A0A096M9U9_POEFO Loading...

Microsomal glutathione S-transferase 2

AlphaFold DB , UniProt , Accession A0A096M9U9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 109 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
1M62.3Low88.9Confident226 Ų226110.9 Ų110.9100%1.11363%0.633SS**  0-23.20-84.7-170-95.100114.4H3 K4M1-H3 VanDerWaalsContact C-N 3.31Å; M1-H3 PolarHBondContact O-N 3.04Å; M1-K4 PolarHBondContact O-N 3.48Å; M1-K4 VanDerWaalsContact O-N 3.1Å
2A79.5Confident89.3Confident96 Ų96104.2 Ų104.279%0.79361%0.606SS**THydrogen-bonded Turntrans-50.4-41.7-177.700000115.1
3H86.2Confident89.7Confident69 Ų69100.2 Ų100.232%0.31959%0.585SS.*THydrogen-bonded Turntrans-97.56.8-177.9-54.8-65.3000114.9M1 I5 P13 E15M1-H3 VanDerWaalsContact C-N 3.31Å; M1-H3 PolarHBondContact O-N 3.04Å; H3-I5 HydrophobicContact CB-CD1 4.41Å; H3-I5 HydrophobicContact CB-CG1 4.04Å; H3-I5 PolarHBondContact O-N 3.32Å; H3-P13 HydrophobicContact CB-CG 4.08Å; H3-E15 IonicContact CE1-OE2 3.69Å; H3-E15 PolarHBondContact CE1-OE2 3.11Å; H3-E15 VanDerWaalsContact CE1-OE2 3.25Å; H3-E15 IonicContact NE2-OE2 3.54Å
4K91.3Very high90Very high179 Ų17999.3 Ų99.378%0.77858%0.584SS**  trans4932.9-179.9-57.9-179.5-179.6178.20115.1M1 L6M1-K4 PolarHBondContact O-N 3.48Å; M1-K4 VanDerWaalsContact O-N 3.1Å; K4-L6 PolarHBondContact O-N 2.96Å
5I91.6Very high90.2Very high48 Ų48100.6 Ų100.625%0.24658%0.582CS.*PPolyproline II helixtrans-73.2116.8173.4-52-58.4000108.6H3 V9 F16H3-I5 HydrophobicContact CB-CD1 4.41Å; H3-I5 HydrophobicContact CB-CG1 4.04Å; H3-I5 PolarHBondContact O-N 3.32Å; I5-V9 HydrophobicContact CG2-CB 3.92Å; I5-V9 HydrophobicContact CG2-CG1 3.98Å; I5-V9 WeakPolarHBondContact CG2-O 3.37Å; I5-F16 HydrophobicContact CB-CD2 4.4Å; I5-F16 HydrophobicContact CB-CE1 4.34Å; I5-F16 HydrophobicContact CB-CE2 4.03Å; I5-F16 HydrophobicContact CB-CZ 4.01Å; I5-F16 HydrophobicContact CG1-CD1 3.98Å; I5-F16 HydrophobicContact CG1-CD2 3.95Å; I5-F16 HydrophobicContact CG1-CE1 4.11Å; I5-F16 HydrophobicContact CG1-CE2 4.08Å; I5-F16 HydrophobicContact CG1-CG 3.9Å; I5-F16 HydrophobicContact CG1-CZ 4.16Å; I5-F16 HydrophobicContact CG2-CE1 3.91Å; I5-F16 HydrophobicContact CG2-CE2 4.26Å; I5-F16 HydrophobicContact CG2-CZ 3.71Å
6L93.5Very high90.5Very high132 Ų13297.2 Ų97.269%0.69156%0.559SS**PPolyproline II helixtrans-91.7136.1179.5-65.4172.4000109.9K4 V9K4-L6 PolarHBondContact O-N 2.96Å; L6-V9 VanDerWaalsContact O-CB 3.3Å; L6-V9 WeakPolarHBondContact O-CB 3.47Å; L6-V9 WeakPolarHBondContact O-CG2 3.3Å; L6-V9 PolarHBondContact O-N 3.1Å
7P92.9Very high90.8Very high119 Ų11996.2 Ų96.277%0.77355%0.548SS*.THydrogen-bonded Turntrans-54.1144.4169.3-24.434.4000111.2
8P94.5Very high91Very high125 Ų12593.1 Ų93.181%0.81253%0.528SS*.THydrogen-bonded Turncis-91.716.46.837.4-36.7000114.4V10P8-V10 PolarHBondContact O-N 3.05Å
9V95.6Very high91.3Very high75 Ų7591.1 Ų91.146%0.45552%0.518SS..  trans-68.9132.3-174.1-177.50000111.1I5 L6 S11I5-V9 HydrophobicContact CG2-CB 3.92Å; I5-V9 HydrophobicContact CG2-CG1 3.98Å; I5-V9 WeakPolarHBondContact CG2-O 3.37Å; L6-V9 VanDerWaalsContact O-CB 3.3Å; L6-V9 WeakPolarHBondContact O-CB 3.47Å; L6-V9 WeakPolarHBondContact O-CG2 3.3Å; L6-V9 PolarHBondContact O-N 3.1Å; V9-S11 WeakPolarHBondContact CG1-O 3.37Å
10V95.3Very high91.6Very high82 Ų8289.3 Ų89.350%0.49750%0.504SS..  trans-120.26-178.8-62.60000113.7P8 F20P8-V10 PolarHBondContact O-N 3.05Å; V10-F20 HydrophobicContact CB-CD1 4.4Å; V10-F20 HydrophobicContact CB-CE1 3.8Å; V10-F20 HydrophobicContact CB-CE2 4.38Å; V10-F20 HydrophobicContact CB-CZ 3.79Å; V10-F20 HydrophobicContact CG1-CE1 4.04Å; V10-F20 HydrophobicContact CG1-CE2 3.95Å; V10-F20 HydrophobicContact CG1-CZ 3.49Å; V10-F20 VanDerWaalsContact CG1-CZ 3.49Å
11S94.9Very high91.8Very high69 Ų6991.3 Ų91.348%0.48350%0.504SS..  trans-115.4156.8174.550.60000110.9V9 E17V9-S11 WeakPolarHBondContact CG1-O 3.37Å; S11-E17 WeakPolarHBondContact CA-OE1 3.45Å; S11-E17 WeakPolarHBondContact CB-OE1 3.37Å
12G93.9Very high93.5Very high30 Ų3080.6 Ų80.631%0.30945%0.451SS..  trans169.2-153.4-176.300000113.1E17G12-E17 PolarHBondContact N-OE1 3.19Å
13P94.6Very high94.4Very high52 Ų5281 Ų8134%0.33844%0.436SS..SBendtrans-56.5147.2175.1-25.935.8000111.7H3 E15 F16 E17H3-P13 HydrophobicContact CB-CG 4.08Å; P13-E15 PolarHBondContact O-N 3.39Å; P13-F16 WeakPolarHBondContact O-CA 3.36Å; P13-F16 WeakPolarHBondContact O-CB 3.34Å; P13-F16 PolarHBondContact O-N 3.05Å; P13-E17 PolarHBondContact O-N 2.88Å; P13-E17 VanDerWaalsContact O-N 3.11Å
14P93.4Very high94.9Very high88 Ų8880.8 Ų80.857%0.57144%0.435SS*.Hα-helixtrans-52.4-35.2-176.9-29.635.3000114.6E17 Q18P14-E17 PolarHBondContact O-N 2.91Å; P14-Q18 WeakPolarHBondContact O-CB 3.5Å; P14-Q18 WeakPolarHBondContact O-CG 3.46Å; P14-Q18 PolarHBondContact O-N 3.5Å
15E93.3Very high95.3Very high119 Ų11973.5 Ų73.556%0.55641%0.405SS*.Hα-helixtrans-63.6-41.2176.9-64.2175.1-179.400112.4H3 P13 T19H3-E15 IonicContact CE1-OE2 3.69Å; H3-E15 PolarHBondContact CE1-OE2 3.11Å; H3-E15 VanDerWaalsContact CE1-OE2 3.25Å; H3-E15 IonicContact NE2-OE2 3.54Å; P13-E15 PolarHBondContact O-N 3.39Å; E15-T19 WeakPolarHBondContact O-CB 3.49Å; E15-T19 PolarHBondContact O-N 2.82Å; E15-T19 VanDerWaalsContact O-N 3.13Å; E15-T19 PolarHBondContact O-OG1 3.36Å
16F95Very high95.6Very high46 Ų4672.5 Ų72.520%0.20240%0.402CS..Hα-helixtrans-64.8-49.1174.3171.3-100.3000110.5I5 P13 Q18 T19 F20I5-F16 HydrophobicContact CB-CD2 4.4Å; I5-F16 HydrophobicContact CB-CE1 4.34Å; I5-F16 HydrophobicContact CB-CE2 4.03Å; I5-F16 HydrophobicContact CB-CZ 4.01Å; I5-F16 HydrophobicContact CG1-CD1 3.98Å; I5-F16 HydrophobicContact CG1-CD2 3.95Å; I5-F16 HydrophobicContact CG1-CE1 4.11Å; I5-F16 HydrophobicContact CG1-CE2 4.08Å; I5-F16 HydrophobicContact CG1-CG 3.9Å; I5-F16 HydrophobicContact CG1-CZ 4.16Å; I5-F16 HydrophobicContact CG2-CE1 3.91Å; I5-F16 HydrophobicContact CG2-CE2 4.26Å; I5-F16 HydrophobicContact CG2-CZ 3.71Å; P13-F16 WeakPolarHBondContact O-CA 3.36Å; P13-F16 WeakPolarHBondContact O-CB 3.34Å; P13-F16 PolarHBondContact O-N 3.05Å; F16-Q18 PolarHBondContact O-N 3.13Å; F16-T19 PolarHBondContact O-N 3.4Å; F16-F20 HydrophobicContact CE1-CB 4.45Å; F16-F20 HydrophobicContact CZ-CB 4.44Å; F16-F20 HydrophobicContact CZ-CD2 4.49Å; F16-F20 WeakPolarHBondContact O-CB 3.13Å; F16-F20 PolarHBondContact O-N 3.22Å
17E95.6Very high95.8Very high81 Ų8170 Ų7038%0.37939%0.392SS..Hα-helixtrans-63.3-41.7-178.1-65-170.4167.600111.7S11 G12 P13 P14 T19 F20 R21S11-E17 WeakPolarHBondContact CA-OE1 3.45Å; S11-E17 WeakPolarHBondContact CB-OE1 3.37Å; G12-E17 PolarHBondContact N-OE1 3.19Å; P13-E17 PolarHBondContact O-N 2.88Å; P13-E17 VanDerWaalsContact O-N 3.11Å; P14-E17 PolarHBondContact O-N 2.91Å; E17-T19 PolarHBondContact O-N 3.39Å; E17-F20 PolarHBondContact O-N 3.44Å; E17-R21 VanDerWaalsContact O-CB 3.31Å; E17-R21 WeakPolarHBondContact O-CB 3.31Å; E17-R21 WeakPolarHBondContact O-CG 3.26Å; E17-R21 PolarHBondContact O-N 3.25Å
18Q95.3Very high96Very high39 Ų3970 Ų7018%0.18238%0.381CS..Hα-helixtrans-59.1-46174.6-74.7169.714.900111.6P14 F16 A22 Y67P14-Q18 WeakPolarHBondContact O-CB 3.5Å; P14-Q18 WeakPolarHBondContact O-CG 3.46Å; P14-Q18 PolarHBondContact O-N 3.5Å; F16-Q18 PolarHBondContact O-N 3.13Å; Q18-A22 VanDerWaalsContact O-CB 3.26Å; Q18-A22 WeakPolarHBondContact O-CB 3.35Å; Q18-A22 PolarHBondContact O-N 3Å; Q18-Y67 HydrophobicContact CB-CD2 4.37Å; Q18-Y67 HydrophobicContact CB-CE2 4.45Å; Q18-Y67 HydrophobicContact CG-CD2 4.45Å; Q18-Y67 HydrophobicContact CG-CE2 4.28Å; Q18-Y67 PolarHBondContact OE1-O 3.29Å
19T95.8Very high96.2Very high56 Ų5666 Ų6634%0.34435%0.351SS..Hα-helixtrans-65.3-45.2178.4-54.70000111.8E15 F16 E17 A22 H23 F64 T68E15-T19 WeakPolarHBondContact O-CB 3.49Å; E15-T19 PolarHBondContact O-N 2.82Å; E15-T19 VanDerWaalsContact O-N 3.13Å; E15-T19 PolarHBondContact O-OG1 3.36Å; F16-T19 PolarHBondContact O-N 3.4Å; E17-T19 PolarHBondContact O-N 3.39Å; T19-A22 PolarHBondContact O-N 2.8Å; T19-H23 PolarHBondContact O-N 2.98Å; T19-F64 HydrophobicContact CG2-CE1 4.48Å; T19-F64 HydrophobicContact CG2-CZ 3.91Å; T19-T68 HydrophobicContact CG2-CG2 4.14Å
