1433T_CHICK Loading...

14-3-3 protein theta

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 (By similarity).

AlphaFold DB , UniProt , Accession Q5ZMD1, Species CHICK (Gallus gallus, Chicken), Gene YWHAQ, Length 245 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M70.1Confident94.7Very high132 Ų13269.5 Ų69.565%0.6534%0.34SS*.  0136.30-161173.2-58.800106.2E5 L6 K9M1-E5 HydrophobicContact CG-CB 3.78Å; M1-E5 WeakPolarHBondContact CG-OE2 3.43Å; M1-E5 HydrophobicContact SD-CB 4.3Å; M1-L6 HydrophobicContact CB-CD1 4.37Å; M1-L6 HydrophobicContact CB-CD2 4.12Å; M1-L6 HydrophobicContact CB-CG 4.02Å; M1-L6 HydrophobicContact CG-CD2 4.14Å; M1-L6 HydrophobicContact CG-CG 4.01Å; M1-L6 HydrophobicContact SD-CD2 3.51Å; M1-L6 VanDerWaalsContact SD-CD2 3.51Å; M1-L6 HydrophobicContact SD-CG 3.93Å; M1-K9 HydrophobicContact CE-CD 4.44Å; M1-K9 HydrophobicContact SD-CD 3.72Å; M1-K9 PolarHBondContact SD-NZ 2.92Å
2D92.6Very high95Very high95 Ų9573.1 Ų73.151%0.50836%0.361SS..  trans-69.1153.5179.7178.737.1000110.9T4 E5 L6D2-T4 VanDerWaalsContact C-N 3.27Å; D2-T4 PolarHBondContact O-N 2.87Å; D2-E5 HydrophobicContact CB-CG 4.31Å; D2-E5 PolarHBondContact N-OE2 3.39Å; D2-E5 PolarHBondContact O-N 3.5Å; D2-L6 PolarHBondContact O-N 2.98Å; D2-L6 VanDerWaalsContact O-N 3.1Å
3K95.5Very high95.2Very high46 Ų4668.2 Ų68.220%0.234%0.339CS..Hα-helixtrans-54.6-44.7178.8-174.8174.7176.3-1710111E5 L6 I7 V29 E40K3-E5 PolarHBondContact O-N 3.49Å; K3-L6 PolarHBondContact O-N 3.2Å; K3-I7 WeakPolarHBondContact O-CG1 3.4Å; K3-I7 PolarHBondContact O-N 3.1Å; K3-V29 HydrophobicContact CD-CG1 4.31Å; K3-V29 HydrophobicContact CG-CG1 4.03Å; K3-V29 HydrophobicContact CG-CG2 4.45Å; K3-E40 WeakPolarHBondContact CE-OE1 3.47Å; K3-E40 WeakPolarHBondContact CE-OE2 3.21Å; K3-E40 IonicContact NZ-OE1 2.65Å; K3-E40 PolarHBondContact NZ-OE1 3.26Å; K3-E40 IonicContact NZ-OE2 3.33Å; K3-E40 PolarHBondContact NZ-OE2 2.83Å
4T96.4Very high95.4Very high83 Ų8368.3 Ų68.351%0.50934%0.338SS..Hα-helixtrans-62.9-41.7-179-60.10000112.2D2 I7 Q8D2-T4 VanDerWaalsContact C-N 3.27Å; D2-T4 PolarHBondContact O-N 2.87Å; T4-I7 PolarHBondContact O-N 3.13Å; T4-Q8 WeakPolarHBondContact O-CG 3.47Å; T4-Q8 PolarHBondContact O-N 3.46Å
5E97.3Very high95.6Very high99 Ų9974.3 Ų74.346%0.46336%0.364SS..Hα-helixtrans-64.2-41176.3-67.6180157.100112M1 D2 K3 Q8 K9M1-E5 HydrophobicContact CG-CB 3.78Å; M1-E5 WeakPolarHBondContact CG-OE2 3.43Å; M1-E5 HydrophobicContact SD-CB 4.3Å; D2-E5 HydrophobicContact CB-CG 4.31Å; D2-E5 PolarHBondContact N-OE2 3.39Å; D2-E5 PolarHBondContact O-N 3.5Å; K3-E5 PolarHBondContact O-N 3.49Å; E5-Q8 PolarHBondContact O-N 3.12Å; E5-K9 WeakPolarHBondContact O-CG 2.93Å; E5-K9 PolarHBondContact O-N 3.41Å
6L98.1Very high95.7Very high13 Ų1373.5 Ų73.57%0.06837%0.374CS..Hα-helixtrans-64.4-42.8177.1-71.8166.6000111.7M1 D2 K3 K9 A10 C25 A28 V29M1-L6 HydrophobicContact CB-CD1 4.37Å; M1-L6 HydrophobicContact CB-CD2 4.12Å; M1-L6 HydrophobicContact CB-CG 4.02Å; M1-L6 HydrophobicContact CG-CD2 4.14Å; M1-L6 HydrophobicContact CG-CG 4.01Å; M1-L6 HydrophobicContact SD-CD2 3.51Å; M1-L6 VanDerWaalsContact SD-CD2 3.51Å; M1-L6 HydrophobicContact SD-CG 3.93Å; D2-L6 PolarHBondContact O-N 2.98Å; D2-L6 VanDerWaalsContact O-N 3.1Å; K3-L6 PolarHBondContact O-N 3.2Å; L6-K9 PolarHBondContact O-N 3.32Å; L6-A10 WeakPolarHBondContact O-CB 3.37Å; L6-A10 PolarHBondContact O-N 3.41Å; L6-C25 HydrophobicContact CD2-CB 4.4Å; L6-A28 HydrophobicContact CD1-CB 3.87Å; L6-A28 HydrophobicContact CD2-CB 4.1Å; L6-V29 HydrophobicContact CB-CG2 3.44Å; L6-V29 VanDerWaalsContact CB-CG2 3.44Å; L6-V29 HydrophobicContact CD1-CG2 3.89Å; L6-V29 HydrophobicContact CG-CG2 4.3Å
7I98.3Very high95.9Very high15 Ų1577.6 Ų77.68%0.07739%0.391CS..Hα-helixtrans-64.2-42.5176.1-67.5-59.4000111.3K3 T4 K9 A10 K11 M26 V29 E40 L43K3-I7 WeakPolarHBondContact O-CG1 3.4Å; K3-I7 PolarHBondContact O-N 3.1Å; T4-I7 PolarHBondContact O-N 3.13Å; I7-K9 VanDerWaalsContact C-N 3.33Å; I7-K9 PolarHBondContact O-N 3.19Å; I7-A10 PolarHBondContact O-N 2.57Å; I7-K11 HydrophobicContact CG2-CD 4.31Å; I7-K11 WeakPolarHBondContact O-CG 3.16Å; I7-K11 PolarHBondContact O-N 3.39Å; I7-M26 HydrophobicContact CD1-CE 3.74Å; I7-M26 HydrophobicContact CD1-SD 3.57Å; I7-M26 VanDerWaalsContact CD1-SD 3.57Å; I7-V29 HydrophobicContact CD1-CB 4.46Å; I7-V29 HydrophobicContact CD1-CG1 4.12Å; I7-V29 HydrophobicContact CD1-CG2 3.89Å; I7-V29 HydrophobicContact CG1-CG2 4.18Å; I7-E40 HydrophobicContact CD1-CB 4.38Å; I7-E40 HydrophobicContact CD1-CG 3.79Å; I7-E40 HydrophobicContact CG1-CG 4.32Å; I7-L43 HydrophobicContact CD1-CD1 4.38Å; I7-L43 HydrophobicContact CG2-CD1 4.12Å
8Q98Very high96Very high117 Ų11781.1 Ų81.155%0.54740%0.399SS..Hα-helixtrans-61.3-42.1175.3-74.6178.2-5.300111.8T4 E5 K11 L12T4-Q8 WeakPolarHBondContact O-CG 3.47Å; T4-Q8 PolarHBondContact O-N 3.46Å; E5-Q8 PolarHBondContact O-N 3.12Å; Q8-K11 PolarHBondContact O-N 2.87Å; Q8-L12 WeakPolarHBondContact O-CG 3.38Å; Q8-L12 PolarHBondContact O-N 3.19Å
9K98.1Very high96.1Very high99 Ų9979.6 Ų79.643%0.4339%0.389SS..Hα-helixtrans-64.1-40.8174.4-75.1179.9-178.5179.50112.6M1 E5 L6 I7 K11 L12 A13M1-K9 HydrophobicContact CE-CD 4.44Å; M1-K9 HydrophobicContact SD-CD 3.72Å; M1-K9 PolarHBondContact SD-NZ 2.92Å; E5-K9 WeakPolarHBondContact O-CG 2.93Å; E5-K9 PolarHBondContact O-N 3.41Å; L6-K9 PolarHBondContact O-N 3.32Å; I7-K9 VanDerWaalsContact C-N 3.33Å; I7-K9 PolarHBondContact O-N 3.19Å; K9-K11 VanDerWaalsContact C-N 3.34Å; K9-K11 PolarHBondContact O-N 2.87Å; K9-L12 PolarHBondContact O-N 3.25Å; K9-A13 WeakPolarHBondContact O-CB 3.37Å; K9-A13 PolarHBondContact O-N 3Å
10A98.5Very high96.2Very high0 Ų079.7 Ų79.70%039%0.391CS..Hα-helixtrans-60.5-43.4175.500000111.5L6 I7 A13 E14 M22 C25 M26L6-A10 WeakPolarHBondContact O-CB 3.37Å; L6-A10 PolarHBondContact O-N 3.41Å; I7-A10 PolarHBondContact O-N 2.57Å; A10-A13 PolarHBondContact O-N 2.97Å; A10-E14 PolarHBondContact O-N 3.19Å; A10-M22 HydrophobicContact CB-CG 4.07Å; A10-C25 HydrophobicContact CB-CB 4.01Å; A10-M26 HydrophobicContact CB-CG 3.98Å; A10-M26 HydrophobicContact CB-SD 3.66Å
11K98.4Very high96.3Very high65 Ų6578.7 Ų78.728%0.28339%0.387SS..Hα-helixtrans-64.3-39.7175.8-70.4177.2176.4-174.40113I7 Q8 K9 E14 Q15 E39 L43I7-K11 HydrophobicContact CG2-CD 4.31Å; I7-K11 WeakPolarHBondContact O-CG 3.16Å; I7-K11 PolarHBondContact O-N 3.39Å; Q8-K11 PolarHBondContact O-N 2.87Å; K9-K11 VanDerWaalsContact C-N 3.34Å; K9-K11 PolarHBondContact O-N 2.87Å; K11-E14 PolarHBondContact O-N 3.32Å; K11-Q15 WeakPolarHBondContact O-CG 3.32Å; K11-Q15 PolarHBondContact O-N 3.07Å; K11-Q15 VanDerWaalsContact O-N 3.17Å; K11-E39 WeakPolarHBondContact CE-OE1 3.44Å; K11-E39 VanDerWaalsContact NZ-CD 3.27Å; K11-E39 IonicContact NZ-OE1 3.33Å; K11-E39 PolarHBondContact NZ-OE1 3.31Å; K11-E39 IonicContact NZ-OE2 3Å; K11-E39 PolarHBondContact NZ-OE2 3.36Å; K11-L43 HydrophobicContact CG-CD1 4.07Å; K11-L43 HydrophobicContact CG-CD2 4.14Å
12L98.5Very high97.6Very high113 Ų11372.4 Ų72.459%0.59236%0.356SS*.Hα-helixtrans-66.1-40.3173.7-71.3171.1000111.6Q8 K9 Q15 A16Q8-L12 WeakPolarHBondContact O-CG 3.38Å; Q8-L12 PolarHBondContact O-N 3.19Å; K9-L12 PolarHBondContact O-N 3.25Å; L12-Q15 PolarHBondContact O-N 3.11Å; L12-A16 WeakPolarHBondContact O-CB 3.49Å; L12-A16 PolarHBondContact O-N 3.49Å; L12-A16 VanDerWaalsContact O-N 3.12Å
13A98.4Very high97.9Very high9 Ų968.2 Ų68.27%0.07434%0.335CS..Hα-helixtrans-65.1-39.6176.500000111.8K9 A10 A16 E17 R18 D21 M22K9-A13 WeakPolarHBondContact O-CB 3.37Å; K9-A13 PolarHBondContact O-N 3Å; A10-A13 PolarHBondContact O-N 2.97Å; A13-A16 CarbonylContact O-C 3.6Å; A13-A16 PolarHBondContact O-N 3.41Å; A13-E17 PolarHBondContact O-N 2.87Å; A13-R18 HydrophobicContact CB-CB 4.3Å; A13-R18 PolarHBondContact O-N 3.41Å; A13-D21 HydrophobicContact CB-CB 3.99Å; A13-M22 HydrophobicContact CB-CB 3.99Å
