A0A096NX85_PAPAN Loading...

Tyrosine 3-monooxygenase/tryptophan 5-monooxygenase activation protein beta

AlphaFold DB (P31946), UniProt , Accession A0A096NX85, Species PAPAN (Papio anubis, Olive baboon), Gene YWHAB, Length 246 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
1M52.3Low89Confident243 Ų24392.3 Ų92.3100%1.19748%0.48SS*.  0122.60-80.4172.5163.900106.7
2T74.3Confident89.8Confident147 Ų14784.6 Ų84.690%0.90244%0.44SS*.PPolyproline II helixtrans-71123.5169.4-320000106.6
3M80.7Confident90.4Very high73 Ų7381.8 Ų81.836%0.3642%0.422SS..PPolyproline II helixtrans-60.1139.9177.5-69.7177.670.400109.4E7 L8 K11M3-E7 WeakPolarHBondContact CA-OE2 3.02Å; M3-E7 HydrophobicContact CB-CB 4.29Å; M3-E7 HydrophobicContact CE-CB 3.67Å; M3-L8 HydrophobicContact CB-CD2 3.97Å; M3-L8 HydrophobicContact CB-CG 3.87Å; M3-L8 HydrophobicContact CE-CD2 4.3Å; M3-L8 HydrophobicContact SD-CD2 4.04Å; M3-K11 HydrophobicContact CE-CB 4.39Å; M3-K11 HydrophobicContact CE-CD 4.2Å; M3-K11 HydrophobicContact SD-CD 4.44Å
4D92.1Very high91Very high87 Ų8783 Ų8347%0.46543%0.429SS..PPolyproline II helixtrans-75.7169.517576.831.4000111.6S6 E7 L8D4-S6 VanDerWaalsContact C-N 3.27Å; D4-S6 PolarHBondContact O-N 3.16Å; D4-S6 WeakPolarHBondContact OD1-CA 3.4Å; D4-S6 WeakPolarHBondContact OD1-CB 3.43Å; D4-S6 PolarHBondContact OD1-N 2.65Å; D4-E7 PolarHBondContact N-OE2 3.19Å; D4-E7 PolarHBondContact O-N 2.99Å; D4-E7 WeakPolarHBondContact OD1-CG 3.24Å; D4-E7 PolarHBondContact OD1-N 3.37Å; D4-L8 WeakPolarHBondContact O-CG 3.45Å; D4-L8 PolarHBondContact O-N 3.25Å
5K95.1Very high91.5Very high51 Ų5178 Ų7822%0.22241%0.405CS..Hα-helixtrans-55.2-42.4180-162.1-172.6-176.4-1610112.4L8 V9 V31 E42K5-L8 PolarHBondContact O-N 3.15Å; K5-V9 VanDerWaalsContact O-CG2 3.3Å; K5-V9 WeakPolarHBondContact O-CG2 3.42Å; K5-V9 PolarHBondContact O-N 3.06Å; K5-V31 HydrophobicContact CD-CG1 4.49Å; K5-V31 HydrophobicContact CG-CG1 3.95Å; K5-V31 HydrophobicContact CG-CG2 4.49Å; K5-E42 VanDerWaalsContact CE-CD 3.42Å; K5-E42 WeakPolarHBondContact CE-OE1 3.41Å; K5-E42 WeakPolarHBondContact CE-OE2 3.5Å; K5-E42 IonicContact NZ-OE1 3.97Å; K5-E42 PolarHBondContact NZ-OE1 2.69Å; K5-E42 IonicContact NZ-OE2 3.34Å; K5-E42 PolarHBondContact NZ-OE2 2.97Å
6S95.6Very high91.9Very high89 Ų8977.4 Ų77.462%0.62240%0.4SS*.Hα-helixtrans-68.8-41.9-175.9-173.80000111.2D4 V9 Q10D4-S6 VanDerWaalsContact C-N 3.27Å; D4-S6 PolarHBondContact O-N 3.16Å; D4-S6 WeakPolarHBondContact OD1-CA 3.4Å; D4-S6 WeakPolarHBondContact OD1-CB 3.43Å; D4-S6 PolarHBondContact OD1-N 2.65Å; S6-V9 PolarHBondContact O-N 3.27Å; S6-Q10 WeakPolarHBondContact O-CB 3.35Å; S6-Q10 PolarHBondContact O-N 3.26Å
7E96.7Very high92.3Very high101 Ų10182 Ų8247%0.47242%0.419SS..Hα-helixtrans-63.4-41.1175.3-68.5-178.5154.300111.7M3 D4 Q10 K11M3-E7 WeakPolarHBondContact CA-OE2 3.02Å; M3-E7 HydrophobicContact CB-CB 4.29Å; M3-E7 HydrophobicContact CE-CB 3.67Å; D4-E7 PolarHBondContact N-OE2 3.19Å; D4-E7 PolarHBondContact O-N 2.99Å; D4-E7 WeakPolarHBondContact OD1-CG 3.24Å; D4-E7 PolarHBondContact OD1-N 3.37Å; E7-Q10 PolarHBondContact O-N 2.63Å; E7-K11 WeakPolarHBondContact O-CB 3.37Å; E7-K11 PolarHBondContact O-N 3.07Å
8L97.7Very high92.6Very high15 Ų1580.8 Ų80.88%0.07942%0.424CS..Hα-helixtrans-66.9-43.5177-70.8167.9000112.2M3 D4 K5 Q10 K11 A12 A30 V31M3-L8 HydrophobicContact CB-CD2 3.97Å; M3-L8 HydrophobicContact CB-CG 3.87Å; M3-L8 HydrophobicContact CE-CD2 4.3Å; M3-L8 HydrophobicContact SD-CD2 4.04Å; D4-L8 WeakPolarHBondContact O-CG 3.45Å; D4-L8 PolarHBondContact O-N 3.25Å; K5-L8 PolarHBondContact O-N 3.15Å; L8-Q10 VanDerWaalsContact C-N 3.33Å; L8-Q10 PolarHBondContact O-N 3.29Å; L8-K11 WeakPolarHBondContact O-CB 3.26Å; L8-K11 PolarHBondContact O-N 3.43Å; L8-A12 PolarHBondContact O-N 3.25Å; L8-A30 HydrophobicContact CD1-CB 3.8Å; L8-A30 HydrophobicContact CD2-CB 4.06Å; L8-V31 HydrophobicContact CB-CG2 3.43Å; L8-V31 VanDerWaalsContact CB-CG2 3.43Å; L8-V31 HydrophobicContact CD1-CG2 4.09Å; L8-V31 HydrophobicContact CG-CG2 4.41Å
9V98.2Very high92.9Very high14 Ų1484.2 Ų84.29%0.08544%0.437CS..Hα-helixtrans-62.3-42.1175.1170.70000110.6K5 S6 K11 A12 K13 V31 E42 L45K5-V9 VanDerWaalsContact O-CG2 3.3Å; K5-V9 WeakPolarHBondContact O-CG2 3.42Å; K5-V9 PolarHBondContact O-N 3.06Å; S6-V9 PolarHBondContact O-N 3.27Å; V9-K11 VanDerWaalsContact C-N 3.33Å; V9-K11 PolarHBondContact O-N 2.88Å; V9-A12 WeakPolarHBondContact O-CB 3.46Å; V9-A12 PolarHBondContact O-N 3.4Å; V9-K13 HydrophobicContact CG1-CD 4.39Å; V9-K13 WeakPolarHBondContact O-CG 3.36Å; V9-K13 PolarHBondContact O-N 3.37Å; V9-V31 HydrophobicContact CG2-CG1 4.36Å; V9-V31 HydrophobicContact CG2-CG2 3.94Å; V9-E42 HydrophobicContact CG2-CG 3.96Å; V9-L45 HydrophobicContact CG1-CD1 3.97Å
10Q98Very high93.2Very high98 Ų9887.2 Ų87.246%0.45844%0.442SS..Hα-helixtrans-63.6-39.7175.8-174.659.524.300111.8S6 E7 L8 A12 K13 L14S6-Q10 WeakPolarHBondContact O-CB 3.35Å; S6-Q10 PolarHBondContact O-N 3.26Å; E7-Q10 PolarHBondContact O-N 2.63Å; L8-Q10 VanDerWaalsContact C-N 3.33Å; L8-Q10 PolarHBondContact O-N 3.29Å; Q10-A12 VanDerWaalsContact C-N 3.35Å; Q10-K13 PolarHBondContact O-N 2.99Å; Q10-L14 WeakPolarHBondContact O-CG 3.39Å; Q10-L14 PolarHBondContact O-N 3.19Å
11K97.9Very high93.4Very high97 Ų9785.5 Ų85.542%0.42243%0.431SS..Hα-helixtrans-61.7-42173.7-176.2-179.2176.6-174.90111.7M3 E7 L8 V9 L14 A15 A27M3-K11 HydrophobicContact CE-CB 4.39Å; M3-K11 HydrophobicContact CE-CD 4.2Å; M3-K11 HydrophobicContact SD-CD 4.44Å; E7-K11 WeakPolarHBondContact O-CB 3.37Å; E7-K11 PolarHBondContact O-N 3.07Å; L8-K11 WeakPolarHBondContact O-CB 3.26Å; L8-K11 PolarHBondContact O-N 3.43Å; V9-K11 VanDerWaalsContact C-N 3.33Å; V9-K11 PolarHBondContact O-N 2.88Å; K11-L14 PolarHBondContact O-N 2.71Å; K11-A15 WeakPolarHBondContact O-CB 3.35Å; K11-A15 PolarHBondContact O-N 3.45Å; K11-A27 HydrophobicContact CB-CB 4.47Å; K11-A27 HydrophobicContact CD-CB 4.36Å; K11-A27 HydrophobicContact CG-CB 4.4Å
12A98.5Very high95.6Very high0 Ų078.1 Ų78.10%040%0.396CS..Hα-helixtrans-61.7-43.4175.900000111.8L8 V9 Q10 L14 A15 E16 M24 A27 M28L8-A12 PolarHBondContact O-N 3.25Å; V9-A12 WeakPolarHBondContact O-CB 3.46Å; V9-A12 PolarHBondContact O-N 3.4Å; Q10-A12 VanDerWaalsContact C-N 3.35Å; A12-L14 PolarHBondContact O-N 2.94Å; A12-A15 WeakPolarHBondContact O-CB 3.38Å; A12-A15 PolarHBondContact O-N 3.15Å; A12-E16 PolarHBondContact O-N 3.04Å; A12-M24 HydrophobicContact CB-CG 4.04Å; A12-A27 HydrophobicContact CB-CB 4.05Å; A12-M28 HydrophobicContact CB-CG 3.74Å; A12-M28 HydrophobicContact CB-SD 3.57Å; A12-M28 VanDerWaalsContact CB-SD 3.57Å
13K98.5Very high96.7Very high48 Ų4873.6 Ų73.621%0.20937%0.366CS..Hα-helixtrans-62.6-40175.7-70175.5176.8-176.60112.9V9 Q10 E16 Q17 E41 L45V9-K13 HydrophobicContact CG1-CD 4.39Å; V9-K13 WeakPolarHBondContact O-CG 3.36Å; V9-K13 PolarHBondContact O-N 3.37Å; Q10-K13 PolarHBondContact O-N 2.99Å; K13-E16 PolarHBondContact O-N 3.5Å; K13-Q17 WeakPolarHBondContact O-CG 3.38Å; K13-Q17 PolarHBondContact O-N 2.61Å; K13-Q17 VanDerWaalsContact O-N 3.17Å; K13-E41 WeakPolarHBondContact CE-OE1 3.4Å; K13-E41 IonicContact NZ-OE1 3.81Å; K13-E41 PolarHBondContact NZ-OE1 3.1Å; K13-E41 IonicContact NZ-OE2 3.86Å; K13-E41 PolarHBondContact NZ-OE2 2.74Å; K13-L45 HydrophobicContact CG-CD1 4.08Å; K13-L45 HydrophobicContact CG-CD2 4.19Å
14L98.5Very high97.6Very high99 Ų9970.1 Ų70.152%0.51835%0.349SS..Hα-helixtrans-66.3-39.7174.2-70.6172000111.7Q10 K11 A12 Q17 A18Q10-L14 WeakPolarHBondContact O-CG 3.39Å; Q10-L14 PolarHBondContact O-N 3.19Å; K11-L14 PolarHBondContact O-N 2.71Å; A12-L14 PolarHBondContact O-N 2.94Å; L14-Q17 PolarHBondContact O-N 3.15Å; L14-A18 PolarHBondContact O-N 3.42Å
15A98.5Very high97.9Very high8 Ų866.3 Ų66.37%0.06633%0.33CS..Hα-helixtrans-65.8-39.3176.400000112K11 A12 A18 E19 R20 D23 M24K11-A15 WeakPolarHBondContact O-CB 3.35Å; K11-A15 PolarHBondContact O-N 3.45Å; A12-A15 WeakPolarHBondContact O-CB 3.38Å; A12-A15 PolarHBondContact O-N 3.15Å; A15-A18 CarbonylContact O-C 3.44Å; A15-A18 PolarHBondContact O-N 2.98Å; A15-E19 PolarHBondContact O-N 3.21Å; A15-R20 HydrophobicContact CB-CB 4.43Å; A15-R20 PolarHBondContact O-N 3.39Å; A15-D23 HydrophobicContact CB-CB 3.96Å; A15-M24 HydrophobicContact CB-CB 3.93Å
16E98.3Very high98Very high69 Ų6966.8 Ų66.832%0.32234%0.343SS..Hα-helixtrans-58.7-49.4173.6-177.3-180-149.900111.7A12 K13 A18 E19 M24 L45A12-E16 PolarHBondContact O-N 3.04Å; K13-E16 PolarHBondContact O-N 3.5Å; E16-A18 PolarHBondContact O-N 3.08Å; E16-E19 PolarHBondContact O-N 3.23Å; E16-M24 HydrophobicContact CB-CE 3.92Å; E16-M24 HydrophobicContact CB-SD 3.93Å; E16-M24 HydrophobicContact CG-CE 4.15Å; E16-M24 HydrophobicContact CG-SD 4.36Å; E16-L45 WeakPolarHBondContact OE2-CD2 3.38Å
17Q97.9Very high98.1Very high155 Ų15562.6 Ų62.672%0.72432%0.315SS*.Hα-helixtrans-62.2-25.6177.9-70.6175.239.300113.3K13 L14K13-Q17 WeakPolarHBondContact O-CG 3.38Å; K13-Q17 PolarHBondContact O-N 2.61Å; K13-Q17 VanDerWaalsContact O-N 3.17Å; L14-Q17 PolarHBondContact O-N 3.15Å
18A98Very high98.2Very high61 Ų6157.8 Ų57.850%0.50429%0.292SS..THydrogen-bonded Turntrans-94.9517600000113.2L14 A15 E16 R20L14-A18 PolarHBondContact O-N 3.42Å; A15-A18 CarbonylContact O-C 3.44Å; A15-A18 PolarHBondContact O-N 2.98Å; E16-A18 PolarHBondContact O-N 3.08Å; A18-R20 HydrophobicContact CB-CG 4.06Å; A18-R20 WeakPolarHBondContact O-CG 3.46Å; A18-R20 PolarHBondContact O-N 3.33Å; A18-R20 VanDerWaalsContact O-N 3.1Å
19E97.8Very high98.3Very high144 Ų14459.5 Ų59.567%0.67330%0.299SS*.THydrogen-bonded Turntrans53.327.4-175-56.9-174.5161.500113.8A15 E16 Y21A15-E19 PolarHBondContact O-N 3.21Å; E16-E19 PolarHBondContact O-N 3.23Å; E19-Y21 VanDerWaalsContact C-N 3.35Å; E19-Y21 HydrophobicContact CB-CE2 3.92Å; E19-Y21 WeakPolarHBondContact O-CD2 3.28Å; E19-Y21 PolarHBondContact O-N 3.3Å
20R98.4Very high98.3Very high144 Ų14460.4 Ų60.454%0.54331%0.308SS..  trans-91.868.7177.9-63.5-159.667.6-155.3-17.4110.4A15 A18 D22 D23 M24A15-R20 HydrophobicContact CB-CB 4.43Å; A15-R20 PolarHBondContact O-N 3.39Å; A18-R20 HydrophobicContact CB-CG 4.06Å; A18-R20 WeakPolarHBondContact O-CG 3.46Å; A18-R20 PolarHBondContact O-N 3.33Å; A18-R20 VanDerWaalsContact O-N 3.1Å; R20-D22 VanDerWaalsContact C-N 3.29Å; R20-D22 PolarHBondContact O-N 2.91Å; R20-D23 HydrophobicContact CB-CB 4.19Å; R20-D23 IonicContact CZ-OD1 2.8Å; R20-D23 IonicContact CZ-OD2 3.3Å; R20-D23 IonicContact NE-OD2 3.85Å; R20-D23 PolarHBondContact NE-OD2 3.47Å; R20-D23 IonicContact NH1-OD2 3.86Å; R20-D23 PolarHBondContact NH1-OD2 3.49Å; R20-D23 VanDerWaalsContact NH2-CG 3.35Å; R20-D23 IonicContact NH2-OD1 2.67Å; R20-D23 PolarHBondContact NH2-OD1 3.38Å; R20-D23 IonicContact NH2-OD2 2.68Å; R20-D23 PolarHBondContact NH2-OD2 3.03Å; R20-D23 WeakPolarHBondContact O-CB 3.34Å; R20-D23 PolarHBondContact O-N 3.28Å; R20-M24 PolarHBondContact O-N 3.2Å
21Y98.4Very high98.3Very high53 Ų5355.8 Ų55.821%0.20829%0.286CS..Hα-helixtrans-64.9-27.5-172-57.6-71000114.5E19 M24 A25 V48 N52 V53E19-Y21 VanDerWaalsContact C-N 3.35Å; E19-Y21 HydrophobicContact CB-CE2 3.92Å; E19-Y21 WeakPolarHBondContact O-CD2 3.28Å; E19-Y21 PolarHBondContact O-N 3.3Å; Y21-M24 HydrophobicContact CD1-SD 4.04Å; Y21-M24 WeakPolarHBondContact O-CB 3Å; Y21-M24 PolarHBondContact O-N 2.8Å; Y21-A25 WeakPolarHBondContact O-CB 3.43Å; Y21-A25 PolarHBondContact O-N 3.22Å; Y21-V48 HydrophobicContact CE1-CG1 4.27Å; Y21-N52 HydrophobicContact CD1-CB 3.56Å; Y21-N52 HydrophobicContact CD2-CB 3.43Å; Y21-N52 VanDerWaalsContact CD2-CB 3.43Å; Y21-N52 HydrophobicContact CE1-CB 3.91Å; Y21-N52 VanDerWaalsContact CE1-ND2 3.34Å; Y21-N52 WeakPolarHBondContact CE1-ND2 3.33Å; Y21-N52 HydrophobicContact CE2-CB 3.78Å; Y21-N52 HydrophobicContact CG-CB 3.29Å; Y21-V53 VanDerWaalsContact C-CG2 3.45Å; Y21-V53 WeakPolarHBondContact O-CG2 3.37Å
22D98.1Very high98.3Very high87 Ų8751.2 Ų51.247%0.46527%0.266SS..Hα-helixtrans-64.9-40.6172.2-59.4-79.3000111.4R20 M24 A25 A26 R57R20-D22 VanDerWaalsContact C-N 3.29Å; R20-D22 PolarHBondContact O-N 2.91Å; D22-M24 VanDerWaalsContact C-N 3.34Å; D22-A25 PolarHBondContact O-N 3.2Å; D22-A26 PolarHBondContact O-N 2.94Å; D22-R57 IonicContact OD1-NH1 2.95Å; D22-R57 PolarHBondContact OD1-NH1 3.37Å; D22-R57 IonicContact OD2-NH1 3.74Å
23D98.3Very high98.2Very high52 Ų5255.3 Ų55.328%0.27829%0.285SS..Hα-helixtrans-67.9-37.5175.5-67.8-4.9000110.9A15 R20 A27A15-D23 HydrophobicContact CB-CB 3.96Å; R20-D23 HydrophobicContact CB-CB 4.19Å; R20-D23 IonicContact CZ-OD1 2.8Å; R20-D23 IonicContact CZ-OD2 3.3Å; R20-D23 IonicContact NE-OD2 3.85Å; R20-D23 PolarHBondContact NE-OD2 3.47Å; R20-D23 IonicContact NH1-OD2 3.86Å; R20-D23 PolarHBondContact NH1-OD2 3.49Å; R20-D23 VanDerWaalsContact NH2-CG 3.35Å; R20-D23 IonicContact NH2-OD1 2.67Å; R20-D23 PolarHBondContact NH2-OD1 3.38Å; R20-D23 IonicContact NH2-OD2 2.68Å; R20-D23 PolarHBondContact NH2-OD2 3.03Å; R20-D23 WeakPolarHBondContact O-CB 3.34Å; R20-D23 PolarHBondContact O-N 3.28Å; D23-A27 WeakPolarHBondContact O-CB 3.3Å; D23-A27 PolarHBondContact O-N 3.48Å
24M98.3Very high98.1Very high0 Ų056.4 Ų56.40%029%0.292CS..Hα-helixtrans-62.8-45.1175.2-165.9-169.9-17900111A12 A15 E16 R20 Y21 D22 A27 M28 L45 V48 A49A12-M24 HydrophobicContact CB-CG 4.04Å; A15-M24 HydrophobicContact CB-CB 3.93Å; E16-M24 HydrophobicContact CB-CE 3.92Å; E16-M24 HydrophobicContact CB-SD 3.93Å; E16-M24 HydrophobicContact CG-CE 4.15Å; E16-M24 HydrophobicContact CG-SD 4.36Å; R20-M24 PolarHBondContact O-N 3.2Å; Y21-M24 HydrophobicContact CD1-SD 4.04Å; Y21-M24 WeakPolarHBondContact O-CB 3Å; Y21-M24 PolarHBondContact O-N 2.8Å; D22-M24 VanDerWaalsContact C-N 3.34Å; M24-A27 PolarHBondContact O-N 3.2Å; M24-M28 WeakPolarHBondContact O-CB 3.4Å; M24-M28 WeakPolarHBondContact O-CG 3.39Å; M24-M28 PolarHBondContact O-N 3.34Å; M24-L45 HydrophobicContact CE-CB 3.89Å; M24-L45 HydrophobicContact CE-CD2 3.44Å; M24-L45 VanDerWaalsContact CE-CD2 3.44Å; M24-L45 HydrophobicContact CE-CG 4.28Å; M24-L45 WeakPolarHBondContact CE-O 3.42Å; M24-V48 HydrophobicContact CE-CB 4.12Å; M24-V48 HydrophobicContact CE-CG1 4.07Å; M24-V48 HydrophobicContact SD-CG1 4.26Å; M24-A49 HydrophobicContact CB-CB 3.87Å; M24-A49 HydrophobicContact CE-CB 4.29Å; M24-A49 HydrophobicContact CG-CB 3.59Å; M24-A49 VanDerWaalsContact SD-CA 3.6Å; M24-A49 HydrophobicContact SD-CB 3.58Å; M24-A49 VanDerWaalsContact SD-CB 3.58Å
25A98.5Very high97.9Very high8 Ų853 Ų537%0.06628%0.281CS..Hα-helixtrans-64.1-44.3178.300000111.1Y21 D22 A27 M28 K29 A49 Y50 V53Y21-A25 WeakPolarHBondContact O-CB 3.43Å; Y21-A25 PolarHBondContact O-N 3.22Å; D22-A25 PolarHBondContact O-N 3.2Å; A25-A27 PolarHBondContact O-N 3.47Å; A25-M28 PolarHBondContact O-N 3.01Å; A25-K29 WeakPolarHBondContact O-CB 3.48Å; A25-K29 PolarHBondContact O-N 3.17Å; A25-A49 HydrophobicContact CB-CB 4.14Å; A25-Y50 HydrophobicContact CB-CD1 4.16Å; A25-Y50 HydrophobicContact CB-CD2 4.38Å; A25-Y50 HydrophobicContact CB-CE1 3.99Å; A25-Y50 HydrophobicContact CB-CE2 4.2Å; A25-Y50 HydrophobicContact CB-CG 4.37Å; A25-V53 HydrophobicContact CB-CG2 4.34Å
26A98.3Very high97.8Very high60 Ų6058.4 Ų58.450%0.49630%0.304SS..Hα-helixtrans-61.3-4217600000112.6D22 A30D22-A26 PolarHBondContact O-N 2.94Å; A26-A30 PolarHBondContact O-N 3.48Å
27A98.3Very high97.7Very high2 Ų258.3 Ų58.32%0.01730%0.303CS..Hα-helixtrans-66.2-46.5176.500000111.8K11 A12 D23 M24 A25 A30 V31K11-A27 HydrophobicContact CB-CB 4.47Å; K11-A27 HydrophobicContact CD-CB 4.36Å; K11-A27 HydrophobicContact CG-CB 4.4Å; A12-A27 HydrophobicContact CB-CB 4.05Å; D23-A27 WeakPolarHBondContact O-CB 3.3Å; D23-A27 PolarHBondContact O-N 3.48Å; M24-A27 PolarHBondContact O-N 3.2Å; A25-A27 PolarHBondContact O-N 3.47Å; A27-A30 PolarHBondContact O-N 3.44Å; A27-V31 WeakPolarHBondContact O-CG2 3.41Å; A27-V31 PolarHBondContact O-N 2.94Å
28M98.5Very high97.7Very high0 Ų051.2 Ų51.20%027%0.271CS..Hα-helixtrans-72.2-28.6-179-69.1-52.2-51.700113.4A12 M24 A25 V31 T32 E42 L45 L46A12-M28 HydrophobicContact CB-CG 3.74Å; A12-M28 HydrophobicContact CB-SD 3.57Å; A12-M28 VanDerWaalsContact CB-SD 3.57Å; M24-M28 WeakPolarHBondContact O-CB 3.4Å; M24-M28 WeakPolarHBondContact O-CG 3.39Å; M24-M28 PolarHBondContact O-N 3.34Å; A25-M28 PolarHBondContact O-N 3.01Å; M28-V31 HydrophobicContact CE-CB 4.18Å; M28-V31 HydrophobicContact CE-CG1 4.14Å; M28-V31 HydrophobicContact CE-CG2 4.47Å; M28-V31 PolarHBondContact O-N 3.22Å; M28-V31 HydrophobicContact SD-CG2 4.37Å; M28-T32 WeakPolarHBondContact O-CB 3.36Å; M28-T32 PolarHBondContact O-N 3.48Å; M28-T32 PolarHBondContact O-OG1 3.47Å; M28-E42 HydrophobicContact CE-CB 4.13Å; M28-E42 WeakPolarHBondContact CE-O 3.27Å; M28-L45 HydrophobicContact CE-CB 4.15Å; M28-L45 HydrophobicContact CG-CB 4.17Å; M28-L45 HydrophobicContact SD-CB 3.88Å; M28-L45 HydrophobicContact SD-CD1 4.32Å; M28-L46 HydrophobicContact CB-CB 4.25Å; M28-L46 HydrophobicContact CB-CD1 3.68Å; M28-L46 HydrophobicContact CE-CB 4.27Å
29K98.4Very high97.6Very high50 Ų5050.9 Ų50.922%0.21726%0.264CS..Hα-helixtrans-58.8-52167175.4165.9-177.81720110.6A25 V31 T32 E33 D98 L102A25-K29 WeakPolarHBondContact O-CB 3.48Å; A25-K29 PolarHBondContact O-N 3.17Å; K29-V31 VanDerWaalsContact C-N 3.26Å; K29-V31 PolarHBondContact O-N 3.45Å; K29-T32 WeakPolarHBondContact O-CB 3.47Å; K29-T32 PolarHBondContact O-N 3Å; K29-E33 WeakPolarHBondContact CE-OE1 3.36Å; K29-E33 HydrophobicContact CG-CG 4.34Å; K29-E33 WeakPolarHBondContact O-CG 3.4Å; K29-E33 PolarHBondContact O-N 3.34Å; K29-D98 WeakPolarHBondContact CD-OD1 3.37Å; K29-D98 WeakPolarHBondContact CD-OD2 3.42Å; K29-D98 WeakPolarHBondContact CE-OD1 3.47Å; K29-D98 IonicContact NZ-OD1 3.49Å; K29-D98 PolarHBondContact NZ-OD1 3.36Å; K29-D98 IonicContact NZ-OD2 3.45Å; K29-D98 PolarHBondContact NZ-OD2 3.27Å; K29-L102 HydrophobicContact CB-CD1 4.14Å; K29-L102 HydrophobicContact CD-CD1 4.5Å; K29-L102 HydrophobicContact CG-CD1 4.05Å; K29-L102 HydrophobicContact CG-CD2 4.11Å
30A98.1Very high97.5Very high33 Ų3348 Ų4827%0.27325%0.254SS..Hα-helixtrans-61.9-31.5178.100000113.1L8 A26 A27 Q34L8-A30 HydrophobicContact CD1-CB 3.8Å; L8-A30 HydrophobicContact CD2-CB 4.06Å; A26-A30 PolarHBondContact O-N 3.48Å; A27-A30 PolarHBondContact O-N 3.44Å; A30-Q34 WeakPolarHBondContact O-CG 3.48Å
31V98.2Very high97.4Very high1 Ų146.2 Ų46.21%0.00625%0.251CS..Hα-helixtrans-66-46.1170.9171.10000111K5 L8 V9 A27 M28 K29 Q34 L38K5-V31 HydrophobicContact CD-CG1 4.49Å; K5-V31 HydrophobicContact CG-CG1 3.95Å; K5-V31 HydrophobicContact CG-CG2 4.49Å; L8-V31 HydrophobicContact CB-CG2 3.43Å; L8-V31 VanDerWaalsContact CB-CG2 3.43Å; L8-V31 HydrophobicContact CD1-CG2 4.09Å; L8-V31 HydrophobicContact CG-CG2 4.41Å; V9-V31 HydrophobicContact CG2-CG1 4.36Å; V9-V31 HydrophobicContact CG2-CG2 3.94Å; A27-V31 WeakPolarHBondContact O-CG2 3.41Å; A27-V31 PolarHBondContact O-N 2.94Å; M28-V31 HydrophobicContact CE-CB 4.18Å; M28-V31 HydrophobicContact CE-CG1 4.14Å; M28-V31 HydrophobicContact CE-CG2 4.47Å; M28-V31 PolarHBondContact O-N 3.22Å; M28-V31 HydrophobicContact SD-CG2 4.37Å; K29-V31 VanDerWaalsContact C-N 3.26Å; K29-V31 PolarHBondContact O-N 3.45Å; V31-Q34 WeakPolarHBondContact O-CB 3.48Å; V31-Q34 PolarHBondContact O-N 2.92Å; V31-L38 HydrophobicContact CG1-CD2 3.78Å
32T98.2Very high97.4Very high1 Ų144.8 Ų44.81%0.00625%0.247CC..Hα-helixtrans-66-40.3-176.7-57.90000111.9M28 K29 Q34 G35 L102 Y106 L107M28-T32 WeakPolarHBondContact O-CB 3.36Å; M28-T32 PolarHBondContact O-N 3.48Å; M28-T32 PolarHBondContact O-OG1 3.47Å; K29-T32 WeakPolarHBondContact O-CB 3.47Å; K29-T32 PolarHBondContact O-N 3Å; T32-Q34 PolarHBondContact O-N 3.23Å; T32-Q34 VanDerWaalsContact O-N 3.15Å; T32-G35 PolarHBondContact O-N 2.95Å; T32-L102 HydrophobicContact CG2-CB 4.18Å; T32-L102 HydrophobicContact CG2-CD2 3.96Å; T32-Y106 HydrophobicContact CG2-CG 4.38Å; T32-L107 HydrophobicContact CG2-CD1 4.1Å; T32-L107 HydrophobicContact CG2-CD2 3.58Å; T32-L107 HydrophobicContact CG2-CG 3.7Å
33E97.7Very high97.4Very high86 Ų8641.2 Ų41.240%0.40223%0.227SC..THydrogen-bonded Turntrans-68.3-9.7179.9-70.3175.2157.100113.8K29 G35 L102 Y106K29-E33 WeakPolarHBondContact CE-OE1 3.36Å; K29-E33 HydrophobicContact CG-CG 4.34Å; K29-E33 WeakPolarHBondContact O-CG 3.4Å; K29-E33 PolarHBondContact O-N 3.34Å; E33-G35 PolarHBondContact O-N 3.39Å; E33-L102 HydrophobicContact CG-CD2 3.79Å; E33-Y106 HydrophobicContact CG-CE2 3.97Å
