1433B_RAT Loading...

14-3-3 protein beta/alpha

Adapter protein implicated in the regulation of a large spectrum of both general and specialized signaling pathways. Binds to a large number of partners, usually by recognition of a phosphoserine or phosphothreonine motif. Binding generally results in the modulation of the activity of the binding partner. Negative regulator of osteogenesis. Blocks the nuclear translocation of the phosphorylated form (by AKT1) of SRPK2 and antagonizes its stimulatory effect on cyclin D1 expression resulting in blockage of neuronal apoptosis elicited by SRPK2. Negative regulator of signaling cascades that mediate activation of MAP kinases via AKAP13.

AlphaFold DB , UniProt , Accession P35213, Species RAT (Rattus norvegicus, Rat), 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
1M53.1Low89.4Confident241 Ų24191.6 Ų91.6100%1.18748%0.477SS*.  01230-79.7172.5164.500106.7
2T76.1Confident90.1Very high146 Ų14684 Ų8490%0.89644%0.437SS*.PPolyproline II helixtrans-71.4124.8170.2-320000106.6
3M81.7Confident90.8Very high75 Ų7581.3 Ų81.337%0.36942%0.42SS..PPolyproline II helixtrans-60.8140.3177.9-69.6176.869.800109.6E7 L8 K11M3-E7 VanDerWaalsContact CA-OE2 3.3Å; M3-E7 WeakPolarHBondContact CA-OE2 3.3Å; M3-E7 HydrophobicContact CB-CB 4.27Å; M3-E7 HydrophobicContact CE-CB 3.68Å; M3-L8 HydrophobicContact CB-CD2 4Å; M3-L8 HydrophobicContact CB-CG 3.91Å; M3-L8 HydrophobicContact CE-CD2 4.24Å; M3-L8 HydrophobicContact SD-CD2 4.05Å; M3-K11 HydrophobicContact CE-CB 4.33Å; M3-K11 HydrophobicContact CE-CD 4.15Å; M3-K11 HydrophobicContact SD-CD 4.42Å
4D92.5Very high91.3Very high87 Ų8782.4 Ų82.447%0.46543%0.426SS..PPolyproline II helixtrans-76.6170.3174.776.630.9000111.8S6 E7 L8D4-S6 VanDerWaalsContact C-N 3.27Å; D4-S6 PolarHBondContact O-N 3.12Å; D4-S6 WeakPolarHBondContact OD1-CA 3.39Å; D4-S6 WeakPolarHBondContact OD1-CB 3.4Å; D4-S6 PolarHBondContact OD1-N 2.64Å; D4-E7 PolarHBondContact N-OE2 3.32Å; D4-E7 PolarHBondContact O-N 2.95Å; D4-E7 WeakPolarHBondContact OD1-CG 3.41Å; D4-E7 PolarHBondContact OD1-N 3.5Å; D4-L8 WeakPolarHBondContact O-CG 3.47Å; D4-L8 PolarHBondContact O-N 2.86Å
5K95.1Very high91.8Very high50 Ų5077.5 Ų77.522%0.21740%0.402CS..Hα-helixtrans-54.9-42.8179.6-160.4-169.4-168.9-157.20112.2L8 V9 V31 E42K5-L8 PolarHBondContact O-N 3.23Å; K5-V9 VanDerWaalsContact O-CG2 3.3Å; K5-V9 WeakPolarHBondContact O-CG2 3.4Å; K5-V9 PolarHBondContact O-N 3.08Å; K5-V31 HydrophobicContact CG-CG1 3.93Å; K5-E42 WeakPolarHBondContact CE-OE1 3.31Å; K5-E42 IonicContact NZ-OE1 2.75Å; K5-E42 PolarHBondContact NZ-OE1 3.01Å; K5-E42 IonicContact NZ-OE2 3.85Å; K5-E42 PolarHBondContact NZ-OE2 2.96Å
6S95.7Very high92.2Very high90 Ų9077.1 Ų77.163%0.62940%0.398SS*.Hα-helixtrans-70.1-40.1-175.1-168.90000111.5D4 V9 Q10D4-S6 VanDerWaalsContact C-N 3.27Å; D4-S6 PolarHBondContact O-N 3.12Å; D4-S6 WeakPolarHBondContact OD1-CA 3.39Å; D4-S6 WeakPolarHBondContact OD1-CB 3.4Å; D4-S6 PolarHBondContact OD1-N 2.64Å; S6-V9 PolarHBondContact O-N 3.37Å; S6-Q10 WeakPolarHBondContact O-CB 3.41Å; S6-Q10 PolarHBondContact O-N 2.82Å
7E96.8Very high92.5Very high100 Ų10081.7 Ų81.747%0.46742%0.417SS..Hα-helixtrans-64.1-41.2175.1-68.8-179150.300111.4M3 D4 Q10 K11M3-E7 VanDerWaalsContact CA-OE2 3.3Å; M3-E7 WeakPolarHBondContact CA-OE2 3.3Å; M3-E7 HydrophobicContact CB-CB 4.27Å; M3-E7 HydrophobicContact CE-CB 3.68Å; D4-E7 PolarHBondContact N-OE2 3.32Å; D4-E7 PolarHBondContact O-N 2.95Å; D4-E7 WeakPolarHBondContact OD1-CG 3.41Å; D4-E7 PolarHBondContact OD1-N 3.5Å; E7-Q10 PolarHBondContact O-N 3.38Å; E7-K11 WeakPolarHBondContact O-CB 3.03Å; E7-K11 PolarHBondContact O-N 3.15Å
8L97.7Very high92.8Very high14 Ų1480.6 Ų80.67%0.07342%0.423CS..Hα-helixtrans-66-43.8176.7-72.2170.5000112.3M3 D4 K5 Q10 K11 A12 A30 V31M3-L8 HydrophobicContact CB-CD2 4Å; M3-L8 HydrophobicContact CB-CG 3.91Å; M3-L8 HydrophobicContact CE-CD2 4.24Å; M3-L8 HydrophobicContact SD-CD2 4.05Å; D4-L8 WeakPolarHBondContact O-CG 3.47Å; D4-L8 PolarHBondContact O-N 2.86Å; K5-L8 PolarHBondContact O-N 3.23Å; L8-Q10 VanDerWaalsContact C-N 3.32Å; L8-Q10 PolarHBondContact O-N 3.36Å; L8-K11 WeakPolarHBondContact O-CB 3.49Å; L8-K11 PolarHBondContact O-N 3.45Å; L8-A12 PolarHBondContact O-N 3.27Å; L8-A30 HydrophobicContact CD1-CB 3.74Å; L8-A30 HydrophobicContact CD2-CB 4.05Å; L8-V31 HydrophobicContact CB-CG2 3.43Å; L8-V31 VanDerWaalsContact CB-CG2 3.43Å; L8-V31 HydrophobicContact CD1-CG2 4.07Å; L8-V31 HydrophobicContact CG-CG2 4.4Å
9V98.2Very high93.1Very high12 Ų1284 Ų847%0.07344%0.436CS..Hα-helixtrans-62.4-41.9175.1170.50000110.6K5 S6 K11 A12 K13 V31 E42 L45K5-V9 VanDerWaalsContact O-CG2 3.3Å; K5-V9 WeakPolarHBondContact O-CG2 3.4Å; K5-V9 PolarHBondContact O-N 3.08Å; S6-V9 PolarHBondContact O-N 3.37Å; V9-K11 VanDerWaalsContact C-N 3.33Å; V9-K11 PolarHBondContact O-N 3.42Å; V9-A12 WeakPolarHBondContact O-CB 3.37Å; V9-A12 PolarHBondContact O-N 3.25Å; V9-K13 HydrophobicContact CG1-CD 4.4Å; V9-K13 WeakPolarHBondContact O-CG 3.39Å; V9-K13 PolarHBondContact O-N 3.19Å; V9-V31 HydrophobicContact CG2-CG1 4.34Å; V9-V31 HydrophobicContact CG2-CG2 3.92Å; V9-E42 HydrophobicContact CG2-CG 3.88Å; V9-L45 HydrophobicContact CG1-CD1 3.97Å
10Q98.1Very high93.4Very high97 Ų9787 Ų8745%0.45344%0.441SS..Hα-helixtrans-63.5-39.7175.7-174.658.925.300111.9S6 E7 L8 K13 L14S6-Q10 WeakPolarHBondContact O-CB 3.41Å; S6-Q10 PolarHBondContact O-N 2.82Å; E7-Q10 PolarHBondContact O-N 3.38Å; L8-Q10 VanDerWaalsContact C-N 3.32Å; L8-Q10 PolarHBondContact O-N 3.36Å; Q10-K13 PolarHBondContact O-N 2.9Å; Q10-L14 WeakPolarHBondContact O-CG 3.44Å; Q10-L14 PolarHBondContact O-N 3.48Å
11K98Very high93.6Very high96 Ų9685.4 Ų85.442%0.41743%0.431SS..Hα-helixtrans-62-41.7173.6-176.8179.7176.3-175.90111.8M3 E7 L8 V9 L14 A15 A27M3-K11 HydrophobicContact CE-CB 4.33Å; M3-K11 HydrophobicContact CE-CD 4.15Å; M3-K11 HydrophobicContact SD-CD 4.42Å; E7-K11 WeakPolarHBondContact O-CB 3.03Å; E7-K11 PolarHBondContact O-N 3.15Å; L8-K11 WeakPolarHBondContact O-CB 3.49Å; L8-K11 PolarHBondContact O-N 3.45Å; V9-K11 VanDerWaalsContact C-N 3.33Å; V9-K11 PolarHBondContact O-N 3.42Å; K11-L14 PolarHBondContact O-N 3.34Å; K11-A15 WeakPolarHBondContact O-CB 3.48Å; K11-A15 PolarHBondContact O-N 3Å; K11-A27 HydrophobicContact CB-CB 4.49Å; K11-A27 HydrophobicContact CD-CB 4.41Å; K11-A27 HydrophobicContact CG-CB 4.4Å
12A98.5Very high95.7Very high0 Ų077.9 Ų77.90%040%0.395CS..Hα-helixtrans-61.8-43.5175.700000111.8L8 V9 L14 A15 E16 M24 A27 M28L8-A12 PolarHBondContact O-N 3.27Å; V9-A12 WeakPolarHBondContact O-CB 3.37Å; V9-A12 PolarHBondContact O-N 3.25Å; A12-L14 PolarHBondContact O-N 3.45Å; A12-A15 WeakPolarHBondContact O-CB 3.26Å; A12-A15 PolarHBondContact O-N 3.21Å; A12-E16 PolarHBondContact O-N 3.45Å; A12-M24 HydrophobicContact CB-CG 4.07Å; A12-A27 HydrophobicContact CB-CB 4.03Å; A12-M28 HydrophobicContact CB-CG 3.78Å; A12-M28 HydrophobicContact CB-SD 3.57Å; A12-M28 VanDerWaalsContact CB-SD 3.57Å
13K98.5Very high96.8Very high49 Ų4973.4 Ų73.421%0.21337%0.366CS..Hα-helixtrans-62.2-40.5175.5-69.8175.5177.4-176.90112.8V9 Q10 E16 Q17 E41 L45V9-K13 HydrophobicContact CG1-CD 4.4Å; V9-K13 WeakPolarHBondContact O-CG 3.39Å; V9-K13 PolarHBondContact O-N 3.19Å; Q10-K13 PolarHBondContact O-N 2.9Å; K13-E16 PolarHBondContact O-N 3.22Å; K13-Q17 WeakPolarHBondContact O-CG 3.44Å; K13-Q17 PolarHBondContact O-N 2.82Å; K13-Q17 VanDerWaalsContact O-N 3.15Å; K13-E41 WeakPolarHBondContact CE-OE1 3.37Å; K13-E41 IonicContact NZ-OE1 2.64Å; K13-E41 PolarHBondContact NZ-OE1 2.92Å; K13-E41 IonicContact NZ-OE2 3.12Å; K13-E41 PolarHBondContact NZ-OE2 3Å; K13-E41 VanDerWaalsContact NZ-OE2 3.12Å; K13-L45 HydrophobicContact CG-CD1 4.06Å; K13-L45 HydrophobicContact CG-CD2 4.2Å
14L98.5Very high97.6Very high97 Ų9769.9 Ų69.951%0.50835%0.348SS..Hα-helixtrans-65.9-40.1174.4-70.6171.4000111.7Q10 K11 A12 Q17 A18Q10-L14 WeakPolarHBondContact O-CG 3.44Å; Q10-L14 PolarHBondContact O-N 3.48Å; K11-L14 PolarHBondContact O-N 3.34Å; A12-L14 PolarHBondContact O-N 3.45Å; L14-Q17 PolarHBondContact O-N 2.8Å; L14-A18 PolarHBondContact O-N 3.34Å
15A98.5Very high97.9Very high8 Ų866 Ų667%0.06633%0.329CS..Hα-helixtrans-65.5-39.2176.300000112K11 A12 A18 E19 R20 D23 M24K11-A15 WeakPolarHBondContact O-CB 3.48Å; K11-A15 PolarHBondContact O-N 3Å; A12-A15 WeakPolarHBondContact O-CB 3.26Å; A12-A15 PolarHBondContact O-N 3.21Å; A15-A18 CarbonylContact O-C 3.51Å; A15-A18 PolarHBondContact O-N 2.76Å; A15-E19 PolarHBondContact O-N 2.91Å; A15-E19 VanDerWaalsContact O-N 3.07Å; A15-R20 HydrophobicContact CB-CB 4.42Å; A15-R20 PolarHBondContact O-N 2.91Å; A15-D23 HydrophobicContact CB-CB 3.96Å; A15-M24 HydrophobicContact CB-CB 3.91Å
16E98.3Very high98Very high71 Ų7166.5 Ų66.533%0.33234%0.342SS..Hα-helixtrans-59.1-48.8173.7-177.1-179.4-151.700111.7A12 K13 A18 E19 M24 L45A12-E16 PolarHBondContact O-N 3.45Å; K13-E16 PolarHBondContact O-N 3.22Å; E16-A18 PolarHBondContact O-N 2.86Å; E16-E19 PolarHBondContact O-N 3.23Å; E16-M24 HydrophobicContact CB-CE 3.94Å; E16-M24 HydrophobicContact CB-SD 3.92Å; E16-M24 HydrophobicContact CG-CE 4.16Å; E16-M24 HydrophobicContact CG-SD 4.34Å; E16-L45 WeakPolarHBondContact OE2-CD2 2.95Å
17Q97.9Very high98.2Very high156 Ų15662.3 Ų62.373%0.72931%0.312SS*.Hα-helixtrans-62.6-25.6177.8-70.1175.529.400113.3K13 L14K13-Q17 WeakPolarHBondContact O-CG 3.44Å; K13-Q17 PolarHBondContact O-N 2.82Å; K13-Q17 VanDerWaalsContact O-N 3.15Å; L14-Q17 PolarHBondContact O-N 2.8Å
18A98Very high98.2Very high62 Ų6257.5 Ų57.551%0.51229%0.29SS..THydrogen-bonded Turntrans-94.85.4175.900000113.2L14 A15 E16 R20L14-A18 PolarHBondContact O-N 3.34Å; A15-A18 CarbonylContact O-C 3.51Å; A15-A18 PolarHBondContact O-N 2.76Å; E16-A18 PolarHBondContact O-N 2.86Å; A18-R20 HydrophobicContact CB-CG 4.12Å; A18-R20 PolarHBondContact O-N 3.48Å; A18-R20 VanDerWaalsContact O-N 3.1Å
19E97.8Very high98.3Very high145 Ų14559.1 Ų59.168%0.67830%0.296SS*.THydrogen-bonded Turntrans53.627.5-175.4-57.1-176159.800113.6A15 E16 Y21A15-E19 PolarHBondContact O-N 2.91Å; A15-E19 VanDerWaalsContact O-N 3.07Å; E16-E19 PolarHBondContact O-N 3.23Å; E19-Y21 HydrophobicContact CB-CE2 4.02Å; E19-Y21 WeakPolarHBondContact O-CD2 3.45Å; E19-Y21 PolarHBondContact O-N 3.39Å
20R98.3Very high98.3Very high143 Ų14360.1 Ų60.154%0.5431%0.306SS..  trans-92.369.2177.9-66.9-159.863.5-177.2-12.9110.6A15 A18 D22 D23 M24A15-R20 HydrophobicContact CB-CB 4.42Å; A15-R20 PolarHBondContact O-N 2.91Å; A18-R20 HydrophobicContact CB-CG 4.12Å; A18-R20 PolarHBondContact O-N 3.48Å; A18-R20 VanDerWaalsContact O-N 3.1Å; R20-D22 VanDerWaalsContact C-N 3.3Å; R20-D22 PolarHBondContact O-N 2.99Å; R20-D23 HydrophobicContact CB-CB 4.16Å; R20-D23 IonicContact CZ-OD1 2.84Å; R20-D23 IonicContact CZ-OD2 3.7Å; R20-D23 IonicContact NE-OD1 2.79Å; R20-D23 IonicContact NE-OD2 3.79Å; R20-D23 PolarHBondContact NE-OD2 3.23Å; R20-D23 IonicContact NH1-OD2 3.29Å; R20-D23 PolarHBondContact NH1-OD2 3.06Å; R20-D23 VanDerWaalsContact NH2-CG 3.31Å; R20-D23 IonicContact NH2-OD1 3.33Å; R20-D23 PolarHBondContact NH2-OD1 2.65Å; R20-D23 IonicContact NH2-OD2 3.84Å; R20-D23 PolarHBondContact NH2-OD2 3.27Å; R20-D23 WeakPolarHBondContact O-CB 3.41Å; R20-D23 PolarHBondContact O-N 3.42Å; R20-D23 VanDerWaalsContact O-N 3.09Å; R20-M24 PolarHBondContact O-N 2.95Å
21Y98.4Very high98.2Very high55 Ų5555.5 Ų55.522%0.21629%0.285CS..Hα-helixtrans-65.6-27.3-172.1-57-69.1000114.6E19 M24 A25 V48 N52 V53E19-Y21 HydrophobicContact CB-CE2 4.02Å; E19-Y21 WeakPolarHBondContact O-CD2 3.45Å; E19-Y21 PolarHBondContact O-N 3.39Å; Y21-M24 HydrophobicContact CD1-SD 4.01Å; Y21-M24 WeakPolarHBondContact O-CB 3.37Å; Y21-M24 PolarHBondContact O-N 3.19Å; Y21-A25 WeakPolarHBondContact O-CB 3.3Å; Y21-A25 PolarHBondContact O-N 3.1Å; Y21-V48 HydrophobicContact CE1-CG1 4.31Å; Y21-N52 HydrophobicContact CD1-CB 3.62Å; Y21-N52 HydrophobicContact CD2-CB 3.4Å; Y21-N52 HydrophobicContact CE1-CB 3.97Å; Y21-N52 WeakPolarHBondContact CE1-ND2 3.39Å; Y21-N52 HydrophobicContact CE2-CB 3.73Å; Y21-N52 HydrophobicContact CG-CB 3.31Å; Y21-V53 VanDerWaalsContact C-CG2 3.42Å; Y21-V53 WeakPolarHBondContact O-CG2 3.39Å
22D98.1Very high98.2Very high82 Ų8251 Ų5144%0.43927%0.265SS..Hα-helixtrans-65-40.9172.3-60.3-82.4000111.2R20 M24 A25 A26 R57R20-D22 VanDerWaalsContact C-N 3.3Å; R20-D22 PolarHBondContact O-N 2.99Å; D22-M24 VanDerWaalsContact C-N 3.34Å; D22-A25 PolarHBondContact O-N 3.2Å; D22-A26 PolarHBondContact O-N 3.19Å; D22-R57 IonicContact OD1-CZ 2.8Å; D22-R57 IonicContact OD1-NH1 3.77Å; D22-R57 PolarHBondContact OD1-NH1 3.25Å; D22-R57 IonicContact OD1-NH2 3.58Å; D22-R57 IonicContact OD2-NH1 3.59Å
23D98.3Very high98.2Very high53 Ų5355.3 Ų55.328%0.28329%0.285SS..Hα-helixtrans-67.4-38.3175.4-64.65.4000110.9A15 R20 A26 A27A15-D23 HydrophobicContact CB-CB 3.96Å; R20-D23 HydrophobicContact CB-CB 4.16Å; R20-D23 IonicContact CZ-OD1 2.84Å; R20-D23 IonicContact CZ-OD2 3.7Å; R20-D23 IonicContact NE-OD1 2.79Å; R20-D23 IonicContact NE-OD2 3.79Å; R20-D23 PolarHBondContact NE-OD2 3.23Å; R20-D23 IonicContact NH1-OD2 3.29Å; R20-D23 PolarHBondContact NH1-OD2 3.06Å; R20-D23 VanDerWaalsContact NH2-CG 3.31Å; R20-D23 IonicContact NH2-OD1 3.33Å; R20-D23 PolarHBondContact NH2-OD1 2.65Å; R20-D23 IonicContact NH2-OD2 3.84Å; R20-D23 PolarHBondContact NH2-OD2 3.27Å; R20-D23 WeakPolarHBondContact O-CB 3.41Å; R20-D23 PolarHBondContact O-N 3.42Å; R20-D23 VanDerWaalsContact O-N 3.09Å; D23-A26 PolarHBondContact O-N 2.72Å; D23-A27 WeakPolarHBondContact O-CB 3.27Å; D23-A27 PolarHBondContact O-N 3Å
24M98.3Very high98Very high0 Ų056.5 Ų56.50%029%0.292CS..Hα-helixtrans-62.5-45.2175.3-166.2-169.8-179.700111A12 A15 E16 R20 Y21 D22 A27 M28 L45 V48 A49A12-M24 HydrophobicContact CB-CG 4.07Å; A15-M24 HydrophobicContact CB-CB 3.91Å; E16-M24 HydrophobicContact CB-CE 3.94Å; E16-M24 HydrophobicContact CB-SD 3.92Å; E16-M24 HydrophobicContact CG-CE 4.16Å; E16-M24 HydrophobicContact CG-SD 4.34Å; R20-M24 PolarHBondContact O-N 2.95Å; Y21-M24 HydrophobicContact CD1-SD 4.01Å; Y21-M24 WeakPolarHBondContact O-CB 3.37Å; Y21-M24 PolarHBondContact O-N 3.19Å; D22-M24 VanDerWaalsContact C-N 3.34Å; M24-A27 PolarHBondContact O-N 3.43Å; M24-M28 WeakPolarHBondContact O-CB 3.48Å; M24-M28 WeakPolarHBondContact O-CG 3.46Å; M24-M28 PolarHBondContact O-N 2.96Å; M24-L45 HydrophobicContact CE-CB 3.89Å; M24-L45 HydrophobicContact CE-CD2 3.46Å; M24-L45 VanDerWaalsContact CE-CD2 3.46Å; M24-L45 HydrophobicContact CE-CG 4.3Å; M24-L45 WeakPolarHBondContact CE-O 3.4Å; M24-V48 HydrophobicContact CE-CB 4.12Å; M24-V48 HydrophobicContact CE-CG1 4.05Å; M24-V48 HydrophobicContact SD-CG1 4.25Å; M24-A49 HydrophobicContact CB-CB 3.9Å; M24-A49 HydrophobicContact CE-CB 4.28Å; M24-A49 HydrophobicContact CG-CB 3.61Å; M24-A49 HydrophobicContact SD-CB 3.6Å; M24-A49 VanDerWaalsContact SD-CB 3.6Å
25A98.5Very high97.8Very high7 Ų753.3 Ų53.36%0.05828%0.283CS..Hα-helixtrans-64.1-43.617800000111.1Y21 D22 A27 M28 K29 A49 Y50 V53Y21-A25 WeakPolarHBondContact O-CB 3.3Å; Y21-A25 PolarHBondContact O-N 3.1Å; D22-A25 PolarHBondContact O-N 3.2Å; A25-A27 PolarHBondContact O-N 3.32Å; A25-M28 PolarHBondContact O-N 3.07Å; A25-K29 VanDerWaalsContact O-CB 3.23Å; A25-K29 WeakPolarHBondContact O-CB 3.46Å; A25-K29 PolarHBondContact O-N 3.22Å; A25-A49 HydrophobicContact CB-CB 4.13Å; A25-Y50 HydrophobicContact CB-CD1 4.12Å; A25-Y50 HydrophobicContact CB-CD2 4.31Å; A25-Y50 HydrophobicContact CB-CE1 3.98Å; A25-Y50 HydrophobicContact CB-CE2 4.13Å; A25-Y50 HydrophobicContact CB-CG 4.32Å; A25-V53 HydrophobicContact CB-CG2 4.3Å
26A98.3Very high97.5Very high59 Ų5958.5 Ų58.549%0.48831%0.305SS..Hα-helixtrans-61.9-41.6176.300000112.6D22 D23 A30D22-A26 PolarHBondContact O-N 3.19Å; D23-A26 PolarHBondContact O-N 2.72Å; A26-A30 PolarHBondContact O-N 2.97Å
27A98.3Very high97.4Very high2 Ų258.3 Ų58.32%0.01730%0.304CS..Hα-helixtrans-65.8-46.1176.200000111.7K11 A12 D23 M24 A25 A30 V31K11-A27 HydrophobicContact CB-CB 4.49Å; K11-A27 HydrophobicContact CD-CB 4.41Å; K11-A27 HydrophobicContact CG-CB 4.4Å; A12-A27 HydrophobicContact CB-CB 4.03Å; D23-A27 WeakPolarHBondContact O-CB 3.27Å; D23-A27 PolarHBondContact O-N 3Å; M24-A27 PolarHBondContact O-N 3.43Å; A25-A27 PolarHBondContact O-N 3.32Å; A27-A30 PolarHBondContact O-N 2.84Å; A27-V31 WeakPolarHBondContact O-CG2 3.4Å; A27-V31 PolarHBondContact O-N 2.79Å
28M98.5Very high97.4Very high0 Ų051.2 Ų51.20%027%0.271CS..Hα-helixtrans-72.3-28.7-179.2-68-52.3-52.400113.5A12 M24 A25 V31 T32 E42 L45 L46A12-M28 HydrophobicContact CB-CG 3.78Å; A12-M28 HydrophobicContact CB-SD 3.57Å; A12-M28 VanDerWaalsContact CB-SD 3.57Å; M24-M28 WeakPolarHBondContact O-CB 3.48Å; M24-M28 WeakPolarHBondContact O-CG 3.46Å; M24-M28 PolarHBondContact O-N 2.96Å; A25-M28 PolarHBondContact O-N 3.07Å; M28-V31 HydrophobicContact CE-CB 4.18Å; M28-V31 HydrophobicContact CE-CG1 4.15Å; M28-V31 HydrophobicContact CE-CG2 4.45Å; M28-V31 PolarHBondContact O-N 3.21Å; M28-V31 HydrophobicContact SD-CG2 4.33Å; M28-T32 WeakPolarHBondContact O-CB 3.35Å; M28-T32 PolarHBondContact O-N 3.47Å; M28-T32 PolarHBondContact O-OG1 3.1Å; M28-E42 HydrophobicContact CE-CB 4.12Å; M28-E42 WeakPolarHBondContact CE-O 3.19Å; M28-L45 HydrophobicContact CE-CB 4.16Å; M28-L45 HydrophobicContact CG-CB 4.2Å; M28-L45 HydrophobicContact SD-CB 3.89Å; M28-L45 HydrophobicContact SD-CD1 4.35Å; M28-L46 HydrophobicContact CB-CB 4.25Å; M28-L46 HydrophobicContact CB-CD1 3.68Å; M28-L46 HydrophobicContact CE-CB 4.25Å
29K98.4Very high97.3Very high47 Ų4750.8 Ų50.820%0.20426%0.264CS..Hα-helixtrans-58.1-51.8167.1179.6168.5-166.6176.80110.1A25 V31 T32 E33 D98 L102A25-K29 VanDerWaalsContact O-CB 3.23Å; A25-K29 WeakPolarHBondContact O-CB 3.46Å; A25-K29 PolarHBondContact O-N 3.22Å; K29-V31 VanDerWaalsContact C-N 3.29Å; K29-V31 PolarHBondContact O-N 3.01Å; K29-T32 PolarHBondContact O-N 2.86Å; K29-E33 WeakPolarHBondContact CE-OE1 3.45Å; K29-E33 HydrophobicContact CG-CG 4.41Å; K29-E33 WeakPolarHBondContact O-CG 3.31Å; K29-E33 PolarHBondContact O-N 2.93Å; K29-D98 IonicContact NZ-OD1 3.96Å; K29-D98 PolarHBondContact NZ-OD1 3.32Å; K29-D98 IonicContact NZ-OD2 2.63Å; K29-D98 PolarHBondContact NZ-OD2 2.87Å; K29-L102 HydrophobicContact CB-CD1 4.11Å; K29-L102 HydrophobicContact CG-CD1 3.99Å; K29-L102 HydrophobicContact CG-CD2 4.12Å
30A98Very high97.2Very high34 Ų3447.9 Ų47.928%0.28125%0.254SS..Hα-helixtrans-62.3-33177.800000113.3L8 A26 A27 Q34L8-A30 HydrophobicContact CD1-CB 3.74Å; L8-A30 HydrophobicContact CD2-CB 4.05Å; A26-A30 PolarHBondContact O-N 2.97Å; A27-A30 PolarHBondContact O-N 2.84Å; A30-Q34 WeakPolarHBondContact O-CG 3.38Å
31V98Very high97.1Very high0 Ų046 Ų460%025%0.251CS..Hα-helixtrans-65.4-45.9171.7171.60000111K5 L8 V9 A27 M28 K29 Q34 L38K5-V31 HydrophobicContact CG-CG1 3.93Å; L8-V31 HydrophobicContact CB-CG2 3.43Å; L8-V31 VanDerWaalsContact CB-CG2 3.43Å; L8-V31 HydrophobicContact CD1-CG2 4.07Å; L8-V31 HydrophobicContact CG-CG2 4.4Å; V9-V31 HydrophobicContact CG2-CG1 4.34Å; V9-V31 HydrophobicContact CG2-CG2 3.92Å; A27-V31 WeakPolarHBondContact O-CG2 3.4Å; A27-V31 PolarHBondContact O-N 2.79Å; M28-V31 HydrophobicContact CE-CB 4.18Å; M28-V31 HydrophobicContact CE-CG1 4.15Å; M28-V31 HydrophobicContact CE-CG2 4.45Å; M28-V31 PolarHBondContact O-N 3.21Å; M28-V31 HydrophobicContact SD-CG2 4.33Å; K29-V31 VanDerWaalsContact C-N 3.29Å; K29-V31 PolarHBondContact O-N 3.01Å; V31-Q34 WeakPolarHBondContact O-CB 3.15Å; V31-Q34 PolarHBondContact O-N 3.46Å; V31-L38 HydrophobicContact CG1-CD2 3.79Å
32T98Very high97Very high1 Ų144.4 Ų44.41%0.00625%0.246CC..Hα-helixtrans-66.9-39.9-176.4-57.60000111.8M28 K29 Q34 G35 L102 Y106 L107M28-T32 WeakPolarHBondContact O-CB 3.35Å; M28-T32 PolarHBondContact O-N 3.47Å; M28-T32 PolarHBondContact O-OG1 3.1Å; K29-T32 PolarHBondContact O-N 2.86Å; T32-Q34 PolarHBondContact O-N 3.38Å; T32-Q34 VanDerWaalsContact O-N 3.15Å; T32-G35 PolarHBondContact O-N 3.18Å; T32-L102 HydrophobicContact CG2-CB 4.17Å; T32-L102 HydrophobicContact CG2-CD2 3.95Å; T32-L102 HydrophobicContact CG2-CG 4.48Å; T32-Y106 HydrophobicContact CG2-CG 4.32Å; T32-L107 HydrophobicContact CG2-CD1 4.07Å; T32-L107 HydrophobicContact CG2-CD2 3.64Å; T32-L107 HydrophobicContact CG2-CG 3.74Å