14E98.1Very high98.1Very high70 Ų7070.8 Ų70.833%0.32736%0.355SS..Hα-helixtrans-58.3-50173.1-178-179.8-151.300111.6A10 K11 A16 E17 M22 L43A10-E14 PolarHBondContact O-N 3.19Å; K11-E14 PolarHBondContact O-N 3.32Å; E14-A16 PolarHBondContact O-N 2.73Å; E14-E17 PolarHBondContact O-N 2.89Å; E14-M22 HydrophobicContact CB-CE 3.96Å; E14-M22 HydrophobicContact CB-SD 3.96Å; E14-M22 HydrophobicContact CG-CE 4.21Å; E14-M22 HydrophobicContact CG-SD 4.41Å; E14-L43 WeakPolarHBondContact OE2-CD2 3.45Å
15Q97.7Very high98.2Very high158 Ų15867.6 Ų67.674%0.73834%0.336SS*.Hα-helixtrans-62.5-26.5177.9-70.3175.341.900113.3K11 L12K11-Q15 WeakPolarHBondContact O-CG 3.32Å; K11-Q15 PolarHBondContact O-N 3.07Å; K11-Q15 VanDerWaalsContact O-N 3.17Å; L12-Q15 PolarHBondContact O-N 3.11Å
16A98Very high98.2Very high62 Ų6262.9 Ų62.951%0.51231%0.314SS..THydrogen-bonded Turntrans-94.56.1176.100000113.2L12 A13 E14 R18L12-A16 WeakPolarHBondContact O-CB 3.49Å; L12-A16 PolarHBondContact O-N 3.49Å; L12-A16 VanDerWaalsContact O-N 3.12Å; A13-A16 CarbonylContact O-C 3.6Å; A13-A16 PolarHBondContact O-N 3.41Å; E14-A16 PolarHBondContact O-N 2.73Å; A16-R18 HydrophobicContact CB-CG 4.12Å; A16-R18 PolarHBondContact O-N 2.91Å; A16-R18 VanDerWaalsContact O-N 3.09Å
17E97.6Very high98.2Very high143 Ų14365.5 Ų65.567%0.66833%0.325SS*.THydrogen-bonded Turntrans53.326.8-175.5-56.5-173.5158.600114A13 E14 Y19A13-E17 PolarHBondContact O-N 2.87Å; E14-E17 PolarHBondContact O-N 2.89Å; E17-Y19 VanDerWaalsContact C-N 3.33Å; E17-Y19 HydrophobicContact CB-CE2 3.89Å; E17-Y19 HydrophobicContact CG-CE2 4.48Å; E17-Y19 VanDerWaalsContact O-CD2 3.3Å; E17-Y19 WeakPolarHBondContact O-CD2 3.5Å; E17-Y19 PolarHBondContact O-N 3.14Å
18R98.3Very high98.2Very high140 Ų14066.6 Ų66.653%0.52834%0.335SS..  trans-9066.8177.6-66.5-160.263.1-178.7-12.1110.9A13 A16 D20 D21 M22A13-R18 HydrophobicContact CB-CB 4.3Å; A13-R18 PolarHBondContact O-N 3.41Å; A16-R18 HydrophobicContact CB-CG 4.12Å; A16-R18 PolarHBondContact O-N 2.91Å; A16-R18 VanDerWaalsContact O-N 3.09Å; R18-D20 VanDerWaalsContact C-N 3.3Å; R18-D20 PolarHBondContact O-N 2.93Å; R18-D21 HydrophobicContact CB-CB 4.19Å; R18-D21 IonicContact CZ-OD1 3.59Å; R18-D21 IonicContact CZ-OD2 2.88Å; R18-D21 IonicContact NE-OD1 3.71Å; R18-D21 IonicContact NE-OD2 2.99Å; R18-D21 PolarHBondContact NE-OD2 3.16Å; R18-D21 IonicContact NH1-OD2 3.53Å; R18-D21 VanDerWaalsContact NH2-CG 3.28Å; R18-D21 IonicContact NH2-OD1 2.87Å; R18-D21 PolarHBondContact NH2-OD1 3.3Å; R18-D21 IonicContact NH2-OD2 2.91Å; R18-D21 PolarHBondContact NH2-OD2 3.3Å; R18-D21 WeakPolarHBondContact O-CB 3.44Å; R18-D21 PolarHBondContact O-N 3.33Å; R18-D21 VanDerWaalsContact O-N 3.08Å; R18-M22 PolarHBondContact O-N 2.97Å
19Y98.4Very high98.3Very high53 Ų5361.1 Ų61.121%0.20831%0.31CS..Hα-helixtrans-64.9-27.2-172-56.9-70.7000114.6E17 M22 A23 V46 N50 V51E17-Y19 VanDerWaalsContact C-N 3.33Å; E17-Y19 HydrophobicContact CB-CE2 3.89Å; E17-Y19 HydrophobicContact CG-CE2 4.48Å; E17-Y19 VanDerWaalsContact O-CD2 3.3Å; E17-Y19 WeakPolarHBondContact O-CD2 3.5Å; E17-Y19 PolarHBondContact O-N 3.14Å; Y19-M22 HydrophobicContact CD1-SD 4.09Å; Y19-M22 WeakPolarHBondContact O-CB 3.32Å; Y19-M22 PolarHBondContact O-N 3.09Å; Y19-A23 WeakPolarHBondContact O-CB 3.49Å; Y19-A23 PolarHBondContact O-N 3.04Å; Y19-V46 HydrophobicContact CE1-CG1 4.19Å; Y19-N50 HydrophobicContact CD1-CB 3.59Å; Y19-N50 HydrophobicContact CD2-CB 3.42Å; Y19-N50 VanDerWaalsContact CD2-CB 3.42Å; Y19-N50 HydrophobicContact CE1-CB 3.93Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.4Å; Y19-N50 HydrophobicContact CE2-CB 3.77Å; Y19-N50 HydrophobicContact CG-CB 3.3Å; Y19-V51 VanDerWaalsContact C-CG2 3.43Å; Y19-V51 WeakPolarHBondContact O-CG2 3.49Å
20D98Very high98.3Very high81 Ų8156.5 Ų56.543%0.43329%0.29SS..Hα-helixtrans-66.2-38.8172.9-62.9-79.5000111.8R18 A23 T24 R55R18-D20 VanDerWaalsContact C-N 3.3Å; R18-D20 PolarHBondContact O-N 2.93Å; D20-A23 PolarHBondContact O-N 2.99Å; D20-T24 PolarHBondContact O-N 2.67Å; D20-T24 PolarHBondContact O-OG1 3.03Å; D20-R55 IonicContact OD1-NH1 3.78Å; D20-R55 PolarHBondContact OD1-NH1 2.86Å; D20-R55 IonicContact OD1-NH2 3.19Å; D20-R55 IonicContact OD2-NH1 3.63Å
21D98.2Very high98.2Very high59 Ų5960.6 Ų60.632%0.31631%0.309SS..Hα-helixtrans-67.7-41.2174.2-64.69.1000110.2A13 R18 T24 C25A13-D21 HydrophobicContact CB-CB 3.99Å; R18-D21 HydrophobicContact CB-CB 4.19Å; R18-D21 IonicContact CZ-OD1 3.59Å; R18-D21 IonicContact CZ-OD2 2.88Å; R18-D21 IonicContact NE-OD1 3.71Å; R18-D21 IonicContact NE-OD2 2.99Å; R18-D21 PolarHBondContact NE-OD2 3.16Å; R18-D21 IonicContact NH1-OD2 3.53Å; R18-D21 VanDerWaalsContact NH2-CG 3.28Å; R18-D21 IonicContact NH2-OD1 2.87Å; R18-D21 PolarHBondContact NH2-OD1 3.3Å; R18-D21 IonicContact NH2-OD2 2.91Å; R18-D21 PolarHBondContact NH2-OD2 3.3Å; R18-D21 WeakPolarHBondContact O-CB 3.44Å; R18-D21 PolarHBondContact O-N 3.33Å; R18-D21 VanDerWaalsContact O-N 3.08Å; D21-T24 PolarHBondContact O-N 3.03Å; D21-C25 PolarHBondContact O-N 3.46Å; D21-C25 PolarHBondContact O-SG 3Å
22M98.2Very high98.2Very high0 Ų062 Ų620%032%0.317CS..Hα-helixtrans-59.6-46.9175.4-164.5-169.8-179.200110.9A10 A13 E14 R18 Y19 T24 C25 M26 L43 V46 A47A10-M22 HydrophobicContact CB-CG 4.07Å; A13-M22 HydrophobicContact CB-CB 3.99Å; E14-M22 HydrophobicContact CB-CE 3.96Å; E14-M22 HydrophobicContact CB-SD 3.96Å; E14-M22 HydrophobicContact CG-CE 4.21Å; E14-M22 HydrophobicContact CG-SD 4.41Å; R18-M22 PolarHBondContact O-N 2.97Å; Y19-M22 HydrophobicContact CD1-SD 4.09Å; Y19-M22 WeakPolarHBondContact O-CB 3.32Å; Y19-M22 PolarHBondContact O-N 3.09Å; M22-T24 VanDerWaalsContact C-N 3.34Å; M22-T24 PolarHBondContact O-N 3.23Å; M22-C25 PolarHBondContact O-N 3.41Å; M22-M26 WeakPolarHBondContact O-CB 3.45Å; M22-M26 VanDerWaalsContact O-CG 3.32Å; M22-M26 WeakPolarHBondContact O-CG 3.31Å; M22-M26 PolarHBondContact O-N 3.22Å; M22-L43 HydrophobicContact CE-CB 3.85Å; M22-L43 HydrophobicContact CE-CD2 3.45Å; M22-L43 VanDerWaalsContact CE-CD2 3.45Å; M22-L43 HydrophobicContact CE-CG 4.27Å; M22-L43 WeakPolarHBondContact CE-O 3.21Å; M22-V46 HydrophobicContact CE-CB 4.12Å; M22-V46 HydrophobicContact CE-CG1 4.08Å; M22-V46 HydrophobicContact SD-CG1 4.22Å; M22-A47 HydrophobicContact CB-CB 3.88Å; M22-A47 HydrophobicContact CE-CB 4.26Å; M22-A47 HydrophobicContact CG-CB 3.59Å; M22-A47 VanDerWaalsContact SD-CA 3.57Å; M22-A47 HydrophobicContact SD-CB 3.56Å; M22-A47 VanDerWaalsContact SD-CB 3.56Å
23A98.5Very high98Very high7 Ų758 Ų586%0.05830%0.303CS..Hα-helixtrans-63.4-40.1178.200000111.5Y19 D20 M26 K27 A47 Y48 V51Y19-A23 WeakPolarHBondContact O-CB 3.49Å; Y19-A23 PolarHBondContact O-N 3.04Å; D20-A23 PolarHBondContact O-N 2.99Å; A23-M26 PolarHBondContact O-N 3.12Å; A23-K27 WeakPolarHBondContact O-CB 3.47Å; A23-K27 PolarHBondContact O-N 2.81Å; A23-A47 HydrophobicContact CB-CB 4.19Å; A23-Y48 HydrophobicContact CB-CD1 4.1Å; A23-Y48 HydrophobicContact CB-CD2 4.49Å; A23-Y48 HydrophobicContact CB-CE1 3.88Å; A23-Y48 HydrophobicContact CB-CE2 4.28Å; A23-Y48 HydrophobicContact CB-CG 4.41Å; A23-V51 HydrophobicContact CB-CG2 4.2Å
24T98.4Very high97.8Very high100 Ų10060.1 Ų60.161%0.61332%0.321SS*.Hα-helixtrans-61.4-45.7175.2-58.70000111.7D20 D21 M22 A28D20-T24 PolarHBondContact O-N 2.67Å; D20-T24 PolarHBondContact O-OG1 3.03Å; D21-T24 PolarHBondContact O-N 3.03Å; M22-T24 VanDerWaalsContact C-N 3.34Å; M22-T24 PolarHBondContact O-N 3.23Å; T24-A28 PolarHBondContact O-N 3.17Å