34Q96Very high97.4Very high72 Ų7242.4 Ų42.434%0.33623%0.233SC..THydrogen-bonded Turntrans-69.7-13.3169-62.3179.122.100112.6A30 V31 T32 H36A30-Q34 WeakPolarHBondContact O-CG 3.48Å; V31-Q34 WeakPolarHBondContact O-CB 3.48Å; V31-Q34 PolarHBondContact O-N 2.92Å; T32-Q34 PolarHBondContact O-N 3.23Å; T32-Q34 VanDerWaalsContact O-N 3.15Å; Q34-H36 VanDerWaalsContact C-N 3.33Å; Q34-H36 PolarHBondContact O-N 2.9Å
35G94.6Very high97.4Very high28 Ų2842.8 Ų42.829%0.28924%0.235SC..  trans77.612171.100000115.5T32 E33 N110T32-G35 PolarHBondContact O-N 2.95Å; E33-G35 PolarHBondContact O-N 3.39Å; G35-N110 PolarHBondContact O-ND2 3.38Å
36H94.4Very high97.4Very high121 Ų12142.5 Ų42.556%0.5623%0.233SC*.PPolyproline II helixtrans-89.3147.6171.5-60.4-49.9000110.8Q34 L38Q34-H36 VanDerWaalsContact C-N 3.33Å; Q34-H36 PolarHBondContact O-N 2.9Å; H36-L38 PolarHBondContact O-N 3.06Å
37E97Very high97.4Very high66 Ų6641.1 Ų41.131%0.30822%0.219SC..PPolyproline II helixtrans-59131.4170.4-173169.6-160.200109.7N110 A111 T112E37-N110 VanDerWaalsContact CD-O 3.26Å; E37-A111 WeakPolarHBondContact OE1-CA 3.41Å; E37-T112 VanDerWaalsContact CD-OG1 3.32Å; E37-T112 PolarHBondContact OE1-N 3.29Å; E37-T112 PolarHBondContact OE1-OG1 3.49Å; E37-T112 WeakPolarHBondContact OE2-CB 3.36Å; E37-T112 VanDerWaalsContact OE2-CG2 3.27Å; E37-T112 WeakPolarHBondContact OE2-CG2 3.49Å; E37-T112 PolarHBondContact OE2-OG1 2.9Å
38L98Very high97.4Very high7 Ų743.2 Ų43.24%0.03723%0.232CC..PPolyproline II helixtrans-76.2141.8179.1-60.3-171.3000110.6V31 H36 E42 R43 L46 L107V31-L38 HydrophobicContact CG1-CD2 3.78Å; H36-L38 PolarHBondContact O-N 3.06Å; L38-E42 WeakPolarHBondContact CA-OE2 3.5Å; L38-E42 HydrophobicContact CB-CB 3.94Å; L38-E42 HydrophobicContact CD1-CB 4.48Å; L38-E42 HydrophobicContact CD2-CB 4.23Å; L38-E42 HydrophobicContact CG-CB 4.44Å; L38-R43 HydrophobicContact CB-CB 4.36Å; L38-L46 HydrophobicContact CD1-CD2 4.06Å; L38-L107 HydrophobicContact CD1-CD2 3.57Å; L38-L107 HydrophobicContact CG-CD2 3.83Å
39S97.1Very high97.4Very high53 Ų5343.2 Ų43.237%0.37123%0.232SC..PPolyproline II helixtrans-66.1165.5166.277.50000110.9E41 E42 R43S39-E41 PolarHBondContact O-N 3.42Å; S39-E41 PolarHBondContact OG-N 3.49Å; S39-E42 PolarHBondContact N-OE2 3.25Å; S39-E42 PolarHBondContact O-N 3.36Å; S39-E42 WeakPolarHBondContact OG-CG 3.38Å; S39-E42 PolarHBondContact OG-N 2.84Å; S39-R43 VanDerWaalsContact O-CB 3.29Å; S39-R43 WeakPolarHBondContact O-CB 3.49Å; S39-R43 PolarHBondContact O-N 2.83Å
40N95.1Very high97.4Very high85 Ų8541.2 Ų41.246%0.45522%0.223SC..Hα-helixtrans-56.8-38.8175.1-75.4-14.7000112.4R43 N44N40-R43 PolarHBondContact OD1-NH1 2.94Å; N40-N44 WeakPolarHBondContact O-CB 3.33Å; N40-N44 PolarHBondContact O-N 2.88Å; N40-N44 PolarHBondContact O-ND2 2.86Å; N40-N44 PolarHBondContact O-OD1 3.32Å
41E96.7Very high97.4Very high105 Ų10546.3 Ų46.349%0.49124%0.239SC..Hα-helixtrans-65.3-48.3176.8-174.7-179.2-15500111.2K13 S39 R43 N44 L45K13-E41 WeakPolarHBondContact CE-OE1 3.4Å; K13-E41 IonicContact NZ-OE1 3.81Å; K13-E41 PolarHBondContact NZ-OE1 3.1Å; K13-E41 IonicContact NZ-OE2 3.86Å; K13-E41 PolarHBondContact NZ-OE2 2.74Å; S39-E41 PolarHBondContact O-N 3.42Å; S39-E41 PolarHBondContact OG-N 3.49Å; E41-R43 PolarHBondContact O-N 2.88Å; E41-N44 PolarHBondContact O-N 3.14Å; E41-L45 HydrophobicContact CG-CD1 4.35Å; E41-L45 WeakPolarHBondContact O-CG 3.44Å; E41-L45 PolarHBondContact O-N 3.36Å
42E98.2Very high97.4Very high23 Ų2349 Ų4911%0.10725%0.253CS..Hα-helixtrans-63.8-42.8-180-69.1165.217000111.8K5 V9 M28 L38 S39 N44 L45 L46K5-E42 VanDerWaalsContact CE-CD 3.42Å; K5-E42 WeakPolarHBondContact CE-OE1 3.41Å; K5-E42 WeakPolarHBondContact CE-OE2 3.5Å; K5-E42 IonicContact NZ-OE1 3.97Å; K5-E42 PolarHBondContact NZ-OE1 2.69Å; K5-E42 IonicContact NZ-OE2 3.34Å; K5-E42 PolarHBondContact NZ-OE2 2.97Å; V9-E42 HydrophobicContact CG2-CG 3.96Å; M28-E42 HydrophobicContact CE-CB 4.13Å; M28-E42 WeakPolarHBondContact CE-O 3.27Å; L38-E42 WeakPolarHBondContact CA-OE2 3.5Å; L38-E42 HydrophobicContact CB-CB 3.94Å; L38-E42 HydrophobicContact CD1-CB 4.48Å; L38-E42 HydrophobicContact CD2-CB 4.23Å; L38-E42 HydrophobicContact CG-CB 4.44Å; S39-E42 PolarHBondContact N-OE2 3.25Å; S39-E42 PolarHBondContact O-N 3.36Å; S39-E42 WeakPolarHBondContact OG-CG 3.38Å; S39-E42 PolarHBondContact OG-N 2.84Å; E42-N44 VanDerWaalsContact C-N 3.32Å; E42-N44 PolarHBondContact O-N 3.41Å; E42-L45 PolarHBondContact O-N 2.94Å; E42-L46 PolarHBondContact O-N 3.45Å
43R97.9Very high97.4Very high13 Ų1349.3 Ų49.35%0.04926%0.255CS..Hα-helixtrans-58.5-44.1173.9-179.7-17075.1-166.8-3.7111.5L38 S39 N40 E41 L46 S47 F119 Y120L38-R43 HydrophobicContact CB-CB 4.36Å; S39-R43 VanDerWaalsContact O-CB 3.29Å; S39-R43 WeakPolarHBondContact O-CB 3.49Å; S39-R43 PolarHBondContact O-N 2.83Å; N40-R43 PolarHBondContact OD1-NH1 2.94Å; E41-R43 PolarHBondContact O-N 2.88Å; R43-L46 PolarHBondContact O-N 3.48Å; R43-S47 WeakPolarHBondContact O-CB 3.24Å; R43-S47 PolarHBondContact O-N 3.17Å; R43-F119 VanDerWaalsContact CD-CD1 3.45Å; R43-F119 HydrophobicContact CG-CD1 3.59Å; R43-F119 HydrophobicContact CG-CE1 3.44Å; R43-F119 VanDerWaalsContact CG-CE1 3.44Å; R43-F119 HydrophobicContact CG-CE2 4.44Å; R43-F119 HydrophobicContact CG-CG 4.19Å; R43-F119 HydrophobicContact CG-CZ 3.89Å; R43-Y120 HydrophobicContact CG-CE1 3.68Å
44N96.9Very high97.4Very high76 Ų7645.2 Ų45.241%0.40624%0.236SC..Hα-helixtrans-66.5-42.3178.6-71.2-8.9000111.3N40 E41 E42 L46 S47 V48N40-N44 WeakPolarHBondContact O-CB 3.33Å; N40-N44 PolarHBondContact O-N 2.88Å; N40-N44 PolarHBondContact O-ND2 2.86Å; N40-N44 PolarHBondContact O-OD1 3.32Å; E41-N44 PolarHBondContact O-N 3.14Å; E42-N44 VanDerWaalsContact C-N 3.32Å; E42-N44 PolarHBondContact O-N 3.41Å; N44-L46 PolarHBondContact O-N 3.38Å; N44-S47 WeakPolarHBondContact O-CB 3.46Å; N44-S47 PolarHBondContact O-N 3.01Å; N44-V48 WeakPolarHBondContact O-CG2 3.33Å; N44-V48 PolarHBondContact O-N 3.35Å
45L98.5Very high97.5Very high9 Ų942.8 Ų42.85%0.04723%0.23CC..Hα-helixtrans-58.7-47.7174.3-71.7169.2000111.6V9 K13 E16 M24 M28 E41 E42 S47 V48 A49V9-L45 HydrophobicContact CG1-CD1 3.97Å; K13-L45 HydrophobicContact CG-CD1 4.08Å; K13-L45 HydrophobicContact CG-CD2 4.19Å; E16-L45 WeakPolarHBondContact OE2-CD2 3.38Å; M24-L45 HydrophobicContact CE-CB 3.89Å; M24-L45 HydrophobicContact CE-CD2 3.44Å; M24-L45 VanDerWaalsContact CE-CD2 3.44Å; M24-L45 HydrophobicContact CE-CG 4.28Å; M24-L45 WeakPolarHBondContact CE-O 3.42Å; M28-L45 HydrophobicContact CE-CB 4.15Å; M28-L45 HydrophobicContact CG-CB 4.17Å; M28-L45 HydrophobicContact SD-CB 3.88Å; M28-L45 HydrophobicContact SD-CD1 4.32Å; E41-L45 HydrophobicContact CG-CD1 4.35Å; E41-L45 WeakPolarHBondContact O-CG 3.44Å; E41-L45 PolarHBondContact O-N 3.36Å; E42-L45 PolarHBondContact O-N 2.94Å; L45-S47 VanDerWaalsContact C-N 3.29Å; L45-S47 PolarHBondContact O-N 3.18Å; L45-V48 PolarHBondContact O-N 3.44Å; L45-A49 WeakPolarHBondContact O-CB 3.17Å; L45-A49 PolarHBondContact O-N 3.01Å
46L98.7Very high97.7Very high2 Ų243.8 Ų43.81%0.0124%0.236CC..Hα-helixtrans-56.8-45.2175.7-179.574.3000111.4M28 L38 E42 R43 N44 A49 Y50 L107M28-L46 HydrophobicContact CB-CB 4.25Å; M28-L46 HydrophobicContact CB-CD1 3.68Å; M28-L46 HydrophobicContact CE-CB 4.27Å; L38-L46 HydrophobicContact CD1-CD2 4.06Å; E42-L46 PolarHBondContact O-N 3.45Å; R43-L46 PolarHBondContact O-N 3.48Å; N44-L46 PolarHBondContact O-N 3.38Å; L46-A49 PolarHBondContact O-N 3.47Å; L46-Y50 HydrophobicContact CD1-CD2 3.7Å; L46-Y50 HydrophobicContact CD1-CE2 3.52Å; L46-Y50 HydrophobicContact CG-CD2 4.23Å; L46-Y50 HydrophobicContact CG-CE2 4.48Å; L46-Y50 PolarHBondContact O-N 2.94Å; L46-L107 HydrophobicContact CD2-CD1 3.49Å; L46-L107 VanDerWaalsContact CD2-CD1 3.49Å; L46-L107 HydrophobicContact CD2-CD2 4.31Å
47S98.3Very high97.9Very high31 Ų3141 Ų4122%0.21722%0.22CC..Hα-helixtrans-63.6-47.7179.7-169.10000112.3R43 N44 L45 A49 K51R43-S47 WeakPolarHBondContact O-CB 3.24Å; R43-S47 PolarHBondContact O-N 3.17Å; N44-S47 WeakPolarHBondContact O-CB 3.46Å; N44-S47 PolarHBondContact O-N 3.01Å; L45-S47 VanDerWaalsContact C-N 3.29Å; L45-S47 PolarHBondContact O-N 3.18Å; S47-A49 VanDerWaalsContact C-N 3.35Å; S47-A49 PolarHBondContact O-N 2.99Å; S47-K51 WeakPolarHBondContact O-CB 3.42Å; S47-K51 PolarHBondContact O-N 3.21Å
48V98.4Very high97.9Very high46 Ų4639.4 Ų39.428%0.27921%0.211SC..Hα-helixtrans-60.7-44.4177.8169.40000110.9Y21 M24 N44 L45 N52Y21-V48 HydrophobicContact CE1-CG1 4.27Å; M24-V48 HydrophobicContact CE-CB 4.12Å; M24-V48 HydrophobicContact CE-CG1 4.07Å; M24-V48 HydrophobicContact SD-CG1 4.26Å; N44-V48 WeakPolarHBondContact O-CG2 3.33Å; N44-V48 PolarHBondContact O-N 3.35Å; L45-V48 PolarHBondContact O-N 3.44Å; V48-N52 PolarHBondContact O-N 3.49Å; V48-N52 VanDerWaalsContact O-N 3.15Å; V48-N52 PolarHBondContact O-ND2 3.24Å
49A98.6Very high97.9Very high0 Ų042.3 Ų42.30%023%0.232CC..Hα-helixtrans-55.9-61.7179.400000111.2M24 A25 L45 L46 S47 K51 N52 V53M24-A49 HydrophobicContact CB-CB 3.87Å; M24-A49 HydrophobicContact CE-CB 4.29Å; M24-A49 HydrophobicContact CG-CB 3.59Å; M24-A49 VanDerWaalsContact SD-CA 3.6Å; M24-A49 HydrophobicContact SD-CB 3.58Å; M24-A49 VanDerWaalsContact SD-CB 3.58Å; A25-A49 HydrophobicContact CB-CB 4.14Å; L45-A49 WeakPolarHBondContact O-CB 3.17Å; L45-A49 PolarHBondContact O-N 3.01Å; L46-A49 PolarHBondContact O-N 3.47Å; S47-A49 VanDerWaalsContact C-N 3.35Å; S47-A49 PolarHBondContact O-N 2.99Å; A49-K51 PolarHBondContact O-N 3.12Å; A49-N52 PolarHBondContact O-N 3.09Å; A49-V53 WeakPolarHBondContact O-CG2 3.45Å; A49-V53 PolarHBondContact O-N 3.14Å; A49-V53 VanDerWaalsContact O-N 3.15Å
50Y98.7Very high98Very high8 Ų842.5 Ų42.53%0.03123%0.234CC..Hα-helixtrans-70.9-32.7-175.1-78.1-77000112.8A25 L46 N52 V53 V54 I95 D98 V99 L102 Y127A25-Y50 HydrophobicContact CB-CD1 4.16Å; A25-Y50 HydrophobicContact CB-CD2 4.38Å; A25-Y50 HydrophobicContact CB-CE1 3.99Å; A25-Y50 HydrophobicContact CB-CE2 4.2Å; A25-Y50 HydrophobicContact CB-CG 4.37Å; L46-Y50 HydrophobicContact CD1-CD2 3.7Å; L46-Y50 HydrophobicContact CD1-CE2 3.52Å; L46-Y50 HydrophobicContact CG-CD2 4.23Å; L46-Y50 HydrophobicContact CG-CE2 4.48Å; L46-Y50 PolarHBondContact O-N 2.94Å; Y50-N52 VanDerWaalsContact C-N 3.29Å; Y50-N52 PolarHBondContact O-N 2.82Å; Y50-V53 PolarHBondContact O-N 3.04Å; Y50-V54 WeakPolarHBondContact O-CB 3.18Å; Y50-V54 WeakPolarHBondContact O-CG1 3.46Å; Y50-V54 PolarHBondContact O-N 2.67Å; Y50-I95 HydrophobicContact CD1-CG2 4.13Å; Y50-D98 PolarHBondContact OH-OD2 3.38Å; Y50-V99 HydrophobicContact CD1-CG2 3.15Å; Y50-V99 HydrophobicContact CD2-CG2 3.77Å; Y50-V99 HydrophobicContact CE1-CG2 3.47Å; Y50-V99 VanDerWaalsContact CE1-CG2 3.47Å; Y50-V99 HydrophobicContact CE2-CG2 4.06Å; Y50-V99 HydrophobicContact CG-CG2 3.3Å; Y50-L102 HydrophobicContact CE2-CD1 3.96Å; Y50-L102 WeakPolarHBondContact OH-CD1 3.19Å; Y50-Y127 WeakPolarHBondContact CB-OH 3.43Å; Y50-Y127 PolarHBondContact O-OH 3.47Å
51K98.1Very high98.1Very high140 Ų14040.5 Ų40.561%0.60922%0.22SC*.Hα-helixtrans-57.8-41.9174.5179.7-176.7175.5-173.90111.6S47 A49 V54 G55 Y127S47-K51 WeakPolarHBondContact O-CB 3.42Å; S47-K51 PolarHBondContact O-N 3.21Å; A49-K51 PolarHBondContact O-N 3.12Å; K51-V54 WeakPolarHBondContact O-CG1 3.3Å; K51-G55 WeakPolarHBondContact O-CA 3.35Å; K51-G55 PolarHBondContact O-N 3.1Å; K51-Y127 PolarHBondContact N-OH 3.24Å
52N98.4Very high98.1Very high58 Ų5840.5 Ų40.531%0.3122%0.215SC..Hα-helixtrans-72.9-43.6178.7-80-73.9000112Y21 V48 A49 Y50 V54 G55 A56Y21-N52 HydrophobicContact CD1-CB 3.56Å; Y21-N52 HydrophobicContact CD2-CB 3.43Å; Y21-N52 VanDerWaalsContact CD2-CB 3.43Å; Y21-N52 HydrophobicContact CE1-CB 3.91Å; Y21-N52 VanDerWaalsContact CE1-ND2 3.34Å; Y21-N52 WeakPolarHBondContact CE1-ND2 3.33Å; Y21-N52 HydrophobicContact CE2-CB 3.78Å; Y21-N52 HydrophobicContact CG-CB 3.29Å; V48-N52 PolarHBondContact O-N 3.49Å; V48-N52 VanDerWaalsContact O-N 3.15Å; V48-N52 PolarHBondContact O-ND2 3.24Å; A49-N52 PolarHBondContact O-N 3.09Å; Y50-N52 VanDerWaalsContact C-N 3.29Å; Y50-N52 PolarHBondContact O-N 2.82Å; N52-V54 PolarHBondContact O-N 3.18Å; N52-G55 PolarHBondContact O-N 3.49Å; N52-A56 PolarHBondContact O-N 3.22Å
53V98.4Very high98.1Very high6 Ų643.5 Ų43.54%0.03624%0.235CC..Hα-helixtrans-59.9-49.2178175.60000111.2Y21 A25 A49 Y50 R57 I95Y21-V53 VanDerWaalsContact C-CG2 3.45Å; Y21-V53 WeakPolarHBondContact O-CG2 3.37Å; A25-V53 HydrophobicContact CB-CG2 4.34Å; A49-V53 WeakPolarHBondContact O-CG2 3.45Å; A49-V53 PolarHBondContact O-N 3.14Å; A49-V53 VanDerWaalsContact O-N 3.15Å; Y50-V53 PolarHBondContact O-N 3.04Å; V53-R57 WeakPolarHBondContact O-CD 3.46Å; V53-R57 PolarHBondContact O-N 3.21Å; V53-I95 HydrophobicContact CG1-CD1 3.6Å; V53-I95 HydrophobicContact CG1-CG1 3.91Å; V53-I95 HydrophobicContact CG1-CG2 4.03Å
54V98.4Very high98Very high1 Ų144.2 Ų44.21%0.00624%0.24CC..Hα-helixtrans-69.2-38.217979.80000111.5Y50 K51 N52 A56 R57 R58 L92 I95 Y127 Y130Y50-V54 WeakPolarHBondContact O-CB 3.18Å; Y50-V54 WeakPolarHBondContact O-CG1 3.46Å; Y50-V54 PolarHBondContact O-N 2.67Å; K51-V54 WeakPolarHBondContact O-CG1 3.3Å; N52-V54 PolarHBondContact O-N 3.18Å; V54-A56 VanDerWaalsContact C-N 3.35Å; V54-A56 PolarHBondContact O-N 3.45Å; V54-R57 PolarHBondContact O-N 2.95Å; V54-R58 WeakPolarHBondContact O-CB 3.29Å; V54-R58 WeakPolarHBondContact O-CG 3.27Å; V54-R58 PolarHBondContact O-N 3.2Å; V54-L92 HydrophobicContact CG2-CD1 3.4Å; V54-I95 HydrophobicContact CB-CG2 4.14Å; V54-I95 HydrophobicContact CG2-CG2 4.39Å; V54-Y127 HydrophobicContact CB-CE1 4.05Å; V54-Y127 HydrophobicContact CG1-CE1 4.01Å; V54-Y127 HydrophobicContact CG2-CD1 4.45Å; V54-Y127 HydrophobicContact CG2-CE1 4.07Å; V54-Y130 HydrophobicContact CG1-CD2 4.11Å; V54-Y130 HydrophobicContact CG1-CE2 3.89Å; V54-Y130 HydrophobicContact CG2-CD2 3.83Å; V54-Y130 HydrophobicContact CG2-CE2 4.45Å; V54-Y130 HydrophobicContact CG2-CG 4.47Å
55G98Very high97.8Very high21 Ų2141.2 Ų41.222%0.21622%0.224CC..Hα-helixtrans-61.3-40.6177.600000113K51 N52 S59K51-G55 WeakPolarHBondContact O-CA 3.35Å; K51-G55 PolarHBondContact O-N 3.1Å; N52-G55 PolarHBondContact O-N 3.49Å; G55-S59 WeakPolarHBondContact O-CB 3.48Å; G55-S59 PolarHBondContact O-N 2.88Å; G55-S59 PolarHBondContact O-OG 2.68Å
56A98.1Very high97.6Very high49 Ų4942.7 Ų42.741%0.40524%0.236SC..Hα-helixtrans-62.3-47.1174.800000111.7N52 V54 S59 S60N52-A56 PolarHBondContact O-N 3.22Å; V54-A56 VanDerWaalsContact C-N 3.35Å; V54-A56 PolarHBondContact O-N 3.45Å; A56-S59 PolarHBondContact O-N 3.02Å; A56-S60 PolarHBondContact O-N 3.46Å; A56-S60 PolarHBondContact O-OG 2.85Å
57R98.3Very high97.3Very high63 Ų6346.8 Ų46.824%0.23826%0.257CS..Hα-helixtrans-64.6-42.8178.3-89.364.9-176.8-164.2-2.5111.9D22 V53 V54 S59 S60 W61 I88 E91 L92 I95D22-R57 IonicContact OD1-NH1 2.95Å; D22-R57 PolarHBondContact OD1-NH1 3.37Å; D22-R57 IonicContact OD2-NH1 3.74Å; V53-R57 WeakPolarHBondContact O-CD 3.46Å; V53-R57 PolarHBondContact O-N 3.21Å; V54-R57 PolarHBondContact O-N 2.95Å; R57-S59 VanDerWaalsContact C-N 3.32Å; R57-S59 PolarHBondContact O-N 3.31Å; R57-S60 PolarHBondContact O-N 3.35Å; R57-W61 WeakPolarHBondContact O-CB 3.47Å; R57-W61 PolarHBondContact O-N 3.1Å; R57-I88 HydrophobicContact CB-CG2 4.35Å; R57-I88 HydrophobicContact CG-CG2 4.47Å; R57-I88 WeakPolarHBondContact O-CG2 3.47Å; R57-E91 HydrophobicContact CG-CB 4.14Å; R57-E91 IonicContact CZ-OE2 2.8Å; R57-E91 IonicContact NE-OE2 3.64Å; R57-E91 PolarHBondContact NE-OE2 3.31Å; R57-E91 VanDerWaalsContact NE-OE2 3.14Å; R57-E91 IonicContact NH2-OE2 2.81Å; R57-L92 HydrophobicContact CB-CB 4.4Å; R57-L92 HydrophobicContact CB-CD1 3.99Å; R57-I95 HydrophobicContact CB-CD1 4.44Å; R57-I95 HydrophobicContact CG-CD1 3.86Å
58R97.9Very high96.9Very high31 Ų3147.2 Ų47.212%0.11726%0.255CS..Hα-helixtrans-61.2-39.5175.3-72.6178.267.6-12812.9112.5V54 W61 R62 L92 Y130 E133V54-R58 WeakPolarHBondContact O-CB 3.29Å; V54-R58 WeakPolarHBondContact O-CG 3.27Å; V54-R58 PolarHBondContact O-N 3.2Å; R58-W61 PolarHBondContact O-N 2.93Å; R58-R62 WeakPolarHBondContact O-CG 3.35Å; R58-R62 PolarHBondContact O-N 3.06Å; R58-L92 HydrophobicContact CG-CD1 3.69Å; R58-L92 HydrophobicContact CG-CD2 4.14Å; R58-Y130 VanDerWaalsContact NE-CD1 3.3Å; R58-E133 IonicContact CZ-OE1 3.28Å; R58-E133 IonicContact CZ-OE2 3.14Å; R58-E133 VanDerWaalsContact CZ-OE2 3.28Å; R58-E133 IonicContact NE-OE1 2.84Å; R58-E133 PolarHBondContact NE-OE1 2.97Å; R58-E133 IonicContact NE-OE2 2.62Å; R58-E133 PolarHBondContact NE-OE2 3.38Å; R58-E133 IonicContact NH2-OE1 2.62Å; R58-E133 PolarHBondContact NH2-OE1 3.28Å; R58-E133 IonicContact NH2-OE2 3.25Å; R58-E133 PolarHBondContact NH2-OE2 3.36Å
59S98.1Very high96.4Very high68 Ų6852 Ų5248%0.47628%0.275SS..Hα-helixtrans-65.4-47.9177.2-58.10000111G55 A56 R57 W61 R62 V63G55-S59 WeakPolarHBondContact O-CB 3.48Å; G55-S59 PolarHBondContact O-N 2.88Å; G55-S59 PolarHBondContact O-OG 2.68Å; A56-S59 PolarHBondContact O-N 3.02Å; R57-S59 VanDerWaalsContact C-N 3.32Å; R57-S59 PolarHBondContact O-N 3.31Å; S59-W61 VanDerWaalsContact C-N 3.33Å; S59-W61 PolarHBondContact O-N 2.88Å; S59-R62 PolarHBondContact O-N 2.86Å; S59-V63 WeakPolarHBondContact O-CG2 3.2Å; S59-V63 PolarHBondContact O-N 3.33Å
60S98.2Very high95.9Very high58 Ų5859.7 Ų59.741%0.40631%0.308SS..Hα-helixtrans-58-45.3174.2-62.20000111.8A56 R57 R62 V63 I64A56-S60 PolarHBondContact O-N 3.46Å; A56-S60 PolarHBondContact O-OG 2.85Å; R57-S60 PolarHBondContact O-N 3.35Å; S60-R62 PolarHBondContact O-N 3.22Å; S60-V63 PolarHBondContact O-N 2.67Å; S60-I64 WeakPolarHBondContact O-CG1 3.34Å; S60-I64 PolarHBondContact O-N 2.84Å
61W97.9Very high95.1Very high43 Ų4360.9 Ų60.916%0.16332%0.316CS..Hα-helixtrans-59.6-45.9179.2177.479.9000112.4R57 R58 S59 V63 I64 S65 I88 E89 E133 V134R57-W61 WeakPolarHBondContact O-CB 3.47Å; R57-W61 PolarHBondContact O-N 3.1Å; R58-W61 PolarHBondContact O-N 2.93Å; S59-W61 VanDerWaalsContact C-N 3.33Å; S59-W61 PolarHBondContact O-N 2.88Å; W61-V63 VanDerWaalsContact C-N 3.35Å; W61-V63 PolarHBondContact O-N 2.86Å; W61-I64 PolarHBondContact O-N 2.97Å; W61-S65 VanDerWaalsContact O-CB 3.26Å; W61-S65 WeakPolarHBondContact O-CB 3.32Å; W61-S65 PolarHBondContact O-N 3.4Å; W61-S65 PolarHBondContact O-OG 2.87Å; W61-I88 HydrophobicContact CB-CG2 3.74Å; W61-E89 VanDerWaalsContact CD1-CG 3.49Å; W61-E89 PolarHBondContact NE1-OE1 3.21Å; W61-E133 WeakPolarHBondContact CH2-O 3.17Å; W61-V134 HydrophobicContact CD2-CG1 3.83Å; W61-V134 HydrophobicContact CE3-CG1 4.3Å; W61-V134 HydrophobicContact CG-CG1 4.24Å; W61-V134 HydrophobicContact CH2-CG1 4.28Å; W61-V134 HydrophobicContact CZ2-CB 4.46Å; W61-V134 HydrophobicContact CZ2-CG1 3.82Å
62R96.8Very high94Very high104 Ų10461.6 Ų61.639%0.39232%0.322SS..Hα-helixtrans-59.1-45176.7-75-176.117986.610.3112.2R58 S59 S60 S66 E133R58-R62 WeakPolarHBondContact O-CG 3.35Å; R58-R62 PolarHBondContact O-N 3.06Å; S59-R62 PolarHBondContact O-N 2.86Å; S60-R62 PolarHBondContact O-N 3.22Å; R62-S66 PolarHBondContact O-N 3.42Å; R62-E133 IonicContact NH2-OE2 3.05Å; R62-E133 PolarHBondContact NH2-OE2 2.9Å
63V97Very high93.1Very high86 Ų8670.6 Ų70.652%0.52135%0.351SS..Hα-helixtrans-62-49.9179.7171.90000110.5S59 S60 W61 S66 I67S59-V63 WeakPolarHBondContact O-CG2 3.2Å; S59-V63 PolarHBondContact O-N 3.33Å; S60-V63 PolarHBondContact O-N 2.67Å; W61-V63 VanDerWaalsContact C-N 3.35Å; W61-V63 PolarHBondContact O-N 2.86Å; V63-S66 PolarHBondContact O-N 3.28Å; V63-I67 HydrophobicContact CG1-CD1 3.91Å; V63-I67 WeakPolarHBondContact O-CG1 3.49Å; V63-I67 PolarHBondContact O-N 3.49Å
64I96Very high92.5Very high28 Ų2873.7 Ų73.714%0.14437%0.367CS..Hα-helixtrans-67.3-41.1-177.9-62.6-55.4000111.4S60 W61 S66 I67 E68 Y84 R85 I88S60-I64 WeakPolarHBondContact O-CG1 3.34Å; S60-I64 PolarHBondContact O-N 2.84Å; W61-I64 PolarHBondContact O-N 2.97Å; I64-S66 VanDerWaalsContact C-N 3.29Å; I64-S66 PolarHBondContact O-N 2.98Å; I64-I67 HydrophobicContact CD1-CD1 4.3Å; I64-I67 PolarHBondContact O-N 3.03Å; I64-I67 VanDerWaalsContact O-N 3.13Å; I64-E68 WeakPolarHBondContact O-CB 3.38Å; I64-E68 PolarHBondContact O-N 3.35Å; I64-Y84 HydrophobicContact CB-CD1 4.49Å; I64-Y84 HydrophobicContact CD1-CD1 3.61Å; I64-Y84 HydrophobicContact CD1-CE1 3.79Å; I64-Y84 HydrophobicContact CG1-CD1 3.63Å; I64-Y84 HydrophobicContact CG1-CE1 3.85Å; I64-Y84 HydrophobicContact CG2-CD1 4.08Å; I64-R85 HydrophobicContact CG2-CB 3.94Å; I64-I88 HydrophobicContact CB-CD1 4.23Å; I64-I88 HydrophobicContact CG1-CD1 3.73Å