33E97.2Very high97Very high91 Ų9141 Ų4143%0.42523%0.226SC..THydrogen-bonded Turntrans-68.2-10.1179.8-71.1173.7165.400113.7K29 G35 L102 Y106K29-E33 WeakPolarHBondContact CE-OE1 3.45Å; K29-E33 HydrophobicContact CG-CG 4.41Å; K29-E33 WeakPolarHBondContact O-CG 3.31Å; K29-E33 PolarHBondContact O-N 2.93Å; E33-G35 PolarHBondContact O-N 2.84Å; E33-L102 HydrophobicContact CG-CD2 3.76Å; E33-Y106 HydrophobicContact CG-CE2 4.03Å
34Q95.4Very high97Very high73 Ų7342 Ų4234%0.34123%0.232SC..THydrogen-bonded Turntrans-69.8-13.4169.3-63.3178.820.600112.7A30 V31 T32 H36A30-Q34 WeakPolarHBondContact O-CG 3.38Å; V31-Q34 WeakPolarHBondContact O-CB 3.15Å; V31-Q34 PolarHBondContact O-N 3.46Å; T32-Q34 PolarHBondContact O-N 3.38Å; T32-Q34 VanDerWaalsContact O-N 3.15Å; Q34-H36 VanDerWaalsContact C-N 3.33Å; Q34-H36 PolarHBondContact O-N 3.23Å
35G93.8Very high97Very high31 Ų3142.5 Ų42.532%0.3224%0.235SC..  trans78.69.8171.600000115.6T32 E33T32-G35 PolarHBondContact O-N 3.18Å; E33-G35 PolarHBondContact O-N 2.84Å
36H92.9Very high97Very high117 Ų11742.3 Ų42.354%0.54223%0.232SC..PPolyproline II helixtrans-87.3146.1171.5-59.7-52.5000110.9Q34 L38Q34-H36 VanDerWaalsContact C-N 3.33Å; Q34-H36 PolarHBondContact O-N 3.23Å; H36-L38 PolarHBondContact O-N 3.37Å
37E95.5Very high97Very high66 Ų6641 Ų4131%0.30822%0.22SC..PPolyproline II helixtrans-58.7133170.4-171.7167.6-160.700109.7A111 T112E37-A111 WeakPolarHBondContact OE1-CA 3.5Å; E37-T112 VanDerWaalsContact CD-OG1 3.31Å; E37-T112 PolarHBondContact OE1-N 2.86Å; E37-T112 PolarHBondContact OE1-OG1 2.96Å; E37-T112 VanDerWaalsContact OE2-CG2 3.31Å; E37-T112 WeakPolarHBondContact OE2-CG2 3.38Å; E37-T112 PolarHBondContact OE2-OG1 3.47Å
38L97.4Very high97Very high7 Ų743.1 Ų43.14%0.03723%0.232CC..PPolyproline II helixtrans-77.3138.8178.7-59.4-172.2000110V31 H36 E42 R43 L46 L107V31-L38 HydrophobicContact CG1-CD2 3.79Å; H36-L38 PolarHBondContact O-N 3.37Å; L38-E42 HydrophobicContact CB-CB 3.98Å; L38-E42 HydrophobicContact CD2-CB 4.21Å; L38-E42 HydrophobicContact CG-CB 4.46Å; L38-R43 HydrophobicContact CB-CB 4.35Å; L38-L46 HydrophobicContact CD1-CD2 4.07Å; L38-L107 HydrophobicContact CD1-CD2 3.6Å; L38-L107 HydrophobicContact CG-CD2 3.8Å
39S96.4Very high97Very high53 Ų5343.1 Ų43.137%0.37123%0.232SC..PPolyproline II helixtrans-65.3165.1164.463.40000111.1E41 E42 R43S39-E41 PolarHBondContact O-N 2.92Å; S39-E42 WeakPolarHBondContact CB-OE2 3.4Å; S39-E42 PolarHBondContact N-OE2 3.47Å; S39-E42 PolarHBondContact O-N 3.15Å; S39-E42 VanDerWaalsContact OG-CG 3.26Å; S39-E42 WeakPolarHBondContact OG-CG 3.48Å; S39-E42 PolarHBondContact OG-N 2.71Å; S39-E42 PolarHBondContact OG-OE2 3.01Å; S39-R43 VanDerWaalsContact O-CB 3.31Å; S39-R43 WeakPolarHBondContact O-CB 3.47Å; S39-R43 PolarHBondContact O-N 2.93Å
40N94.4Very high97Very high85 Ų8541.2 Ų41.246%0.45522%0.224SC..Hα-helixtrans-56.7-38.8177.2-72.5-6.2000112.6N44N40-N44 WeakPolarHBondContact O-CB 3.46Å; N40-N44 PolarHBondContact O-N 3.36Å; N40-N44 PolarHBondContact O-ND2 3.36Å; N40-N44 PolarHBondContact O-OD1 3.31Å
41E96.5Very high97Very high104 Ų10446 Ų4649%0.48624%0.239SC..Hα-helixtrans-64.6-49.3176.5-174.4-179.9-152.200111.2K13 S39 R43 N44 L45K13-E41 WeakPolarHBondContact CE-OE1 3.37Å; K13-E41 IonicContact NZ-OE1 2.64Å; K13-E41 PolarHBondContact NZ-OE1 2.92Å; K13-E41 IonicContact NZ-OE2 3.12Å; K13-E41 PolarHBondContact NZ-OE2 3Å; K13-E41 VanDerWaalsContact NZ-OE2 3.12Å; S39-E41 PolarHBondContact O-N 2.92Å; E41-R43 PolarHBondContact O-N 3.35Å; E41-N44 PolarHBondContact O-N 3.45Å; E41-L45 HydrophobicContact CG-CD1 4.36Å; E41-L45 WeakPolarHBondContact O-CG 3.45Å; E41-L45 PolarHBondContact O-N 3.33Å
42E98Very high97Very high21 Ų2148.7 Ų48.710%0.09825%0.253CS..Hα-helixtrans-63.8-41.7180-68.8163.2151.400112K5 V9 M28 L38 S39 N44 L45 L46K5-E42 WeakPolarHBondContact CE-OE1 3.31Å; K5-E42 IonicContact NZ-OE1 2.75Å; K5-E42 PolarHBondContact NZ-OE1 3.01Å; K5-E42 IonicContact NZ-OE2 3.85Å; K5-E42 PolarHBondContact NZ-OE2 2.96Å; V9-E42 HydrophobicContact CG2-CG 3.88Å; M28-E42 HydrophobicContact CE-CB 4.12Å; M28-E42 WeakPolarHBondContact CE-O 3.19Å; L38-E42 HydrophobicContact CB-CB 3.98Å; L38-E42 HydrophobicContact CD2-CB 4.21Å; L38-E42 HydrophobicContact CG-CB 4.46Å; S39-E42 WeakPolarHBondContact CB-OE2 3.4Å; S39-E42 PolarHBondContact N-OE2 3.47Å; S39-E42 PolarHBondContact O-N 3.15Å; S39-E42 VanDerWaalsContact OG-CG 3.26Å; S39-E42 WeakPolarHBondContact OG-CG 3.48Å; S39-E42 PolarHBondContact OG-N 2.71Å; S39-E42 PolarHBondContact OG-OE2 3.01Å; E42-N44 VanDerWaalsContact C-N 3.32Å; E42-N44 PolarHBondContact O-N 2.95Å; E42-L45 PolarHBondContact O-N 3.41Å; E42-L46 PolarHBondContact O-N 3.5Å
43R97.6Very high97Very high9 Ų949 Ų493%0.03425%0.254CS..Hα-helixtrans-58.2-44.9173.6178.2-171.475.7-171.9-0.1111.4L38 S39 E41 L46 S47 E115 F119 Y120L38-R43 HydrophobicContact CB-CB 4.35Å; S39-R43 VanDerWaalsContact O-CB 3.31Å; S39-R43 WeakPolarHBondContact O-CB 3.47Å; S39-R43 PolarHBondContact O-N 2.93Å; E41-R43 PolarHBondContact O-N 3.35Å; R43-L46 PolarHBondContact O-N 3.26Å; R43-S47 WeakPolarHBondContact O-CB 3.42Å; R43-S47 PolarHBondContact O-N 3.34Å; R43-E115 IonicContact CZ-OE1 2.8Å; R43-E115 VanDerWaalsContact CZ-OE1 3.29Å; R43-E115 IonicContact NH1-OE1 2.94Å; R43-E115 PolarHBondContact NH1-OE1 3.35Å; R43-E115 IonicContact NH2-OE1 2.76Å; R43-E115 PolarHBondContact NH2-OE1 3.03Å; R43-F119 VanDerWaalsContact CD-CD1 3.48Å; R43-F119 HydrophobicContact CG-CD1 3.58Å; R43-F119 HydrophobicContact CG-CE1 3.4Å; R43-F119 VanDerWaalsContact CG-CE1 3.4Å; R43-F119 HydrophobicContact CG-CE2 4.4Å; R43-F119 HydrophobicContact CG-CG 4.18Å; R43-F119 HydrophobicContact CG-CZ 3.84Å; R43-Y120 HydrophobicContact CG-CE1 3.72Å
44N96.8Very high97.1Very high75 Ų7544.7 Ų44.740%0.40123%0.234SC..Hα-helixtrans-66.5-41.7179-71.4-10.8000111.3N40 E41 E42 L46 S47 V48N40-N44 WeakPolarHBondContact O-CB 3.46Å; N40-N44 PolarHBondContact O-N 3.36Å; N40-N44 PolarHBondContact O-ND2 3.36Å; N40-N44 PolarHBondContact O-OD1 3.31Å; E41-N44 PolarHBondContact O-N 3.45Å; E42-N44 VanDerWaalsContact C-N 3.32Å; E42-N44 PolarHBondContact O-N 2.95Å; N44-L46 PolarHBondContact O-N 3.07Å; N44-S47 WeakPolarHBondContact O-CB 3.44Å; N44-S47 PolarHBondContact O-N 3.25Å; N44-V48 WeakPolarHBondContact O-CG2 3.45Å; N44-V48 PolarHBondContact O-N 3.38Å
45L98.5Very high97.2Very high11 Ų1142.4 Ų42.46%0.05823%0.23CC..Hα-helixtrans-59.1-47.4174.3-71.3170000111.6V9 K13 E16 M24 M28 E41 E42 S47 V48 A49V9-L45 HydrophobicContact CG1-CD1 3.97Å; K13-L45 HydrophobicContact CG-CD1 4.06Å; K13-L45 HydrophobicContact CG-CD2 4.2Å; E16-L45 WeakPolarHBondContact OE2-CD2 2.95Å; M24-L45 HydrophobicContact CE-CB 3.89Å; M24-L45 HydrophobicContact CE-CD2 3.46Å; M24-L45 VanDerWaalsContact CE-CD2 3.46Å; M24-L45 HydrophobicContact CE-CG 4.3Å; M24-L45 WeakPolarHBondContact CE-O 3.4Å; M28-L45 HydrophobicContact CE-CB 4.16Å; M28-L45 HydrophobicContact CG-CB 4.2Å; M28-L45 HydrophobicContact SD-CB 3.89Å; M28-L45 HydrophobicContact SD-CD1 4.35Å; E41-L45 HydrophobicContact CG-CD1 4.36Å; E41-L45 WeakPolarHBondContact O-CG 3.45Å; E41-L45 PolarHBondContact O-N 3.33Å; E42-L45 PolarHBondContact O-N 3.41Å; L45-S47 VanDerWaalsContact C-N 3.29Å; L45-S47 PolarHBondContact O-N 2.98Å; L45-V48 PolarHBondContact O-N 3.45Å; L45-A49 WeakPolarHBondContact O-CB 3.38Å; L45-A49 PolarHBondContact O-N 3.15Å
46L98.6Very high97.4Very high2 Ų243.2 Ų43.21%0.0124%0.235CC..Hα-helixtrans-57.1-44.9175.6-18073.9000111.4M28 L38 E42 R43 N44 A49 Y50 L102 L107M28-L46 HydrophobicContact CB-CB 4.25Å; M28-L46 HydrophobicContact CB-CD1 3.68Å; M28-L46 HydrophobicContact CE-CB 4.25Å; L38-L46 HydrophobicContact CD1-CD2 4.07Å; E42-L46 PolarHBondContact O-N 3.5Å; R43-L46 PolarHBondContact O-N 3.26Å; N44-L46 PolarHBondContact O-N 3.07Å; L46-A49 PolarHBondContact O-N 3.16Å; L46-Y50 HydrophobicContact CD1-CD2 3.67Å; L46-Y50 HydrophobicContact CD1-CE2 3.53Å; L46-Y50 HydrophobicContact CG-CD2 4.26Å; L46-Y50 PolarHBondContact O-N 3.46Å; L46-L102 HydrophobicContact CD1-CD1 4.47Å; L46-L107 HydrophobicContact CD2-CD1 3.46Å; L46-L107 VanDerWaalsContact CD2-CD1 3.46Å
47S98.2Very high97.7Very high32 Ų3240.5 Ų40.522%0.22422%0.22CC..Hα-helixtrans-63.1-48.1179.5-168.70000112.2R43 N44 L45 A49 K51R43-S47 WeakPolarHBondContact O-CB 3.42Å; R43-S47 PolarHBondContact O-N 3.34Å; N44-S47 WeakPolarHBondContact O-CB 3.44Å; N44-S47 PolarHBondContact O-N 3.25Å; L45-S47 VanDerWaalsContact C-N 3.29Å; L45-S47 PolarHBondContact O-N 2.98Å; S47-A49 VanDerWaalsContact C-N 3.35Å; S47-A49 PolarHBondContact O-N 2.93Å; S47-K51 WeakPolarHBondContact O-CB 3.44Å; S47-K51 PolarHBondContact O-N 3.16Å
48V98.4Very high97.8Very high46 Ų4638.7 Ų38.728%0.27921%0.21SC..Hα-helixtrans-60.9-44.2178.11690000110.9Y21 M24 N44 L45 N52Y21-V48 HydrophobicContact CE1-CG1 4.31Å; M24-V48 HydrophobicContact CE-CB 4.12Å; M24-V48 HydrophobicContact CE-CG1 4.05Å; M24-V48 HydrophobicContact SD-CG1 4.25Å; N44-V48 WeakPolarHBondContact O-CG2 3.45Å; N44-V48 PolarHBondContact O-N 3.38Å; L45-V48 PolarHBondContact O-N 3.45Å; V48-N52 PolarHBondContact O-N 3.41Å; V48-N52 VanDerWaalsContact O-N 3.16Å; V48-N52 PolarHBondContact O-ND2 3.46Å
49A98.6Very high97.8Very high0 Ų041.5 Ų41.50%023%0.23CC..Hα-helixtrans-55.9-61.9179.500000111.3M24 A25 L45 L46 S47 K51 N52 V53M24-A49 HydrophobicContact CB-CB 3.9Å; M24-A49 HydrophobicContact CE-CB 4.28Å; M24-A49 HydrophobicContact CG-CB 3.61Å; M24-A49 HydrophobicContact SD-CB 3.6Å; M24-A49 VanDerWaalsContact SD-CB 3.6Å; A25-A49 HydrophobicContact CB-CB 4.13Å; L45-A49 WeakPolarHBondContact O-CB 3.38Å; L45-A49 PolarHBondContact O-N 3.15Å; L46-A49 PolarHBondContact O-N 3.16Å; S47-A49 VanDerWaalsContact C-N 3.35Å; S47-A49 PolarHBondContact O-N 2.93Å; A49-K51 PolarHBondContact O-N 3.2Å; A49-N52 PolarHBondContact O-N 2.6Å; A49-V53 WeakPolarHBondContact O-CG2 3.46Å; A49-V53 PolarHBondContact O-N 3.44Å; A49-V53 VanDerWaalsContact O-N 3.11Å
50Y98.7Very high97.9Very high7 Ų741.8 Ų41.83%0.02723%0.232CC..Hα-helixtrans-72.1-30.8-174.3-78.6-76.8000113.2A25 L46 N52 V53 V54 I95 V99 L102 Y127A25-Y50 HydrophobicContact CB-CD1 4.12Å; A25-Y50 HydrophobicContact CB-CD2 4.31Å; A25-Y50 HydrophobicContact CB-CE1 3.98Å; A25-Y50 HydrophobicContact CB-CE2 4.13Å; A25-Y50 HydrophobicContact CB-CG 4.32Å; L46-Y50 HydrophobicContact CD1-CD2 3.67Å; L46-Y50 HydrophobicContact CD1-CE2 3.53Å; L46-Y50 HydrophobicContact CG-CD2 4.26Å; L46-Y50 PolarHBondContact O-N 3.46Å; Y50-N52 VanDerWaalsContact C-N 3.31Å; Y50-N52 PolarHBondContact O-N 3.01Å; Y50-V53 PolarHBondContact O-N 3.12Å; Y50-V54 WeakPolarHBondContact O-CB 3.34Å; Y50-V54 PolarHBondContact O-N 3.18Å; Y50-I95 HydrophobicContact CD1-CG2 3.91Å; Y50-I95 HydrophobicContact CE1-CG2 4.28Å; Y50-V99 HydrophobicContact CD1-CG2 3.01Å; Y50-V99 HydrophobicContact CD2-CG2 3.7Å; Y50-V99 HydrophobicContact CE1-CG2 3.24Å; Y50-V99 HydrophobicContact CE2-CG2 3.91Å; Y50-V99 HydrophobicContact CG-CG2 3.22Å; Y50-L102 HydrophobicContact CE2-CD1 4.01Å; Y50-Y127 WeakPolarHBondContact CB-OH 3.23Å
51K98.1Very high98.1Very high136 Ų13639.5 Ų39.559%0.59122%0.217SC*.Hα-helixtrans-58.5-43.8173.3178.9-176.1175-173.70111.2S47 A49 G55 Y127S47-K51 WeakPolarHBondContact O-CB 3.44Å; S47-K51 PolarHBondContact O-N 3.16Å; A49-K51 PolarHBondContact O-N 3.2Å; K51-G55 WeakPolarHBondContact O-CA 3.28Å; K51-G55 PolarHBondContact O-N 3.08Å; K51-Y127 PolarHBondContact N-OH 3.15Å
52N98.4Very high98.1Very high56 Ų5639.4 Ų39.430%0.29921%0.212SC..Hα-helixtrans-72.1-43.4179.7-79.3-71.6000112.2Y21 V48 A49 Y50 V54 G55 A56Y21-N52 HydrophobicContact CD1-CB 3.62Å; Y21-N52 HydrophobicContact CD2-CB 3.4Å; Y21-N52 HydrophobicContact CE1-CB 3.97Å; Y21-N52 WeakPolarHBondContact CE1-ND2 3.39Å; Y21-N52 HydrophobicContact CE2-CB 3.73Å; Y21-N52 HydrophobicContact CG-CB 3.31Å; V48-N52 PolarHBondContact O-N 3.41Å; V48-N52 VanDerWaalsContact O-N 3.16Å; V48-N52 PolarHBondContact O-ND2 3.46Å; A49-N52 PolarHBondContact O-N 2.6Å; Y50-N52 VanDerWaalsContact C-N 3.31Å; Y50-N52 PolarHBondContact O-N 3.01Å; N52-V54 PolarHBondContact O-N 2.99Å; N52-G55 PolarHBondContact O-N 3.19Å; N52-A56 PolarHBondContact O-N 2.94Å
53V98.4Very high98Very high6 Ų642.5 Ų42.54%0.03623%0.232CC..Hα-helixtrans-58.3-50177.4176.40000110.9Y21 A25 A49 Y50 R57 I95Y21-V53 VanDerWaalsContact C-CG2 3.42Å; Y21-V53 WeakPolarHBondContact O-CG2 3.39Å; A25-V53 HydrophobicContact CB-CG2 4.3Å; A49-V53 WeakPolarHBondContact O-CG2 3.46Å; A49-V53 PolarHBondContact O-N 3.44Å; A49-V53 VanDerWaalsContact O-N 3.11Å; Y50-V53 PolarHBondContact O-N 3.12Å; V53-R57 VanDerWaalsContact O-CD 3.32Å; V53-R57 WeakPolarHBondContact O-CD 3.44Å; V53-R57 PolarHBondContact O-N 3.38Å; V53-I95 HydrophobicContact CG1-CD1 3.62Å; V53-I95 HydrophobicContact CG1-CG1 3.96Å; V53-I95 HydrophobicContact CG1-CG2 3.87Å
54V98.4Very high97.9Very high1 Ų143.4 Ų43.41%0.00624%0.237CC..Hα-helixtrans-68.2-41.1177.1164.80000112.1Y50 N52 A56 R57 R58 L92 I95 Y127 Y130Y50-V54 WeakPolarHBondContact O-CB 3.34Å; Y50-V54 PolarHBondContact O-N 3.18Å; N52-V54 PolarHBondContact O-N 2.99Å; V54-A56 VanDerWaalsContact C-N 3.27Å; V54-A56 PolarHBondContact O-N 3.09Å; V54-R57 PolarHBondContact O-N 2.81Å; V54-R57 VanDerWaalsContact O-N 3.15Å; V54-R58 HydrophobicContact CG1-CG 4Å; V54-R58 WeakPolarHBondContact O-CG 3.36Å; V54-R58 PolarHBondContact O-N 2.87Å; V54-L92 HydrophobicContact CB-CD1 4.37Å; V54-L92 HydrophobicContact CG1-CD1 3.68Å; V54-L92 HydrophobicContact CG2-CD1 4.31Å; V54-I95 HydrophobicContact CG2-CB 4.09Å; V54-I95 HydrophobicContact CG2-CG2 3.33Å; V54-Y127 HydrophobicContact CB-CE1 4.29Å; V54-Y127 HydrophobicContact CG2-CD1 4.13Å; V54-Y127 HydrophobicContact CG2-CE1 3.6Å; V54-Y130 HydrophobicContact CG1-CD2 3.53Å; V54-Y130 HydrophobicContact CG1-CE2 3.99Å; V54-Y130 HydrophobicContact CG1-CG 4.08Å
55G98Very high97.8Very high25 Ų2540.5 Ų40.526%0.25822%0.223SC..Hα-helixtrans-57-40.5178.400000112.8K51 N52 S59K51-G55 WeakPolarHBondContact O-CA 3.28Å; K51-G55 PolarHBondContact O-N 3.08Å; N52-G55 PolarHBondContact O-N 3.19Å; G55-S59 WeakPolarHBondContact O-CB 3.17Å; G55-S59 PolarHBondContact O-N 2.83Å; G55-S59 PolarHBondContact O-OG 2.94Å
56A98.1Very high97.6Very high49 Ų4942 Ų4241%0.40523%0.234SC..Hα-helixtrans-62.7-47.5174.900000111.9N52 V54 S59 S60N52-A56 PolarHBondContact O-N 2.94Å; V54-A56 VanDerWaalsContact C-N 3.27Å; V54-A56 PolarHBondContact O-N 3.09Å; A56-S59 PolarHBondContact O-N 3.48Å; A56-S60 PolarHBondContact O-N 2.88Å; A56-S60 PolarHBondContact O-OG 2.93Å
57R98.3Very high97.2Very high60 Ų6046 Ų4623%0.22626%0.255CS..Hα-helixtrans-65.4-41.7179.5-86.965.9-178.1-165.2-4.2111.8D22 V53 V54 S59 S60 W61 I88 E91 L92 I95D22-R57 IonicContact OD1-CZ 2.8Å; D22-R57 IonicContact OD1-NH1 3.77Å; D22-R57 PolarHBondContact OD1-NH1 3.25Å; D22-R57 IonicContact OD1-NH2 3.58Å; D22-R57 IonicContact OD2-NH1 3.59Å; V53-R57 VanDerWaalsContact O-CD 3.32Å; V53-R57 WeakPolarHBondContact O-CD 3.44Å; V53-R57 PolarHBondContact O-N 3.38Å; V54-R57 PolarHBondContact O-N 2.81Å; V54-R57 VanDerWaalsContact O-N 3.15Å; R57-S59 VanDerWaalsContact C-N 3.34Å; R57-S59 PolarHBondContact O-N 3.48Å; R57-S60 PolarHBondContact O-N 3.16Å; R57-W61 WeakPolarHBondContact O-CB 3.44Å; R57-W61 PolarHBondContact O-N 3.21Å; R57-I88 HydrophobicContact CB-CG2 4.28Å; R57-I88 HydrophobicContact CG-CG2 4.49Å; R57-I88 VanDerWaalsContact O-CG2 3.31Å; R57-I88 WeakPolarHBondContact O-CG2 3.39Å; R57-E91 HydrophobicContact CG-CB 4.2Å; R57-E91 IonicContact NE-OE2 3.52Å; R57-E91 PolarHBondContact NE-OE2 3.44Å; R57-L92 HydrophobicContact CB-CD1 4.2Å; R57-I95 HydrophobicContact CG-CD1 3.96Å
58R97.9Very high96.8Very high28 Ų2845.9 Ų45.911%0.10625%0.251CS..Hα-helixtrans-61.4-41.2175-70.9178.669.4-142.413.3112.4V54 W61 R62 L92 Y130 E133V54-R58 HydrophobicContact CG1-CG 4Å; V54-R58 WeakPolarHBondContact O-CG 3.36Å; V54-R58 PolarHBondContact O-N 2.87Å; R58-W61 PolarHBondContact O-N 3.03Å; R58-R62 VanDerWaalsContact CZ-NH2 3.25Å; R58-R62 WeakPolarHBondContact O-CG 3.21Å; R58-R62 PolarHBondContact O-N 3.45Å; R58-L92 HydrophobicContact CG-CD1 3.89Å; R58-L92 HydrophobicContact CG-CD2 4.23Å; R58-Y130 VanDerWaalsContact CZ-CE1 3.46Å; R58-Y130 VanDerWaalsContact NH1-CE1 3.31Å; R58-E133 IonicContact CZ-OE2 3Å; R58-E133 IonicContact NE-OE2 2.8Å; R58-E133 PolarHBondContact NE-OE2 3.03Å; R58-E133 IonicContact NH2-OE1 3.63Å; R58-E133 IonicContact NH2-OE2 2.71Å; R58-E133 PolarHBondContact NH2-OE2 3.29Å
59S98.1Very high96.3Very high66 Ų6650.4 Ų50.446%0.46227%0.269SS..Hα-helixtrans-64.2-46.5177.3-580000111.1G55 A56 R57 W61 R62 V63G55-S59 WeakPolarHBondContact O-CB 3.17Å; G55-S59 PolarHBondContact O-N 2.83Å; G55-S59 PolarHBondContact O-OG 2.94Å; A56-S59 PolarHBondContact O-N 3.48Å; R57-S59 VanDerWaalsContact C-N 3.34Å; R57-S59 PolarHBondContact O-N 3.48Å; S59-W61 VanDerWaalsContact C-N 3.35Å; S59-W61 PolarHBondContact O-N 3.38Å; S59-R62 PolarHBondContact O-N 3.03Å; S59-V63 WeakPolarHBondContact O-CG2 3.31Å; S59-V63 PolarHBondContact O-N 3.23Å
60S98.1Very high95.8Very high58 Ų5858.3 Ų58.341%0.40630%0.303SS..Hα-helixtrans-58.5-46.1173.6-62.70000111.8A56 R57 R62 V63 I64A56-S60 PolarHBondContact O-N 2.88Å; A56-S60 PolarHBondContact O-OG 2.93Å; R57-S60 PolarHBondContact O-N 3.16Å; S60-R62 PolarHBondContact O-N 3.36Å; S60-V63 PolarHBondContact O-N 3.11Å; S60-I64 VanDerWaalsContact O-CG1 3.32Å; S60-I64 WeakPolarHBondContact O-CG1 3.28Å; S60-I64 PolarHBondContact O-N 2.88Å
61W97.9Very high95Very high38 Ų3859.6 Ų59.614%0.14431%0.312CS..Hα-helixtrans-57.7-49178.9-179.982000111.7R57 R58 S59 V63 I64 S65 I88 E89 E133 V134R57-W61 WeakPolarHBondContact O-CB 3.44Å; R57-W61 PolarHBondContact O-N 3.21Å; R58-W61 PolarHBondContact O-N 3.03Å; S59-W61 VanDerWaalsContact C-N 3.35Å; S59-W61 PolarHBondContact O-N 3.38Å; W61-V63 VanDerWaalsContact C-N 3.33Å; W61-V63 PolarHBondContact O-N 3.28Å; W61-I64 PolarHBondContact O-N 2.84Å; W61-S65 WeakPolarHBondContact O-CB 3.29Å; W61-S65 PolarHBondContact O-N 3.09Å; W61-S65 PolarHBondContact O-OG 3.03Å; W61-I88 HydrophobicContact CB-CG2 3.75Å; W61-E89 PolarHBondContact NE1-OE1 3.5Å; W61-E133 HydrophobicContact CH2-CG 4.17Å; W61-E133 HydrophobicContact CZ3-CG 3.78Å; W61-V134 HydrophobicContact CD2-CG1 3.74Å; W61-V134 HydrophobicContact CE3-CG1 4.17Å; W61-V134 HydrophobicContact CG-CG1 4.14Å; W61-V134 HydrophobicContact CH2-CG1 4.27Å; W61-V134 HydrophobicContact CZ2-CB 4.28Å; W61-V134 HydrophobicContact CZ2-CG1 3.86Å; W61-V134 HydrophobicContact CZ3-CG1 4.42Å
62R96.8Very high93.8Very high102 Ų10260.7 Ų60.739%0.38532%0.319SS..Hα-helixtrans-59-42.6178.5-71.6-177.3-171.5124.5-3.3113.1R58 S59 S60 S66 E133R58-R62 VanDerWaalsContact CZ-NH2 3.25Å; R58-R62 WeakPolarHBondContact O-CG 3.21Å; R58-R62 PolarHBondContact O-N 3.45Å; S59-R62 PolarHBondContact O-N 3.03Å; S60-R62 PolarHBondContact O-N 3.36Å; R62-S66 WeakPolarHBondContact O-CB 3.4Å; R62-S66 PolarHBondContact O-N 2.96Å; R62-E133 IonicContact CZ-OE1 3.84Å; R62-E133 VanDerWaalsContact CZ-OE1 3.25Å; R62-E133 IonicContact NE-OE1 3.17Å; R62-E133 PolarHBondContact NE-OE1 3.04Å; R62-E133 IonicContact NH2-OE1 3.37Å; R62-E133 PolarHBondContact NH2-OE1 3.35Å; R62-E133 IonicContact NH2-OE2 2.81Å; R62-E133 PolarHBondContact NH2-OE2 3.18Å
63V96.9Very high93Very high85 Ų8570.2 Ų70.252%0.51535%0.351SS..Hα-helixtrans-62.7-47.9178.2171.80000110.4S59 S60 W61 S66 I67S59-V63 WeakPolarHBondContact O-CG2 3.31Å; S59-V63 PolarHBondContact O-N 3.23Å; S60-V63 PolarHBondContact O-N 3.11Å; W61-V63 VanDerWaalsContact C-N 3.33Å; W61-V63 PolarHBondContact O-N 3.28Å; V63-S66 PolarHBondContact O-N 3.2Å; V63-I67 HydrophobicContact CG1-CD1 3.88Å; V63-I67 WeakPolarHBondContact O-CG1 3.44Å; V63-I67 PolarHBondContact O-N 3.48Å
64I95.9Very high92.3Very high28 Ų2873.1 Ų73.114%0.14437%0.366CS..Hα-helixtrans-68.4-42.7-178.2-62-57.2000111.5S60 W61 S66 I67 E68 G81 Y84 R85 I88S60-I64 VanDerWaalsContact O-CG1 3.32Å; S60-I64 WeakPolarHBondContact O-CG1 3.28Å; S60-I64 PolarHBondContact O-N 2.88Å; W61-I64 PolarHBondContact O-N 2.84Å; I64-S66 VanDerWaalsContact C-N 3.28Å; I64-S66 PolarHBondContact O-N 3.02Å; I64-I67 HydrophobicContact CD1-CD1 4.34Å; I64-I67 PolarHBondContact O-N 3.38Å; I64-I67 VanDerWaalsContact O-N 3.12Å; I64-E68 WeakPolarHBondContact O-CB 3.33Å; I64-E68 PolarHBondContact O-N 3.35Å; I64-G81 WeakPolarHBondContact CG2-O 3.36Å; I64-Y84 HydrophobicContact CD1-CD1 3.6Å; I64-Y84 HydrophobicContact CD1-CE1 3.84Å; I64-Y84 HydrophobicContact CG1-CD1 3.64Å; I64-Y84 HydrophobicContact CG1-CE1 3.93Å; I64-Y84 HydrophobicContact CG2-CD1 4.15Å; I64-R85 HydrophobicContact CG2-CB 3.93Å; I64-I88 HydrophobicContact CB-CD1 4.27Å; I64-I88 HydrophobicContact CG1-CD1 3.77Å