20F96.4Very high96.3Very high54 Ų5468.6 Ų68.624%0.23735%0.354CS..Hα-helixtrans-62-45.2178.5179.9-99000111.5V10 F16 E17 H23 Q24V10-F20 HydrophobicContact CB-CD1 4.4Å; V10-F20 HydrophobicContact CB-CE1 3.8Å; V10-F20 HydrophobicContact CB-CE2 4.38Å; V10-F20 HydrophobicContact CB-CZ 3.79Å; V10-F20 HydrophobicContact CG1-CE1 4.04Å; V10-F20 HydrophobicContact CG1-CE2 3.95Å; V10-F20 HydrophobicContact CG1-CZ 3.49Å; V10-F20 VanDerWaalsContact CG1-CZ 3.49Å; F16-F20 HydrophobicContact CE1-CB 4.45Å; F16-F20 HydrophobicContact CZ-CB 4.44Å; F16-F20 HydrophobicContact CZ-CD2 4.49Å; F16-F20 WeakPolarHBondContact O-CB 3.13Å; F16-F20 PolarHBondContact O-N 3.22Å; E17-F20 PolarHBondContact O-N 3.44Å; F20-H23 WeakPolarHBondContact O-CB 3.43Å; F20-H23 PolarHBondContact O-N 2.91Å; F20-Q24 HydrophobicContact CD1-CG 4.29Å; F20-Q24 HydrophobicContact CE1-CG 3.82Å; F20-Q24 VanDerWaalsContact CE1-OE1 3.31Å; F20-Q24 HydrophobicContact CE2-CG 4.46Å; F20-Q24 HydrophobicContact CZ-CG 3.91Å; F20-Q24 PolarHBondContact O-N 3.46Å
21R96.9Very high96.5Very high133 Ų13368.3 Ų68.350%0.50235%0.354SS..Hα-helixtrans-69.2-35.6177.9-64.1-66.1-73.8169.8-6.1112.4E17 H23 Q24 N25 Y67E17-R21 VanDerWaalsContact O-CB 3.31Å; E17-R21 WeakPolarHBondContact O-CB 3.31Å; E17-R21 WeakPolarHBondContact O-CG 3.26Å; E17-R21 PolarHBondContact O-N 3.25Å; R21-H23 VanDerWaalsContact C-N 3.33Å; R21-Q24 PolarHBondContact O-N 3.13Å; R21-N25 WeakPolarHBondContact O-CB 3.18Å; R21-N25 PolarHBondContact O-N 3.49Å; R21-Y67 HydrophobicContact CB-CE1 4.37Å
22A97.5Very high96.6Very high0 Ų069.9 Ų69.90%036%0.356CS..Hα-helixtrans-61-44172.100000111.2Q18 T19 C26 Y63 F64 Y67Q18-A22 VanDerWaalsContact O-CB 3.26Å; Q18-A22 WeakPolarHBondContact O-CB 3.35Å; Q18-A22 PolarHBondContact O-N 3Å; T19-A22 PolarHBondContact O-N 2.8Å; A22-C26 PolarHBondContact O-N 2.98Å; A22-C26 VanDerWaalsContact O-N 3.15Å; A22-C26 PolarHBondContact O-SG 3.47Å; A22-Y63 HydrophobicContact CB-CE1 4.48Å; A22-F64 HydrophobicContact CB-CD2 3.64Å; A22-F64 HydrophobicContact CB-CE2 3.81Å; A22-F64 HydrophobicContact CB-CG 4.35Å; A22-Y67 HydrophobicContact CB-CD1 3.63Å; A22-Y67 HydrophobicContact CB-CE1 4.41Å; A22-Y67 HydrophobicContact CB-CG 3.99Å
23H97.7Very high96.9Very high105 Ų10569 Ų6949%0.48634%0.344SS..Hα-helixtrans-63.4-50.9175.8176.472.1000112T19 F20 R21 N25 C26 V27 F64T19-H23 PolarHBondContact O-N 2.98Å; F20-H23 WeakPolarHBondContact O-CB 3.43Å; F20-H23 PolarHBondContact O-N 2.91Å; R21-H23 VanDerWaalsContact C-N 3.33Å; H23-N25 VanDerWaalsContact C-N 3.29Å; H23-N25 PolarHBondContact O-N 2.89Å; H23-C26 WeakPolarHBondContact O-CB 3.4Å; H23-C26 PolarHBondContact O-N 2.87Å; H23-C26 VanDerWaalsContact O-N 3.08Å; H23-V27 WeakPolarHBondContact O-CG2 3.49Å; H23-V27 PolarHBondContact O-N 3.08Å; H23-F64 HydrophobicContact CB-CE2 4Å
24Q98.3Very high97.1Very high65 Ų6569.2 Ų69.230%0.30434%0.342SS..Hα-helixtrans-55.9-44.5178.5-76.9-159.7-51.500111.8F20 R21 C26 V27 E28F20-Q24 HydrophobicContact CD1-CG 4.29Å; F20-Q24 HydrophobicContact CE1-CG 3.82Å; F20-Q24 VanDerWaalsContact CE1-OE1 3.31Å; F20-Q24 HydrophobicContact CE2-CG 4.46Å; F20-Q24 HydrophobicContact CZ-CG 3.91Å; F20-Q24 PolarHBondContact O-N 3.46Å; R21-Q24 PolarHBondContact O-N 3.13Å; Q24-C26 VanDerWaalsContact C-N 3.33Å; Q24-C26 PolarHBondContact O-N 2.88Å; Q24-V27 PolarHBondContact O-N 3.39Å; Q24-V27 VanDerWaalsContact O-N 3.13Å; Q24-E28 WeakPolarHBondContact O-CG 3.35Å; Q24-E28 PolarHBondContact O-N 2.89Å
25N98.1Very high97.3Very high26 Ų2669.6 Ų69.614%0.13934%0.342CS..Hα-helixtrans-62.1-39.8177.5-172.5-94.9000112.4R21 H23 V27 E28 F29 R60 Y63R21-N25 WeakPolarHBondContact O-CB 3.18Å; R21-N25 PolarHBondContact O-N 3.49Å; H23-N25 VanDerWaalsContact C-N 3.29Å; H23-N25 PolarHBondContact O-N 2.89Å; N25-V27 VanDerWaalsContact C-N 3.33Å; N25-V27 PolarHBondContact O-N 3.33Å; N25-E28 PolarHBondContact O-N 2.89Å; N25-F29 WeakPolarHBondContact ND2-CE2 3.45Å; N25-F29 VanDerWaalsContact O-CD2 3.27Å; N25-F29 WeakPolarHBondContact O-CD2 3.44Å; N25-F29 PolarHBondContact O-N 3.37Å; N25-R60 PolarHBondContact OD1-NH1 3.25Å; N25-Y63 HydrophobicContact CB-CE1 4.09Å; N25-Y63 PolarHBondContact OD1-OH 3.31Å
26C98Very high97.5Very high27 Ų2764.9 Ų64.918%0.18232%0.322CS..Hα-helixtrans-62.2-41.8174.4-68.90000111.5A22 H23 Q24 F29 Y30A22-C26 PolarHBondContact O-N 2.98Å; A22-C26 VanDerWaalsContact O-N 3.15Å; A22-C26 PolarHBondContact O-SG 3.47Å; H23-C26 WeakPolarHBondContact O-CB 3.4Å; H23-C26 PolarHBondContact O-N 2.87Å; H23-C26 VanDerWaalsContact O-N 3.08Å; Q24-C26 VanDerWaalsContact C-N 3.33Å; Q24-C26 PolarHBondContact O-N 2.88Å; C26-F29 PolarHBondContact O-N 3.49Å; C26-Y30 WeakPolarHBondContact O-CB 3.12Å; C26-Y30 PolarHBondContact O-N 3.07Å; C26-Y30 VanDerWaalsContact O-N 3.07Å
27V98.4Very high97.7Very high80 Ų8064.2 Ų64.249%0.48532%0.32SS..Hα-helixtrans-64.6-45177.8172.30000111.6H23 Q24 N25 F29 Y30 P31H23-V27 WeakPolarHBondContact O-CG2 3.49Å; H23-V27 PolarHBondContact O-N 3.08Å; Q24-V27 PolarHBondContact O-N 3.39Å; Q24-V27 VanDerWaalsContact O-N 3.13Å; N25-V27 VanDerWaalsContact C-N 3.33Å; N25-V27 PolarHBondContact O-N 3.33Å; V27-F29 VanDerWaalsContact C-N 3.27Å; V27-F29 PolarHBondContact O-N 3.24Å; V27-Y30 PolarHBondContact O-N 3.15Å; V27-P31 WeakPolarHBondContact O-CD 3.5Å
28E98.1Very high97.9Very high117 Ų11768.6 Ų68.655%0.54733%0.333SS..Hα-helixtrans-60-36.2179.5-73.3167.5-17700112.6Q24 N25Q24-E28 WeakPolarHBondContact O-CG 3.35Å; Q24-E28 PolarHBondContact O-N 2.89Å; N25-E28 PolarHBondContact O-N 2.89Å
29F98.1Very high98Very high41 Ų4168.4 Ų68.418%0.1834%0.335CS..Hα-helixtrans-89.5-13.1-179.3-84.8-97.6000114.4N25 C26 V27 L32 F33 Y56 R60 F78 L85N25-F29 WeakPolarHBondContact ND2-CE2 3.45Å; N25-F29 VanDerWaalsContact O-CD2 3.27Å; N25-F29 WeakPolarHBondContact O-CD2 3.44Å; N25-F29 PolarHBondContact O-N 3.37Å; C26-F29 PolarHBondContact O-N 3.49Å; V27-F29 VanDerWaalsContact C-N 3.27Å; V27-F29 PolarHBondContact O-N 3.24Å; F29-L32 HydrophobicContact CD1-CD1 4.35Å; F29-L32 PolarHBondContact O-N 3.16Å; F29-F33 PolarHBondContact O-N 3.34Å; F29-Y56 PolarHBondContact O-OH 3.07Å; F29-R60 VanDerWaalsContact CD1-NH2 3.32Å; F29-F78 HydrophobicContact CE2-CE2 4.3Å; F29-F78 HydrophobicContact CZ-CE2 4.1Å; F29-F78 HydrophobicContact CZ-CZ 4.36Å; F29-L85 HydrophobicContact CD1-CD1 3.49Å; F29-L85 VanDerWaalsContact CD1-CD1 3.49Å; F29-L85 HydrophobicContact CE1-CD1 3.89Å
30Y98.2Very high98.2Very high131 Ų13165.8 Ų65.851%0.51432%0.318SS..Hα-helixtrans-63-43-176.9-171.5-113.7000112.6C26 V27 L32 F33 L34C26-Y30 WeakPolarHBondContact O-CB 3.12Å; C26-Y30 PolarHBondContact O-N 3.07Å; C26-Y30 VanDerWaalsContact O-N 3.07Å; V27-Y30 PolarHBondContact O-N 3.15Å; Y30-L32 PolarHBondContact O-N 3.14Å; Y30-F33 HydrophobicContact CD2-CD1 4.18Å; Y30-F33 HydrophobicContact CE2-CD1 4.21Å; Y30-F33 WeakPolarHBondContact O-CB 3.38Å; Y30-F33 PolarHBondContact O-N 2.99Å; Y30-L34 HydrophobicContact CD1-CD1 3.94Å; Y30-L34 HydrophobicContact CD1-CG 4.41Å; Y30-L34 HydrophobicContact CE1-CD1 3.55Å; Y30-L34 HydrophobicContact CE1-CG 4.14Å; Y30-L34 HydrophobicContact CE2-CD2 4.38Å; Y30-L34 HydrophobicContact CE2-CG 4.43Å; Y30-L34 WeakPolarHBondContact O-CG 3.33Å; Y30-L34 PolarHBondContact O-N 3.22Å
31P98.5Very high98.3Very high75 Ų7564.2 Ų64.249%0.48732%0.318SS..Hα-helixtrans-59.8-42.8173.2-25.335000113.4V27 F33 L34 V35V27-P31 WeakPolarHBondContact O-CD 3.5Å; P31-F33 VanDerWaalsContact C-N 3.32Å; P31-F33 PolarHBondContact O-N 3.25Å; P31-L34 PolarHBondContact O-N 3.03Å; P31-V35 WeakPolarHBondContact O-CG2 3.33Å; P31-V35 PolarHBondContact O-N 3.41Å