25C98.5Very high97.7Very high17 Ų1759.9 Ų59.912%0.11532%0.32CS..Hα-helixtrans-65.5-47.1177.8-64.90000111.6L6 A10 D21 M22 K27 A28 V29L6-C25 HydrophobicContact CD2-CB 4.4Å; A10-C25 HydrophobicContact CB-CB 4.01Å; D21-C25 PolarHBondContact O-N 3.46Å; D21-C25 PolarHBondContact O-SG 3Å; M22-C25 PolarHBondContact O-N 3.41Å; C25-K27 VanDerWaalsContact C-N 3.34Å; C25-K27 PolarHBondContact O-N 2.86Å; C25-A28 PolarHBondContact O-N 2.84Å; C25-V29 WeakPolarHBondContact O-CG2 3.4Å; C25-V29 PolarHBondContact O-N 3.17Å
26M98.6Very high97.7Very high0 Ų052.7 Ų52.70%029%0.286CS..Hα-helixtrans-70.2-30.2-177.7-67.6-51-53.500113I7 A10 M22 A23 V29 T30 E40 L43 L44I7-M26 HydrophobicContact CD1-CE 3.74Å; I7-M26 HydrophobicContact CD1-SD 3.57Å; I7-M26 VanDerWaalsContact CD1-SD 3.57Å; A10-M26 HydrophobicContact CB-CG 3.98Å; A10-M26 HydrophobicContact CB-SD 3.66Å; M22-M26 WeakPolarHBondContact O-CB 3.45Å; M22-M26 VanDerWaalsContact O-CG 3.32Å; M22-M26 WeakPolarHBondContact O-CG 3.31Å; M22-M26 PolarHBondContact O-N 3.22Å; A23-M26 PolarHBondContact O-N 3.12Å; M26-V29 HydrophobicContact CE-CB 4.47Å; M26-V29 PolarHBondContact O-N 3.28Å; M26-T30 WeakPolarHBondContact O-CB 3.23Å; M26-T30 PolarHBondContact O-N 3.31Å; M26-T30 PolarHBondContact O-OG1 3.38Å; M26-E40 HydrophobicContact CE-CB 4.36Å; M26-E40 WeakPolarHBondContact CE-O 3.42Å; M26-L43 HydrophobicContact CE-CB 4.05Å; M26-L43 HydrophobicContact CG-CB 4.29Å; M26-L43 HydrophobicContact SD-CB 3.84Å; M26-L43 HydrophobicContact SD-CD1 4.41Å; M26-L44 HydrophobicContact CB-CB 4.3Å; M26-L44 HydrophobicContact CB-CD1 3.65Å; M26-L44 HydrophobicContact CE-CB 4.1Å
27K98.5Very high97.7Very high68 Ų6852.2 Ų52.230%0.29628%0.279SS..Hα-helixtrans-59.4-51.5167.5178.5170.1-179.61790110.8A23 C25 V29 T30 E31 T96 L100A23-K27 WeakPolarHBondContact O-CB 3.47Å; A23-K27 PolarHBondContact O-N 2.81Å; C25-K27 VanDerWaalsContact C-N 3.34Å; C25-K27 PolarHBondContact O-N 2.86Å; K27-V29 VanDerWaalsContact C-N 3.26Å; K27-V29 PolarHBondContact O-N 3.41Å; K27-T30 PolarHBondContact O-N 3.17Å; K27-T30 VanDerWaalsContact O-N 3.09Å; K27-E31 WeakPolarHBondContact CE-OE1 3.45Å; K27-E31 HydrophobicContact CG-CG 4.35Å; K27-E31 IonicContact NZ-OE1 3.11Å; K27-E31 WeakPolarHBondContact O-CG 3.3Å; K27-E31 PolarHBondContact O-N 3.29Å; K27-T96 HydrophobicContact CD-CG2 3.98Å; K27-L100 HydrophobicContact CB-CD1 4.26Å; K27-L100 HydrophobicContact CG-CD1 4.07Å; K27-L100 HydrophobicContact CG-CD2 4.14Å
28A98.3Very high97.5Very high37 Ų3749.2 Ų49.231%0.30627%0.268SS..Hα-helixtrans-63.2-30.418000000113.1L6 T24 C25 Q32L6-A28 HydrophobicContact CD1-CB 3.87Å; L6-A28 HydrophobicContact CD2-CB 4.1Å; T24-A28 PolarHBondContact O-N 3.17Å; C25-A28 PolarHBondContact O-N 2.84Å; A28-Q32 WeakPolarHBondContact O-CG 3.4Å
29V98.4Very high97.4Very high2 Ų247.6 Ų47.61%0.01227%0.266CS..Hα-helixtrans-69.4-46.9171172.10000111.1K3 L6 I7 C25 M26 K27 E31 Q32 L36K3-V29 HydrophobicContact CD-CG1 4.31Å; K3-V29 HydrophobicContact CG-CG1 4.03Å; K3-V29 HydrophobicContact CG-CG2 4.45Å; L6-V29 HydrophobicContact CB-CG2 3.44Å; L6-V29 VanDerWaalsContact CB-CG2 3.44Å; L6-V29 HydrophobicContact CD1-CG2 3.89Å; L6-V29 HydrophobicContact CG-CG2 4.3Å; I7-V29 HydrophobicContact CD1-CB 4.46Å; I7-V29 HydrophobicContact CD1-CG1 4.12Å; I7-V29 HydrophobicContact CD1-CG2 3.89Å; I7-V29 HydrophobicContact CG1-CG2 4.18Å; C25-V29 WeakPolarHBondContact O-CG2 3.4Å; C25-V29 PolarHBondContact O-N 3.17Å; M26-V29 HydrophobicContact CE-CB 4.47Å; M26-V29 PolarHBondContact O-N 3.28Å; K27-V29 VanDerWaalsContact C-N 3.26Å; K27-V29 PolarHBondContact O-N 3.41Å; V29-E31 VanDerWaalsContact C-N 3.33Å; V29-E31 PolarHBondContact O-N 2.99Å; V29-Q32 WeakPolarHBondContact O-CB 3.39Å; V29-Q32 PolarHBondContact O-N 3.05Å; V29-L36 HydrophobicContact CG1-CD2 3.84Å
30T98.3Very high97.4Very high2 Ų246.3 Ų46.31%0.01226%0.262CS..Hα-helixtrans-62.6-40-178.1-580000111.9M26 K27 Q32 G33 L100 Y104 L105M26-T30 WeakPolarHBondContact O-CB 3.23Å; M26-T30 PolarHBondContact O-N 3.31Å; M26-T30 PolarHBondContact O-OG1 3.38Å; K27-T30 PolarHBondContact O-N 3.17Å; K27-T30 VanDerWaalsContact O-N 3.09Å; T30-Q32 PolarHBondContact O-N 3.4Å; T30-Q32 VanDerWaalsContact O-N 3.15Å; T30-G33 PolarHBondContact O-N 3.11Å; T30-G33 VanDerWaalsContact O-N 3.08Å; T30-L100 HydrophobicContact CG2-CB 4.23Å; T30-L100 HydrophobicContact CG2-CD2 3.96Å; T30-Y104 HydrophobicContact CG2-CD2 4.41Å; T30-Y104 HydrophobicContact CG2-CG 4.34Å; T30-L105 HydrophobicContact CG2-CD1 4.11Å; T30-L105 HydrophobicContact CG2-CD2 3.65Å; T30-L105 HydrophobicContact CG2-CG 3.76Å
31E97.9Very high97.4Very high87 Ų8742.8 Ų42.841%0.40724%0.243SC..THydrogen-bonded Turntrans-69.8-6.6179.4-69.8176153.500113.8K27 V29 G33 L100 Y104K27-E31 WeakPolarHBondContact CE-OE1 3.45Å; K27-E31 HydrophobicContact CG-CG 4.35Å; K27-E31 IonicContact NZ-OE1 3.11Å; K27-E31 WeakPolarHBondContact O-CG 3.3Å; K27-E31 PolarHBondContact O-N 3.29Å; V29-E31 VanDerWaalsContact C-N 3.33Å; V29-E31 PolarHBondContact O-N 2.99Å; E31-G33 PolarHBondContact O-N 3.02Å; E31-L100 HydrophobicContact CG-CD2 3.75Å; E31-Y104 HydrophobicContact CB-CE2 4.42Å; E31-Y104 HydrophobicContact CG-CD2 4.42Å; E31-Y104 HydrophobicContact CG-CE2 3.79Å
32Q96.5Very high97.3Very high93 Ų9343.7 Ų43.744%0.43525%0.247SC..THydrogen-bonded Turntrans-72.5-13.8169.1-59.8-178.721.300112.6A28 V29 T30 A34A28-Q32 WeakPolarHBondContact O-CG 3.4Å; V29-Q32 WeakPolarHBondContact O-CB 3.39Å; V29-Q32 PolarHBondContact O-N 3.05Å; T30-Q32 PolarHBondContact O-N 3.4Å; T30-Q32 VanDerWaalsContact O-N 3.15Å; Q32-A34 VanDerWaalsContact C-N 3.31Å; Q32-A34 PolarHBondContact O-N 3.09Å
33G95Very high97.3Very high30 Ų3044.1 Ų44.131%0.30925%0.25SC..  trans800.3171.200000116.1T30 E31 N108T30-G33 PolarHBondContact O-N 3.11Å; T30-G33 VanDerWaalsContact O-N 3.08Å; E31-G33 PolarHBondContact O-N 3.02Å; G33-N108 PolarHBondContact O-ND2 3.34Å
34A95Very high97.3Very high54 Ų5444 Ų4445%0.44625%0.248SC..SBendtrans-78.7144.1170.300000110.9Q32 L36Q32-A34 VanDerWaalsContact C-N 3.31Å; Q32-A34 PolarHBondContact O-N 3.09Å; A34-L36 PolarHBondContact O-N 3.17Å
35E96.5Very high97.3Very high64 Ų6440.7 Ų40.730%0.29923%0.229SC..PPolyproline II helixtrans-58.3132.9172.3-171.3171.3-158.900110.1A109 T110 N111E35-A109 WeakPolarHBondContact OE1-CA 3.49Å; E35-T110 VanDerWaalsContact CD-OG1 3.27Å; E35-T110 PolarHBondContact OE1-N 3.48Å; E35-T110 PolarHBondContact OE1-OG1 3.03Å; E35-T110 VanDerWaalsContact OE1-OG1 3.1Å; E35-T110 WeakPolarHBondContact OE2-CB 3.34Å; E35-T110 WeakPolarHBondContact OE2-CG2 3.48Å; E35-T110 PolarHBondContact OE2-OG1 2.92Å; E35-N111 PolarHBondContact OE1-ND2 3.43Å
36L97.7Very high97.3Very high7 Ų742 Ų424%0.03724%0.237CC..PPolyproline II helixtrans-76.7141.3-179.8-60.6-172000110.6V29 A34 E40 R41 L44 L105V29-L36 HydrophobicContact CG1-CD2 3.84Å; A34-L36 PolarHBondContact O-N 3.17Å; L36-E40 WeakPolarHBondContact CA-OE2 2.99Å; L36-E40 HydrophobicContact CB-CB 3.92Å; L36-E40 HydrophobicContact CD2-CB 4.23Å; L36-E40 HydrophobicContact CG-CB 4.44Å; L36-R41 HydrophobicContact CB-CB 4.39Å; L36-L44 HydrophobicContact CD1-CB 4.44Å; L36-L44 HydrophobicContact CD1-CD2 4.06Å; L36-L105 HydrophobicContact CD1-CD2 3.61Å; L36-L105 HydrophobicContact CG-CD2 3.88Å
37S96.7Very high97.3Very high53 Ų5342 Ų4237%0.37124%0.237SC..PPolyproline II helixtrans-66.6165.6166.7780000111.1E39 E40 R41S37-E39 PolarHBondContact O-N 2.85Å; S37-E39 PolarHBondContact OG-N 3.05Å; S37-E40 PolarHBondContact N-OE2 3.21Å; S37-E40 PolarHBondContact O-N 3.05Å; S37-E40 VanDerWaalsContact O-N 3.13Å; S37-E40 VanDerWaalsContact OG-CG 3.28Å; S37-E40 WeakPolarHBondContact OG-CG 3.48Å; S37-E40 PolarHBondContact OG-N 3.44Å; S37-R41 VanDerWaalsContact O-CB 3.28Å; S37-R41 WeakPolarHBondContact O-CB 3.32Å; S37-R41 PolarHBondContact O-N 2.93Å