65S94Very high92Very high13 Ų1381.6 Ų81.69%0.09141%0.405CS..Hα-helixtrans-58.9-40.9174.9-58.70000111.8W61 Q69 R85W61-S65 VanDerWaalsContact O-CB 3.26Å; W61-S65 WeakPolarHBondContact O-CB 3.32Å; W61-S65 PolarHBondContact O-N 3.4Å; W61-S65 PolarHBondContact O-OG 2.87Å; S65-Q69 VanDerWaalsContact O-CG 3.3Å; S65-Q69 WeakPolarHBondContact O-CG 3.46Å; S65-Q69 PolarHBondContact O-N 2.76Å; S65-Q69 VanDerWaalsContact O-N 3.12Å; S65-R85 VanDerWaalsContact OG-CD 3.23Å; S65-R85 WeakPolarHBondContact OG-CD 3.33Å
66S93.6Very high91.6Very high40 Ų4088.1 Ų88.128%0.2843%0.427SS..Hα-helixtrans-67.3-38.4175.3-171.90000112.8R62 V63 I64 K70R62-S66 PolarHBondContact O-N 3.42Å; V63-S66 PolarHBondContact O-N 3.28Å; I64-S66 VanDerWaalsContact C-N 3.29Å; I64-S66 PolarHBondContact O-N 2.98Å; S66-K70 WeakPolarHBondContact O-CG 3.44Å; S66-K70 PolarHBondContact O-N 3.47Å; S66-K70 PolarHBondContact OG-NZ 2.91Å; S66-K70 VanDerWaalsContact OG-NZ 3.11Å
67I91.9Very high91.2Very high88 Ų8891.9 Ų91.945%0.45143%0.434SS..Hα-helixtrans-66.1-45.4176.7-69.4167.8000110.6V63 I64 Q69 K70 T71V63-I67 HydrophobicContact CG1-CD1 3.91Å; V63-I67 WeakPolarHBondContact O-CG1 3.49Å; V63-I67 PolarHBondContact O-N 3.49Å; I64-I67 HydrophobicContact CD1-CD1 4.3Å; I64-I67 PolarHBondContact O-N 3.03Å; I64-I67 VanDerWaalsContact O-N 3.13Å; I67-Q69 PolarHBondContact O-N 3Å; I67-K70 PolarHBondContact O-N 2.99Å; I67-T71 WeakPolarHBondContact O-CB 3.39Å; I67-T71 PolarHBondContact O-N 3.41Å; I67-T71 VanDerWaalsContact O-N 3.17Å; I67-T71 PolarHBondContact O-OG1 3.02Å
68E89.6Confident90.8Very high40 Ų4092.1 Ų92.119%0.18744%0.438CS..Hα-helixtrans-56.2-50.6177.6-178.6-177.1166.100110.8I64 K70 T71 K82 R85I64-E68 WeakPolarHBondContact O-CB 3.38Å; I64-E68 PolarHBondContact O-N 3.35Å; E68-K70 VanDerWaalsContact C-N 3.34Å; E68-K70 PolarHBondContact O-N 3.36Å; E68-T71 PolarHBondContact O-N 3.39Å; E68-K82 WeakPolarHBondContact OE1-CB 3.37Å; E68-R85 IonicContact OE1-CZ 3.21Å; E68-R85 IonicContact OE1-NE 3.72Å; E68-R85 IonicContact OE1-NH2 3.54Å; E68-R85 PolarHBondContact OE1-NH2 3.4Å; E68-R85 VanDerWaalsContact OE2-CD 3.29Å; E68-R85 WeakPolarHBondContact OE2-CD 3.46Å; E68-R85 IonicContact OE2-CZ 3.7Å; E68-R85 IonicContact OE2-NE 3.85Å; E68-R85 PolarHBondContact OE2-NE 2.98Å; E68-R85 IonicContact OE2-NH2 2.68Å
69Q87.7Confident90.6Very high147 Ų14795 Ų9569%0.68745%0.452SS*.Hα-helixtrans-60.5-38.3179.3-73.1173.1-4.400113.2S65 I67 T71S65-Q69 VanDerWaalsContact O-CG 3.3Å; S65-Q69 WeakPolarHBondContact O-CG 3.46Å; S65-Q69 PolarHBondContact O-N 2.76Å; S65-Q69 VanDerWaalsContact O-N 3.12Å; I67-Q69 PolarHBondContact O-N 3Å; Q69-T71 VanDerWaalsContact C-N 3.32Å; Q69-T71 PolarHBondContact O-N 3.45Å
70K89.7Confident90.4Very high161 Ų16197 Ų9770%0.746%0.456SS*.Hα-helixtrans-80-10.8-178.7-70.8170179.5162.10113.7S66 I67 E68 E72S66-K70 WeakPolarHBondContact O-CG 3.44Å; S66-K70 PolarHBondContact O-N 3.47Å; S66-K70 PolarHBondContact OG-NZ 2.91Å; S66-K70 VanDerWaalsContact OG-NZ 3.11Å; I67-K70 PolarHBondContact O-N 2.99Å; E68-K70 VanDerWaalsContact C-N 3.34Å; E68-K70 PolarHBondContact O-N 3.36Å; K70-E72 VanDerWaalsContact C-N 3.28Å; K70-E72 PolarHBondContact O-N 2.98Å; K70-E72 VanDerWaalsContact O-N 3.13Å
71T81.9Confident90.1Very high33 Ų3394.9 Ų94.920%0.20244%0.443CS..  trans-89.651.6-172.8-58.40000111.7I67 E68 Q69 R73 K77 Q78I67-T71 WeakPolarHBondContact O-CB 3.39Å; I67-T71 PolarHBondContact O-N 3.41Å; I67-T71 VanDerWaalsContact O-N 3.17Å; I67-T71 PolarHBondContact O-OG1 3.02Å; E68-T71 PolarHBondContact O-N 3.39Å; Q69-T71 VanDerWaalsContact C-N 3.32Å; Q69-T71 PolarHBondContact O-N 3.45Å; T71-R73 VanDerWaalsContact C-N 3.32Å; T71-R73 PolarHBondContact O-N 2.94Å; T71-K77 HydrophobicContact CG2-CB 3.42Å; T71-K77 VanDerWaalsContact CG2-CB 3.42Å; T71-K77 HydrophobicContact CG2-CD 4.21Å; T71-K77 HydrophobicContact CG2-CG 4.48Å; T71-Q78 HydrophobicContact CG2-CG 4.34Å; T71-Q78 WeakPolarHBondContact O-CG 3.45Å; T71-Q78 PolarHBondContact O-NE2 3.19Å
72E74.9Confident90Very high155 Ų15596.7 Ų96.772%0.72445%0.452SS*.THydrogen-bonded Turntrans-67.5-22.7-170.6-67-179175.100115.4K70 Q78K70-E72 VanDerWaalsContact C-N 3.28Å; K70-E72 PolarHBondContact O-N 2.98Å; K70-E72 VanDerWaalsContact O-N 3.13Å; E72-Q78 PolarHBondContact O-NE2 3.28Å
73R78.9Confident89.9Confident248 Ų24896.7 Ų96.794%0.93646%0.456SS*.THydrogen-bonded Turntrans-991.7-166.1-62.3-174.5-178.5-176.80.4116T71T71-R73 VanDerWaalsContact C-N 3.32Å; T71-R73 PolarHBondContact O-N 2.94Å
74N85.2Confident89.9Confident70 Ų7098.4 Ų98.437%0.37445%0.454SS..  trans-144.2102-176.4-174-44.8000111.2K76 K77 Q78N74-K76 VanDerWaalsContact C-N 3.26Å; N74-K76 PolarHBondContact O-N 3.35Å; N74-K76 WeakPolarHBondContact OD1-CB 3.44Å; N74-K76 PolarHBondContact OD1-N 3.46Å; N74-K76 VanDerWaalsContact OD1-N 3.09Å; N74-K77 HydrophobicContact CB-CB 4.08Å; N74-K77 HydrophobicContact CB-CD 4.15Å; N74-K77 HydrophobicContact CB-CG 4.12Å; N74-K77 PolarHBondContact O-N 2.85Å; N74-K77 PolarHBondContact OD1-N 3.26Å; N74-Q78 PolarHBondContact O-N 3.36Å
75E88.1Confident90Very high168 Ų16899.2 Ų99.279%0.78546%0.455SS*.Hα-helixtrans-52.7-41.5-179.7-65.3179.1171.700112.7K77 Q78 Q79E75-K77 PolarHBondContact O-N 2.95Å; E75-Q78 PolarHBondContact O-N 3.09Å; E75-Q79 WeakPolarHBondContact O-CB 3.39Å; E75-Q79 PolarHBondContact O-N 3.43Å
76K90.5Very high90.1Very high157 Ų157102.7 Ų102.768%0.68347%0.47SS*.Hα-helixtrans-63.7-42.2178.5-175177-179.3177.30111.6N74 M80N74-K76 VanDerWaalsContact C-N 3.26Å; N74-K76 PolarHBondContact O-N 3.35Å; N74-K76 WeakPolarHBondContact OD1-CB 3.44Å; N74-K76 PolarHBondContact OD1-N 3.46Å; N74-K76 VanDerWaalsContact OD1-N 3.09Å; K76-M80 HydrophobicContact CG-SD 4.39Å; K76-M80 VanDerWaalsContact O-CG 3.25Å; K76-M80 WeakPolarHBondContact O-CG 3.5Å; K76-M80 PolarHBondContact O-N 2.9Å
77K89.3Confident90.3Very high128 Ų128106.2 Ų106.256%0.55748%0.481SS*.Hα-helixtrans-70.4-35.6177.3-68.8-175174.9-174.70112.2T71 N74 E75 M80 G81T71-K77 HydrophobicContact CG2-CB 3.42Å; T71-K77 VanDerWaalsContact CG2-CB 3.42Å; T71-K77 HydrophobicContact CG2-CD 4.21Å; T71-K77 HydrophobicContact CG2-CG 4.48Å; N74-K77 HydrophobicContact CB-CB 4.08Å; N74-K77 HydrophobicContact CB-CD 4.15Å; N74-K77 HydrophobicContact CB-CG 4.12Å; N74-K77 PolarHBondContact O-N 2.85Å; N74-K77 PolarHBondContact OD1-N 3.26Å; E75-K77 PolarHBondContact O-N 2.95Å; K77-M80 PolarHBondContact O-N 3.17Å; K77-G81 PolarHBondContact O-N 3.4Å
78Q90.5Very high90.6Very high69 Ų69102.3 Ų102.332%0.32246%0.46SS..Hα-helixtrans-60.9-48.7173.1-71175.7-1.500111T71 E72 N74 E75 M80 G81 K82T71-Q78 HydrophobicContact CG2-CG 4.34Å; T71-Q78 WeakPolarHBondContact O-CG 3.45Å; T71-Q78 PolarHBondContact O-NE2 3.19Å; E72-Q78 PolarHBondContact O-NE2 3.28Å; N74-Q78 PolarHBondContact O-N 3.36Å; E75-Q78 PolarHBondContact O-N 3.09Å; Q78-M80 VanDerWaalsContact C-N 3.34Å; Q78-M80 PolarHBondContact O-N 2.87Å; Q78-G81 PolarHBondContact O-N 3.23Å; Q78-G81 VanDerWaalsContact O-N 3.12Å; Q78-K82 WeakPolarHBondContact O-CB 3.26Å; Q78-K82 PolarHBondContact O-N 3.48Å
79Q92.7Very high91Very high90 Ų90101.5 Ų101.542%0.42146%0.457SS..Hα-helixtrans-60.6-43.7179-175.857.632.800111.6E75 G81 K82 E83E75-Q79 WeakPolarHBondContact O-CB 3.39Å; E75-Q79 PolarHBondContact O-N 3.43Å; Q79-G81 VanDerWaalsContact C-N 3.34Å; Q79-G81 PolarHBondContact O-N 3.47Å; Q79-K82 PolarHBondContact O-N 3.42Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.48Å; Q79-E83 PolarHBondContact NE2-OE1 2.9Å; Q79-E83 WeakPolarHBondContact O-CB 3.35Å; Q79-E83 WeakPolarHBondContact O-CG 3.38Å; Q79-E83 PolarHBondContact O-N 2.97Å
80M93.5Very high91.4Very high112 Ų11296.6 Ų96.655%0.55244%0.441SS*.Hα-helixtrans-61.6-40.2174-71175.369.200112.7K76 K77 Q78 Y84K76-M80 HydrophobicContact CG-SD 4.39Å; K76-M80 VanDerWaalsContact O-CG 3.25Å; K76-M80 WeakPolarHBondContact O-CG 3.5Å; K76-M80 PolarHBondContact O-N 2.9Å; K77-M80 PolarHBondContact O-N 3.17Å; Q78-M80 VanDerWaalsContact C-N 3.34Å; Q78-M80 PolarHBondContact O-N 2.87Å; M80-Y84 WeakPolarHBondContact O-CB 3.33Å; M80-Y84 PolarHBondContact O-N 3.44Å; M80-Y84 VanDerWaalsContact O-N 3.12Å
81G93.4Very high91.9Very high12 Ų1291.8 Ų91.812%0.12442%0.421CS..Hα-helixtrans-62.2-47.6175.900000111.8K77 Q78 Q79 Y84 R85K77-G81 PolarHBondContact O-N 3.4Å; Q78-G81 PolarHBondContact O-N 3.23Å; Q78-G81 VanDerWaalsContact O-N 3.12Å; Q79-G81 VanDerWaalsContact C-N 3.34Å; Q79-G81 PolarHBondContact O-N 3.47Å; G81-Y84 PolarHBondContact O-N 2.84Å; G81-R85 WeakPolarHBondContact O-CB 3.42Å; G81-R85 PolarHBondContact O-N 2.8Å
82K94.4Very high92.6Very high81 Ų8190.2 Ų90.235%0.35241%0.412SS..Hα-helixtrans-59.7-51.1177177.4174.9175.5-176.60112.5E68 Q78 Q79 Y84 R85 E86E68-K82 WeakPolarHBondContact OE1-CB 3.37Å; Q78-K82 WeakPolarHBondContact O-CB 3.26Å; Q78-K82 PolarHBondContact O-N 3.48Å; Q79-K82 PolarHBondContact O-N 3.42Å; K82-Y84 VanDerWaalsContact C-N 3.25Å; K82-Y84 PolarHBondContact O-N 2.96Å; K82-R85 WeakPolarHBondContact O-CB 3.47Å; K82-R85 PolarHBondContact O-N 3.3Å; K82-E86 WeakPolarHBondContact CE-OE1 3.08Å; K82-E86 HydrophobicContact CG-CG 4.48Å; K82-E86 IonicContact NZ-OE1 3.9Å; K82-E86 WeakPolarHBondContact O-CG 3.33Å; K82-E86 PolarHBondContact O-N 2.85Å
83E96.3Very high93.7Very high104 Ų10486.3 Ų86.349%0.48639%0.394SS..Hα-helixtrans-58.5-39.8178.8-75.3169.7-170.100111.7Q79 K87Q79-E83 WeakPolarHBondContact CG-OE1 3.48Å; Q79-E83 PolarHBondContact NE2-OE1 2.9Å; Q79-E83 WeakPolarHBondContact O-CB 3.35Å; Q79-E83 WeakPolarHBondContact O-CG 3.38Å; Q79-E83 PolarHBondContact O-N 2.97Å; E83-K87 PolarHBondContact O-N 2.91Å
84Y97Very high94.6Very high122 Ų12279.9 Ų79.948%0.47838%0.378SS..Hα-helixtrans-73.8-35.6178.6-163-121.5000112.5I64 M80 G81 K82 K87 I88I64-Y84 HydrophobicContact CB-CD1 4.49Å; I64-Y84 HydrophobicContact CD1-CD1 3.61Å; I64-Y84 HydrophobicContact CD1-CE1 3.79Å; I64-Y84 HydrophobicContact CG1-CD1 3.63Å; I64-Y84 HydrophobicContact CG1-CE1 3.85Å; I64-Y84 HydrophobicContact CG2-CD1 4.08Å; M80-Y84 WeakPolarHBondContact O-CB 3.33Å; M80-Y84 PolarHBondContact O-N 3.44Å; M80-Y84 VanDerWaalsContact O-N 3.12Å; G81-Y84 PolarHBondContact O-N 2.84Å; K82-Y84 VanDerWaalsContact C-N 3.25Å; K82-Y84 PolarHBondContact O-N 2.96Å; Y84-K87 HydrophobicContact CD2-CD 4.4Å; Y84-K87 HydrophobicContact CE2-CD 4.42Å; Y84-K87 PolarHBondContact O-N 2.87Å; Y84-I88 HydrophobicContact CD1-CD1 4.09Å; Y84-I88 HydrophobicContact CE1-CD1 3.94Å; Y84-I88 WeakPolarHBondContact O-CG1 3.41Å; Y84-I88 PolarHBondContact O-N 3.48Å; Y84-I88 VanDerWaalsContact O-N 3.17Å
85R96.4Very high95.3Very high45 Ų4577.7 Ų77.717%0.1737%0.366CS..Hα-helixtrans-59.8-51.6170.9-178.1179.651726.8110.6I64 S65 E68 G81 K82 K87 I88 E89I64-R85 HydrophobicContact CG2-CB 3.94Å; S65-R85 VanDerWaalsContact OG-CD 3.23Å; S65-R85 WeakPolarHBondContact OG-CD 3.33Å; E68-R85 IonicContact OE1-CZ 3.21Å; E68-R85 IonicContact OE1-NE 3.72Å; E68-R85 IonicContact OE1-NH2 3.54Å; E68-R85 PolarHBondContact OE1-NH2 3.4Å; E68-R85 VanDerWaalsContact OE2-CD 3.29Å; E68-R85 WeakPolarHBondContact OE2-CD 3.46Å; E68-R85 IonicContact OE2-CZ 3.7Å; E68-R85 IonicContact OE2-NE 3.85Å; E68-R85 PolarHBondContact OE2-NE 2.98Å; E68-R85 IonicContact OE2-NH2 2.68Å; G81-R85 WeakPolarHBondContact O-CB 3.42Å; G81-R85 PolarHBondContact O-N 2.8Å; K82-R85 WeakPolarHBondContact O-CB 3.47Å; K82-R85 PolarHBondContact O-N 3.3Å; R85-K87 VanDerWaalsContact C-N 3.27Å; R85-K87 PolarHBondContact O-N 2.87Å; R85-I88 PolarHBondContact O-N 3.49Å; R85-E89 WeakPolarHBondContact CD-OE1 3.47Å; R85-E89 HydrophobicContact CG-CG 4.37Å; R85-E89 WeakPolarHBondContact CG-OE1 3.28Å; R85-E89 IonicContact CZ-OE1 2.72Å; R85-E89 IonicContact NE-OE1 3.08Å; R85-E89 IonicContact NH1-OE1 3.97Å; R85-E89 PolarHBondContact NH1-OE1 3.38Å; R85-E89 IonicContact NH1-OE2 3.84Å; R85-E89 PolarHBondContact NH1-OE2 3.2Å; R85-E89 VanDerWaalsContact NH1-OE2 3.08Å; R85-E89 WeakPolarHBondContact O-CG 3.28Å; R85-E89 PolarHBondContact O-N 2.95Å
86E96.6Very high95.8Very high86 Ų8669.7 Ų69.740%0.40233%0.328SS..Hα-helixtrans-60.2-36.6-179.5-72.7173.8174.100111.9K82 E89 A90K82-E86 WeakPolarHBondContact CE-OE1 3.08Å; K82-E86 HydrophobicContact CG-CG 4.48Å; K82-E86 IonicContact NZ-OE1 3.9Å; K82-E86 WeakPolarHBondContact O-CG 3.33Å; K82-E86 PolarHBondContact O-N 2.85Å; E86-E89 PolarHBondContact O-N 3.4Å; E86-A90 PolarHBondContact O-N 3.32Å
87K98.1Very high96.1Very high115 Ų11566.1 Ų66.150%0.532%0.317SS..Hα-helixtrans-60-47171.6-179.4-178.5175-177.90112.1E83 Y84 R85 E89 A90 E91E83-K87 PolarHBondContact O-N 2.91Å; Y84-K87 HydrophobicContact CD2-CD 4.4Å; Y84-K87 HydrophobicContact CE2-CD 4.42Å; Y84-K87 PolarHBondContact O-N 2.87Å; R85-K87 VanDerWaalsContact C-N 3.27Å; R85-K87 PolarHBondContact O-N 2.87Å; K87-E89 VanDerWaalsContact C-N 3.31Å; K87-A90 PolarHBondContact O-N 3.15Å; K87-E91 VanDerWaalsContact CE-OE1 3.25Å; K87-E91 WeakPolarHBondContact CE-OE1 3.16Å; K87-E91 PolarHBondContact O-N 2.84Å
88I98.1Very high96.6Very high5 Ų561.9 Ų61.93%0.02630%0.3CS..Hα-helixtrans-66.6-37179.5-62.4162.9000110.6R57 W61 I64 Y84 R85 E91 L92R57-I88 HydrophobicContact CB-CG2 4.35Å; R57-I88 HydrophobicContact CG-CG2 4.47Å; R57-I88 WeakPolarHBondContact O-CG2 3.47Å; W61-I88 HydrophobicContact CB-CG2 3.74Å; I64-I88 HydrophobicContact CB-CD1 4.23Å; I64-I88 HydrophobicContact CG1-CD1 3.73Å; Y84-I88 HydrophobicContact CD1-CD1 4.09Å; Y84-I88 HydrophobicContact CE1-CD1 3.94Å; Y84-I88 WeakPolarHBondContact O-CG1 3.41Å; Y84-I88 PolarHBondContact O-N 3.48Å; Y84-I88 VanDerWaalsContact O-N 3.17Å; R85-I88 PolarHBondContact O-N 3.49Å; I88-E91 PolarHBondContact O-N 3.06Å; I88-L92 VanDerWaalsContact O-CB 3.32Å; I88-L92 WeakPolarHBondContact O-CB 3.32Å; I88-L92 PolarHBondContact O-N 3.15Å
89E97.7Very high96.9Very high23 Ų2358.7 Ų58.711%0.10729%0.285CS..Hα-helixtrans-61.3-43.2174.9-69.2172.7175.400111.6W61 R85 E86 K87 L92 Q93 V134W61-E89 VanDerWaalsContact CD1-CG 3.49Å; W61-E89 PolarHBondContact NE1-OE1 3.21Å; R85-E89 WeakPolarHBondContact CD-OE1 3.47Å; R85-E89 HydrophobicContact CG-CG 4.37Å; R85-E89 WeakPolarHBondContact CG-OE1 3.28Å; R85-E89 IonicContact CZ-OE1 2.72Å; R85-E89 IonicContact NE-OE1 3.08Å; R85-E89 IonicContact NH1-OE1 3.97Å; R85-E89 PolarHBondContact NH1-OE1 3.38Å; R85-E89 IonicContact NH1-OE2 3.84Å; R85-E89 PolarHBondContact NH1-OE2 3.2Å; R85-E89 VanDerWaalsContact NH1-OE2 3.08Å; R85-E89 WeakPolarHBondContact O-CG 3.28Å; R85-E89 PolarHBondContact O-N 2.95Å; E86-E89 PolarHBondContact O-N 3.4Å; K87-E89 VanDerWaalsContact C-N 3.31Å; E89-L92 PolarHBondContact O-N 3.45Å; E89-Q93 WeakPolarHBondContact O-CB 3.34Å; E89-Q93 VanDerWaalsContact O-CG 3.22Å; E89-Q93 WeakPolarHBondContact O-CG 3.38Å; E89-Q93 PolarHBondContact O-N 3.41Å; E89-V134 HydrophobicContact CG-CB 4.03Å; E89-V134 HydrophobicContact CG-CG1 4.24Å
90A97.6Very high97.2Very high44 Ų4455 Ų5536%0.36427%0.268SS..Hα-helixtrans-62-47.3174.800000111.8E86 K87 L92 Q93 D94E86-A90 PolarHBondContact O-N 3.32Å; K87-A90 PolarHBondContact O-N 3.15Å; A90-L92 VanDerWaalsContact C-N 3.31Å; A90-L92 PolarHBondContact O-N 3.19Å; A90-Q93 PolarHBondContact O-N 2.78Å; A90-D94 PolarHBondContact O-N 3.26Å
91E98.2Very high97.5Very high60 Ų6053.8 Ų53.828%0.2826%0.261SS..Hα-helixtrans-58.7-43.1175.2-69.8178.6-160.200111.8R57 K87 I88 D94 I95R57-E91 HydrophobicContact CG-CB 4.14Å; R57-E91 IonicContact CZ-OE2 2.8Å; R57-E91 IonicContact NE-OE2 3.64Å; R57-E91 PolarHBondContact NE-OE2 3.31Å; R57-E91 VanDerWaalsContact NE-OE2 3.14Å; R57-E91 IonicContact NH2-OE2 2.81Å; K87-E91 VanDerWaalsContact CE-OE1 3.25Å; K87-E91 WeakPolarHBondContact CE-OE1 3.16Å; K87-E91 PolarHBondContact O-N 2.84Å; I88-E91 PolarHBondContact O-N 3.06Å; E91-D94 PolarHBondContact O-N 3.36Å; E91-I95 VanDerWaalsContact O-CD1 3.27Å; E91-I95 WeakPolarHBondContact O-CD1 2.99Å; E91-I95 VanDerWaalsContact O-CG1 3.24Å; E91-I95 WeakPolarHBondContact O-CG1 3.39Å; E91-I95 PolarHBondContact O-N 3.4Å
92L98Very high97.7Very high0 Ų053.3 Ų53.30%026%0.256CS..Hα-helixtrans-63-43177.9-176.269.6000111.4V54 R57 R58 I88 E89 A90 I95 C96 V134V54-L92 HydrophobicContact CG2-CD1 3.4Å; R57-L92 HydrophobicContact CB-CB 4.4Å; R57-L92 HydrophobicContact CB-CD1 3.99Å; R58-L92 HydrophobicContact CG-CD1 3.69Å; R58-L92 HydrophobicContact CG-CD2 4.14Å; I88-L92 VanDerWaalsContact O-CB 3.32Å; I88-L92 WeakPolarHBondContact O-CB 3.32Å; I88-L92 PolarHBondContact O-N 3.15Å; E89-L92 PolarHBondContact O-N 3.45Å; A90-L92 VanDerWaalsContact C-N 3.31Å; A90-L92 PolarHBondContact O-N 3.19Å; L92-I95 PolarHBondContact O-N 3.48Å; L92-C96 WeakPolarHBondContact O-CB 3.46Å; L92-C96 PolarHBondContact O-N 2.84Å; L92-C96 PolarHBondContact O-SG 3.27Å; L92-V134 HydrophobicContact CD2-CB 4.43Å; L92-V134 HydrophobicContact CD2-CG1 3.53Å; L92-V134 HydrophobicContact CD2-CG2 4.01Å
93Q97.7Very high97.9Very high74 Ų7449.5 Ų49.535%0.34624%0.239SC..Hα-helixtrans-62.1-45.7176.9-75.3171.71400111.4E89 A90 I95 C96 N97 L131E89-Q93 WeakPolarHBondContact O-CB 3.34Å; E89-Q93 VanDerWaalsContact O-CG 3.22Å; E89-Q93 WeakPolarHBondContact O-CG 3.38Å; E89-Q93 PolarHBondContact O-N 3.41Å; A90-Q93 PolarHBondContact O-N 2.78Å; Q93-I95 PolarHBondContact O-N 2.76Å; Q93-C96 PolarHBondContact O-N 3.4Å; Q93-N97 WeakPolarHBondContact O-CB 3.06Å; Q93-N97 VanDerWaalsContact O-CG 3.24Å; Q93-N97 PolarHBondContact O-N 3.06Å; Q93-N97 PolarHBondContact O-ND2 2.92Å; Q93-N97 VanDerWaalsContact O-ND2 3.15Å; Q93-L131 HydrophobicContact CB-CD2 4.2Å; Q93-L131 HydrophobicContact CG-CD2 3.79Å
94D98.2Very high98.1Very high113 Ų11348 Ų4860%0.60424%0.235SC*.Hα-helixtrans-59.5-47.9177.8-70.9-18.9000111.3A90 E91 C96 N97 D98A90-D94 PolarHBondContact O-N 3.26Å; E91-D94 PolarHBondContact O-N 3.36Å; D94-C96 PolarHBondContact O-N 3.35Å; D94-N97 PolarHBondContact O-N 3.36Å; D94-D98 WeakPolarHBondContact O-CB 3.27Å; D94-D98 PolarHBondContact O-N 3.01Å
95I98.4Very high98.1Very high23 Ų2347.9 Ų47.912%0.11824%0.237CC..Hα-helixtrans-60.3-45.8177.4-65.8155.8000111Y50 V53 V54 R57 E91 L92 Q93 D98 V99Y50-I95 HydrophobicContact CD1-CG2 4.13Å; V53-I95 HydrophobicContact CG1-CD1 3.6Å; V53-I95 HydrophobicContact CG1-CG1 3.91Å; V53-I95 HydrophobicContact CG1-CG2 4.03Å; V54-I95 HydrophobicContact CB-CG2 4.14Å; V54-I95 HydrophobicContact CG2-CG2 4.39Å; R57-I95 HydrophobicContact CB-CD1 4.44Å; R57-I95 HydrophobicContact CG-CD1 3.86Å; E91-I95 VanDerWaalsContact O-CD1 3.27Å; E91-I95 WeakPolarHBondContact O-CD1 2.99Å; E91-I95 VanDerWaalsContact O-CG1 3.24Å; E91-I95 WeakPolarHBondContact O-CG1 3.39Å; E91-I95 PolarHBondContact O-N 3.4Å; L92-I95 PolarHBondContact O-N 3.48Å; Q93-I95 PolarHBondContact O-N 2.76Å; I95-D98 PolarHBondContact O-N 3.45Å; I95-V99 PolarHBondContact O-N 3.04Å
96C98.5Very high98.2Very high0 Ų049 Ų490%024%0.241CC..Hα-helixtrans-66.5-43.6-178.8-65.90000111.7L92 Q93 D94 D98 V99 L100 Y127 L131L92-C96 WeakPolarHBondContact O-CB 3.46Å; L92-C96 PolarHBondContact O-N 2.84Å; L92-C96 PolarHBondContact O-SG 3.27Å; Q93-C96 PolarHBondContact O-N 3.4Å; D94-C96 PolarHBondContact O-N 3.35Å; C96-D98 VanDerWaalsContact C-N 3.3Å; C96-D98 PolarHBondContact O-N 2.79Å; C96-V99 PolarHBondContact O-N 3.25Å; C96-L100 WeakPolarHBondContact O-CB 3.36Å; C96-L100 WeakPolarHBondContact O-CG 3.44Å; C96-L100 PolarHBondContact O-N 3.04Å; C96-Y127 HydrophobicContact CB-CD1 4.07Å; C96-L131 HydrophobicContact CB-CD1 3.98Å; C96-L131 HydrophobicContact CB-CD2 3.68Å; C96-L131 HydrophobicContact CB-CG 3.66Å
97N98.3Very high98.3Very high82 Ų8245.1 Ų45.144%0.43922%0.223SC..Hα-helixtrans-64.9-36179.1-72.5-31000111.8Q93 D94 L100 E101Q93-N97 WeakPolarHBondContact O-CB 3.06Å; Q93-N97 VanDerWaalsContact O-CG 3.24Å; Q93-N97 PolarHBondContact O-N 3.06Å; Q93-N97 PolarHBondContact O-ND2 2.92Å; Q93-N97 VanDerWaalsContact O-ND2 3.15Å; D94-N97 PolarHBondContact O-N 3.36Å; N97-L100 PolarHBondContact O-N 2.91Å; N97-E101 WeakPolarHBondContact O-CB 3.45Å; N97-E101 PolarHBondContact O-N 2.95Å
98D98.3Very high98.3Very high39 Ų3941.1 Ų41.121%0.20921%0.207CC..Hα-helixtrans-59-49.8173.6-164.21.2000111.4K29 Y50 D94 I95 C96 L100 E101 L102K29-D98 WeakPolarHBondContact CD-OD1 3.37Å; K29-D98 WeakPolarHBondContact CD-OD2 3.42Å; K29-D98 WeakPolarHBondContact CE-OD1 3.47Å; K29-D98 IonicContact NZ-OD1 3.49Å; K29-D98 PolarHBondContact NZ-OD1 3.36Å; K29-D98 IonicContact NZ-OD2 3.45Å; K29-D98 PolarHBondContact NZ-OD2 3.27Å; Y50-D98 PolarHBondContact OH-OD2 3.38Å; D94-D98 WeakPolarHBondContact O-CB 3.27Å; D94-D98 PolarHBondContact O-N 3.01Å; I95-D98 PolarHBondContact O-N 3.45Å; C96-D98 VanDerWaalsContact C-N 3.3Å; C96-D98 PolarHBondContact O-N 2.79Å; D98-L100 PolarHBondContact O-N 3.02Å; D98-E101 PolarHBondContact O-N 3.15Å; D98-L102 WeakPolarHBondContact O-CG 3.43Å; D98-L102 PolarHBondContact O-N 3.32Å