32L98.2Very high98.3Very high102 Ų10264.7 Ų64.753%0.53433%0.328SS..Hα-helixtrans-62-42.5177.9-69.1174.6000111.5F29 Y30 T36F29-L32 HydrophobicContact CD1-CD1 4.35Å; F29-L32 PolarHBondContact O-N 3.16Å; Y30-L32 PolarHBondContact O-N 3.14Å; L32-T36 WeakPolarHBondContact O-CB 3.27Å; L32-T36 WeakPolarHBondContact O-CG2 3.41Å; L32-T36 PolarHBondContact O-N 3.08Å; L32-T36 VanDerWaalsContact O-N 3.07Å; L32-T36 PolarHBondContact O-OG1 2.9Å
33F98.6Very high98.3Very high13 Ų1370.5 Ų70.56%0.05735%0.353CS..Hα-helixtrans-60-49.4174.1167.5-117.3000111.7F29 Y30 P31 V35 T36 L37 Y56 L85 L88F29-F33 PolarHBondContact O-N 3.34Å; Y30-F33 HydrophobicContact CD2-CD1 4.18Å; Y30-F33 HydrophobicContact CE2-CD1 4.21Å; Y30-F33 WeakPolarHBondContact O-CB 3.38Å; Y30-F33 PolarHBondContact O-N 2.99Å; P31-F33 VanDerWaalsContact C-N 3.32Å; P31-F33 PolarHBondContact O-N 3.25Å; F33-V35 PolarHBondContact O-N 3.05Å; F33-T36 PolarHBondContact O-N 3.07Å; F33-T36 PolarHBondContact O-OG1 3.44Å; F33-T36 VanDerWaalsContact O-OG1 3.1Å; F33-L37 HydrophobicContact CD2-CB 4.42Å; F33-L37 HydrophobicContact CE1-CD2 4.19Å; F33-L37 HydrophobicContact CE2-CB 4.1Å; F33-L37 HydrophobicContact CE2-CD1 4.1Å; F33-L37 HydrophobicContact CE2-CD2 4.21Å; F33-L37 HydrophobicContact CE2-CG 4.37Å; F33-L37 HydrophobicContact CZ-CB 4.43Å; F33-L37 HydrophobicContact CZ-CD1 4.28Å; F33-L37 HydrophobicContact CZ-CD2 3.73Å; F33-L37 HydrophobicContact CZ-CG 4.38Å; F33-L37 WeakPolarHBondContact O-CB 3.45Å; F33-L37 PolarHBondContact O-N 2.97Å; F33-Y56 HydrophobicContact CB-CD1 4.42Å; F33-Y56 HydrophobicContact CB-CD2 4.37Å; F33-Y56 HydrophobicContact CB-CE1 3.86Å; F33-Y56 HydrophobicContact CB-CE2 3.76Å; F33-Y56 VanDerWaalsContact CB-CZ 3.48Å; F33-Y56 AromaticContact CD1-CD1 3.73Å; F33-Y56 HydrophobicContact CD1-CD1 3.73Å; F33-Y56 AromaticContact CD1-CE1 3.57Å; F33-Y56 HydrophobicContact CD1-CE1 3.57Å; F33-Y56 HydrophobicContact CD1-CG 4.45Å; F33-Y56 AromaticContact CD2-CD1 3.62Å; F33-Y56 HydrophobicContact CD2-CD1 3.62Å; F33-Y56 AromaticContact CD2-CD2 3.66Å; F33-Y56 HydrophobicContact CD2-CD2 3.66Å; F33-Y56 AromaticContact CD2-CE1 3.94Å; F33-Y56 HydrophobicContact CD2-CE1 3.94Å; F33-Y56 AromaticContact CD2-CE2 3.94Å; F33-Y56 HydrophobicContact CD2-CE2 3.94Å; F33-Y56 AromaticContact CD2-CG 3.48Å; F33-Y56 HydrophobicContact CD2-CG 3.48Å; F33-Y56 VanDerWaalsContact CD2-CG 3.48Å; F33-Y56 AromaticContact CE1-CD1 3.79Å; F33-Y56 HydrophobicContact CE1-CD1 3.79Å; F33-Y56 HydrophobicContact CE1-CE1 4.06Å; F33-Y56 AromaticContact CE2-CD1 3.69Å; F33-Y56 HydrophobicContact CE2-CD1 3.69Å; F33-Y56 HydrophobicContact CE2-CD2 4.19Å; F33-Y56 HydrophobicContact CE2-CE1 4.41Å; F33-Y56 AromaticContact CE2-CG 3.57Å; F33-Y56 HydrophobicContact CE2-CG 3.57Å; F33-Y56 AromaticContact CG-CD1 3.63Å; F33-Y56 HydrophobicContact CG-CD1 3.63Å; F33-Y56 HydrophobicContact CG-CD2 4.08Å; F33-Y56 AromaticContact CG-CE1 3.48Å; F33-Y56 HydrophobicContact CG-CE1 3.48Å; F33-Y56 VanDerWaalsContact CG-CE1 3.48Å; F33-Y56 AromaticContact CG-CE2 3.91Å; F33-Y56 HydrophobicContact CG-CE2 3.91Å; F33-Y56 AromaticContact CG-CG 3.94Å; F33-Y56 HydrophobicContact CG-CG 3.94Å; F33-Y56 AromaticContact CG-CZ 3.62Å; F33-Y56 AromaticContact CZ-CD1 3.76Å; F33-Y56 HydrophobicContact CZ-CD1 3.76Å; F33-Y56 HydrophobicContact CZ-CE1 4.44Å; F33-Y56 HydrophobicContact CZ-CG 4.09Å; F33-L85 HydrophobicContact CB-CD2 3.96Å; F33-L85 HydrophobicContact CD2-CD2 4.41Å; F33-L88 HydrophobicContact CD2-CD1 4.1Å; F33-L88 HydrophobicContact CE2-CD1 4.08Å
34L98.6Very high98.3Very high55 Ų5568.7 Ų68.729%0.28834%0.344SS..Hα-helixtrans-60.6-47.7-179.6-70.5179.7000111.7Y30 P31 T36 L37 W38Y30-L34 HydrophobicContact CD1-CD1 3.94Å; Y30-L34 HydrophobicContact CD1-CG 4.41Å; Y30-L34 HydrophobicContact CE1-CD1 3.55Å; Y30-L34 HydrophobicContact CE1-CG 4.14Å; Y30-L34 HydrophobicContact CE2-CD2 4.38Å; Y30-L34 HydrophobicContact CE2-CG 4.43Å; Y30-L34 WeakPolarHBondContact O-CG 3.33Å; Y30-L34 PolarHBondContact O-N 3.22Å; P31-L34 PolarHBondContact O-N 3.03Å; L34-T36 PolarHBondContact O-N 3.36Å; L34-L37 PolarHBondContact O-N 3.47Å; L34-W38 WeakPolarHBondContact O-CB 3.38Å; L34-W38 PolarHBondContact O-N 2.95Å
35V98.6Very high98.3Very high97 Ų9767.3 Ų67.359%0.58834%0.342SS*.Hα-helixtrans-58.5-49.3179.3170.70000111P31 F33 T39P31-V35 WeakPolarHBondContact O-CG2 3.33Å; P31-V35 PolarHBondContact O-N 3.41Å; F33-V35 PolarHBondContact O-N 3.05Å; V35-T39 VanDerWaalsContact O-CB 3.26Å; V35-T39 WeakPolarHBondContact O-CB 3.46Å; V35-T39 PolarHBondContact O-N 3.31Å; V35-T39 PolarHBondContact O-OG1 3.45Å
36T98.5Very high98.3Very high19 Ų1973.5 Ų73.512%0.11737%0.37CS..Hα-helixtrans-69.5-38.3-177.5540000112.4L32 F33 L34 C40 S89L32-T36 WeakPolarHBondContact O-CB 3.27Å; L32-T36 WeakPolarHBondContact O-CG2 3.41Å; L32-T36 PolarHBondContact O-N 3.08Å; L32-T36 VanDerWaalsContact O-N 3.07Å; L32-T36 PolarHBondContact O-OG1 2.9Å; F33-T36 PolarHBondContact O-N 3.07Å; F33-T36 PolarHBondContact O-OG1 3.44Å; F33-T36 VanDerWaalsContact O-OG1 3.1Å; L34-T36 PolarHBondContact O-N 3.36Å; T36-C40 VanDerWaalsContact O-CB 3.23Å; T36-C40 WeakPolarHBondContact O-CB 3.24Å; T36-C40 PolarHBondContact O-N 3.25Å; T36-S89 VanDerWaalsContact CG2-OG 3.27Å; T36-S89 WeakPolarHBondContact CG2-OG 3.26Å
37L98.8Very high98.3Very high33 Ų3377.8 Ų77.817%0.17339%0.394CS..Hα-helixtrans-60.5-55.6175.6-179.174.9000111.5F33 L34 T39 C40 G41 A49 L88F33-L37 HydrophobicContact CD2-CB 4.42Å; F33-L37 HydrophobicContact CE1-CD2 4.19Å; F33-L37 HydrophobicContact CE2-CB 4.1Å; F33-L37 HydrophobicContact CE2-CD1 4.1Å; F33-L37 HydrophobicContact CE2-CD2 4.21Å; F33-L37 HydrophobicContact CE2-CG 4.37Å; F33-L37 HydrophobicContact CZ-CB 4.43Å; F33-L37 HydrophobicContact CZ-CD1 4.28Å; F33-L37 HydrophobicContact CZ-CD2 3.73Å; F33-L37 HydrophobicContact CZ-CG 4.38Å; F33-L37 WeakPolarHBondContact O-CB 3.45Å; F33-L37 PolarHBondContact O-N 2.97Å; L34-L37 PolarHBondContact O-N 3.47Å; L37-T39 VanDerWaalsContact C-N 3.34Å; L37-T39 PolarHBondContact O-N 3.43Å; L37-C40 PolarHBondContact O-N 3.26Å; L37-G41 PolarHBondContact O-N 2.98Å; L37-A49 HydrophobicContact CD1-CB 4.26Å; L37-A49 WeakPolarHBondContact CD1-O 3.43Å; L37-L88 HydrophobicContact CB-CD1 4.43Å; L37-L88 HydrophobicContact CD1-CD1 4.4Å; L37-L88 HydrophobicContact CD1-CD2 4.39Å
38W98.8Very high98.3Very high173 Ų17377.9 Ų77.966%0.65539%0.392SS*.Hα-helixtrans-64.7-40.8-178-80.6100.6000111.4L34 G41 M42L34-W38 WeakPolarHBondContact O-CB 3.38Å; L34-W38 PolarHBondContact O-N 2.95Å; W38-G41 PolarHBondContact O-N 2.81Å; W38-M42 WeakPolarHBondContact O-CB 3.45Å; W38-M42 WeakPolarHBondContact O-CG 3.36Å; W38-M42 PolarHBondContact O-N 3.06Å
39T98.6Very high98.3Very high35 Ų3572.5 Ų72.522%0.21537%0.367CS..Hα-helixtrans-64.4-44.7177.7-51.60000111V35 L37 G41 F43 A92 I96V35-T39 VanDerWaalsContact O-CB 3.26Å; V35-T39 WeakPolarHBondContact O-CB 3.46Å; V35-T39 PolarHBondContact O-N 3.31Å; V35-T39 PolarHBondContact O-OG1 3.45Å; L37-T39 VanDerWaalsContact C-N 3.34Å; L37-T39 PolarHBondContact O-N 3.43Å; T39-G41 VanDerWaalsContact C-N 3.34Å; T39-G41 PolarHBondContact O-N 3.49Å; T39-F43 HydrophobicContact CG2-CD2 3.71Å; T39-F43 HydrophobicContact CG2-CE2 4.19Å; T39-F43 WeakPolarHBondContact O-CB 3.34Å; T39-F43 VanDerWaalsContact O-CD2 3.31Å; T39-F43 WeakPolarHBondContact O-CD2 3.39Å; T39-F43 PolarHBondContact O-N 2.75Å; T39-A92 HydrophobicContact CG2-CB 3.72Å; T39-I96 HydrophobicContact CG2-CD1 3.6Å; T39-I96 HydrophobicContact CG2-CG1 4.29Å
40C98.6Very high98.4Very high0 Ų073.2 Ų73.20%038%0.381CS..Hα-helixtrans-62.3-41.6175-178.20000112T36 L37 F44 S45 A49 L88 L91 A92T36-C40 VanDerWaalsContact O-CB 3.23Å; T36-C40 WeakPolarHBondContact O-CB 3.24Å; T36-C40 PolarHBondContact O-N 3.25Å; L37-C40 PolarHBondContact O-N 3.26Å; C40-F44 WeakPolarHBondContact O-CA 3.48Å; C40-F44 WeakPolarHBondContact O-CB 3.36Å; C40-F44 PolarHBondContact O-N 3.28Å; C40-S45 PolarHBondContact O-N 3.31Å; C40-A49 HydrophobicContact CB-CB 4.11Å; C40-L88 HydrophobicContact CB-CD2 4.01Å; C40-L91 VanDerWaalsContact SG-CB 3.53Å; C40-A92 HydrophobicContact CB-CB 4.27Å