38N94.3Very high97.3Very high80 Ų8039.4 Ų39.443%0.42823%0.225SC..Hα-helixtrans-56.6-38.1176.2-74.4-3.7000112.6R41 N42N38-R41 PolarHBondContact OD1-NH1 3.48Å; N38-N42 WeakPolarHBondContact O-CB 3.43Å; N38-N42 PolarHBondContact O-N 3.08Å; N38-N42 PolarHBondContact O-ND2 3.32Å; N38-N42 PolarHBondContact O-OD1 3.43Å
39E96.1Very high97.3Very high105 Ų10544.2 Ų44.249%0.49124%0.239SC..Hα-helixtrans-65.8-46.9176.1-173.9-179-157.200111.3K11 S37 N42 L43K11-E39 WeakPolarHBondContact CE-OE1 3.44Å; K11-E39 VanDerWaalsContact NZ-CD 3.27Å; K11-E39 IonicContact NZ-OE1 3.33Å; K11-E39 PolarHBondContact NZ-OE1 3.31Å; K11-E39 IonicContact NZ-OE2 3Å; K11-E39 PolarHBondContact NZ-OE2 3.36Å; S37-E39 PolarHBondContact O-N 2.85Å; S37-E39 PolarHBondContact OG-N 3.05Å; E39-N42 PolarHBondContact O-N 2.75Å; E39-L43 HydrophobicContact CG-CD1 4.48Å; E39-L43 WeakPolarHBondContact O-CG 3.34Å; E39-L43 PolarHBondContact O-N 2.67Å
40E97.9Very high97.3Very high26 Ų2647 Ų4712%0.12125%0.254CS..Hα-helixtrans-65.5-41.2-179.7-65.8168.4169.300111.8K3 I7 M26 L36 S37 N42 L43 L44K3-E40 WeakPolarHBondContact CE-OE1 3.47Å; K3-E40 WeakPolarHBondContact CE-OE2 3.21Å; K3-E40 IonicContact NZ-OE1 2.65Å; K3-E40 PolarHBondContact NZ-OE1 3.26Å; K3-E40 IonicContact NZ-OE2 3.33Å; K3-E40 PolarHBondContact NZ-OE2 2.83Å; I7-E40 HydrophobicContact CD1-CB 4.38Å; I7-E40 HydrophobicContact CD1-CG 3.79Å; I7-E40 HydrophobicContact CG1-CG 4.32Å; M26-E40 HydrophobicContact CE-CB 4.36Å; M26-E40 WeakPolarHBondContact CE-O 3.42Å; L36-E40 WeakPolarHBondContact CA-OE2 2.99Å; L36-E40 HydrophobicContact CB-CB 3.92Å; L36-E40 HydrophobicContact CD2-CB 4.23Å; L36-E40 HydrophobicContact CG-CB 4.44Å; S37-E40 PolarHBondContact N-OE2 3.21Å; S37-E40 PolarHBondContact O-N 3.05Å; S37-E40 VanDerWaalsContact O-N 3.13Å; S37-E40 VanDerWaalsContact OG-CG 3.28Å; S37-E40 WeakPolarHBondContact OG-CG 3.48Å; S37-E40 PolarHBondContact OG-N 3.44Å; E40-N42 VanDerWaalsContact C-N 3.33Å; E40-N42 PolarHBondContact O-N 3.08Å; E40-L43 PolarHBondContact O-N 3Å; E40-L44 PolarHBondContact O-N 3.46Å
41R97.6Very high97.3Very high8 Ų847.3 Ų47.33%0.0326%0.256CS..Hα-helixtrans-58.7-44.2173178.8-174.677.6-170.10.2111.5L36 S37 N38 L44 S45 E113 S114 F117 Y118L36-R41 HydrophobicContact CB-CB 4.39Å; S37-R41 VanDerWaalsContact O-CB 3.28Å; S37-R41 WeakPolarHBondContact O-CB 3.32Å; S37-R41 PolarHBondContact O-N 2.93Å; N38-R41 PolarHBondContact OD1-NH1 3.48Å; R41-L44 PolarHBondContact O-N 3.27Å; R41-S45 WeakPolarHBondContact O-CB 3.37Å; R41-S45 PolarHBondContact O-N 3Å; R41-E113 IonicContact CZ-OE1 3.21Å; R41-E113 IonicContact NH1-OE1 2.89Å; R41-E113 PolarHBondContact NH1-OE1 3.37Å; R41-E113 IonicContact NH2-OE1 3.98Å; R41-E113 PolarHBondContact NH2-OE1 2.89Å; R41-S114 PolarHBondContact NH1-OG 3.39Å; R41-F117 VanDerWaalsContact CD-CD1 3.45Å; R41-F117 HydrophobicContact CG-CD1 3.57Å; R41-F117 HydrophobicContact CG-CE1 3.38Å; R41-F117 HydrophobicContact CG-CE2 4.36Å; R41-F117 HydrophobicContact CG-CG 4.15Å; R41-F117 HydrophobicContact CG-CZ 3.8Å; R41-Y118 HydrophobicContact CG-CE1 3.68Å
42N96.4Very high97.3Very high77 Ų7743.3 Ų43.341%0.41224%0.237SC..Hα-helixtrans-66.1-42.5178.2-72.8-12.2000111.5N38 E39 E40 L44 S45 V46N38-N42 WeakPolarHBondContact O-CB 3.43Å; N38-N42 PolarHBondContact O-N 3.08Å; N38-N42 PolarHBondContact O-ND2 3.32Å; N38-N42 PolarHBondContact O-OD1 3.43Å; E39-N42 PolarHBondContact O-N 2.75Å; E40-N42 VanDerWaalsContact C-N 3.33Å; E40-N42 PolarHBondContact O-N 3.08Å; N42-L44 PolarHBondContact O-N 3.42Å; N42-S45 WeakPolarHBondContact O-CB 3.33Å; N42-S45 PolarHBondContact O-N 3.17Å; N42-V46 WeakPolarHBondContact O-CG2 3.38Å; N42-V46 PolarHBondContact O-N 2.87Å
43L98.3Very high97.3Very high10 Ų1039.9 Ų39.95%0.05223%0.227CC..Hα-helixtrans-58.5-47174.3-71.4169.9000111.6I7 K11 E14 M22 M26 E39 E40 S45 V46 A47I7-L43 HydrophobicContact CD1-CD1 4.38Å; I7-L43 HydrophobicContact CG2-CD1 4.12Å; K11-L43 HydrophobicContact CG-CD1 4.07Å; K11-L43 HydrophobicContact CG-CD2 4.14Å; E14-L43 WeakPolarHBondContact OE2-CD2 3.45Å; M22-L43 HydrophobicContact CE-CB 3.85Å; M22-L43 HydrophobicContact CE-CD2 3.45Å; M22-L43 VanDerWaalsContact CE-CD2 3.45Å; M22-L43 HydrophobicContact CE-CG 4.27Å; M22-L43 WeakPolarHBondContact CE-O 3.21Å; M26-L43 HydrophobicContact CE-CB 4.05Å; M26-L43 HydrophobicContact CG-CB 4.29Å; M26-L43 HydrophobicContact SD-CB 3.84Å; M26-L43 HydrophobicContact SD-CD1 4.41Å; E39-L43 HydrophobicContact CG-CD1 4.48Å; E39-L43 WeakPolarHBondContact O-CG 3.34Å; E39-L43 PolarHBondContact O-N 2.67Å; E40-L43 PolarHBondContact O-N 3Å; L43-S45 VanDerWaalsContact C-N 3.3Å; L43-S45 PolarHBondContact O-N 3.49Å; L43-V46 PolarHBondContact O-N 3.4Å; L43-A47 WeakPolarHBondContact O-CB 3.32Å; L43-A47 PolarHBondContact O-N 3.36Å
44L98.6Very high97.5Very high3 Ų340.5 Ų40.52%0.01623%0.234CC..Hα-helixtrans-57.4-45.4176.1179.574.8000111.6M26 L36 E40 R41 N42 A47 Y48 L105M26-L44 HydrophobicContact CB-CB 4.3Å; M26-L44 HydrophobicContact CB-CD1 3.65Å; M26-L44 HydrophobicContact CE-CB 4.1Å; L36-L44 HydrophobicContact CD1-CB 4.44Å; L36-L44 HydrophobicContact CD1-CD2 4.06Å; E40-L44 PolarHBondContact O-N 3.46Å; R41-L44 PolarHBondContact O-N 3.27Å; N42-L44 PolarHBondContact O-N 3.42Å; L44-A47 PolarHBondContact O-N 3.13Å; L44-Y48 HydrophobicContact CD1-CD2 3.63Å; L44-Y48 HydrophobicContact CD1-CE2 3.51Å; L44-Y48 HydrophobicContact CG-CD2 4.2Å; L44-Y48 PolarHBondContact O-N 3.01Å; L44-Y48 VanDerWaalsContact O-N 3.16Å; L44-L105 HydrophobicContact CD2-CD1 3.43Å; L44-L105 VanDerWaalsContact CD2-CD1 3.43Å; L44-L105 HydrophobicContact CD2-CD2 4.26Å; L44-L105 HydrophobicContact CD2-CG 4.49Å
45S98.1Very high97.6Very high32 Ų3241 Ų4122%0.22422%0.224CC..Hα-helixtrans-63-48.5179.5-176.10000112R41 N42 L43 A47 K49R41-S45 WeakPolarHBondContact O-CB 3.37Å; R41-S45 PolarHBondContact O-N 3Å; N42-S45 WeakPolarHBondContact O-CB 3.33Å; N42-S45 PolarHBondContact O-N 3.17Å; L43-S45 VanDerWaalsContact C-N 3.3Å; L43-S45 PolarHBondContact O-N 3.49Å; S45-A47 VanDerWaalsContact C-N 3.35Å; S45-A47 PolarHBondContact O-N 3.5Å; S45-K49 WeakPolarHBondContact O-CB 3.26Å; S45-K49 PolarHBondContact O-N 3.21Å
46V98.3Very high97.7Very high45 Ų4539.6 Ų39.627%0.27322%0.216SC..Hα-helixtrans-59.7-44.6177.4169.30000111.2Y19 M22 N42 L43 N50Y19-V46 HydrophobicContact CE1-CG1 4.19Å; M22-V46 HydrophobicContact CE-CB 4.12Å; M22-V46 HydrophobicContact CE-CG1 4.08Å; M22-V46 HydrophobicContact SD-CG1 4.22Å; N42-V46 WeakPolarHBondContact O-CG2 3.38Å; N42-V46 PolarHBondContact O-N 2.87Å; L43-V46 PolarHBondContact O-N 3.4Å; V46-N50 PolarHBondContact O-N 2.95Å; V46-N50 PolarHBondContact O-ND2 2.68Å
47A98.6Very high97.7Very high0 Ų042.7 Ų42.70%024%0.238CC..Hα-helixtrans-56.2-60.3179.400000111.3M22 A23 L43 L44 S45 K49 N50 V51M22-A47 HydrophobicContact CB-CB 3.88Å; M22-A47 HydrophobicContact CE-CB 4.26Å; M22-A47 HydrophobicContact CG-CB 3.59Å; M22-A47 VanDerWaalsContact SD-CA 3.57Å; M22-A47 HydrophobicContact SD-CB 3.56Å; M22-A47 VanDerWaalsContact SD-CB 3.56Å; A23-A47 HydrophobicContact CB-CB 4.19Å; L43-A47 WeakPolarHBondContact O-CB 3.32Å; L43-A47 PolarHBondContact O-N 3.36Å; L44-A47 PolarHBondContact O-N 3.13Å; S45-A47 VanDerWaalsContact C-N 3.35Å; S45-A47 PolarHBondContact O-N 3.5Å; A47-K49 PolarHBondContact O-N 3.43Å; A47-N50 PolarHBondContact O-N 3.34Å; A47-V51 WeakPolarHBondContact O-CG2 3.43Å; A47-V51 PolarHBondContact O-N 3.31Å; A47-V51 VanDerWaalsContact O-N 3.13Å