99V98.5Very high98.3Very high3 Ų345 Ų452%0.01823%0.233CC..Hα-helixtrans-62.1-44.6176.4177.30000112Y50 I95 C96 E101 L102 L103 M123 Y127Y50-V99 HydrophobicContact CD1-CG2 3.15Å; Y50-V99 HydrophobicContact CD2-CG2 3.77Å; Y50-V99 HydrophobicContact CE1-CG2 3.47Å; Y50-V99 VanDerWaalsContact CE1-CG2 3.47Å; Y50-V99 HydrophobicContact CE2-CG2 4.06Å; Y50-V99 HydrophobicContact CG-CG2 3.3Å; I95-V99 PolarHBondContact O-N 3.04Å; C96-V99 PolarHBondContact O-N 3.25Å; V99-E101 VanDerWaalsContact C-N 3.28Å; V99-E101 PolarHBondContact O-N 3.2Å; V99-L102 PolarHBondContact O-N 3.33Å; V99-L103 HydrophobicContact CG1-CD1 3.7Å; V99-L103 HydrophobicContact CG1-CG 4.13Å; V99-L103 WeakPolarHBondContact O-CB 3.4Å; V99-L103 VanDerWaalsContact O-CG 3.26Å; V99-L103 WeakPolarHBondContact O-CG 3.44Å; V99-L103 PolarHBondContact O-N 3.03Å; V99-M123 HydrophobicContact CG1-CE 3.71Å; V99-Y127 HydrophobicContact CB-CD1 4.02Å; V99-Y127 HydrophobicContact CB-CD2 4.27Å; V99-Y127 HydrophobicContact CB-CE1 4.05Å; V99-Y127 HydrophobicContact CB-CE2 4.37Å; V99-Y127 HydrophobicContact CB-CG 4.15Å; V99-Y127 HydrophobicContact CG1-CD1 4.25Å; V99-Y127 HydrophobicContact CG1-CD2 3.6Å; V99-Y127 HydrophobicContact CG1-CE1 4.25Å; V99-Y127 HydrophobicContact CG1-CE2 3.66Å; V99-Y127 HydrophobicContact CG1-CG 3.95Å; V99-Y127 HydrophobicContact CG2-CD1 4.15Å; V99-Y127 HydrophobicContact CG2-CE1 3.69Å; V99-Y127 HydrophobicContact CG2-CE2 4.39Å
100L98.8Very high98.3Very high11 Ų1146.8 Ų46.86%0.05824%0.243CC..Hα-helixtrans-62.1-38.7-179.7-70.4170.5000111.4C96 N97 D98 L103 D104 K124 F128 L131C96-L100 WeakPolarHBondContact O-CB 3.36Å; C96-L100 WeakPolarHBondContact O-CG 3.44Å; C96-L100 PolarHBondContact O-N 3.04Å; N97-L100 PolarHBondContact O-N 2.91Å; D98-L100 PolarHBondContact O-N 3.02Å; L100-L103 HydrophobicContact CD2-CD1 4.44Å; L100-L103 PolarHBondContact O-N 2.95Å; L100-D104 WeakPolarHBondContact O-CB 3.41Å; L100-D104 PolarHBondContact O-N 3.25Å; L100-K124 HydrophobicContact CD2-CG 3.82Å; L100-F128 HydrophobicContact CD1-CD1 3.97Å; L100-F128 HydrophobicContact CD1-CD2 4.45Å; L100-F128 HydrophobicContact CD1-CE1 3.62Å; L100-F128 HydrophobicContact CD1-CE2 4.15Å; L100-F128 HydrophobicContact CD1-CG 4.36Å; L100-F128 HydrophobicContact CD1-CZ 3.72Å; L100-F128 HydrophobicContact CD2-CD2 3.73Å; L100-F128 HydrophobicContact CD2-CE1 4.49Å; L100-F128 HydrophobicContact CD2-CE2 3.5Å; L100-F128 HydrophobicContact CD2-CG 4.31Å; L100-F128 HydrophobicContact CD2-CZ 3.92Å; L100-F128 HydrophobicContact CG-CE2 4.44Å; L100-F128 HydrophobicContact CG-CZ 4.39Å; L100-L131 HydrophobicContact CD1-CD1 3.64Å
101E98.7Very high98.3Very high88 Ų8845.6 Ų45.641%0.41123%0.233SC..Hα-helixtrans-63.2-44.2173.8-176.8172.6-170.900111.7N97 D98 V99 L103 D104 K105N97-E101 WeakPolarHBondContact O-CB 3.45Å; N97-E101 PolarHBondContact O-N 2.95Å; D98-E101 PolarHBondContact O-N 3.15Å; V99-E101 VanDerWaalsContact C-N 3.28Å; V99-E101 PolarHBondContact O-N 3.2Å; E101-L103 VanDerWaalsContact C-N 3.34Å; E101-L103 PolarHBondContact O-N 3.05Å; E101-D104 PolarHBondContact O-N 3.03Å; E101-K105 HydrophobicContact CG-CD 3.73Å; E101-K105 HydrophobicContact CG-CG 4.32Å; E101-K105 VanDerWaalsContact O-CB 3.29Å; E101-K105 WeakPolarHBondContact O-CB 3.12Å; E101-K105 WeakPolarHBondContact O-CG 3.41Å; E101-K105 PolarHBondContact O-N 3.01Å; E101-K105 WeakPolarHBondContact OE1-CE 3.21Å; E101-K105 IonicContact OE1-NZ 2.94Å; E101-K105 PolarHBondContact OE1-NZ 3.25Å
102L98.8Very high98.2Very high2 Ų247.3 Ų47.31%0.0125%0.248CC..Hα-helixtrans-61.7-42.6175.4-66.9175.9000112.3K29 T32 E33 Y50 D98 V99 Y106 L107K29-L102 HydrophobicContact CB-CD1 4.14Å; K29-L102 HydrophobicContact CD-CD1 4.5Å; K29-L102 HydrophobicContact CG-CD1 4.05Å; K29-L102 HydrophobicContact CG-CD2 4.11Å; T32-L102 HydrophobicContact CG2-CB 4.18Å; T32-L102 HydrophobicContact CG2-CD2 3.96Å; E33-L102 HydrophobicContact CG-CD2 3.79Å; Y50-L102 HydrophobicContact CE2-CD1 3.96Å; Y50-L102 WeakPolarHBondContact OH-CD1 3.19Å; D98-L102 WeakPolarHBondContact O-CG 3.43Å; D98-L102 PolarHBondContact O-N 3.32Å; V99-L102 PolarHBondContact O-N 3.33Å; L102-Y106 HydrophobicContact CD2-CD2 4.04Å; L102-Y106 HydrophobicContact CD2-CE2 4.31Å; L102-Y106 PolarHBondContact O-N 2.73Å; L102-L107 HydrophobicContact CB-CD1 4.34Å; L102-L107 PolarHBondContact O-N 2.7Å; L102-L107 VanDerWaalsContact O-N 3.08Å
103L98.8Very high98.1Very high0 Ų052.8 Ų52.80%027%0.273CS..Iπ-helixtrans-61.6-48.9178.1-72.9167.2000111.5V99 L100 E101 L107 I108 Y120 M123 K124V99-L103 HydrophobicContact CG1-CD1 3.7Å; V99-L103 HydrophobicContact CG1-CG 4.13Å; V99-L103 WeakPolarHBondContact O-CB 3.4Å; V99-L103 VanDerWaalsContact O-CG 3.26Å; V99-L103 WeakPolarHBondContact O-CG 3.44Å; V99-L103 PolarHBondContact O-N 3.03Å; L100-L103 HydrophobicContact CD2-CD1 4.44Å; L100-L103 PolarHBondContact O-N 2.95Å; E101-L103 VanDerWaalsContact C-N 3.34Å; E101-L103 PolarHBondContact O-N 3.05Å; L103-L107 HydrophobicContact CD2-CB 4.31Å; L103-L107 HydrophobicContact CD2-CD1 3.8Å; L103-L107 HydrophobicContact CG-CD1 4.28Å; L103-L107 PolarHBondContact O-N 3.17Å; L103-I108 HydrophobicContact CB-CD1 4.12Å; L103-I108 HydrophobicContact CB-CG1 4.48Å; L103-I108 WeakPolarHBondContact O-CB 3.31Å; L103-I108 WeakPolarHBondContact O-CG1 3.41Å; L103-I108 PolarHBondContact O-N 2.66Å; L103-Y120 HydrophobicContact CD2-CD1 3.86Å; L103-Y120 HydrophobicContact CD2-CG 4.13Å; L103-M123 HydrophobicContact CD1-CB 4.34Å; L103-M123 HydrophobicContact CD1-CG 4.22Å; L103-M123 HydrophobicContact CD2-CB 4.32Å; L103-M123 HydrophobicContact CD2-CG 4.48Å; L103-M123 HydrophobicContact CD2-SD 4.25Å; L103-K124 HydrophobicContact CD1-CB 3.92Å
104D98.6Very high98.1Very high72 Ų7251.2 Ų51.239%0.38527%0.27SS..Iπ-helixtrans-77.3-32.6-173.6-75.5-13.1000113.3L100 E101 P109 K124L100-D104 WeakPolarHBondContact O-CB 3.41Å; L100-D104 PolarHBondContact O-N 3.25Å; E101-D104 PolarHBondContact O-N 3.03Å; D104-P109 WeakPolarHBondContact O-CG 3.41Å; D104-K124 VanDerWaalsContact CG-NZ 3.27Å; D104-K124 VanDerWaalsContact OD1-CE 3.3Å; D104-K124 WeakPolarHBondContact OD1-CE 3.27Å; D104-K124 IonicContact OD1-NZ 3.05Å; D104-K124 PolarHBondContact OD1-NZ 3.24Å; D104-K124 IonicContact OD2-NZ 3.03Å; D104-K124 PolarHBondContact OD2-NZ 3.2Å; D104-K124 VanDerWaalsContact OD2-NZ 3.14Å
105K98.3Very high98Very high121 Ų12149.6 Ų49.653%0.52626%0.258SS..Iπ-helixtrans-90.1-35.5-177.8-67-174.3178.6178.60113.9E101E101-K105 HydrophobicContact CG-CD 3.73Å; E101-K105 HydrophobicContact CG-CG 4.32Å; E101-K105 VanDerWaalsContact O-CB 3.29Å; E101-K105 WeakPolarHBondContact O-CB 3.12Å; E101-K105 WeakPolarHBondContact O-CG 3.41Å; E101-K105 PolarHBondContact O-N 3.01Å; E101-K105 WeakPolarHBondContact OE1-CE 3.21Å; E101-K105 IonicContact OE1-NZ 2.94Å; E101-K105 PolarHBondContact OE1-NZ 3.25Å
106Y98.5Very high98Very high67 Ų6748.7 Ų48.726%0.26325%0.254SS..Iπ-helixtrans-124.3-37.9-166.9-57.6-82.3000114.1T32 E33 L102 N110T32-Y106 HydrophobicContact CG2-CG 4.38Å; E33-Y106 HydrophobicContact CG-CE2 3.97Å; L102-Y106 HydrophobicContact CD2-CD2 4.04Å; L102-Y106 HydrophobicContact CD2-CE2 4.31Å; L102-Y106 PolarHBondContact O-N 2.73Å; Y106-N110 VanDerWaalsContact O-CB 3.27Å; Y106-N110 WeakPolarHBondContact O-CB 3.39Å; Y106-N110 PolarHBondContact O-ND2 3.32Å
107L98.6Very high98Very high5 Ų551.9 Ų51.93%0.02627%0.268CS..Iπ-helixtrans-91.8-54.6-168.3-59.6165.8000112.9T32 L38 L46 L102 L103 N110 A111 Y120T32-L107 HydrophobicContact CG2-CD1 4.1Å; T32-L107 HydrophobicContact CG2-CD2 3.58Å; T32-L107 HydrophobicContact CG2-CG 3.7Å; L38-L107 HydrophobicContact CD1-CD2 3.57Å; L38-L107 HydrophobicContact CG-CD2 3.83Å; L46-L107 HydrophobicContact CD2-CD1 3.49Å; L46-L107 VanDerWaalsContact CD2-CD1 3.49Å; L46-L107 HydrophobicContact CD2-CD2 4.31Å; L102-L107 HydrophobicContact CB-CD1 4.34Å; L102-L107 PolarHBondContact O-N 2.7Å; L102-L107 VanDerWaalsContact O-N 3.08Å; L103-L107 HydrophobicContact CD2-CB 4.31Å; L103-L107 HydrophobicContact CD2-CD1 3.8Å; L103-L107 HydrophobicContact CG-CD1 4.28Å; L103-L107 PolarHBondContact O-N 3.17Å; L107-N110 PolarHBondContact O-N 3.13Å; L107-A111 WeakPolarHBondContact O-CB 3.31Å; L107-A111 PolarHBondContact O-N 3.28Å; L107-Y120 HydrophobicContact CB-CD1 3.86Å; L107-Y120 HydrophobicContact CB-CD2 3.87Å; L107-Y120 HydrophobicContact CB-CE1 3.9Å; L107-Y120 HydrophobicContact CB-CE2 3.93Å; L107-Y120 HydrophobicContact CB-CG 3.87Å; L107-Y120 HydrophobicContact CD1-CD1 4.1Å; L107-Y120 HydrophobicContact CD1-CE1 4Å; L107-Y120 HydrophobicContact CD2-CE1 3.91Å; L107-Y120 HydrophobicContact CD2-CE2 4.48Å; L107-Y120 HydrophobicContact CG-CD1 4.42Å; L107-Y120 HydrophobicContact CG-CE1 4.16Å
108I98.4Very high98Very high32 Ų3248 Ų4816%0.16425%0.247CC..Hα-helixtrans-63.5-45-179.4-63.8168.8000111.2L103 N110 A111 L121 K124L103-I108 HydrophobicContact CB-CD1 4.12Å; L103-I108 HydrophobicContact CB-CG1 4.48Å; L103-I108 WeakPolarHBondContact O-CB 3.31Å; L103-I108 WeakPolarHBondContact O-CG1 3.41Å; L103-I108 PolarHBondContact O-N 2.66Å; I108-N110 VanDerWaalsContact C-N 3.31Å; I108-N110 PolarHBondContact O-N 3.03Å; I108-A111 PolarHBondContact O-N 3.36Å; I108-L121 HydrophobicContact CD1-CD2 4.04Å; I108-K124 HydrophobicContact CD1-CB 4.5Å; I108-K124 HydrophobicContact CD1-CD 3.83Å
109P97.8Very high98Very high86 Ų8647.4 Ų47.456%0.55824%0.243SC*.Hα-helixtrans-65.7-30179.4-23.335.2000114.4D104D104-P109 WeakPolarHBondContact O-CG 3.41Å
110N96.7Very high98Very high61 Ų6147.4 Ų47.433%0.32624%0.242SC..Hα-helixtrans-95.5-1.6-178.3-67.2-42.4000113.6G35 E37 Y106 L107 I108 T112G35-N110 PolarHBondContact O-ND2 3.38Å; E37-N110 VanDerWaalsContact CD-O 3.26Å; Y106-N110 VanDerWaalsContact O-CB 3.27Å; Y106-N110 WeakPolarHBondContact O-CB 3.39Å; Y106-N110 PolarHBondContact O-ND2 3.32Å; L107-N110 PolarHBondContact O-N 3.13Å; I108-N110 VanDerWaalsContact C-N 3.31Å; I108-N110 PolarHBondContact O-N 3.03Å; N110-T112 PolarHBondContact O-N 2.85Å
111A97.5Very high98Very high18 Ų1847 Ų4715%0.14924%0.241CC..  trans-71.6110.5178.700000110.6E37 L107 I108 K117 Y120E37-A111 WeakPolarHBondContact OE1-CA 3.41Å; L107-A111 WeakPolarHBondContact O-CB 3.31Å; L107-A111 PolarHBondContact O-N 3.28Å; I108-A111 PolarHBondContact O-N 3.36Å; A111-K117 HydrophobicContact CB-CB 4.19Å; A111-Y120 HydrophobicContact CB-CD2 3.93Å; A111-Y120 HydrophobicContact CB-CE2 4.05Å
112T96.5Very high98Very high97 Ų9744.6 Ų44.660%0.59523%0.229SC*.  trans-89.7-27.2-179.962.20000112.7E37 N110E37-T112 VanDerWaalsContact CD-OG1 3.32Å; E37-T112 PolarHBondContact OE1-N 3.29Å; E37-T112 PolarHBondContact OE1-OG1 3.49Å; E37-T112 WeakPolarHBondContact OE2-CB 3.36Å; E37-T112 VanDerWaalsContact OE2-CG2 3.27Å; E37-T112 WeakPolarHBondContact OE2-CG2 3.49Å; E37-T112 PolarHBondContact OE2-OG1 2.9Å; N110-T112 PolarHBondContact O-N 2.85Å
113Q96.4Very high98Very high114 Ų11444.9 Ų44.953%0.53323%0.23SC..SBendtrans-95.3141.1-179.6-58.7-55.8-38.500112.1E115 S116 K117Q113-E115 PolarHBondContact O-N 2.98Å; Q113-S116 PolarHBondContact O-N 2.98Å; Q113-S116 VanDerWaalsContact O-N 3.14Å; Q113-K117 PolarHBondContact O-N 3.48Å
114P97Very high98Very high42 Ų4247 Ų4727%0.27324%0.239SC..Hα-helixtrans-53-41.1174.3-27.435000113S116 K117 V118 I157 E161P114-S116 PolarHBondContact O-N 3.44Å; P114-K117 PolarHBondContact O-N 3.45Å; P114-V118 WeakPolarHBondContact O-CG2 3.24Å; P114-V118 PolarHBondContact O-N 2.93Å; P114-I157 HydrophobicContact CB-CG2 4.28Å; P114-E161 HydrophobicContact CB-CB 3.67Å; P114-E161 HydrophobicContact CB-CG 3.98Å; P114-E161 HydrophobicContact CG-CB 4.11Å; P114-E161 HydrophobicContact CG-CG 4.14Å
115E96.8Very high98Very high78 Ų7843.5 Ų43.536%0.36422%0.221SC..Hα-helixtrans-59-47.3177.7-69.2179.2-169.100112.6Q113 K117 V118 F119 H166 I168Q113-E115 PolarHBondContact O-N 2.98Å; E115-K117 VanDerWaalsContact C-N 3.34Å; E115-V118 PolarHBondContact O-N 2.71Å; E115-F119 VanDerWaalsContact O-CB 3.28Å; E115-F119 WeakPolarHBondContact O-CB 3.42Å; E115-F119 PolarHBondContact O-N 3.34Å; E115-H166 IonicContact OE1-NE2 3.66Å; E115-H166 PolarHBondContact OE1-NE2 3.42Å; E115-I168 HydrophobicContact CB-CD1 4.33Å
116S98Very high98.1Very high4 Ų438.2 Ų38.23%0.02820%0.198CC..Hα-helixtrans-62.2-43.4176.6-67.80000111Q113 P114 F119 Y120Q113-S116 PolarHBondContact O-N 2.98Å; Q113-S116 VanDerWaalsContact O-N 3.14Å; P114-S116 PolarHBondContact O-N 3.44Å; S116-F119 WeakPolarHBondContact O-CB 3.39Å; S116-F119 PolarHBondContact O-N 2.97Å; S116-Y120 WeakPolarHBondContact O-CD2 3.43Å; S116-Y120 VanDerWaalsContact O-CG 3.31Å; S116-Y120 PolarHBondContact O-N 3.12Å
117K98.3Very high98.1Very high67 Ų6735.3 Ų35.329%0.29119%0.187SC..Hα-helixtrans-63.1-46178.8-172.1168.9177.1-172.40111.9A111 Q113 P114 E115 F119 Y120 L121 E153 I157A111-K117 HydrophobicContact CB-CB 4.19Å; Q113-K117 PolarHBondContact O-N 3.48Å; P114-K117 PolarHBondContact O-N 3.45Å; E115-K117 VanDerWaalsContact C-N 3.34Å; K117-F119 VanDerWaalsContact C-N 3.35Å; K117-Y120 PolarHBondContact O-N 2.86Å; K117-L121 HydrophobicContact CG-CD1 3.85Å; K117-L121 HydrophobicContact CG-CG 4.46Å; K117-L121 WeakPolarHBondContact O-CB 3.5Å; K117-L121 WeakPolarHBondContact O-CG 3.28Å; K117-L121 PolarHBondContact O-N 3.25Å; K117-E153 VanDerWaalsContact CE-OE1 3.29Å; K117-E153 WeakPolarHBondContact CE-OE1 3.43Å; K117-E153 IonicContact NZ-OE1 3.22Å; K117-E153 PolarHBondContact NZ-OE1 3.27Å; K117-I157 HydrophobicContact CD-CD1 3.7Å; K117-I157 HydrophobicContact CG-CD1 3.95Å
118V98.7Very high98.1Very high0 Ų036.1 Ų36.10%019%0.19CC..Hα-helixtrans-63.3-41.7175.8175.20000110.9P114 E115 Y120 L121 K122 A154 I157 M162 I168 L172P114-V118 WeakPolarHBondContact O-CG2 3.24Å; P114-V118 PolarHBondContact O-N 2.93Å; E115-V118 PolarHBondContact O-N 2.71Å; V118-Y120 PolarHBondContact O-N 3.38Å; V118-L121 PolarHBondContact O-N 3.18Å; V118-K122 WeakPolarHBondContact O-CB 3.25Å; V118-K122 PolarHBondContact O-N 2.89Å; V118-A154 HydrophobicContact CG1-CB 4.35Å; V118-I157 HydrophobicContact CG2-CB 3.78Å; V118-I157 HydrophobicContact CG2-CG2 3.53Å; V118-M162 HydrophobicContact CB-SD 3.98Å; V118-M162 HydrophobicContact CG1-SD 3.99Å; V118-M162 HydrophobicContact CG2-SD 3.78Å; V118-I168 HydrophobicContact CB-CG2 4.3Å; V118-I168 HydrophobicContact CG1-CG2 3.76Å; V118-L172 HydrophobicContact CG1-CD2 4.04Å
119F98.6Very high98.1Very high28 Ų2835.1 Ų35.112%0.12318%0.184CC..Hα-helixtrans-57.9-49.6177-171.7-79.6000111.8R43 E115 S116 K117 M123 I168R43-F119 VanDerWaalsContact CD-CD1 3.45Å; R43-F119 HydrophobicContact CG-CD1 3.59Å; R43-F119 HydrophobicContact CG-CE1 3.44Å; R43-F119 VanDerWaalsContact CG-CE1 3.44Å; R43-F119 HydrophobicContact CG-CE2 4.44Å; R43-F119 HydrophobicContact CG-CG 4.19Å; R43-F119 HydrophobicContact CG-CZ 3.89Å; E115-F119 VanDerWaalsContact O-CB 3.28Å; E115-F119 WeakPolarHBondContact O-CB 3.42Å; E115-F119 PolarHBondContact O-N 3.34Å; S116-F119 WeakPolarHBondContact O-CB 3.39Å; S116-F119 PolarHBondContact O-N 2.97Å; K117-F119 VanDerWaalsContact C-N 3.35Å; F119-M123 HydrophobicContact CE1-SD 4.37Å; F119-M123 WeakPolarHBondContact O-CB 3.41Å; F119-M123 PolarHBondContact O-N 3.45Å; F119-I168 HydrophobicContact CB-CD1 4.39Å; F119-I168 HydrophobicContact CB-CG2 4.45Å; F119-I168 HydrophobicContact CD2-CD1 3.96Å; F119-I168 HydrophobicContact CD2-CG1 4.18Å
120Y98.8Very high98.1Very high2 Ų232.1 Ų32.11%0.00816%0.162CC..Hα-helixtrans-71-39-178.5-62.6-45000112.9R43 L103 L107 A111 S116 K117 V118 M123 K124R43-Y120 HydrophobicContact CG-CE1 3.68Å; L103-Y120 HydrophobicContact CD2-CD1 3.86Å; L103-Y120 HydrophobicContact CD2-CG 4.13Å; L107-Y120 HydrophobicContact CB-CD1 3.86Å; L107-Y120 HydrophobicContact CB-CD2 3.87Å; L107-Y120 HydrophobicContact CB-CE1 3.9Å; L107-Y120 HydrophobicContact CB-CE2 3.93Å; L107-Y120 HydrophobicContact CB-CG 3.87Å; L107-Y120 HydrophobicContact CD1-CD1 4.1Å; L107-Y120 HydrophobicContact CD1-CE1 4Å; L107-Y120 HydrophobicContact CD2-CE1 3.91Å; L107-Y120 HydrophobicContact CD2-CE2 4.48Å; L107-Y120 HydrophobicContact CG-CD1 4.42Å; L107-Y120 HydrophobicContact CG-CE1 4.16Å; A111-Y120 HydrophobicContact CB-CD2 3.93Å; A111-Y120 HydrophobicContact CB-CE2 4.05Å; S116-Y120 WeakPolarHBondContact O-CD2 3.43Å; S116-Y120 VanDerWaalsContact O-CG 3.31Å; S116-Y120 PolarHBondContact O-N 3.12Å; K117-Y120 PolarHBondContact O-N 2.86Å; V118-Y120 PolarHBondContact O-N 3.38Å; Y120-M123 WeakPolarHBondContact O-CB 3.41Å; Y120-M123 PolarHBondContact O-N 3.44Å; Y120-K124 WeakPolarHBondContact O-CB 3.48Å; Y120-K124 PolarHBondContact O-N 3.02Å
121L98.9Very high98.2Very high4 Ų429.8 Ų29.82%0.02115%0.149CC..Hα-helixtrans-67.1-40.6175.5-73.3168.3000112.1I108 K117 V118 M123 K124 G125 E153 A154 I157I108-L121 HydrophobicContact CD1-CD2 4.04Å; K117-L121 HydrophobicContact CG-CD1 3.85Å; K117-L121 HydrophobicContact CG-CG 4.46Å; K117-L121 WeakPolarHBondContact O-CB 3.5Å; K117-L121 WeakPolarHBondContact O-CG 3.28Å; K117-L121 PolarHBondContact O-N 3.25Å; V118-L121 PolarHBondContact O-N 3.18Å; L121-M123 VanDerWaalsContact C-N 3.31Å; L121-M123 PolarHBondContact O-N 2.87Å; L121-K124 WeakPolarHBondContact O-CB 3.35Å; L121-K124 PolarHBondContact O-N 3.05Å; L121-G125 PolarHBondContact O-N 3.45Å; L121-E153 HydrophobicContact CD1-CB 4.06Å; L121-E153 HydrophobicContact CD1-CG 3.69Å; L121-E153 HydrophobicContact CD2-CB 4.45Å; L121-E153 HydrophobicContact CD2-CG 4.46Å; L121-A154 HydrophobicContact CB-CB 3.65Å; L121-I157 HydrophobicContact CD1-CD1 3.73Å
122K98.8Very high98.2Very high37 Ų3729 Ų2916%0.16114%0.142CC..Hα-helixtrans-56.8-48.4170.4177.9-167.2168.9-660110.4V118 K124 G125 D126 G171 L172 N175V118-K122 WeakPolarHBondContact O-CB 3.25Å; V118-K122 PolarHBondContact O-N 2.89Å; K122-K124 VanDerWaalsContact C-N 3.34Å; K122-K124 PolarHBondContact O-N 2.83Å; K122-G125 PolarHBondContact O-N 3.25Å; K122-D126 IonicContact NZ-OD2 3.29Å; K122-D126 PolarHBondContact NZ-OD2 3.41Å; K122-D126 PolarHBondContact O-N 3.49Å; K122-G171 WeakPolarHBondContact CE-O 3.5Å; K122-L172 HydrophobicContact CB-CD1 4Å; K122-L172 HydrophobicContact CD-CB 4.11Å; K122-L172 HydrophobicContact CG-CB 4.29Å; K122-L172 HydrophobicContact CG-CD1 3.97Å; K122-N175 PolarHBondContact NZ-ND2 3.13Å
123M98.7Very high98.1Very high8 Ų825.9 Ų25.94%0.03912%0.121CC..Hα-helixtrans-58.8-46177.2-166.9173.3-18000110.7V99 L103 F119 Y120 L121 G125 D126 Y127V99-M123 HydrophobicContact CG1-CE 3.71Å; L103-M123 HydrophobicContact CD1-CB 4.34Å; L103-M123 HydrophobicContact CD1-CG 4.22Å; L103-M123 HydrophobicContact CD2-CB 4.32Å; L103-M123 HydrophobicContact CD2-CG 4.48Å; L103-M123 HydrophobicContact CD2-SD 4.25Å; F119-M123 HydrophobicContact CE1-SD 4.37Å; F119-M123 WeakPolarHBondContact O-CB 3.41Å; F119-M123 PolarHBondContact O-N 3.45Å; Y120-M123 WeakPolarHBondContact O-CB 3.41Å; Y120-M123 PolarHBondContact O-N 3.44Å; L121-M123 VanDerWaalsContact C-N 3.31Å; L121-M123 PolarHBondContact O-N 2.87Å; M123-G125 VanDerWaalsContact C-N 3.32Å; M123-G125 PolarHBondContact O-N 3.02Å; M123-D126 WeakPolarHBondContact O-CA 3.35Å; M123-D126 WeakPolarHBondContact O-CB 3.49Å; M123-D126 PolarHBondContact O-N 3.31Å; M123-Y127 HydrophobicContact CE-CE2 3.63Å; M123-Y127 HydrophobicContact CG-CD2 3.81Å; M123-Y127 HydrophobicContact CG-CE2 3.57Å; M123-Y127 VanDerWaalsContact O-CD2 3.23Å; M123-Y127 WeakPolarHBondContact O-CD2 3.29Å; M123-Y127 PolarHBondContact O-N 3.36Å; M123-Y127 HydrophobicContact SD-CE2 4.46Å
124K98.9Very high98Very high43 Ų4321 Ų2119%0.18710%0.099CC..Hα-helixtrans-55.4-45.9174.6-171.9172-178.5170.80111.9L100 L103 D104 I108 Y120 L121 K122 D126 Y127 F128 A150L100-K124 HydrophobicContact CD2-CG 3.82Å; L103-K124 HydrophobicContact CD1-CB 3.92Å; D104-K124 VanDerWaalsContact CG-NZ 3.27Å; D104-K124 VanDerWaalsContact OD1-CE 3.3Å; D104-K124 WeakPolarHBondContact OD1-CE 3.27Å; D104-K124 IonicContact OD1-NZ 3.05Å; D104-K124 PolarHBondContact OD1-NZ 3.24Å; D104-K124 IonicContact OD2-NZ 3.03Å; D104-K124 PolarHBondContact OD2-NZ 3.2Å; D104-K124 VanDerWaalsContact OD2-NZ 3.14Å; I108-K124 HydrophobicContact CD1-CB 4.5Å; I108-K124 HydrophobicContact CD1-CD 3.83Å; Y120-K124 WeakPolarHBondContact O-CB 3.48Å; Y120-K124 PolarHBondContact O-N 3.02Å; L121-K124 WeakPolarHBondContact O-CB 3.35Å; L121-K124 PolarHBondContact O-N 3.05Å; K122-K124 VanDerWaalsContact C-N 3.34Å; K122-K124 PolarHBondContact O-N 2.83Å; K124-D126 VanDerWaalsContact C-N 3.34Å; K124-D126 PolarHBondContact O-N 3.43Å; K124-Y127 PolarHBondContact O-N 2.77Å; K124-F128 HydrophobicContact CD-CE2 4.36Å; K124-F128 HydrophobicContact CG-CD2 3.9Å; K124-F128 HydrophobicContact CG-CE2 3.81Å; K124-F128 WeakPolarHBondContact O-CD2 3.47Å; K124-F128 PolarHBondContact O-N 2.9Å; K124-A150 HydrophobicContact CB-CB 4Å; K124-A150 HydrophobicContact CD-CB 4.24Å; K124-A150 HydrophobicContact CG-CB 3.94Å
