 HydrophobicContact CE-CZ2 4.29Å; M243-W288 HydrophobicContact CE-CZ3 3.79Å; M243-W288 HydrophobicContact CG-CD2 4.49Å; M243-W288 HydrophobicContact CG-CE3 3.94Å; M243-W288 HydrophobicContact CG-CZ3 4.36Å; M243-W288 HydrophobicContact SD-CB 4.38Å; M243-W288 HydrophobicContact SD-CD2 3.35Å; M243-W288 HydrophobicContact SD-CE3 3.16Å; M243-W288 HydrophobicContact SD-CG 3.92Å; M243-W288 HydrophobicContact SD-CH2 3.93Å; M243-W288 HydrophobicContact SD-CZ2 4.1Å; M243-W288 HydrophobicContact SD-CZ3 3.49Å; M243-W288 WeakPolarHBondContact SD-CZ3 3.22Å; L284-W288 WeakPolarHBondContact O-CB 3Å; L284-W288 PolarHBondContact O-N 2.61Å; L285-W288 PolarHBondContact O-N 3.44Å; Y286-W288 VanDerWaalsContact C-N 3.27Å; Y286-W288 PolarHBondContact O-N 3.38Å; W288-T291 HydrophobicContact CE3-CG2 4.09Å; W288-T291 HydrophobicContact CZ3-CG2 4.1Å; W288-T291 WeakPolarHBondContact O-CB 3.4Å; W288-T291 PolarHBondContact O-N 2.98Å; W288-A292 PolarHBondContact O-N 3.18Å
289H98.1Very high96.1Very high7 Ų740.2 Ų40.23%0.03219%0.185CC..Hα-helixtrans-56.7-52.3169.9171.7-84.4000112.1D90 F115 L285 Y286 T291 A292 V293D90-H289 IonicContact OD1-CE1 2.85Å; D90-H289 IonicContact OD1-NE2 3.72Å; D90-H289 IonicContact OD2-CD2 3.15Å; D90-H289 IonicContact OD2-CE1 3.25Å; D90-H289 IonicContact OD2-NE2 2.65Å; D90-H289 PolarHBondContact OD2-NE2 2.04Å; F115-H289 HydrophobicContact CE2-CB 4.43Å; L285-H289 WeakPolarHBondContact O-CB 3.48Å; L285-H289 PolarHBondContact O-N 3.42Å; Y286-H289 WeakPolarHBondContact O-CB 3.28Å; Y286-H289 PolarHBondContact O-N 2.94Å; H289-T291 PolarHBondContact O-N 3.44Å; H289-A292 WeakPolarHBondContact O-CB 3.3Å; H289-A292 PolarHBondContact O-N 3.32Å; H289-A292 VanDerWaalsContact O-N 3.11Å; H289-V293 PolarHBondContact O-N 2.99Å
290Q97.4Very high95.6Very high64 Ų6439.3 Ų39.330%0.29918%0.176SC..Hα-helixtrans-59.8-35.8177.9-64.7-56.4-45.600111.9Y286 W287 Y294Y286-Q290 HydrophobicContact CD1-CG 4.28Å; Y286-Q290 HydrophobicContact CE1-CG 3.82Å; Y286-Q290 HydrophobicContact CE2-CG 4.11Å; Y286-Q290 WeakPolarHBondContact O-CG 3.37Å; Y286-Q290 PolarHBondContact O-N 2.95Å; W287-Q290 PolarHBondContact O-N 3.38Å; Q290-Y294 WeakPolarHBondContact O-CB 3.22Å; Q290-Y294 PolarHBondContact O-N 3.1Å