48Y98.7Very high97.7Very high12 Ų1242 Ų425%0.04724%0.236CC..Hα-helixtrans-72.9-32.3-174.2-78.6-73.1000112.8A23 L44 N50 V51 V52 I93 T96 V97 L100 Y125A23-Y48 HydrophobicContact CB-CD1 4.1Å; A23-Y48 HydrophobicContact CB-CD2 4.49Å; A23-Y48 HydrophobicContact CB-CE1 3.88Å; A23-Y48 HydrophobicContact CB-CE2 4.28Å; A23-Y48 HydrophobicContact CB-CG 4.41Å; L44-Y48 HydrophobicContact CD1-CD2 3.63Å; L44-Y48 HydrophobicContact CD1-CE2 3.51Å; L44-Y48 HydrophobicContact CG-CD2 4.2Å; L44-Y48 PolarHBondContact O-N 3.01Å; L44-Y48 VanDerWaalsContact O-N 3.16Å; Y48-N50 VanDerWaalsContact C-N 3.32Å; Y48-N50 PolarHBondContact O-N 2.93Å; Y48-V51 PolarHBondContact O-N 3.06Å; Y48-V52 WeakPolarHBondContact O-CB 3.36Å; Y48-V52 VanDerWaalsContact O-CG1 3.27Å; Y48-V52 WeakPolarHBondContact O-CG1 3.43Å; Y48-V52 PolarHBondContact O-N 3.31Å; Y48-I93 HydrophobicContact CD1-CG2 4.19Å; Y48-T96 HydrophobicContact CE1-CG2 4.48Å; Y48-V97 HydrophobicContact CD1-CG2 3.27Å; Y48-V97 HydrophobicContact CD2-CG2 3.92Å; Y48-V97 HydrophobicContact CE1-CG2 3.59Å; Y48-V97 HydrophobicContact CE2-CG2 4.2Å; Y48-V97 HydrophobicContact CG-CG2 3.44Å; Y48-V97 VanDerWaalsContact CG-CG2 3.44Å; Y48-L100 HydrophobicContact CE2-CD1 3.94Å; Y48-Y125 WeakPolarHBondContact CB-OH 3.45Å; Y48-Y125 PolarHBondContact O-OH 3.43Å
49K97.9Very high97.9Very high138 Ų13840.1 Ų40.160%0.622%0.223SC*.Hα-helixtrans-57.3-44.3174179.2-176.4175.3-174.40111.5S45 A47 G53 Y125S45-K49 WeakPolarHBondContact O-CB 3.26Å; S45-K49 PolarHBondContact O-N 3.21Å; A47-K49 PolarHBondContact O-N 3.43Å; K49-G53 WeakPolarHBondContact O-CA 3.46Å; K49-G53 PolarHBondContact O-N 3.26Å; K49-Y125 PolarHBondContact N-OH 3.17Å
50N98.2Very high97.9Very high62 Ų6239.7 Ų39.733%0.33222%0.217SC..Hα-helixtrans-72.8-42.7179.3-78.5-72.7000112.1Y19 V46 A47 Y48 V52 G53 G54Y19-N50 HydrophobicContact CD1-CB 3.59Å; Y19-N50 HydrophobicContact CD2-CB 3.42Å; Y19-N50 VanDerWaalsContact CD2-CB 3.42Å; Y19-N50 HydrophobicContact CE1-CB 3.93Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.4Å; Y19-N50 HydrophobicContact CE2-CB 3.77Å; Y19-N50 HydrophobicContact CG-CB 3.3Å; V46-N50 PolarHBondContact O-N 2.95Å; V46-N50 PolarHBondContact O-ND2 2.68Å; A47-N50 PolarHBondContact O-N 3.34Å; Y48-N50 VanDerWaalsContact C-N 3.32Å; Y48-N50 PolarHBondContact O-N 2.93Å; N50-V52 PolarHBondContact O-N 2.89Å; N50-G53 PolarHBondContact O-N 2.98Å; N50-G54 PolarHBondContact O-N 2.86Å
51V98.2Very high97.9Very high8 Ų842.7 Ų42.75%0.04824%0.236CC..Hα-helixtrans-59.1-49.6177.3171.70000111.4Y19 A23 A47 Y48 R55 I93Y19-V51 VanDerWaalsContact C-CG2 3.43Å; Y19-V51 WeakPolarHBondContact O-CG2 3.49Å; A23-V51 HydrophobicContact CB-CG2 4.2Å; A47-V51 WeakPolarHBondContact O-CG2 3.43Å; A47-V51 PolarHBondContact O-N 3.31Å; A47-V51 VanDerWaalsContact O-N 3.13Å; Y48-V51 PolarHBondContact O-N 3.06Å; V51-R55 WeakPolarHBondContact O-CD 3.3Å; V51-I93 HydrophobicContact CG1-CD1 3.66Å; V51-I93 HydrophobicContact CG1-CG1 3.99Å; V51-I93 HydrophobicContact CG1-CG2 4.13Å
52V98.3Very high97.9Very high2 Ų243 Ų431%0.01224%0.239CC..Hα-helixtrans-70.8-35.7178.677.90000111.6Y48 N50 G54 R55 R56 L90 I93 Y125 Y128Y48-V52 WeakPolarHBondContact O-CB 3.36Å; Y48-V52 VanDerWaalsContact O-CG1 3.27Å; Y48-V52 WeakPolarHBondContact O-CG1 3.43Å; Y48-V52 PolarHBondContact O-N 3.31Å; N50-V52 PolarHBondContact O-N 2.89Å; V52-G54 VanDerWaalsContact C-N 3.35Å; V52-G54 PolarHBondContact O-N 3.23Å; V52-R55 PolarHBondContact O-N 3.21Å; V52-R56 HydrophobicContact CG2-CG 4.43Å; V52-R56 WeakPolarHBondContact O-CG 3.5Å; V52-R56 PolarHBondContact O-N 3.48Å; V52-L90 HydrophobicContact CG2-CD1 4.38Å; V52-L90 HydrophobicContact CG2-CG 4.43Å; V52-I93 HydrophobicContact CB-CG2 4.11Å; V52-I93 HydrophobicContact CG2-CG2 4.38Å; V52-Y125 HydrophobicContact CB-CE1 4.09Å; V52-Y125 HydrophobicContact CG1-CE1 4Å; V52-Y125 HydrophobicContact CG2-CE1 4.23Å; V52-Y128 HydrophobicContact CG1-CD2 4Å; V52-Y128 HydrophobicContact CG1-CE2 3.84Å; V52-Y128 HydrophobicContact CG2-CD2 3.96Å
53G97.8Very high97.8Very high21 Ų2140 Ų4022%0.21622%0.224CC..Hα-helixtrans-57.6-45.2176.600000112.4K49 N50 R55 R56 S57K49-G53 WeakPolarHBondContact O-CA 3.46Å; K49-G53 PolarHBondContact O-N 3.26Å; N50-G53 PolarHBondContact O-N 2.98Å; G53-R55 PolarHBondContact O-N 3.2Å; G53-R56 PolarHBondContact O-N 3.41Å; G53-S57 WeakPolarHBondContact O-CB 3.42Å; G53-S57 PolarHBondContact O-N 3.44Å; G53-S57 PolarHBondContact O-OG 3.16Å
54G97.3Very high97.7Very high44 Ų4441.3 Ų41.345%0.45423%0.234SC..Hα-helixtrans-58.5-44.2175.500000113N50 V52 A58N50-G54 PolarHBondContact O-N 2.86Å; V52-G54 VanDerWaalsContact C-N 3.35Å; V52-G54 PolarHBondContact O-N 3.23Å; G54-A58 WeakPolarHBondContact O-CB 3.44Å; G54-A58 PolarHBondContact O-N 3.4Å
55R98.1Very high97.5Very high64 Ų6445 Ų4524%0.24225%0.252CS..Hα-helixtrans-69.3-40.6178.6-85.867-176.1-163.31.6112D20 V51 V52 G53 A58 W59 V86 E89 L90 I93D20-R55 IonicContact OD1-NH1 3.78Å; D20-R55 PolarHBondContact OD1-NH1 2.86Å; D20-R55 IonicContact OD1-NH2 3.19Å; D20-R55 IonicContact OD2-NH1 3.63Å; V51-R55 WeakPolarHBondContact O-CD 3.3Å; V52-R55 PolarHBondContact O-N 3.21Å; G53-R55 PolarHBondContact O-N 3.2Å; R55-A58 PolarHBondContact O-N 2.94Å; R55-W59 WeakPolarHBondContact O-CB 3.33Å; R55-W59 PolarHBondContact O-N 2.88Å; R55-V86 HydrophobicContact CB-CG1 4.35Å; R55-V86 HydrophobicContact CG-CG1 4.49Å; R55-V86 WeakPolarHBondContact O-CG1 3.35Å; R55-E89 HydrophobicContact CG-CB 4.08Å; R55-E89 IonicContact CZ-OE2 3.2Å; R55-E89 IonicContact NE-OE2 3.47Å; R55-E89 PolarHBondContact NE-OE2 2.88Å; R55-E89 VanDerWaalsContact NE-OE2 3.11Å; R55-E89 IonicContact NH2-OE2 2.78Å; R55-L90 HydrophobicContact CB-CB 4.23Å; R55-L90 HydrophobicContact CB-CD1 4.24Å; R55-I93 HydrophobicContact CG-CD1 3.97Å
56R97.8Very high97.2Very high35 Ų3545.5 Ų45.513%0.13225%0.251CS..Hα-helixtrans-61-44.6175.2-76-179.870.4-127.415.1112.1V52 G53 W59 R60 L90 Y128 E131V52-R56 HydrophobicContact CG2-CG 4.43Å; V52-R56 WeakPolarHBondContact O-CG 3.5Å; V52-R56 PolarHBondContact O-N 3.48Å; G53-R56 PolarHBondContact O-N 3.41Å; R56-W59 PolarHBondContact O-N 3.48Å; R56-R60 WeakPolarHBondContact O-CG 3.36Å; R56-R60 PolarHBondContact O-N 2.98Å; R56-L90 HydrophobicContact CB-CD1 4.3Å; R56-L90 HydrophobicContact CG-CD1 3.35Å; R56-Y128 VanDerWaalsContact NE-CD1 3.26Å; R56-E131 IonicContact CZ-OE1 3.74Å; R56-E131 IonicContact CZ-OE2 3.53Å; R56-E131 IonicContact NE-OE1 2.76Å; R56-E131 PolarHBondContact NE-OE1 3.39Å; R56-E131 IonicContact NE-OE2 3.63Å; R56-E131 PolarHBondContact NE-OE2 3.37Å; R56-E131 VanDerWaalsContact NH2-CD 3.35Å; R56-E131 IonicContact NH2-OE1 3.36Å; R56-E131 PolarHBondContact NH2-OE1 2.7Å; R56-E131 IonicContact NH2-OE2 3.84Å; R56-E131 PolarHBondContact NH2-OE2 3.33Å
57S98.1Very high96.8Very high72 Ų7251.2 Ų51.250%0.50328%0.275SS..Hα-helixtrans-64.1-45.6177.2-66.10000111.6G53 W59 R60 V61G53-S57 WeakPolarHBondContact O-CB 3.42Å; G53-S57 PolarHBondContact O-N 3.44Å; G53-S57 PolarHBondContact O-OG 3.16Å; S57-W59 VanDerWaalsContact C-N 3.34Å; S57-W59 PolarHBondContact O-N 3.43Å; S57-R60 PolarHBondContact O-N 3.48Å; S57-V61 WeakPolarHBondContact O-CG2 3.09Å; S57-V61 PolarHBondContact O-N 3.25Å; S57-V61 VanDerWaalsContact O-N 3.17Å
58A98Very high96.4Very high39 Ų3959.2 Ų59.232%0.32231%0.31SS..Hα-helixtrans-58.8-46.8175.100000111.5G54 R55 V61 I62 V86G54-A58 WeakPolarHBondContact O-CB 3.44Å; G54-A58 PolarHBondContact O-N 3.4Å; R55-A58 PolarHBondContact O-N 2.94Å; A58-V61 PolarHBondContact O-N 3.49Å; A58-I62 VanDerWaalsContact O-CD1 3.31Å; A58-I62 WeakPolarHBondContact O-CD1 3.26Å; A58-I62 WeakPolarHBondContact O-CG1 3.31Å; A58-I62 PolarHBondContact O-N 3.41Å; A58-V86 HydrophobicContact CB-CG1 4.19Å