65S93.8Very high91.9Very high14 Ų1481 Ų8110%0.09840%0.403CS..Hα-helixtrans-56.8-41.3173.3-63.60000111.8W61 Q69 R85W61-S65 WeakPolarHBondContact O-CB 3.29Å; W61-S65 PolarHBondContact O-N 3.09Å; W61-S65 PolarHBondContact O-OG 3.03Å; S65-Q69 VanDerWaalsContact O-CG 3.3Å; S65-Q69 WeakPolarHBondContact O-CG 3.46Å; S65-Q69 PolarHBondContact O-N 3Å; S65-Q69 VanDerWaalsContact O-N 3.12Å; S65-R85 WeakPolarHBondContact OG-CD 3.47Å
66S93.2Very high91.5Very high42 Ų4287.3 Ų87.329%0.29442%0.423SS..Hα-helixtrans-67-39175.9-168.50000112.8R62 V63 I64 K70R62-S66 WeakPolarHBondContact O-CB 3.4Å; R62-S66 PolarHBondContact O-N 2.96Å; V63-S66 PolarHBondContact O-N 3.2Å; I64-S66 VanDerWaalsContact C-N 3.28Å; I64-S66 PolarHBondContact O-N 3.02Å; S66-K70 WeakPolarHBondContact O-CG 3.49Å; S66-K70 PolarHBondContact O-N 2.79Å; S66-K70 PolarHBondContact OG-NZ 3.39Å
67I91.7Very high91.1Very high86 Ų8691 Ų9144%0.44143%0.43SS..Hα-helixtrans-67-45176.9-69.6167.1000110.6V63 I64 Q69 K70 T71V63-I67 HydrophobicContact CG1-CD1 3.88Å; V63-I67 WeakPolarHBondContact O-CG1 3.44Å; V63-I67 PolarHBondContact O-N 3.48Å; I64-I67 HydrophobicContact CD1-CD1 4.34Å; I64-I67 PolarHBondContact O-N 3.38Å; I64-I67 VanDerWaalsContact O-N 3.12Å; I67-Q69 VanDerWaalsContact C-N 3.34Å; I67-Q69 PolarHBondContact O-N 3.19Å; I67-K70 PolarHBondContact O-N 3.04Å; I67-T71 WeakPolarHBondContact O-CB 3.45Å; I67-T71 PolarHBondContact O-N 3.17Å; I67-T71 PolarHBondContact O-OG1 2.92Å
68E89Confident90.7Very high31 Ų3192.3 Ų92.315%0.14544%0.439CS..Hα-helixtrans-56.1-48.8177.8-177.5-176.516500110.8I64 K70 T71 R85I64-E68 WeakPolarHBondContact O-CB 3.33Å; I64-E68 PolarHBondContact O-N 3.35Å; E68-K70 VanDerWaalsContact C-N 3.34Å; E68-K70 PolarHBondContact O-N 3.15Å; E68-T71 PolarHBondContact O-N 3.2Å; E68-R85 IonicContact OE1-CZ 3.98Å; E68-R85 IonicContact OE1-NE 3.68Å; E68-R85 IonicContact OE1-NH2 3.32Å; E68-R85 PolarHBondContact OE1-NH2 2.89Å; E68-R85 WeakPolarHBondContact OE2-CD 3.36Å; E68-R85 IonicContact OE2-CZ 3.63Å; E68-R85 IonicContact OE2-NE 2.7Å; E68-R85 PolarHBondContact OE2-NE 3.39Å; E68-R85 IonicContact OE2-NH2 3.67Å
69Q87.5Confident90.4Very high140 Ų14095.2 Ų95.265%0.65445%0.453SS*.Hα-helixtrans-61.6-36.6178.6-73.1173.2-3.400113.2S65 I67 T71 E72S65-Q69 VanDerWaalsContact O-CG 3.3Å; S65-Q69 WeakPolarHBondContact O-CG 3.46Å; S65-Q69 PolarHBondContact O-N 3Å; S65-Q69 VanDerWaalsContact O-N 3.12Å; I67-Q69 VanDerWaalsContact C-N 3.34Å; I67-Q69 PolarHBondContact O-N 3.19Å; Q69-T71 VanDerWaalsContact C-N 3.34Å; Q69-T71 PolarHBondContact O-N 2.8Å; Q69-E72 WeakPolarHBondContact O-CG 3.07Å
70K89.2Confident90.2Very high166 Ų16697.4 Ų97.472%0.72246%0.458SS*.Hα-helixtrans-81.9-8.8-178.1-69.4172-176.6168.80114.2S66 I67 E68 E72S66-K70 WeakPolarHBondContact O-CG 3.49Å; S66-K70 PolarHBondContact O-N 2.79Å; S66-K70 PolarHBondContact OG-NZ 3.39Å; I67-K70 PolarHBondContact O-N 3.04Å; E68-K70 VanDerWaalsContact C-N 3.34Å; E68-K70 PolarHBondContact O-N 3.15Å; K70-E72 PolarHBondContact O-N 2.79Å
71T81Confident90Very high34 Ų3495.1 Ų95.121%0.20944%0.444CS..  trans-95.923.4-168.7-57.30000113.9I67 E68 Q69 R73 N74 K77I67-T71 WeakPolarHBondContact O-CB 3.45Å; I67-T71 PolarHBondContact O-N 3.17Å; I67-T71 PolarHBondContact O-OG1 2.92Å; E68-T71 PolarHBondContact O-N 3.2Å; Q69-T71 VanDerWaalsContact C-N 3.34Å; Q69-T71 PolarHBondContact O-N 2.8Å; T71-R73 PolarHBondContact O-N 2.88Å; T71-N74 PolarHBondContact O-N 3.44Å; T71-K77 HydrophobicContact CG2-CB 3.33Å; T71-K77 HydrophobicContact CG2-CD 3.98Å; T71-K77 HydrophobicContact CG2-CG 4.32Å
72E74Confident89.8Confident159 Ų15997.2 Ų97.274%0.74345%0.454SS*.THydrogen-bonded Turntrans-50.4-25.3-170.9-59-179.2166.800116.3Q69 K70Q69-E72 WeakPolarHBondContact O-CG 3.07Å; K70-E72 PolarHBondContact O-N 2.79Å
73R80.1Confident89.8Confident256 Ų25697.3 Ų97.397%0.96646%0.459SS*.THydrogen-bonded Turntrans-85.2-4.5-174.6-62-174.6-178-1760.7115T71T71-R73 PolarHBondContact O-N 2.88Å
74N85.5Confident89.8Confident68 Ų6899.2 Ų99.236%0.36446%0.457SS..  trans-13899.9-176.8-173.1-44.3000111.5T71 K76 K77 Q78T71-N74 PolarHBondContact O-N 3.44Å; N74-K76 VanDerWaalsContact C-N 3.26Å; N74-K76 PolarHBondContact O-N 3.1Å; N74-K76 WeakPolarHBondContact OD1-CB 2.98Å; N74-K76 PolarHBondContact OD1-N 3.42Å; N74-K76 VanDerWaalsContact OD1-N 3.13Å; N74-K77 HydrophobicContact CB-CB 4.1Å; N74-K77 HydrophobicContact CB-CD 4.2Å; N74-K77 HydrophobicContact CB-CG 4.18Å; N74-K77 PolarHBondContact O-N 3.5Å; N74-K77 PolarHBondContact OD1-N 2.85Å; N74-Q78 PolarHBondContact O-N 2.68Å
75E88.3Confident89.8Confident167 Ų167100 Ų10078%0.7846%0.458SS*.Hα-helixtrans-52-41.9-179.7-65.3179.7171.600112.8K77 Q78 Q79E75-K77 PolarHBondContact O-N 3.18Å; E75-Q78 PolarHBondContact O-N 2.96Å; E75-Q79 WeakPolarHBondContact O-CB 3.35Å; E75-Q79 PolarHBondContact O-N 3.47Å
76K90.4Very high90Very high157 Ų157103.3 Ų103.368%0.68347%0.473SS*.Hα-helixtrans-64.3-43.8179.4-173.5179-179.1178.10111.6N74 M80N74-K76 VanDerWaalsContact C-N 3.26Å; N74-K76 PolarHBondContact O-N 3.1Å; N74-K76 WeakPolarHBondContact OD1-CB 2.98Å; N74-K76 PolarHBondContact OD1-N 3.42Å; N74-K76 VanDerWaalsContact OD1-N 3.13Å; K76-M80 HydrophobicContact CG-SD 4.45Å; K76-M80 VanDerWaalsContact O-CG 3.28Å; K76-M80 WeakPolarHBondContact O-CG 3.44Å; K76-M80 PolarHBondContact O-N 3.4Å
77K89.3Confident90.2Very high127 Ų127106.9 Ų106.955%0.55248%0.483SS*.Hα-helixtrans-69.8-35.6177.6-70.2-174.4175.6-173.70111.9T71 N74 E75 M80 G81T71-K77 HydrophobicContact CG2-CB 3.33Å; T71-K77 HydrophobicContact CG2-CD 3.98Å; T71-K77 HydrophobicContact CG2-CG 4.32Å; N74-K77 HydrophobicContact CB-CB 4.1Å; N74-K77 HydrophobicContact CB-CD 4.2Å; N74-K77 HydrophobicContact CB-CG 4.18Å; N74-K77 PolarHBondContact O-N 3.5Å; N74-K77 PolarHBondContact OD1-N 2.85Å; E75-K77 PolarHBondContact O-N 3.18Å; K77-M80 PolarHBondContact O-N 3.16Å; K77-G81 PolarHBondContact O-N 3.34Å
78Q90.3Very high90.5Very high86 Ų86103 Ų10340%0.40246%0.463SS..Hα-helixtrans-62.1-46.6174.5-172.4-178.719.600110.9N74 E75 M80 G81 K82N74-Q78 PolarHBondContact O-N 2.68Å; E75-Q78 PolarHBondContact O-N 2.96Å; Q78-M80 PolarHBondContact O-N 3.25Å; Q78-G81 PolarHBondContact O-N 2.87Å; Q78-K82 PolarHBondContact O-N 2.94Å
79Q92.6Very high90.9Very high89 Ų89103.3 Ų103.342%0.41646%0.464SS..Hα-helixtrans-61.2-44176.6-176.958.231.400112E75 G81 K82 E83E75-Q79 WeakPolarHBondContact O-CB 3.35Å; E75-Q79 PolarHBondContact O-N 3.47Å; Q79-G81 VanDerWaalsContact C-N 3.33Å; Q79-G81 PolarHBondContact O-N 3.35Å; Q79-K82 PolarHBondContact O-N 2.9Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.39Å; Q79-E83 PolarHBondContact NE2-OE1 3.41Å; Q79-E83 WeakPolarHBondContact O-CG 3.41Å; Q79-E83 PolarHBondContact O-N 3.18Å
80M93.4Very high91.4Very high112 Ų11299 Ų9955%0.55245%0.453SS*.Hα-helixtrans-61.5-40174.6-70.7174.568.300112.5K76 K77 Q78 Y84K76-M80 HydrophobicContact CG-SD 4.45Å; K76-M80 VanDerWaalsContact O-CG 3.28Å; K76-M80 WeakPolarHBondContact O-CG 3.44Å; K76-M80 PolarHBondContact O-N 3.4Å; K77-M80 PolarHBondContact O-N 3.16Å; Q78-M80 PolarHBondContact O-N 3.25Å; M80-Y84 WeakPolarHBondContact O-CB 3.36Å; M80-Y84 PolarHBondContact O-N 3Å; M80-Y84 VanDerWaalsContact O-N 3.12Å
81G93.6Very high91.8Very high11 Ų1194.2 Ų94.211%0.11343%0.433CS..Hα-helixtrans-62-47.4175.900000111.7I64 K77 Q78 Q79 Y84 R85I64-G81 WeakPolarHBondContact CG2-O 3.36Å; K77-G81 PolarHBondContact O-N 3.34Å; Q78-G81 PolarHBondContact O-N 2.87Å; Q79-G81 VanDerWaalsContact C-N 3.33Å; Q79-G81 PolarHBondContact O-N 3.35Å; G81-Y84 PolarHBondContact O-N 3.1Å; G81-R85 WeakPolarHBondContact O-CB 3.4Å; G81-R85 PolarHBondContact O-N 3.3Å
82K94.3Very high92.6Very high81 Ų8192.6 Ų92.635%0.35242%0.423SS..Hα-helixtrans-59.3-51176.7178.8176.6174.9-176.50112.5Q78 Q79 Y84 R85 E86Q78-K82 PolarHBondContact O-N 2.94Å; Q79-K82 PolarHBondContact O-N 2.9Å; K82-Y84 VanDerWaalsContact C-N 3.26Å; K82-Y84 PolarHBondContact O-N 3.42Å; K82-R85 WeakPolarHBondContact O-CB 3.33Å; K82-R85 PolarHBondContact O-N 2.91Å; K82-E86 WeakPolarHBondContact CE-OE1 3.33Å; K82-E86 HydrophobicContact CG-CG 4.49Å; K82-E86 IonicContact NZ-OE1 3.9Å; K82-E86 WeakPolarHBondContact O-CG 3.23Å; K82-E86 PolarHBondContact O-N 2.99Å
83E96.2Very high93.7Very high104 Ų10488.9 Ų88.949%0.48641%0.406SS..Hα-helixtrans-58.6-39.9179.1-74.8169.7-17000111.8Q79 K87Q79-E83 WeakPolarHBondContact CG-OE1 3.39Å; Q79-E83 PolarHBondContact NE2-OE1 3.41Å; Q79-E83 WeakPolarHBondContact O-CG 3.41Å; Q79-E83 PolarHBondContact O-N 3.18Å; E83-K87 PolarHBondContact O-N 3.39Å
84Y96.9Very high94.6Very high125 Ų12581.8 Ų81.849%0.4939%0.387SS..Hα-helixtrans-73.9-35.1178.8-161.8-119000112.4I64 M80 G81 K82 K87 I88I64-Y84 HydrophobicContact CD1-CD1 3.6Å; I64-Y84 HydrophobicContact CD1-CE1 3.84Å; I64-Y84 HydrophobicContact CG1-CD1 3.64Å; I64-Y84 HydrophobicContact CG1-CE1 3.93Å; I64-Y84 HydrophobicContact CG2-CD1 4.15Å; M80-Y84 WeakPolarHBondContact O-CB 3.36Å; M80-Y84 PolarHBondContact O-N 3Å; M80-Y84 VanDerWaalsContact O-N 3.12Å; G81-Y84 PolarHBondContact O-N 3.1Å; K82-Y84 VanDerWaalsContact C-N 3.26Å; K82-Y84 PolarHBondContact O-N 3.42Å; Y84-K87 HydrophobicContact CD2-CD 4.42Å; Y84-K87 HydrophobicContact CE2-CD 4.41Å; Y84-K87 PolarHBondContact O-N 2.74Å; Y84-I88 HydrophobicContact CD1-CD1 4.09Å; Y84-I88 HydrophobicContact CE1-CD1 4Å; Y84-I88 WeakPolarHBondContact O-CG1 3.41Å; Y84-I88 PolarHBondContact O-N 3.3Å
85R96.3Very high95.2Very high44 Ų4479.6 Ų79.617%0.16638%0.375CS..Hα-helixtrans-60.2-51.2170.9-177.4178.651.572.65.4110.8I64 S65 E68 G81 K82 K87 I88 E89I64-R85 HydrophobicContact CG2-CB 3.93Å; S65-R85 WeakPolarHBondContact OG-CD 3.47Å; E68-R85 IonicContact OE1-CZ 3.98Å; E68-R85 IonicContact OE1-NE 3.68Å; E68-R85 IonicContact OE1-NH2 3.32Å; E68-R85 PolarHBondContact OE1-NH2 2.89Å; E68-R85 WeakPolarHBondContact OE2-CD 3.36Å; E68-R85 IonicContact OE2-CZ 3.63Å; E68-R85 IonicContact OE2-NE 2.7Å; E68-R85 PolarHBondContact OE2-NE 3.39Å; E68-R85 IonicContact OE2-NH2 3.67Å; G81-R85 WeakPolarHBondContact O-CB 3.4Å; G81-R85 PolarHBondContact O-N 3.3Å; K82-R85 WeakPolarHBondContact O-CB 3.33Å; K82-R85 PolarHBondContact O-N 2.91Å; R85-K87 VanDerWaalsContact C-N 3.26Å; R85-K87 PolarHBondContact O-N 3.45Å; R85-I88 PolarHBondContact O-N 3.03Å; R85-E89 HydrophobicContact CG-CG 4.41Å; R85-E89 WeakPolarHBondContact CG-OE1 3.38Å; R85-E89 IonicContact CZ-OE1 3.72Å; R85-E89 IonicContact NE-OE1 4Å; R85-E89 VanDerWaalsContact NH1-CD 3.28Å; R85-E89 IonicContact NH1-OE1 2.71Å; R85-E89 PolarHBondContact NH1-OE1 2.8Å; R85-E89 IonicContact NH1-OE2 3.15Å; R85-E89 PolarHBondContact NH1-OE2 2.88Å; R85-E89 VanDerWaalsContact NH1-OE2 3.15Å; R85-E89 WeakPolarHBondContact O-CG 3.17Å; R85-E89 PolarHBondContact O-N 2.89Å
86E96.4Very high95.7Very high85 Ų8571.7 Ų71.740%0.39734%0.338SS..Hα-helixtrans-60.2-35.9-180-72.7173.9173.900111.9K82 E89 A90K82-E86 WeakPolarHBondContact CE-OE1 3.33Å; K82-E86 HydrophobicContact CG-CG 4.49Å; K82-E86 IonicContact NZ-OE1 3.9Å; K82-E86 WeakPolarHBondContact O-CG 3.23Å; K82-E86 PolarHBondContact O-N 2.99Å; E86-E89 PolarHBondContact O-N 2.84Å; E86-A90 PolarHBondContact O-N 3.5Å
87K98.1Very high96.1Very high116 Ų11666.3 Ų66.350%0.50432%0.321SS..Hα-helixtrans-60.6-46.7171.7-176.4-175.9175.3-174.50112.1E83 Y84 R85 E89 A90 E91E83-K87 PolarHBondContact O-N 3.39Å; Y84-K87 HydrophobicContact CD2-CD 4.42Å; Y84-K87 HydrophobicContact CE2-CD 4.41Å; Y84-K87 PolarHBondContact O-N 2.74Å; R85-K87 VanDerWaalsContact C-N 3.26Å; R85-K87 PolarHBondContact O-N 3.45Å; K87-E89 VanDerWaalsContact C-N 3.31Å; K87-A90 PolarHBondContact O-N 3.45Å; K87-E91 VanDerWaalsContact CE-OE1 3.29Å; K87-E91 WeakPolarHBondContact CE-OE1 3.4Å; K87-E91 WeakPolarHBondContact O-CG 3.43Å; K87-E91 PolarHBondContact O-N 3.11Å
88I98.1Very high96.5Very high4 Ų463 Ų632%0.02131%0.309CS..Hα-helixtrans-66.3-37.2179.4-62.9162.9000110.6R57 W61 I64 Y84 R85 E91 L92R57-I88 HydrophobicContact CB-CG2 4.28Å; R57-I88 HydrophobicContact CG-CG2 4.49Å; R57-I88 VanDerWaalsContact O-CG2 3.31Å; R57-I88 WeakPolarHBondContact O-CG2 3.39Å; W61-I88 HydrophobicContact CB-CG2 3.75Å; I64-I88 HydrophobicContact CB-CD1 4.27Å; I64-I88 HydrophobicContact CG1-CD1 3.77Å; Y84-I88 HydrophobicContact CD1-CD1 4.09Å; Y84-I88 HydrophobicContact CE1-CD1 4Å; Y84-I88 WeakPolarHBondContact O-CG1 3.41Å; Y84-I88 PolarHBondContact O-N 3.3Å; R85-I88 PolarHBondContact O-N 3.03Å; I88-E91 PolarHBondContact O-N 2.95Å; I88-L92 WeakPolarHBondContact O-CB 3.5Å; I88-L92 PolarHBondContact O-N 3.29Å
89E97.6Very high96.9Very high38 Ų3859 Ų5918%0.17829%0.291CS..Hα-helixtrans-61.4-42.8175-68.8172.2175.900111.7W61 R85 E86 K87 L92 Q93 V134W61-E89 PolarHBondContact NE1-OE1 3.5Å; R85-E89 HydrophobicContact CG-CG 4.41Å; R85-E89 WeakPolarHBondContact CG-OE1 3.38Å; R85-E89 IonicContact CZ-OE1 3.72Å; R85-E89 IonicContact NE-OE1 4Å; R85-E89 VanDerWaalsContact NH1-CD 3.28Å; R85-E89 IonicContact NH1-OE1 2.71Å; R85-E89 PolarHBondContact NH1-OE1 2.8Å; R85-E89 IonicContact NH1-OE2 3.15Å; R85-E89 PolarHBondContact NH1-OE2 2.88Å; R85-E89 VanDerWaalsContact NH1-OE2 3.15Å; R85-E89 WeakPolarHBondContact O-CG 3.17Å; R85-E89 PolarHBondContact O-N 2.89Å; E86-E89 PolarHBondContact O-N 2.84Å; K87-E89 VanDerWaalsContact C-N 3.31Å; E89-L92 PolarHBondContact O-N 3.47Å; E89-Q93 WeakPolarHBondContact O-CB 3.48Å; E89-Q93 PolarHBondContact O-N 2.87Å; E89-V134 HydrophobicContact CG-CB 4.09Å; E89-V134 HydrophobicContact CG-CG1 4.47Å
90A97.5Very high97.2Very high51 Ų5155.5 Ų55.542%0.42127%0.274SS..Hα-helixtrans-62.5-46.3174.200000112E86 K87 L92 Q93 D94E86-A90 PolarHBondContact O-N 3.5Å; K87-A90 PolarHBondContact O-N 3.45Å; A90-L92 VanDerWaalsContact C-N 3.33Å; A90-L92 PolarHBondContact O-N 2.98Å; A90-Q93 WeakPolarHBondContact O-CB 3.48Å; A90-Q93 PolarHBondContact O-N 3.29Å; A90-D94 PolarHBondContact O-N 3.49Å
91E98.2Very high97.4Very high64 Ų6454.3 Ų54.330%0.29927%0.267SS..Hα-helixtrans-59-44.4175.3-69.8177.4-16200111.7R57 K87 I88 D94 I95R57-E91 HydrophobicContact CG-CB 4.2Å; R57-E91 IonicContact NE-OE2 3.52Å; R57-E91 PolarHBondContact NE-OE2 3.44Å; K87-E91 VanDerWaalsContact CE-OE1 3.29Å; K87-E91 WeakPolarHBondContact CE-OE1 3.4Å; K87-E91 WeakPolarHBondContact O-CG 3.43Å; K87-E91 PolarHBondContact O-N 3.11Å; I88-E91 PolarHBondContact O-N 2.95Å; E91-D94 PolarHBondContact O-N 3.29Å; E91-I95 VanDerWaalsContact O-CD1 3.26Å; E91-I95 WeakPolarHBondContact O-CD1 3.27Å; E91-I95 WeakPolarHBondContact O-CG1 3.25Å; E91-I95 PolarHBondContact O-N 3.31Å
92L97.9Very high97.6Very high0 Ų053.9 Ų53.90%026%0.263CS..Hα-helixtrans-62.9-42.5177.5-17668.4000111.5V54 R57 R58 I88 E89 A90 I95 C96 V134V54-L92 HydrophobicContact CB-CD1 4.37Å; V54-L92 HydrophobicContact CG1-CD1 3.68Å; V54-L92 HydrophobicContact CG2-CD1 4.31Å; R57-L92 HydrophobicContact CB-CD1 4.2Å; R58-L92 HydrophobicContact CG-CD1 3.89Å; R58-L92 HydrophobicContact CG-CD2 4.23Å; I88-L92 WeakPolarHBondContact O-CB 3.5Å; I88-L92 PolarHBondContact O-N 3.29Å; E89-L92 PolarHBondContact O-N 3.47Å; A90-L92 VanDerWaalsContact C-N 3.33Å; A90-L92 PolarHBondContact O-N 2.98Å; L92-I95 PolarHBondContact O-N 3.3Å; L92-C96 WeakPolarHBondContact O-CB 3.38Å; L92-C96 PolarHBondContact O-N 3.41Å; L92-C96 PolarHBondContact O-SG 2.82Å; L92-V134 HydrophobicContact CD2-CB 4.38Å; L92-V134 HydrophobicContact CD2-CG1 3.56Å; L92-V134 HydrophobicContact CD2-CG2 3.89Å
93Q97.6Very high97.8Very high82 Ų8250 Ų5038%0.38325%0.246SC..Hα-helixtrans-60.1-45.6176.3-178.866.84600111.2E89 A90 C96 S97 L131E89-Q93 WeakPolarHBondContact O-CB 3.48Å; E89-Q93 PolarHBondContact O-N 2.87Å; A90-Q93 WeakPolarHBondContact O-CB 3.48Å; A90-Q93 PolarHBondContact O-N 3.29Å; Q93-C96 PolarHBondContact O-N 3.45Å; Q93-S97 PolarHBondContact NE2-OG 3.41Å; Q93-S97 VanDerWaalsContact NE2-OG 3.14Å; Q93-S97 VanDerWaalsContact O-CB 3.26Å; Q93-S97 WeakPolarHBondContact O-CB 3.49Å; Q93-S97 PolarHBondContact O-N 3.43Å; Q93-S97 PolarHBondContact O-OG 2.93Å; Q93-L131 HydrophobicContact CB-CD2 4.49Å; Q93-L131 VanDerWaalsContact OE1-CD2 3.24Å
94D98.2Very high97.9Very high107 Ų10748.1 Ų48.157%0.57224%0.239SC*.Hα-helixtrans-62.6-49.1179.2-70.3-17.5000111A90 E91 C96 S97 D98A90-D94 PolarHBondContact O-N 3.49Å; E91-D94 PolarHBondContact O-N 3.29Å; D94-C96 PolarHBondContact O-N 2.95Å; D94-S97 PolarHBondContact O-N 3.25Å; D94-D98 WeakPolarHBondContact O-CB 3.48Å; D94-D98 PolarHBondContact O-N 3.45Å
95I98.4Very high98Very high22 Ų2247.6 Ų47.611%0.11324%0.239CC..Hα-helixtrans-61.9-45.6179.7-61154.1000111.2Y50 V53 V54 R57 E91 L92 D98 V99Y50-I95 HydrophobicContact CD1-CG2 3.91Å; Y50-I95 HydrophobicContact CE1-CG2 4.28Å; V53-I95 HydrophobicContact CG1-CD1 3.62Å; V53-I95 HydrophobicContact CG1-CG1 3.96Å; V53-I95 HydrophobicContact CG1-CG2 3.87Å; V54-I95 HydrophobicContact CG2-CB 4.09Å; V54-I95 HydrophobicContact CG2-CG2 3.33Å; R57-I95 HydrophobicContact CG-CD1 3.96Å; E91-I95 VanDerWaalsContact O-CD1 3.26Å; E91-I95 WeakPolarHBondContact O-CD1 3.27Å; E91-I95 WeakPolarHBondContact O-CG1 3.25Å; E91-I95 PolarHBondContact O-N 3.31Å; L92-I95 PolarHBondContact O-N 3.3Å; I95-D98 WeakPolarHBondContact O-CB 3.45Å; I95-D98 PolarHBondContact O-N 3.28Å; I95-V99 WeakPolarHBondContact O-CG2 3.42Å; I95-V99 PolarHBondContact O-N 2.96Å
96C98.4Very high98.1Very high0 Ų048.7 Ų48.70%024%0.244CC..Hα-helixtrans-64.9-41.6178.4-73.10000111.5L92 Q93 D94 D98 V99 L100 Y127 L131L92-C96 WeakPolarHBondContact O-CB 3.38Å; L92-C96 PolarHBondContact O-N 3.41Å; L92-C96 PolarHBondContact O-SG 2.82Å; Q93-C96 PolarHBondContact O-N 3.45Å; D94-C96 PolarHBondContact O-N 2.95Å; C96-D98 VanDerWaalsContact C-N 3.34Å; C96-D98 PolarHBondContact O-N 3.49Å; C96-V99 PolarHBondContact O-N 3.18Å; C96-L100 WeakPolarHBondContact O-CB 3.4Å; C96-L100 WeakPolarHBondContact O-CD1 3.16Å; C96-L100 WeakPolarHBondContact O-CG 3.3Å; C96-L100 PolarHBondContact O-N 2.95Å; C96-Y127 HydrophobicContact CB-CD1 4.29Å; C96-L131 HydrophobicContact CB-CD1 3.96Å; C96-L131 HydrophobicContact CB-CD2 3.53Å; C96-L131 HydrophobicContact CB-CG 3.71Å
97S98.1Very high98.2Very high45 Ų4544.9 Ų44.932%0.31523%0.226SC..Hα-helixtrans-63.3-42.5179.2-56.70000111.2Q93 D94 V99 L100 E101Q93-S97 PolarHBondContact NE2-OG 3.41Å; Q93-S97 VanDerWaalsContact NE2-OG 3.14Å; Q93-S97 VanDerWaalsContact O-CB 3.26Å; Q93-S97 WeakPolarHBondContact O-CB 3.49Å; Q93-S97 PolarHBondContact O-N 3.43Å; Q93-S97 PolarHBondContact O-OG 2.93Å; D94-S97 PolarHBondContact O-N 3.25Å; S97-V99 PolarHBondContact O-N 3.47Å; S97-L100 PolarHBondContact O-N 3.48Å; S97-E101 WeakPolarHBondContact O-CB 3.43Å; S97-E101 PolarHBondContact O-N 3.4Å
98D98.1Very high98.2Very high58 Ų5840.7 Ų40.731%0.3121%0.209SC..Hα-helixtrans-54.8-49.4173.9-99.810.3000111.9K29 D94 I95 C96 E101 L102K29-D98 IonicContact NZ-OD1 3.96Å; K29-D98 PolarHBondContact NZ-OD1 3.32Å; K29-D98 IonicContact NZ-OD2 2.63Å; K29-D98 PolarHBondContact NZ-OD2 2.87Å; D94-D98 WeakPolarHBondContact O-CB 3.48Å; D94-D98 PolarHBondContact O-N 3.45Å; I95-D98 WeakPolarHBondContact O-CB 3.45Å; I95-D98 PolarHBondContact O-N 3.28Å; C96-D98 VanDerWaalsContact C-N 3.34Å; C96-D98 PolarHBondContact O-N 3.49Å; D98-E101 PolarHBondContact O-N 2.84Å; D98-L102 WeakPolarHBondContact O-CG 3.01Å; D98-L102 PolarHBondContact O-N 3.42Å; D98-L102 VanDerWaalsContact O-N 3.13Å