41G98.5Very high98.4Very high22 Ų2269.2 Ų69.223%0.22738%0.375CS..Hα-helixtrans-65-42.4-179.300000112.9L37 W38 T39 E46L37-G41 PolarHBondContact O-N 2.98Å; W38-G41 PolarHBondContact O-N 2.81Å; T39-G41 VanDerWaalsContact C-N 3.34Å; T39-G41 PolarHBondContact O-N 3.49Å; G41-E46 PolarHBondContact O-N 2.85Å
42M98.3Very high98.4Very high143 Ų14367 Ų6770%0.70436%0.36SS*.Hα-helixtrans-77.7-38.6-177.8-66.9-65.9-67.200113.3W38W38-M42 WeakPolarHBondContact O-CB 3.45Å; W38-M42 WeakPolarHBondContact O-CG 3.36Å; W38-M42 PolarHBondContact O-N 3.06Å
43F97.4Very high98.4Very high121 Ų12162.3 Ų62.353%0.53134%0.336SS..Hα-helixtrans-104.3-14.1-170.4-66.4-82.3000114.4T39 G95 I96T39-F43 HydrophobicContact CG2-CD2 3.71Å; T39-F43 HydrophobicContact CG2-CE2 4.19Å; T39-F43 WeakPolarHBondContact O-CB 3.34Å; T39-F43 VanDerWaalsContact O-CD2 3.31Å; T39-F43 WeakPolarHBondContact O-CD2 3.39Å; T39-F43 PolarHBondContact O-N 2.75Å; F43-G95 CarbonylContact O-C 3.48Å; F43-G95 WeakPolarHBondContact O-CA 3.31Å; F43-I96 HydrophobicContact CB-CG1 4.1Å; F43-I96 HydrophobicContact CD1-CG1 4.12Å; F43-I96 HydrophobicContact CD2-CG1 4.14Å; F43-I96 HydrophobicContact CG-CG1 3.86Å
44F97.8Very high98.4Very high68 Ų6867 Ų6730%0.29836%0.362SS..THydrogen-bonded Turntrans-126.4-66.4-177.4-172.9-98.3000113.3C40 L48 L91 V94C40-F44 WeakPolarHBondContact O-CA 3.48Å; C40-F44 WeakPolarHBondContact O-CB 3.36Å; C40-F44 PolarHBondContact O-N 3.28Å; F44-L48 HydrophobicContact CD1-CD1 4.33Å; F44-L48 HydrophobicContact CE1-CD1 3.7Å; F44-L91 WeakPolarHBondContact CB-O 3.38Å; F44-L91 HydrophobicContact CD1-CB 3.95Å; F44-L91 HydrophobicContact CD1-CD1 4.23Å; F44-L91 HydrophobicContact CD1-CD2 4.13Å; F44-L91 HydrophobicContact CD1-CG 4.32Å; F44-L91 HydrophobicContact CE1-CB 4.34Å; F44-L91 HydrophobicContact CE1-CD1 4.17Å; F44-L91 HydrophobicContact CE1-CD2 3.63Å; F44-L91 HydrophobicContact CE1-CG 4.25Å; F44-L91 HydrophobicContact CE2-CD2 4.41Å; F44-L91 HydrophobicContact CG-CB 4.18Å; F44-L91 HydrophobicContact CZ-CD2 3.8Å; F44-V94 HydrophobicContact CD2-CB 4.47Å; F44-V94 HydrophobicContact CD2-CG1 4.13Å; F44-V94 HydrophobicContact CE2-CB 4.47Å; F44-V94 HydrophobicContact CE2-CG1 3.84Å
45S98Very high98.4Very high36 Ų3667.6 Ų67.625%0.25237%0.367SS..  trans-164.8119.6-179.6176.40000111.1C40 V47 L48 A49C40-S45 PolarHBondContact O-N 3.31Å; S45-V47 PolarHBondContact O-N 2.95Å; S45-L48 PolarHBondContact O-N 2.9Å; S45-L48 PolarHBondContact OG-N 3.45Å; S45-A49 WeakPolarHBondContact O-CB 3.41Å; S45-A49 PolarHBondContact O-N 3.36Å
46E98.3Very high98.4Very high156 Ų15663.3 Ų63.373%0.72934%0.341SS*.Hα-helixtrans-60.2-44.7177-172179.8168.500112.1G41 L48 A49 A50G41-E46 PolarHBondContact O-N 2.85Å; E46-L48 PolarHBondContact O-N 3.41Å; E46-A49 PolarHBondContact O-N 2.96Å; E46-A50 WeakPolarHBondContact O-CB 3.4Å; E46-A50 PolarHBondContact O-N 3.06Å
47V98.5Very high98.4Very high116 Ų11667.5 Ų67.570%0.70336%0.36SS*.Hα-helixtrans-62.7-45.9-178.6178.30000111.4S45 A50 A51S45-V47 PolarHBondContact O-N 2.95Å; V47-A50 PolarHBondContact O-N 3.49Å; V47-A51 WeakPolarHBondContact O-CB 3.41Å; V47-A51 PolarHBondContact O-N 3.18Å
48L98.1Very high98.4Very high83 Ų8368.4 Ų68.444%0.43537%0.372SS..Hα-helixtrans-69.4-38.2179.5-68.1175.8000111.9F44 S45 E46 T52F44-L48 HydrophobicContact CD1-CD1 4.33Å; F44-L48 HydrophobicContact CE1-CD1 3.7Å; S45-L48 PolarHBondContact O-N 2.9Å; S45-L48 PolarHBondContact OG-N 3.45Å; E46-L48 PolarHBondContact O-N 3.41Å; L48-T52 WeakPolarHBondContact O-CB 3.42Å; L48-T52 PolarHBondContact O-N 2.97Å; L48-T52 PolarHBondContact O-OG1 3.24Å
49A98.5Very high98.4Very high3 Ų360.2 Ų60.23%0.02534%0.341CS..Hα-helixtrans-61.7-49.8174.500000110.9L37 C40 S45 E46 T52 G53 L88L37-A49 HydrophobicContact CD1-CB 4.26Å; L37-A49 WeakPolarHBondContact CD1-O 3.43Å; C40-A49 HydrophobicContact CB-CB 4.11Å; S45-A49 WeakPolarHBondContact O-CB 3.41Å; S45-A49 PolarHBondContact O-N 3.36Å; E46-A49 PolarHBondContact O-N 2.96Å; A49-T52 PolarHBondContact O-N 3.25Å; A49-G53 PolarHBondContact O-N 3.21Å; A49-L88 HydrophobicContact CB-CD2 4.5Å
50A98.6Very high98.3Very high56 Ų5659.4 Ų59.446%0.46333%0.334SS..Hα-helixtrans-60.9-49.417900000112.1E46 V47 T52 G53 L54E46-A50 WeakPolarHBondContact O-CB 3.4Å; E46-A50 PolarHBondContact O-N 3.06Å; V47-A50 PolarHBondContact O-N 3.49Å; A50-T52 VanDerWaalsContact C-N 3.33Å; A50-T52 PolarHBondContact O-N 3.04Å; A50-G53 PolarHBondContact O-N 3.42Å; A50-G53 VanDerWaalsContact O-N 3.17Å; A50-L54 WeakPolarHBondContact O-CG 3.45Å; A50-L54 PolarHBondContact O-N 2.64Å
51A98.6Very high98.3Very high48 Ų4864.8 Ų64.840%0.39736%0.359SS..Hα-helixtrans-58.8-45.6178.500000111.6V47 G53 L54 V55V47-A51 WeakPolarHBondContact O-CB 3.41Å; V47-A51 PolarHBondContact O-N 3.18Å; A51-G53 VanDerWaalsContact C-N 3.33Å; A51-G53 PolarHBondContact O-N 3.49Å; A51-L54 WeakPolarHBondContact O-CB 3.26Å; A51-L54 PolarHBondContact O-N 3.01Å; A51-V55 PolarHBondContact O-N 3.42Å
52T98.3Very high98.3Very high27 Ų2768.9 Ų68.917%0.16638%0.375CS..Hα-helixtrans-68.2-33.6178.6-57.70000111.7L48 A49 A50 V55 Y56 V84 L88L48-T52 WeakPolarHBondContact O-CB 3.42Å; L48-T52 PolarHBondContact O-N 2.97Å; L48-T52 PolarHBondContact O-OG1 3.24Å; A49-T52 PolarHBondContact O-N 3.25Å; A50-T52 VanDerWaalsContact C-N 3.33Å; A50-T52 PolarHBondContact O-N 3.04Å; T52-V55 WeakPolarHBondContact O-CB 3.3Å; T52-V55 PolarHBondContact O-N 3.45Å; T52-Y56 PolarHBondContact O-N 3.45Å; T52-V84 HydrophobicContact CG2-CG1 3.67Å; T52-L88 HydrophobicContact CG2-CD1 4.3Å; T52-L88 HydrophobicContact CG2-CD2 3.83Å; T52-L88 HydrophobicContact CG2-CG 3.74Å
53G98.4Very high98.3Very high4 Ų462.1 Ų62.14%0.04134%0.342CS..Hα-helixtrans-64.5-36.7172.200000113.7A49 A50 A51 V55 Y56 M57A49-G53 PolarHBondContact O-N 3.21Å; A50-G53 PolarHBondContact O-N 3.42Å; A50-G53 VanDerWaalsContact O-N 3.17Å; A51-G53 VanDerWaalsContact C-N 3.33Å; A51-G53 PolarHBondContact O-N 3.49Å; G53-V55 VanDerWaalsContact C-N 3.32Å; G53-V55 PolarHBondContact O-N 2.9Å; G53-Y56 WeakPolarHBondContact O-CB 3.43Å; G53-Y56 PolarHBondContact O-N 3.07Å; G53-M57 PolarHBondContact O-N 3.21Å; G53-M57 VanDerWaalsContact O-N 3.11Å
54L98.7Very high98.3Very high113 Ų11359 Ų5959%0.59233%0.329SS*.Hα-helixtrans-62.4-41.5171-64.9179.9000111.2A50 A51 Y56 M57 A58A50-L54 WeakPolarHBondContact O-CG 3.45Å; A50-L54 PolarHBondContact O-N 2.64Å; A51-L54 WeakPolarHBondContact O-CB 3.26Å; A51-L54 PolarHBondContact O-N 3.01Å; L54-Y56 VanDerWaalsContact C-N 3.32Å; L54-Y56 PolarHBondContact O-N 3.48Å; L54-M57 HydrophobicContact CD2-CE 3.37Å; L54-M57 HydrophobicContact CG-CE 4.5Å; L54-M57 PolarHBondContact O-N 3.11Å; L54-A58 PolarHBondContact O-N 2.98Å
55V98.6Very high98.3Very high66 Ų6658.9 Ų58.940%0.433%0.331SS..Hα-helixtrans-62.9-39.1175.4-177.60000111.1A51 T52 G53 M57 A58 A59 L80 V84A51-V55 PolarHBondContact O-N 3.42Å; T52-V55 WeakPolarHBondContact O-CB 3.3Å; T52-V55 PolarHBondContact O-N 3.45Å; G53-V55 VanDerWaalsContact C-N 3.32Å; G53-V55 PolarHBondContact O-N 2.9Å; V55-M57 VanDerWaalsContact C-N 3.35Å; V55-M57 PolarHBondContact O-N 3.45Å; V55-A58 PolarHBondContact O-N 3.08Å; V55-A59 WeakPolarHBondContact O-CB 3.13Å; V55-A59 PolarHBondContact O-N 3.28Å; V55-L80 HydrophobicContact CG1-CD1 4.28Å; V55-L80 HydrophobicContact CG1-CD2 4.45Å; V55-V84 HydrophobicContact CB-CG2 4.21Å; V55-V84 HydrophobicContact CG1-CG2 3.71Å