59W97.8Very high95.5Very high40 Ų4060 Ų6015%0.15232%0.316CS..Hα-helixtrans-58.8-50.1178.3178.478.8000112.1R55 R56 S57 V61 I62 S63 V86 E87 E131 V132R55-W59 WeakPolarHBondContact O-CB 3.33Å; R55-W59 PolarHBondContact O-N 2.88Å; R56-W59 PolarHBondContact O-N 3.48Å; S57-W59 VanDerWaalsContact C-N 3.34Å; S57-W59 PolarHBondContact O-N 3.43Å; W59-V61 VanDerWaalsContact C-N 3.29Å; W59-V61 PolarHBondContact O-N 3.45Å; W59-I62 PolarHBondContact O-N 3.24Å; W59-I62 VanDerWaalsContact O-N 3.17Å; W59-S63 VanDerWaalsContact CE2-OG 3.31Å; W59-S63 PolarHBondContact NE1-OG 3.25Å; W59-S63 WeakPolarHBondContact O-CB 3.49Å; W59-S63 PolarHBondContact O-N 3.27Å; W59-S63 PolarHBondContact O-OG 2.88Å; W59-S63 VanDerWaalsContact O-OG 3.05Å; W59-V86 HydrophobicContact CB-CG1 3.84Å; W59-E87 VanDerWaalsContact CD1-CG 3.4Å; W59-E87 VanDerWaalsContact NE1-CG 3.34Å; W59-E87 PolarHBondContact NE1-OE1 3.01Å; W59-E131 VanDerWaalsContact CH2-O 3.3Å; W59-E131 WeakPolarHBondContact CH2-O 3.46Å; W59-E131 HydrophobicContact CZ3-CB 4.36Å; W59-V132 HydrophobicContact CD2-CG1 3.84Å; W59-V132 HydrophobicContact CE3-CG1 4.32Å; W59-V132 HydrophobicContact CG-CG1 4.2Å; W59-V132 HydrophobicContact CH2-CG1 4.41Å; W59-V132 HydrophobicContact CZ2-CG1 3.95Å
60R96.8Very high94.6Very high96 Ų9661.3 Ų61.336%0.36233%0.33SS..Hα-helixtrans-55.3-43.9177.9-76.2-173.8177.282.113.8112.6R56 S57 S64 E131R56-R60 WeakPolarHBondContact O-CG 3.36Å; R56-R60 PolarHBondContact O-N 2.98Å; S57-R60 PolarHBondContact O-N 3.48Å; R60-S64 WeakPolarHBondContact O-CB 3.39Å; R60-S64 PolarHBondContact O-N 3.32Å; R60-E131 IonicContact CZ-OE2 2.67Å; R60-E131 IonicContact NH1-OE2 3.91Å; R60-E131 IonicContact NH2-OE1 2.86Å; R60-E131 IonicContact NH2-OE2 3.33Å; R60-E131 PolarHBondContact NH2-OE2 2.97Å
61V97.5Very high93.7Very high88 Ų8860.5 Ų60.553%0.53333%0.327SS..Hα-helixtrans-64.1-47.7178.8171.90000110.7S57 A58 W59 S64 I65S57-V61 WeakPolarHBondContact O-CG2 3.09Å; S57-V61 PolarHBondContact O-N 3.25Å; S57-V61 VanDerWaalsContact O-N 3.17Å; A58-V61 PolarHBondContact O-N 3.49Å; W59-V61 VanDerWaalsContact C-N 3.29Å; W59-V61 PolarHBondContact O-N 3.45Å; V61-S64 PolarHBondContact O-N 3.42Å; V61-I65 HydrophobicContact CG1-CD1 3.94Å; V61-I65 WeakPolarHBondContact O-CG1 3.38Å; V61-I65 PolarHBondContact O-N 3.31Å
62I96.6Very high93.1Very high15 Ų1563.9 Ų63.98%0.07735%0.351CS..Hα-helixtrans-65.9-44.1-178.2-60.9157.1000110.7A58 W59 S64 I65 E66 I79 Y82 R83 V86A58-I62 VanDerWaalsContact O-CD1 3.31Å; A58-I62 WeakPolarHBondContact O-CD1 3.26Å; A58-I62 WeakPolarHBondContact O-CG1 3.31Å; A58-I62 PolarHBondContact O-N 3.41Å; W59-I62 PolarHBondContact O-N 3.24Å; W59-I62 VanDerWaalsContact O-N 3.17Å; I62-S64 VanDerWaalsContact C-N 3.3Å; I62-S64 PolarHBondContact O-N 2.88Å; I62-I65 WeakPolarHBondContact O-CB 3.43Å; I62-I65 PolarHBondContact O-N 2.84Å; I62-I65 VanDerWaalsContact O-N 3.11Å; I62-E66 PolarHBondContact O-N 3.36Å; I62-I79 HydrophobicContact CG2-CG2 4.08Å; I62-Y82 HydrophobicContact CD1-CD1 3.4Å; I62-Y82 VanDerWaalsContact CD1-CD1 3.4Å; I62-Y82 HydrophobicContact CD1-CE1 3.5Å; I62-Y82 HydrophobicContact CD1-CG 4.5Å; I62-Y82 HydrophobicContact CG1-CD1 3.97Å; I62-Y82 HydrophobicContact CG1-CE1 4.22Å; I62-R83 HydrophobicContact CG2-CB 3.74Å; I62-R83 HydrophobicContact CG2-CG 4.46Å; I62-V86 HydrophobicContact CD1-CB 4.43Å; I62-V86 HydrophobicContact CD1-CG2 3.66Å
63S94.9Very high92.7Very high14 Ų1470.7 Ų70.710%0.09839%0.387CS..Hα-helixtrans-60.6-39175.6-60.60000111.7W59 E66 Q67 R83W59-S63 VanDerWaalsContact CE2-OG 3.31Å; W59-S63 PolarHBondContact NE1-OG 3.25Å; W59-S63 WeakPolarHBondContact O-CB 3.49Å; W59-S63 PolarHBondContact O-N 3.27Å; W59-S63 PolarHBondContact O-OG 2.88Å; W59-S63 VanDerWaalsContact O-OG 3.05Å; S63-E66 PolarHBondContact O-N 2.98Å; S63-Q67 WeakPolarHBondContact O-CG 3.33Å; S63-Q67 PolarHBondContact O-N 2.97Å; S63-Q67 VanDerWaalsContact O-N 3.09Å; S63-R83 VanDerWaalsContact OG-CD 3.26Å; S63-R83 WeakPolarHBondContact OG-CD 3.37Å
64S95.3Very high92.4Very high38 Ų3878 Ų7827%0.26641%0.413SS..Hα-helixtrans-66.2-37.5174.3-168.20000112.4R60 V61 I62 K68R60-S64 WeakPolarHBondContact O-CB 3.39Å; R60-S64 PolarHBondContact O-N 3.32Å; V61-S64 PolarHBondContact O-N 3.42Å; I62-S64 VanDerWaalsContact C-N 3.3Å; I62-S64 PolarHBondContact O-N 2.88Å; S64-K68 WeakPolarHBondContact O-CB 3.39Å; S64-K68 WeakPolarHBondContact O-CG 3.49Å; S64-K68 PolarHBondContact O-N 3.46Å; S64-K68 PolarHBondContact OG-NZ 3.4Å
65I94.9Very high92.1Very high79 Ų7981.1 Ų81.141%0.40541%0.414SS..Hα-helixtrans-64-48.5174-68.4165.2000109.8V61 I62 Q67 K68 T69 I79V61-I65 HydrophobicContact CG1-CD1 3.94Å; V61-I65 WeakPolarHBondContact O-CG1 3.38Å; V61-I65 PolarHBondContact O-N 3.31Å; I62-I65 WeakPolarHBondContact O-CB 3.43Å; I62-I65 PolarHBondContact O-N 2.84Å; I62-I65 VanDerWaalsContact O-N 3.11Å; I65-Q67 VanDerWaalsContact C-N 3.29Å; I65-Q67 PolarHBondContact O-N 3.46Å; I65-K68 PolarHBondContact O-N 3.16Å; I65-T69 WeakPolarHBondContact O-CB 3.32Å; I65-T69 PolarHBondContact O-N 2.96Å; I65-T69 VanDerWaalsContact O-N 3.07Å; I65-T69 PolarHBondContact O-OG1 3.39Å; I65-I79 HydrophobicContact CG2-CD1 3.96Å; I65-I79 HydrophobicContact CG2-CG1 4.38Å; I65-I79 HydrophobicContact CG2-CG2 4.42Å
66E92.6Very high91.9Very high43 Ų4380.7 Ų80.720%0.20142%0.415CS..Hα-helixtrans-54.1-45.3178.4-166.6-178.4-16100111.7I62 S63 K68 M76 I79 R83I62-E66 PolarHBondContact O-N 3.36Å; S63-E66 PolarHBondContact O-N 2.98Å; E66-K68 PolarHBondContact O-N 3.45Å; E66-M76 HydrophobicContact CG-SD 3.93Å; E66-I79 HydrophobicContact CB-CG2 3.66Å; E66-I79 HydrophobicContact CG-CG2 4.08Å; E66-R83 IonicContact OE1-CZ 3.76Å; E66-R83 IonicContact OE1-NE 2.67Å; E66-R83 IonicContact OE1-NH2 3.33Å; E66-R83 PolarHBondContact OE1-NH2 3.47Å; E66-R83 VanDerWaalsContact OE2-CD 3.23Å; E66-R83 WeakPolarHBondContact OE2-CD 3.4Å; E66-R83 IonicContact OE2-CZ 4Å; E66-R83 IonicContact OE2-NE 3.9Å; E66-R83 PolarHBondContact OE2-NE 2.94Å; E66-R83 IonicContact OE2-NH2 3.57Å
67Q89.9Confident91.8Very high165 Ų16583.5 Ų83.577%0.77143%0.43SS*.Hα-helixtrans-68.1-33-179.9-71.6173.7-3.800114.3S63 I65S63-Q67 WeakPolarHBondContact O-CG 3.33Å; S63-Q67 PolarHBondContact O-N 2.97Å; S63-Q67 VanDerWaalsContact O-N 3.09Å; I65-Q67 VanDerWaalsContact C-N 3.29Å; I65-Q67 PolarHBondContact O-N 3.46Å
68K90.2Very high91.6Very high169 Ų16985.8 Ų85.874%0.73544%0.436SS*.Hα-helixtrans-92.8-8.9-175.7-69.4174.8179.9169.70113.8S64 I65 E66 D70S64-K68 WeakPolarHBondContact O-CB 3.39Å; S64-K68 WeakPolarHBondContact O-CG 3.49Å; S64-K68 PolarHBondContact O-N 3.46Å; S64-K68 PolarHBondContact OG-NZ 3.4Å; I65-K68 PolarHBondContact O-N 3.16Å; E66-K68 PolarHBondContact O-N 3.45Å; K68-D70 PolarHBondContact O-N 3.18Å
69T79.7Confident91.5Very high27 Ų2785 Ų8517%0.16643%0.426CS..  trans-91.9106.5-169.4-66.90000110.6I65 T71 M76 I79I65-T69 WeakPolarHBondContact O-CB 3.32Å; I65-T69 PolarHBondContact O-N 2.96Å; I65-T69 VanDerWaalsContact O-N 3.07Å; I65-T69 PolarHBondContact O-OG1 3.39Å; T69-T71 HydrophobicContact CG2-CG2 3.1Å; T69-T71 WeakPolarHBondContact CG2-OG1 3.11Å; T69-T71 PolarHBondContact O-N 3.5Å; T69-M76 HydrophobicContact CG2-CE 4.3Å; T69-M76 WeakPolarHBondContact O-CE 3.49Å; T69-I79 HydrophobicContact CG2-CD1 3.82Å
70D79.1Confident91.4Very high167 Ų16786.9 Ų86.989%0.89344%0.435SS*.  trans-92.385.2162.6-170.39.8000108.6K68K68-D70 PolarHBondContact O-N 3.18Å
71T78.9Confident91.4Very high45 Ų4586 Ų8628%0.27644%0.437SS..  trans-133.1168.9-178.172.50000111.7T69 K75T69-T71 HydrophobicContact CG2-CG2 3.1Å; T69-T71 WeakPolarHBondContact CG2-OG1 3.11Å; T69-T71 PolarHBondContact O-N 3.5Å; T71-K75 HydrophobicContact CG2-CD 3.89Å; T71-K75 WeakPolarHBondContact OG1-CB 3.35Å; T71-K75 WeakPolarHBondContact OG1-CG 3.46Å
72S86.2Confident91.4Very high78 Ų7888 Ų8855%0.54544%0.437SS..  trans-45.7142.8174.7640000112.9K74 K75 M76S72-K74 PolarHBondContact O-N 2.89Å; S72-K75 PolarHBondContact O-N 3.23Å; S72-M76 PolarHBondContact O-N 3.38Å; S72-M76 VanDerWaalsContact O-N 3.13Å