99V98.3Very high98Very high2 Ų246.7 Ų46.71%0.01224%0.24CC..Hα-helixtrans-66.9-43.4179.5175.60000112.1Y50 I95 C96 S97 E101 L102 L103 M123 Y127Y50-V99 HydrophobicContact CD1-CG2 3.01Å; Y50-V99 HydrophobicContact CD2-CG2 3.7Å; Y50-V99 HydrophobicContact CE1-CG2 3.24Å; Y50-V99 HydrophobicContact CE2-CG2 3.91Å; Y50-V99 HydrophobicContact CG-CG2 3.22Å; I95-V99 WeakPolarHBondContact O-CG2 3.42Å; I95-V99 PolarHBondContact O-N 2.96Å; C96-V99 PolarHBondContact O-N 3.18Å; S97-V99 PolarHBondContact O-N 3.47Å; V99-E101 VanDerWaalsContact C-N 3.27Å; V99-E101 PolarHBondContact O-N 3.13Å; V99-L102 PolarHBondContact O-N 2.9Å; V99-L103 HydrophobicContact CG1-CD1 3.73Å; V99-L103 HydrophobicContact CG1-CG 4.16Å; V99-L103 WeakPolarHBondContact O-CB 3.4Å; V99-L103 VanDerWaalsContact O-CG 3.26Å; V99-L103 WeakPolarHBondContact O-CG 3.34Å; V99-L103 PolarHBondContact O-N 3.41Å; V99-M123 HydrophobicContact CG1-CE 3.67Å; V99-Y127 HydrophobicContact CB-CD1 4.11Å; V99-Y127 HydrophobicContact CB-CD2 4.38Å; V99-Y127 HydrophobicContact CB-CE1 4.11Å; V99-Y127 HydrophobicContact CB-CE2 4.48Å; V99-Y127 HydrophobicContact CB-CG 4.27Å; V99-Y127 HydrophobicContact CG1-CD1 4.18Å; V99-Y127 HydrophobicContact CG1-CD2 3.6Å; V99-Y127 HydrophobicContact CG1-CE1 4.1Å; V99-Y127 HydrophobicContact CG1-CE2 3.61Å; V99-Y127 HydrophobicContact CG1-CG 3.97Å; V99-Y127 HydrophobicContact CG2-CD1 4.27Å; V99-Y127 HydrophobicContact CG2-CE1 3.82Å
100L98.7Very high97.8Very high14 Ų1448 Ų487%0.07325%0.249CC..Hα-helixtrans-62.2-38.2179.9-71.6169.2000111C96 S97 L103 D104 K124 F128 L131C96-L100 WeakPolarHBondContact O-CB 3.4Å; C96-L100 WeakPolarHBondContact O-CD1 3.16Å; C96-L100 WeakPolarHBondContact O-CG 3.3Å; C96-L100 PolarHBondContact O-N 2.95Å; S97-L100 PolarHBondContact O-N 3.48Å; L100-L103 HydrophobicContact CD2-CD1 4.43Å; L100-L103 PolarHBondContact O-N 2.81Å; L100-D104 WeakPolarHBondContact O-CB 3.47Å; L100-D104 PolarHBondContact O-N 2.71Å; L100-K124 HydrophobicContact CD2-CB 4.48Å; L100-K124 HydrophobicContact CD2-CG 3.79Å; L100-F128 HydrophobicContact CD1-CD1 4.03Å; L100-F128 HydrophobicContact CD1-CD2 4.43Å; L100-F128 HydrophobicContact CD1-CE1 3.69Å; L100-F128 HydrophobicContact CD1-CE2 4.12Å; L100-F128 HydrophobicContact CD1-CG 4.38Å; L100-F128 HydrophobicContact CD1-CZ 3.74Å; L100-F128 HydrophobicContact CD2-CD2 3.72Å; L100-F128 HydrophobicContact CD2-CE2 3.5Å; L100-F128 HydrophobicContact CD2-CG 4.34Å; L100-F128 HydrophobicContact CD2-CZ 3.97Å; L100-F128 HydrophobicContact CG-CE2 4.41Å; L100-F128 HydrophobicContact CG-CZ 4.41Å; L100-L131 HydrophobicContact CD1-CD1 3.81Å
101E98.5Very high97.7Very high87 Ų8746.5 Ų46.541%0.40724%0.236SC..Hα-helixtrans-63.6-44.1173.4-176.8173.1-174.500111.9S97 D98 V99 L103 D104 K105S97-E101 WeakPolarHBondContact O-CB 3.43Å; S97-E101 PolarHBondContact O-N 3.4Å; D98-E101 PolarHBondContact O-N 2.84Å; V99-E101 VanDerWaalsContact C-N 3.27Å; V99-E101 PolarHBondContact O-N 3.13Å; E101-L103 VanDerWaalsContact C-N 3.34Å; E101-L103 PolarHBondContact O-N 3Å; E101-D104 PolarHBondContact O-N 3.01Å; E101-K105 HydrophobicContact CG-CD 3.71Å; E101-K105 HydrophobicContact CG-CG 4.26Å; E101-K105 VanDerWaalsContact O-CB 3.29Å; E101-K105 WeakPolarHBondContact O-CB 3.36Å; E101-K105 WeakPolarHBondContact O-CG 3.44Å; E101-K105 PolarHBondContact O-N 3.46Å; E101-K105 WeakPolarHBondContact OE1-CE 3.32Å; E101-K105 IonicContact OE1-NZ 3.58Å; E101-K105 PolarHBondContact OE1-NZ 3.36Å
102L98.6Very high97.5Very high3 Ų348.2 Ų48.22%0.01625%0.251CS..Hα-helixtrans-61.3-43.7175.4-67.7175.8000112.2K29 T32 E33 L46 Y50 D98 V99 Y106 L107K29-L102 HydrophobicContact CB-CD1 4.11Å; K29-L102 HydrophobicContact CG-CD1 3.99Å; K29-L102 HydrophobicContact CG-CD2 4.12Å; T32-L102 HydrophobicContact CG2-CB 4.17Å; T32-L102 HydrophobicContact CG2-CD2 3.95Å; T32-L102 HydrophobicContact CG2-CG 4.48Å; E33-L102 HydrophobicContact CG-CD2 3.76Å; L46-L102 HydrophobicContact CD1-CD1 4.47Å; Y50-L102 HydrophobicContact CE2-CD1 4.01Å; D98-L102 WeakPolarHBondContact O-CG 3.01Å; D98-L102 PolarHBondContact O-N 3.42Å; D98-L102 VanDerWaalsContact O-N 3.13Å; V99-L102 PolarHBondContact O-N 2.9Å; L102-Y106 HydrophobicContact CD2-CD2 4.03Å; L102-Y106 HydrophobicContact CD2-CE2 4.27Å; L102-Y106 PolarHBondContact O-N 3.02Å; L102-L107 HydrophobicContact CB-CD1 4.46Å; L102-L107 PolarHBondContact O-N 2.96Å
103L98.7Very high97.4Very high0 Ų054.3 Ų54.30%028%0.279CS..Iπ-helixtrans-59.8-49.3178-72.9167.5000111.1V99 L100 E101 L107 I108 Y120 M123 K124V99-L103 HydrophobicContact CG1-CD1 3.73Å; V99-L103 HydrophobicContact CG1-CG 4.16Å; V99-L103 WeakPolarHBondContact O-CB 3.4Å; V99-L103 VanDerWaalsContact O-CG 3.26Å; V99-L103 WeakPolarHBondContact O-CG 3.34Å; V99-L103 PolarHBondContact O-N 3.41Å; L100-L103 HydrophobicContact CD2-CD1 4.43Å; L100-L103 PolarHBondContact O-N 2.81Å; E101-L103 VanDerWaalsContact C-N 3.34Å; E101-L103 PolarHBondContact O-N 3Å; L103-L107 HydrophobicContact CD2-CB 4.41Å; L103-L107 HydrophobicContact CD2-CD1 3.83Å; L103-L107 HydrophobicContact CG-CD1 4.37Å; L103-L107 PolarHBondContact O-N 3.36Å; L103-I108 HydrophobicContact CB-CD1 4.08Å; L103-I108 HydrophobicContact CB-CG1 4.49Å; L103-I108 WeakPolarHBondContact O-CB 3.38Å; L103-I108 WeakPolarHBondContact O-CG1 3.49Å; L103-I108 PolarHBondContact O-N 3.42Å; L103-Y120 HydrophobicContact CD2-CD1 3.88Å; L103-Y120 HydrophobicContact CD2-CG 4.17Å; L103-M123 HydrophobicContact CD1-CB 4.33Å; L103-M123 HydrophobicContact CD1-CG 4.18Å; L103-M123 HydrophobicContact CD2-CB 4.26Å; L103-M123 HydrophobicContact CD2-CG 4.37Å; L103-M123 HydrophobicContact CD2-SD 4.13Å; L103-K124 HydrophobicContact CD1-CB 3.97Å
104D98.2Very high97.3Very high63 Ų6351.8 Ų51.834%0.33727%0.273SS..Iπ-helixtrans-76.1-36.7-174.4-75.6-12.7000113.2L100 E101 L109 K124L100-D104 WeakPolarHBondContact O-CB 3.47Å; L100-D104 PolarHBondContact O-N 2.71Å; E101-D104 PolarHBondContact O-N 3.01Å; D104-L109 WeakPolarHBondContact O-CD1 3.4Å; D104-L109 VanDerWaalsContact O-CG 3.3Å; D104-L109 WeakPolarHBondContact O-CG 3.43Å; D104-K124 VanDerWaalsContact OD1-CE 3.29Å; D104-K124 WeakPolarHBondContact OD1-CE 3.37Å; D104-K124 IonicContact OD1-NZ 3.76Å; D104-K124 PolarHBondContact OD1-NZ 3.22Å; D104-K124 IonicContact OD2-NZ 3.25Å; D104-K124 PolarHBondContact OD2-NZ 3.48Å
105K97.7Very high97.3Very high115 Ų11549.4 Ų49.450%0.526%0.258SS..Iπ-helixtrans-87.5-32.4-175.8-67.4-173.7179.3178.60114.1E101E101-K105 HydrophobicContact CG-CD 3.71Å; E101-K105 HydrophobicContact CG-CG 4.26Å; E101-K105 VanDerWaalsContact O-CB 3.29Å; E101-K105 WeakPolarHBondContact O-CB 3.36Å; E101-K105 WeakPolarHBondContact O-CG 3.44Å; E101-K105 PolarHBondContact O-N 3.46Å; E101-K105 WeakPolarHBondContact OE1-CE 3.32Å; E101-K105 IonicContact OE1-NZ 3.58Å; E101-K105 PolarHBondContact OE1-NZ 3.36Å
106Y98Very high97.2Very high67 Ų6748.5 Ų48.526%0.26325%0.254SS..Iπ-helixtrans-125.4-32.1-167.5-58.5-84.3000114.4T32 E33 L102 N110T32-Y106 HydrophobicContact CG2-CG 4.32Å; E33-Y106 HydrophobicContact CG-CE2 4.03Å; L102-Y106 HydrophobicContact CD2-CD2 4.03Å; L102-Y106 HydrophobicContact CD2-CE2 4.27Å; L102-Y106 PolarHBondContact O-N 3.02Å; Y106-N110 WeakPolarHBondContact O-CB 3.26Å; Y106-N110 PolarHBondContact O-ND2 2.99Å
107L98.4Very high97.2Very high5 Ų551.9 Ų51.93%0.02627%0.268CS..Iπ-helixtrans-99.2-55-168.8-59.5168.9000112.7T32 L38 L46 L102 L103 L109 N110 A111 Y120T32-L107 HydrophobicContact CG2-CD1 4.07Å; T32-L107 HydrophobicContact CG2-CD2 3.64Å; T32-L107 HydrophobicContact CG2-CG 3.74Å; L38-L107 HydrophobicContact CD1-CD2 3.6Å; L38-L107 HydrophobicContact CG-CD2 3.8Å; L46-L107 HydrophobicContact CD2-CD1 3.46Å; L46-L107 VanDerWaalsContact CD2-CD1 3.46Å; L102-L107 HydrophobicContact CB-CD1 4.46Å; L102-L107 PolarHBondContact O-N 2.96Å; L103-L107 HydrophobicContact CD2-CB 4.41Å; L103-L107 HydrophobicContact CD2-CD1 3.83Å; L103-L107 HydrophobicContact CG-CD1 4.37Å; L103-L107 PolarHBondContact O-N 3.36Å; L107-L109 PolarHBondContact O-N 2.99Å; L107-N110 PolarHBondContact O-N 2.86Å; L107-A111 WeakPolarHBondContact O-CB 3.47Å; L107-A111 PolarHBondContact O-N 3.43Å; L107-Y120 HydrophobicContact CB-CD1 3.89Å; L107-Y120 HydrophobicContact CB-CD2 3.8Å; L107-Y120 HydrophobicContact CB-CE1 3.96Å; L107-Y120 HydrophobicContact CB-CE2 3.89Å; L107-Y120 HydrophobicContact CB-CG 3.84Å; L107-Y120 HydrophobicContact CD1-CD1 4.07Å; L107-Y120 HydrophobicContact CD1-CE1 3.98Å; L107-Y120 HydrophobicContact CD2-CE1 4Å; L107-Y120 HydrophobicContact CD2-CE2 4.44Å; L107-Y120 HydrophobicContact CG-CD1 4.45Å; L107-Y120 HydrophobicContact CG-CE1 4.2Å
108I98Very high97.2Very high27 Ų2749.7 Ų49.714%0.13825%0.253CS..THydrogen-bonded Turntrans-66.2-40.1-177.9-65.7169.6000110.6L103 N110 L121 K124L103-I108 HydrophobicContact CB-CD1 4.08Å; L103-I108 HydrophobicContact CB-CG1 4.49Å; L103-I108 WeakPolarHBondContact O-CB 3.38Å; L103-I108 WeakPolarHBondContact O-CG1 3.49Å; L103-I108 PolarHBondContact O-N 3.42Å; I108-N110 VanDerWaalsContact C-N 3.34Å; I108-N110 PolarHBondContact O-N 3.28Å; I108-L121 HydrophobicContact CD1-CD2 4.04Å; I108-L121 HydrophobicContact CG2-CD2 4.46Å; I108-K124 HydrophobicContact CD1-CB 4.4Å; I108-K124 HydrophobicContact CD1-CD 3.8Å
109L94.3Very high97.2Very high130 Ų13048.2 Ų48.268%0.68124%0.244SC*.THydrogen-bonded Turntrans-67.3-33.2179.6-69177.2000113.2D104 L107D104-L109 WeakPolarHBondContact O-CD1 3.4Å; D104-L109 VanDerWaalsContact O-CG 3.3Å; D104-L109 WeakPolarHBondContact O-CG 3.43Å; L107-L109 PolarHBondContact O-N 2.99Å
110N93.2Very high97.3Very high67 Ų6748.2 Ų48.236%0.35824%0.244SC..THydrogen-bonded Turntrans-98.7-0.7-177-64.2-39.2000113.4Y106 L107 I108 T112Y106-N110 WeakPolarHBondContact O-CB 3.26Å; Y106-N110 PolarHBondContact O-ND2 2.99Å; L107-N110 PolarHBondContact O-N 2.86Å; I108-N110 VanDerWaalsContact C-N 3.34Å; I108-N110 PolarHBondContact O-N 3.28Å; N110-T112 PolarHBondContact O-N 3.45Å
111A96Very high97.3Very high18 Ų1847.7 Ų47.715%0.14924%0.241CC..  trans-69.6112.2179.200000110.6E37 L107 K117 Y120E37-A111 WeakPolarHBondContact OE1-CA 3.5Å; L107-A111 WeakPolarHBondContact O-CB 3.47Å; L107-A111 PolarHBondContact O-N 3.43Å; A111-K117 HydrophobicContact CB-CB 4.08Å; A111-Y120 HydrophobicContact CB-CD2 4.02Å; A111-Y120 HydrophobicContact CB-CE2 4.15Å
112T94.8Very high97.3Very high101 Ų10145.3 Ų45.362%0.6223%0.229SC*.  trans-89.2-27.6-178.858.10000112.6E37 N110E37-T112 VanDerWaalsContact CD-OG1 3.31Å; E37-T112 PolarHBondContact OE1-N 2.86Å; E37-T112 PolarHBondContact OE1-OG1 2.96Å; E37-T112 VanDerWaalsContact OE2-CG2 3.31Å; E37-T112 WeakPolarHBondContact OE2-CG2 3.38Å; E37-T112 PolarHBondContact OE2-OG1 3.47Å; N110-T112 PolarHBondContact O-N 3.45Å
113H95.4Very high97.3Very high127 Ų12745.5 Ų45.559%0.58823%0.23SC*.SBendtrans-100143.3179.5-62.5-66.2000112.5E115 S116 K117H113-E115 PolarHBondContact O-N 2.95Å; H113-S116 PolarHBondContact O-N 3.44Å; H113-K117 PolarHBondContact O-N 2.88Å
114A96Very high97.3Very high30 Ų3047.6 Ų47.625%0.24824%0.239CC..Hα-helixtrans-55.4-39.3176.600000112K117 V118 I157 E161A114-K117 PolarHBondContact O-N 3.03Å; A114-V118 WeakPolarHBondContact O-CB 3.35Å; A114-V118 VanDerWaalsContact O-CG2 3.29Å; A114-V118 WeakPolarHBondContact O-CG2 3.47Å; A114-V118 PolarHBondContact O-N 2.75Å; A114-I157 HydrophobicContact CB-CG2 4.11Å; A114-E161 HydrophobicContact CB-CB 3.67Å; A114-E161 HydrophobicContact CB-CG 3.98Å
115E96.5Very high97.3Very high56 Ų5644.6 Ų44.626%0.26222%0.223SC..Hα-helixtrans-57.4-52.4176.8-170.3-167120.300112.1R43 H113 K117 V118 F119 H166 I168R43-E115 IonicContact CZ-OE1 2.8Å; R43-E115 VanDerWaalsContact CZ-OE1 3.29Å; R43-E115 IonicContact NH1-OE1 2.94Å; R43-E115 PolarHBondContact NH1-OE1 3.35Å; R43-E115 IonicContact NH2-OE1 2.76Å; R43-E115 PolarHBondContact NH2-OE1 3.03Å; H113-E115 PolarHBondContact O-N 2.95Å; E115-K117 VanDerWaalsContact C-N 3.33Å; E115-K117 PolarHBondContact O-N 3.09Å; E115-V118 PolarHBondContact O-N 3.31Å; E115-F119 WeakPolarHBondContact O-CB 3.46Å; E115-F119 PolarHBondContact O-N 3.15Å; E115-H166 IonicContact OE2-CE1 2.89Å; E115-H166 IonicContact OE2-NE2 3.5Å; E115-I168 HydrophobicContact CG-CD1 3.34Å; E115-I168 WeakPolarHBondContact OE1-CD1 3.38Å
116S97.7Very high97.4Very high4 Ų439.5 Ų39.53%0.02820%0.201CC..Hα-helixtrans-60.7-43.2177.8-65.40000111.3H113 F119 Y120H113-S116 PolarHBondContact O-N 3.44Å; S116-F119 WeakPolarHBondContact O-CB 3.47Å; S116-F119 PolarHBondContact O-N 3.43Å; S116-Y120 WeakPolarHBondContact O-CD2 3.44Å; S116-Y120 VanDerWaalsContact O-CG 3.29Å; S116-Y120 PolarHBondContact O-N 3.41Å
117K98.1Very high97.4Very high70 Ų7036.6 Ų36.630%0.30419%0.19SC..Hα-helixtrans-62.9-46179.2-171.3168.7178.6-1770112A111 H113 A114 E115 F119 Y120 L121 E153 I157A111-K117 HydrophobicContact CB-CB 4.08Å; H113-K117 PolarHBondContact O-N 2.88Å; A114-K117 PolarHBondContact O-N 3.03Å; E115-K117 VanDerWaalsContact C-N 3.33Å; E115-K117 PolarHBondContact O-N 3.09Å; K117-F119 VanDerWaalsContact C-N 3.35Å; K117-Y120 PolarHBondContact O-N 2.79Å; K117-L121 HydrophobicContact CG-CD1 3.86Å; K117-L121 HydrophobicContact CG-CG 4.48Å; K117-L121 WeakPolarHBondContact O-CB 3.29Å; K117-L121 VanDerWaalsContact O-CG 3.32Å; K117-L121 WeakPolarHBondContact O-CG 3.18Å; K117-L121 PolarHBondContact O-N 2.81Å; K117-E153 WeakPolarHBondContact CE-OE1 3.3Å; K117-E153 IonicContact NZ-OE1 2.96Å; K117-I157 HydrophobicContact CD-CD1 3.75Å; K117-I157 HydrophobicContact CG-CD1 3.98Å
118V98.7Very high97.4Very high0 Ų037.4 Ų37.40%019%0.194CC..Hα-helixtrans-64-41.3176.1174.10000110.8A114 E115 Y120 L121 K122 A154 I157 M162 I168 L172A114-V118 WeakPolarHBondContact O-CB 3.35Å; A114-V118 VanDerWaalsContact O-CG2 3.29Å; A114-V118 WeakPolarHBondContact O-CG2 3.47Å; A114-V118 PolarHBondContact O-N 2.75Å; E115-V118 PolarHBondContact O-N 3.31Å; V118-Y120 PolarHBondContact O-N 2.87Å; V118-L121 PolarHBondContact O-N 3.34Å; V118-K122 WeakPolarHBondContact O-CB 3.34Å; V118-K122 PolarHBondContact O-N 2.86Å; V118-A154 HydrophobicContact CG1-CB 4.35Å; V118-I157 HydrophobicContact CG2-CB 3.78Å; V118-I157 HydrophobicContact CG2-CG2 3.55Å; V118-M162 HydrophobicContact CB-SD 3.97Å; V118-M162 HydrophobicContact CG1-SD 3.97Å; V118-M162 HydrophobicContact CG2-SD 3.8Å; V118-I168 HydrophobicContact CB-CG2 4.3Å; V118-I168 HydrophobicContact CG1-CG2 3.75Å; V118-L172 HydrophobicContact CG1-CD2 4.04Å
119F98.5Very high97.4Very high27 Ų2736.8 Ų36.812%0.11819%0.189CC..Hα-helixtrans-57.7-50.1176.5-172.4-80.2000111.7R43 E115 S116 K117 M123 I168R43-F119 VanDerWaalsContact CD-CD1 3.48Å; R43-F119 HydrophobicContact CG-CD1 3.58Å; R43-F119 HydrophobicContact CG-CE1 3.4Å; R43-F119 VanDerWaalsContact CG-CE1 3.4Å; R43-F119 HydrophobicContact CG-CE2 4.4Å; R43-F119 HydrophobicContact CG-CG 4.18Å; R43-F119 HydrophobicContact CG-CZ 3.84Å; E115-F119 WeakPolarHBondContact O-CB 3.46Å; E115-F119 PolarHBondContact O-N 3.15Å; S116-F119 WeakPolarHBondContact O-CB 3.47Å; S116-F119 PolarHBondContact O-N 3.43Å; K117-F119 VanDerWaalsContact C-N 3.35Å; F119-M123 HydrophobicContact CE1-SD 4.32Å; F119-M123 WeakPolarHBondContact O-CB 3.26Å; F119-M123 PolarHBondContact O-N 2.86Å; F119-I168 HydrophobicContact CB-CD1 4.39Å; F119-I168 HydrophobicContact CB-CG2 4.46Å; F119-I168 HydrophobicContact CD2-CD1 3.79Å; F119-I168 HydrophobicContact CD2-CG1 4.06Å
120Y98.7Very high97.6Very high2 Ų231.7 Ų31.71%0.00816%0.161CC..Hα-helixtrans-70.7-38.6-178.7-61.3-45.2000113R43 L103 L107 A111 S116 K117 V118 M123 K124R43-Y120 HydrophobicContact CG-CE1 3.72Å; L103-Y120 HydrophobicContact CD2-CD1 3.88Å; L103-Y120 HydrophobicContact CD2-CG 4.17Å; L107-Y120 HydrophobicContact CB-CD1 3.89Å; L107-Y120 HydrophobicContact CB-CD2 3.8Å; L107-Y120 HydrophobicContact CB-CE1 3.96Å; L107-Y120 HydrophobicContact CB-CE2 3.89Å; L107-Y120 HydrophobicContact CB-CG 3.84Å; L107-Y120 HydrophobicContact CD1-CD1 4.07Å; L107-Y120 HydrophobicContact CD1-CE1 3.98Å; L107-Y120 HydrophobicContact CD2-CE1 4Å; L107-Y120 HydrophobicContact CD2-CE2 4.44Å; L107-Y120 HydrophobicContact CG-CD1 4.45Å; L107-Y120 HydrophobicContact CG-CE1 4.2Å; A111-Y120 HydrophobicContact CB-CD2 4.02Å; A111-Y120 HydrophobicContact CB-CE2 4.15Å; S116-Y120 WeakPolarHBondContact O-CD2 3.44Å; S116-Y120 VanDerWaalsContact O-CG 3.29Å; S116-Y120 PolarHBondContact O-N 3.41Å; K117-Y120 PolarHBondContact O-N 2.79Å; V118-Y120 PolarHBondContact O-N 2.87Å; Y120-M123 WeakPolarHBondContact O-CB 3.49Å; Y120-M123 PolarHBondContact O-N 3.15Å; Y120-K124 WeakPolarHBondContact O-CB 3.37Å; Y120-K124 PolarHBondContact O-N 2.94Å
121L98.8Very high97.9Very high2 Ų228.7 Ų28.71%0.0115%0.145CC..Hα-helixtrans-67.4-41.1175.6-73.9167.6000112I108 K117 V118 M123 K124 G125 E153 A154 I157I108-L121 HydrophobicContact CD1-CD2 4.04Å; I108-L121 HydrophobicContact CG2-CD2 4.46Å; K117-L121 HydrophobicContact CG-CD1 3.86Å; K117-L121 HydrophobicContact CG-CG 4.48Å; K117-L121 WeakPolarHBondContact O-CB 3.29Å; K117-L121 VanDerWaalsContact O-CG 3.32Å; K117-L121 WeakPolarHBondContact O-CG 3.18Å; K117-L121 PolarHBondContact O-N 2.81Å; V118-L121 PolarHBondContact O-N 3.34Å; L121-M123 VanDerWaalsContact C-N 3.3Å; L121-M123 PolarHBondContact O-N 3.37Å; L121-K124 WeakPolarHBondContact O-CB 3.34Å; L121-K124 PolarHBondContact O-N 3.37Å; L121-G125 PolarHBondContact O-N 2.94Å; L121-E153 HydrophobicContact CD1-CB 4.1Å; L121-E153 HydrophobicContact CD1-CG 3.71Å; L121-E153 HydrophobicContact CD2-CB 4.43Å; L121-E153 HydrophobicContact CD2-CG 4.43Å; L121-A154 HydrophobicContact CB-CB 3.66Å; L121-I157 HydrophobicContact CD1-CD1 3.73Å
122K98.7Very high97.9Very high37 Ų3727.8 Ų27.816%0.16114%0.138CC..Hα-helixtrans-56.5-48.3170.5177.6-166.9169.4-66.60110.3V118 K124 G125 D126 G171 L172 N175V118-K122 WeakPolarHBondContact O-CB 3.34Å; V118-K122 PolarHBondContact O-N 2.86Å; K122-K124 VanDerWaalsContact C-N 3.35Å; K122-K124 PolarHBondContact O-N 3.02Å; K122-G125 PolarHBondContact O-N 3.17Å; K122-D126 IonicContact NZ-OD2 3.01Å; K122-D126 PolarHBondContact NZ-OD2 2.78Å; K122-D126 PolarHBondContact O-N 3.31Å; K122-G171 WeakPolarHBondContact CE-O 3.36Å; K122-L172 HydrophobicContact CB-CD1 4.01Å; K122-L172 HydrophobicContact CD-CB 4.11Å; K122-L172 HydrophobicContact CG-CB 4.29Å; K122-L172 HydrophobicContact CG-CD1 3.99Å; K122-N175 PolarHBondContact NZ-ND2 2.9Å
123M98.7Very high98Very high8 Ų824.9 Ų24.94%0.03912%0.117CC..Hα-helixtrans-58.1-47.4177.4-166.4173171.100110.6V99 L103 F119 Y120 L121 G125 D126 Y127V99-M123 HydrophobicContact CG1-CE 3.67Å; L103-M123 HydrophobicContact CD1-CB 4.33Å; L103-M123 HydrophobicContact CD1-CG 4.18Å; L103-M123 HydrophobicContact CD2-CB 4.26Å; L103-M123 HydrophobicContact CD2-CG 4.37Å; L103-M123 HydrophobicContact CD2-SD 4.13Å; F119-M123 HydrophobicContact CE1-SD 4.32Å; F119-M123 WeakPolarHBondContact O-CB 3.26Å; F119-M123 PolarHBondContact O-N 2.86Å; Y120-M123 WeakPolarHBondContact O-CB 3.49Å; Y120-M123 PolarHBondContact O-N 3.15Å; L121-M123 VanDerWaalsContact C-N 3.3Å; L121-M123 PolarHBondContact O-N 3.37Å; M123-G125 VanDerWaalsContact C-N 3.32Å; M123-G125 PolarHBondContact O-N 3.45Å; M123-D126 WeakPolarHBondContact O-CA 3.06Å; M123-D126 WeakPolarHBondContact O-CB 3.24Å; M123-D126 PolarHBondContact O-N 3Å; M123-Y127 HydrophobicContact CE-CD2 4.48Å; M123-Y127 HydrophobicContact CE-CE2 3.53Å; M123-Y127 HydrophobicContact CG-CD2 3.83Å; M123-Y127 HydrophobicContact CG-CE2 3.43Å; M123-Y127 VanDerWaalsContact CG-CE2 3.43Å; M123-Y127 WeakPolarHBondContact O-CD2 3.47Å; M123-Y127 PolarHBondContact O-N 3.32Å; M123-Y127 HydrophobicContact SD-CE2 4.33Å
124K98.8Very high98Very high43 Ų4319.8 Ų19.819%0.18710%0.095CC..Hα-helixtrans-54.8-45.8174.9-173.9173.2-177.1170.30112.1L100 L103 D104 I108 Y120 L121 K122 D126 Y127 F128 A150L100-K124 HydrophobicContact CD2-CB 4.48Å; L100-K124 HydrophobicContact CD2-CG 3.79Å; L103-K124 HydrophobicContact CD1-CB 3.97Å; D104-K124 VanDerWaalsContact OD1-CE 3.29Å; D104-K124 WeakPolarHBondContact OD1-CE 3.37Å; D104-K124 IonicContact OD1-NZ 3.76Å; D104-K124 PolarHBondContact OD1-NZ 3.22Å; D104-K124 IonicContact OD2-NZ 3.25Å; D104-K124 PolarHBondContact OD2-NZ 3.48Å; I108-K124 HydrophobicContact CD1-CB 4.4Å; I108-K124 HydrophobicContact CD1-CD 3.8Å; Y120-K124 WeakPolarHBondContact O-CB 3.37Å; Y120-K124 PolarHBondContact O-N 2.94Å; L121-K124 WeakPolarHBondContact O-CB 3.34Å; L121-K124 PolarHBondContact O-N 3.37Å; K122-K124 VanDerWaalsContact C-N 3.35Å; K122-K124 PolarHBondContact O-N 3.02Å; K124-D126 VanDerWaalsContact C-N 3.34Å; K124-D126 PolarHBondContact O-N 3.44Å; K124-Y127 PolarHBondContact O-N 2.89Å; K124-F128 HydrophobicContact CD-CE2 4.39Å; K124-F128 HydrophobicContact CG-CD2 3.91Å; K124-F128 HydrophobicContact CG-CE2 3.83Å; K124-F128 WeakPolarHBondContact O-CD2 3.32Å; K124-F128 PolarHBondContact O-N 3.48Å; K124-A150 HydrophobicContact CB-CB 4.03Å; K124-A150 HydrophobicContact CD-CB 4.21Å; K124-A150 HydrophobicContact CG-CB 3.93Å