291T96.1Very high95.1Very high1 Ų141 Ų411%0.00619%0.191CC..Hα-helixtrans-64.9-45.5175-66.60000111.4F236 R239 W287 W288 H289 V293 Y294 I295F236-T291 HydrophobicContact CD2-CG2 4.38Å; F236-T291 HydrophobicContact CE2-CG2 4.01Å; R239-T291 HydrophobicContact CB-CG2 3.73Å; R239-T291 HydrophobicContact CG-CG2 4.43Å; W287-T291 VanDerWaalsContact O-CB 3.32Å; W287-T291 WeakPolarHBondContact O-CB 3.37Å; W287-T291 PolarHBondContact O-N 2.92Å; W287-T291 PolarHBondContact O-OG1 3Å; W288-T291 HydrophobicContact CE3-CG2 4.09Å; W288-T291 HydrophobicContact CZ3-CG2 4.1Å; W288-T291 WeakPolarHBondContact O-CB 3.4Å; W288-T291 PolarHBondContact O-N 2.98Å; H289-T291 PolarHBondContact O-N 3.44Å; T291-V293 PolarHBondContact O-N 3.23Å; T291-Y294 WeakPolarHBondContact O-CB 3.44Å; T291-Y294 PolarHBondContact O-N 3.44Å; T291-I295 HydrophobicContact CG2-CD1 3.61Å; T291-I295 HydrophobicContact CG2-CG1 4.46Å; T291-I295 WeakPolarHBondContact O-CD1 2.99Å; T291-I295 WeakPolarHBondContact O-CG1 3.08Å; T291-I295 PolarHBondContact O-N 3.02Å
292A95.3Very high94.4Very high6 Ų645.1 Ų45.15%0.0521%0.209CC..Hα-helixtrans-58.9-47.1175.500000111.8Y108 P158 W288 H289 Y294 I295 M296Y108-A292 HydrophobicContact CE1-CB 4.32Å; Y108-A292 PolarHBondContact OH-O 3.06Å; P158-A292 HydrophobicContact CB-CB 3.95Å; W288-A292 PolarHBondContact O-N 3.18Å; H289-A292 WeakPolarHBondContact O-CB 3.3Å; H289-A292 PolarHBondContact O-N 3.32Å; H289-A292 VanDerWaalsContact O-N 3.11Å; A292-Y294 VanDerWaalsContact C-N 3.28Å; A292-Y294 PolarHBondContact O-N 3Å; A292-I295 PolarHBondContact O-N 3.46Å; A292-M296 WeakPolarHBondContact O-CB 3.32Å; A292-M296 PolarHBondContact O-N 3Å
293V95Very high93.3Very high15 Ų1549.3 Ų49.39%0.09124%0.236CC..Hα-helixtrans-58.2-44.7177.9174.30000110.8V94 Y108 H289 T291 K297V94-V293 HydrophobicContact CG1-CG1 3.82Å; Y108-V293 HydrophobicContact CE1-CG2 3.69Å; Y108-V293 WeakPolarHBondContact OH-CA 3.15Å; Y108-V293 PolarHBondContact OH-N 3.23Å; H289-V293 PolarHBondContact O-N 2.99Å; T291-V293 PolarHBondContact O-N 3.23Å; V293-K297 HydrophobicContact CG1-CD 4.41Å; V293-K297 WeakPolarHBondContact O-CG 3.43Å; V293-K297 PolarHBondContact O-N 3.14Å; V293-K297 VanDerWaalsContact O-N 3.12Å
294Y93.9Very high92.6Very high96 Ų9646.1 Ų46.138%0.37623%0.226SC..Hα-helixtrans-62.1-45179.5-174.1-92.7000112.2L235 R239 Q290 T291 A292 F298L235-Y294 HydrophobicContact CD1-CE1 3.7Å; L235-Y294 WeakPolarHBondContact CD1-OH 3.41Å; L235-Y294 HydrophobicContact CD2-CE1 3.71Å; L235-Y294 HydrophobicContact CG-CE1 3.66Å; R239-Y294 VanDerWaalsContact NH2-CD2 3.34Å; Q290-Y294 WeakPolarHBondContact O-CB 3.22Å; Q290-Y294 PolarHBondContact O-N 3.1Å; T291-Y294 WeakPolarHBondContact O-CB 3.44Å; T291-Y294 PolarHBondContact O-N 3.44Å; A292-Y294 VanDerWaalsContact C-N 3.28Å; A292-Y294 PolarHBondContact O-N 3Å; Y294-F298 PolarHBondContact O-N 2.63Å