73D89.7Confident91.4Very high146 Ų14689.1 Ų89.178%0.78144%0.44SS*.Hα-helixtrans-46.2-38.2178.1-57.9-20.5000113.5K75 M76 Q77D73-K75 PolarHBondContact O-N 2.89Å; D73-M76 PolarHBondContact O-N 3.16Å; D73-Q77 WeakPolarHBondContact O-CB 3.1Å; D73-Q77 PolarHBondContact O-N 3.37Å
74K91.2Very high91.5Very high174 Ų17492.3 Ų92.376%0.75745%0.453SS*.Hα-helixtrans-62.6-43.2178-68.8-174.9179.2-179.90113.2S72 L78S72-K74 PolarHBondContact O-N 2.89Å; K74-L78 WeakPolarHBondContact O-CG 3.37Å; K74-L78 PolarHBondContact O-N 2.78Å
75K91.7Very high91.6Very high109 Ų10996 Ų9647%0.47446%0.464SS..Hα-helixtrans-73.6-37.1179.6178.4174.5172.4-171.20110.6T71 S72 D73 L78 I79T71-K75 HydrophobicContact CG2-CD 3.89Å; T71-K75 WeakPolarHBondContact OG1-CB 3.35Å; T71-K75 WeakPolarHBondContact OG1-CG 3.46Å; S72-K75 PolarHBondContact O-N 3.23Å; D73-K75 PolarHBondContact O-N 2.89Å; K75-L78 PolarHBondContact O-N 3.19Å; K75-I79 HydrophobicContact CG-CD1 4.17Å; K75-I79 WeakPolarHBondContact O-CG1 3.27Å; K75-I79 PolarHBondContact O-N 3.41Å; K75-I79 VanDerWaalsContact O-N 3.1Å
76M93.5Very high91.8Very high56 Ų5692.4 Ų92.428%0.27645%0.446SS..Hα-helixtrans-60.2-45.6173.3-173.756.473.200111.6E66 T69 S72 D73 L78 I79 K80E66-M76 HydrophobicContact CG-SD 3.93Å; T69-M76 HydrophobicContact CG2-CE 4.3Å; T69-M76 WeakPolarHBondContact O-CE 3.49Å; S72-M76 PolarHBondContact O-N 3.38Å; S72-M76 VanDerWaalsContact O-N 3.13Å; D73-M76 PolarHBondContact O-N 3.16Å; M76-L78 PolarHBondContact O-N 2.97Å; M76-I79 PolarHBondContact O-N 3.14Å; M76-K80 PolarHBondContact O-N 3.5Å
77Q94.5Very high92Very high93 Ų9391.4 Ų91.444%0.43544%0.442SS..Hα-helixtrans-60.1-43.1176.3-171.261.844.600112.3D73 I79 K80 D81D73-Q77 WeakPolarHBondContact O-CB 3.1Å; D73-Q77 PolarHBondContact O-N 3.37Å; Q77-I79 VanDerWaalsContact C-N 3.32Å; Q77-I79 PolarHBondContact O-N 2.84Å; Q77-K80 PolarHBondContact O-N 2.67Å; Q77-D81 PolarHBondContact NE2-OD1 3.24Å; Q77-D81 WeakPolarHBondContact O-CB 3.4Å; Q77-D81 PolarHBondContact O-N 3.2Å
78L95.3Very high92.4Very high121 Ų12186.7 Ų86.763%0.63443%0.427SS*.Hα-helixtrans-61.2-38.7176.7-72.5171.2000112.9K74 K75 M76 Y82K74-L78 WeakPolarHBondContact O-CG 3.37Å; K74-L78 PolarHBondContact O-N 2.78Å; K75-L78 PolarHBondContact O-N 3.19Å; M76-L78 PolarHBondContact O-N 2.97Å; L78-Y82 WeakPolarHBondContact O-CB 3.4Å; L78-Y82 PolarHBondContact O-N 2.86Å; L78-Y82 VanDerWaalsContact O-N 3.12Å
79I95.9Very high92.8Very high21 Ų2181.7 Ų81.711%0.10841%0.406CS..Hα-helixtrans-65.6-46.2176.8-67.5160.3000109.9I62 I65 E66 T69 K75 M76 Q77 Y82 R83I62-I79 HydrophobicContact CG2-CG2 4.08Å; I65-I79 HydrophobicContact CG2-CD1 3.96Å; I65-I79 HydrophobicContact CG2-CG1 4.38Å; I65-I79 HydrophobicContact CG2-CG2 4.42Å; E66-I79 HydrophobicContact CB-CG2 3.66Å; E66-I79 HydrophobicContact CG-CG2 4.08Å; T69-I79 HydrophobicContact CG2-CD1 3.82Å; K75-I79 HydrophobicContact CG-CD1 4.17Å; K75-I79 WeakPolarHBondContact O-CG1 3.27Å; K75-I79 PolarHBondContact O-N 3.41Å; K75-I79 VanDerWaalsContact O-N 3.1Å; M76-I79 PolarHBondContact O-N 3.14Å; Q77-I79 VanDerWaalsContact C-N 3.32Å; Q77-I79 PolarHBondContact O-N 2.84Å; I79-Y82 PolarHBondContact O-N 2.97Å; I79-R83 PolarHBondContact O-N 3.03Å
80K95.3Very high93.6Very high81 Ų8180.5 Ų80.535%0.35240%0.399SS..Hα-helixtrans-59.9-49.3177.7-177.2176.8176-179.60112M76 Q77 Y82 R83 E84M76-K80 PolarHBondContact O-N 3.5Å; Q77-K80 PolarHBondContact O-N 2.67Å; K80-Y82 VanDerWaalsContact C-N 3.25Å; K80-Y82 PolarHBondContact O-N 3.01Å; K80-R83 WeakPolarHBondContact O-CB 3.07Å; K80-R83 PolarHBondContact O-N 3.36Å; K80-R83 VanDerWaalsContact O-N 3.14Å; K80-E84 WeakPolarHBondContact CE-OE1 3.47Å; K80-E84 WeakPolarHBondContact O-CG 3.35Å; K80-E84 PolarHBondContact O-N 3.17Å
81D97Very high94.5Very high76 Ų7678.4 Ų78.441%0.40638%0.378SS..Hα-helixtrans-58.5-40.2178.4-67.1-14.9000111.2Q77 K85Q77-D81 PolarHBondContact NE2-OD1 3.24Å; Q77-D81 WeakPolarHBondContact O-CB 3.4Å; Q77-D81 PolarHBondContact O-N 3.2Å; D81-K85 PolarHBondContact O-N 3.47Å
82Y97.5Very high95.4Very high132 Ų13279.8 Ų79.852%0.51839%0.39SS..Hα-helixtrans-71.7-37.3178.2-163.5-116.4000112.5I62 L78 I79 K80 K85 V86I62-Y82 HydrophobicContact CD1-CD1 3.4Å; I62-Y82 VanDerWaalsContact CD1-CD1 3.4Å; I62-Y82 HydrophobicContact CD1-CE1 3.5Å; I62-Y82 HydrophobicContact CD1-CG 4.5Å; I62-Y82 HydrophobicContact CG1-CD1 3.97Å; I62-Y82 HydrophobicContact CG1-CE1 4.22Å; L78-Y82 WeakPolarHBondContact O-CB 3.4Å; L78-Y82 PolarHBondContact O-N 2.86Å; L78-Y82 VanDerWaalsContact O-N 3.12Å; I79-Y82 PolarHBondContact O-N 2.97Å; K80-Y82 VanDerWaalsContact C-N 3.25Å; K80-Y82 PolarHBondContact O-N 3.01Å; Y82-K85 HydrophobicContact CD2-CD 4.38Å; Y82-K85 HydrophobicContact CE2-CD 4.37Å; Y82-K85 WeakPolarHBondContact O-CB 3.49Å; Y82-K85 PolarHBondContact O-N 3.44Å; Y82-V86 WeakPolarHBondContact O-CG2 3.43Å; Y82-V86 PolarHBondContact O-N 3.3Å; Y82-V86 VanDerWaalsContact O-N 3.16Å
83R96.8Very high96Very high37 Ų3777.2 Ų77.214%0.1437%0.37CS..Hα-helixtrans-58.8-51.3171.6-176.7-179.251.171.54.3110.6I62 S63 E66 I79 K80 K85 V86 E87I62-R83 HydrophobicContact CG2-CB 3.74Å; I62-R83 HydrophobicContact CG2-CG 4.46Å; S63-R83 VanDerWaalsContact OG-CD 3.26Å; S63-R83 WeakPolarHBondContact OG-CD 3.37Å; E66-R83 IonicContact OE1-CZ 3.76Å; E66-R83 IonicContact OE1-NE 2.67Å; E66-R83 IonicContact OE1-NH2 3.33Å; E66-R83 PolarHBondContact OE1-NH2 3.47Å; E66-R83 VanDerWaalsContact OE2-CD 3.23Å; E66-R83 WeakPolarHBondContact OE2-CD 3.4Å; E66-R83 IonicContact OE2-CZ 4Å; E66-R83 IonicContact OE2-NE 3.9Å; E66-R83 PolarHBondContact OE2-NE 2.94Å; E66-R83 IonicContact OE2-NH2 3.57Å; I79-R83 PolarHBondContact O-N 3.03Å; K80-R83 WeakPolarHBondContact O-CB 3.07Å; K80-R83 PolarHBondContact O-N 3.36Å; K80-R83 VanDerWaalsContact O-N 3.14Å; R83-K85 VanDerWaalsContact C-N 3.27Å; R83-K85 PolarHBondContact O-N 3.48Å; R83-V86 PolarHBondContact O-N 3.49Å; R83-E87 HydrophobicContact CG-CG 4.44Å; R83-E87 IonicContact CZ-OE1 3.89Å; R83-E87 IonicContact NE-OE1 2.61Å; R83-E87 IonicContact NH1-OE1 3.36Å; R83-E87 PolarHBondContact NH1-OE1 3.23Å; R83-E87 IonicContact NH1-OE2 2.97Å; R83-E87 PolarHBondContact NH1-OE2 3.27Å; R83-E87 VanDerWaalsContact NH1-OE2 3.08Å; R83-E87 WeakPolarHBondContact O-CG 3.36Å; R83-E87 PolarHBondContact O-N 3.09Å
84E96.6Very high96.4Very high81 Ų8170.2 Ų70.238%0.37933%0.332SS..Hα-helixtrans-61.7-34.7-178.6-71.9177.8-176.200112.2K80 E87 S88K80-E84 WeakPolarHBondContact CE-OE1 3.47Å; K80-E84 WeakPolarHBondContact O-CG 3.35Å; K80-E84 PolarHBondContact O-N 3.17Å; E84-E87 PolarHBondContact O-N 2.94Å; E84-S88 WeakPolarHBondContact O-CB 3.45Å; E84-S88 PolarHBondContact O-N 3.1Å
85K98Very high96.7Very high115 Ų11565 Ų6550%0.532%0.315SS..Hα-helixtrans-60-49.8170.8-177.8-174.3174.4-170.30111.7D81 Y82 R83 E87 S88 E89D81-K85 PolarHBondContact O-N 3.47Å; Y82-K85 HydrophobicContact CD2-CD 4.38Å; Y82-K85 HydrophobicContact CE2-CD 4.37Å; Y82-K85 WeakPolarHBondContact O-CB 3.49Å; Y82-K85 PolarHBondContact O-N 3.44Å; R83-K85 VanDerWaalsContact C-N 3.27Å; R83-K85 PolarHBondContact O-N 3.48Å; K85-E87 VanDerWaalsContact C-N 3.31Å; K85-E87 PolarHBondContact O-N 3.27Å; K85-S88 WeakPolarHBondContact O-CB 3.5Å; K85-S88 PolarHBondContact O-N 3.12Å; K85-S88 VanDerWaalsContact O-N 3.17Å; K85-E89 VanDerWaalsContact CE-OE1 3.32Å; K85-E89 WeakPolarHBondContact CE-OE1 3.45Å; K85-E89 PolarHBondContact O-N 3.37Å