125G98.8Very high97.8Very high0 Ų019.3 Ų19.30%09%0.091CC..Hα-helixtrans-59.7-41.5173.700000112.9L121 K122 M123 R129 S147 Y151L121-G125 PolarHBondContact O-N 2.94Å; K122-G125 PolarHBondContact O-N 3.17Å; M123-G125 VanDerWaalsContact C-N 3.32Å; M123-G125 PolarHBondContact O-N 3.45Å; G125-R129 VanDerWaalsContact O-CB 3.24Å; G125-R129 WeakPolarHBondContact O-CB 3.42Å; G125-R129 PolarHBondContact O-N 3.01Å; G125-S147 PolarHBondContact O-OG 3.44Å; G125-Y151 VanDerWaalsContact C-OH 3.26Å; G125-Y151 WeakPolarHBondContact O-CE2 3.43Å; G125-Y151 PolarHBondContact O-OH 3.42Å
126D98.8Very high97.4Very high8 Ų821.1 Ų21.14%0.04311%0.11CC..Hα-helixtrans-61.3-48.3176.1-78.8-50000112.3K122 M123 K124 R129 Y130 Y151 N175K122-D126 IonicContact NZ-OD2 3.01Å; K122-D126 PolarHBondContact NZ-OD2 2.78Å; K122-D126 PolarHBondContact O-N 3.31Å; M123-D126 WeakPolarHBondContact O-CA 3.06Å; M123-D126 WeakPolarHBondContact O-CB 3.24Å; M123-D126 PolarHBondContact O-N 3Å; K124-D126 VanDerWaalsContact C-N 3.34Å; K124-D126 PolarHBondContact O-N 3.44Å; D126-R129 WeakPolarHBondContact O-CB 3.41Å; D126-R129 PolarHBondContact O-N 3.48Å; D126-R129 IonicContact OD1-CZ 3Å; D126-R129 IonicContact OD1-NE 2.71Å; D126-R129 IonicContact OD1-NH2 2.89Å; D126-R129 PolarHBondContact OD1-NH2 3.21Å; D126-Y130 HydrophobicContact CB-CE2 4.08Å; D126-Y130 WeakPolarHBondContact O-CD1 3.39Å; D126-Y130 WeakPolarHBondContact O-CD2 3.49Å; D126-Y130 WeakPolarHBondContact O-CE2 3.16Å; D126-Y130 PolarHBondContact O-N 2.93Å; D126-Y151 VanDerWaalsContact CA-OH 3.25Å; D126-Y151 WeakPolarHBondContact CA-OH 3.48Å; D126-Y151 PolarHBondContact N-OH 3.01Å; D126-Y151 VanDerWaalsContact N-OH 3.16Å; D126-Y151 PolarHBondContact OD1-OH 3Å; D126-N175 WeakPolarHBondContact OD1-CB 3.37Å; D126-N175 PolarHBondContact OD1-ND2 2.92Å; D126-N175 PolarHBondContact OD2-ND2 2.92Å
127Y98.7Very high96.9Very high6 Ų623.9 Ų23.92%0.02414%0.139CC..Hα-helixtrans-68.7-38.6-178.9-73.4-87.3000112.4Y50 K51 V54 C96 V99 M123 K124 R129 Y130 L131Y50-Y127 WeakPolarHBondContact CB-OH 3.23Å; K51-Y127 PolarHBondContact N-OH 3.15Å; V54-Y127 HydrophobicContact CB-CE1 4.29Å; V54-Y127 HydrophobicContact CG2-CD1 4.13Å; V54-Y127 HydrophobicContact CG2-CE1 3.6Å; C96-Y127 HydrophobicContact CB-CD1 4.29Å; V99-Y127 HydrophobicContact CB-CD1 4.11Å; V99-Y127 HydrophobicContact CB-CD2 4.38Å; V99-Y127 HydrophobicContact CB-CE1 4.11Å; V99-Y127 HydrophobicContact CB-CE2 4.48Å; V99-Y127 HydrophobicContact CB-CG 4.27Å; V99-Y127 HydrophobicContact CG1-CD1 4.18Å; V99-Y127 HydrophobicContact CG1-CD2 3.6Å; V99-Y127 HydrophobicContact CG1-CE1 4.1Å; V99-Y127 HydrophobicContact CG1-CE2 3.61Å; V99-Y127 HydrophobicContact CG1-CG 3.97Å; V99-Y127 HydrophobicContact CG2-CD1 4.27Å; V99-Y127 HydrophobicContact CG2-CE1 3.82Å; M123-Y127 HydrophobicContact CE-CD2 4.48Å; M123-Y127 HydrophobicContact CE-CE2 3.53Å; M123-Y127 HydrophobicContact CG-CD2 3.83Å; M123-Y127 HydrophobicContact CG-CE2 3.43Å; M123-Y127 VanDerWaalsContact CG-CE2 3.43Å; M123-Y127 WeakPolarHBondContact O-CD2 3.47Å; M123-Y127 PolarHBondContact O-N 3.32Å; M123-Y127 HydrophobicContact SD-CE2 4.33Å; K124-Y127 PolarHBondContact O-N 2.89Å; Y127-R129 VanDerWaalsContact C-N 3.34Å; Y127-Y130 HydrophobicContact CD1-CD2 4.17Å; Y127-Y130 HydrophobicContact CG-CD2 4.44Å; Y127-Y130 PolarHBondContact O-N 3.07Å; Y127-L131 WeakPolarHBondContact O-CG 3.16Å; Y127-L131 PolarHBondContact O-N 3.33Å
128F98.7Very high96.2Very high23 Ų2327.4 Ų27.410%0.10116%0.161CC..Hα-helixtrans-65.1-37.7171.3-81.9-61.4000112.6L100 K124 Y130 L131 S132 T143 N146L100-F128 HydrophobicContact CD1-CD1 4.03Å; L100-F128 HydrophobicContact CD1-CD2 4.43Å; L100-F128 HydrophobicContact CD1-CE1 3.69Å; L100-F128 HydrophobicContact CD1-CE2 4.12Å; L100-F128 HydrophobicContact CD1-CG 4.38Å; L100-F128 HydrophobicContact CD1-CZ 3.74Å; L100-F128 HydrophobicContact CD2-CD2 3.72Å; L100-F128 HydrophobicContact CD2-CE2 3.5Å; L100-F128 HydrophobicContact CD2-CG 4.34Å; L100-F128 HydrophobicContact CD2-CZ 3.97Å; L100-F128 HydrophobicContact CG-CE2 4.41Å; L100-F128 HydrophobicContact CG-CZ 4.41Å; K124-F128 HydrophobicContact CD-CE2 4.39Å; K124-F128 HydrophobicContact CG-CD2 3.91Å; K124-F128 HydrophobicContact CG-CE2 3.83Å; K124-F128 WeakPolarHBondContact O-CD2 3.32Å; K124-F128 PolarHBondContact O-N 3.48Å; F128-Y130 VanDerWaalsContact C-N 3.32Å; F128-Y130 PolarHBondContact O-N 3.48Å; F128-L131 HydrophobicContact CD1-CD1 4.13Å; F128-L131 HydrophobicContact CE1-CD1 4.45Å; F128-L131 WeakPolarHBondContact O-CB 3.5Å; F128-L131 PolarHBondContact O-N 3.41Å; F128-S132 PolarHBondContact O-N 3Å; F128-S132 PolarHBondContact O-OG 3.41Å; F128-S132 VanDerWaalsContact O-OG 3.1Å; F128-T143 HydrophobicContact CD1-CG2 4.44Å; F128-N146 HydrophobicContact CB-CB 4.46Å; F128-N146 HydrophobicContact CD1-CB 3.73Å; F128-N146 HydrophobicContact CD2-CB 3.62Å; F128-N146 HydrophobicContact CE1-CB 3.75Å; F128-N146 WeakPolarHBondContact CE1-ND2 3.36Å; F128-N146 HydrophobicContact CE2-CB 3.64Å; F128-N146 HydrophobicContact CG-CB 3.68Å; F128-N146 HydrophobicContact CZ-CB 3.71Å
129R98.4Very high95.8Very high13 Ų1332.9 Ų32.95%0.04919%0.191CC..Hα-helixtrans-59-42.7172.9171.6170.371.390.20.6111.9G125 D126 Y127 L131 S132 E133 Y151 F179 E182 I183G125-R129 VanDerWaalsContact O-CB 3.24Å; G125-R129 WeakPolarHBondContact O-CB 3.42Å; G125-R129 PolarHBondContact O-N 3.01Å; D126-R129 WeakPolarHBondContact O-CB 3.41Å; D126-R129 PolarHBondContact O-N 3.48Å; D126-R129 IonicContact OD1-CZ 3Å; D126-R129 IonicContact OD1-NE 2.71Å; D126-R129 IonicContact OD1-NH2 2.89Å; D126-R129 PolarHBondContact OD1-NH2 3.21Å; Y127-R129 VanDerWaalsContact C-N 3.34Å; R129-L131 VanDerWaalsContact C-N 3.32Å; R129-S132 WeakPolarHBondContact O-CB 3.49Å; R129-S132 PolarHBondContact O-N 2.92Å; R129-E133 PolarHBondContact O-N 3.34Å; R129-E133 VanDerWaalsContact O-N 3.09Å; R129-Y151 PolarHBondContact NE-OH 3.27Å; R129-F179 HydrophobicContact CB-CD2 4.24Å; R129-F179 HydrophobicContact CG-CD2 4.23Å; R129-E182 IonicContact NH1-OE2 2.7Å; R129-I183 HydrophobicContact CG-CD1 4.32Å; R129-I183 HydrophobicContact CG-CG1 3.83Å
130Y98.2Very high95.6Very high24 Ų2435.8 Ų35.89%0.09420%0.203CC..Hα-helixtrans-64.4-37.4175.8-55.5-32.2000112.3V54 R58 D126 Y127 F128 E133V54-Y130 HydrophobicContact CG1-CD2 3.53Å; V54-Y130 HydrophobicContact CG1-CE2 3.99Å; V54-Y130 HydrophobicContact CG1-CG 4.08Å; R58-Y130 VanDerWaalsContact CZ-CE1 3.46Å; R58-Y130 VanDerWaalsContact NH1-CE1 3.31Å; D126-Y130 HydrophobicContact CB-CE2 4.08Å; D126-Y130 WeakPolarHBondContact O-CD1 3.39Å; D126-Y130 WeakPolarHBondContact O-CD2 3.49Å; D126-Y130 WeakPolarHBondContact O-CE2 3.16Å; D126-Y130 PolarHBondContact O-N 2.93Å; Y127-Y130 HydrophobicContact CD1-CD2 4.17Å; Y127-Y130 HydrophobicContact CG-CD2 4.44Å; Y127-Y130 PolarHBondContact O-N 3.07Å; F128-Y130 VanDerWaalsContact C-N 3.32Å; F128-Y130 PolarHBondContact O-N 3.48Å; Y130-E133 WeakPolarHBondContact O-CB 3.42Å; Y130-E133 PolarHBondContact O-N 3.24Å
131L98.1Very high95.5Very high3 Ų342.2 Ų42.22%0.01623%0.233CC..Hα-helixtrans-65-41.3171.7-67.2178.7000111.8Q93 C96 L100 Y127 F128 R129 E133 V134 A135 T143Q93-L131 HydrophobicContact CB-CD2 4.49Å; Q93-L131 VanDerWaalsContact OE1-CD2 3.24Å; C96-L131 HydrophobicContact CB-CD1 3.96Å; C96-L131 HydrophobicContact CB-CD2 3.53Å; C96-L131 HydrophobicContact CB-CG 3.71Å; L100-L131 HydrophobicContact CD1-CD1 3.81Å; Y127-L131 WeakPolarHBondContact O-CG 3.16Å; Y127-L131 PolarHBondContact O-N 3.33Å; F128-L131 HydrophobicContact CD1-CD1 4.13Å; F128-L131 HydrophobicContact CE1-CD1 4.45Å; F128-L131 WeakPolarHBondContact O-CB 3.5Å; F128-L131 PolarHBondContact O-N 3.41Å; R129-L131 VanDerWaalsContact C-N 3.32Å; L131-E133 PolarHBondContact O-N 2.63Å; L131-V134 WeakPolarHBondContact O-CG2 3.34Å; L131-V134 PolarHBondContact O-N 3.28Å; L131-A135 WeakPolarHBondContact O-CB 3.43Å; L131-A135 PolarHBondContact O-N 3.45Å; L131-T143 HydrophobicContact CB-CG2 3.69Å; L131-T143 HydrophobicContact CD1-CG2 4.39Å
132S97.5Very high95.4Very high0 Ų046 Ų460%026%0.256CS..Hα-helixtrans-63.6-27.6177.4-62.60000114F128 R129 V134 T143 V144F128-S132 PolarHBondContact O-N 3Å; F128-S132 PolarHBondContact O-OG 3.41Å; F128-S132 VanDerWaalsContact O-OG 3.1Å; R129-S132 WeakPolarHBondContact O-CB 3.49Å; R129-S132 PolarHBondContact O-N 2.92Å; S132-V134 VanDerWaalsContact C-N 3.29Å; S132-V134 PolarHBondContact O-N 2.88Å; S132-T143 WeakPolarHBondContact CA-OG1 3.33Å; S132-T143 WeakPolarHBondContact OG-CB 3.45Å; S132-T143 PolarHBondContact OG-OG1 3.29Å; S132-V144 PolarHBondContact OG-N 3.16Å; S132-V144 VanDerWaalsContact OG-N 3.1Å
133E95.7Very high95.4Very high40 Ų4044.8 Ų44.819%0.18725%0.252CS..Hα-helixtrans-62.9-37.1175.6-174.8175.5-169.100111.5R58 W61 R62 R129 Y130 L131R58-E133 IonicContact CZ-OE2 3Å; R58-E133 IonicContact NE-OE2 2.8Å; R58-E133 PolarHBondContact NE-OE2 3.03Å; R58-E133 IonicContact NH2-OE1 3.63Å; R58-E133 IonicContact NH2-OE2 2.71Å; R58-E133 PolarHBondContact NH2-OE2 3.29Å; W61-E133 HydrophobicContact CH2-CG 4.17Å; W61-E133 HydrophobicContact CZ3-CG 3.78Å; R62-E133 IonicContact CZ-OE1 3.84Å; R62-E133 VanDerWaalsContact CZ-OE1 3.25Å; R62-E133 IonicContact NE-OE1 3.17Å; R62-E133 PolarHBondContact NE-OE1 3.04Å; R62-E133 IonicContact NH2-OE1 3.37Å; R62-E133 PolarHBondContact NH2-OE1 3.35Å; R62-E133 IonicContact NH2-OE2 2.81Å; R62-E133 PolarHBondContact NH2-OE2 3.18Å; R129-E133 PolarHBondContact O-N 3.34Å; R129-E133 VanDerWaalsContact O-N 3.09Å; Y130-E133 WeakPolarHBondContact O-CB 3.42Å; Y130-E133 PolarHBondContact O-N 3.24Å; L131-E133 PolarHBondContact O-N 2.63Å
134V94.9Very high95.3Very high19 Ų1945.1 Ų45.112%0.11526%0.255CS..Hα-helixtrans-104.4-16.8-176-54.20000114.1W61 E89 L92 L131 S132W61-V134 HydrophobicContact CD2-CG1 3.74Å; W61-V134 HydrophobicContact CE3-CG1 4.17Å; W61-V134 HydrophobicContact CG-CG1 4.14Å; W61-V134 HydrophobicContact CH2-CG1 4.27Å; W61-V134 HydrophobicContact CZ2-CB 4.28Å; W61-V134 HydrophobicContact CZ2-CG1 3.86Å; W61-V134 HydrophobicContact CZ3-CG1 4.42Å; E89-V134 HydrophobicContact CG-CB 4.09Å; E89-V134 HydrophobicContact CG-CG1 4.47Å; L92-V134 HydrophobicContact CD2-CB 4.38Å; L92-V134 HydrophobicContact CD2-CG1 3.56Å; L92-V134 HydrophobicContact CD2-CG2 3.89Å; L131-V134 WeakPolarHBondContact O-CG2 3.34Å; L131-V134 PolarHBondContact O-N 3.28Å; S132-V134 VanDerWaalsContact C-N 3.29Å; S132-V134 PolarHBondContact O-N 2.88Å
135A93.4Very high95.3Very high20 Ų2045.9 Ų45.917%0.16527%0.265CS..  trans-70.5150.3-177.400000112.6L131 N139 K140L131-A135 WeakPolarHBondContact O-CB 3.43Å; L131-A135 PolarHBondContact O-N 3.45Å; A135-N139 HydrophobicContact CB-CB 4.27Å; A135-K140 HydrophobicContact CB-CB 4.12Å
136S87.5Confident95.3Very high94 Ų9448.1 Ų48.166%0.65728%0.277SS*.  trans-129.9159.917460.40000111.2N139S136-N139 PolarHBondContact O-N 3.5Å
137G86.2Confident95.3Very high62 Ų6247.7 Ų47.764%0.63928%0.275SS*.Hα-helixtrans56.9-140.6179.300000113.7N139 K140G137-N139 VanDerWaalsContact C-N 3.26Å; G137-N139 PolarHBondContact O-N 3.19Å; G137-K140 WeakPolarHBondContact O-CB 3.32Å; G137-K140 PolarHBondContact O-N 2.92Å
138D84.7Confident95.3Very high145 Ų14550.9 Ų50.978%0.77529%0.29SS*.Hα-helixtrans-60.5-33.4-176.6-64.3-23000113.1K140 Q141 T142D138-K140 PolarHBondContact O-N 3.32Å; D138-Q141 PolarHBondContact O-N 3.5Å; D138-Q141 VanDerWaalsContact O-N 3.13Å; D138-T142 PolarHBondContact O-N 3.48Å; D138-T142 PolarHBondContact O-OG1 2.95Å
139N90.5Very high95.3Very high115 Ų11555.5 Ų55.562%0.61531%0.312SS*.Hα-helixtrans-60.6-32.3176.3-69.8-16.7000111.7A135 S136 G137 T143A135-N139 HydrophobicContact CB-CB 4.27Å; S136-N139 PolarHBondContact O-N 3.5Å; G137-N139 VanDerWaalsContact C-N 3.26Å; G137-N139 PolarHBondContact O-N 3.19Å; N139-T143 WeakPolarHBondContact O-CB 3.32Å; N139-T143 VanDerWaalsContact O-CG2 3.24Å; N139-T143 WeakPolarHBondContact O-CG2 3.14Å; N139-T143 PolarHBondContact O-N 2.62Å; N139-T143 PolarHBondContact O-OG1 2.85Å
140K94.7Very high95.3Very high88 Ų8855.1 Ų55.138%0.38331%0.312SS..Hα-helixtrans-66.5-45.2176.3-169.9163.9-171.3157.90110.9A135 G137 D138 T142 T143 V144A135-K140 HydrophobicContact CB-CB 4.12Å; G137-K140 WeakPolarHBondContact O-CB 3.32Å; G137-K140 PolarHBondContact O-N 2.92Å; D138-K140 PolarHBondContact O-N 3.32Å; K140-T142 VanDerWaalsContact C-N 3.34Å; K140-T142 PolarHBondContact O-N 2.91Å; K140-T143 PolarHBondContact O-N 3.44Å; K140-T143 PolarHBondContact O-OG1 3.3Å; K140-V144 HydrophobicContact CG-CG2 4.15Å; K140-V144 WeakPolarHBondContact O-CB 3.29Å; K140-V144 WeakPolarHBondContact O-CG2 3.29Å; K140-V144 PolarHBondContact O-N 3.26Å
141Q95.5Very high95.3Very high136 Ų13654 Ų5464%0.63631%0.307SS*.Hα-helixtrans-61.5-43.1179.7-173.158.950.400111.9D138 S145D138-Q141 PolarHBondContact O-N 3.5Å; D138-Q141 VanDerWaalsContact O-N 3.13Å; Q141-S145 WeakPolarHBondContact O-CB 3.49Å; Q141-S145 PolarHBondContact O-N 3.26Å
142T97Very high95.4Very high81 Ų8157 Ų5750%0.49732%0.321SS..Hα-helixtrans-64.5-47.5178.1-58.80000112.1D138 K140 V144 S145 N146D138-T142 PolarHBondContact O-N 3.48Å; D138-T142 PolarHBondContact O-OG1 2.95Å; K140-T142 VanDerWaalsContact C-N 3.34Å; K140-T142 PolarHBondContact O-N 2.91Å; T142-V144 PolarHBondContact O-N 3.33Å; T142-S145 PolarHBondContact O-N 2.99Å; T142-N146 WeakPolarHBondContact O-CB 3.26Å; T142-N146 PolarHBondContact O-N 3.36Å; T142-N146 PolarHBondContact O-ND2 3.41Å
143T97.8Very high95.4Very high13 Ų1360.6 Ų60.68%0.0834%0.338CS..Hα-helixtrans-64.1-41179.953.70000111.6F128 L131 S132 N139 K140 N146 S147F128-T143 HydrophobicContact CD1-CG2 4.44Å; L131-T143 HydrophobicContact CB-CG2 3.69Å; L131-T143 HydrophobicContact CD1-CG2 4.39Å; S132-T143 WeakPolarHBondContact CA-OG1 3.33Å; S132-T143 WeakPolarHBondContact OG-CB 3.45Å; S132-T143 PolarHBondContact OG-OG1 3.29Å; N139-T143 WeakPolarHBondContact O-CB 3.32Å; N139-T143 VanDerWaalsContact O-CG2 3.24Å; N139-T143 WeakPolarHBondContact O-CG2 3.14Å; N139-T143 PolarHBondContact O-N 2.62Å; N139-T143 PolarHBondContact O-OG1 2.85Å; K140-T143 PolarHBondContact O-N 3.44Å; K140-T143 PolarHBondContact O-OG1 3.3Å; T143-N146 PolarHBondContact O-N 3.27Å; T143-S147 VanDerWaalsContact O-CB 3.31Å; T143-S147 WeakPolarHBondContact O-CB 3.21Å; T143-S147 PolarHBondContact O-N 2.85Å
144V98.2Very high95.6Very high14 Ų1458.7 Ų58.79%0.08533%0.329CS..Hα-helixtrans-62.1-47.3176.8171.40000110.9S132 K140 T142 N146 S147 Q148 F179 I183 L184S132-V144 PolarHBondContact OG-N 3.16Å; S132-V144 VanDerWaalsContact OG-N 3.1Å; K140-V144 HydrophobicContact CG-CG2 4.15Å; K140-V144 WeakPolarHBondContact O-CB 3.29Å; K140-V144 WeakPolarHBondContact O-CG2 3.29Å; K140-V144 PolarHBondContact O-N 3.26Å; T142-V144 PolarHBondContact O-N 3.33Å; V144-N146 PolarHBondContact O-N 3.04Å; V144-S147 PolarHBondContact O-N 3.49Å; V144-Q148 WeakPolarHBondContact O-CB 3.36Å; V144-Q148 PolarHBondContact O-N 2.71Å; V144-F179 HydrophobicContact CG1-CE2 4.5Å; V144-F179 HydrophobicContact CG1-CZ 4.1Å; V144-I183 HydrophobicContact CG1-CG2 4.48Å; V144-I183 HydrophobicContact CG2-CG2 3.62Å; V144-L184 HydrophobicContact CG1-CD2 3.51Å
145S98.1Very high95.7Very high59 Ų5959 Ų5941%0.41333%0.329SS..Hα-helixtrans-59.7-47178.1-176.60000111.8Q141 T142 Q148 Q149Q141-S145 WeakPolarHBondContact O-CB 3.49Å; Q141-S145 PolarHBondContact O-N 3.26Å; T142-S145 PolarHBondContact O-N 2.99Å; S145-Q148 PolarHBondContact O-N 3.17Å; S145-Q149 WeakPolarHBondContact O-CB 3.42Å; S145-Q149 PolarHBondContact O-N 2.98Å
146N98.4Very high96Very high47 Ų4762 Ų6225%0.25134%0.34SS..Hα-helixtrans-66.4-39.9179.8-71.8-20.4000112.3F128 T142 T143 V144 Q149 A150F128-N146 HydrophobicContact CB-CB 4.46Å; F128-N146 HydrophobicContact CD1-CB 3.73Å; F128-N146 HydrophobicContact CD2-CB 3.62Å; F128-N146 HydrophobicContact CE1-CB 3.75Å; F128-N146 WeakPolarHBondContact CE1-ND2 3.36Å; F128-N146 HydrophobicContact CE2-CB 3.64Å; F128-N146 HydrophobicContact CG-CB 3.68Å; F128-N146 HydrophobicContact CZ-CB 3.71Å; T142-N146 WeakPolarHBondContact O-CB 3.26Å; T142-N146 PolarHBondContact O-N 3.36Å; T142-N146 PolarHBondContact O-ND2 3.41Å; T143-N146 PolarHBondContact O-N 3.27Å; V144-N146 PolarHBondContact O-N 3.04Å; N146-Q149 PolarHBondContact O-N 2.93Å; N146-A150 WeakPolarHBondContact O-CB 3.42Å; N146-A150 PolarHBondContact O-N 2.97Å
147S98.7Very high96.5Very high0 Ų059.1 Ų59.10%032%0.316CS..Hα-helixtrans-57.8-52.4173.7175.70000110.7G125 T143 V144 Q149 A150 Y151 F179G125-S147 PolarHBondContact O-OG 3.44Å; T143-S147 VanDerWaalsContact O-CB 3.31Å; T143-S147 WeakPolarHBondContact O-CB 3.21Å; T143-S147 PolarHBondContact O-N 2.85Å; V144-S147 PolarHBondContact O-N 3.49Å; S147-Q149 PolarHBondContact O-N 2.72Å; S147-A150 PolarHBondContact O-N 3.43Å; S147-Y151 WeakPolarHBondContact O-CD2 3.36Å; S147-Y151 PolarHBondContact O-N 3.42Å; S147-Y151 VanDerWaalsContact OG-CE2 3.3Å; S147-Y151 WeakPolarHBondContact OG-CE2 3.46Å; S147-F179 WeakPolarHBondContact OG-CD2 3.42Å; S147-F179 WeakPolarHBondContact OG-CE2 3.31Å
148Q98.7Very high97.1Very high72 Ų7256.1 Ų56.134%0.33629%0.286SS..Hα-helixtrans-61.3-43.6-179.8-173.5173.13.800112.1V144 S145 Y151 Q152 F179V144-Q148 WeakPolarHBondContact O-CB 3.36Å; V144-Q148 PolarHBondContact O-N 2.71Å; S145-Q148 PolarHBondContact O-N 3.17Å; Q148-Y151 PolarHBondContact O-N 2.98Å; Q148-Q152 WeakPolarHBondContact O-CB 3.4Å; Q148-Q152 PolarHBondContact O-N 3.31Å; Q148-F179 HydrophobicContact CB-CE1 3.78Å; Q148-F179 HydrophobicContact CB-CZ 3.86Å; Q148-F179 HydrophobicContact CG-CE1 4.17Å
149Q98.7Very high97.7Very high121 Ų12153.9 Ų53.957%0.56527%0.269SS*.Hα-helixtrans-60.6-47.3178.3-177.9-179.1-4.200111.6S145 N146 S147 Q152 E153S145-Q149 WeakPolarHBondContact O-CB 3.42Å; S145-Q149 PolarHBondContact O-N 2.98Å; N146-Q149 PolarHBondContact O-N 2.93Å; S147-Q149 PolarHBondContact O-N 2.72Å; Q149-Q152 PolarHBondContact O-N 2.83Å; Q149-E153 PolarHBondContact O-N 3.41Å
150A98.8Very high98Very high4 Ų455.8 Ų55.83%0.03327%0.272CS..Hα-helixtrans-63.6-43.8-179.400000111.9K124 N146 S147 A154K124-A150 HydrophobicContact CB-CB 4.03Å; K124-A150 HydrophobicContact CD-CB 4.21Å; K124-A150 HydrophobicContact CG-CB 3.93Å; N146-A150 WeakPolarHBondContact O-CB 3.42Å; N146-A150 PolarHBondContact O-N 2.97Å; S147-A150 PolarHBondContact O-N 3.43Å; A150-A154 WeakPolarHBondContact O-CB 3.31Å; A150-A154 PolarHBondContact O-N 2.99Å
151Y98.9Very high98.1Very high0 Ų058.2 Ų58.20%029%0.285CS..Hα-helixtrans-63.9-42.8174.7-75.3-55.6000112.6G125 D126 R129 S147 Q148 A154 F155 L172 N175 F176 F179G125-Y151 VanDerWaalsContact C-OH 3.26Å; G125-Y151 WeakPolarHBondContact O-CE2 3.43Å; G125-Y151 PolarHBondContact O-OH 3.42Å; D126-Y151 VanDerWaalsContact CA-OH 3.25Å; D126-Y151 WeakPolarHBondContact CA-OH 3.48Å; D126-Y151 PolarHBondContact N-OH 3.01Å; D126-Y151 VanDerWaalsContact N-OH 3.16Å; D126-Y151 PolarHBondContact OD1-OH 3Å; R129-Y151 PolarHBondContact NE-OH 3.27Å; S147-Y151 WeakPolarHBondContact O-CD2 3.36Å; S147-Y151 PolarHBondContact O-N 3.42Å; S147-Y151 VanDerWaalsContact OG-CE2 3.3Å; S147-Y151 WeakPolarHBondContact OG-CE2 3.46Å; Q148-Y151 PolarHBondContact O-N 2.98Å; Y151-A154 PolarHBondContact O-N 3.17Å; Y151-F155 VanDerWaalsContact O-CB 3.23Å; Y151-F155 WeakPolarHBondContact O-CB 3.43Å; Y151-F155 PolarHBondContact O-N 2.71Å; Y151-L172 HydrophobicContact CD1-CD1 3.65Å; Y151-L172 HydrophobicContact CE1-CD1 4.34Å; 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 3.92Å; Y151-F176 HydrophobicContact CD1-CD2 4.32Å; Y151-F176 HydrophobicContact CD1-CG 4.17Å; Y151-F176 AromaticContact CD2-CD2 3.64Å; Y151-F176 HydrophobicContact CD2-CD2 3.64Å; Y151-F176 HydrophobicContact CD2-CE2 4.04Å; Y151-F176 HydrophobicContact CD2-CG 4.3Å; Y151-F176 HydrophobicContact CE1-CB 4.38Å; Y151-F176 HydrophobicContact CE2-CD2 4.47Å; 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 4.23Å; Y151-F179 HydrophobicContact CD2-CD1 4.22Å; Y151-F179 HydrophobicContact CD2-CG 4.1Å; Y151-F179 HydrophobicContact CE2-CB 3.78Å; Y151-F179 HydrophobicContact CE2-CD1 4.49Å; Y151-F179 HydrophobicContact CE2-CD2 4.24Å; Y151-F179 AromaticContact CE2-CG 3.92Å; Y151-F179 HydrophobicContact CE2-CG 3.92Å