125G98.9Very high97.9Very high0 Ų019.9 Ų19.90%09%0.093CC..Hα-helixtrans-58.4-43.1174.200000112.9L121 K122 M123 R129 S147 Y151L121-G125 PolarHBondContact O-N 3.45Å; K122-G125 PolarHBondContact O-N 3.25Å; M123-G125 VanDerWaalsContact C-N 3.32Å; M123-G125 PolarHBondContact O-N 3.02Å; G125-R129 VanDerWaalsContact O-CB 3.32Å; G125-R129 WeakPolarHBondContact O-CB 3.04Å; G125-R129 PolarHBondContact O-N 3.06Å; G125-S147 PolarHBondContact O-OG 3.24Å; G125-Y151 WeakPolarHBondContact O-CE2 3.23Å; G125-Y151 PolarHBondContact O-OH 2.74Å
126D98.8Very high97.4Very high9 Ų920.7 Ų20.75%0.04811%0.108CC..Hα-helixtrans-61.4-48.5176.7-78.4-49.3000112.3K122 M123 K124 R129 Y130 Y151 N175K122-D126 IonicContact NZ-OD2 3.29Å; K122-D126 PolarHBondContact NZ-OD2 3.41Å; K122-D126 PolarHBondContact O-N 3.49Å; M123-D126 WeakPolarHBondContact O-CA 3.35Å; M123-D126 WeakPolarHBondContact O-CB 3.49Å; M123-D126 PolarHBondContact O-N 3.31Å; K124-D126 VanDerWaalsContact C-N 3.34Å; K124-D126 PolarHBondContact O-N 3.43Å; D126-R129 WeakPolarHBondContact O-CB 3.2Å; D126-R129 PolarHBondContact O-N 3.35Å; D126-R129 IonicContact OD1-CZ 3.63Å; D126-R129 IonicContact OD1-NE 2.69Å; D126-R129 IonicContact OD1-NH2 2.76Å; D126-R129 PolarHBondContact OD1-NH2 3.27Å; D126-Y130 HydrophobicContact CB-CE2 4.15Å; D126-Y130 WeakPolarHBondContact O-CD1 3.23Å; D126-Y130 VanDerWaalsContact O-CD2 3.25Å; D126-Y130 WeakPolarHBondContact O-CD2 3.42Å; D126-Y130 PolarHBondContact O-N 2.93Å; D126-Y151 VanDerWaalsContact CA-OH 3.27Å; D126-Y151 WeakPolarHBondContact CA-OH 3.18Å; D126-Y151 PolarHBondContact N-OH 2.51Å; D126-Y151 PolarHBondContact OD1-OH 2.99Å; D126-N175 WeakPolarHBondContact OD1-CB 3.46Å; D126-N175 PolarHBondContact OD1-ND2 3.34Å; D126-N175 PolarHBondContact OD2-ND2 2.86Å
127Y98.7Very high96.8Very high7 Ų723.4 Ų23.43%0.02714%0.137CC..Hα-helixtrans-70.2-36.6-178.3-77.6-87.3000112.7Y50 K51 V54 C96 V99 M123 K124 R129 Y130 L131Y50-Y127 WeakPolarHBondContact CB-OH 3.43Å; Y50-Y127 PolarHBondContact O-OH 3.47Å; K51-Y127 PolarHBondContact N-OH 3.24Å; V54-Y127 HydrophobicContact CB-CE1 4.05Å; V54-Y127 HydrophobicContact CG1-CE1 4.01Å; V54-Y127 HydrophobicContact CG2-CD1 4.45Å; V54-Y127 HydrophobicContact CG2-CE1 4.07Å; C96-Y127 HydrophobicContact CB-CD1 4.07Å; V99-Y127 HydrophobicContact CB-CD1 4.02Å; V99-Y127 HydrophobicContact CB-CD2 4.27Å; V99-Y127 HydrophobicContact CB-CE1 4.05Å; V99-Y127 HydrophobicContact CB-CE2 4.37Å; V99-Y127 HydrophobicContact CB-CG 4.15Å; V99-Y127 HydrophobicContact CG1-CD1 4.25Å; V99-Y127 HydrophobicContact CG1-CD2 3.6Å; V99-Y127 HydrophobicContact CG1-CE1 4.25Å; V99-Y127 HydrophobicContact CG1-CE2 3.66Å; V99-Y127 HydrophobicContact CG1-CG 3.95Å; V99-Y127 HydrophobicContact CG2-CD1 4.15Å; V99-Y127 HydrophobicContact CG2-CE1 3.69Å; V99-Y127 HydrophobicContact CG2-CE2 4.39Å; M123-Y127 HydrophobicContact CE-CE2 3.63Å; M123-Y127 HydrophobicContact CG-CD2 3.81Å; M123-Y127 HydrophobicContact CG-CE2 3.57Å; M123-Y127 VanDerWaalsContact O-CD2 3.23Å; M123-Y127 WeakPolarHBondContact O-CD2 3.29Å; M123-Y127 PolarHBondContact O-N 3.36Å; M123-Y127 HydrophobicContact SD-CE2 4.46Å; K124-Y127 PolarHBondContact O-N 2.77Å; Y127-R129 VanDerWaalsContact C-N 3.33Å; Y127-Y130 HydrophobicContact CD1-CD2 4.09Å; Y127-Y130 HydrophobicContact CE1-CD2 4.4Å; Y127-Y130 HydrophobicContact CG-CD2 4.36Å; Y127-Y130 PolarHBondContact O-N 3.2Å; Y127-L131 WeakPolarHBondContact O-CG 3.47Å; Y127-L131 PolarHBondContact O-N 2.94Å
128F98.7Very high96.2Very high21 Ų2126.9 Ų26.99%0.09216%0.158CC..Hα-helixtrans-65.7-36.2169.6-81.7-60.6000112.7L100 K124 Y130 L131 S132 T143 N146L100-F128 HydrophobicContact CD1-CD1 3.97Å; L100-F128 HydrophobicContact CD1-CD2 4.45Å; L100-F128 HydrophobicContact CD1-CE1 3.62Å; L100-F128 HydrophobicContact CD1-CE2 4.15Å; L100-F128 HydrophobicContact CD1-CG 4.36Å; L100-F128 HydrophobicContact CD1-CZ 3.72Å; L100-F128 HydrophobicContact CD2-CD2 3.73Å; L100-F128 HydrophobicContact CD2-CE1 4.49Å; L100-F128 HydrophobicContact CD2-CE2 3.5Å; L100-F128 HydrophobicContact CD2-CG 4.31Å; L100-F128 HydrophobicContact CD2-CZ 3.92Å; L100-F128 HydrophobicContact CG-CE2 4.44Å; L100-F128 HydrophobicContact CG-CZ 4.39Å; K124-F128 HydrophobicContact CD-CE2 4.36Å; K124-F128 HydrophobicContact CG-CD2 3.9Å; K124-F128 HydrophobicContact CG-CE2 3.81Å; K124-F128 WeakPolarHBondContact O-CD2 3.47Å; K124-F128 PolarHBondContact O-N 2.9Å; F128-Y130 VanDerWaalsContact C-N 3.35Å; F128-Y130 PolarHBondContact O-N 2.91Å; F128-L131 HydrophobicContact CD1-CD1 4.02Å; F128-L131 HydrophobicContact CE1-CD1 4.36Å; F128-L131 WeakPolarHBondContact O-CB 3.46Å; F128-L131 PolarHBondContact O-N 2.81Å; F128-S132 PolarHBondContact O-N 2.94Å; F128-S132 PolarHBondContact O-OG 2.88Å; F128-S132 VanDerWaalsContact O-OG 3.09Å; F128-T143 HydrophobicContact CD1-CG2 4.44Å; F128-N146 HydrophobicContact CB-CB 4.46Å; F128-N146 HydrophobicContact CD1-CB 3.75Å; F128-N146 HydrophobicContact CD2-CB 3.62Å; F128-N146 HydrophobicContact CE1-CB 3.78Å; F128-N146 HydrophobicContact CE2-CB 3.64Å; F128-N146 HydrophobicContact CG-CB 3.69Å; F128-N146 HydrophobicContact CZ-CB 3.73Å
129R98.4Very high95.8Very high12 Ų1232.2 Ų32.25%0.04519%0.187CC..Hα-helixtrans-60.4-44.9173.4168.7168.370.583.63.5111.2G125 D126 Y127 L131 S132 E133 S147 Y151 F179 E182 I183G125-R129 VanDerWaalsContact O-CB 3.32Å; G125-R129 WeakPolarHBondContact O-CB 3.04Å; G125-R129 PolarHBondContact O-N 3.06Å; D126-R129 WeakPolarHBondContact O-CB 3.2Å; D126-R129 PolarHBondContact O-N 3.35Å; D126-R129 IonicContact OD1-CZ 3.63Å; D126-R129 IonicContact OD1-NE 2.69Å; D126-R129 IonicContact OD1-NH2 2.76Å; D126-R129 PolarHBondContact OD1-NH2 3.27Å; Y127-R129 VanDerWaalsContact C-N 3.33Å; R129-L131 VanDerWaalsContact C-N 3.3Å; R129-L131 PolarHBondContact O-N 3.47Å; R129-S132 WeakPolarHBondContact O-CB 3.43Å; R129-S132 PolarHBondContact O-N 3.39Å; R129-S132 VanDerWaalsContact O-N 3.09Å; R129-E133 IonicContact NH1-OE1 3.14Å; R129-E133 PolarHBondContact O-N 3.18Å; R129-E133 VanDerWaalsContact O-N 3.08Å; R129-S147 PolarHBondContact N-OG 2.98Å; R129-Y151 PolarHBondContact NE-OH 3.29Å; R129-F179 HydrophobicContact CB-CD2 4.26Å; R129-F179 HydrophobicContact CG-CD2 4.34Å; R129-E182 IonicContact NH1-OE2 2.91Å; R129-I183 HydrophobicContact CG-CD1 4.16Å; R129-I183 HydrophobicContact CG-CG1 3.8Å
130Y98.2Very high95.6Very high22 Ų2235.5 Ų35.59%0.08620%0.201CC..Hα-helixtrans-62.1-37.6176-55.7-31.1000112.4V54 R58 D126 Y127 F128 E133V54-Y130 HydrophobicContact CG1-CD2 4.11Å; V54-Y130 HydrophobicContact CG1-CE2 3.89Å; V54-Y130 HydrophobicContact CG2-CD2 3.83Å; V54-Y130 HydrophobicContact CG2-CE2 4.45Å; V54-Y130 HydrophobicContact CG2-CG 4.47Å; R58-Y130 VanDerWaalsContact NE-CD1 3.3Å; D126-Y130 HydrophobicContact CB-CE2 4.15Å; D126-Y130 WeakPolarHBondContact O-CD1 3.23Å; D126-Y130 VanDerWaalsContact O-CD2 3.25Å; D126-Y130 WeakPolarHBondContact O-CD2 3.42Å; D126-Y130 PolarHBondContact O-N 2.93Å; Y127-Y130 HydrophobicContact CD1-CD2 4.09Å; Y127-Y130 HydrophobicContact CE1-CD2 4.4Å; Y127-Y130 HydrophobicContact CG-CD2 4.36Å; Y127-Y130 PolarHBondContact O-N 3.2Å; F128-Y130 VanDerWaalsContact C-N 3.35Å; F128-Y130 PolarHBondContact O-N 2.91Å; Y130-E133 WeakPolarHBondContact O-CB 3.2Å; Y130-E133 PolarHBondContact O-N 3.01Å
131L98.1Very high95.4Very high12 Ų1241.7 Ų41.76%0.06323%0.23CC..Hα-helixtrans-64.4-40.7171.6-70.9172.9000111.8Q93 C96 L100 Y127 F128 R129 E133 V134 A135 T143Q93-L131 HydrophobicContact CB-CD2 4.2Å; Q93-L131 HydrophobicContact CG-CD2 3.79Å; C96-L131 HydrophobicContact CB-CD1 3.98Å; C96-L131 HydrophobicContact CB-CD2 3.68Å; C96-L131 HydrophobicContact CB-CG 3.66Å; L100-L131 HydrophobicContact CD1-CD1 3.64Å; Y127-L131 WeakPolarHBondContact O-CG 3.47Å; Y127-L131 PolarHBondContact O-N 2.94Å; F128-L131 HydrophobicContact CD1-CD1 4.02Å; F128-L131 HydrophobicContact CE1-CD1 4.36Å; F128-L131 WeakPolarHBondContact O-CB 3.46Å; F128-L131 PolarHBondContact O-N 2.81Å; R129-L131 VanDerWaalsContact C-N 3.3Å; R129-L131 PolarHBondContact O-N 3.47Å; L131-E133 VanDerWaalsContact C-N 3.26Å; L131-E133 PolarHBondContact O-N 3.29Å; L131-V134 WeakPolarHBondContact O-CG2 3.42Å; L131-V134 PolarHBondContact O-N 3.44Å; L131-A135 WeakPolarHBondContact O-CB 3.26Å; L131-A135 PolarHBondContact O-N 2.8Å; L131-T143 HydrophobicContact CB-CG2 3.71Å; L131-T143 HydrophobicContact CD1-CG2 4.41Å
132S97.5Very high95.3Very high1 Ų145.3 Ų45.31%0.00725%0.253CS..Hα-helixtrans-63.9-27.7177.3-62.50000113.9F128 R129 V134 T143 V144F128-S132 PolarHBondContact O-N 2.94Å; F128-S132 PolarHBondContact O-OG 2.88Å; F128-S132 VanDerWaalsContact O-OG 3.09Å; R129-S132 WeakPolarHBondContact O-CB 3.43Å; R129-S132 PolarHBondContact O-N 3.39Å; R129-S132 VanDerWaalsContact O-N 3.09Å; S132-V134 VanDerWaalsContact C-N 3.26Å; S132-V134 PolarHBondContact O-N 3.35Å; S132-T143 WeakPolarHBondContact CA-OG1 3.47Å; S132-T143 WeakPolarHBondContact OG-CB 3.36Å; S132-T143 PolarHBondContact OG-OG1 3.45Å; S132-V144 PolarHBondContact OG-N 3.08Å; S132-V144 VanDerWaalsContact OG-N 3.13Å
133E95.5Very high95.3Very high32 Ų3244.3 Ų44.315%0.1525%0.25CC..Hα-helixtrans-62.2-34.7175-70.7170.2-150.400112R58 W61 R62 R129 Y130 L131 I183R58-E133 IonicContact CZ-OE1 3.28Å; R58-E133 IonicContact CZ-OE2 3.14Å; R58-E133 VanDerWaalsContact CZ-OE2 3.28Å; R58-E133 IonicContact NE-OE1 2.84Å; R58-E133 PolarHBondContact NE-OE1 2.97Å; R58-E133 IonicContact NE-OE2 2.62Å; R58-E133 PolarHBondContact NE-OE2 3.38Å; R58-E133 IonicContact NH2-OE1 2.62Å; R58-E133 PolarHBondContact NH2-OE1 3.28Å; R58-E133 IonicContact NH2-OE2 3.25Å; R58-E133 PolarHBondContact NH2-OE2 3.36Å; W61-E133 WeakPolarHBondContact CH2-O 3.17Å; R62-E133 IonicContact NH2-OE2 3.05Å; R62-E133 PolarHBondContact NH2-OE2 2.9Å; R129-E133 IonicContact NH1-OE1 3.14Å; R129-E133 PolarHBondContact O-N 3.18Å; R129-E133 VanDerWaalsContact O-N 3.08Å; Y130-E133 WeakPolarHBondContact O-CB 3.2Å; Y130-E133 PolarHBondContact O-N 3.01Å; L131-E133 VanDerWaalsContact C-N 3.26Å; L131-E133 PolarHBondContact O-N 3.29Å; E133-I183 HydrophobicContact CG-CD1 3.83Å
134V94.7Very high95.3Very high12 Ų1244.6 Ų44.67%0.07325%0.252CS..Hα-helixtrans-108.3-12.2-175.1-55.80000114W61 E89 L92 L131 S132W61-V134 HydrophobicContact CD2-CG1 3.83Å; W61-V134 HydrophobicContact CE3-CG1 4.3Å; W61-V134 HydrophobicContact CG-CG1 4.24Å; W61-V134 HydrophobicContact CH2-CG1 4.28Å; W61-V134 HydrophobicContact CZ2-CB 4.46Å; W61-V134 HydrophobicContact CZ2-CG1 3.82Å; E89-V134 HydrophobicContact CG-CB 4.03Å; E89-V134 HydrophobicContact CG-CG1 4.24Å; L92-V134 HydrophobicContact CD2-CB 4.43Å; L92-V134 HydrophobicContact CD2-CG1 3.53Å; L92-V134 HydrophobicContact CD2-CG2 4.01Å; L131-V134 WeakPolarHBondContact O-CG2 3.42Å; L131-V134 PolarHBondContact O-N 3.44Å; S132-V134 VanDerWaalsContact C-N 3.26Å; S132-V134 PolarHBondContact O-N 3.35Å
135A93.3Very high95.2Very high18 Ų1845.4 Ų45.415%0.14926%0.263CS..  trans-74.5150-178.600000112.6L131 N139 K140L131-A135 WeakPolarHBondContact O-CB 3.26Å; L131-A135 PolarHBondContact O-N 2.8Å; A135-N139 HydrophobicContact CB-CB 4.28Å; A135-K140 HydrophobicContact CB-CB 4.08Å
136S87.2Confident95.2Very high95 Ų9547.8 Ų47.866%0.66428%0.275SS*.  trans-130.2159.7174.156.20000111N139S136-N139 PolarHBondContact O-N 2.98Å
137G86Confident95.2Very high62 Ų6247.3 Ų47.364%0.63927%0.273SS*.Hα-helixtrans56.4-140.3179.400000113.8N139 K140G137-N139 PolarHBondContact O-N 3.35Å; G137-K140 WeakPolarHBondContact O-CB 3.44Å; G137-K140 PolarHBondContact O-N 2.92Å
138D84.4Confident95.2Very high139 Ų13950.5 Ų50.574%0.74329%0.288SS*.Hα-helixtrans-62.5-28.8-176.5-62.7-23.3000113.5K140 Q141 T142D138-K140 PolarHBondContact O-N 3.5Å; D138-Q141 PolarHBondContact O-N 3.37Å; D138-T142 PolarHBondContact O-N 3.48Å; D138-T142 VanDerWaalsContact O-N 3.13Å; D138-T142 PolarHBondContact O-OG1 3.19Å; D138-T142 VanDerWaalsContact O-OG1 3.08Å
139N90.5Very high95.2Very high113 Ų11355.3 Ų55.360%0.60431%0.311SS*.Hα-helixtrans-64-33.9174.7-69.5-15.4000111.2A135 S136 G137 T143A135-N139 HydrophobicContact CB-CB 4.28Å; S136-N139 PolarHBondContact O-N 2.98Å; G137-N139 PolarHBondContact O-N 3.35Å; N139-T143 WeakPolarHBondContact O-CB 3.35Å; N139-T143 VanDerWaalsContact O-CG2 3.25Å; N139-T143 WeakPolarHBondContact O-CG2 3.49Å; N139-T143 PolarHBondContact O-N 3.04Å; N139-T143 PolarHBondContact O-OG1 3.02Å
140K94.6Very high95.2Very high97 Ų9754.9 Ų54.942%0.42231%0.31SS..Hα-helixtrans-65.8-47.5176.3-169.5170-174.21690110.8A135 G137 D138 T142 T143 V144A135-K140 HydrophobicContact CB-CB 4.08Å; G137-K140 WeakPolarHBondContact O-CB 3.44Å; G137-K140 PolarHBondContact O-N 2.92Å; D138-K140 PolarHBondContact O-N 3.5Å; K140-T142 VanDerWaalsContact C-N 3.29Å; K140-T142 PolarHBondContact O-N 2.87Å; K140-T143 PolarHBondContact O-N 2.87Å; K140-T143 PolarHBondContact O-OG1 3.34Å; K140-V144 HydrophobicContact CG-CG2 4.2Å; K140-V144 WeakPolarHBondContact O-CB 3.39Å; K140-V144 WeakPolarHBondContact O-CG2 3.43Å; K140-V144 PolarHBondContact O-N 3.34Å
141Q95.4Very high95.3Very high132 Ų13253.9 Ų53.962%0.61731%0.306SS*.Hα-helixtrans-59.9-41.6179.5-173.158.84800112.1D138 S145D138-Q141 PolarHBondContact O-N 3.37Å; Q141-S145 WeakPolarHBondContact O-CB 3.15Å; Q141-S145 PolarHBondContact O-N 3.25Å
142T97Very high95.3Very high80 Ų8056.5 Ų56.549%0.49132%0.318SS..Hα-helixtrans-65.4-48.3179.4-57.30000111.8D138 K140 V144 S145 N146D138-T142 PolarHBondContact O-N 3.48Å; D138-T142 VanDerWaalsContact O-N 3.13Å; D138-T142 PolarHBondContact O-OG1 3.19Å; D138-T142 VanDerWaalsContact O-OG1 3.08Å; K140-T142 VanDerWaalsContact C-N 3.29Å; K140-T142 PolarHBondContact O-N 2.87Å; T142-V144 PolarHBondContact O-N 2.96Å; T142-S145 PolarHBondContact O-N 3.36Å; T142-N146 WeakPolarHBondContact O-CB 3.44Å; T142-N146 PolarHBondContact O-N 3.45Å; T142-N146 PolarHBondContact O-ND2 3.33Å
143T97.8Very high95.3Very high16 Ų1660.1 Ų60.110%0.09834%0.335CS..Hα-helixtrans-64.1-40.7179.353.60000111.8F128 L131 S132 N139 K140 N146 S147F128-T143 HydrophobicContact CD1-CG2 4.44Å; L131-T143 HydrophobicContact CB-CG2 3.71Å; L131-T143 HydrophobicContact CD1-CG2 4.41Å; S132-T143 WeakPolarHBondContact CA-OG1 3.47Å; S132-T143 WeakPolarHBondContact OG-CB 3.36Å; S132-T143 PolarHBondContact OG-OG1 3.45Å; N139-T143 WeakPolarHBondContact O-CB 3.35Å; N139-T143 VanDerWaalsContact O-CG2 3.25Å; N139-T143 WeakPolarHBondContact O-CG2 3.49Å; N139-T143 PolarHBondContact O-N 3.04Å; N139-T143 PolarHBondContact O-OG1 3.02Å; K140-T143 PolarHBondContact O-N 2.87Å; K140-T143 PolarHBondContact O-OG1 3.34Å; T143-N146 PolarHBondContact O-N 3.42Å; T143-S147 WeakPolarHBondContact O-CB 2.98Å; T143-S147 PolarHBondContact O-N 3.08Å
144V98.2Very high95.5Very high14 Ų1458.6 Ų58.69%0.08533%0.328CS..Hα-helixtrans-61.9-47.7176.6171.40000110.9S132 K140 T142 N146 S147 Q148 F179 I183 L184S132-V144 PolarHBondContact OG-N 3.08Å; S132-V144 VanDerWaalsContact OG-N 3.13Å; K140-V144 HydrophobicContact CG-CG2 4.2Å; K140-V144 WeakPolarHBondContact O-CB 3.39Å; K140-V144 WeakPolarHBondContact O-CG2 3.43Å; K140-V144 PolarHBondContact O-N 3.34Å; T142-V144 PolarHBondContact O-N 2.96Å; V144-N146 PolarHBondContact O-N 2.64Å; V144-S147 PolarHBondContact O-N 3.18Å; V144-Q148 WeakPolarHBondContact O-CB 3.34Å; V144-Q148 PolarHBondContact O-N 2.87Å; V144-F179 HydrophobicContact CG1-CE2 4.48Å; V144-F179 HydrophobicContact CG1-CZ 4.1Å; V144-I183 HydrophobicContact CG1-CG2 4.47Å; V144-I183 HydrophobicContact CG2-CG2 3.63Å; V144-L184 HydrophobicContact CG1-CD2 3.51Å
145S98.1Very high95.7Very high59 Ų5959.2 Ų59.241%0.41333%0.329SS..Hα-helixtrans-60.2-45.7178.5-173.40000111.7Q141 T142 Q148 Q149Q141-S145 WeakPolarHBondContact O-CB 3.15Å; Q141-S145 PolarHBondContact O-N 3.25Å; T142-S145 PolarHBondContact O-N 3.36Å; S145-Q148 PolarHBondContact O-N 3.27Å; S145-Q149 WeakPolarHBondContact O-CB 3.14Å; S145-Q149 PolarHBondContact O-N 3.33Å
146N98.5Very high95.9Very high50 Ų5063.3 Ų63.327%0.26735%0.346SS..Hα-helixtrans-66.8-39.3179.5-72.1-19.5000112.3F128 T142 T143 V144 Q149 A150F128-N146 HydrophobicContact CB-CB 4.46Å; F128-N146 HydrophobicContact CD1-CB 3.75Å; F128-N146 HydrophobicContact CD2-CB 3.62Å; F128-N146 HydrophobicContact CE1-CB 3.78Å; F128-N146 HydrophobicContact CE2-CB 3.64Å; F128-N146 HydrophobicContact CG-CB 3.69Å; F128-N146 HydrophobicContact CZ-CB 3.73Å; T142-N146 WeakPolarHBondContact O-CB 3.44Å; T142-N146 PolarHBondContact O-N 3.45Å; T142-N146 PolarHBondContact O-ND2 3.33Å; T143-N146 PolarHBondContact O-N 3.42Å; V144-N146 PolarHBondContact O-N 2.64Å; N146-Q149 PolarHBondContact O-N 3.48Å; N146-A150 WeakPolarHBondContact O-CB 3.49Å; N146-A150 PolarHBondContact O-N 3.03Å
147S98.7Very high96.5Very high0 Ų060.3 Ų60.30%032%0.322CS..Hα-helixtrans-60.5-50.3175-172.90000110.8G125 R129 T143 V144 Q149 A150 Y151 F179G125-S147 PolarHBondContact O-OG 3.24Å; R129-S147 PolarHBondContact N-OG 2.98Å; T143-S147 WeakPolarHBondContact O-CB 2.98Å; T143-S147 PolarHBondContact O-N 3.08Å; V144-S147 PolarHBondContact O-N 3.18Å; S147-Q149 PolarHBondContact O-N 3.42Å; S147-A150 PolarHBondContact O-N 3.04Å; S147-Y151 WeakPolarHBondContact O-CD2 3.26Å; S147-Y151 PolarHBondContact O-N 3.3Å; S147-Y151 VanDerWaalsContact OG-CE2 3.26Å; S147-Y151 WeakPolarHBondContact OG-CE2 3.37Å; S147-F179 WeakPolarHBondContact OG-CD2 3.32Å; S147-F179 WeakPolarHBondContact OG-CE2 3.44Å
148Q98.7Very high97Very high73 Ų7357.3 Ų57.334%0.34129%0.291SS..Hα-helixtrans-60.6-44.4178.9-173.5173.42.700112.1V144 S145 Y151 Q152 F179V144-Q148 WeakPolarHBondContact O-CB 3.34Å; V144-Q148 PolarHBondContact O-N 2.87Å; S145-Q148 PolarHBondContact O-N 3.27Å; Q148-Y151 PolarHBondContact O-N 3.13Å; Q148-Q152 WeakPolarHBondContact O-CB 3.37Å; Q148-Q152 PolarHBondContact O-N 3.37Å; Q148-F179 HydrophobicContact CB-CE1 3.8Å; Q148-F179 HydrophobicContact CB-CZ 3.83Å; Q148-F179 HydrophobicContact CG-CE1 4.17Å
149Q98.7Very high97.6Very high122 Ų12255.6 Ų55.657%0.5728%0.277SS*.Hα-helixtrans-60.6-46.9178.6-177.9-179-200111.6S145 N146 S147 Q152 E153S145-Q149 WeakPolarHBondContact O-CB 3.14Å; S145-Q149 PolarHBondContact O-N 3.33Å; N146-Q149 PolarHBondContact O-N 3.48Å; S147-Q149 PolarHBondContact O-N 3.42Å; Q149-Q152 PolarHBondContact O-N 3.42Å; Q149-E153 PolarHBondContact O-N 3.01Å
150A98.8Very high98Very high4 Ų458 Ų583%0.03328%0.282CS..Hα-helixtrans-63.7-43.4-179.400000112K124 N146 S147 A154K124-A150 HydrophobicContact CB-CB 4Å; K124-A150 HydrophobicContact CD-CB 4.24Å; K124-A150 HydrophobicContact CG-CB 3.94Å; N146-A150 WeakPolarHBondContact O-CB 3.49Å; N146-A150 PolarHBondContact O-N 3.03Å; S147-A150 PolarHBondContact O-N 3.04Å; A150-A154 WeakPolarHBondContact O-CB 3.43Å; A150-A154 PolarHBondContact O-N 2.82Å
151Y98.9Very high98.1Very high0 Ų057.9 Ų57.90%028%0.283CS..Hα-helixtrans-64.1-42.3174.5-74.8-54.6000112.7G125 D126 R129 S147 Q148 A154 F155 L172 N175 F176 F179G125-Y151 WeakPolarHBondContact O-CE2 3.23Å; G125-Y151 PolarHBondContact O-OH 2.74Å; D126-Y151 VanDerWaalsContact CA-OH 3.27Å; D126-Y151 WeakPolarHBondContact CA-OH 3.18Å; D126-Y151 PolarHBondContact N-OH 2.51Å; D126-Y151 PolarHBondContact OD1-OH 2.99Å; R129-Y151 PolarHBondContact NE-OH 3.29Å; S147-Y151 WeakPolarHBondContact O-CD2 3.26Å; S147-Y151 PolarHBondContact O-N 3.3Å; S147-Y151 VanDerWaalsContact OG-CE2 3.26Å; S147-Y151 WeakPolarHBondContact OG-CE2 3.37Å; Q148-Y151 PolarHBondContact O-N 3.13Å; Y151-A154 PolarHBondContact O-N 3.18Å; Y151-F155 VanDerWaalsContact O-CB 3.24Å; Y151-F155 WeakPolarHBondContact O-CB 3.33Å; Y151-F155 PolarHBondContact O-N 3.02Å; Y151-L172 HydrophobicContact CD1-CD1 3.65Å; Y151-L172 HydrophobicContact CE1-CD1 4.35Å; Y151-N175 HydrophobicContact CE1-CB 4.16Å; Y151-F176 VanDerWaalsContact CB-CD2 3.43Å; Y151-F176 VanDerWaalsContact CB-CE2 3.46Å; Y151-F176 HydrophobicContact CD1-CB 3.97Å; Y151-F176 HydrophobicContact CD1-CD2 4.36Å; Y151-F176 HydrophobicContact CD1-CG 4.21Å; Y151-F176 AromaticContact CD2-CD2 3.57Å; Y151-F176 HydrophobicContact CD2-CD2 3.57Å; Y151-F176 AromaticContact CD2-CE2 3.98Å; Y151-F176 HydrophobicContact CD2-CE2 3.98Å; Y151-F176 HydrophobicContact CD2-CG 4.24Å; Y151-F176 HydrophobicContact CE1-CB 4.41Å; Y151-F176 HydrophobicContact CE2-CD2 4.39Å; Y151-F176 HydrophobicContact CG-CB 4.04Å; Y151-F176 HydrophobicContact CG-CD1 4.43Å; Y151-F176 AromaticContact CG-CD2 3.56Å; Y151-F176 HydrophobicContact CG-CD2 3.56Å; Y151-F176 HydrophobicContact CG-CE2 4.02Å; Y151-F176 AromaticContact CG-CG 3.79Å; Y151-F176 HydrophobicContact CG-CG 3.79Å; Y151-F179 HydrophobicContact CD2-CB 4.21Å; Y151-F179 HydrophobicContact CD2-CD1 4.25Å; Y151-F179 HydrophobicContact CD2-CG 4.1Å; Y151-F179 HydrophobicContact CE2-CB 3.72Å; Y151-F179 HydrophobicContact CE2-CD1 4.49Å; Y151-F179 HydrophobicContact CE2-CD2 4.19Å; Y151-F179 AromaticContact CE2-CG 3.88Å; Y151-F179 HydrophobicContact CE2-CG 3.88Å