56Y98.6Very high98.2Very high8 Ų857.7 Ų57.73%0.03132%0.324CS..Hα-helixtrans-56.6-47.3172.7179.3-91.9000111.9F29 F33 T52 G53 L54 A58 A59 R60 T81 V84 L85F29-Y56 PolarHBondContact O-OH 3.07Å; F33-Y56 HydrophobicContact CB-CD1 4.42Å; F33-Y56 HydrophobicContact CB-CD2 4.37Å; F33-Y56 HydrophobicContact CB-CE1 3.86Å; F33-Y56 HydrophobicContact CB-CE2 3.76Å; F33-Y56 VanDerWaalsContact CB-CZ 3.48Å; F33-Y56 AromaticContact CD1-CD1 3.73Å; F33-Y56 HydrophobicContact CD1-CD1 3.73Å; F33-Y56 AromaticContact CD1-CE1 3.57Å; F33-Y56 HydrophobicContact CD1-CE1 3.57Å; F33-Y56 HydrophobicContact CD1-CG 4.45Å; F33-Y56 AromaticContact CD2-CD1 3.62Å; F33-Y56 HydrophobicContact CD2-CD1 3.62Å; F33-Y56 AromaticContact CD2-CD2 3.66Å; F33-Y56 HydrophobicContact CD2-CD2 3.66Å; F33-Y56 AromaticContact CD2-CE1 3.94Å; F33-Y56 HydrophobicContact CD2-CE1 3.94Å; F33-Y56 AromaticContact CD2-CE2 3.94Å; F33-Y56 HydrophobicContact CD2-CE2 3.94Å; F33-Y56 AromaticContact CD2-CG 3.48Å; F33-Y56 HydrophobicContact CD2-CG 3.48Å; F33-Y56 VanDerWaalsContact CD2-CG 3.48Å; F33-Y56 AromaticContact CE1-CD1 3.79Å; F33-Y56 HydrophobicContact CE1-CD1 3.79Å; F33-Y56 HydrophobicContact CE1-CE1 4.06Å; F33-Y56 AromaticContact CE2-CD1 3.69Å; F33-Y56 HydrophobicContact CE2-CD1 3.69Å; F33-Y56 HydrophobicContact CE2-CD2 4.19Å; F33-Y56 HydrophobicContact CE2-CE1 4.41Å; F33-Y56 AromaticContact CE2-CG 3.57Å; F33-Y56 HydrophobicContact CE2-CG 3.57Å; F33-Y56 AromaticContact CG-CD1 3.63Å; F33-Y56 HydrophobicContact CG-CD1 3.63Å; F33-Y56 HydrophobicContact CG-CD2 4.08Å; F33-Y56 AromaticContact CG-CE1 3.48Å; F33-Y56 HydrophobicContact CG-CE1 3.48Å; F33-Y56 VanDerWaalsContact CG-CE1 3.48Å; F33-Y56 AromaticContact CG-CE2 3.91Å; F33-Y56 HydrophobicContact CG-CE2 3.91Å; F33-Y56 AromaticContact CG-CG 3.94Å; F33-Y56 HydrophobicContact CG-CG 3.94Å; F33-Y56 AromaticContact CG-CZ 3.62Å; F33-Y56 AromaticContact CZ-CD1 3.76Å; F33-Y56 HydrophobicContact CZ-CD1 3.76Å; F33-Y56 HydrophobicContact CZ-CE1 4.44Å; F33-Y56 HydrophobicContact CZ-CG 4.09Å; T52-Y56 PolarHBondContact O-N 3.45Å; G53-Y56 WeakPolarHBondContact O-CB 3.43Å; G53-Y56 PolarHBondContact O-N 3.07Å; L54-Y56 VanDerWaalsContact C-N 3.32Å; L54-Y56 PolarHBondContact O-N 3.48Å; Y56-A58 PolarHBondContact O-N 2.85Å; Y56-A59 WeakPolarHBondContact O-CB 3.34Å; Y56-A59 PolarHBondContact O-N 3.44Å; Y56-R60 HydrophobicContact CD1-CG 4.02Å; Y56-R60 HydrophobicContact CE1-CG 3.55Å; Y56-R60 HydrophobicContact CE2-CG 4.33Å; Y56-R60 WeakPolarHBondContact O-CG 3.22Å; Y56-R60 PolarHBondContact O-N 3.39Å; Y56-R60 PolarHBondContact OH-NE 3.1Å; Y56-T81 HydrophobicContact CD2-CG2 3.85Å; Y56-T81 HydrophobicContact CE2-CG2 3.42Å; Y56-T81 VanDerWaalsContact CE2-CG2 3.42Å; Y56-V84 HydrophobicContact CD2-CG1 4.15Å; Y56-V84 HydrophobicContact CG-CG1 4.43Å; Y56-L85 HydrophobicContact CD2-CD2 4.21Å; Y56-L85 HydrophobicContact CD2-CG 4.27Å; Y56-L85 HydrophobicContact CE2-CD1 4.18Å; Y56-L85 HydrophobicContact CE2-CD2 3.86Å; Y56-L85 HydrophobicContact CE2-CG 3.98Å
57M98.4Very high98.1Very high107 Ų10751.3 Ų51.353%0.52729%0.293SS..Hα-helixtrans-62.5-43179.9-68.6-167.1-71.600111.6G53 L54 V55 R60 Q61G53-M57 PolarHBondContact O-N 3.21Å; G53-M57 VanDerWaalsContact O-N 3.11Å; L54-M57 HydrophobicContact CD2-CE 3.37Å; L54-M57 HydrophobicContact CG-CE 4.5Å; L54-M57 PolarHBondContact O-N 3.11Å; V55-M57 VanDerWaalsContact C-N 3.35Å; V55-M57 PolarHBondContact O-N 3.45Å; M57-R60 PolarHBondContact O-N 3Å; M57-Q61 PolarHBondContact O-N 3.34Å
58A98.6Very high97.8Very high52 Ų5247.9 Ų47.943%0.4327%0.273SS..Hα-helixtrans-62.6-43174.400000112.1L54 V55 Y56 R60 Q61 L62L54-A58 PolarHBondContact O-N 2.98Å; V55-A58 PolarHBondContact O-N 3.08Å; Y56-A58 PolarHBondContact O-N 2.85Å; A58-R60 VanDerWaalsContact C-N 3.32Å; A58-R60 PolarHBondContact O-N 2.93Å; A58-Q61 PolarHBondContact O-N 2.89Å; A58-L62 WeakPolarHBondContact O-CG 3.47Å; A58-L62 PolarHBondContact O-N 3.23Å
59A98.3Very high97.6Very high0 Ų049.8 Ų49.80%028%0.28CS..Hα-helixtrans-60.9-40.7176.700000112.1V55 Y56 L62 Y63 L80V55-A59 WeakPolarHBondContact O-CB 3.13Å; V55-A59 PolarHBondContact O-N 3.28Å; Y56-A59 WeakPolarHBondContact O-CB 3.34Å; Y56-A59 PolarHBondContact O-N 3.44Å; A59-L62 PolarHBondContact O-N 3.47Å; A59-Y63 WeakPolarHBondContact O-CB 3.27Å; A59-Y63 PolarHBondContact O-N 3.37Å; A59-L80 HydrophobicContact CB-CB 3.96Å; A59-L80 HydrophobicContact CB-CD2 3.64Å; A59-L80 HydrophobicContact CB-CG 3.61Å
60R98.2Very high97.3Very high19 Ų1951.6 Ų51.67%0.07229%0.292CS..Hα-helixtrans-67-38.7176.3-77.1-68.7-179.7-162.2-15.5112.6N25 F29 Y56 M57 A58 Y63 F64N25-R60 PolarHBondContact OD1-NH1 3.25Å; F29-R60 VanDerWaalsContact CD1-NH2 3.32Å; Y56-R60 HydrophobicContact CD1-CG 4.02Å; Y56-R60 HydrophobicContact CE1-CG 3.55Å; Y56-R60 HydrophobicContact CE2-CG 4.33Å; Y56-R60 WeakPolarHBondContact O-CG 3.22Å; Y56-R60 PolarHBondContact O-N 3.39Å; Y56-R60 PolarHBondContact OH-NE 3.1Å; M57-R60 PolarHBondContact O-N 3Å; A58-R60 VanDerWaalsContact C-N 3.32Å; A58-R60 PolarHBondContact O-N 2.93Å; R60-Y63 PolarHBondContact O-N 2.99Å; R60-F64 WeakPolarHBondContact O-CB 3.23Å; R60-F64 PolarHBondContact O-N 3.26Å
61Q98Very high96.9Very high112 Ų11252 Ų5252%0.52329%0.289SS..Hα-helixtrans-63.3-43.9174-172.462.211.700111.3M57 A58 N65M57-Q61 PolarHBondContact O-N 3.34Å; A58-Q61 PolarHBondContact O-N 2.89Å; Q61-N65 PolarHBondContact NE2-ND2 2.89Å; Q61-N65 WeakPolarHBondContact O-CB 3.46Å; Q61-N65 VanDerWaalsContact O-CG 3.24Å; Q61-N65 PolarHBondContact O-N 3.33Å; Q61-N65 PolarHBondContact O-ND2 3.29Å
62L97.9Very high96.6Very high108 Ų10857.9 Ų57.957%0.56531%0.305SS*.Hα-helixtrans-62.8-44174.7-69.9171.9000112.1A58 A59 G66A58-L62 WeakPolarHBondContact O-CG 3.47Å; A58-L62 PolarHBondContact O-N 3.23Å; A59-L62 PolarHBondContact O-N 3.47Å; L62-G66 PolarHBondContact O-N 2.99Å
63Y98.1Very high96.5Very high2 Ų262 Ų621%0.00832%0.321CS..Hα-helixtrans-58.8-52176.9173.1-97.5000111.3A22 N25 A59 R60 G66 Y67 R74 F78A22-Y63 HydrophobicContact CB-CE1 4.48Å; N25-Y63 HydrophobicContact CB-CE1 4.09Å; N25-Y63 PolarHBondContact OD1-OH 3.31Å; A59-Y63 WeakPolarHBondContact O-CB 3.27Å; A59-Y63 PolarHBondContact O-N 3.37Å; R60-Y63 PolarHBondContact O-N 2.99Å; Y63-G66 PolarHBondContact O-N 2.68Å; Y63-Y67 AromaticContact CE1-CD1 3.94Å; Y63-Y67 HydrophobicContact CE1-CD1 3.94Å; Y63-Y67 HydrophobicContact CE2-CD1 4.32Å; Y63-Y67 AromaticContact CZ-CD1 3.64Å; Y63-Y67 WeakPolarHBondContact O-CB 3.4Å; Y63-Y67 PolarHBondContact O-N 2.94Å; Y63-Y67 WeakPolarHBondContact OH-CD1 3.34Å; Y63-Y67 WeakPolarHBondContact OH-CE1 3.3Å; Y63-R74 HydrophobicContact CD2-CB 3.92Å; Y63-R74 HydrophobicContact CD2-CG 4.45Å; Y63-R74 VanDerWaalsContact CD2-O 3.3Å; Y63-R74 WeakPolarHBondContact CD2-O 3.29Å; Y63-R74 HydrophobicContact CE2-CB 3.77Å; Y63-R74 HydrophobicContact CE2-CG 3.92Å; Y63-F78 HydrophobicContact CD2-CB 3.62Å; Y63-F78 HydrophobicContact CD2-CD2 4.09Å; Y63-F78 HydrophobicContact CD2-CG 4.34Å; Y63-F78 HydrophobicContact CE2-CB 3.76Å; Y63-F78 AromaticContact CE2-CD2 3.62Å; Y63-F78 HydrophobicContact CE2-CD2 3.62Å; Y63-F78 HydrophobicContact CE2-CG 4.06Å
64F97.9Very high96.3Very high56 Ų5665.4 Ų65.425%0.24633%0.333CS..Hα-helixtrans-63.2-52.4-175.3-169.3-87000110.8T19 A22 H23 R60 G66 Y67 T68T19-F64 HydrophobicContact CG2-CE1 4.48Å; T19-F64 HydrophobicContact CG2-CZ 3.91Å; A22-F64 HydrophobicContact CB-CD2 3.64Å; A22-F64 HydrophobicContact CB-CE2 3.81Å; A22-F64 HydrophobicContact CB-CG 4.35Å; H23-F64 HydrophobicContact CB-CE2 4Å; R60-F64 WeakPolarHBondContact O-CB 3.23Å; R60-F64 PolarHBondContact O-N 3.26Å; F64-G66 VanDerWaalsContact C-N 3.3Å; F64-G66 PolarHBondContact O-N 3.42Å; F64-Y67 PolarHBondContact O-N 3.35Å; F64-Y67 VanDerWaalsContact O-N 3.14Å; F64-T68 HydrophobicContact CD1-CG2 4Å; F64-T68 HydrophobicContact CE1-CG2 3.73Å; F64-T68 HydrophobicContact CZ-CG2 4.27Å; F64-T68 WeakPolarHBondContact O-CG2 3.32Å; F64-T68 PolarHBondContact O-N 3.49Å; F64-T68 PolarHBondContact O-OG1 2.86Å
65N97.1Very high96.3Very high65 Ų6563.8 Ų63.835%0.34832%0.324SS..Hα-helixtrans-63.8-34.9180-66.3-17.8000112.8Q61 T68 Q69Q61-N65 PolarHBondContact NE2-ND2 2.89Å; Q61-N65 WeakPolarHBondContact O-CB 3.46Å; Q61-N65 VanDerWaalsContact O-CG 3.24Å; Q61-N65 PolarHBondContact O-N 3.33Å; Q61-N65 PolarHBondContact O-ND2 3.29Å; N65-T68 PolarHBondContact O-OG1 3.3Å; N65-Q69 WeakPolarHBondContact O-CG 3.34Å