152Q98.7Very high98.2Very high67 Ų6752.3 Ų52.331%0.31326%0.257SS..Hα-helixtrans-63.8-44.5179.3-169.466.548.700111.1Q148 Q149 A154 F155 E156Q148-Q152 WeakPolarHBondContact O-CB 3.4Å; Q148-Q152 PolarHBondContact O-N 3.31Å; Q149-Q152 PolarHBondContact O-N 2.83Å; Q152-A154 PolarHBondContact O-N 3.03Å; Q152-F155 PolarHBondContact O-N 3Å; Q152-F155 VanDerWaalsContact O-N 3.15Å; Q152-E156 PolarHBondContact NE2-OE1 3.16Å; Q152-E156 WeakPolarHBondContact O-CG 3.27Å; Q152-E156 PolarHBondContact O-N 3.24Å
153E98.5Very high98.1Very high76 Ų7654.2 Ų54.236%0.35526%0.26SS..Hα-helixtrans-61-45.3176.8-168.9-175.7163.200111.4K117 L121 Q149 F155 E156 I157K117-E153 WeakPolarHBondContact CE-OE1 3.3Å; K117-E153 IonicContact NZ-OE1 2.96Å; L121-E153 HydrophobicContact CD1-CB 4.1Å; L121-E153 HydrophobicContact CD1-CG 3.71Å; L121-E153 HydrophobicContact CD2-CB 4.43Å; L121-E153 HydrophobicContact CD2-CG 4.43Å; Q149-E153 PolarHBondContact O-N 3.41Å; E153-F155 VanDerWaalsContact C-N 3.27Å; E153-F155 PolarHBondContact O-N 3.37Å; E153-E156 PolarHBondContact O-N 3.37Å; E153-I157 HydrophobicContact CG-CD1 4.19Å; E153-I157 WeakPolarHBondContact O-CD1 3.12Å; E153-I157 WeakPolarHBondContact O-CG1 3.49Å; E153-I157 PolarHBondContact O-N 2.94Å
154A98.8Very high98.1Very high0 Ų054.1 Ų54.10%026%0.26CS..Hα-helixtrans-58.2-42.1174.400000111.4V118 L121 A150 Y151 Q152 I157 S158 L172V118-A154 HydrophobicContact CG1-CB 4.35Å; L121-A154 HydrophobicContact CB-CB 3.66Å; A150-A154 WeakPolarHBondContact O-CB 3.31Å; A150-A154 PolarHBondContact O-N 2.99Å; Y151-A154 PolarHBondContact O-N 3.17Å; Q152-A154 PolarHBondContact O-N 3.03Å; A154-I157 PolarHBondContact O-N 2.81Å; A154-S158 VanDerWaalsContact O-CB 3.3Å; A154-S158 WeakPolarHBondContact O-CB 3.34Å; A154-S158 PolarHBondContact O-N 2.9Å; A154-S158 PolarHBondContact O-OG 3.47Å; A154-L172 VanDerWaalsContact C-CD2 3.49Å; A154-L172 HydrophobicContact CB-CD1 3.8Å; A154-L172 HydrophobicContact CB-CD2 3.66Å; A154-L172 HydrophobicContact CB-CG 4.4Å
155F98.4Very high98Very high26 Ų2653.9 Ų53.911%0.11426%0.259CS..Hα-helixtrans-68.3-44.2-175.5-167.1-114.4000111.7Y151 Q152 E153 I157 S158 K159 L172 F176 L193Y151-F155 VanDerWaalsContact O-CB 3.23Å; Y151-F155 WeakPolarHBondContact O-CB 3.43Å; Y151-F155 PolarHBondContact O-N 2.71Å; Q152-F155 PolarHBondContact O-N 3Å; Q152-F155 VanDerWaalsContact O-N 3.15Å; E153-F155 VanDerWaalsContact C-N 3.27Å; E153-F155 PolarHBondContact O-N 3.37Å; F155-I157 VanDerWaalsContact C-N 3.34Å; F155-I157 PolarHBondContact O-N 2.7Å; F155-S158 WeakPolarHBondContact CA-OG 3.28Å; F155-S158 PolarHBondContact O-N 3.32Å; F155-S158 PolarHBondContact O-OG 3.04Å; F155-K159 HydrophobicContact CD1-CD 4.07Å; F155-K159 HydrophobicContact CE1-CD 3.76Å; F155-K159 HydrophobicContact CE1-CG 4.47Å; F155-K159 HydrophobicContact CZ-CD 4.13Å; F155-K159 WeakPolarHBondContact O-CB 3.42Å; F155-K159 PolarHBondContact O-N 3.28Å; F155-L172 HydrophobicContact CB-CD2 4.17Å; F155-L172 HydrophobicContact CD2-CD2 4.21Å; F155-F176 HydrophobicContact CB-CE1 4.43Å; F155-L193 HydrophobicContact CE1-CD1 4.3Å; F155-L193 HydrophobicContact CE2-CD1 3.55Å; F155-L193 HydrophobicContact CZ-CD1 3.38Å
156E98.3Very high97.9Very high82 Ų8253.3 Ų53.338%0.38325%0.25SC..Hα-helixtrans-60.5-40.8175.9-69.1-51.513600112.8Q152 E153 K160Q152-E156 PolarHBondContact NE2-OE1 3.16Å; Q152-E156 WeakPolarHBondContact O-CG 3.27Å; Q152-E156 PolarHBondContact O-N 3.24Å; E153-E156 PolarHBondContact O-N 3.37Å; E156-K160 WeakPolarHBondContact O-CG 3.42Å
157I98.5Very high97.8Very high33 Ų3352.1 Ų52.117%0.16924%0.244CC..Hα-helixtrans-69.1-47.3176.5-62.1163.4000109.7A114 K117 V118 L121 E153 A154 F155 K159 K160 E161A114-I157 HydrophobicContact CB-CG2 4.11Å; K117-I157 HydrophobicContact CD-CD1 3.75Å; K117-I157 HydrophobicContact CG-CD1 3.98Å; V118-I157 HydrophobicContact CG2-CB 3.78Å; V118-I157 HydrophobicContact CG2-CG2 3.55Å; L121-I157 HydrophobicContact CD1-CD1 3.73Å; E153-I157 HydrophobicContact CG-CD1 4.19Å; E153-I157 WeakPolarHBondContact O-CD1 3.12Å; E153-I157 WeakPolarHBondContact O-CG1 3.49Å; E153-I157 PolarHBondContact O-N 2.94Å; A154-I157 PolarHBondContact O-N 2.81Å; F155-I157 VanDerWaalsContact C-N 3.34Å; F155-I157 PolarHBondContact O-N 2.7Å; I157-K159 VanDerWaalsContact C-N 3.29Å; I157-K159 PolarHBondContact O-N 3.35Å; I157-K160 PolarHBondContact O-N 3.2Å; I157-K160 VanDerWaalsContact O-N 3.11Å; I157-E161 HydrophobicContact CG2-CG 4.34Å; I157-E161 PolarHBondContact O-N 3.45Å
158S98.3Very high97.8Very high0 Ų053.1 Ų53.10%025%0.249CC..Hα-helixtrans-61.7-35.8-177.374.80000113.1A154 F155 K160 M162A154-S158 VanDerWaalsContact O-CB 3.3Å; A154-S158 WeakPolarHBondContact O-CB 3.34Å; A154-S158 PolarHBondContact O-N 2.9Å; A154-S158 PolarHBondContact O-OG 3.47Å; F155-S158 WeakPolarHBondContact CA-OG 3.28Å; F155-S158 PolarHBondContact O-N 3.32Å; F155-S158 PolarHBondContact O-OG 3.04Å; S158-K160 VanDerWaalsContact C-N 3.31Å; S158-K160 PolarHBondContact O-N 3Å; S158-M162 VanDerWaalsContact O-CB 3.31Å; S158-M162 WeakPolarHBondContact O-CB 3.25Å; S158-M162 PolarHBondContact O-N 3.4Å; S158-M162 VanDerWaalsContact O-N 3.09Å
159K97.2Very high97.8Very high97 Ų9750.9 Ų50.942%0.42224%0.238SC..Hα-helixtrans-66.8-31.5177-84-173.6160.5-179.90113.3F155 I157F155-K159 HydrophobicContact CD1-CD 4.07Å; F155-K159 HydrophobicContact CE1-CD 3.76Å; F155-K159 HydrophobicContact CE1-CG 4.47Å; F155-K159 HydrophobicContact CZ-CD 4.13Å; F155-K159 WeakPolarHBondContact O-CB 3.42Å; F155-K159 PolarHBondContact O-N 3.28Å; I157-K159 VanDerWaalsContact C-N 3.29Å; I157-K159 PolarHBondContact O-N 3.35Å
160K97.4Very high97.7Very high156 Ų15645.2 Ų45.268%0.67821%0.211SC*.Hα-helixtrans-86.4-37.8-177.2-68.2173.9-172.1175.70112.4E156 I157 S158E156-K160 WeakPolarHBondContact O-CG 3.42Å; I157-K160 PolarHBondContact O-N 3.2Å; I157-K160 VanDerWaalsContact O-N 3.11Å; S158-K160 VanDerWaalsContact C-N 3.31Å; S158-K160 PolarHBondContact O-N 3Å
161E97.6Very high97.7Very high138 Ų13845.4 Ų45.465%0.64521%0.214SC*.Hα-helixtrans-114-6.4-164.3-59.2-66.5153.900113.9A114 I157A114-E161 HydrophobicContact CB-CB 3.67Å; A114-E161 HydrophobicContact CB-CG 3.98Å; I157-E161 HydrophobicContact CG2-CG 4.34Å; I157-E161 PolarHBondContact O-N 3.45Å
162M96.6Very high97.7Very high13 Ų1345.4 Ų45.46%0.06421%0.214CC..SBendtrans-131.7140.2-172.6-52172.768.800111.8V118 S158 H166 I168 R169V118-M162 HydrophobicContact CB-SD 3.97Å; V118-M162 HydrophobicContact CG1-SD 3.97Å; V118-M162 HydrophobicContact CG2-SD 3.8Å; S158-M162 VanDerWaalsContact O-CB 3.31Å; S158-M162 WeakPolarHBondContact O-CB 3.25Å; S158-M162 PolarHBondContact O-N 3.4Å; S158-M162 VanDerWaalsContact O-N 3.09Å; M162-H166 HydrophobicContact CB-CB 4.31Å; M162-H166 HydrophobicContact CE-CB 4.1Å; M162-H166 VanDerWaalsContact CE-CE1 3.44Å; M162-H166 WeakPolarHBondContact CE-CE1 3.25Å; M162-H166 WeakPolarHBondContact CE-ND1 3.42Å; M162-I168 HydrophobicContact CE-CB 3.8Å; M162-I168 HydrophobicContact CE-CG2 3.9Å; M162-R169 HydrophobicContact CB-CB 4.38Å; M162-R169 HydrophobicContact CE-CB 4.21Å; M162-R169 PolarHBondContact O-NH1 3.29Å
163Q96Very high97.7Very high120 Ų12042.3 Ų42.356%0.56120%0.2SC*.  trans-64.3146.4174.9-61.4-58.7-22.300111.2T165 H166 R169 E204Q163-T165 PolarHBondContact O-N 3.01Å; Q163-T165 VanDerWaalsContact O-N 3.12Å; Q163-H166 WeakPolarHBondContact O-CB 3.37Å; Q163-H166 PolarHBondContact O-N 3.47Å; Q163-R169 WeakPolarHBondContact O-CD 3.42Å; Q163-E204 PolarHBondContact OE1-OE2 3.4Å
164P97.2Very high97.7Very high12 Ų1239.7 Ų39.78%0.07819%0.188CC..THydrogen-bonded Turntrans-51.3-32.5175-28.135.4000114.5H166 L170 E200 E204P164-H166 VanDerWaalsContact C-N 3.3Å; P164-H166 PolarHBondContact O-N 3.37Å; P164-L170 WeakPolarHBondContact O-CG 3.14Å; P164-E200 HydrophobicContact CB-CB 3.84Å; P164-E200 HydrophobicContact CG-CB 4.28Å; P164-E204 WeakPolarHBondContact CD-OE2 3.18Å
165T96.5Very high97.7Very high8 Ų841 Ų415%0.04920%0.195CC..THydrogen-bonded Turntrans-79.6-5.317950.90000114.4Q163 A201 E204 L208 S216Q163-T165 PolarHBondContact O-N 3.01Å; Q163-T165 VanDerWaalsContact O-N 3.12Å; T165-A201 HydrophobicContact CG2-CB 4.45Å; T165-A201 WeakPolarHBondContact CG2-O 3.17Å; T165-E204 HydrophobicContact CG2-CB 3.9Å; T165-L208 HydrophobicContact CG2-CD1 3.79Å; T165-L208 HydrophobicContact CG2-CG 4.1Å; T165-S216 WeakPolarHBondContact O-CB 3.37Å; T165-S216 PolarHBondContact O-OG 3.44Å
166H96.2Very high97.7Very high48 Ų4839.9 Ų39.922%0.22219%0.19CC..  trans-68127.9-175.4-169.6-58.1000111.4E115 M162 Q163 P164 I168 R169 L170E115-H166 IonicContact OE2-CE1 2.89Å; E115-H166 IonicContact OE2-NE2 3.5Å; M162-H166 HydrophobicContact CB-CB 4.31Å; M162-H166 HydrophobicContact CE-CB 4.1Å; M162-H166 VanDerWaalsContact CE-CE1 3.44Å; M162-H166 WeakPolarHBondContact CE-CE1 3.25Å; M162-H166 WeakPolarHBondContact CE-ND1 3.42Å; Q163-H166 WeakPolarHBondContact O-CB 3.37Å; Q163-H166 PolarHBondContact O-N 3.47Å; P164-H166 VanDerWaalsContact C-N 3.3Å; P164-H166 PolarHBondContact O-N 3.37Å; H166-I168 VanDerWaalsContact C-N 3.34Å; H166-I168 PolarHBondContact ND1-N 3.18Å; H166-I168 VanDerWaalsContact ND1-N 3.18Å; H166-I168 PolarHBondContact O-N 2.82Å; H166-R169 HydrophobicContact CB-CB 4.22Å; H166-R169 PolarHBondContact O-N 3.33Å; H166-L170 PolarHBondContact O-N 2.8Å
167P96.6Very high97.8Very high21 Ų2136 Ų3614%0.13617%0.172CC..Hα-helixtrans-53.2-44.2-175.6-27.331000114.5L170 G171 D215 S216 I219P167-L170 PolarHBondContact O-N 3.45Å; P167-G171 PolarHBondContact O-N 3.03Å; P167-D215 HydrophobicContact CB-CB 4.13Å; P167-D215 HydrophobicContact CG-CB 4.05Å; P167-S216 WeakPolarHBondContact CD-OG 3.42Å; P167-S216 WeakPolarHBondContact CG-OG 3.47Å; P167-I219 HydrophobicContact CB-CD1 4.12Å; P167-I219 VanDerWaalsContact O-CD1 3.28Å; P167-I219 WeakPolarHBondContact O-CD1 3.24Å
168I97.6Very high97.8Very high21 Ų2135.2 Ų35.211%0.10817%0.169CC..Hα-helixtrans-64.3-39.2177.3-68.9167.8000112.9E115 V118 F119 M162 H166 G171 L172E115-I168 HydrophobicContact CG-CD1 3.34Å; E115-I168 WeakPolarHBondContact OE1-CD1 3.38Å; V118-I168 HydrophobicContact CB-CG2 4.3Å; V118-I168 HydrophobicContact CG1-CG2 3.75Å; F119-I168 HydrophobicContact CB-CD1 4.39Å; F119-I168 HydrophobicContact CB-CG2 4.46Å; F119-I168 HydrophobicContact CD2-CD1 3.79Å; F119-I168 HydrophobicContact CD2-CG1 4.06Å; M162-I168 HydrophobicContact CE-CB 3.8Å; M162-I168 HydrophobicContact CE-CG2 3.9Å; H166-I168 VanDerWaalsContact C-N 3.34Å; H166-I168 PolarHBondContact ND1-N 3.18Å; H166-I168 VanDerWaalsContact ND1-N 3.18Å; H166-I168 PolarHBondContact O-N 2.82Å; I168-G171 PolarHBondContact O-N 3.22Å; I168-L172 WeakPolarHBondContact O-CB 3.3Å; I168-L172 PolarHBondContact O-N 3.24Å
169R98.1Very high97.8Very high25 Ų2535.2 Ų35.29%0.09417%0.169CC..Hα-helixtrans-66.8-44176.2177.2176.2167.4172.4-6.1110.8M162 Q163 H166 L172 A173 E200M162-R169 HydrophobicContact CB-CB 4.38Å; M162-R169 HydrophobicContact CE-CB 4.21Å; M162-R169 PolarHBondContact O-NH1 3.29Å; Q163-R169 WeakPolarHBondContact O-CD 3.42Å; H166-R169 HydrophobicContact CB-CB 4.22Å; H166-R169 PolarHBondContact O-N 3.33Å; R169-L172 WeakPolarHBondContact O-CB 3.47Å; R169-L172 PolarHBondContact O-N 2.9Å; R169-A173 PolarHBondContact O-N 3.43Å; R169-E200 IonicContact CZ-OE2 2.62Å; R169-E200 IonicContact NH2-OE2 3.25Å; R169-E200 PolarHBondContact NH2-OE2 3.5Å
170L98.5Very high97.8Very high2 Ų231.9 Ų31.91%0.0115%0.154CC..Hα-helixtrans-61.6-45.3174.4-74.4168.4000111.8P164 H166 P167 L172 A173 L174 A201 I219 M220 L223P164-L170 WeakPolarHBondContact O-CG 3.14Å; H166-L170 PolarHBondContact O-N 2.8Å; P167-L170 PolarHBondContact O-N 3.45Å; L170-L172 VanDerWaalsContact C-N 3.28Å; L170-L172 PolarHBondContact O-N 2.96Å; L170-A173 PolarHBondContact O-N 3.09Å; L170-L174 PolarHBondContact O-N 3.22Å; L170-A201 HydrophobicContact CD1-CB 4.44Å; L170-A201 HydrophobicContact CD2-CB 3.74Å; L170-I219 HydrophobicContact CB-CB 4.18Å; L170-I219 HydrophobicContact CB-CD1 4.47Å; L170-I219 HydrophobicContact CB-CG2 3.64Å; L170-M220 HydrophobicContact CD1-CG 3.95Å; L170-M220 HydrophobicContact CD1-SD 4.35Å; L170-M220 HydrophobicContact CD2-CG 4.06Å; L170-L223 HydrophobicContact CD2-CD1 3.96Å
171G98.4Very high97.9Very high9 Ų926.6 Ų26.69%0.09313%0.13CC..Hα-helixtrans-64-33.7177.800000112.5K122 P167 I168 N175K122-G171 WeakPolarHBondContact CE-O 3.36Å; P167-G171 PolarHBondContact O-N 3.03Å; I168-G171 PolarHBondContact O-N 3.22Å; G171-N175 PolarHBondContact O-N 3.03Å; G171-N175 VanDerWaalsContact O-N 3.09Å
172L98.8Very high97.8Very high0 Ų025 Ų250%012%0.123CC..Hα-helixtrans-63.9-49.3171169.663.7000111.3V118 K122 Y151 A154 F155 I168 R169 L170 L174 N175 F176V118-L172 HydrophobicContact CG1-CD2 4.04Å; K122-L172 HydrophobicContact CB-CD1 4.01Å; K122-L172 HydrophobicContact CD-CB 4.11Å; K122-L172 HydrophobicContact CG-CB 4.29Å; K122-L172 HydrophobicContact CG-CD1 3.99Å; Y151-L172 HydrophobicContact CD1-CD1 3.65Å; Y151-L172 HydrophobicContact CE1-CD1 4.34Å; A154-L172 VanDerWaalsContact C-CD2 3.49Å; A154-L172 HydrophobicContact CB-CD1 3.8Å; A154-L172 HydrophobicContact CB-CD2 3.66Å; A154-L172 HydrophobicContact CB-CG 4.4Å; F155-L172 HydrophobicContact CB-CD2 4.17Å; F155-L172 HydrophobicContact CD2-CD2 4.21Å; I168-L172 WeakPolarHBondContact O-CB 3.3Å; I168-L172 PolarHBondContact O-N 3.24Å; R169-L172 WeakPolarHBondContact O-CB 3.47Å; R169-L172 PolarHBondContact O-N 2.9Å; L170-L172 VanDerWaalsContact C-N 3.28Å; L170-L172 PolarHBondContact O-N 2.96Å; L172-L174 VanDerWaalsContact C-N 3.31Å; L172-L174 PolarHBondContact O-N 3.33Å; L172-N175 PolarHBondContact O-N 3.46Å; L172-F176 VanDerWaalsContact O-CB 3.24Å; L172-F176 WeakPolarHBondContact O-CB 3.39Å; L172-F176 PolarHBondContact O-N 3.1Å
173A98.8Very high97.9Very high2 Ų225.8 Ų25.82%0.01713%0.127CC..Hα-helixtrans-59.8-42.217800000111.9R169 L170 S177 A197R169-A173 PolarHBondContact O-N 3.43Å; L170-A173 PolarHBondContact O-N 3.09Å; A173-S177 VanDerWaalsContact O-CB 3.27Å; A173-S177 WeakPolarHBondContact O-CB 3.44Å; A173-S177 PolarHBondContact O-N 2.84Å; A173-S177 PolarHBondContact O-OG 2.95Å; A173-A197 HydrophobicContact CB-CB 3.44Å; A173-A197 VanDerWaalsContact CB-CB 3.44Å
174L98.8Very high97.9Very high20 Ų2022.2 Ų22.211%0.10511%0.111CC..Hα-helixtrans-56.1-56.3174.717864.5000110.9L170 L172 F176 S177 V178 I219 L222 L223 N226L170-L174 PolarHBondContact O-N 3.22Å; L172-L174 VanDerWaalsContact C-N 3.31Å; L172-L174 PolarHBondContact O-N 3.33Å; L174-F176 PolarHBondContact O-N 3.43Å; L174-S177 PolarHBondContact O-N 3.37Å; L174-S177 PolarHBondContact O-OG 3.47Å; L174-V178 WeakPolarHBondContact O-CG2 3.32Å; L174-V178 PolarHBondContact O-N 2.9Å; L174-V178 VanDerWaalsContact O-N 3.15Å; L174-I219 HydrophobicContact CB-CG2 4.32Å; L174-I219 HydrophobicContact CD2-CG2 4.2Å; L174-L222 HydrophobicContact CD1-CB 4.11Å; L174-L222 HydrophobicContact CD2-CB 3.94Å; L174-L222 HydrophobicContact CD2-CD1 3.93Å; L174-L223 HydrophobicContact CB-CD2 3.93Å; L174-L223 HydrophobicContact CB-CG 4.24Å; L174-L223 HydrophobicContact CD1-CD2 3.98Å; L174-L223 HydrophobicContact CD1-CG 4.18Å; L174-N226 VanDerWaalsContact CD1-ND2 3.32Å; L174-N226 WeakPolarHBondContact CD1-ND2 3.35Å
175N98.6Very high97.9Very high29 Ų2928.3 Ų28.316%0.15514%0.143CC..Hα-helixtrans-70.1-34.5-174.9-73.115.9000113K122 D126 Y151 G171 L172 V178 F179K122-N175 PolarHBondContact NZ-ND2 2.9Å; D126-N175 WeakPolarHBondContact OD1-CB 3.37Å; D126-N175 PolarHBondContact OD1-ND2 2.92Å; D126-N175 PolarHBondContact OD2-ND2 2.92Å; Y151-N175 HydrophobicContact CE1-CB 4.16Å; G171-N175 PolarHBondContact O-N 3.03Å; G171-N175 VanDerWaalsContact O-N 3.09Å; L172-N175 PolarHBondContact O-N 3.46Å; N175-V178 PolarHBondContact O-N 3.17Å; N175-F179 PolarHBondContact O-N 3.22Å
176F98.8Very high97.9Very high2 Ų229.1 Ų29.11%0.00915%0.149CC..Hα-helixtrans-72.3-33.9177.4-167.3-167.6000111.8Y151 F155 L172 L174 F179 Y180 L193Y151-F176 VanDerWaalsContact CB-CD2 3.43Å; Y151-F176 VanDerWaalsContact CB-CE2 3.46Å; Y151-F176 HydrophobicContact CD1-CB 3.92Å; Y151-F176 HydrophobicContact CD1-CD2 4.32Å; Y151-F176 HydrophobicContact CD1-CG 4.17Å; Y151-F176 AromaticContact CD2-CD2 3.64Å; Y151-F176 HydrophobicContact CD2-CD2 3.64Å; Y151-F176 HydrophobicContact CD2-CE2 4.04Å; Y151-F176 HydrophobicContact CD2-CG 4.3Å; Y151-F176 HydrophobicContact CE1-CB 4.38Å; Y151-F176 HydrophobicContact CE2-CD2 4.47Å; 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 4.43Å; L172-F176 VanDerWaalsContact O-CB 3.24Å; L172-F176 WeakPolarHBondContact O-CB 3.39Å; L172-F176 PolarHBondContact O-N 3.1Å; L174-F176 PolarHBondContact O-N 3.43Å; F176-F179 HydrophobicContact CD2-CB 4.26Å; F176-F179 AromaticContact CD2-CD1 3.79Å; F176-F179 HydrophobicContact CD2-CD1 3.79Å; F176-F179 HydrophobicContact CD2-CG 4.43Å; F176-F179 AromaticContact CE2-CD1 3.71Å; F176-F179 HydrophobicContact CE2-CD1 3.71Å; F176-F179 HydrophobicContact CE2-CE1 4.17Å; F176-F179 WeakPolarHBondContact O-CB 3.31Å; F176-F179 PolarHBondContact O-N 2.86Å; F176-Y180 HydrophobicContact CD1-CE2 4.15Å; F176-Y180 AromaticContact CD2-CD2 4Å; F176-Y180 HydrophobicContact CD2-CD2 4Å; F176-Y180 AromaticContact CD2-CE2 3.66Å; F176-Y180 HydrophobicContact CD2-CE2 3.66Å; F176-Y180 AromaticContact CE1-CE2 3.95Å; F176-Y180 HydrophobicContact CE1-CE2 3.95Å; F176-Y180 HydrophobicContact CE2-CD2 4.12Å; F176-Y180 HydrophobicContact CE2-CE1 4.33Å; F176-Y180 AromaticContact CE2-CE2 3.43Å; F176-Y180 HydrophobicContact CE2-CE2 3.43Å; F176-Y180 VanDerWaalsContact CE2-CE2 3.43Å; F176-Y180 AromaticContact CE2-CZ 3.55Å; F176-Y180 HydrophobicContact CG-CD2 4.42Å; F176-Y180 HydrophobicContact CG-CE2 4.03Å; 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 3.25Å; F176-Y180 WeakPolarHBondContact O-CD2 3.45Å; F176-Y180 PolarHBondContact O-N 3.38Å; F176-L193 HydrophobicContact CB-CD2 3.82Å; F176-L193 HydrophobicContact CD1-CD2 3.75Å; F176-L193 HydrophobicContact CG-CD2 3.83Å
177S98.7Very high98Very high0 Ų027.7 Ų27.70%014%0.144CC..Hα-helixtrans-63.9-41.6171.769.70000111.8A173 L174 F179 Y180 Y181 A190 W230A173-S177 VanDerWaalsContact O-CB 3.27Å; A173-S177 WeakPolarHBondContact O-CB 3.44Å; A173-S177 PolarHBondContact O-N 2.84Å; A173-S177 PolarHBondContact O-OG 2.95Å; L174-S177 PolarHBondContact O-N 3.37Å; L174-S177 PolarHBondContact O-OG 3.47Å; S177-F179 VanDerWaalsContact C-N 3.32Å; S177-F179 PolarHBondContact O-N 3.4Å; S177-Y180 PolarHBondContact O-N 2.88Å; S177-Y181 PolarHBondContact O-N 3.35Å; S177-A190 WeakPolarHBondContact CB-O 3.49Å; S177-A190 VanDerWaalsContact O-CB 3.25Å; S177-A190 WeakPolarHBondContact O-CB 3.4Å; S177-W230 WeakPolarHBondContact OG-CH2 2.88Å
178V98.4Very high98Very high17 Ų1732.9 Ų32.910%0.10317%0.166CC..Hα-helixtrans-61.6-39.4173.7174.90000111.3L174 N175 Y181 E182 W230L174-V178 WeakPolarHBondContact O-CG2 3.32Å; L174-V178 PolarHBondContact O-N 2.9Å; L174-V178 VanDerWaalsContact O-N 3.15Å; N175-V178 PolarHBondContact O-N 3.17Å; V178-Y181 PolarHBondContact O-N 3.06Å; V178-E182 HydrophobicContact CG1-CG 3.95Å; V178-E182 VanDerWaalsContact CG1-OE2 3.28Å; V178-E182 WeakPolarHBondContact CG1-OE2 3.24Å; V178-E182 WeakPolarHBondContact O-CB 3.39Å; V178-E182 PolarHBondContact O-N 3.33Å; V178-W230 HydrophobicContact CG2-CH2 4.02Å; V178-W230 HydrophobicContact CG2-CZ2 4Å