295I91.6Very high91.4Very high12 Ų1248.2 Ų48.26%0.06224%0.241CC..Hα-helixtrans-72.6-39.5-178.1-57.5150.5000111.3Y162 F236 T291 A292 K297 F298 R299Y162-I295 HydrophobicContact CG-CG2 4.44Å; F236-I295 HydrophobicContact CD2-CD1 3.24Å; F236-I295 HydrophobicContact CD2-CG1 3.73Å; F236-I295 HydrophobicContact CE2-CD1 3.02Å; F236-I295 HydrophobicContact CE2-CG1 4.04Å; F236-I295 HydrophobicContact CG-CD1 4.26Å; F236-I295 HydrophobicContact CG-CG1 4.49Å; F236-I295 HydrophobicContact CZ-CD1 3.86Å; T291-I295 HydrophobicContact CG2-CD1 3.61Å; T291-I295 HydrophobicContact CG2-CG1 4.46Å; T291-I295 WeakPolarHBondContact O-CD1 2.99Å; T291-I295 WeakPolarHBondContact O-CG1 3.08Å; T291-I295 PolarHBondContact O-N 3.02Å; A292-I295 PolarHBondContact O-N 3.46Å; I295-K297 VanDerWaalsContact C-N 3.32Å; I295-K297 PolarHBondContact O-N 3.37Å; I295-F298 CarbonylContact O-C 3.51Å; I295-F298 WeakPolarHBondContact O-CB 3.29Å; I295-F298 PolarHBondContact O-N 3.08Å; I295-F298 VanDerWaalsContact O-N 3.16Å; I295-R299 HydrophobicContact CG2-CG 4.21Å; I295-R299 WeakPolarHBondContact O-CG 3.26Å; I295-R299 PolarHBondContact O-N 3.41Å
296M92.9Very high89.8Confident0 Ų052.7 Ų52.70%027%0.27CS..Hα-helixtrans-56.5-49.1174.9174.9-139.258.600110.2L95 Y108 Y162 A292 F298 R299 H300L95-M296 HydrophobicContact CD2-SD 3.7Å; Y108-M296 HydrophobicContact CE2-CB 4.45Å; Y108-M296 HydrophobicContact CE2-CG 4.4Å; Y108-M296 HydrophobicContact CE2-SD 3.96Å; Y162-M296 HydrophobicContact CD1-CB 4.28Å; Y162-M296 HydrophobicContact CE1-CB 3.74Å; Y162-M296 HydrophobicContact CE1-CG 3.86Å; Y162-M296 HydrophobicContact CE2-CB 4.12Å; A292-M296 WeakPolarHBondContact O-CB 3.32Å; A292-M296 PolarHBondContact O-N 3Å; M296-F298 VanDerWaalsContact C-N 3.32Å; M296-F298 PolarHBondContact O-N 3.15Å; M296-R299 PolarHBondContact O-N 2.98Å; M296-H300 PolarHBondContact O-CD2 3.12Å; M296-H300 VanDerWaalsContact O-CD2 3.23Å; M296-H300 PolarHBondContact O-N 3.23Å
297K92.3Very high88Confident104 Ų10454 Ų5445%0.45228%0.278SS..Hα-helixtrans-58.6-43.8175.5-71.2-178.6179.9-177.40111.9S98 V293 I295 R299 H300 S301S98-K297 WeakPolarHBondContact OG-CE 3.37Å; V293-K297 HydrophobicContact CG1-CD 4.41Å; V293-K297 WeakPolarHBondContact O-CG 3.43Å; V293-K297 PolarHBondContact O-N 3.14Å; V293-K297 VanDerWaalsContact O-N 3.12Å; I295-K297 VanDerWaalsContact C-N 3.32Å; I295-K297 PolarHBondContact O-N 3.37Å; K297-R299 PolarHBondContact O-N 3.22Å; K297-H300 PolarHBondContact O-N 3.21Å; K297-S301 PolarHBondContact O-N 3.23Å; K297-S301 PolarHBondContact O-OG 2.85Å