152Q98.7Very high98.2Very high67 Ų6752.2 Ų52.231%0.31326%0.257SS..Hα-helixtrans-63.8-45.2179.2-167.867.349.300111.1Q148 Q149 A154 F155 E156Q148-Q152 WeakPolarHBondContact O-CB 3.37Å; Q148-Q152 PolarHBondContact O-N 3.37Å; Q149-Q152 PolarHBondContact O-N 3.42Å; Q152-A154 VanDerWaalsContact C-N 3.34Å; Q152-A154 PolarHBondContact O-N 3.19Å; Q152-F155 PolarHBondContact O-N 3.44Å; Q152-F155 VanDerWaalsContact O-N 3.12Å; Q152-E156 PolarHBondContact NE2-OE1 3.31Å; Q152-E156 WeakPolarHBondContact O-CG 3.37Å; Q152-E156 PolarHBondContact O-N 2.94Å
153E98.6Very high98.1Very high77 Ų7754.1 Ų54.136%0.3626%0.26SS..Hα-helixtrans-60.8-44.3176.6-168.9-174.9163.800111.3K117 L121 Q149 F155 I157K117-E153 VanDerWaalsContact CE-OE1 3.29Å; K117-E153 WeakPolarHBondContact CE-OE1 3.43Å; K117-E153 IonicContact NZ-OE1 3.22Å; K117-E153 PolarHBondContact NZ-OE1 3.27Å; L121-E153 HydrophobicContact CD1-CB 4.06Å; L121-E153 HydrophobicContact CD1-CG 3.69Å; L121-E153 HydrophobicContact CD2-CB 4.45Å; L121-E153 HydrophobicContact CD2-CG 4.46Å; Q149-E153 PolarHBondContact O-N 3.01Å; E153-F155 VanDerWaalsContact C-N 3.26Å; E153-F155 PolarHBondContact O-N 3.03Å; E153-I157 HydrophobicContact CG-CD1 4.18Å; E153-I157 WeakPolarHBondContact O-CD1 3.49Å; E153-I157 WeakPolarHBondContact O-CG1 3.26Å; E153-I157 PolarHBondContact O-N 2.9Å
154A98.8Very high98.1Very high0 Ų054 Ų540%026%0.259CS..Hα-helixtrans-58.9-41.3174.600000111.4V118 L121 A150 Y151 Q152 I157 S158 L172V118-A154 HydrophobicContact CG1-CB 4.35Å; L121-A154 HydrophobicContact CB-CB 3.65Å; A150-A154 WeakPolarHBondContact O-CB 3.43Å; A150-A154 PolarHBondContact O-N 2.82Å; Y151-A154 PolarHBondContact O-N 3.18Å; Q152-A154 VanDerWaalsContact C-N 3.34Å; Q152-A154 PolarHBondContact O-N 3.19Å; A154-I157 PolarHBondContact O-N 3.46Å; A154-S158 VanDerWaalsContact O-CB 3.28Å; A154-S158 WeakPolarHBondContact O-CB 3.15Å; A154-S158 PolarHBondContact O-N 3.04Å; A154-S158 PolarHBondContact O-OG 3.49Å; A154-L172 VanDerWaalsContact C-CD2 3.48Å; A154-L172 HydrophobicContact CB-CD1 3.8Å; A154-L172 HydrophobicContact CB-CD2 3.65Å; A154-L172 HydrophobicContact CB-CG 4.4Å
155F98.4Very high98Very high25 Ų2553.6 Ų53.611%0.1126%0.257CS..Hα-helixtrans-69-44.4-175-166.6-113.5000111.8Y151 Q152 E153 I157 S158 K159 L172 F176 L193Y151-F155 VanDerWaalsContact O-CB 3.24Å; Y151-F155 WeakPolarHBondContact O-CB 3.33Å; Y151-F155 PolarHBondContact O-N 3.02Å; Q152-F155 PolarHBondContact O-N 3.44Å; Q152-F155 VanDerWaalsContact O-N 3.12Å; E153-F155 VanDerWaalsContact C-N 3.26Å; E153-F155 PolarHBondContact O-N 3.03Å; F155-I157 PolarHBondContact O-N 3.33Å; F155-S158 WeakPolarHBondContact CA-OG 3.37Å; F155-S158 PolarHBondContact O-N 3.22Å; F155-S158 PolarHBondContact O-OG 2.91Å; F155-K159 HydrophobicContact CD1-CD 4.04Å; F155-K159 HydrophobicContact CE1-CD 3.75Å; F155-K159 HydrophobicContact CE1-CG 4.42Å; F155-K159 VanDerWaalsContact CE1-NZ 3.25Å; F155-K159 HydrophobicContact CZ-CD 4.17Å; F155-K159 PolarHBondContact O-N 2.95Å; F155-L172 HydrophobicContact CB-CD2 4.15Å; F155-L172 HydrophobicContact CD2-CD2 4.17Å; F155-F176 HydrophobicContact CB-CE1 4.48Å; F155-L193 HydrophobicContact CE1-CD1 4.27Å; F155-L193 HydrophobicContact CE2-CD1 3.59Å; F155-L193 HydrophobicContact CZ-CD1 3.39Å
156E98.3Very high97.9Very high104 Ų10452.6 Ų52.649%0.48625%0.246SC..Hα-helixtrans-59.7-44.3175.6-65.9-48.4137.500112.2Q152 K160Q152-E156 PolarHBondContact NE2-OE1 3.31Å; Q152-E156 WeakPolarHBondContact O-CG 3.37Å; Q152-E156 PolarHBondContact O-N 2.94Å; E156-K160 PolarHBondContact O-N 3.35Å
157I98.5Very high97.9Very high32 Ų3251.3 Ų51.316%0.16424%0.24CC..Hα-helixtrans-65.4-46.4177-61.3164000110P114 K117 V118 L121 E153 A154 F155 K159 K160 E161P114-I157 HydrophobicContact CB-CG2 4.28Å; K117-I157 HydrophobicContact CD-CD1 3.7Å; K117-I157 HydrophobicContact CG-CD1 3.95Å; V118-I157 HydrophobicContact CG2-CB 3.78Å; V118-I157 HydrophobicContact CG2-CG2 3.53Å; L121-I157 HydrophobicContact CD1-CD1 3.73Å; E153-I157 HydrophobicContact CG-CD1 4.18Å; E153-I157 WeakPolarHBondContact O-CD1 3.49Å; E153-I157 WeakPolarHBondContact O-CG1 3.26Å; E153-I157 PolarHBondContact O-N 2.9Å; A154-I157 PolarHBondContact O-N 3.46Å; F155-I157 PolarHBondContact O-N 3.33Å; I157-K159 VanDerWaalsContact C-N 3.32Å; I157-K159 PolarHBondContact O-N 3.5Å; I157-K160 PolarHBondContact O-N 3.19Å; I157-K160 VanDerWaalsContact O-N 3.17Å; I157-E161 HydrophobicContact CG2-CG 4.19Å; I157-E161 WeakPolarHBondContact O-CB 3.32Å; I157-E161 PolarHBondContact O-N 3.46Å
158S98.3Very high97.8Very high0 Ų052.4 Ų52.40%025%0.246CC..Hα-helixtrans-63-36.3-177.475.70000113.1A154 F155 K160 M162A154-S158 VanDerWaalsContact O-CB 3.28Å; A154-S158 WeakPolarHBondContact O-CB 3.15Å; A154-S158 PolarHBondContact O-N 3.04Å; A154-S158 PolarHBondContact O-OG 3.49Å; F155-S158 WeakPolarHBondContact CA-OG 3.37Å; F155-S158 PolarHBondContact O-N 3.22Å; F155-S158 PolarHBondContact O-OG 2.91Å; S158-K160 VanDerWaalsContact C-N 3.31Å; S158-K160 PolarHBondContact O-N 2.69Å; S158-M162 WeakPolarHBondContact O-CB 3.25Å; S158-M162 PolarHBondContact O-N 2.93Å; S158-M162 VanDerWaalsContact O-N 3.1Å
159K97.3Very high97.8Very high102 Ų10250.1 Ų50.144%0.44323%0.234SC..Hα-helixtrans-65.9-34.6177-84.6-175.2160179.80112.7F155 I157F155-K159 HydrophobicContact CD1-CD 4.04Å; F155-K159 HydrophobicContact CE1-CD 3.75Å; F155-K159 HydrophobicContact CE1-CG 4.42Å; F155-K159 VanDerWaalsContact CE1-NZ 3.25Å; F155-K159 HydrophobicContact CZ-CD 4.17Å; F155-K159 PolarHBondContact O-N 2.95Å; I157-K159 VanDerWaalsContact C-N 3.32Å; I157-K159 PolarHBondContact O-N 3.5Å
160K97.4Very high97.8Very high164 Ų16444.4 Ų44.471%0.71321%0.207SC*.Hα-helixtrans-84.2-37.5-177.3-175.6178.6174.2-107.30112.9E156 I157 S158E156-K160 PolarHBondContact O-N 3.35Å; I157-K160 PolarHBondContact O-N 3.19Å; I157-K160 VanDerWaalsContact O-N 3.17Å; S158-K160 VanDerWaalsContact C-N 3.31Å; S158-K160 PolarHBondContact O-N 2.69Å
161E97.6Very high97.7Very high95 Ų9544.7 Ų44.744%0.44421%0.21SC..Hα-helixtrans-112.2-7-164.8-56.3-64.3155.300113.8P114 I157P114-E161 HydrophobicContact CB-CB 3.67Å; P114-E161 HydrophobicContact CB-CG 3.98Å; P114-E161 HydrophobicContact CG-CB 4.11Å; P114-E161 HydrophobicContact CG-CG 4.14Å; I157-E161 HydrophobicContact CG2-CG 4.19Å; I157-E161 WeakPolarHBondContact O-CB 3.32Å; I157-E161 PolarHBondContact O-N 3.46Å
162M96.6Very high97.7Very high13 Ų1344.7 Ų44.76%0.06421%0.21CC..SBendtrans-133.6141.3-172.1-53.2168.166.800112.1V118 S158 H166 I168 R169V118-M162 HydrophobicContact CB-SD 3.98Å; V118-M162 HydrophobicContact CG1-SD 3.99Å; V118-M162 HydrophobicContact CG2-SD 3.78Å; S158-M162 WeakPolarHBondContact O-CB 3.25Å; S158-M162 PolarHBondContact O-N 2.93Å; S158-M162 VanDerWaalsContact O-N 3.1Å; M162-H166 HydrophobicContact CB-CB 4.28Å; M162-H166 HydrophobicContact CE-CB 4.1Å; M162-H166 VanDerWaalsContact CE-CE1 3.46Å; M162-H166 WeakPolarHBondContact CE-CE1 3.3Å; M162-H166 VanDerWaalsContact CE-CG 3.41Å; M162-H166 WeakPolarHBondContact CE-ND1 3.42Å; M162-I168 HydrophobicContact CE-CB 3.69Å; M162-I168 HydrophobicContact CE-CG2 3.9Å; M162-R169 HydrophobicContact CB-CB 4.4Å; M162-R169 HydrophobicContact CE-CB 4.04Å; M162-R169 PolarHBondContact O-NH1 3.04Å
163Q96Very high97.8Very high120 Ų12041.6 Ų41.656%0.56120%0.197SC*.  trans-65.1147.7175.8-61.9-60.1-14.300111.5T165 H166 R169 E204Q163-T165 PolarHBondContact O-N 2.78Å; Q163-T165 VanDerWaalsContact O-N 3.12Å; Q163-H166 WeakPolarHBondContact O-CB 3.34Å; Q163-H166 PolarHBondContact O-N 3.46Å; Q163-R169 WeakPolarHBondContact O-CD 3.48Å; Q163-E204 PolarHBondContact OE1-OE2 2.86Å
164P97.2Very high97.8Very high12 Ų1238.9 Ų38.98%0.07818%0.184CC..THydrogen-bonded Turntrans-51.5-32.6175.2-28.235.7000114.6H166 L170 E200 E204P164-H166 VanDerWaalsContact C-N 3.3Å; P164-H166 PolarHBondContact O-N 3.06Å; P164-L170 WeakPolarHBondContact O-CG 3.36Å; P164-E200 HydrophobicContact CB-CB 3.85Å; P164-E200 HydrophobicContact CG-CB 4.29Å; P164-E204 WeakPolarHBondContact CD-OE2 3.42Å
165T96.5Very high97.8Very high6 Ų640.3 Ų40.34%0.03719%0.192CC..THydrogen-bonded Turntrans-81.2-3.8179.253.90000114.1Q163 A201 E204 S216Q163-T165 PolarHBondContact O-N 2.78Å; Q163-T165 VanDerWaalsContact O-N 3.12Å; T165-A201 HydrophobicContact CG2-CB 4.42Å; T165-A201 WeakPolarHBondContact CG2-O 3.26Å; T165-E204 HydrophobicContact CG2-CB 3.91Å; T165-S216 WeakPolarHBondContact O-CB 3.33Å; T165-S216 PolarHBondContact O-OG 3.01Å
166H96.3Very high97.8Very high38 Ų3839.2 Ų39.218%0.17619%0.187CC..  trans-67.9127.7-176.3-172.2-58.5000111.3E115 M162 Q163 P164 I168 R169 L170E115-H166 IonicContact OE1-NE2 3.66Å; E115-H166 PolarHBondContact OE1-NE2 3.42Å; M162-H166 HydrophobicContact CB-CB 4.28Å; M162-H166 HydrophobicContact CE-CB 4.1Å; M162-H166 VanDerWaalsContact CE-CE1 3.46Å; M162-H166 WeakPolarHBondContact CE-CE1 3.3Å; M162-H166 VanDerWaalsContact CE-CG 3.41Å; M162-H166 WeakPolarHBondContact CE-ND1 3.42Å; Q163-H166 WeakPolarHBondContact O-CB 3.34Å; Q163-H166 PolarHBondContact O-N 3.46Å; P164-H166 VanDerWaalsContact C-N 3.3Å; P164-H166 PolarHBondContact O-N 3.06Å; H166-I168 PolarHBondContact ND1-N 3.27Å; H166-I168 PolarHBondContact O-N 3.4Å; H166-R169 HydrophobicContact CB-CB 4.25Å; H166-R169 PolarHBondContact O-N 3.14Å; H166-L170 PolarHBondContact O-N 3.45Å
167P96.6Very high97.8Very high23 Ų2334.3 Ų34.315%0.14916%0.164CC..Hα-helixtrans-53.4-44.6-175.7-26.330000114.6R169 L170 G171 D215 S216 I219P167-R169 PolarHBondContact O-N 3.18Å; P167-L170 PolarHBondContact O-N 3.35Å; P167-G171 PolarHBondContact O-N 2.62Å; P167-D215 HydrophobicContact CB-CB 4.16Å; P167-D215 HydrophobicContact CG-CB 4.11Å; P167-S216 WeakPolarHBondContact CD-OG 3.36Å; P167-S216 WeakPolarHBondContact CG-OG 3.39Å; P167-I219 HydrophobicContact CB-CD1 4.16Å; P167-I219 VanDerWaalsContact O-CD1 3.3Å; P167-I219 WeakPolarHBondContact O-CD1 3.41Å
168I97.7Very high97.8Very high23 Ų2333.6 Ų33.612%0.11816%0.162CC..Hα-helixtrans-62.5-40.6176.9-62.9172.2000112.4E115 V118 F119 M162 H166 G171 L172E115-I168 HydrophobicContact CB-CD1 4.33Å; V118-I168 HydrophobicContact CB-CG2 4.3Å; V118-I168 HydrophobicContact CG1-CG2 3.76Å; F119-I168 HydrophobicContact CB-CD1 4.39Å; F119-I168 HydrophobicContact CB-CG2 4.45Å; F119-I168 HydrophobicContact CD2-CD1 3.96Å; F119-I168 HydrophobicContact CD2-CG1 4.18Å; M162-I168 HydrophobicContact CE-CB 3.69Å; M162-I168 HydrophobicContact CE-CG2 3.9Å; H166-I168 PolarHBondContact ND1-N 3.27Å; H166-I168 PolarHBondContact O-N 3.4Å; I168-G171 PolarHBondContact O-N 3.04Å; I168-L172 WeakPolarHBondContact O-CB 3.42Å; I168-L172 PolarHBondContact O-N 2.94Å
169R98.1Very high97.8Very high26 Ų2633.6 Ų33.610%0.09816%0.162CC..Hα-helixtrans-67.1-44.7177.7176.7176.4167.9171.8-5.9110.9M162 Q163 H166 P167 L172 A173 E200M162-R169 HydrophobicContact CB-CB 4.4Å; M162-R169 HydrophobicContact CE-CB 4.04Å; M162-R169 PolarHBondContact O-NH1 3.04Å; Q163-R169 WeakPolarHBondContact O-CD 3.48Å; H166-R169 HydrophobicContact CB-CB 4.25Å; H166-R169 PolarHBondContact O-N 3.14Å; P167-R169 PolarHBondContact O-N 3.18Å; R169-L172 WeakPolarHBondContact O-CB 3.42Å; R169-L172 PolarHBondContact O-N 3.44Å; R169-A173 PolarHBondContact O-N 2.97Å; R169-E200 IonicContact CZ-OE2 2.96Å; R169-E200 IonicContact NH2-OE2 2.64Å; R169-E200 PolarHBondContact NH2-OE2 3.04Å
170L98.5Very high97.9Very high2 Ų230 Ų301%0.0115%0.145CC..Hα-helixtrans-60.1-45.7173.8-75.3170.8000111.8P164 H166 P167 L172 A173 L174 A201 I219 M220 L223P164-L170 WeakPolarHBondContact O-CG 3.36Å; H166-L170 PolarHBondContact O-N 3.45Å; P167-L170 PolarHBondContact O-N 3.35Å; L170-L172 VanDerWaalsContact C-N 3.28Å; L170-L172 PolarHBondContact O-N 3.46Å; L170-A173 PolarHBondContact O-N 2.84Å; L170-L174 PolarHBondContact O-N 3.43Å; L170-A201 HydrophobicContact CD1-CB 4.47Å; L170-A201 HydrophobicContact CD2-CB 3.73Å; L170-I219 HydrophobicContact CB-CB 4.18Å; L170-I219 HydrophobicContact CB-CD1 4.46Å; L170-I219 HydrophobicContact CB-CG2 3.65Å; L170-M220 HydrophobicContact CD1-CG 3.93Å; L170-M220 HydrophobicContact CD1-SD 4.37Å; L170-M220 HydrophobicContact CD2-CG 4.1Å; L170-L223 HydrophobicContact CD2-CD1 3.99Å
171G98.5Very high97.9Very high9 Ų924.4 Ų24.49%0.09312%0.12CC..Hα-helixtrans-64.5-33.2178.200000112.7K122 P167 I168 N175K122-G171 WeakPolarHBondContact CE-O 3.5Å; P167-G171 PolarHBondContact O-N 2.62Å; I168-G171 PolarHBondContact O-N 3.04Å; G171-N175 PolarHBondContact O-N 3.43Å; G171-N175 VanDerWaalsContact O-N 3.09Å
172L98.8Very high97.8Very high0 Ų024.9 Ų24.90%012%0.122CC..Hα-helixtrans-64.3-49.2171169.763.8000111.2V118 K122 Y151 A154 F155 I168 R169 L170 L174 N175 F176V118-L172 HydrophobicContact CG1-CD2 4.04Å; K122-L172 HydrophobicContact CB-CD1 4Å; K122-L172 HydrophobicContact CD-CB 4.11Å; K122-L172 HydrophobicContact CG-CB 4.29Å; K122-L172 HydrophobicContact CG-CD1 3.97Å; Y151-L172 HydrophobicContact CD1-CD1 3.65Å; Y151-L172 HydrophobicContact CE1-CD1 4.35Å; A154-L172 VanDerWaalsContact C-CD2 3.48Å; A154-L172 HydrophobicContact CB-CD1 3.8Å; A154-L172 HydrophobicContact CB-CD2 3.65Å; A154-L172 HydrophobicContact CB-CG 4.4Å; F155-L172 HydrophobicContact CB-CD2 4.15Å; F155-L172 HydrophobicContact CD2-CD2 4.17Å; I168-L172 WeakPolarHBondContact O-CB 3.42Å; I168-L172 PolarHBondContact O-N 2.94Å; R169-L172 WeakPolarHBondContact O-CB 3.42Å; R169-L172 PolarHBondContact O-N 3.44Å; L170-L172 VanDerWaalsContact C-N 3.28Å; L170-L172 PolarHBondContact O-N 3.46Å; L172-L174 VanDerWaalsContact C-N 3.31Å; L172-L174 PolarHBondContact O-N 2.83Å; L172-N175 PolarHBondContact O-N 3.33Å; L172-F176 VanDerWaalsContact O-CB 3.25Å; L172-F176 WeakPolarHBondContact O-CB 3.4Å; L172-F176 PolarHBondContact O-N 3.38Å
173A98.8Very high97.9Very high3 Ų325.5 Ų25.53%0.02513%0.126CC..Hα-helixtrans-59.6-42.4177.900000111.8R169 L170 S177 A197R169-A173 PolarHBondContact O-N 2.97Å; L170-A173 PolarHBondContact O-N 2.84Å; A173-S177 VanDerWaalsContact O-CB 3.28Å; A173-S177 WeakPolarHBondContact O-CB 3.33Å; A173-S177 PolarHBondContact O-N 3.29Å; A173-S177 PolarHBondContact O-OG 3.23Å; A173-A197 HydrophobicContact CB-CB 3.44Å; A173-A197 VanDerWaalsContact CB-CB 3.44Å
174L98.8Very high97.9Very high20 Ų2022.1 Ų22.111%0.10511%0.111CC..Hα-helixtrans-56.2-56.2174.7177.964.9000110.9L170 L172 F176 S177 V178 I219 L222 L223 N226L170-L174 PolarHBondContact O-N 3.43Å; L172-L174 VanDerWaalsContact C-N 3.31Å; L172-L174 PolarHBondContact O-N 2.83Å; L174-F176 PolarHBondContact O-N 3.12Å; L174-S177 PolarHBondContact O-N 3.45Å; L174-S177 PolarHBondContact O-OG 3.45Å; L174-V178 WeakPolarHBondContact O-CG2 3.34Å; L174-V178 PolarHBondContact O-N 3.46Å; L174-V178 VanDerWaalsContact O-N 3.13Å; L174-I219 HydrophobicContact CB-CG2 4.29Å; L174-I219 HydrophobicContact CD2-CG2 4.18Å; L174-L222 HydrophobicContact CD1-CB 4.1Å; L174-L222 HydrophobicContact CD2-CB 3.93Å; L174-L222 HydrophobicContact CD2-CD1 3.92Å; L174-L223 HydrophobicContact CB-CD2 3.92Å; L174-L223 HydrophobicContact CB-CG 4.23Å; L174-L223 HydrophobicContact CD1-CD2 3.96Å; L174-L223 HydrophobicContact CD1-CG 4.17Å; L174-N226 VanDerWaalsContact CD1-ND2 3.33Å; L174-N226 WeakPolarHBondContact CD1-ND2 3.19Å
175N98.7Very high97.9Very high30 Ų3028.2 Ų28.216%0.1614%0.143CC..Hα-helixtrans-69.8-34.7-175-7316.3000112.9K122 D126 Y151 G171 L172 V178 F179K122-N175 PolarHBondContact NZ-ND2 3.13Å; D126-N175 WeakPolarHBondContact OD1-CB 3.46Å; D126-N175 PolarHBondContact OD1-ND2 3.34Å; D126-N175 PolarHBondContact OD2-ND2 2.86Å; Y151-N175 HydrophobicContact CE1-CB 4.16Å; G171-N175 PolarHBondContact O-N 3.43Å; G171-N175 VanDerWaalsContact O-N 3.09Å; L172-N175 PolarHBondContact O-N 3.33Å; N175-V178 PolarHBondContact O-N 2.97Å; N175-F179 PolarHBondContact O-N 3.41Å
176F98.8Very high97.9Very high2 Ų229.1 Ų29.11%0.00915%0.15CC..Hα-helixtrans-72.2-33.8177.4-167.1-167.5000111.8Y151 F155 L172 L174 F179 Y180 L193Y151-F176 VanDerWaalsContact CB-CD2 3.43Å; Y151-F176 VanDerWaalsContact CB-CE2 3.46Å; Y151-F176 HydrophobicContact CD1-CB 3.97Å; Y151-F176 HydrophobicContact CD1-CD2 4.36Å; Y151-F176 HydrophobicContact CD1-CG 4.21Å; Y151-F176 AromaticContact CD2-CD2 3.57Å; Y151-F176 HydrophobicContact CD2-CD2 3.57Å; Y151-F176 AromaticContact CD2-CE2 3.98Å; Y151-F176 HydrophobicContact CD2-CE2 3.98Å; Y151-F176 HydrophobicContact CD2-CG 4.24Å; Y151-F176 HydrophobicContact CE1-CB 4.41Å; Y151-F176 HydrophobicContact CE2-CD2 4.39Å; Y151-F176 HydrophobicContact CG-CB 4.04Å; Y151-F176 HydrophobicContact CG-CD1 4.43Å; Y151-F176 AromaticContact CG-CD2 3.56Å; Y151-F176 HydrophobicContact CG-CD2 3.56Å; Y151-F176 HydrophobicContact CG-CE2 4.02Å; Y151-F176 AromaticContact CG-CG 3.79Å; Y151-F176 HydrophobicContact CG-CG 3.79Å; F155-F176 HydrophobicContact CB-CE1 4.48Å; L172-F176 VanDerWaalsContact O-CB 3.25Å; L172-F176 WeakPolarHBondContact O-CB 3.4Å; L172-F176 PolarHBondContact O-N 3.38Å; L174-F176 PolarHBondContact O-N 3.12Å; F176-F179 HydrophobicContact CD2-CB 4.26Å; F176-F179 AromaticContact CD2-CD1 3.77Å; F176-F179 HydrophobicContact CD2-CD1 3.77Å; F176-F179 HydrophobicContact CD2-CG 4.4Å; F176-F179 AromaticContact CE2-CD1 3.69Å; F176-F179 HydrophobicContact CE2-CD1 3.69Å; F176-F179 HydrophobicContact CE2-CE1 4.12Å; F176-F179 WeakPolarHBondContact O-CB 3.4Å; F176-F179 PolarHBondContact O-N 2.96Å; F176-Y180 HydrophobicContact CD1-CE2 4.12Å; F176-Y180 AromaticContact CD2-CD2 3.99Å; F176-Y180 HydrophobicContact CD2-CD2 3.99Å; F176-Y180 AromaticContact CD2-CE2 3.66Å; F176-Y180 HydrophobicContact CD2-CE2 3.66Å; F176-Y180 AromaticContact CE1-CE2 3.92Å; F176-Y180 HydrophobicContact CE1-CE2 3.92Å; F176-Y180 HydrophobicContact CE2-CD2 4.12Å; F176-Y180 HydrophobicContact CE2-CE1 4.35Å; F176-Y180 AromaticContact CE2-CE2 3.44Å; F176-Y180 HydrophobicContact CE2-CE2 3.44Å; F176-Y180 VanDerWaalsContact CE2-CE2 3.44Å; F176-Y180 AromaticContact CE2-CZ 3.57Å; F176-Y180 HydrophobicContact CG-CD2 4.4Å; F176-Y180 HydrophobicContact CG-CE2 4.01Å; F176-Y180 AromaticContact CZ-CE2 3.59Å; F176-Y180 HydrophobicContact CZ-CE2 3.59Å; F176-Y180 AromaticContact CZ-CZ 3.58Å; F176-Y180 WeakPolarHBondContact CZ-OH 3.4Å; F176-Y180 VanDerWaalsContact O-CD2 3.23Å; F176-Y180 WeakPolarHBondContact O-CD2 3.36Å; F176-Y180 PolarHBondContact O-N 2.91Å; F176-L193 HydrophobicContact CB-CD2 3.83Å; F176-L193 HydrophobicContact CD1-CD2 3.77Å; F176-L193 HydrophobicContact CG-CD2 3.85Å
177S98.7Very high98Very high0 Ų028.2 Ų28.20%015%0.147CC..Hα-helixtrans-64.1-41.3171.769.90000111.8A173 L174 F179 Y180 Y181 A190 W230A173-S177 VanDerWaalsContact O-CB 3.28Å; A173-S177 WeakPolarHBondContact O-CB 3.33Å; A173-S177 PolarHBondContact O-N 3.29Å; A173-S177 PolarHBondContact O-OG 3.23Å; L174-S177 PolarHBondContact O-N 3.45Å; L174-S177 PolarHBondContact O-OG 3.45Å; S177-F179 VanDerWaalsContact C-N 3.32Å; S177-F179 PolarHBondContact O-N 3.47Å; S177-Y180 PolarHBondContact O-N 3.29Å; S177-Y181 PolarHBondContact O-N 3.32Å; S177-A190 VanDerWaalsContact O-CB 3.26Å; S177-A190 WeakPolarHBondContact O-CB 3.24Å; S177-W230 WeakPolarHBondContact OG-CH2 3.48Å
178V98.4Very high98Very high18 Ų1833.3 Ų33.311%0.10917%0.169CC..Hα-helixtrans-61.4-39.9173.3174.40000111.2L174 N175 Y181 E182 W230L174-V178 WeakPolarHBondContact O-CG2 3.34Å; L174-V178 PolarHBondContact O-N 3.46Å; L174-V178 VanDerWaalsContact O-N 3.13Å; N175-V178 PolarHBondContact O-N 2.97Å; V178-Y181 PolarHBondContact O-N 2.89Å; V178-E182 VanDerWaalsContact CG1-CD 3.42Å; V178-E182 HydrophobicContact CG1-CG 3.96Å; V178-E182 WeakPolarHBondContact CG1-OE2 3.29Å; V178-E182 WeakPolarHBondContact O-CB 3.42Å; V178-E182 PolarHBondContact O-N 3.35Å; V178-W230 HydrophobicContact CG2-CH2 4.04Å; V178-W230 HydrophobicContact CG2-CZ2 4.02Å