179F98.7Very high98Very high0 Ų037.5 Ų37.50%019%0.186CC..Hα-helixtrans-59.5-47.2172.7172.4-105.1000112.4R129 V144 S147 Q148 Y151 N175 F176 S177 Y181 I183 L184R129-F179 HydrophobicContact CB-CD2 4.24Å; R129-F179 HydrophobicContact CG-CD2 4.23Å; V144-F179 HydrophobicContact CG1-CE2 4.5Å; V144-F179 HydrophobicContact CG1-CZ 4.1Å; S147-F179 WeakPolarHBondContact OG-CD2 3.42Å; S147-F179 WeakPolarHBondContact OG-CE2 3.31Å; Q148-F179 HydrophobicContact CB-CE1 3.78Å; Q148-F179 HydrophobicContact CB-CZ 3.86Å; Q148-F179 HydrophobicContact CG-CE1 4.17Å; Y151-F179 HydrophobicContact CD2-CB 4.23Å; Y151-F179 HydrophobicContact CD2-CD1 4.22Å; Y151-F179 HydrophobicContact CD2-CG 4.1Å; Y151-F179 HydrophobicContact CE2-CB 3.78Å; Y151-F179 HydrophobicContact CE2-CD1 4.49Å; Y151-F179 HydrophobicContact CE2-CD2 4.24Å; Y151-F179 AromaticContact CE2-CG 3.92Å; Y151-F179 HydrophobicContact CE2-CG 3.92Å; N175-F179 PolarHBondContact O-N 3.22Å; F176-F179 HydrophobicContact CD2-CB 4.26Å; F176-F179 AromaticContact CD2-CD1 3.79Å; F176-F179 HydrophobicContact CD2-CD1 3.79Å; F176-F179 HydrophobicContact CD2-CG 4.43Å; F176-F179 AromaticContact CE2-CD1 3.71Å; F176-F179 HydrophobicContact CE2-CD1 3.71Å; F176-F179 HydrophobicContact CE2-CE1 4.17Å; F176-F179 WeakPolarHBondContact O-CB 3.31Å; F176-F179 PolarHBondContact O-N 2.86Å; S177-F179 VanDerWaalsContact C-N 3.32Å; S177-F179 PolarHBondContact O-N 3.4Å; F179-Y181 VanDerWaalsContact C-N 3.27Å; F179-Y181 PolarHBondContact O-N 2.65Å; F179-I183 HydrophobicContact CD2-CB 3.72Å; F179-I183 HydrophobicContact CD2-CG1 3.81Å; F179-I183 HydrophobicContact CD2-CG2 4.08Å; F179-I183 HydrophobicContact CE2-CB 3.81Å; F179-I183 HydrophobicContact CE2-CG1 4.25Å; F179-I183 HydrophobicContact CE2-CG2 3.65Å; F179-I183 HydrophobicContact CZ-CG2 4.48Å; F179-I183 WeakPolarHBondContact O-CB 3.44Å; F179-I183 PolarHBondContact O-N 3.37Å; F179-L184 HydrophobicContact CD1-CD1 4.04Å; F179-L184 HydrophobicContact CD1-CG 4.31Å; F179-L184 HydrophobicContact CE1-CD1 3.34Å; F179-L184 HydrophobicContact CE1-CD2 4.42Å; F179-L184 HydrophobicContact CE1-CG 3.67Å; F179-L184 HydrophobicContact CZ-CD1 3.9Å; F179-L184 HydrophobicContact CZ-CD2 4.14Å; F179-L184 HydrophobicContact CZ-CG 3.78Å; F179-L184 PolarHBondContact O-N 2.94Å
180Y98.6Very high98Very high26 Ų2636.3 Ų36.310%0.10218%0.181CC..Hα-helixtrans-59.5-40.5176.9-80.1-60.7000112F176 S177 L184 N185 S186 K189 L193F176-Y180 HydrophobicContact CD1-CE2 4.15Å; F176-Y180 AromaticContact CD2-CD2 4Å; F176-Y180 HydrophobicContact CD2-CD2 4Å; F176-Y180 AromaticContact CD2-CE2 3.66Å; F176-Y180 HydrophobicContact CD2-CE2 3.66Å; F176-Y180 AromaticContact CE1-CE2 3.95Å; F176-Y180 HydrophobicContact CE1-CE2 3.95Å; F176-Y180 HydrophobicContact CE2-CD2 4.12Å; F176-Y180 HydrophobicContact CE2-CE1 4.33Å; F176-Y180 AromaticContact CE2-CE2 3.43Å; F176-Y180 HydrophobicContact CE2-CE2 3.43Å; F176-Y180 VanDerWaalsContact CE2-CE2 3.43Å; F176-Y180 AromaticContact CE2-CZ 3.55Å; F176-Y180 HydrophobicContact CG-CD2 4.42Å; F176-Y180 HydrophobicContact CG-CE2 4.03Å; 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 3.25Å; F176-Y180 WeakPolarHBondContact O-CD2 3.45Å; F176-Y180 PolarHBondContact O-N 3.38Å; S177-Y180 PolarHBondContact O-N 2.88Å; Y180-L184 HydrophobicContact CD1-CB 4.48Å; Y180-L184 HydrophobicContact CD1-CD1 3.57Å; Y180-L184 HydrophobicContact CE1-CD1 3.71Å; Y180-L184 CarbonylContact O-C 3.45Å; Y180-N185 PolarHBondContact O-N 3Å; Y180-S186 PolarHBondContact O-N 3.14Å; Y180-K189 HydrophobicContact CD1-CB 3.91Å; Y180-K189 HydrophobicContact CD1-CD 4.05Å; Y180-K189 HydrophobicContact CD2-CB 4.45Å; Y180-K189 HydrophobicContact CE1-CB 4.36Å; Y180-K189 HydrophobicContact CE1-CD 3.96Å; Y180-K189 HydrophobicContact CG-CB 3.99Å; Y180-L193 HydrophobicContact CD2-CD2 3.98Å; Y180-L193 HydrophobicContact CE2-CD2 3.91Å
181Y98.1Very high98Very high45 Ų4537.2 Ų37.218%0.17619%0.187CC..Hα-helixtrans-70.3-63.7179.9-164.9-97.5000111.8S177 V178 F179 N185 P187 A190 W230 E233S177-Y181 PolarHBondContact O-N 3.35Å; V178-Y181 PolarHBondContact O-N 3.06Å; F179-Y181 VanDerWaalsContact C-N 3.27Å; F179-Y181 PolarHBondContact O-N 2.65Å; Y181-N185 WeakPolarHBondContact O-CA 3.37Å; Y181-N185 PolarHBondContact O-N 2.7Å; Y181-P187 HydrophobicContact CD2-CB 3.86Å; Y181-P187 HydrophobicContact CE2-CB 3.72Å; Y181-A190 HydrophobicContact CD2-CB 4.23Å; Y181-W230 AromaticContact CD1-CD1 3.78Å; Y181-W230 AromaticContact CD1-CE2 3.94Å; Y181-W230 HydrophobicContact CD1-CG 4.47Å; Y181-W230 HydrophobicContact CD1-CZ2 4.48Å; Y181-W230 AromaticContact CD1-NE1 3.41Å; Y181-W230 HydrophobicContact CD2-CB 4.1Å; Y181-W230 AromaticContact CD2-CD1 3.65Å; Y181-W230 AromaticContact CD2-CD2 3.72Å; Y181-W230 HydrophobicContact CD2-CD2 3.72Å; Y181-W230 AromaticContact CD2-CE2 3.89Å; Y181-W230 HydrophobicContact CD2-CE3 4.39Å; Y181-W230 AromaticContact CD2-CG 3.57Å; Y181-W230 HydrophobicContact CD2-CG 3.57Å; Y181-W230 AromaticContact CD2-NE1 3.83Å; Y181-W230 AromaticContact CE1-CD1 3.44Å; Y181-W230 VanDerWaalsContact CE1-CD1 3.44Å; Y181-W230 HydrophobicContact CE1-CG 4.31Å; Y181-W230 AromaticContact CE1-NE1 3.49Å; Y181-W230 HydrophobicContact CE2-CB 3.63Å; Y181-W230 AromaticContact CE2-CD1 3.34Å; Y181-W230 HydrophobicContact CE2-CD2 4.09Å; Y181-W230 AromaticContact CE2-CG 3.41Å; Y181-W230 HydrophobicContact CE2-CG 3.41Å; Y181-W230 VanDerWaalsContact CE2-CG 3.41Å; Y181-W230 AromaticContact CE2-NE1 3.94Å; Y181-W230 AromaticContact CG-CD1 3.87Å; Y181-W230 HydrophobicContact CG-CD2 4.01Å; Y181-W230 AromaticContact CG-CE2 3.66Å; Y181-W230 HydrophobicContact CG-CG 4.13Å; Y181-W230 HydrophobicContact CG-CZ2 4.13Å; Y181-W230 AromaticContact CG-NE1 3.58Å; Y181-W230 AromaticContact CZ-CD1 3.22Å; Y181-W230 AromaticContact CZ-CG 3.8Å; Y181-W230 AromaticContact CZ-NE1 3.78Å; Y181-E233 PolarHBondContact OH-OE2 3.49Å
182E96.3Very high97.9Very high106 Ų10640.2 Ų40.250%0.49521%0.207SC..Hα-helixtrans-77.5-31.8-167.8-63.3-179.9167.500113.5R129 V178R129-E182 IonicContact NH1-OE2 2.7Å; V178-E182 HydrophobicContact CG1-CG 3.95Å; V178-E182 VanDerWaalsContact CG1-OE2 3.28Å; V178-E182 WeakPolarHBondContact CG1-OE2 3.24Å; V178-E182 WeakPolarHBondContact O-CB 3.39Å; V178-E182 PolarHBondContact O-N 3.33Å
183I97.4Very high97.9Very high29 Ų2941.1 Ų41.115%0.14921%0.212CC..THydrogen-bonded Turntrans-105.3-44.3-171.7-54.6-55.3000112.4R129 V144 F179R129-I183 HydrophobicContact CG-CD1 4.32Å; R129-I183 HydrophobicContact CG-CG1 3.83Å; V144-I183 HydrophobicContact CG1-CG2 4.48Å; V144-I183 HydrophobicContact CG2-CG2 3.62Å; F179-I183 HydrophobicContact CD2-CB 3.72Å; F179-I183 HydrophobicContact CD2-CG1 3.81Å; F179-I183 HydrophobicContact CD2-CG2 4.08Å; F179-I183 HydrophobicContact CE2-CB 3.81Å; F179-I183 HydrophobicContact CE2-CG1 4.25Å; F179-I183 HydrophobicContact CE2-CG2 3.65Å; F179-I183 HydrophobicContact CZ-CG2 4.48Å; F179-I183 WeakPolarHBondContact O-CB 3.44Å; F179-I183 PolarHBondContact O-N 3.37Å
184L97.2Very high97.9Very high45 Ų4541 Ų4124%0.23621%0.211CC..THydrogen-bonded Turntrans-90.8-2.4179.8-67.3-176.7000113.6V144 F179 Y180 S186V144-L184 HydrophobicContact CG1-CD2 3.51Å; F179-L184 HydrophobicContact CD1-CD1 4.04Å; F179-L184 HydrophobicContact CD1-CG 4.31Å; F179-L184 HydrophobicContact CE1-CD1 3.34Å; F179-L184 HydrophobicContact CE1-CD2 4.42Å; F179-L184 HydrophobicContact CE1-CG 3.67Å; F179-L184 HydrophobicContact CZ-CD1 3.9Å; F179-L184 HydrophobicContact CZ-CD2 4.14Å; F179-L184 HydrophobicContact CZ-CG 3.78Å; F179-L184 PolarHBondContact O-N 2.94Å; Y180-L184 HydrophobicContact CD1-CB 4.48Å; Y180-L184 HydrophobicContact CD1-CD1 3.57Å; Y180-L184 HydrophobicContact CE1-CD1 3.71Å; Y180-L184 CarbonylContact O-C 3.45Å; L184-S186 PolarHBondContact O-N 3.14Å; L184-S186 VanDerWaalsContact O-N 3.13Å; L184-S186 PolarHBondContact O-OG 3.38Å
185N96.4Very high97.9Very high139 Ų13945.4 Ų45.474%0.74323%0.229SC*.  trans46.244.9-177.4-164.852.3000111.9Y180 Y181 P187Y180-N185 PolarHBondContact O-N 3Å; Y181-N185 WeakPolarHBondContact O-CA 3.37Å; Y181-N185 PolarHBondContact O-N 2.7Å; N185-P187 VanDerWaalsContact C-CD 3.44Å; N185-P187 WeakPolarHBondContact O-CD 3.35Å
186S97.6Very high97.9Very high25 Ų2546.8 Ų46.818%0.17524%0.239CC..  trans-121.968.4-173.7-65.30000109.8Y180 L184 E188 K189 A190Y180-S186 PolarHBondContact O-N 3.14Å; L184-S186 PolarHBondContact O-N 3.14Å; L184-S186 VanDerWaalsContact O-N 3.13Å; L184-S186 PolarHBondContact O-OG 3.38Å; S186-E188 VanDerWaalsContact C-N 3.27Å; S186-E188 PolarHBondContact O-N 2.65Å; S186-K189 PolarHBondContact O-N 3.3Å; S186-K189 VanDerWaalsContact O-N 3.13Å; S186-A190 PolarHBondContact O-N 3.02Å
187P97.1Very high97.9Very high18 Ų1847.3 Ų47.312%0.11724%0.243CC..Hα-helixtrans-62.9-30.6-17226.9-35.6000113.2Y181 N185 K189 A190 C191 N234Y181-P187 HydrophobicContact CD2-CB 3.86Å; Y181-P187 HydrophobicContact CE2-CB 3.72Å; N185-P187 VanDerWaalsContact C-CD 3.44Å; N185-P187 WeakPolarHBondContact O-CD 3.35Å; P187-K189 PolarHBondContact O-N 3.39Å; P187-A190 PolarHBondContact O-N 3.32Å; P187-C191 WeakPolarHBondContact O-CB 3.47Å; P187-C191 PolarHBondContact O-N 3.11Å; P187-C191 PolarHBondContact O-SG 3.5Å; P187-N234 WeakPolarHBondContact CB-ND2 3.42Å
188E96.6Very high97.8Very high130 Ų13049 Ų4961%0.60725%0.251SS*.Hα-helixtrans-65.4-41.4176.7-55.873.3-159.200111S186 S192S186-E188 VanDerWaalsContact C-N 3.27Å; S186-E188 PolarHBondContact O-N 2.65Å; E188-S192 WeakPolarHBondContact O-CB 3.47Å; E188-S192 PolarHBondContact O-N 2.53Å
189K97.8Very high97.8Very high118 Ų11851.7 Ų51.751%0.51327%0.265SS..Hα-helixtrans-68.7-41.1176-69.8-176.6-179.2171.30111.1Y180 S186 P187 S192 L193Y180-K189 HydrophobicContact CD1-CB 3.91Å; Y180-K189 HydrophobicContact CD1-CD 4.05Å; Y180-K189 HydrophobicContact CD2-CB 4.45Å; Y180-K189 HydrophobicContact CE1-CB 4.36Å; Y180-K189 HydrophobicContact CE1-CD 3.96Å; Y180-K189 HydrophobicContact CG-CB 3.99Å; S186-K189 PolarHBondContact O-N 3.3Å; S186-K189 VanDerWaalsContact O-N 3.13Å; P187-K189 PolarHBondContact O-N 3.39Å; K189-S192 PolarHBondContact O-N 2.87Å; K189-L193 WeakPolarHBondContact O-CB 3.34Å; K189-L193 PolarHBondContact O-N 3.49Å
190A98.2Very high97.8Very high0 Ų054.8 Ų54.80%028%0.279CS..Hα-helixtrans-59.1-51.9176.300000111.2S177 Y181 S186 P187 L193 A194 W230S177-A190 WeakPolarHBondContact CB-O 3.49Å; S177-A190 VanDerWaalsContact O-CB 3.25Å; S177-A190 WeakPolarHBondContact O-CB 3.4Å; Y181-A190 HydrophobicContact CD2-CB 4.23Å; S186-A190 PolarHBondContact O-N 3.02Å; P187-A190 PolarHBondContact O-N 3.32Å; A190-L193 PolarHBondContact O-N 3.27Å; A190-A194 WeakPolarHBondContact O-CB 3.26Å; A190-A194 PolarHBondContact O-N 3.03Å; A190-W230 HydrophobicContact CB-CE3 4.14Å; A190-W230 HydrophobicContact CB-CZ3 3.97Å
191C98.2Very high97.7Very high21 Ų2153.6 Ų53.614%0.14227%0.274CS..Hα-helixtrans-65-43.3179.4-66.50000111.9P187 L193 A194 K195 L227P187-C191 WeakPolarHBondContact O-CB 3.47Å; P187-C191 PolarHBondContact O-N 3.11Å; P187-C191 PolarHBondContact O-SG 3.5Å; C191-L193 PolarHBondContact O-N 3.24Å; C191-A194 PolarHBondContact O-N 2.89Å; C191-K195 WeakPolarHBondContact O-CB 3.31Å; C191-K195 PolarHBondContact O-N 3.13Å; C191-L227 HydrophobicContact CB-CD2 4.06Å; C191-L227 WeakPolarHBondContact O-CD2 3.34Å
192S98.1Very high97.6Very high72 Ų7255.5 Ų55.550%0.50329%0.287SS..Hα-helixtrans-59.1-45.8177.5-1800000111.9E188 K189 T196E188-S192 WeakPolarHBondContact O-CB 3.47Å; E188-S192 PolarHBondContact O-N 2.53Å; K189-S192 PolarHBondContact O-N 2.87Å; S192-T196 VanDerWaalsContact O-CB 3.31Å; S192-T196 WeakPolarHBondContact O-CB 3.48Å; S192-T196 PolarHBondContact O-N 3.33Å; S192-T196 PolarHBondContact O-OG1 3.33Å
193L98.4Very high97.7Very high20 Ų2054.5 Ų54.511%0.10530%0.297CS..Hα-helixtrans-64.9-50.1177.9178.261.4000112F155 F176 Y180 K189 A190 C191 K195 T196 A197F155-L193 HydrophobicContact CE1-CD1 4.3Å; F155-L193 HydrophobicContact CE2-CD1 3.55Å; F155-L193 HydrophobicContact CZ-CD1 3.38Å; F176-L193 HydrophobicContact CB-CD2 3.82Å; F176-L193 HydrophobicContact CD1-CD2 3.75Å; F176-L193 HydrophobicContact CG-CD2 3.83Å; Y180-L193 HydrophobicContact CD2-CD2 3.98Å; Y180-L193 HydrophobicContact CE2-CD2 3.91Å; K189-L193 WeakPolarHBondContact O-CB 3.34Å; K189-L193 PolarHBondContact O-N 3.49Å; A190-L193 PolarHBondContact O-N 3.27Å; C191-L193 PolarHBondContact O-N 3.24Å; L193-K195 PolarHBondContact O-N 3.32Å; L193-T196 PolarHBondContact O-N 3.39Å; L193-A197 PolarHBondContact O-N 2.86Å
194A98.4Very high97.6Very high0 Ų056.4 Ų56.40%031%0.305CS..Hα-helixtrans-63.2-42.4-178.700000111.9A190 C191 A197 F198 L223 L227 W230A190-A194 WeakPolarHBondContact O-CB 3.26Å; A190-A194 PolarHBondContact O-N 3.03Å; C191-A194 PolarHBondContact O-N 2.89Å; A194-A197 PolarHBondContact O-N 3.24Å; A194-F198 WeakPolarHBondContact O-CB 3.34Å; A194-F198 PolarHBondContact O-N 3.02Å; A194-L223 HydrophobicContact CB-CD2 3.84Å; A194-L227 HydrophobicContact CB-CD1 4.3Å; A194-L227 HydrophobicContact CB-CD2 3.82Å; A194-L227 HydrophobicContact CB-CG 3.9Å; A194-W230 HydrophobicContact CB-CZ3 4.36Å
195K98.1Very high97.4Very high111 Ų11155.8 Ų55.848%0.48330%0.302SS..Hα-helixtrans-64.5-45.9177.2-175.3177.8-175.4-61.50111.6C191 L193 A197 F198 D199 L227C191-K195 WeakPolarHBondContact O-CB 3.31Å; C191-K195 PolarHBondContact O-N 3.13Å; L193-K195 PolarHBondContact O-N 3.32Å; K195-A197 PolarHBondContact O-N 3.17Å; K195-F198 PolarHBondContact O-N 3.12Å; K195-D199 WeakPolarHBondContact CG-OD2 3.39Å; K195-D199 IonicContact NZ-OD2 3.04Å; K195-D199 PolarHBondContact NZ-OD2 3.23Å; K195-D199 WeakPolarHBondContact O-CB 3.45Å; K195-D199 VanDerWaalsContact O-CG 3.24Å; K195-D199 PolarHBondContact O-N 3.31Å; K195-L227 HydrophobicContact CB-CD1 4.18Å; K195-L227 HydrophobicContact CB-CD2 4.09Å
196T98.5Very high97.1Very high59 Ų5957.1 Ų57.136%0.36231%0.309SS..Hα-helixtrans-59.1-47.8177.8-58.60000111S192 L193 F198 D199 E200S192-T196 VanDerWaalsContact O-CB 3.31Å; S192-T196 WeakPolarHBondContact O-CB 3.48Å; S192-T196 PolarHBondContact O-N 3.33Å; S192-T196 PolarHBondContact O-OG1 3.33Å; L193-T196 PolarHBondContact O-N 3.39Å; T196-F198 VanDerWaalsContact C-N 3.34Å; T196-F198 PolarHBondContact O-N 3.01Å; T196-D199 PolarHBondContact O-N 2.82Å; T196-E200 HydrophobicContact CG2-CG 4.27Å; T196-E200 WeakPolarHBondContact CG2-OE1 3.37Å; T196-E200 WeakPolarHBondContact O-CB 3.13Å; T196-E200 VanDerWaalsContact O-CG 3.26Å; T196-E200 WeakPolarHBondContact O-CG 3.25Å; T196-E200 PolarHBondContact O-N 3Å
197A98.4Very high96.6Very high12 Ų1260.9 Ų60.910%0.09933%0.331CS..Hα-helixtrans-63.2-39.6179.100000112.7A173 L193 A194 K195 A201 L223A173-A197 HydrophobicContact CB-CB 3.44Å; A173-A197 VanDerWaalsContact CB-CB 3.44Å; L193-A197 PolarHBondContact O-N 2.86Å; A194-A197 PolarHBondContact O-N 3.24Å; K195-A197 PolarHBondContact O-N 3.17Å; A197-A201 VanDerWaalsContact O-CB 3.27Å; A197-A201 WeakPolarHBondContact O-CB 3.36Å; A197-A201 PolarHBondContact O-N 3.03Å; A197-A201 VanDerWaalsContact O-N 3.1Å; A197-L223 HydrophobicContact CB-CD1 4.35Å
198F98.2Very high96.2Very high36 Ų3661.5 Ų61.516%0.15833%0.333CS..Hα-helixtrans-66.3-47.6176.9-175.4-97.9000112A194 K195 T196 A201 I202 M220 L223 R224A194-F198 WeakPolarHBondContact O-CB 3.34Å; A194-F198 PolarHBondContact O-N 3.02Å; K195-F198 PolarHBondContact O-N 3.12Å; T196-F198 VanDerWaalsContact C-N 3.34Å; T196-F198 PolarHBondContact O-N 3.01Å; F198-A201 PolarHBondContact O-N 3.34Å; F198-I202 HydrophobicContact CD1-CD1 3.66Å; 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 4.24Å; F198-I202 HydrophobicContact CG-CD1 4.45Å; F198-I202 HydrophobicContact CZ-CD1 3.43Å; F198-I202 VanDerWaalsContact CZ-CD1 3.43Å; F198-I202 HydrophobicContact CZ-CG1 4.26Å; F198-I202 WeakPolarHBondContact O-CB 3.43Å; F198-I202 WeakPolarHBondContact O-CG1 3.09Å; F198-I202 PolarHBondContact O-N 3.19Å; F198-M220 HydrophobicContact CD2-CB 4.06Å; F198-M220 WeakPolarHBondContact CD2-O 3.47Å; F198-M220 HydrophobicContact CE2-CB 4.06Å; F198-M220 HydrophobicContact CE2-CE 4.49Å; F198-M220 WeakPolarHBondContact CE2-O 3.28Å; F198-L223 HydrophobicContact CD2-CB 4.44Å; F198-R224 HydrophobicContact CD2-CB 4.39Å; F198-R224 HydrophobicContact CE2-CB 3.85Å; F198-R224 HydrophobicContact CE2-CG 4.46Å; F198-R224 HydrophobicContact CZ-CB 4.16Å; F198-R224 HydrophobicContact CZ-CG 4.27Å
199D98.2Very high95.8Very high74 Ų7459.6 Ų59.640%0.39633%0.327SS..Hα-helixtrans-64.6-44.3-179.4-69.4-15.2000111.4K195 T196 A201 I202 A203K195-D199 WeakPolarHBondContact CG-OD2 3.39Å; K195-D199 IonicContact NZ-OD2 3.04Å; K195-D199 PolarHBondContact NZ-OD2 3.23Å; K195-D199 WeakPolarHBondContact O-CB 3.45Å; K195-D199 VanDerWaalsContact O-CG 3.24Å; K195-D199 PolarHBondContact O-N 3.31Å; T196-D199 PolarHBondContact O-N 2.82Å; D199-A201 PolarHBondContact O-N 2.84Å; D199-I202 PolarHBondContact O-N 3.31Å; D199-A203 PolarHBondContact O-N 3.1Å; D199-A203 VanDerWaalsContact O-N 3.1Å
200E97.8Very high95.2Very high65 Ų6562.9 Ų62.930%0.30434%0.344SS..Hα-helixtrans-61.2-43.3175.6-71.9177.4173.700111.5P164 R169 T196 A203P164-E200 HydrophobicContact CB-CB 3.84Å; P164-E200 HydrophobicContact CG-CB 4.28Å; R169-E200 IonicContact CZ-OE2 2.62Å; R169-E200 IonicContact NH2-OE2 3.25Å; R169-E200 PolarHBondContact NH2-OE2 3.5Å; T196-E200 HydrophobicContact CG2-CG 4.27Å; T196-E200 WeakPolarHBondContact CG2-OE1 3.37Å; T196-E200 WeakPolarHBondContact O-CB 3.13Å; T196-E200 VanDerWaalsContact O-CG 3.26Å; T196-E200 WeakPolarHBondContact O-CG 3.25Å; T196-E200 PolarHBondContact O-N 3Å; E200-A203 PolarHBondContact O-N 2.96Å
201A97.3Very high94.5Very high0 Ų071 Ų710%038%0.382CS..Hα-helixtrans-72.5-34.4-179.900000113.2T165 L170 A197 F198 D199 A203 E204 L205 M220T165-A201 HydrophobicContact CG2-CB 4.45Å; T165-A201 WeakPolarHBondContact CG2-O 3.17Å; L170-A201 HydrophobicContact CD1-CB 4.44Å; L170-A201 HydrophobicContact CD2-CB 3.74Å; A197-A201 VanDerWaalsContact O-CB 3.27Å; A197-A201 WeakPolarHBondContact O-CB 3.36Å; A197-A201 PolarHBondContact O-N 3.03Å; A197-A201 VanDerWaalsContact O-N 3.1Å; F198-A201 PolarHBondContact O-N 3.34Å; D199-A201 PolarHBondContact O-N 2.84Å; A201-A203 VanDerWaalsContact C-N 3.32Å; A201-E204 PolarHBondContact O-N 3.48Å; A201-L205 WeakPolarHBondContact O-CA 3.44Å; A201-L205 WeakPolarHBondContact O-CB 3.35Å; A201-L205 PolarHBondContact O-N 2.95Å; A201-M220 HydrophobicContact CB-CE 3.89Å; A201-M220 HydrophobicContact CB-CG 4.31Å; A201-M220 HydrophobicContact CB-SD 3.87Å
202I96.6Very high94.1Very high85 Ų8571.5 Ų71.544%0.43639%0.386SS..Hα-helixtrans-60.4-44.3171.8-80.4-173.5000110.8F198 D199 E204 L205 M220F198-I202 HydrophobicContact CD1-CD1 3.66Å; 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 4.24Å; F198-I202 HydrophobicContact CG-CD1 4.45Å; F198-I202 HydrophobicContact CZ-CD1 3.43Å; F198-I202 VanDerWaalsContact CZ-CD1 3.43Å; F198-I202 HydrophobicContact CZ-CG1 4.26Å; F198-I202 WeakPolarHBondContact O-CB 3.43Å; F198-I202 WeakPolarHBondContact O-CG1 3.09Å; F198-I202 PolarHBondContact O-N 3.19Å; D199-I202 PolarHBondContact O-N 3.31Å; I202-E204 PolarHBondContact O-N 2.87Å; I202-E204 VanDerWaalsContact O-N 3.16Å; I202-L205 PolarHBondContact O-N 3.49Å; I202-M220 HydrophobicContact CB-CE 4.36Å; I202-M220 HydrophobicContact CG1-CE 3.45Å; I202-M220 VanDerWaalsContact CG1-CE 3.45Å
203A96.7Very high93.8Very high85 Ų8573.5 Ų73.570%0.70238%0.384SS*.Hα-helixtrans-61.7-24.4-176.900000113.2D199 E200 A201D199-A203 PolarHBondContact O-N 3.1Å; D199-A203 VanDerWaalsContact O-N 3.1Å; E200-A203 PolarHBondContact O-N 2.96Å; A201-A203 VanDerWaalsContact C-N 3.32Å
204E95.6Very high93.6Very high69 Ų6980.1 Ų80.132%0.32241%0.411SS..THydrogen-bonded Turntrans-115.46.7-178.2-64.5-175.1-157.100113.3Q163 P164 T165 A201 I202 D206 T207Q163-E204 PolarHBondContact OE1-OE2 3.4Å; P164-E204 WeakPolarHBondContact CD-OE2 3.18Å; T165-E204 HydrophobicContact CG2-CB 3.9Å; A201-E204 PolarHBondContact O-N 3.48Å; I202-E204 PolarHBondContact O-N 2.87Å; I202-E204 VanDerWaalsContact O-N 3.16Å; E204-D206 PolarHBondContact O-N 3.01Å; E204-T207 WeakPolarHBondContact O-CB 3.17Å; E204-T207 PolarHBondContact O-N 3.37Å; E204-T207 PolarHBondContact O-OG1 2.88Å
205L92.5Very high93.4Very high33 Ų3384.3 Ų84.317%0.17343%0.434CS..G310 helixtrans-59.3-35.7-172.2-169.774.1000112.6A201 I202 T207 L208 Y213 T217 M220A201-L205 WeakPolarHBondContact O-CA 3.44Å; A201-L205 WeakPolarHBondContact O-CB 3.35Å; A201-L205 PolarHBondContact O-N 2.95Å; I202-L205 PolarHBondContact O-N 3.49Å; L205-T207 PolarHBondContact O-N 3.4Å; L205-T207 VanDerWaalsContact O-N 3.1Å; L205-L208 HydrophobicContact CD1-CD1 3.52Å; L205-L208 HydrophobicContact CG-CD1 4.38Å; L205-L208 WeakPolarHBondContact O-CB 3.45Å; L205-L208 PolarHBondContact O-N 2.98Å; L205-Y213 HydrophobicContact CG-CE2 4.29Å; L205-T217 HydrophobicContact CD1-CG2 4.09Å; L205-M220 HydrophobicContact CD1-CE 4.08Å; L205-M220 HydrophobicContact CD1-SD 3.67Å
206D90.9Very high93.3Very high167 Ų16779 Ų7989%0.89341%0.411SS*.G310 helixtrans-66.1-11179.7-66.2-25.2000113.5E204E204-D206 PolarHBondContact O-N 3.01Å