298F90.9Very high86Confident53 Ų5354.9 Ų54.923%0.23228%0.282CS..Hα-helixtrans-58.4-47.5175.5175.4-93.7000111.8V232 L235 Y294 I295 M296 H300 S301 Q302V232-F298 HydrophobicContact CB-CE1 4.37Å; V232-F298 HydrophobicContact CB-CZ 4.22Å; V232-F298 HydrophobicContact CG2-CD1 4.46Å; V232-F298 HydrophobicContact CG2-CE1 3.53Å; V232-F298 HydrophobicContact CG2-CZ 3.85Å; L235-F298 HydrophobicContact CD2-CD2 3.51Å; L235-F298 HydrophobicContact CD2-CE2 3.75Å; L235-F298 HydrophobicContact CD2-CG 4.02Å; L235-F298 HydrophobicContact CD2-CZ 4.44Å; Y294-F298 PolarHBondContact O-N 2.63Å; I295-F298 CarbonylContact O-C 3.51Å; I295-F298 WeakPolarHBondContact O-CB 3.29Å; I295-F298 PolarHBondContact O-N 3.08Å; I295-F298 VanDerWaalsContact O-N 3.16Å; M296-F298 VanDerWaalsContact C-N 3.32Å; M296-F298 PolarHBondContact O-N 3.15Å; F298-H300 VanDerWaalsContact C-N 3.3Å; F298-H300 PolarHBondContact O-N 3.38Å; F298-S301 PolarHBondContact O-N 3.17Å; F298-S301 VanDerWaalsContact O-N 3.14Å; F298-S301 PolarHBondContact O-OG 3.15Å; F298-Q302 HydrophobicContact CE1-CB 4.48Å; F298-Q302 HydrophobicContact CE2-CG 4.06Å; F298-Q302 HydrophobicContact CZ-CB 4.42Å; F298-Q302 HydrophobicContact CZ-CG 4.1Å; F298-Q302 PolarHBondContact O-N 3.23Å
299R88.9Confident84Confident28 Ų2858.6 Ų58.611%0.10631%0.306CS..Hα-helixtrans-63.7-33.7178.3-70.6-62.2-174.2-163.90.3113Y162 A163 Y165 I295 M296 K297 S301 Q302Y162-R299 PolarHBondContact O-NE 2.83Å; Y162-R299 PolarHBondContact O-NH2 3.28Å; A163-R299 PolarHBondContact O-NH2 3.14Å; A163-R299 VanDerWaalsContact O-NH2 3.13Å; Y165-R299 HydrophobicContact CD1-CB 4.47Å; Y165-R299 HydrophobicContact CG-CB 4.48Å; Y165-R299 HydrophobicContact CG-CG 4.26Å; I295-R299 HydrophobicContact CG2-CG 4.21Å; I295-R299 WeakPolarHBondContact O-CG 3.26Å; I295-R299 PolarHBondContact O-N 3.41Å; M296-R299 PolarHBondContact O-N 2.98Å; K297-R299 PolarHBondContact O-N 3.22Å; R299-S301 VanDerWaalsContact C-N 3.33Å; R299-Q302 CarbonylContact O-C 3.48Å; R299-Q302 PolarHBondContact O-N 3.04Å
300H87.9Confident81.5Confident57 Ų5764.2 Ų64.226%0.26433%0.333SS..Hα-helixtrans-73.8-29.5176.7-73.7-146.1000111.8S98 D104 M296 K297 F298S98-H300 PolarHBondContact O-ND1 3.24Å; D104-H300 IonicContact OD1-NE2 2.98Å; D104-H300 IonicContact OD2-CE1 3.56Å; D104-H300 PolarHBondContact OD2-CE1 3.46Å; D104-H300 IonicContact OD2-NE2 3.83Å; D104-H300 PolarHBondContact OD2-NE2 3.43Å; D104-H300 VanDerWaalsContact OD2-NE2 3.15Å; M296-H300 PolarHBondContact O-CD2 3.12Å; M296-H300 VanDerWaalsContact O-CD2 3.23Å; M296-H300 PolarHBondContact O-N 3.23Å; K297-H300 PolarHBondContact O-N 3.21Å; F298-H300 VanDerWaalsContact C-N 3.3Å; F298-H300 PolarHBondContact O-N 3.38Å