179F98.7Very high98Very high0 Ų038 Ų380%019%0.188CC..Hα-helixtrans-59.5-47.5173171-102.4000112.4R129 V144 S147 Q148 Y151 N175 F176 S177 Y181 I183 L184R129-F179 HydrophobicContact CB-CD2 4.26Å; R129-F179 HydrophobicContact CG-CD2 4.34Å; V144-F179 HydrophobicContact CG1-CE2 4.48Å; V144-F179 HydrophobicContact CG1-CZ 4.1Å; S147-F179 WeakPolarHBondContact OG-CD2 3.32Å; S147-F179 WeakPolarHBondContact OG-CE2 3.44Å; Q148-F179 HydrophobicContact CB-CE1 3.8Å; Q148-F179 HydrophobicContact CB-CZ 3.83Å; Q148-F179 HydrophobicContact CG-CE1 4.17Å; Y151-F179 HydrophobicContact CD2-CB 4.21Å; Y151-F179 HydrophobicContact CD2-CD1 4.25Å; Y151-F179 HydrophobicContact CD2-CG 4.1Å; Y151-F179 HydrophobicContact CE2-CB 3.72Å; Y151-F179 HydrophobicContact CE2-CD1 4.49Å; Y151-F179 HydrophobicContact CE2-CD2 4.19Å; Y151-F179 AromaticContact CE2-CG 3.88Å; Y151-F179 HydrophobicContact CE2-CG 3.88Å; N175-F179 PolarHBondContact O-N 3.41Å; F176-F179 HydrophobicContact CD2-CB 4.26Å; F176-F179 AromaticContact CD2-CD1 3.77Å; F176-F179 HydrophobicContact CD2-CD1 3.77Å; F176-F179 HydrophobicContact CD2-CG 4.4Å; F176-F179 AromaticContact CE2-CD1 3.69Å; F176-F179 HydrophobicContact CE2-CD1 3.69Å; F176-F179 HydrophobicContact CE2-CE1 4.12Å; F176-F179 WeakPolarHBondContact O-CB 3.4Å; F176-F179 PolarHBondContact O-N 2.96Å; S177-F179 VanDerWaalsContact C-N 3.32Å; S177-F179 PolarHBondContact O-N 3.47Å; F179-Y181 VanDerWaalsContact C-N 3.25Å; F179-Y181 PolarHBondContact O-N 3.45Å; F179-I183 HydrophobicContact CD2-CB 3.73Å; F179-I183 HydrophobicContact CD2-CG1 3.77Å; F179-I183 HydrophobicContact CD2-CG2 4.09Å; F179-I183 HydrophobicContact CE2-CB 3.82Å; F179-I183 HydrophobicContact CE2-CG1 4.23Å; F179-I183 HydrophobicContact CE2-CG2 3.67Å; F179-I183 HydrophobicContact CZ-CG2 4.5Å; F179-I183 WeakPolarHBondContact O-CB 3.35Å; F179-I183 PolarHBondContact O-N 2.85Å; F179-L184 HydrophobicContact CD1-CD1 4.06Å; F179-L184 HydrophobicContact CD1-CG 4.3Å; F179-L184 HydrophobicContact CE1-CD1 3.33Å; F179-L184 HydrophobicContact CE1-CD2 4.4Å; F179-L184 HydrophobicContact CE1-CG 3.64Å; F179-L184 HydrophobicContact CZ-CD1 3.88Å; F179-L184 HydrophobicContact CZ-CD2 4.11Å; F179-L184 HydrophobicContact CZ-CG 3.75Å; F179-L184 PolarHBondContact O-N 3.4Å
180Y98.6Very high98Very high26 Ų2636.8 Ų36.810%0.10218%0.184CC..Hα-helixtrans-59-40.3176.7-80.2-61.2000112F176 S177 L184 N185 S186 K189 L193F176-Y180 HydrophobicContact CD1-CE2 4.12Å; F176-Y180 AromaticContact CD2-CD2 3.99Å; F176-Y180 HydrophobicContact CD2-CD2 3.99Å; F176-Y180 AromaticContact CD2-CE2 3.66Å; F176-Y180 HydrophobicContact CD2-CE2 3.66Å; F176-Y180 AromaticContact CE1-CE2 3.92Å; F176-Y180 HydrophobicContact CE1-CE2 3.92Å; F176-Y180 HydrophobicContact CE2-CD2 4.12Å; F176-Y180 HydrophobicContact CE2-CE1 4.35Å; F176-Y180 AromaticContact CE2-CE2 3.44Å; F176-Y180 HydrophobicContact CE2-CE2 3.44Å; F176-Y180 VanDerWaalsContact CE2-CE2 3.44Å; F176-Y180 AromaticContact CE2-CZ 3.57Å; F176-Y180 HydrophobicContact CG-CD2 4.4Å; F176-Y180 HydrophobicContact CG-CE2 4.01Å; F176-Y180 AromaticContact CZ-CE2 3.59Å; F176-Y180 HydrophobicContact CZ-CE2 3.59Å; F176-Y180 AromaticContact CZ-CZ 3.58Å; F176-Y180 WeakPolarHBondContact CZ-OH 3.4Å; F176-Y180 VanDerWaalsContact O-CD2 3.23Å; F176-Y180 WeakPolarHBondContact O-CD2 3.36Å; F176-Y180 PolarHBondContact O-N 2.91Å; S177-Y180 PolarHBondContact O-N 3.29Å; Y180-L184 HydrophobicContact CD1-CB 4.49Å; Y180-L184 HydrophobicContact CD1-CD1 3.59Å; Y180-L184 HydrophobicContact CE1-CD1 3.72Å; Y180-L184 CarbonylContact O-C 3.52Å; Y180-N185 PolarHBondContact O-N 3.14Å; Y180-S186 PolarHBondContact O-N 3.41Å; Y180-K189 HydrophobicContact CD1-CB 3.93Å; Y180-K189 HydrophobicContact CD1-CD 4.07Å; Y180-K189 HydrophobicContact CE1-CB 4.38Å; Y180-K189 HydrophobicContact CE1-CD 3.98Å; Y180-K189 HydrophobicContact CG-CB 4.02Å; Y180-L193 HydrophobicContact CD2-CD2 3.98Å; Y180-L193 HydrophobicContact CE2-CD2 3.92Å
181Y98.1Very high98Very high47 Ų4737.7 Ų37.718%0.18419%0.19CC..Hα-helixtrans-70.5-63.8179.9-165.6-98000111.8S177 V178 F179 N185 P187 A190 W230 E233S177-Y181 PolarHBondContact O-N 3.32Å; V178-Y181 PolarHBondContact O-N 2.89Å; F179-Y181 VanDerWaalsContact C-N 3.25Å; F179-Y181 PolarHBondContact O-N 3.45Å; Y181-N185 WeakPolarHBondContact O-CA 3.25Å; Y181-N185 PolarHBondContact O-N 3.05Å; Y181-P187 HydrophobicContact CD2-CB 3.93Å; Y181-P187 HydrophobicContact CE2-CB 3.78Å; Y181-A190 HydrophobicContact CD2-CB 4.24Å; Y181-W230 AromaticContact CD1-CD1 3.77Å; Y181-W230 AromaticContact CD1-CE2 3.93Å; Y181-W230 HydrophobicContact CD1-CG 4.48Å; Y181-W230 HydrophobicContact CD1-CZ2 4.46Å; Y181-W230 AromaticContact CD1-NE1 3.38Å; Y181-W230 HydrophobicContact CD2-CB 4.11Å; Y181-W230 AromaticContact CD2-CD1 3.63Å; Y181-W230 AromaticContact CD2-CD2 3.73Å; Y181-W230 HydrophobicContact CD2-CD2 3.73Å; Y181-W230 AromaticContact CD2-CE2 3.89Å; Y181-W230 HydrophobicContact CD2-CE3 4.41Å; Y181-W230 AromaticContact CD2-CG 3.57Å; Y181-W230 HydrophobicContact CD2-CG 3.57Å; Y181-W230 AromaticContact CD2-NE1 3.81Å; Y181-W230 AromaticContact CE1-CD1 3.45Å; Y181-W230 VanDerWaalsContact CE1-CD1 3.45Å; Y181-W230 HydrophobicContact CE1-CG 4.33Å; Y181-W230 AromaticContact CE1-NE1 3.49Å; Y181-W230 HydrophobicContact CE2-CB 3.67Å; Y181-W230 AromaticContact CE2-CD1 3.33Å; Y181-W230 HydrophobicContact CE2-CD2 4.12Å; Y181-W230 AromaticContact CE2-CG 3.43Å; Y181-W230 HydrophobicContact CE2-CG 3.43Å; Y181-W230 VanDerWaalsContact CE2-CG 3.43Å; Y181-W230 AromaticContact CE2-NE1 3.94Å; Y181-W230 AromaticContact CG-CD1 3.85Å; Y181-W230 HydrophobicContact CG-CD2 4.01Å; Y181-W230 AromaticContact CG-CE2 3.65Å; Y181-W230 HydrophobicContact CG-CG 4.12Å; Y181-W230 HydrophobicContact CG-CZ2 4.12Å; Y181-W230 AromaticContact CG-NE1 3.56Å; Y181-W230 AromaticContact CZ-CD1 3.24Å; Y181-W230 AromaticContact CZ-CG 3.85Å; Y181-W230 AromaticContact CZ-NE1 3.79Å; Y181-E233 PolarHBondContact OH-OE2 3.09Å
182E96.3Very high98Very high105 Ų10540.7 Ų40.749%0.49121%0.209SC..Hα-helixtrans-78-30.3-167.6-62.9-177.3166.800113.5R129 V178R129-E182 IonicContact NH1-OE2 2.91Å; V178-E182 VanDerWaalsContact CG1-CD 3.42Å; V178-E182 HydrophobicContact CG1-CG 3.96Å; V178-E182 WeakPolarHBondContact CG1-OE2 3.29Å; V178-E182 WeakPolarHBondContact O-CB 3.42Å; V178-E182 PolarHBondContact O-N 3.35Å
183I97.3Very high97.9Very high26 Ų2641.6 Ų41.613%0.13321%0.214CC..THydrogen-bonded Turntrans-105.9-45.4-171.8-52.4-57.1000112.2R129 E133 V144 F179R129-I183 HydrophobicContact CG-CD1 4.16Å; R129-I183 HydrophobicContact CG-CG1 3.8Å; E133-I183 HydrophobicContact CG-CD1 3.83Å; V144-I183 HydrophobicContact CG1-CG2 4.47Å; V144-I183 HydrophobicContact CG2-CG2 3.63Å; F179-I183 HydrophobicContact CD2-CB 3.73Å; F179-I183 HydrophobicContact CD2-CG1 3.77Å; F179-I183 HydrophobicContact CD2-CG2 4.09Å; F179-I183 HydrophobicContact CE2-CB 3.82Å; F179-I183 HydrophobicContact CE2-CG1 4.23Å; F179-I183 HydrophobicContact CE2-CG2 3.67Å; F179-I183 HydrophobicContact CZ-CG2 4.5Å; F179-I183 WeakPolarHBondContact O-CB 3.35Å; F179-I183 PolarHBondContact O-N 2.85Å
184L97.1Very high97.9Very high49 Ų4941.5 Ų41.526%0.25721%0.213SC..THydrogen-bonded Turntrans-90.1-3179.8-67.4-175.9000113.6V144 F179 Y180 S186V144-L184 HydrophobicContact CG1-CD2 3.51Å; F179-L184 HydrophobicContact CD1-CD1 4.06Å; F179-L184 HydrophobicContact CD1-CG 4.3Å; F179-L184 HydrophobicContact CE1-CD1 3.33Å; F179-L184 HydrophobicContact CE1-CD2 4.4Å; F179-L184 HydrophobicContact CE1-CG 3.64Å; F179-L184 HydrophobicContact CZ-CD1 3.88Å; F179-L184 HydrophobicContact CZ-CD2 4.11Å; F179-L184 HydrophobicContact CZ-CG 3.75Å; F179-L184 PolarHBondContact O-N 3.4Å; Y180-L184 HydrophobicContact CD1-CB 4.49Å; Y180-L184 HydrophobicContact CD1-CD1 3.59Å; Y180-L184 HydrophobicContact CE1-CD1 3.72Å; Y180-L184 CarbonylContact O-C 3.52Å; L184-S186 PolarHBondContact O-N 2.62Å; L184-S186 VanDerWaalsContact O-N 3.14Å; L184-S186 PolarHBondContact O-OG 2.94Å
185N96.4Very high97.9Very high140 Ų14046 Ų4675%0.74923%0.232SC*.  trans46.744.9-177.6-164.653.9000112Y180 Y181 P187Y180-N185 PolarHBondContact O-N 3.14Å; Y181-N185 WeakPolarHBondContact O-CA 3.25Å; Y181-N185 PolarHBondContact O-N 3.05Å; N185-P187 VanDerWaalsContact C-CD 3.43Å; N185-P187 WeakPolarHBondContact O-CD 3.27Å
186S97.6Very high97.9Very high25 Ų2547.4 Ų47.418%0.17524%0.242CC..  trans-121.668.8-174.2-64.80000110Y180 L184 E188 K189 A190Y180-S186 PolarHBondContact O-N 3.41Å; L184-S186 PolarHBondContact O-N 2.62Å; L184-S186 VanDerWaalsContact O-N 3.14Å; L184-S186 PolarHBondContact O-OG 2.94Å; S186-E188 VanDerWaalsContact C-N 3.27Å; S186-E188 PolarHBondContact O-N 2.87Å; S186-K189 PolarHBondContact O-N 3.32Å; S186-K189 VanDerWaalsContact O-N 3.13Å; S186-A190 PolarHBondContact O-N 3.24Å
187P97Very high97.9Very high18 Ų1847.8 Ų47.812%0.11725%0.246CC..Hα-helixtrans-61.1-32.3-172.924.9-34.3000113.3Y181 N185 K189 A190 C191Y181-P187 HydrophobicContact CD2-CB 3.93Å; Y181-P187 HydrophobicContact CE2-CB 3.78Å; N185-P187 VanDerWaalsContact C-CD 3.43Å; N185-P187 WeakPolarHBondContact O-CD 3.27Å; P187-K189 PolarHBondContact O-N 3.28Å; P187-A190 PolarHBondContact O-N 3.14Å; P187-C191 WeakPolarHBondContact O-CB 3.44Å; P187-C191 PolarHBondContact O-N 3.43Å; P187-C191 PolarHBondContact O-SG 2.93Å
188E96.7Very high97.8Very high131 Ų13149.6 Ų49.661%0.61225%0.253SS*.Hα-helixtrans-65.4-41.2177.6-55.973.5-159.300111.1S186 S192S186-E188 VanDerWaalsContact C-N 3.27Å; S186-E188 PolarHBondContact O-N 2.87Å; E188-S192 WeakPolarHBondContact O-CB 3.37Å; E188-S192 PolarHBondContact O-N 3.47Å
189K97.8Very high97.8Very high121 Ų12152.1 Ų52.153%0.52627%0.267SS..Hα-helixtrans-68.8-41.3176.1-70.3-176.8-179.7171.10111.2Y180 S186 P187 S192 L193Y180-K189 HydrophobicContact CD1-CB 3.93Å; Y180-K189 HydrophobicContact CD1-CD 4.07Å; Y180-K189 HydrophobicContact CE1-CB 4.38Å; Y180-K189 HydrophobicContact CE1-CD 3.98Å; Y180-K189 HydrophobicContact CG-CB 4.02Å; S186-K189 PolarHBondContact O-N 3.32Å; S186-K189 VanDerWaalsContact O-N 3.13Å; P187-K189 PolarHBondContact O-N 3.28Å; K189-S192 PolarHBondContact O-N 3.34Å; K189-L193 WeakPolarHBondContact O-CB 3.36Å; K189-L193 PolarHBondContact O-N 3.4Å
190A98.2Very high97.8Very high0 Ų055.3 Ų55.30%028%0.281CS..Hα-helixtrans-58.9-51.7176.200000111.2S177 Y181 S186 P187 L193 A194 W230S177-A190 VanDerWaalsContact O-CB 3.26Å; S177-A190 WeakPolarHBondContact O-CB 3.24Å; Y181-A190 HydrophobicContact CD2-CB 4.24Å; S186-A190 PolarHBondContact O-N 3.24Å; P187-A190 PolarHBondContact O-N 3.14Å; A190-L193 PolarHBondContact O-N 2.99Å; A190-A194 WeakPolarHBondContact O-CB 3.43Å; A190-A194 PolarHBondContact O-N 2.96Å; A190-W230 HydrophobicContact CB-CE3 4.13Å; A190-W230 HydrophobicContact CB-CZ3 3.98Å
191C98.2Very high97.7Very high21 Ų2154.1 Ų54.114%0.14228%0.277CS..Hα-helixtrans-64.8-43.1179.2-66.60000111.9P187 L193 A194 K195 L227P187-C191 WeakPolarHBondContact O-CB 3.44Å; P187-C191 PolarHBondContact O-N 3.43Å; P187-C191 PolarHBondContact O-SG 2.93Å; C191-L193 PolarHBondContact O-N 3.34Å; C191-A194 PolarHBondContact O-N 3.47Å; C191-K195 WeakPolarHBondContact O-CB 3.45Å; C191-K195 PolarHBondContact O-N 3.08Å; C191-L227 HydrophobicContact CB-CD2 4.06Å; C191-L227 WeakPolarHBondContact O-CD2 2.96Å
192S98.1Very high97.6Very high72 Ų7256 Ų5650%0.50329%0.289SS..Hα-helixtrans-59.1-45.9177.5-179.90000112E188 K189 T196E188-S192 WeakPolarHBondContact O-CB 3.37Å; E188-S192 PolarHBondContact O-N 3.47Å; K189-S192 PolarHBondContact O-N 3.34Å; S192-T196 VanDerWaalsContact O-CB 3.31Å; S192-T196 WeakPolarHBondContact O-CB 3.47Å; S192-T196 PolarHBondContact O-N 2.85Å; S192-T196 PolarHBondContact O-OG1 3.09Å
193L98.5Very high97.6Very high20 Ų2055 Ų5511%0.10530%0.299CS..Hα-helixtrans-64.9-50178.1178.361.9000111.9F155 F176 Y180 K189 A190 C191 K195 T196 A197F155-L193 HydrophobicContact CE1-CD1 4.27Å; F155-L193 HydrophobicContact CE2-CD1 3.59Å; F155-L193 HydrophobicContact CZ-CD1 3.39Å; F176-L193 HydrophobicContact CB-CD2 3.83Å; F176-L193 HydrophobicContact CD1-CD2 3.77Å; F176-L193 HydrophobicContact CG-CD2 3.85Å; Y180-L193 HydrophobicContact CD2-CD2 3.98Å; Y180-L193 HydrophobicContact CE2-CD2 3.92Å; K189-L193 WeakPolarHBondContact O-CB 3.36Å; K189-L193 PolarHBondContact O-N 3.4Å; A190-L193 PolarHBondContact O-N 2.99Å; C191-L193 PolarHBondContact O-N 3.34Å; L193-K195 PolarHBondContact O-N 3.44Å; L193-T196 PolarHBondContact O-N 3.13Å; L193-A197 PolarHBondContact O-N 2.87Å
194A98.4Very high97.6Very high0 Ų056.9 Ų56.90%031%0.307CS..Hα-helixtrans-63.2-42.4-178.700000111.8A190 C191 A197 F198 L223 L227 W230A190-A194 WeakPolarHBondContact O-CB 3.43Å; A190-A194 PolarHBondContact O-N 2.96Å; C191-A194 PolarHBondContact O-N 3.47Å; A194-A197 PolarHBondContact O-N 3.42Å; A194-F198 WeakPolarHBondContact O-CB 3.18Å; A194-F198 PolarHBondContact O-N 2.89Å; A194-L223 HydrophobicContact CB-CD2 3.85Å; A194-L227 HydrophobicContact CB-CD1 4.29Å; A194-L227 HydrophobicContact CB-CD2 3.84Å; A194-L227 HydrophobicContact CB-CG 3.9Å; A194-W230 HydrophobicContact CB-CZ3 4.35Å
195K98.2Very high97.3Very high114 Ų11456.2 Ų56.250%0.49630%0.304SS..Hα-helixtrans-64.4-46.1177.3-174.7179.1-175-60.90111.5C191 L193 A197 F198 D199 L227C191-K195 WeakPolarHBondContact O-CB 3.45Å; C191-K195 PolarHBondContact O-N 3.08Å; L193-K195 PolarHBondContact O-N 3.44Å; K195-A197 PolarHBondContact O-N 3.23Å; K195-F198 PolarHBondContact O-N 3.48Å; K195-D199 WeakPolarHBondContact CG-OD2 3.39Å; K195-D199 IonicContact NZ-OD2 2.63Å; K195-D199 PolarHBondContact NZ-OD2 3.09Å; K195-D199 WeakPolarHBondContact O-CB 3.45Å; K195-D199 VanDerWaalsContact O-CG 3.23Å; K195-D199 PolarHBondContact O-N 3.4Å; K195-L227 HydrophobicContact CB-CD1 4.2Å; K195-L227 HydrophobicContact CB-CD2 4.09Å
196T98.4Very high97.1Very high60 Ų6057.6 Ų57.637%0.36831%0.311SS..Hα-helixtrans-59.1-48.4178-58.60000110.9S192 L193 F198 D199 E200S192-T196 VanDerWaalsContact O-CB 3.31Å; S192-T196 WeakPolarHBondContact O-CB 3.47Å; S192-T196 PolarHBondContact O-N 2.85Å; S192-T196 PolarHBondContact O-OG1 3.09Å; L193-T196 PolarHBondContact O-N 3.13Å; T196-F198 VanDerWaalsContact C-N 3.34Å; T196-F198 PolarHBondContact O-N 2.95Å; T196-D199 PolarHBondContact O-N 3.43Å; T196-E200 HydrophobicContact CG2-CG 4.27Å; T196-E200 WeakPolarHBondContact CG2-OE1 3.48Å; T196-E200 WeakPolarHBondContact O-CB 3.37Å; T196-E200 VanDerWaalsContact O-CG 3.26Å; T196-E200 WeakPolarHBondContact O-CG 3.49Å; T196-E200 PolarHBondContact O-N 3.18Å
197A98.3Very high96.6Very high11 Ų1161.3 Ų61.39%0.09133%0.333CS..Hα-helixtrans-62.7-39.7178.800000112.8A173 L193 A194 K195 A201 L223A173-A197 HydrophobicContact CB-CB 3.44Å; A173-A197 VanDerWaalsContact CB-CB 3.44Å; L193-A197 PolarHBondContact O-N 2.87Å; A194-A197 PolarHBondContact O-N 3.42Å; K195-A197 PolarHBondContact O-N 3.23Å; A197-A201 VanDerWaalsContact O-CB 3.27Å; A197-A201 WeakPolarHBondContact O-CB 3.34Å; A197-A201 PolarHBondContact O-N 3.37Å; A197-A201 VanDerWaalsContact O-N 3.1Å; A197-L223 HydrophobicContact CB-CD1 4.36Å
198F98.2Very high96.2Very high37 Ų3761.9 Ų61.916%0.16234%0.335CS..Hα-helixtrans-66.2-47.3177.2-176-98.1000111.9A194 K195 T196 A201 I202 M220 L223 R224A194-F198 WeakPolarHBondContact O-CB 3.18Å; A194-F198 PolarHBondContact O-N 2.89Å; K195-F198 PolarHBondContact O-N 3.48Å; T196-F198 VanDerWaalsContact C-N 3.34Å; T196-F198 PolarHBondContact O-N 2.95Å; F198-A201 PolarHBondContact O-N 3.29Å; F198-I202 HydrophobicContact CD1-CD1 3.67Å; F198-I202 HydrophobicContact CD1-CG1 4.32Å; F198-I202 HydrophobicContact CE1-CD1 3.09Å; F198-I202 HydrophobicContact CE1-CG1 4.1Å; F198-I202 HydrophobicContact CE2-CD1 4.21Å; F198-I202 HydrophobicContact CG-CD1 4.46Å; F198-I202 HydrophobicContact CZ-CD1 3.41Å; F198-I202 VanDerWaalsContact CZ-CD1 3.41Å; F198-I202 HydrophobicContact CZ-CG1 4.26Å; F198-I202 WeakPolarHBondContact O-CB 3.23Å; F198-I202 WeakPolarHBondContact O-CG1 3.43Å; F198-I202 PolarHBondContact O-N 2.76Å; F198-M220 HydrophobicContact CD2-CB 4.08Å; F198-M220 WeakPolarHBondContact CD2-O 3.4Å; F198-M220 HydrophobicContact CE2-CB 4.08Å; F198-M220 WeakPolarHBondContact CE2-O 3.44Å; F198-L223 HydrophobicContact CD2-CB 4.43Å; F198-R224 HydrophobicContact CD2-CB 4.4Å; F198-R224 HydrophobicContact CE2-CB 3.85Å; F198-R224 HydrophobicContact CE2-CG 4.47Å; F198-R224 HydrophobicContact CZ-CB 4.16Å; F198-R224 HydrophobicContact CZ-CG 4.27Å
199D98.2Very high95.7Very high72 Ų7259.9 Ų59.939%0.38533%0.328SS..Hα-helixtrans-65.3-44-179.4-69.4-15.1000111.5K195 T196 A201 I202 A203K195-D199 WeakPolarHBondContact CG-OD2 3.39Å; K195-D199 IonicContact NZ-OD2 2.63Å; K195-D199 PolarHBondContact NZ-OD2 3.09Å; K195-D199 WeakPolarHBondContact O-CB 3.45Å; K195-D199 VanDerWaalsContact O-CG 3.23Å; K195-D199 PolarHBondContact O-N 3.4Å; T196-D199 PolarHBondContact O-N 3.43Å; D199-A201 PolarHBondContact O-N 2.99Å; D199-I202 PolarHBondContact O-N 3.11Å; D199-A203 PolarHBondContact O-N 2.89Å
200E97.8Very high95.2Very high67 Ų6763.1 Ų63.131%0.31335%0.345SS..Hα-helixtrans-60.8-43.4175.4-71.9177.6174.600111.4P164 R169 T196 A203P164-E200 HydrophobicContact CB-CB 3.85Å; P164-E200 HydrophobicContact CG-CB 4.29Å; R169-E200 IonicContact CZ-OE2 2.96Å; R169-E200 IonicContact NH2-OE2 2.64Å; R169-E200 PolarHBondContact NH2-OE2 3.04Å; T196-E200 HydrophobicContact CG2-CG 4.27Å; T196-E200 WeakPolarHBondContact CG2-OE1 3.48Å; T196-E200 WeakPolarHBondContact O-CB 3.37Å; T196-E200 VanDerWaalsContact O-CG 3.26Å; T196-E200 WeakPolarHBondContact O-CG 3.49Å; T196-E200 PolarHBondContact O-N 3.18Å; E200-A203 PolarHBondContact O-N 3.13Å
201A97.2Very high94.6Very high0 Ų071.2 Ų71.20%038%0.383CS..Hα-helixtrans-71.9-35.3179.700000113.1T165 L170 A197 F198 D199 A203 E204 L205 M220T165-A201 HydrophobicContact CG2-CB 4.42Å; T165-A201 WeakPolarHBondContact CG2-O 3.26Å; L170-A201 HydrophobicContact CD1-CB 4.47Å; L170-A201 HydrophobicContact CD2-CB 3.73Å; A197-A201 VanDerWaalsContact O-CB 3.27Å; A197-A201 WeakPolarHBondContact O-CB 3.34Å; A197-A201 PolarHBondContact O-N 3.37Å; A197-A201 VanDerWaalsContact O-N 3.1Å; F198-A201 PolarHBondContact O-N 3.29Å; D199-A201 PolarHBondContact O-N 2.99Å; A201-A203 VanDerWaalsContact C-N 3.33Å; A201-E204 PolarHBondContact O-N 3.02Å; A201-L205 WeakPolarHBondContact O-CA 3.22Å; A201-L205 WeakPolarHBondContact O-CB 3.25Å; A201-L205 PolarHBondContact O-N 2.85Å; A201-M220 HydrophobicContact CB-CE 3.86Å; A201-M220 HydrophobicContact CB-CG 4.3Å; A201-M220 HydrophobicContact CB-SD 3.91Å
202I96.6Very high94.1Very high86 Ų8671.7 Ų71.744%0.44139%0.387SS..Hα-helixtrans-60.4-44.6172.1-80.3-173.1000110.8F198 D199 E204 L205 M220F198-I202 HydrophobicContact CD1-CD1 3.67Å; F198-I202 HydrophobicContact CD1-CG1 4.32Å; F198-I202 HydrophobicContact CE1-CD1 3.09Å; F198-I202 HydrophobicContact CE1-CG1 4.1Å; F198-I202 HydrophobicContact CE2-CD1 4.21Å; F198-I202 HydrophobicContact CG-CD1 4.46Å; F198-I202 HydrophobicContact CZ-CD1 3.41Å; F198-I202 VanDerWaalsContact CZ-CD1 3.41Å; F198-I202 HydrophobicContact CZ-CG1 4.26Å; F198-I202 WeakPolarHBondContact O-CB 3.23Å; F198-I202 WeakPolarHBondContact O-CG1 3.43Å; F198-I202 PolarHBondContact O-N 2.76Å; D199-I202 PolarHBondContact O-N 3.11Å; I202-E204 PolarHBondContact O-N 2.81Å; I202-E204 VanDerWaalsContact O-N 3.15Å; I202-L205 PolarHBondContact O-N 3.19Å; I202-M220 HydrophobicContact CB-CE 4.37Å; I202-M220 HydrophobicContact CG1-CE 3.46Å; I202-M220 VanDerWaalsContact CG1-CE 3.46Å
203A96.7Very high93.8Very high85 Ų8573.9 Ų73.970%0.70239%0.385SS*.Hα-helixtrans-61.4-24.6-17700000113.2D199 E200 A201D199-A203 PolarHBondContact O-N 2.89Å; E200-A203 PolarHBondContact O-N 3.13Å; A201-A203 VanDerWaalsContact C-N 3.33Å
204E95.6Very high93.6Very high66 Ų6680.6 Ų80.631%0.30841%0.413SS..THydrogen-bonded Turntrans-115.57.6-178.1-64.4-173.8-157.900113.5Q163 P164 T165 A201 I202 D206 T207Q163-E204 PolarHBondContact OE1-OE2 2.86Å; P164-E204 WeakPolarHBondContact CD-OE2 3.42Å; T165-E204 HydrophobicContact CG2-CB 3.91Å; A201-E204 PolarHBondContact O-N 3.02Å; I202-E204 PolarHBondContact O-N 2.81Å; I202-E204 VanDerWaalsContact O-N 3.15Å; E204-D206 PolarHBondContact O-N 3.03Å; E204-T207 WeakPolarHBondContact O-CB 3.45Å; E204-T207 PolarHBondContact O-N 2.91Å; E204-T207 PolarHBondContact O-OG1 2.87Å