207T88.2Confident93.2Very high104 Ų10478.3 Ų78.364%0.63841%0.407SS*.G310 helixtrans-91.2-8.9178.8720000113.7E204 L205E204-T207 WeakPolarHBondContact O-CB 3.17Å; E204-T207 PolarHBondContact O-N 3.37Å; E204-T207 PolarHBondContact O-OG1 2.88Å; L205-T207 PolarHBondContact O-N 3.4Å; L205-T207 VanDerWaalsContact O-N 3.1Å
208L87.8Confident93.2Very high31 Ų3182.7 Ų82.716%0.16243%0.428CS..  trans-68.5142.4-177.6-92.7153.5000112.4T165 L205 S212 Y213T165-L208 HydrophobicContact CG2-CD1 3.79Å; T165-L208 HydrophobicContact CG2-CG 4.1Å; L205-L208 HydrophobicContact CD1-CD1 3.52Å; L205-L208 HydrophobicContact CG-CD1 4.38Å; L205-L208 WeakPolarHBondContact O-CB 3.45Å; L205-L208 PolarHBondContact O-N 2.98Å; L208-S212 VanDerWaalsContact CD2-CB 3.49Å; L208-Y213 HydrophobicContact CB-CD2 4.14Å; L208-Y213 HydrophobicContact CD1-CD2 4.49Å
209N87.4Confident93.2Very high89 Ų8982.3 Ų82.348%0.47643%0.427SS..  trans-77.1161.4166.465.729.6000111.4E211 S212 Y213N209-E211 PolarHBondContact O-N 3.18Å; N209-E211 PolarHBondContact OD1-N 3.15Å; N209-S212 PolarHBondContact O-N 3.34Å; N209-S212 WeakPolarHBondContact OD1-CB 3.41Å; N209-S212 PolarHBondContact OD1-N 3.03Å; N209-S212 PolarHBondContact OD1-OG 2.78Å; N209-Y213 WeakPolarHBondContact O-CB 3.35Å; N209-Y213 PolarHBondContact O-N 3.32Å; N209-Y213 VanDerWaalsContact O-N 3.08Å
210E85.3Confident93.1Very high188 Ų18879.2 Ų79.288%0.87941%0.41SS*.Hα-helixtrans-60.2-32.4-179-67.9-176.2175.200113.3
211E84.4Confident93.2Very high169 Ų16979.2 Ų79.279%0.7941%0.41SS*.Hα-helixtrans-65.6-44.5-177.3-173.5177.9-172.800112.2N209N209-E211 PolarHBondContact O-N 3.18Å; N209-E211 PolarHBondContact OD1-N 3.15Å
212S89.1Confident93.2Very high33 Ų3382.8 Ų82.823%0.23143%0.429CS..Hα-helixtrans-88.1-19.9-179.4-62.30000113.3L208 N209 K214 D215 S216L208-S212 VanDerWaalsContact CD2-CB 3.49Å; N209-S212 PolarHBondContact O-N 3.34Å; N209-S212 WeakPolarHBondContact OD1-CB 3.41Å; N209-S212 PolarHBondContact OD1-N 3.03Å; N209-S212 PolarHBondContact OD1-OG 2.78Å; S212-K214 VanDerWaalsContact C-N 3.32Å; S212-K214 PolarHBondContact O-N 3.42Å; S212-D215 PolarHBondContact O-N 3.12Å; S212-S216 WeakPolarHBondContact O-CB 3.17Å; S212-S216 PolarHBondContact O-N 2.71Å; S212-S216 PolarHBondContact O-OG 2.86Å
213Y91.9Very high93.3Very high114 Ų11478.8 Ų78.845%0.44741%0.408SS..Hα-helixtrans-54.9-45.7-173.3-171.8-91.9000112.7L205 L208 N209 T217L205-Y213 HydrophobicContact CG-CE2 4.29Å; L208-Y213 HydrophobicContact CB-CD2 4.14Å; L208-Y213 HydrophobicContact CD1-CD2 4.49Å; N209-Y213 WeakPolarHBondContact O-CB 3.35Å; N209-Y213 PolarHBondContact O-N 3.32Å; N209-Y213 VanDerWaalsContact O-N 3.08Å; Y213-T217 HydrophobicContact CD1-CG2 4.11Å; Y213-T217 HydrophobicContact CE1-CG2 3.81Å; Y213-T217 HydrophobicContact CE2-CG2 4.23Å; Y213-T217 HydrophobicContact CG-CG2 4.45Å; Y213-T217 WeakPolarHBondContact O-CB 3.36Å; Y213-T217 VanDerWaalsContact O-CG2 3.27Å; Y213-T217 WeakPolarHBondContact O-CG2 3.45Å; Y213-T217 PolarHBondContact O-N 2.92Å; Y213-T217 PolarHBondContact O-OG1 3.04Å
214K93.9Very high93.4Very high158 Ų15880.2 Ų80.269%0.68740%0.396SS*.Hα-helixtrans-63.6-45.1-178.5-175.7-176.8174.3-171.90112.2S212 T217 L218S212-K214 VanDerWaalsContact C-N 3.32Å; S212-K214 PolarHBondContact O-N 3.42Å; K214-T217 PolarHBondContact O-OG1 2.9Å; K214-L218 WeakPolarHBondContact O-CB 3.47Å; K214-L218 PolarHBondContact O-N 3.22Å; K214-L218 VanDerWaalsContact O-N 3.15Å
215D94.5Very high93.5Very high88 Ų8880.2 Ų80.247%0.47140%0.398SS..Hα-helixtrans-71.8-43.5-177.2-71-14.5000111.2P167 S212 L218 I219P167-D215 HydrophobicContact CB-CB 4.13Å; P167-D215 HydrophobicContact CG-CB 4.05Å; S212-D215 PolarHBondContact O-N 3.12Å; D215-L218 PolarHBondContact O-N 3.21Å; D215-I219 VanDerWaalsContact O-CG1 3.28Å; D215-I219 WeakPolarHBondContact O-CG1 3.38Å; D215-I219 PolarHBondContact O-N 3.45Å; D215-I219 VanDerWaalsContact O-N 3.08Å
216S96.4Very high93.7Very high0 Ų080.3 Ų80.30%040%0.399CS..Hα-helixtrans-62.5-46.4177.7-62.60000112.2T165 P167 S212 L218 I219 M220T165-S216 WeakPolarHBondContact O-CB 3.37Å; T165-S216 PolarHBondContact O-OG 3.44Å; P167-S216 WeakPolarHBondContact CD-OG 3.42Å; P167-S216 WeakPolarHBondContact CG-OG 3.47Å; S212-S216 WeakPolarHBondContact O-CB 3.17Å; S212-S216 PolarHBondContact O-N 2.71Å; S212-S216 PolarHBondContact O-OG 2.86Å; S216-L218 VanDerWaalsContact C-N 3.35Å; S216-L218 PolarHBondContact O-N 3.43Å; S216-I219 PolarHBondContact O-N 3.37Å; S216-M220 WeakPolarHBondContact O-CB 3.48Å; S216-M220 VanDerWaalsContact O-CG 3.25Å; S216-M220 WeakPolarHBondContact O-CG 3.44Å; S216-M220 PolarHBondContact O-N 3.13Å
217T96.7Very high94Very high45 Ų4573.6 Ų73.628%0.27636%0.362SS..Hα-helixtrans-65.5-36.2179.252.30000112.6L205 Y213 K214 M220 Q221L205-T217 HydrophobicContact CD1-CG2 4.09Å; Y213-T217 HydrophobicContact CD1-CG2 4.11Å; Y213-T217 HydrophobicContact CE1-CG2 3.81Å; Y213-T217 HydrophobicContact CE2-CG2 4.23Å; Y213-T217 HydrophobicContact CG-CG2 4.45Å; Y213-T217 WeakPolarHBondContact O-CB 3.36Å; Y213-T217 VanDerWaalsContact O-CG2 3.27Å; Y213-T217 WeakPolarHBondContact O-CG2 3.45Å; Y213-T217 PolarHBondContact O-N 2.92Å; Y213-T217 PolarHBondContact O-OG1 3.04Å; K214-T217 PolarHBondContact O-OG1 2.9Å; T217-M220 PolarHBondContact O-N 3.32Å; T217-Q221 WeakPolarHBondContact O-CB 3.19Å; T217-Q221 PolarHBondContact O-N 3.07Å
218L97.2Very high94.4Very high103 Ų10372.7 Ų72.754%0.53936%0.357SS..Hα-helixtrans-62.4-43173178.163000111.5K214 D215 S216 Q221 L222K214-L218 WeakPolarHBondContact O-CB 3.47Å; K214-L218 PolarHBondContact O-N 3.22Å; K214-L218 VanDerWaalsContact O-N 3.15Å; D215-L218 PolarHBondContact O-N 3.21Å; S216-L218 VanDerWaalsContact C-N 3.35Å; S216-L218 PolarHBondContact O-N 3.43Å; L218-Q221 WeakPolarHBondContact O-CB 3.38Å; L218-Q221 PolarHBondContact O-N 3.38Å; L218-L222 WeakPolarHBondContact O-CG 3.3Å; L218-L222 PolarHBondContact O-N 3.12Å
219I98Very high94.8Very high29 Ų2975.2 Ų75.215%0.14937%0.37CS..Hα-helixtrans-70.2-39.8178.9-61.4164.8000111.2P167 L170 L174 D215 S216 Q221 L222 L223P167-I219 HydrophobicContact CB-CD1 4.12Å; P167-I219 VanDerWaalsContact O-CD1 3.28Å; P167-I219 WeakPolarHBondContact O-CD1 3.24Å; L170-I219 HydrophobicContact CB-CB 4.18Å; L170-I219 HydrophobicContact CB-CD1 4.47Å; L170-I219 HydrophobicContact CB-CG2 3.64Å; L174-I219 HydrophobicContact CB-CG2 4.32Å; L174-I219 HydrophobicContact CD2-CG2 4.2Å; D215-I219 VanDerWaalsContact O-CG1 3.28Å; D215-I219 WeakPolarHBondContact O-CG1 3.38Å; D215-I219 PolarHBondContact O-N 3.45Å; 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 3.22Å; I219-L222 WeakPolarHBondContact O-CB 3.38Å; I219-L222 PolarHBondContact O-N 2.98Å; I219-L222 VanDerWaalsContact O-N 3.16Å; I219-L223 PolarHBondContact O-N 3.47Å
220M98.1Very high95.2Very high9 Ų971.3 Ų71.34%0.04435%0.349CS..Hα-helixtrans-60.8-38.4174.5-71.1170.170.900111.8L170 F198 A201 I202 L205 S216 T217 L223 R224L170-M220 HydrophobicContact CD1-CG 3.95Å; L170-M220 HydrophobicContact CD1-SD 4.35Å; L170-M220 HydrophobicContact CD2-CG 4.06Å; F198-M220 HydrophobicContact CD2-CB 4.06Å; F198-M220 WeakPolarHBondContact CD2-O 3.47Å; F198-M220 HydrophobicContact CE2-CB 4.06Å; F198-M220 HydrophobicContact CE2-CE 4.49Å; F198-M220 WeakPolarHBondContact CE2-O 3.28Å; A201-M220 HydrophobicContact CB-CE 3.89Å; A201-M220 HydrophobicContact CB-CG 4.31Å; A201-M220 HydrophobicContact CB-SD 3.87Å; I202-M220 HydrophobicContact CB-CE 4.36Å; I202-M220 HydrophobicContact CG1-CE 3.45Å; I202-M220 VanDerWaalsContact CG1-CE 3.45Å; L205-M220 HydrophobicContact CD1-CE 4.08Å; L205-M220 HydrophobicContact CD1-SD 3.67Å; S216-M220 WeakPolarHBondContact O-CB 3.48Å; S216-M220 VanDerWaalsContact O-CG 3.25Å; S216-M220 WeakPolarHBondContact O-CG 3.44Å; S216-M220 PolarHBondContact O-N 3.13Å; T217-M220 PolarHBondContact O-N 3.32Å; M220-L223 WeakPolarHBondContact O-CB 3.41Å; M220-L223 PolarHBondContact O-N 2.97Å; M220-R224 PolarHBondContact O-N 3.23Å
221Q98.1Very high95.5Very high64 Ų6465.3 Ų65.330%0.29933%0.325SS..Hα-helixtrans-59.6-46.4173.1177.755.438.600111.4T217 L218 I219 L223 R224 D225T217-Q221 WeakPolarHBondContact O-CB 3.19Å; T217-Q221 PolarHBondContact O-N 3.07Å; L218-Q221 WeakPolarHBondContact O-CB 3.38Å; L218-Q221 PolarHBondContact O-N 3.38Å; I219-Q221 VanDerWaalsContact C-N 3.27Å; I219-Q221 PolarHBondContact O-N 3.22Å; Q221-L223 PolarHBondContact O-N 2.64Å; Q221-R224 WeakPolarHBondContact O-CB 3.33Å; Q221-R224 PolarHBondContact O-N 3.23Å; Q221-D225 PolarHBondContact NE2-OD1 3.45Å; Q221-D225 PolarHBondContact NE2-OD2 3.49Å; Q221-D225 PolarHBondContact O-N 3.29Å
222L98.4Very high95.8Very high76 Ų7660.4 Ų60.440%0.39831%0.309SS..Hα-helixtrans-63-39.6176.7-65.5171.9000112.7L174 L218 I219 D225 N226L174-L222 HydrophobicContact CD1-CB 4.11Å; L174-L222 HydrophobicContact CD2-CB 3.94Å; L174-L222 HydrophobicContact CD2-CD1 3.93Å; L218-L222 WeakPolarHBondContact O-CG 3.3Å; L218-L222 PolarHBondContact O-N 3.12Å; I219-L222 WeakPolarHBondContact O-CB 3.38Å; I219-L222 PolarHBondContact O-N 2.98Å; I219-L222 VanDerWaalsContact O-N 3.16Å; L222-D225 PolarHBondContact O-N 3.05Å; L222-N226 PolarHBondContact O-N 2.93Å
223L98.4Very high95.6Very high0 Ų063 Ų630%032%0.318CS..Hα-helixtrans-59.7-45.7173.9-78.4167.5000111.5L170 L174 A194 A197 F198 I219 M220 Q221 N226 L227L170-L223 HydrophobicContact CD2-CD1 3.96Å; L174-L223 HydrophobicContact CB-CD2 3.93Å; L174-L223 HydrophobicContact CB-CG 4.24Å; L174-L223 HydrophobicContact CD1-CD2 3.98Å; L174-L223 HydrophobicContact CD1-CG 4.18Å; A194-L223 HydrophobicContact CB-CD2 3.84Å; A197-L223 HydrophobicContact CB-CD1 4.35Å; F198-L223 HydrophobicContact CD2-CB 4.44Å; I219-L223 PolarHBondContact O-N 3.47Å; M220-L223 WeakPolarHBondContact O-CB 3.41Å; M220-L223 PolarHBondContact O-N 2.97Å; Q221-L223 PolarHBondContact O-N 2.64Å; L223-N226 PolarHBondContact O-N 3.44Å; L223-L227 WeakPolarHBondContact O-CG 3.14Å; L223-L227 PolarHBondContact O-N 3.38Å
224R97.9Very high94.9Very high116 Ų11660 Ų6044%0.43831%0.31SS..Hα-helixtrans-63.1-41177.3-171.9-172.273.9-172.66.3112.2F198 M220 Q221 L227 T228F198-R224 HydrophobicContact CD2-CB 4.39Å; F198-R224 HydrophobicContact CE2-CB 3.85Å; F198-R224 HydrophobicContact CE2-CG 4.46Å; F198-R224 HydrophobicContact CZ-CB 4.16Å; F198-R224 HydrophobicContact CZ-CG 4.27Å; M220-R224 PolarHBondContact O-N 3.23Å; Q221-R224 WeakPolarHBondContact O-CB 3.33Å; Q221-R224 PolarHBondContact O-N 3.23Å; R224-L227 PolarHBondContact O-N 3.39Å; R224-T228 PolarHBondContact O-N 2.99Å; R224-T228 PolarHBondContact O-OG1 3.47Å
225D98.1Very high93.8Very high68 Ų6859 Ų5936%0.36431%0.307SS..Hα-helixtrans-67-42-179.1-65-12.9000110.6Q221 L222 T228 L229Q221-D225 PolarHBondContact NE2-OD1 3.45Å; Q221-D225 PolarHBondContact NE2-OD2 3.49Å; Q221-D225 PolarHBondContact O-N 3.29Å; L222-D225 PolarHBondContact O-N 3.05Å; D225-T228 PolarHBondContact O-N 3.33Å; D225-L229 PolarHBondContact O-N 2.7Å
226N97.1Very high92.1Very high36 Ų3657.1 Ų57.119%0.19331%0.309CS..Hα-helixtrans-60.5-46.4172-78.61.4000112.5L174 L222 L223 T228 L229 W230L174-N226 VanDerWaalsContact CD1-ND2 3.32Å; L174-N226 WeakPolarHBondContact CD1-ND2 3.35Å; L222-N226 PolarHBondContact O-N 2.93Å; L223-N226 PolarHBondContact O-N 3.44Å; N226-T228 VanDerWaalsContact C-N 3.27Å; N226-T228 PolarHBondContact O-N 2.91Å; N226-L229 PolarHBondContact O-N 3.32Å; N226-W230 HydrophobicContact CB-CD2 4.21Å; N226-W230 HydrophobicContact CB-CE3 4.09Å; N226-W230 HydrophobicContact CB-CH2 3.69Å; N226-W230 HydrophobicContact CB-CZ2 3.79Å; N226-W230 HydrophobicContact CB-CZ3 3.83Å; N226-W230 WeakPolarHBondContact O-CB 3.36Å; N226-W230 VanDerWaalsContact O-CD2 3.25Å; N226-W230 PolarHBondContact O-N 3.19Å
227L97.1Very high90Very high25 Ų2564 Ų6413%0.13135%0.346CS..Hα-helixtrans-57.4-42.4175.9-76.7168.3000111.7C191 A194 K195 L223 R224 T231C191-L227 HydrophobicContact CB-CD2 4.06Å; C191-L227 WeakPolarHBondContact O-CD2 3.34Å; A194-L227 HydrophobicContact CB-CD1 4.3Å; A194-L227 HydrophobicContact CB-CD2 3.82Å; A194-L227 HydrophobicContact CB-CG 3.9Å; K195-L227 HydrophobicContact CB-CD1 4.18Å; K195-L227 HydrophobicContact CB-CD2 4.09Å; L223-L227 WeakPolarHBondContact O-CG 3.14Å; L223-L227 PolarHBondContact O-N 3.38Å; R224-L227 PolarHBondContact O-N 3.39Å; L227-T231 WeakPolarHBondContact O-CB 3.44Å; L227-T231 VanDerWaalsContact O-CG2 3.28Å; L227-T231 WeakPolarHBondContact O-CG2 3.43Å; L227-T231 PolarHBondContact O-N 2.9Å; L227-T231 PolarHBondContact O-OG1 3.45Å
228T96.5Very high87.7Confident85 Ų8569.6 Ų69.652%0.52137%0.369SS..Hα-helixtrans-63.6-46.8178.5-54.90000111R224 D225 N226 T231 S232R224-T228 PolarHBondContact O-N 2.99Å; R224-T228 PolarHBondContact O-OG1 3.47Å; D225-T228 PolarHBondContact O-N 3.33Å; N226-T228 VanDerWaalsContact C-N 3.27Å; N226-T228 PolarHBondContact O-N 2.91Å; T228-T231 PolarHBondContact O-OG1 3.43Å; T228-S232 WeakPolarHBondContact O-CB 3.28Å; T228-S232 PolarHBondContact O-N 2.92Å; T228-S232 VanDerWaalsContact O-N 3.16Å; T228-S232 PolarHBondContact O-OG 3.32Å
229L95.5Very high85Confident84 Ų8467.4 Ų67.444%0.4437%0.371SS..Hα-helixtrans-59.9-56178.5-178.965.5000111.4D225 N226 T231 S232 E233D225-L229 PolarHBondContact O-N 2.7Å; N226-L229 PolarHBondContact O-N 3.32Å; L229-T231 PolarHBondContact O-N 3.24Å; L229-S232 PolarHBondContact O-N 3.18Å; L229-S232 VanDerWaalsContact O-N 3.14Å; L229-S232 PolarHBondContact O-OG 2.94Å; L229-E233 WeakPolarHBondContact CD1-OE1 3.38Å; L229-E233 PolarHBondContact O-N 2.84Å
230W96Very high82.3Confident8 Ų873.8 Ų73.83%0.0341%0.405CS..Hα-helixtrans-67.3-34-173.9-57.7-27.3000113.3S177 V178 Y181 A190 A194 N226 S232 N234S177-W230 WeakPolarHBondContact OG-CH2 2.88Å; V178-W230 HydrophobicContact CG2-CH2 4.02Å; V178-W230 HydrophobicContact CG2-CZ2 4Å; Y181-W230 AromaticContact CD1-CD1 3.78Å; Y181-W230 AromaticContact CD1-CE2 3.94Å; Y181-W230 HydrophobicContact CD1-CG 4.47Å; Y181-W230 HydrophobicContact CD1-CZ2 4.48Å; Y181-W230 AromaticContact CD1-NE1 3.41Å; Y181-W230 HydrophobicContact CD2-CB 4.1Å; Y181-W230 AromaticContact CD2-CD1 3.65Å; Y181-W230 AromaticContact CD2-CD2 3.72Å; Y181-W230 HydrophobicContact CD2-CD2 3.72Å; Y181-W230 AromaticContact CD2-CE2 3.89Å; Y181-W230 HydrophobicContact CD2-CE3 4.39Å; Y181-W230 AromaticContact CD2-CG 3.57Å; Y181-W230 HydrophobicContact CD2-CG 3.57Å; Y181-W230 AromaticContact CD2-NE1 3.83Å; Y181-W230 AromaticContact CE1-CD1 3.44Å; Y181-W230 VanDerWaalsContact CE1-CD1 3.44Å; Y181-W230 HydrophobicContact CE1-CG 4.31Å; Y181-W230 AromaticContact CE1-NE1 3.49Å; Y181-W230 HydrophobicContact CE2-CB 3.63Å; Y181-W230 AromaticContact CE2-CD1 3.34Å; Y181-W230 HydrophobicContact CE2-CD2 4.09Å; Y181-W230 AromaticContact CE2-CG 3.41Å; Y181-W230 HydrophobicContact CE2-CG 3.41Å; Y181-W230 VanDerWaalsContact CE2-CG 3.41Å; Y181-W230 AromaticContact CE2-NE1 3.94Å; Y181-W230 AromaticContact CG-CD1 3.87Å; Y181-W230 HydrophobicContact CG-CD2 4.01Å; Y181-W230 AromaticContact CG-CE2 3.66Å; Y181-W230 HydrophobicContact CG-CG 4.13Å; Y181-W230 HydrophobicContact CG-CZ2 4.13Å; Y181-W230 AromaticContact CG-NE1 3.58Å; Y181-W230 AromaticContact CZ-CD1 3.22Å; Y181-W230 AromaticContact CZ-CG 3.8Å; Y181-W230 AromaticContact CZ-NE1 3.78Å; A190-W230 HydrophobicContact CB-CE3 4.14Å; A190-W230 HydrophobicContact CB-CZ3 3.97Å; A194-W230 HydrophobicContact CB-CZ3 4.36Å; N226-W230 HydrophobicContact CB-CD2 4.21Å; N226-W230 HydrophobicContact CB-CE3 4.09Å; N226-W230 HydrophobicContact CB-CH2 3.69Å; N226-W230 HydrophobicContact CB-CZ2 3.79Å; N226-W230 HydrophobicContact CB-CZ3 3.83Å; N226-W230 WeakPolarHBondContact O-CB 3.36Å; N226-W230 VanDerWaalsContact O-CD2 3.25Å; N226-W230 PolarHBondContact O-N 3.19Å; W230-S232 VanDerWaalsContact C-N 3.35Å; W230-N234 WeakPolarHBondContact O-CB 3.4Å; W230-N234 PolarHBondContact O-N 3.48Å; W230-N234 VanDerWaalsContact O-N 3.11Å; W230-N234 PolarHBondContact O-OD1 3.13Å
231T91.8Very high79.6Confident61 Ų6177.9 Ų77.937%0.37444%0.441SS..Hα-helixtrans-72.4-29.4174.953.10000112.8L227 T228 L229 Q235L227-T231 WeakPolarHBondContact O-CB 3.44Å; L227-T231 VanDerWaalsContact O-CG2 3.28Å; L227-T231 WeakPolarHBondContact O-CG2 3.43Å; L227-T231 PolarHBondContact O-N 2.9Å; L227-T231 PolarHBondContact O-OG1 3.45Å; T228-T231 PolarHBondContact O-OG1 3.43Å; L229-T231 PolarHBondContact O-N 3.24Å; T231-Q235 VanDerWaalsContact O-CG 3.31Å; T231-Q235 WeakPolarHBondContact O-CG 3.45Å; T231-Q235 PolarHBondContact O-N 3.02Å; T231-Q235 PolarHBondContact O-NE2 3.17Å
232S90.4Very high76.5Confident66 Ų6677.5 Ų77.546%0.46245%0.454SS..Hα-helixtrans-73.4-39174.272.60000112.7T228 L229 W230 Q235 G236T228-S232 WeakPolarHBondContact O-CB 3.28Å; T228-S232 PolarHBondContact O-N 2.92Å; T228-S232 VanDerWaalsContact O-N 3.16Å; T228-S232 PolarHBondContact O-OG 3.32Å; L229-S232 PolarHBondContact O-N 3.18Å; L229-S232 VanDerWaalsContact O-N 3.14Å; L229-S232 PolarHBondContact O-OG 2.94Å; W230-S232 VanDerWaalsContact C-N 3.35Å; S232-Q235 PolarHBondContact O-N 3.05Å; S232-G236 PolarHBondContact O-N 2.87Å
233E84.7Confident73.6Confident87 Ų8783.8 Ų83.841%0.40748%0.481SS..Hα-helixtrans-65.6-44.1176.9-70.9178.217300110.8Y181 L229 Q235 G236 D237Y181-E233 PolarHBondContact OH-OE2 3.49Å; L229-E233 WeakPolarHBondContact CD1-OE1 3.38Å; L229-E233 PolarHBondContact O-N 2.84Å; E233-Q235 VanDerWaalsContact C-N 3.33Å; E233-Q235 PolarHBondContact O-N 3.43Å; E233-G236 PolarHBondContact O-N 3.13Å; E233-D237 PolarHBondContact O-N 3.21Å
234N77.4Confident70.7Confident52 Ų5287.5 Ų87.528%0.27852%0.519SS..Hα-helixtrans-66.4-29.4177.8-77.625.9000114.1P187 W230P187-N234 WeakPolarHBondContact CB-ND2 3.42Å; W230-N234 WeakPolarHBondContact O-CB 3.4Å; W230-N234 PolarHBondContact O-N 3.48Å; W230-N234 VanDerWaalsContact O-N 3.11Å; W230-N234 PolarHBondContact O-OD1 3.13Å
235Q71.8Confident67.8Low136 Ų13691 Ų9164%0.63654%0.54SS*.Hα-helixtrans-76.6-27.8175.4-75.6173.341.400112.5T231 S232 E233 E238T231-Q235 VanDerWaalsContact O-CG 3.31Å; T231-Q235 WeakPolarHBondContact O-CG 3.45Å; T231-Q235 PolarHBondContact O-N 3.02Å; T231-Q235 PolarHBondContact O-NE2 3.17Å; S232-Q235 PolarHBondContact O-N 3.05Å; E233-Q235 VanDerWaalsContact C-N 3.33Å; E233-Q235 PolarHBondContact O-N 3.43Å; Q235-E238 PolarHBondContact O-N 3.5Å
236G57.8Low65.1Low50 Ų5099.1 Ų99.152%0.51558%0.584SS.*Hα-helixtrans-66.3-36.5176.600000112.9S232 E233 E238 G239S232-G236 PolarHBondContact O-N 2.87Å; E233-G236 PolarHBondContact O-N 3.13Å; G236-E238 VanDerWaalsContact C-N 3.33Å; G236-E238 PolarHBondContact O-N 3.21Å; G236-G239 PolarHBondContact O-N 3.28Å
237D52.9Low63.5Low143 Ų143102.3 Ų102.377%0.76560%0.604SS**Hα-helixtrans-73.5-22.2178.7-77.1-13.8000113.3E233 G239E233-D237 PolarHBondContact O-N 3.21Å; D237-G239 VanDerWaalsContact C-N 3.32Å
238E48.3Very low61.7Low164 Ų164106.4 Ų106.477%0.76663%0.629SS**THydrogen-bonded Turntrans-79.8-13.8171.7-69.1-173.4168.900112.8Q235 G236Q235-E238 PolarHBondContact O-N 3.5Å; G236-E238 VanDerWaalsContact C-N 3.33Å; G236-E238 PolarHBondContact O-N 3.21Å
239G41.2Very low59.8Low56 Ų56107.6 Ų107.658%0.57764%0.635SS**THydrogen-bonded Turntrans-86.6-13.1-173.600000116.3G236 D237G236-G239 PolarHBondContact O-N 3.28Å; D237-G239 VanDerWaalsContact C-N 3.32Å
240D41Very low57.7Low163 Ų163108.9 Ų108.987%0.87265%0.646SS**THydrogen-bonded Turntrans-96.49.9-179.6-141.714.6000113.2
241A40.6Very low55.3Low96 Ų96115.3 Ų115.379%0.79369%0.685SS**SBendtrans-104.847.3170.900000111.3
242G33.5Very low52.9Low55 Ų55118.9 Ų118.957%0.56771%0.705SS**  trans-173.6104176.800000113.9
243E37Very low50.2Low208 Ų208122.6 Ų122.697%0.97272%0.723SS**  trans129.1111.8137.6-67.9-175.5-176.600114.1
244G38.5Very low47.6Very low78 Ų78125.4 Ų125.480%0.80475%0.747SS**  trans174.643.3173.300000113.1N246G244-N246 PolarHBondContact O-N 3.3Å
245E35.4Very low45.1Very low189 Ų189131.5 Ų131.588%0.88379%0.786SS**  trans-60.9115.3166.4-68.4179.8149.400110.1
246N42.7Very low42.6Very low240 Ų240131.1 Ų131.1100%1.28380%0.8SS**  trans170.40134.5-86.5-33.8000111G244G244-N246 PolarHBondContact O-N 3.3Å

Retrieved 246 of 246 residues in 255.5 ms (Link to these results)

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