301S87.8Confident78.9Confident74 Ų7467.5 Ų67.552%0.51736%0.36SS..Hα-helixtrans-80.5-19.4174.372.10000114.2K297 F298 R299K297-S301 PolarHBondContact O-N 3.23Å; K297-S301 PolarHBondContact O-OG 2.85Å; F298-S301 PolarHBondContact O-N 3.17Å; F298-S301 VanDerWaalsContact O-N 3.14Å; F298-S301 PolarHBondContact O-OG 3.15Å; R299-S301 VanDerWaalsContact C-N 3.33Å
302Q84.7Confident76.7Confident110 Ų11070.5 Ų70.551%0.51439%0.39SS..SBendtrans-13190.1-175.3-65.7-63.9-39.200109.3F298 R299F298-Q302 HydrophobicContact CE1-CB 4.48Å; F298-Q302 HydrophobicContact CE2-CG 4.06Å; F298-Q302 HydrophobicContact CZ-CB 4.42Å; F298-Q302 HydrophobicContact CZ-CG 4.1Å; F298-Q302 PolarHBondContact O-N 3.23Å; R299-Q302 CarbonylContact O-C 3.48Å; R299-Q302 PolarHBondContact O-N 3.04Å
303P75.8Confident74.2Confident109 Ų10975 Ų7571%0.70841%0.414SS*.PPolyproline II helixtrans-63.4158.5-178.526.3-33.2000111.6
304C83.3Confident71.9Confident34 Ų3480.1 Ų80.123%0.2344%0.439CS..PPolyproline II helixtrans-58.8137.8-179.7-68.10000111.8C166C166-C304 WeakPolarHBondContact CA-SG 3.41Å; C166-C304 HydrophobicContact CB-CB 3.7Å; C166-C304 WeakPolarHBondContact CB-SG 3.44Å; C166-C304 WeakPolarHBondContact SG-CA 3.4Å; C166-C304 WeakPolarHBondContact SG-CB 3.38Å; C166-C304 CovalentContact SG-SG 2.04Å; C166-C304 PolarHBondContact SG-SG 3.48Å
305P74.8Confident69.2Low68 Ų6886.4 Ų86.444%0.44248%0.479SS..PPolyproline II helixtrans-54.9145.3174-24.731.6000111.5F307 Y308P305-F307 PolarHBondContact O-N 3.02Å; P305-Y308 HydrophobicContact CB-CD2 4.02Å; P305-Y308 HydrophobicContact CB-CE2 4.36Å; P305-Y308 HydrophobicContact CG-CD2 4.07Å; P305-Y308 HydrophobicContact CG-CE2 4.16Å; P305-Y308 PolarHBondContact O-N 3.38Å
306P64.2Low68Low99 Ų9990.2 Ų90.264%0.64350%0.5SS*.G310 helixtrans-54.9-30.8-176-2633.2000114.2Y308 T309P306-Y308 PolarHBondContact O-N 2.73Å; P306-Y308 VanDerWaalsContact O-N 3.15Å; P306-T309 WeakPolarHBondContact CA-OG1 3.49Å; P306-T309 PolarHBondContact O-N 2.97Å; P306-T309 PolarHBondContact O-OG1 3.15Å
307F60.8Low66.7Low114 Ų11494.9 Ų94.950%0.553%0.526SS..G310 helixtrans-56.7-28.6178.3-166.8-95.3000113.5P305 L313P305-F307 PolarHBondContact O-N 3.02Å; F307-L313 HydrophobicContact CD2-CD1 4.24Å; F307-L313 HydrophobicContact CE2-CB 4.34Å; F307-L313 HydrophobicContact CE2-CD1 3.92Å; F307-L313 HydrophobicContact CE2-CD2 4.21Å; F307-L313 HydrophobicContact CE2-CG 4.4Å; F307-L313 HydrophobicContact CZ-CB 4.11Å; F307-L313 HydrophobicContact CZ-CD2 4.39Å