205L92.4Very high93.4Very high35 Ų3584.7 Ų84.718%0.18344%0.435CS..G310 helixtrans-59.8-34.5-172.3-171.662.2000112.8A201 I202 T207 L208 Y213 T217 M220A201-L205 WeakPolarHBondContact O-CA 3.22Å; A201-L205 WeakPolarHBondContact O-CB 3.25Å; A201-L205 PolarHBondContact O-N 2.85Å; I202-L205 PolarHBondContact O-N 3.19Å; L205-T207 PolarHBondContact O-N 3.4Å; L205-T207 VanDerWaalsContact O-N 3.16Å; L205-L208 HydrophobicContact CD1-CD2 4.06Å; L205-L208 VanDerWaalsContact O-CB 3.24Å; L205-L208 WeakPolarHBondContact O-CB 3.38Å; L205-L208 PolarHBondContact O-N 3.33Å; L205-L208 VanDerWaalsContact O-N 3.15Å; L205-Y213 HydrophobicContact CD1-CE2 4.45Å; L205-Y213 HydrophobicContact CG-CE2 4.45Å; L205-T217 HydrophobicContact CD1-CG2 4.17Å; L205-M220 HydrophobicContact CD1-CE 4.38Å; L205-M220 HydrophobicContact CD1-SD 3.93Å; L205-M220 HydrophobicContact CD2-CE 4.44Å
206D91Very high93.4Very high168 Ų16879.3 Ų79.390%0.89841%0.411SS*.G310 helixtrans-66.2-13.7179.1-67.2-23.8000113.5E204E204-D206 PolarHBondContact O-N 3.03Å
207T87.7Confident93.3Very high103 Ų10378.5 Ų78.563%0.63241%0.407SS*.G310 helixtrans-88.4-8.6177.971.60000113.2E204 L205E204-T207 WeakPolarHBondContact O-CB 3.45Å; E204-T207 PolarHBondContact O-N 2.91Å; E204-T207 PolarHBondContact O-OG1 2.87Å; L205-T207 PolarHBondContact O-N 3.4Å; L205-T207 VanDerWaalsContact O-N 3.16Å
208L87.8Confident93.2Very high31 Ų3182.9 Ų82.916%0.16243%0.428CS..  trans-75.5137-170.9-165.259.2000111.5L205 Y213L205-L208 HydrophobicContact CD1-CD2 4.06Å; L205-L208 VanDerWaalsContact O-CB 3.24Å; L205-L208 WeakPolarHBondContact O-CB 3.38Å; L205-L208 PolarHBondContact O-N 3.33Å; L205-L208 VanDerWaalsContact O-N 3.15Å; L208-Y213 HydrophobicContact CB-CD2 4.42Å; L208-Y213 HydrophobicContact CD2-CD2 4.19Å
209N87.5Confident93.2Very high89 Ų8982.5 Ų82.548%0.47643%0.427SS..  trans-74.9160.3174.666.629.3000112E211 S212 Y213N209-E211 PolarHBondContact O-N 3.36Å; N209-E211 PolarHBondContact OD1-N 3.49Å; N209-S212 PolarHBondContact O-N 3.36Å; N209-S212 WeakPolarHBondContact OD1-CB 3.38Å; N209-S212 PolarHBondContact OD1-N 3.17Å; N209-S212 PolarHBondContact OD1-OG 3.15Å; N209-Y213 WeakPolarHBondContact O-CB 3.22Å; N209-Y213 PolarHBondContact O-N 3.21Å
210E86Confident93.2Very high189 Ų18979.5 Ų79.588%0.88341%0.411SS*.Hα-helixtrans-59.8-33.1-178.8-68-176176.200113.1
211E85.3Confident93.2Very high170 Ų17079.3 Ų79.379%0.79441%0.41SS*.Hα-helixtrans-65.5-42.5-177.6-172.8177.5-173.500112.3N209N209-E211 PolarHBondContact O-N 3.36Å; N209-E211 PolarHBondContact OD1-N 3.49Å
212S89.3Confident93.3Very high31 Ų3182.9 Ų82.922%0.21743%0.429CS..Hα-helixtrans-89.9-16.5-179.5-59.90000113.3N209 K214 D215 S216N209-S212 PolarHBondContact O-N 3.36Å; N209-S212 WeakPolarHBondContact OD1-CB 3.38Å; N209-S212 PolarHBondContact OD1-N 3.17Å; N209-S212 PolarHBondContact OD1-OG 3.15Å; S212-K214 VanDerWaalsContact C-N 3.33Å; S212-K214 PolarHBondContact O-N 3.45Å; S212-D215 PolarHBondContact O-N 3.07Å; S212-S216 PolarHBondContact O-N 2.98Å; S212-S216 PolarHBondContact O-OG 2.95Å
213Y91.7Very high93.4Very high118 Ų11878.8 Ų78.846%0.46341%0.408SS..Hα-helixtrans-53.6-47.7-172.9-168.9-90.6000113L205 L208 N209 T217L205-Y213 HydrophobicContact CD1-CE2 4.45Å; L205-Y213 HydrophobicContact CG-CE2 4.45Å; L208-Y213 HydrophobicContact CB-CD2 4.42Å; L208-Y213 HydrophobicContact CD2-CD2 4.19Å; N209-Y213 WeakPolarHBondContact O-CB 3.22Å; N209-Y213 PolarHBondContact O-N 3.21Å; Y213-T217 HydrophobicContact CD1-CG2 4.09Å; Y213-T217 HydrophobicContact CE1-CG2 3.79Å; Y213-T217 HydrophobicContact CE2-CG2 4.27Å; Y213-T217 HydrophobicContact CG-CG2 4.46Å; Y213-T217 WeakPolarHBondContact O-CB 3.39Å; Y213-T217 VanDerWaalsContact O-CG2 3.26Å; Y213-T217 WeakPolarHBondContact O-CG2 3.16Å; Y213-T217 PolarHBondContact O-N 2.93Å; Y213-T217 PolarHBondContact O-OG1 2.99Å
214K94Very high93.4Very high160 Ų16080.2 Ų80.270%0.69640%0.395SS*.Hα-helixtrans-64.5-43.9-177.5-175.7-176.9174.7-172.40112.1S212 T217 L218S212-K214 VanDerWaalsContact C-N 3.33Å; S212-K214 PolarHBondContact O-N 3.45Å; K214-T217 PolarHBondContact O-OG1 3.39Å; K214-L218 WeakPolarHBondContact O-CB 3.33Å; K214-L218 PolarHBondContact O-N 3.02Å; K214-L218 VanDerWaalsContact O-N 3.15Å
215D94.7Very high93.6Very high87 Ų8780.3 Ų80.347%0.46540%0.398SS..Hα-helixtrans-72.6-44.4-176-71.7-12.8000111.1P167 S212 L218 I219P167-D215 HydrophobicContact CB-CB 4.16Å; P167-D215 HydrophobicContact CG-CB 4.11Å; S212-D215 PolarHBondContact O-N 3.07Å; D215-L218 PolarHBondContact O-N 3.08Å; D215-I219 VanDerWaalsContact O-CG1 3.28Å; D215-I219 WeakPolarHBondContact O-CG1 3.42Å; D215-I219 PolarHBondContact O-N 3.34Å; D215-I219 VanDerWaalsContact O-N 3.08Å
216S96.4Very high93.8Very high0 Ų080.3 Ų80.30%040%0.398CS..Hα-helixtrans-63.6-45.3178-60.80000112.1T165 P167 S212 L218 I219 M220T165-S216 WeakPolarHBondContact O-CB 3.33Å; T165-S216 PolarHBondContact O-OG 3.01Å; P167-S216 WeakPolarHBondContact CD-OG 3.36Å; P167-S216 WeakPolarHBondContact CG-OG 3.39Å; S212-S216 PolarHBondContact O-N 2.98Å; S212-S216 PolarHBondContact O-OG 2.95Å; S216-L218 VanDerWaalsContact C-N 3.34Å; S216-L218 PolarHBondContact O-N 2.93Å; S216-I219 PolarHBondContact O-N 3.37Å; S216-M220 WeakPolarHBondContact O-CB 3.29Å; S216-M220 VanDerWaalsContact O-CG 3.24Å; S216-M220 WeakPolarHBondContact O-CG 3.47Å; S216-M220 PolarHBondContact O-N 3.32Å
217T96.6Very high94.1Very high43 Ų4373.5 Ų73.526%0.26436%0.361SS..Hα-helixtrans-65.8-36.1179.853.20000112.3L205 Y213 K214 M220 Q221L205-T217 HydrophobicContact CD1-CG2 4.17Å; Y213-T217 HydrophobicContact CD1-CG2 4.09Å; Y213-T217 HydrophobicContact CE1-CG2 3.79Å; Y213-T217 HydrophobicContact CE2-CG2 4.27Å; Y213-T217 HydrophobicContact CG-CG2 4.46Å; Y213-T217 WeakPolarHBondContact O-CB 3.39Å; Y213-T217 VanDerWaalsContact O-CG2 3.26Å; Y213-T217 WeakPolarHBondContact O-CG2 3.16Å; Y213-T217 PolarHBondContact O-N 2.93Å; Y213-T217 PolarHBondContact O-OG1 2.99Å; K214-T217 PolarHBondContact O-OG1 3.39Å; T217-M220 PolarHBondContact O-N 3.35Å; T217-Q221 WeakPolarHBondContact O-CB 3.38Å; T217-Q221 PolarHBondContact O-N 3.32Å
218L97.3Very high94.5Very high103 Ų10372.6 Ų72.654%0.53936%0.356SS..Hα-helixtrans-61.9-43.4172.2178.762.2000111.6K214 D215 S216 Q221 L222K214-L218 WeakPolarHBondContact O-CB 3.33Å; K214-L218 PolarHBondContact O-N 3.02Å; K214-L218 VanDerWaalsContact O-N 3.15Å; D215-L218 PolarHBondContact O-N 3.08Å; S216-L218 VanDerWaalsContact C-N 3.34Å; S216-L218 PolarHBondContact O-N 2.93Å; L218-Q221 WeakPolarHBondContact O-CB 3.38Å; L218-Q221 PolarHBondContact O-N 3.29Å; L218-L222 WeakPolarHBondContact O-CG 3.4Å; L218-L222 PolarHBondContact O-N 3.17Å; L218-L222 VanDerWaalsContact O-N 3.14Å
219I98.1Very high94.9Very high29 Ų2975.1 Ų75.115%0.14937%0.369CS..Hα-helixtrans-69.9-39.7179.1-61.4164.1000111.2P167 L170 L174 D215 S216 Q221 L222 L223P167-I219 HydrophobicContact CB-CD1 4.16Å; P167-I219 VanDerWaalsContact O-CD1 3.3Å; P167-I219 WeakPolarHBondContact O-CD1 3.41Å; L170-I219 HydrophobicContact CB-CB 4.18Å; L170-I219 HydrophobicContact CB-CD1 4.46Å; L170-I219 HydrophobicContact CB-CG2 3.65Å; L174-I219 HydrophobicContact CB-CG2 4.29Å; L174-I219 HydrophobicContact CD2-CG2 4.18Å; D215-I219 VanDerWaalsContact O-CG1 3.28Å; D215-I219 WeakPolarHBondContact O-CG1 3.42Å; D215-I219 PolarHBondContact O-N 3.34Å; D215-I219 VanDerWaalsContact O-N 3.08Å; S216-I219 PolarHBondContact O-N 3.37Å; I219-Q221 VanDerWaalsContact C-N 3.27Å; I219-Q221 PolarHBondContact O-N 3.48Å; I219-L222 WeakPolarHBondContact O-CB 3.3Å; I219-L222 PolarHBondContact O-N 2.64Å; I219-L222 VanDerWaalsContact O-N 3.17Å; I219-L223 PolarHBondContact O-N 3.13Å
220M98.1Very high95.3Very high10 Ų1071.2 Ų71.25%0.04935%0.348CS..Hα-helixtrans-60.4-38.8174.1-70.4170.272.400111.7L170 F198 A201 I202 L205 S216 T217 L223 R224L170-M220 HydrophobicContact CD1-CG 3.93Å; L170-M220 HydrophobicContact CD1-SD 4.37Å; L170-M220 HydrophobicContact CD2-CG 4.1Å; F198-M220 HydrophobicContact CD2-CB 4.08Å; F198-M220 WeakPolarHBondContact CD2-O 3.4Å; F198-M220 HydrophobicContact CE2-CB 4.08Å; F198-M220 WeakPolarHBondContact CE2-O 3.44Å; A201-M220 HydrophobicContact CB-CE 3.86Å; A201-M220 HydrophobicContact CB-CG 4.3Å; A201-M220 HydrophobicContact CB-SD 3.91Å; I202-M220 HydrophobicContact CB-CE 4.37Å; I202-M220 HydrophobicContact CG1-CE 3.46Å; I202-M220 VanDerWaalsContact CG1-CE 3.46Å; L205-M220 HydrophobicContact CD1-CE 4.38Å; L205-M220 HydrophobicContact CD1-SD 3.93Å; L205-M220 HydrophobicContact CD2-CE 4.44Å; S216-M220 WeakPolarHBondContact O-CB 3.29Å; S216-M220 VanDerWaalsContact O-CG 3.24Å; S216-M220 WeakPolarHBondContact O-CG 3.47Å; S216-M220 PolarHBondContact O-N 3.32Å; T217-M220 PolarHBondContact O-N 3.35Å; M220-L223 WeakPolarHBondContact O-CB 3.49Å; M220-L223 PolarHBondContact O-N 3.13Å; M220-R224 PolarHBondContact O-N 3.36Å
221Q98.1Very high95.6Very high62 Ų6265.1 Ų65.129%0.2932%0.323SS..Hα-helixtrans-60.1-46.2173.4177.355.639.100111.5T217 L218 I219 L223 R224 D225T217-Q221 WeakPolarHBondContact O-CB 3.38Å; T217-Q221 PolarHBondContact O-N 3.32Å; L218-Q221 WeakPolarHBondContact O-CB 3.38Å; L218-Q221 PolarHBondContact O-N 3.29Å; I219-Q221 VanDerWaalsContact C-N 3.27Å; I219-Q221 PolarHBondContact O-N 3.48Å; Q221-L223 PolarHBondContact O-N 3.48Å; Q221-R224 WeakPolarHBondContact O-CB 3.48Å; Q221-R224 PolarHBondContact O-N 3.12Å; Q221-D225 PolarHBondContact NE2-OD1 2.93Å; Q221-D225 PolarHBondContact NE2-OD2 2.92Å; Q221-D225 PolarHBondContact O-N 3.2Å
222L98.4Very high95.9Very high75 Ų7560.1 Ų60.139%0.39331%0.307SS..Hα-helixtrans-63.1-39.6176.6-65.5171.7000112.7L174 L218 I219 R224 D225 N226L174-L222 HydrophobicContact CD1-CB 4.1Å; L174-L222 HydrophobicContact CD2-CB 3.93Å; L174-L222 HydrophobicContact CD2-CD1 3.92Å; L218-L222 WeakPolarHBondContact O-CG 3.4Å; L218-L222 PolarHBondContact O-N 3.17Å; L218-L222 VanDerWaalsContact O-N 3.14Å; I219-L222 WeakPolarHBondContact O-CB 3.3Å; I219-L222 PolarHBondContact O-N 2.64Å; I219-L222 VanDerWaalsContact O-N 3.17Å; L222-R224 VanDerWaalsContact C-N 3.35Å; L222-D225 PolarHBondContact O-N 3.08Å; L222-N226 PolarHBondContact O-N 3.35Å
223L98.5Very high95.7Very high0 Ų062.8 Ų62.80%032%0.316CS..Hα-helixtrans-59.5-45.7173.9-78.3167.7000111.5L170 L174 A194 A197 F198 I219 M220 Q221 N226 L227L170-L223 HydrophobicContact CD2-CD1 3.99Å; L174-L223 HydrophobicContact CB-CD2 3.92Å; L174-L223 HydrophobicContact CB-CG 4.23Å; L174-L223 HydrophobicContact CD1-CD2 3.96Å; L174-L223 HydrophobicContact CD1-CG 4.17Å; A194-L223 HydrophobicContact CB-CD2 3.85Å; A197-L223 HydrophobicContact CB-CD1 4.36Å; F198-L223 HydrophobicContact CD2-CB 4.43Å; I219-L223 PolarHBondContact O-N 3.13Å; M220-L223 WeakPolarHBondContact O-CB 3.49Å; M220-L223 PolarHBondContact O-N 3.13Å; Q221-L223 PolarHBondContact O-N 3.48Å; L223-N226 PolarHBondContact O-N 2.87Å; L223-L227 WeakPolarHBondContact O-CG 3.49Å; L223-L227 PolarHBondContact O-N 2.68Å
224R97.9Very high95Very high116 Ų11659.7 Ų59.744%0.43831%0.308SS..Hα-helixtrans-62.9-41.5177.3-171.8-17274.3-171.46.2112.3F198 M220 Q221 L222 L227 T228F198-R224 HydrophobicContact CD2-CB 4.4Å; F198-R224 HydrophobicContact CE2-CB 3.85Å; F198-R224 HydrophobicContact CE2-CG 4.47Å; F198-R224 HydrophobicContact CZ-CB 4.16Å; F198-R224 HydrophobicContact CZ-CG 4.27Å; M220-R224 PolarHBondContact O-N 3.36Å; Q221-R224 WeakPolarHBondContact O-CB 3.48Å; Q221-R224 PolarHBondContact O-N 3.12Å; L222-R224 VanDerWaalsContact C-N 3.35Å; R224-L227 PolarHBondContact O-N 3.21Å; R224-T228 PolarHBondContact O-N 2.72Å; R224-T228 PolarHBondContact O-OG1 3.12Å
225D98.1Very high94Very high67 Ų6758.5 Ų58.536%0.35831%0.305SS..Hα-helixtrans-66.9-41.6-179.2-65.1-12.9000110.6Q221 L222 T228 L229Q221-D225 PolarHBondContact NE2-OD1 2.93Å; Q221-D225 PolarHBondContact NE2-OD2 2.92Å; Q221-D225 PolarHBondContact O-N 3.2Å; L222-D225 PolarHBondContact O-N 3.08Å; D225-T228 PolarHBondContact O-N 2.87Å; D225-L229 PolarHBondContact O-N 3.46Å
226N97.4Very high92.3Very high36 Ų3656.8 Ų56.819%0.19331%0.307CS..Hα-helixtrans-61.1-46172.2-78.61.4000112.4L174 L222 L223 T228 L229 W230L174-N226 VanDerWaalsContact CD1-ND2 3.33Å; L174-N226 WeakPolarHBondContact CD1-ND2 3.19Å; L222-N226 PolarHBondContact O-N 3.35Å; L223-N226 PolarHBondContact O-N 2.87Å; N226-T228 VanDerWaalsContact C-N 3.28Å; N226-T228 PolarHBondContact O-N 3.33Å; N226-L229 PolarHBondContact O-N 3.12Å; N226-W230 HydrophobicContact CB-CD2 4.19Å; N226-W230 HydrophobicContact CB-CE3 4.08Å; N226-W230 HydrophobicContact CB-CH2 3.67Å; N226-W230 HydrophobicContact CB-CZ2 3.77Å; N226-W230 HydrophobicContact CB-CZ3 3.82Å; N226-W230 WeakPolarHBondContact ND2-CH2 2.87Å; N226-W230 WeakPolarHBondContact O-CB 3.49Å; N226-W230 VanDerWaalsContact O-CD2 3.26Å; N226-W230 PolarHBondContact O-N 3.05Å
227L97.3Very high90.2Very high24 Ų2463.5 Ų63.513%0.12634%0.343CS..Hα-helixtrans-57.4-42.9176.1-77.3167.4000111.7C191 A194 K195 L223 R224 T231C191-L227 HydrophobicContact CB-CD2 4.06Å; C191-L227 WeakPolarHBondContact O-CD2 2.96Å; A194-L227 HydrophobicContact CB-CD1 4.29Å; A194-L227 HydrophobicContact CB-CD2 3.84Å; A194-L227 HydrophobicContact CB-CG 3.9Å; K195-L227 HydrophobicContact CB-CD1 4.2Å; K195-L227 HydrophobicContact CB-CD2 4.09Å; L223-L227 WeakPolarHBondContact O-CG 3.49Å; L223-L227 PolarHBondContact O-N 2.68Å; R224-L227 PolarHBondContact O-N 3.21Å; L227-T231 VanDerWaalsContact O-CB 3.31Å; L227-T231 WeakPolarHBondContact O-CB 3.41Å; L227-T231 WeakPolarHBondContact O-CG2 3.25Å; L227-T231 PolarHBondContact O-N 2.89Å; L227-T231 PolarHBondContact O-OG1 3.31Å
228T96.7Very high88Confident84 Ų8469 Ų6952%0.51537%0.366SS..Hα-helixtrans-63.6-46.1178.6-54.80000110.9R224 D225 N226 T231 S232R224-T228 PolarHBondContact O-N 2.72Å; R224-T228 PolarHBondContact O-OG1 3.12Å; D225-T228 PolarHBondContact O-N 2.87Å; N226-T228 VanDerWaalsContact C-N 3.28Å; N226-T228 PolarHBondContact O-N 3.33Å; T228-T231 PolarHBondContact O-OG1 3.45Å; T228-S232 WeakPolarHBondContact O-CB 3.43Å; T228-S232 PolarHBondContact O-N 3.26Å; T228-S232 VanDerWaalsContact O-N 3.17Å; T228-S232 PolarHBondContact O-OG 3.22Å
229L95.6Very high85.3Confident84 Ų8467 Ų6744%0.4437%0.37SS..Hα-helixtrans-60.1-56.8178.3-179.465.2000111.3D225 N226 T231 S232 E233D225-L229 PolarHBondContact O-N 3.46Å; N226-L229 PolarHBondContact O-N 3.12Å; L229-T231 PolarHBondContact O-N 3.17Å; L229-S232 PolarHBondContact O-N 3.45Å; L229-S232 VanDerWaalsContact O-N 3.13Å; L229-S232 PolarHBondContact O-OG 3.03Å; L229-E233 HydrophobicContact CD1-CG 4.5Å; L229-E233 PolarHBondContact O-N 2.81Å
230W96.2Very high82.7Confident8 Ų873.2 Ų73.23%0.0340%0.403CS..Hα-helixtrans-66.7-34.9-173.7-57.4-27.7000113.1S177 V178 Y181 A190 A194 N226 S232 N234S177-W230 WeakPolarHBondContact OG-CH2 3.48Å; V178-W230 HydrophobicContact CG2-CH2 4.04Å; V178-W230 HydrophobicContact CG2-CZ2 4.02Å; Y181-W230 AromaticContact CD1-CD1 3.77Å; Y181-W230 AromaticContact CD1-CE2 3.93Å; Y181-W230 HydrophobicContact CD1-CG 4.48Å; Y181-W230 HydrophobicContact CD1-CZ2 4.46Å; Y181-W230 AromaticContact CD1-NE1 3.38Å; Y181-W230 HydrophobicContact CD2-CB 4.11Å; Y181-W230 AromaticContact CD2-CD1 3.63Å; Y181-W230 AromaticContact CD2-CD2 3.73Å; Y181-W230 HydrophobicContact CD2-CD2 3.73Å; Y181-W230 AromaticContact CD2-CE2 3.89Å; Y181-W230 HydrophobicContact CD2-CE3 4.41Å; Y181-W230 AromaticContact CD2-CG 3.57Å; Y181-W230 HydrophobicContact CD2-CG 3.57Å; Y181-W230 AromaticContact CD2-NE1 3.81Å; Y181-W230 AromaticContact CE1-CD1 3.45Å; Y181-W230 VanDerWaalsContact CE1-CD1 3.45Å; Y181-W230 HydrophobicContact CE1-CG 4.33Å; Y181-W230 AromaticContact CE1-NE1 3.49Å; Y181-W230 HydrophobicContact CE2-CB 3.67Å; Y181-W230 AromaticContact CE2-CD1 3.33Å; Y181-W230 HydrophobicContact CE2-CD2 4.12Å; Y181-W230 AromaticContact CE2-CG 3.43Å; Y181-W230 HydrophobicContact CE2-CG 3.43Å; Y181-W230 VanDerWaalsContact CE2-CG 3.43Å; Y181-W230 AromaticContact CE2-NE1 3.94Å; Y181-W230 AromaticContact CG-CD1 3.85Å; Y181-W230 HydrophobicContact CG-CD2 4.01Å; Y181-W230 AromaticContact CG-CE2 3.65Å; Y181-W230 HydrophobicContact CG-CG 4.12Å; Y181-W230 HydrophobicContact CG-CZ2 4.12Å; Y181-W230 AromaticContact CG-NE1 3.56Å; Y181-W230 AromaticContact CZ-CD1 3.24Å; Y181-W230 AromaticContact CZ-CG 3.85Å; Y181-W230 AromaticContact CZ-NE1 3.79Å; A190-W230 HydrophobicContact CB-CE3 4.13Å; A190-W230 HydrophobicContact CB-CZ3 3.98Å; A194-W230 HydrophobicContact CB-CZ3 4.35Å; N226-W230 HydrophobicContact CB-CD2 4.19Å; N226-W230 HydrophobicContact CB-CE3 4.08Å; N226-W230 HydrophobicContact CB-CH2 3.67Å; N226-W230 HydrophobicContact CB-CZ2 3.77Å; N226-W230 HydrophobicContact CB-CZ3 3.82Å; N226-W230 WeakPolarHBondContact ND2-CH2 2.87Å; N226-W230 WeakPolarHBondContact O-CB 3.49Å; N226-W230 VanDerWaalsContact O-CD2 3.26Å; N226-W230 PolarHBondContact O-N 3.05Å; W230-S232 VanDerWaalsContact C-N 3.34Å; W230-N234 WeakPolarHBondContact O-CB 3.41Å; W230-N234 PolarHBondContact O-N 2.94Å; W230-N234 VanDerWaalsContact O-N 3.08Å; W230-N234 PolarHBondContact O-OD1 3.02Å
231T92.3Very high79.9Confident60 Ų6077.2 Ų77.237%0.36844%0.438SS..Hα-helixtrans-72.1-28.2175.755.10000112.9L227 T228 L229 Q235L227-T231 VanDerWaalsContact O-CB 3.31Å; L227-T231 WeakPolarHBondContact O-CB 3.41Å; L227-T231 WeakPolarHBondContact O-CG2 3.25Å; L227-T231 PolarHBondContact O-N 2.89Å; L227-T231 PolarHBondContact O-OG1 3.31Å; T228-T231 PolarHBondContact O-OG1 3.45Å; L229-T231 PolarHBondContact O-N 3.17Å; T231-Q235 WeakPolarHBondContact O-CG 3.35Å; T231-Q235 PolarHBondContact O-N 3.24Å; T231-Q235 PolarHBondContact O-NE2 3.45Å
232S90.9Very high76.9Confident66 Ų6677.2 Ų77.246%0.46245%0.454SS..Hα-helixtrans-74.5-38173.973.10000112.7T228 L229 W230 Q235 G236T228-S232 WeakPolarHBondContact O-CB 3.43Å; T228-S232 PolarHBondContact O-N 3.26Å; T228-S232 VanDerWaalsContact O-N 3.17Å; T228-S232 PolarHBondContact O-OG 3.22Å; L229-S232 PolarHBondContact O-N 3.45Å; L229-S232 VanDerWaalsContact O-N 3.13Å; L229-S232 PolarHBondContact O-OG 3.03Å; W230-S232 VanDerWaalsContact C-N 3.34Å; S232-Q235 PolarHBondContact O-N 2.91Å; S232-G236 PolarHBondContact O-N 3.05Å
233E85.5Confident74.1Confident87 Ų8783.1 Ų83.141%0.40748%0.48SS..Hα-helixtrans-66.5-44.6176.7-70.5178.3168.800110.7Y181 L229 Q235 G236 D237Y181-E233 PolarHBondContact OH-OE2 3.09Å; L229-E233 HydrophobicContact CD1-CG 4.5Å; L229-E233 PolarHBondContact O-N 2.81Å; E233-Q235 VanDerWaalsContact C-N 3.34Å; E233-Q235 PolarHBondContact O-N 3.3Å; E233-G236 PolarHBondContact O-N 3.42Å; E233-D237 PolarHBondContact O-N 2.99Å
234N77.5Confident71Confident53 Ų5386.8 Ų86.828%0.28352%0.518SS..Hα-helixtrans-64.9-30.9177-83.445.4000114.1W230W230-N234 WeakPolarHBondContact O-CB 3.41Å; W230-N234 PolarHBondContact O-N 2.94Å; W230-N234 VanDerWaalsContact O-N 3.08Å; W230-N234 PolarHBondContact O-OD1 3.02Å
235Q72.7Confident68.4Low135 Ų13590.7 Ų90.763%0.63154%0.541SS*.Hα-helixtrans-74.7-28.2175.5-76.7172.748.700112.7T231 S232 E233T231-Q235 WeakPolarHBondContact O-CG 3.35Å; T231-Q235 PolarHBondContact O-N 3.24Å; T231-Q235 PolarHBondContact O-NE2 3.45Å; S232-Q235 PolarHBondContact O-N 2.91Å; E233-Q235 VanDerWaalsContact C-N 3.34Å; E233-Q235 PolarHBondContact O-N 3.3Å
236G58.4Low65.6Low50 Ų5099.2 Ų99.252%0.51559%0.587SS.*Hα-helixtrans-66.3-37.3175.600000112.7S232 E233 G239S232-G236 PolarHBondContact O-N 3.05Å; E233-G236 PolarHBondContact O-N 3.42Å; G236-G239 PolarHBondContact O-N 2.84Å
237D53.7Low64Low141 Ų141102.4 Ų102.475%0.75461%0.606SS**Hα-helixtrans-74.2-24.3179-76-15.2000113.2E233 G239E233-D237 PolarHBondContact O-N 2.99Å; D237-G239 VanDerWaalsContact C-N 3.31Å
238E48.8Very low62.2Low160 Ų160106.5 Ų106.575%0.74863%0.632SS**Hα-helixtrans-77.4-16.3172.2-70.8-174171.500113
239G42.2Very low60.3Low60 Ų60107.7 Ų107.762%0.61964%0.638SS**THydrogen-bonded Turntrans-79.4-15.3-176.600000115.8G236 D237G236-G239 PolarHBondContact O-N 2.84Å; D237-G239 VanDerWaalsContact C-N 3.31Å
240D42.5Very low58.2Low159 Ų159109.1 Ų109.185%0.8565%0.65SS**THydrogen-bonded Turntrans-99.911.9-176.8-144.715.9000113.5
241A40.2Very low55.9Low95 Ų95115.4 Ų115.479%0.78569%0.688SS**SBendtrans-105.126.2176.400000113.5
242G34.6Very low53.4Low61 Ų61119.1 Ų119.163%0.62971%0.71SS**  trans-146.537.9-163.400000118
243E39.9Very low50.7Low199 Ų199122.9 Ų122.993%0.9373%0.728SS**  trans-132.273.6156.2-73.8-166.6-178.900110.7
244G32.9Very low48.1Very low77 Ų77125.7 Ų125.779%0.79475%0.752SS**  trans-98.4106.8147.900000108.3
245E42.4Very low45.6Very low198 Ų198131.8 Ų131.893%0.92579%0.791SS**  trans-130.2136.9154-76.5-164.8159.700109.1
246N39.2Very low43.2Very low246 Ų246131.5 Ų131.5100%1.31681%0.806SS**  trans-59.20-169.2-65-56.9000114.9

Retrieved 246 of 246 residues in 2228.8 ms (Link to these results)

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