66G96.6Very high96.2Very high10 Ų1065 Ų6510%0.10333%0.333CS..Hα-helixtrans-65.4-4617400000111.3L62 Y63 F64 Q69 S70 K73L62-G66 PolarHBondContact O-N 2.99Å; Y63-G66 PolarHBondContact O-N 2.68Å; F64-G66 VanDerWaalsContact C-N 3.3Å; F64-G66 PolarHBondContact O-N 3.42Å; G66-Q69 PolarHBondContact O-N 2.94Å; G66-S70 PolarHBondContact O-N 3.29Å; G66-S70 VanDerWaalsContact O-N 3.07Å; G66-K73 VanDerWaalsContact O-CB 3.26Å; G66-K73 WeakPolarHBondContact O-CB 3.34Å
67Y96Very high96.1Very high22 Ų2264.7 Ų64.79%0.08633%0.333CS..Hα-helixtrans-67-39.4-176.9-155.5170.1000112.3Q18 R21 A22 Y63 F64 Q69 S70 T71 R74Q18-Y67 HydrophobicContact CB-CD2 4.37Å; Q18-Y67 HydrophobicContact CB-CE2 4.45Å; Q18-Y67 HydrophobicContact CG-CD2 4.45Å; Q18-Y67 HydrophobicContact CG-CE2 4.28Å; Q18-Y67 PolarHBondContact OE1-O 3.29Å; R21-Y67 HydrophobicContact CB-CE1 4.37Å; A22-Y67 HydrophobicContact CB-CD1 3.63Å; A22-Y67 HydrophobicContact CB-CE1 4.41Å; A22-Y67 HydrophobicContact CB-CG 3.99Å; Y63-Y67 AromaticContact CE1-CD1 3.94Å; Y63-Y67 HydrophobicContact CE1-CD1 3.94Å; Y63-Y67 HydrophobicContact CE2-CD1 4.32Å; Y63-Y67 AromaticContact CZ-CD1 3.64Å; Y63-Y67 WeakPolarHBondContact O-CB 3.4Å; Y63-Y67 PolarHBondContact O-N 2.94Å; Y63-Y67 WeakPolarHBondContact OH-CD1 3.34Å; Y63-Y67 WeakPolarHBondContact OH-CE1 3.3Å; F64-Y67 PolarHBondContact O-N 3.35Å; F64-Y67 VanDerWaalsContact O-N 3.14Å; Y67-Q69 PolarHBondContact O-N 3.29Å; Y67-Q69 VanDerWaalsContact O-N 3.16Å; Y67-S70 CarbonylContact O-C 3.59Å; Y67-S70 PolarHBondContact O-N 2.9Å; Y67-T71 HydrophobicContact CE2-CG2 4.13Å; Y67-R74 HydrophobicContact CD1-CB 4.05Å; Y67-R74 HydrophobicContact CD1-CG 4.43Å; Y67-R74 HydrophobicContact CD2-CB 4.24Å; Y67-R74 HydrophobicContact CG-CB 3.72Å; Y67-R74 HydrophobicContact CG-CG 4.35Å; Y67-R74 PolarHBondContact OH-NH1 3.05Å
68T93.2Very high96.1Very high44 Ų4462.3 Ų62.327%0.2732%0.319SS..Hα-helixtrans-63.8-19.817758.10000113.3T19 F64 N65T19-T68 HydrophobicContact CG2-CG2 4.14Å; F64-T68 HydrophobicContact CD1-CG2 4Å; F64-T68 HydrophobicContact CE1-CG2 3.73Å; F64-T68 HydrophobicContact CZ-CG2 4.27Å; F64-T68 WeakPolarHBondContact O-CG2 3.32Å; F64-T68 PolarHBondContact O-N 3.49Å; F64-T68 PolarHBondContact O-OG1 2.86Å; N65-T68 PolarHBondContact O-OG1 3.3Å
69Q92.3Very high96.1Very high124 Ų12465.1 Ų65.158%0.57932%0.324SS*.Hα-helixtrans-91.8-37175-65.8175.925.900112.8N65 G66 Y67 K73N65-Q69 WeakPolarHBondContact O-CG 3.34Å; G66-Q69 PolarHBondContact O-N 2.94Å; Y67-Q69 PolarHBondContact O-N 3.29Å; Y67-Q69 VanDerWaalsContact O-N 3.16Å; Q69-K73 HydrophobicContact CB-CD 4.03Å
70S93Very high96.1Very high40 Ų4068.3 Ų68.328%0.2834%0.34SS..  trans-169.8140.3-176.71700000111G66 Y67 K72 K73G66-S70 PolarHBondContact O-N 3.29Å; G66-S70 VanDerWaalsContact O-N 3.07Å; Y67-S70 CarbonylContact O-C 3.59Å; Y67-S70 PolarHBondContact O-N 2.9Å; S70-K72 PolarHBondContact O-N 3.48Å; S70-K72 VanDerWaalsContact O-N 3.08Å; S70-K72 PolarHBondContact OG-N 2.99Å; S70-K73 PolarHBondContact O-N 3.35Å
71T89.9Confident96.1Very high66 Ų6667.5 Ų67.541%0.40534%0.337SS..THydrogen-bonded Turntrans-53.9-31173.6-49.70000113.8Y67 R74Y67-T71 HydrophobicContact CE2-CG2 4.13Å; T71-R74 WeakPolarHBondContact O-CD 3.31Å; T71-R74 VanDerWaalsContact O-CG 3.24Å; T71-R74 WeakPolarHBondContact O-CG 3.22Å; T71-R74 PolarHBondContact O-NE 2.97Å
72K93.4Very high96.1Very high170 Ų17065.8 Ų65.874%0.73933%0.331SS*.THydrogen-bonded Turntrans-78.1-33.1179.6-66.3-174.4-179.4-178.50112.5S70 R74 L75S70-K72 PolarHBondContact O-N 3.48Å; S70-K72 VanDerWaalsContact O-N 3.08Å; S70-K72 PolarHBondContact OG-N 2.99Å; K72-R74 PolarHBondContact O-N 3.38Å; K72-L75 WeakPolarHBondContact O-CG 3.39Å; K72-L75 PolarHBondContact O-N 2.94Å
73K94.8Very high96.1Very high115 Ų11562.9 Ų62.950%0.532%0.323SS..THydrogen-bonded Turntrans-71.4-11.6-177.2-77.2-178.1171.8-179.90113.6G66 Q69 S70 L75 P76G66-K73 VanDerWaalsContact O-CB 3.26Å; G66-K73 WeakPolarHBondContact O-CB 3.34Å; Q69-K73 HydrophobicContact CB-CD 4.03Å; S70-K73 PolarHBondContact O-N 3.35Å; K73-L75 VanDerWaalsContact C-N 3.31Å; K73-L75 PolarHBondContact O-N 3.47Å; K73-P76 WeakPolarHBondContact O-CD 3.46Å
74R95.5Very high96.1Very high75 Ų7563.2 Ų63.228%0.28333%0.325SS..THydrogen-bonded Turntrans-70.1-24.9174.883.7-169.3173.91570.1113.7Y63 Y67 T71 K72 G77 F78Y63-R74 HydrophobicContact CD2-CB 3.92Å; Y63-R74 HydrophobicContact CD2-CG 4.45Å; Y63-R74 VanDerWaalsContact CD2-O 3.3Å; Y63-R74 WeakPolarHBondContact CD2-O 3.29Å; Y63-R74 HydrophobicContact CE2-CB 3.77Å; Y63-R74 HydrophobicContact CE2-CG 3.92Å; Y67-R74 HydrophobicContact CD1-CB 4.05Å; Y67-R74 HydrophobicContact CD1-CG 4.43Å; Y67-R74 HydrophobicContact CD2-CB 4.24Å; Y67-R74 HydrophobicContact CG-CB 3.72Å; Y67-R74 HydrophobicContact CG-CG 4.35Å; Y67-R74 PolarHBondContact OH-NH1 3.05Å; T71-R74 WeakPolarHBondContact O-CD 3.31Å; T71-R74 VanDerWaalsContact O-CG 3.24Å; T71-R74 WeakPolarHBondContact O-CG 3.22Å; T71-R74 PolarHBondContact O-NE 2.97Å; K72-R74 PolarHBondContact O-N 3.38Å; R74-G77 PolarHBondContact O-N 3.34Å; R74-F78 WeakPolarHBondContact O-CB 3.4Å; R74-F78 PolarHBondContact O-N 3.39Å
75L97Very high96.2Very high78 Ų7861.2 Ų61.241%0.40832%0.317SS..Hα-helixtrans-60.7-44.5-166.9-64.9174.1000114.2K72 K73 G77 F78 H79K72-L75 WeakPolarHBondContact O-CG 3.39Å; K72-L75 PolarHBondContact O-N 2.94Å; K73-L75 VanDerWaalsContact C-N 3.31Å; K73-L75 PolarHBondContact O-N 3.47Å; L75-G77 PolarHBondContact O-N 3.46Å; L75-F78 WeakPolarHBondContact O-CB 3.32Å; L75-F78 PolarHBondContact O-N 3Å; L75-H79 PolarHBondContact O-CD2 3.35Å; L75-H79 PolarHBondContact O-N 2.89Å
76P97.4Very high96.2Very high92 Ų9262.9 Ų62.960%0.59733%0.326SS*.Hα-helixtrans-60.3-47.6-179.4-24.635.8000113K73 F78 H79 L80K73-P76 WeakPolarHBondContact O-CD 3.46Å; P76-F78 VanDerWaalsContact C-N 3.29Å; P76-F78 PolarHBondContact O-N 2.94Å; P76-H79 PolarHBondContact O-N 2.93Å; P76-L80 PolarHBondContact O-N 3.38Å
77G97.1Very high96.3Very high2 Ų265.7 Ų65.72%0.02134%0.341CS..Hα-helixtrans-64.9-33.9176.300000112.7R74 L75 T81R74-G77 PolarHBondContact O-N 3.34Å; L75-G77 PolarHBondContact O-N 3.46Å; G77-T81 WeakPolarHBondContact O-CB 3.47Å; G77-T81 PolarHBondContact O-N 3.05Å; G77-T81 PolarHBondContact O-OG1 3.46Å
78F97.5Very high96.5Very high56 Ų5664.7 Ų64.725%0.24634%0.337CS..Hα-helixtrans-65.1-48.6175.5-170.9-108.3000112F29 Y63 R74 L75 P76 L80 T81 L82F29-F78 HydrophobicContact CE2-CE2 4.3Å; F29-F78 HydrophobicContact CZ-CE2 4.1Å; F29-F78 HydrophobicContact CZ-CZ 4.36Å; Y63-F78 HydrophobicContact CD2-CB 3.62Å; Y63-F78 HydrophobicContact CD2-CD2 4.09Å; Y63-F78 HydrophobicContact CD2-CG 4.34Å; Y63-F78 HydrophobicContact CE2-CB 3.76Å; Y63-F78 AromaticContact CE2-CD2 3.62Å; Y63-F78 HydrophobicContact CE2-CD2 3.62Å; Y63-F78 HydrophobicContact CE2-CG 4.06Å; R74-F78 WeakPolarHBondContact O-CB 3.4Å; R74-F78 PolarHBondContact O-N 3.39Å; L75-F78 WeakPolarHBondContact O-CB 3.32Å; L75-F78 PolarHBondContact O-N 3Å; P76-F78 VanDerWaalsContact C-N 3.29Å; P76-F78 PolarHBondContact O-N 2.94Å; F78-L80 PolarHBondContact O-N 3.46Å; F78-T81 WeakPolarHBondContact O-CB 3.34Å; F78-T81 PolarHBondContact O-N 3.29Å; F78-L82 PolarHBondContact O-N 3.06Å
79H98.3Very high96.7Very high112 Ų11264.6 Ų64.652%0.51934%0.338SS..Hα-helixtrans-63.8-41.4178.9-71.8-56.9000112L75 P76 T81 L82 A83L75-H79 PolarHBondContact O-CD2 3.35Å; L75-H79 PolarHBondContact O-N 2.89Å; P76-H79 PolarHBondContact O-N 2.93Å; H79-T81 VanDerWaalsContact C-N 3.31Å; H79-T81 PolarHBondContact O-N 2.8Å; H79-L82 PolarHBondContact O-N 3.26Å; H79-A83 PolarHBondContact O-N 3.25Å
80L98.4Very high97Very high67 Ų6762.9 Ų62.935%0.35134%0.336SS..Hα-helixtrans-62.4-41.1174.6-177.959.7000111.3V55 A59 P76 F78 L82 A83 V84V55-L80 HydrophobicContact CG1-CD1 4.28Å; V55-L80 HydrophobicContact CG1-CD2 4.45Å; A59-L80 HydrophobicContact CB-CB 3.96Å; A59-L80 HydrophobicContact CB-CD2 3.64Å; A59-L80 HydrophobicContact CB-CG 3.61Å; P76-L80 PolarHBondContact O-N 3.38Å; F78-L80 PolarHBondContact O-N 3.46Å; L80-L82 VanDerWaalsContact C-N 3.33Å; L80-L82 PolarHBondContact O-N 2.97Å; L80-A83 PolarHBondContact O-N 3.49Å; L80-V84 HydrophobicContact CD1-CG2 4.38Å; L80-V84 VanDerWaalsContact O-CG2 3.29Å; L80-V84 WeakPolarHBondContact O-CG2 3.12Å; L80-V84 PolarHBondContact O-N 3.33Å