308Y57.2Low65.3Low84 Ų8494.4 Ų94.433%0.32953%0.53SS..G310 helixtrans-89.8-3.9178.4-63.8-69.8000114.1C166 I167 P305 P306C166-Y308 HydrophobicContact CB-CD2 4.22Å; C166-Y308 HydrophobicContact CB-CG 4.16Å; C166-Y308 WeakPolarHBondContact O-CB 3.47Å; I167-Y308 HydrophobicContact CD1-CD1 4.29Å; I167-Y308 HydrophobicContact CD1-CE1 3.55Å; I167-Y308 HydrophobicContact CG1-CD1 3.73Å; I167-Y308 HydrophobicContact CG1-CE1 3.51Å; P305-Y308 HydrophobicContact CB-CD2 4.02Å; P305-Y308 HydrophobicContact CB-CE2 4.36Å; P305-Y308 HydrophobicContact CG-CD2 4.07Å; P305-Y308 HydrophobicContact CG-CE2 4.16Å; P305-Y308 PolarHBondContact O-N 3.38Å; P306-Y308 PolarHBondContact O-N 2.73Å; P306-Y308 VanDerWaalsContact O-N 3.15Å
309T55Low63.8Low95 Ų9596.8 Ų96.858%0.58355%0.548SS*.THydrogen-bonded Turntrans-105-6.7-179.758.30000113.5P306P306-T309 WeakPolarHBondContact CA-OG1 3.49Å; P306-T309 PolarHBondContact O-N 2.97Å; P306-T309 PolarHBondContact O-OG1 3.15Å
310Q45.7Very low62.2Low126 Ų126101.1 Ų101.159%0.58958%0.576SS**SBendtrans-89116.1177.7-69.7-78.6-23.300109.8G312 L313Q310-G312 PolarHBondContact O-N 3.14Å; Q310-G312 VanDerWaalsContact O-N 3.14Å; Q310-L313 HydrophobicContact CB-CD1 4.37Å
311P42.6Very low60.5Low133 Ų133104.1 Ų104.186%0.86460%0.596SS**THydrogen-bonded Turntrans-72.2106.5173.711.9-0.2000108.6
312G49.7Very low58.6Low63 Ų63106.2 Ų106.265%0.64960%0.602SS**THydrogen-bonded Turntrans136.510.3172.100000117.6Q310Q310-G312 PolarHBondContact O-N 3.14Å; Q310-G312 VanDerWaalsContact O-N 3.14Å
313L44.1Very low56.6Low102 Ų102105.9 Ų105.953%0.53461%0.609SS.*SBendtrans-110.710.6176.9-87157.5000114F307 Q310F307-L313 HydrophobicContact CD2-CD1 4.24Å; F307-L313 HydrophobicContact CE2-CB 4.34Å; F307-L313 HydrophobicContact CE2-CD1 3.92Å; F307-L313 HydrophobicContact CE2-CD2 4.21Å; F307-L313 HydrophobicContact CE2-CG 4.4Å; F307-L313 HydrophobicContact CZ-CB 4.11Å; F307-L313 HydrophobicContact CZ-CD2 4.39Å; Q310-L313 HydrophobicContact CB-CD1 4.37Å
314I45.2Very low55Low121 Ų121105.7 Ų105.762%0.62160%0.601SS**  trans-125.965174.1-44.8174.2000107.3
315D37.3Very low52.4Low229 Ų229112.2 Ų112.2100%1.22563%0.634SS**  trans-111.40155.9-77.4-25.9000107.6

Retrieved 315 of 315 residues in 99.3 ms (Link to these results)

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