81T98.4Very high97.3Very high1 Ų162.7 Ų62.71%0.00633%0.332CS..Hα-helixtrans-60.4-44.2175.4-58.70000111.7Y56 G77 F78 H79 V84 L85Y56-T81 HydrophobicContact CD2-CG2 3.85Å; Y56-T81 HydrophobicContact CE2-CG2 3.42Å; Y56-T81 VanDerWaalsContact CE2-CG2 3.42Å; G77-T81 WeakPolarHBondContact O-CB 3.47Å; G77-T81 PolarHBondContact O-N 3.05Å; G77-T81 PolarHBondContact O-OG1 3.46Å; F78-T81 WeakPolarHBondContact O-CB 3.34Å; F78-T81 PolarHBondContact O-N 3.29Å; H79-T81 VanDerWaalsContact C-N 3.31Å; H79-T81 PolarHBondContact O-N 2.8Å; T81-V84 PolarHBondContact O-N 2.92Å; T81-L85 HydrophobicContact CG2-CD1 4.02Å; T81-L85 HydrophobicContact CG2-CG 4.44Å; T81-L85 WeakPolarHBondContact O-CG 3.34Å; T81-L85 PolarHBondContact O-N 3.27Å
82L98.3Very high97.7Very high76 Ų7659.9 Ų59.940%0.39832%0.315SS..Hα-helixtrans-64-43.6178.5-17563.4000111.5F78 H79 L80 V84 L85 L86F78-L82 PolarHBondContact O-N 3.06Å; H79-L82 PolarHBondContact O-N 3.26Å; L80-L82 VanDerWaalsContact C-N 3.33Å; L80-L82 PolarHBondContact O-N 2.97Å; L82-V84 VanDerWaalsContact C-N 3.35Å; L82-V84 PolarHBondContact O-N 3.29Å; L82-L85 PolarHBondContact O-N 3.48Å; L82-L86 HydrophobicContact CG-CD1 4.18Å; L82-L86 WeakPolarHBondContact O-CB 3.29Å; L82-L86 WeakPolarHBondContact O-CG 3.25Å; L82-L86 PolarHBondContact O-N 3.49Å
83A98.6Very high97.9Very high48 Ų4856.1 Ų56.140%0.39731%0.306SS..Hα-helixtrans-58.6-47.1176.100000111.3H79 L80 L85 L86 T87H79-A83 PolarHBondContact O-N 3.25Å; L80-A83 PolarHBondContact O-N 3.49Å; A83-L85 PolarHBondContact O-N 2.95Å; A83-L86 PolarHBondContact O-N 3Å; A83-T87 PolarHBondContact O-N 3.46Å; A83-T87 PolarHBondContact O-OG1 3Å; A83-T87 VanDerWaalsContact O-OG1 3.05Å
84V98.5Very high98.1Very high9 Ų953.1 Ų53.16%0.05530%0.297CS..Hα-helixtrans-60.8-45.7178168.20000112.1T52 V55 Y56 L80 T81 L82 L86 T87 L88T52-V84 HydrophobicContact CG2-CG1 3.67Å; V55-V84 HydrophobicContact CB-CG2 4.21Å; V55-V84 HydrophobicContact CG1-CG2 3.71Å; Y56-V84 HydrophobicContact CD2-CG1 4.15Å; Y56-V84 HydrophobicContact CG-CG1 4.43Å; L80-V84 HydrophobicContact CD1-CG2 4.38Å; L80-V84 VanDerWaalsContact O-CG2 3.29Å; L80-V84 WeakPolarHBondContact O-CG2 3.12Å; L80-V84 PolarHBondContact O-N 3.33Å; T81-V84 PolarHBondContact O-N 2.92Å; L82-V84 VanDerWaalsContact C-N 3.35Å; L82-V84 PolarHBondContact O-N 3.29Å; V84-L86 VanDerWaalsContact C-N 3.35Å; V84-L86 PolarHBondContact O-N 3.44Å; V84-T87 PolarHBondContact O-N 3.33Å; V84-L88 HydrophobicContact CG1-CD1 4.21Å; V84-L88 PolarHBondContact O-N 3.27Å
85L98.6Very high98.1Very high13 Ų1349.7 Ų49.77%0.06829%0.286CS..Hα-helixtrans-63.9-40.2178-72.7172.1000112.2F29 F33 Y56 T81 L82 A83 S89F29-L85 HydrophobicContact CD1-CD1 3.49Å; F29-L85 VanDerWaalsContact CD1-CD1 3.49Å; F29-L85 HydrophobicContact CE1-CD1 3.89Å; F33-L85 HydrophobicContact CB-CD2 3.96Å; F33-L85 HydrophobicContact CD2-CD2 4.41Å; Y56-L85 HydrophobicContact CD2-CD2 4.21Å; Y56-L85 HydrophobicContact CD2-CG 4.27Å; Y56-L85 HydrophobicContact CE2-CD1 4.18Å; Y56-L85 HydrophobicContact CE2-CD2 3.86Å; Y56-L85 HydrophobicContact CE2-CG 3.98Å; T81-L85 HydrophobicContact CG2-CD1 4.02Å; T81-L85 HydrophobicContact CG2-CG 4.44Å; T81-L85 WeakPolarHBondContact O-CG 3.34Å; T81-L85 PolarHBondContact O-N 3.27Å; L82-L85 PolarHBondContact O-N 3.48Å; A83-L85 PolarHBondContact O-N 2.95Å; L85-S89 VanDerWaalsContact O-CB 3.3Å; L85-S89 WeakPolarHBondContact O-CB 3.37Å; L85-S89 PolarHBondContact O-N 3.5Å; L85-S89 PolarHBondContact O-OG 3Å
86L98.6Very high98.2Very high101 Ų10149 Ų4953%0.52928%0.282SS..Hα-helixtrans-63.5-44.7174.6-75172000111L82 A83 V84 S89 V90L82-L86 HydrophobicContact CG-CD1 4.18Å; L82-L86 WeakPolarHBondContact O-CB 3.29Å; L82-L86 WeakPolarHBondContact O-CG 3.25Å; L82-L86 PolarHBondContact O-N 3.49Å; A83-L86 PolarHBondContact O-N 3Å; V84-L86 VanDerWaalsContact C-N 3.35Å; V84-L86 PolarHBondContact O-N 3.44Å; L86-S89 PolarHBondContact O-N 3.45Å; L86-V90 WeakPolarHBondContact O-CG2 3.09Å; L86-V90 PolarHBondContact O-N 2.98Å
87T98.6Very high98.1Very high69 Ų6947.8 Ų47.842%0.42327%0.273SS..Hα-helixtrans-58.9-51.6176.3-60.40000111.4A83 V84 S89 V90 L91A83-T87 PolarHBondContact O-N 3.46Å; A83-T87 PolarHBondContact O-OG1 3Å; A83-T87 VanDerWaalsContact O-OG1 3.05Å; V84-T87 PolarHBondContact O-N 3.33Å; T87-S89 VanDerWaalsContact C-N 3.29Å; T87-S89 PolarHBondContact O-N 3.42Å; T87-V90 PolarHBondContact O-N 3.47Å; T87-L91 HydrophobicContact CG2-CD1 4.08Å; T87-L91 HydrophobicContact CG2-CG 4.4Å; T87-L91 VanDerWaalsContact O-CG 3.31Å; T87-L91 WeakPolarHBondContact O-CG 3.44Å; T87-L91 PolarHBondContact O-N 2.95Å
88L98.7Very high98.1Very high0 Ų053.3 Ų53.30%029%0.293CS..Hα-helixtrans-58.7-41.8177.5-72.7171.9000112F33 L37 C40 A49 T52 V84 A92F33-L88 HydrophobicContact CD2-CD1 4.1Å; F33-L88 HydrophobicContact CE2-CD1 4.08Å; L37-L88 HydrophobicContact CB-CD1 4.43Å; L37-L88 HydrophobicContact CD1-CD1 4.4Å; L37-L88 HydrophobicContact CD1-CD2 4.39Å; C40-L88 HydrophobicContact CB-CD2 4.01Å; A49-L88 HydrophobicContact CB-CD2 4.5Å; T52-L88 HydrophobicContact CG2-CD1 4.3Å; T52-L88 HydrophobicContact CG2-CD2 3.83Å; T52-L88 HydrophobicContact CG2-CG 3.74Å; V84-L88 HydrophobicContact CG1-CD1 4.21Å; V84-L88 PolarHBondContact O-N 3.27Å; L88-A92 VanDerWaalsContact O-CB 3.22Å; L88-A92 WeakPolarHBondContact O-CB 3.45Å; L88-A92 PolarHBondContact O-N 3.21Å
89S98.5Very high97.9Very high43 Ų4352.5 Ų52.530%0.30130%0.3SS..Hα-helixtrans-63.9-45.3178.8-57.80000112.1T36 L85 L86 T87 A92 V93T36-S89 VanDerWaalsContact CG2-OG 3.27Å; T36-S89 WeakPolarHBondContact CG2-OG 3.26Å; L85-S89 VanDerWaalsContact O-CB 3.3Å; L85-S89 WeakPolarHBondContact O-CB 3.37Å; L85-S89 PolarHBondContact O-N 3.5Å; L85-S89 PolarHBondContact O-OG 3Å; L86-S89 PolarHBondContact O-N 3.45Å; T87-S89 VanDerWaalsContact C-N 3.29Å; T87-S89 PolarHBondContact O-N 3.42Å; S89-A92 PolarHBondContact O-N 3.25Å; S89-V93 WeakPolarHBondContact O-CG2 3.15Å; S89-V93 PolarHBondContact O-N 2.92Å
90V98.6Very high97.7Very high88 Ų8851.2 Ų51.253%0.53330%0.297SS..Hα-helixtrans-63.9-46.8178.6169.30000110.6L86 T87 A92 V93 V94L86-V90 WeakPolarHBondContact O-CG2 3.09Å; L86-V90 PolarHBondContact O-N 2.98Å; T87-V90 PolarHBondContact O-N 3.47Å; V90-A92 VanDerWaalsContact C-N 3.33Å; V90-A92 PolarHBondContact O-N 3.09Å; V90-V93 PolarHBondContact O-N 2.71Å; V90-V94 HydrophobicContact CG1-CG2 4.43Å; V90-V94 VanDerWaalsContact O-CG2 3.31Å; V90-V94 WeakPolarHBondContact O-CG2 3.49Å; V90-V94 PolarHBondContact O-N 3.3Å
91L98.4Very high97.6Very high36 Ų3651 Ų5119%0.18830%0.295CS..Hα-helixtrans-63.1-40.4178.6-65.8-177.6000111.9C40 F44 T87 V94 G95C40-L91 VanDerWaalsContact SG-CB 3.53Å; F44-L91 WeakPolarHBondContact CB-O 3.38Å; F44-L91 HydrophobicContact CD1-CB 3.95Å; F44-L91 HydrophobicContact CD1-CD1 4.23Å; F44-L91 HydrophobicContact CD1-CD2 4.13Å; F44-L91 HydrophobicContact CD1-CG 4.32Å; F44-L91 HydrophobicContact CE1-CB 4.34Å; F44-L91 HydrophobicContact CE1-CD1 4.17Å; F44-L91 HydrophobicContact CE1-CD2 3.63Å; F44-L91 HydrophobicContact CE1-CG 4.25Å; F44-L91 HydrophobicContact CE2-CD2 4.41Å; F44-L91 HydrophobicContact CG-CB 4.18Å; F44-L91 HydrophobicContact CZ-CD2 3.8Å; T87-L91 HydrophobicContact CG2-CD1 4.08Å; T87-L91 HydrophobicContact CG2-CG 4.4Å; T87-L91 VanDerWaalsContact O-CG 3.31Å; T87-L91 WeakPolarHBondContact O-CG 3.44Å; T87-L91 PolarHBondContact O-N 2.95Å; L91-V94 PolarHBondContact O-N 2.9Å; L91-G95 PolarHBondContact O-N 2.9Å
92A98.3Very high97.3Very high6 Ų653.8 Ų53.85%0.0531%0.311CS..Hα-helixtrans-59.4-47.1173.700000112.1T39 C40 L88 S89 V90 V94 G95 I96T39-A92 HydrophobicContact CG2-CB 3.72Å; C40-A92 HydrophobicContact CB-CB 4.27Å; L88-A92 VanDerWaalsContact O-CB 3.22Å; L88-A92 WeakPolarHBondContact O-CB 3.45Å; L88-A92 PolarHBondContact O-N 3.21Å; S89-A92 PolarHBondContact O-N 3.25Å; V90-A92 VanDerWaalsContact C-N 3.33Å; V90-A92 PolarHBondContact O-N 3.09Å; A92-V94 PolarHBondContact O-N 2.92Å; A92-G95 PolarHBondContact O-N 2.93Å; A92-I96 WeakPolarHBondContact O-CG1 3.42Å; A92-I96 PolarHBondContact O-N 2.98Å
93V98.4Very high97Very high91 Ų9157 Ų5755%0.55232%0.321SS*.Hα-helixtrans-63.1-42.3177.61700000111.3S89 V90 I96 T97S89-V93 WeakPolarHBondContact O-CG2 3.15Å; S89-V93 PolarHBondContact O-N 2.92Å; V90-V93 PolarHBondContact O-N 2.71Å; V93-I96 PolarHBondContact O-N 3.4Å; V93-T97 VanDerWaalsContact O-CB 3.31Å; V93-T97 WeakPolarHBondContact O-CB 3.31Å; V93-T97 PolarHBondContact O-N 3.48Å; V93-T97 PolarHBondContact O-OG1 3.01Å
94V98Very high96.8Very high52 Ų5261.7 Ų61.732%0.31533%0.33SS..Hα-helixtrans-61-47.2176.1170.40000110.7F44 V90 L91 A92 T97 R98F44-V94 HydrophobicContact CD2-CB 4.47Å; F44-V94 HydrophobicContact CD2-CG1 4.13Å; F44-V94 HydrophobicContact CE2-CB 4.47Å; F44-V94 HydrophobicContact CE2-CG1 3.84Å; V90-V94 HydrophobicContact CG1-CG2 4.43Å; V90-V94 VanDerWaalsContact O-CG2 3.31Å; V90-V94 WeakPolarHBondContact O-CG2 3.49Å; V90-V94 PolarHBondContact O-N 3.3Å; L91-V94 PolarHBondContact O-N 2.9Å; A92-V94 PolarHBondContact O-N 2.92Å; V94-T97 PolarHBondContact O-N 2.87Å; V94-R98 WeakPolarHBondContact O-CG 3.29Å; V94-R98 PolarHBondContact O-N 3.49Å
95G97Very high96.6Very high4 Ų468.1 Ų68.14%0.04136%0.357CS..Hα-helixtrans-60.1-47.7178.200000113.1F43 L91 A92 T97 R98 G99F43-G95 CarbonylContact O-C 3.48Å; F43-G95 WeakPolarHBondContact O-CA 3.31Å; L91-G95 PolarHBondContact O-N 2.9Å; A92-G95 PolarHBondContact O-N 2.93Å; G95-T97 VanDerWaalsContact C-N 3.35Å; G95-T97 PolarHBondContact O-N 3.36Å; G95-R98 PolarHBondContact O-N 2.92Å; G95-G99 PolarHBondContact O-N 3.26Å
96I97.5Very high95.9Very high64 Ų6476.4 Ų76.433%0.32839%0.389SS..Hα-helixtrans-60.4-46.3175.6-69.1166.3000110.7T39 F43 A92 V93 R98 G99 L100T39-I96 HydrophobicContact CG2-CD1 3.6Å; T39-I96 HydrophobicContact CG2-CG1 4.29Å; F43-I96 HydrophobicContact CB-CG1 4.1Å; F43-I96 HydrophobicContact CD1-CG1 4.12Å; F43-I96 HydrophobicContact CD2-CG1 4.14Å; F43-I96 HydrophobicContact CG-CG1 3.86Å; A92-I96 WeakPolarHBondContact O-CG1 3.42Å; A92-I96 PolarHBondContact O-N 2.98Å; V93-I96 PolarHBondContact O-N 3.4Å; I96-R98 PolarHBondContact O-N 3.49Å; I96-G99 PolarHBondContact O-N 3.36Å; I96-L100 HydrophobicContact CG2-CD1 3.93Å; I96-L100 HydrophobicContact CG2-CG 4.31Å; I96-L100 WeakPolarHBondContact O-CG 3.34Å; I96-L100 PolarHBondContact O-N 2.96Å
97T96.8Very high94.9Very high66 Ų6674.1 Ų74.141%0.40538%0.379SS..Hα-helixtrans-62.3-45.4-177.9-56.20000111V93 V94 G95 L100 L101V93-T97 VanDerWaalsContact O-CB 3.31Å; V93-T97 WeakPolarHBondContact O-CB 3.31Å; V93-T97 PolarHBondContact O-N 3.48Å; V93-T97 PolarHBondContact O-OG1 3.01Å; V94-T97 PolarHBondContact O-N 2.87Å; G95-T97 VanDerWaalsContact C-N 3.35Å; G95-T97 PolarHBondContact O-N 3.36Å; T97-L100 PolarHBondContact O-N 3.41Å; T97-L101 HydrophobicContact CG2-CD1 4.1Å; T97-L101 HydrophobicContact CG2-CG 4.41Å; T97-L101 WeakPolarHBondContact O-CB 3.31Å; T97-L101 VanDerWaalsContact O-CG 3.29Å; T97-L101 WeakPolarHBondContact O-CG 3.5Å; T97-L101 PolarHBondContact O-N 3.17Å
98R95.4Very high93.4Very high117 Ų11778.9 Ų78.944%0.44240%0.396SS..Hα-helixtrans-58.3-48.6174.3-74.4-178.3177.9-174.6-6.1111.7V94 G95 I96 L100 L101 D102V94-R98 WeakPolarHBondContact O-CG 3.29Å; V94-R98 PolarHBondContact O-N 3.49Å; G95-R98 PolarHBondContact O-N 2.92Å; I96-R98 PolarHBondContact O-N 3.49Å; R98-L100 VanDerWaalsContact C-N 3.29Å; R98-L100 PolarHBondContact O-N 3.17Å; R98-L101 PolarHBondContact O-N 3.38Å; R98-L101 VanDerWaalsContact O-N 3.09Å; R98-D102 PolarHBondContact O-N 3.41Å
99G93.8Very high91.7Very high39 Ų3986.1 Ų86.140%0.40243%0.433SS..Hα-helixtrans-60.8-3517800000113.8G95 I96 K103G95-G99 PolarHBondContact O-N 3.26Å; I96-G99 PolarHBondContact O-N 3.36Å; G99-K103 VanDerWaalsContact O-CB 3.25Å; G99-K103 WeakPolarHBondContact O-CB 3.47Å; G99-K103 PolarHBondContact O-N 2.74Å
100L95Very high91.4Very high86 Ų8688.3 Ų88.345%0.4544%0.44SS..Hα-helixtrans-69.4-43.2173.1-70.1173.4000111.8I96 T97 R98 K103 Y104I96-L100 HydrophobicContact CG2-CD1 3.93Å; I96-L100 HydrophobicContact CG2-CG 4.31Å; I96-L100 WeakPolarHBondContact O-CG 3.34Å; I96-L100 PolarHBondContact O-N 2.96Å; T97-L100 PolarHBondContact O-N 3.41Å; R98-L100 VanDerWaalsContact C-N 3.29Å; R98-L100 PolarHBondContact O-N 3.17Å; L100-K103 PolarHBondContact O-N 3.49Å; L100-Y104 HydrophobicContact CD2-CD2 4.21Å; L100-Y104 HydrophobicContact CD2-CE2 3.75Å; L100-Y104 VanDerWaalsContact O-CD2 3.29Å; L100-Y104 WeakPolarHBondContact O-CD2 3.4Å; L100-Y104 PolarHBondContact O-N 3.31Å
101L95.1Very high91Very high61 Ų6188.3 Ų88.332%0.31944%0.435SS..Hα-helixtrans-62.2-47.5178.5-72.9174.7000111.7T97 R98 K103 F105 Y106T97-L101 HydrophobicContact CG2-CD1 4.1Å; T97-L101 HydrophobicContact CG2-CG 4.41Å; T97-L101 WeakPolarHBondContact O-CB 3.31Å; T97-L101 VanDerWaalsContact O-CG 3.29Å; T97-L101 WeakPolarHBondContact O-CG 3.5Å; T97-L101 PolarHBondContact O-N 3.17Å; R98-L101 PolarHBondContact O-N 3.38Å; R98-L101 VanDerWaalsContact O-N 3.09Å; L101-K103 VanDerWaalsContact C-N 3.3Å; L101-K103 PolarHBondContact O-N 2.99Å; L101-F105 HydrophobicContact CD2-CD2 3.84Å; L101-F105 HydrophobicContact CD2-CE2 4.33Å; L101-F105 HydrophobicContact CD2-CG 4.5Å; L101-F105 CarbonylContact O-C 3.59Å; L101-F105 WeakPolarHBondContact O-CA 3.39Å; L101-F105 WeakPolarHBondContact O-CB 3.42Å; L101-F105 PolarHBondContact O-N 3.04Å; L101-Y106 PolarHBondContact O-N 2.88Å
102D92.1Very high90.6Very high61 Ų6191.2 Ų91.233%0.32645%0.449SS..Hα-helixtrans-57.9-44.2175.3-79.8-36.7000111.6R98 Y106 H108R98-D102 PolarHBondContact O-N 3.41Å; D102-Y106 PolarHBondContact O-N 3.45Å; D102-H108 WeakPolarHBondContact OD1-CA 3.33Å; D102-H108 IonicContact OD1-ND1 3.25Å
103K93Very high90.1Very high143 Ų14396.2 Ų96.262%0.62247%0.472SS*.Hα-helixtrans-71.8-38.6-174.7-175.4171-177.7174.20113.9G99 L100 L101G99-K103 VanDerWaalsContact O-CB 3.25Å; G99-K103 WeakPolarHBondContact O-CB 3.47Å; G99-K103 PolarHBondContact O-N 2.74Å; L100-K103 PolarHBondContact O-N 3.49Å; L101-K103 VanDerWaalsContact C-N 3.3Å; L101-K103 PolarHBondContact O-N 2.99Å
104Y94.4Very high89.6Confident147 Ų14796.5 Ų96.558%0.57647%0.467SS*.Hα-helixtrans-107-25.9-171.1-67-69.8000114.2L100L100-Y104 HydrophobicContact CD2-CD2 4.21Å; L100-Y104 HydrophobicContact CD2-CE2 3.75Å; L100-Y104 VanDerWaalsContact O-CD2 3.29Å; L100-Y104 WeakPolarHBondContact O-CD2 3.4Å; L100-Y104 PolarHBondContact O-N 3.31Å
105F93.1Very high89.1Confident144 Ų14499.5 Ų99.563%0.63248%0.477SS*.Hα-helixtrans-115.5-3.6-175.4-61.6-83.7000113.1L101 T107L101-F105 HydrophobicContact CD2-CD2 3.84Å; L101-F105 HydrophobicContact CD2-CE2 4.33Å; L101-F105 HydrophobicContact CD2-CG 4.5Å; L101-F105 CarbonylContact O-C 3.59Å; L101-F105 WeakPolarHBondContact O-CA 3.39Å; L101-F105 WeakPolarHBondContact O-CB 3.42Å; L101-F105 PolarHBondContact O-N 3.04Å; F105-T107 HydrophobicContact CB-CG2 4.2Å; F105-T107 PolarHBondContact O-N 2.87Å
106Y85Confident88.5Confident187 Ų187106.3 Ų106.373%0.73351%0.508SS*.  trans51.926.5-178.1-57.9-84.9000113.3L101 D102 H108L101-Y106 PolarHBondContact O-N 2.88Å; D102-Y106 PolarHBondContact O-N 3.45Å; Y106-H108 PolarHBondContact O-N 3.42Å
107T77.9Confident87.8Confident53 Ų53109.5 Ų109.533%0.32552%0.522SS..  trans-90.197.8176.9480000108.6F105 I109F105-T107 HydrophobicContact CB-CG2 4.2Å; F105-T107 PolarHBondContact O-N 2.87Å; T107-I109 PolarHBondContact O-N 3Å
108H67.4Low87.1Confident169 Ų169113.2 Ų113.278%0.78253%0.532SS*.  trans-70.491.1174.3-62.6-55.2000110.5D102 Y106D102-H108 WeakPolarHBondContact OD1-CA 3.33Å; D102-H108 IonicContact OD1-ND1 3.25Å; Y106-H108 PolarHBondContact O-N 3.42Å
109I62.6Low86.3Confident151 Ų151112.8 Ų112.877%0.77454%0.54SS*.  trans-130.30-178.8-53.3174.8000111.1T107T107-I109 PolarHBondContact O-N 3Å

Retrieved 109 of 109 residues in 193.4 ms (Link to these results)

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