86V98Very high97.1Very high5 Ų561.4 Ų61.43%0.0330%0.302CS..Hα-helixtrans-64.1-37.8179.4177.80000111.1R55 A58 W59 I62 Y82 R83 S88 E89 L90R55-V86 HydrophobicContact CB-CG1 4.35Å; R55-V86 HydrophobicContact CG-CG1 4.49Å; R55-V86 WeakPolarHBondContact O-CG1 3.35Å; A58-V86 HydrophobicContact CB-CG1 4.19Å; W59-V86 HydrophobicContact CB-CG1 3.84Å; I62-V86 HydrophobicContact CD1-CB 4.43Å; I62-V86 HydrophobicContact CD1-CG2 3.66Å; Y82-V86 WeakPolarHBondContact O-CG2 3.43Å; Y82-V86 PolarHBondContact O-N 3.3Å; Y82-V86 VanDerWaalsContact O-N 3.16Å; R83-V86 PolarHBondContact O-N 3.49Å; V86-S88 VanDerWaalsContact C-N 3.33Å; V86-S88 PolarHBondContact O-N 3.14Å; V86-E89 PolarHBondContact O-N 3.01Å; V86-L90 WeakPolarHBondContact O-CB 3.49Å; V86-L90 PolarHBondContact O-N 3.36Å
87E97.5Very high97.3Very high21 Ų2158.9 Ų58.910%0.09829%0.29CS..Hα-helixtrans-62.8-39173.4-69.5174176.500112.4W59 R83 E84 K85 L90 R91 V132W59-E87 VanDerWaalsContact CD1-CG 3.4Å; W59-E87 VanDerWaalsContact NE1-CG 3.34Å; W59-E87 PolarHBondContact NE1-OE1 3.01Å; R83-E87 HydrophobicContact CG-CG 4.44Å; R83-E87 IonicContact CZ-OE1 3.89Å; R83-E87 IonicContact NE-OE1 2.61Å; R83-E87 IonicContact NH1-OE1 3.36Å; R83-E87 PolarHBondContact NH1-OE1 3.23Å; R83-E87 IonicContact NH1-OE2 2.97Å; R83-E87 PolarHBondContact NH1-OE2 3.27Å; R83-E87 VanDerWaalsContact NH1-OE2 3.08Å; R83-E87 WeakPolarHBondContact O-CG 3.36Å; R83-E87 PolarHBondContact O-N 3.09Å; E84-E87 PolarHBondContact O-N 2.94Å; K85-E87 VanDerWaalsContact C-N 3.31Å; K85-E87 PolarHBondContact O-N 3.27Å; E87-L90 PolarHBondContact O-N 3.42Å; E87-R91 WeakPolarHBondContact O-CB 3.46Å; E87-R91 VanDerWaalsContact O-CG 3.26Å; E87-R91 WeakPolarHBondContact O-CG 3.44Å; E87-R91 PolarHBondContact O-N 3.22Å; E87-R91 PolarHBondContact O-NE 3.39Å; E87-V132 HydrophobicContact CG-CB 4.06Å; E87-V132 HydrophobicContact CG-CG1 4.18Å
88S97.4Very high97.5Very high67 Ų6755.1 Ų55.147%0.46927%0.273SS..Hα-helixtrans-64.1-44.6175.2-176.90000111.7E84 K85 V86 R91 S92E84-S88 WeakPolarHBondContact O-CB 3.45Å; E84-S88 PolarHBondContact O-N 3.1Å; K85-S88 WeakPolarHBondContact O-CB 3.5Å; K85-S88 PolarHBondContact O-N 3.12Å; K85-S88 VanDerWaalsContact O-N 3.17Å; V86-S88 VanDerWaalsContact C-N 3.33Å; V86-S88 PolarHBondContact O-N 3.14Å; S88-R91 PolarHBondContact O-N 3.15Å; S88-S92 WeakPolarHBondContact O-CB 3.35Å; S88-S92 PolarHBondContact O-N 3.27Å
89E98Very high97.7Very high64 Ų6453.8 Ų53.830%0.29926%0.263SS..Hα-helixtrans-60.8-47.2174.8-69179.3-162.500111.4R55 K85 V86 R91 S92 I93R55-E89 HydrophobicContact CG-CB 4.08Å; R55-E89 IonicContact CZ-OE2 3.2Å; R55-E89 IonicContact NE-OE2 3.47Å; R55-E89 PolarHBondContact NE-OE2 2.88Å; R55-E89 VanDerWaalsContact NE-OE2 3.11Å; R55-E89 IonicContact NH2-OE2 2.78Å; K85-E89 VanDerWaalsContact CE-OE1 3.32Å; K85-E89 WeakPolarHBondContact CE-OE1 3.45Å; K85-E89 PolarHBondContact O-N 3.37Å; V86-E89 PolarHBondContact O-N 3.01Å; E89-R91 PolarHBondContact O-N 3.46Å; E89-S92 WeakPolarHBondContact O-CB 3.47Å; E89-S92 PolarHBondContact O-N 2.7Å; E89-I93 WeakPolarHBondContact O-CD1 3.19Å; E89-I93 VanDerWaalsContact O-CG1 3.31Å; E89-I93 WeakPolarHBondContact O-CG1 2.93Å; E89-I93 PolarHBondContact O-N 3.23Å
90L97.7Very high97.8Very high1 Ų153 Ų531%0.00526%0.259CS..Hα-helixtrans-60.2-45.8178.2-176.8135.4000111.7V52 R55 R56 V86 E87 S92 I93 C94 V132V52-L90 HydrophobicContact CG2-CD1 4.38Å; V52-L90 HydrophobicContact CG2-CG 4.43Å; R55-L90 HydrophobicContact CB-CB 4.23Å; R55-L90 HydrophobicContact CB-CD1 4.24Å; R56-L90 HydrophobicContact CB-CD1 4.3Å; R56-L90 HydrophobicContact CG-CD1 3.35Å; V86-L90 WeakPolarHBondContact O-CB 3.49Å; V86-L90 PolarHBondContact O-N 3.36Å; E87-L90 PolarHBondContact O-N 3.42Å; L90-S92 PolarHBondContact O-N 3.15Å; L90-I93 PolarHBondContact O-N 3.34Å; L90-C94 PolarHBondContact O-N 2.99Å; L90-C94 PolarHBondContact O-SG 3.16Å; L90-V132 HydrophobicContact CD2-CG1 4.01Å; L90-V132 HydrophobicContact CD2-CG2 3.67Å
91R97.6Very high98Very high124 Ų12449.1 Ų49.147%0.46824%0.243SC..Hα-helixtrans-58.4-47.9175-78.1-175.1-73171.4-5.9111.1E87 S88 E89 I93 C94 T95 L129 V132E87-R91 WeakPolarHBondContact O-CB 3.46Å; E87-R91 VanDerWaalsContact O-CG 3.26Å; E87-R91 WeakPolarHBondContact O-CG 3.44Å; E87-R91 PolarHBondContact O-N 3.22Å; E87-R91 PolarHBondContact O-NE 3.39Å; S88-R91 PolarHBondContact O-N 3.15Å; E89-R91 PolarHBondContact O-N 3.46Å; R91-I93 VanDerWaalsContact C-N 3.33Å; R91-I93 PolarHBondContact O-N 3.1Å; R91-C94 PolarHBondContact O-N 3.21Å; R91-T95 WeakPolarHBondContact O-CB 3.47Å; R91-T95 PolarHBondContact O-N 3.35Å; R91-T95 PolarHBondContact O-OG1 3.26Å; R91-L129 HydrophobicContact CB-CD2 4.22Å; R91-L129 HydrophobicContact CG-CD2 3.75Å; R91-V132 HydrophobicContact CG-CG2 4.37Å
92S98.1Very high98Very high74 Ų7449 Ų4952%0.51724%0.242SC..Hα-helixtrans-59-42.4178.7-174.10000112.7S88 E89 L90 T96S88-S92 WeakPolarHBondContact O-CB 3.35Å; S88-S92 PolarHBondContact O-N 3.27Å; E89-S92 WeakPolarHBondContact O-CB 3.47Å; E89-S92 PolarHBondContact O-N 2.7Å; L90-S92 PolarHBondContact O-N 3.15Å; S92-T96 WeakPolarHBondContact O-CB 3.23Å; S92-T96 PolarHBondContact O-N 3.04Å; S92-T96 VanDerWaalsContact O-N 3.07Å; S92-T96 PolarHBondContact O-OG1 2.97Å
93I98.4Very high98.1Very high23 Ų2348.3 Ų48.312%0.11824%0.242CC..Hα-helixtrans-64.5-48.9177.2-66.8155.3000109.9Y48 V51 V52 R55 E89 L90 R91 T96 V97Y48-I93 HydrophobicContact CD1-CG2 4.19Å; V51-I93 HydrophobicContact CG1-CD1 3.66Å; V51-I93 HydrophobicContact CG1-CG1 3.99Å; V51-I93 HydrophobicContact CG1-CG2 4.13Å; V52-I93 HydrophobicContact CB-CG2 4.11Å; V52-I93 HydrophobicContact CG2-CG2 4.38Å; R55-I93 HydrophobicContact CG-CD1 3.97Å; E89-I93 WeakPolarHBondContact O-CD1 3.19Å; E89-I93 VanDerWaalsContact O-CG1 3.31Å; E89-I93 WeakPolarHBondContact O-CG1 2.93Å; E89-I93 PolarHBondContact O-N 3.23Å; L90-I93 PolarHBondContact O-N 3.34Å; R91-I93 VanDerWaalsContact C-N 3.33Å; R91-I93 PolarHBondContact O-N 3.1Å; I93-T96 WeakPolarHBondContact O-CB 3.45Å; I93-T96 PolarHBondContact O-N 2.85Å; I93-V97 WeakPolarHBondContact O-CG2 3.29Å; I93-V97 PolarHBondContact O-N 3.41Å
94C98.4Very high98.1Very high0 Ų049.8 Ų49.80%025%0.248CC..Hα-helixtrans-63.7-45.2-178.4-62.20000112L90 R91 T96 V97 L98 Y125 L129L90-C94 PolarHBondContact O-N 2.99Å; L90-C94 PolarHBondContact O-SG 3.16Å; R91-C94 PolarHBondContact O-N 3.21Å; C94-T96 VanDerWaalsContact C-N 3.31Å; C94-T96 PolarHBondContact O-N 3.24Å; C94-V97 PolarHBondContact O-N 2.99Å; C94-L98 WeakPolarHBondContact O-CB 3.39Å; C94-L98 VanDerWaalsContact O-CG 3.23Å; C94-L98 WeakPolarHBondContact O-CG 3.38Å; C94-L98 PolarHBondContact O-N 3.19Å; C94-Y125 HydrophobicContact CB-CD1 4.05Å; C94-L129 HydrophobicContact CB-CD1 3.89Å; C94-L129 HydrophobicContact CB-CD2 3.64Å; C94-L129 HydrophobicContact CB-CG 3.57Å
95T98.1Very high98.2Very high65 Ų6546.3 Ų46.340%0.39923%0.231SC..Hα-helixtrans-58.6-43.3175.5-59.90000111.3R91 V97 L98 E99R91-T95 WeakPolarHBondContact O-CB 3.47Å; R91-T95 PolarHBondContact O-N 3.35Å; R91-T95 PolarHBondContact O-OG1 3.26Å; T95-V97 VanDerWaalsContact C-N 3.33Å; T95-V97 PolarHBondContact O-N 2.84Å; T95-L98 PolarHBondContact O-N 3.07Å; T95-E99 WeakPolarHBondContact O-CB 3.17Å; T95-E99 WeakPolarHBondContact O-CG 3.09Å; T95-E99 PolarHBondContact O-N 3.39Å
96T98.5Very high98.2Very high33 Ų3342.3 Ų42.320%0.20222%0.215CC..Hα-helixtrans-58-46.8176-61.50000111.4K27 Y48 S92 I93 C94 E99 L100K27-T96 HydrophobicContact CD-CG2 3.98Å; Y48-T96 HydrophobicContact CE1-CG2 4.48Å; S92-T96 WeakPolarHBondContact O-CB 3.23Å; S92-T96 PolarHBondContact O-N 3.04Å; S92-T96 VanDerWaalsContact O-N 3.07Å; S92-T96 PolarHBondContact O-OG1 2.97Å; I93-T96 WeakPolarHBondContact O-CB 3.45Å; I93-T96 PolarHBondContact O-N 2.85Å; C94-T96 VanDerWaalsContact C-N 3.31Å; C94-T96 PolarHBondContact O-N 3.24Å; T96-E99 PolarHBondContact O-N 3.45Å; T96-L100 HydrophobicContact CG2-CD1 4.32Å; T96-L100 WeakPolarHBondContact O-CG 3.19Å; T96-L100 PolarHBondContact O-N 2.94Å
97V98.7Very high98.2Very high2 Ų245.3 Ų45.31%0.01224%0.24CC..Hα-helixtrans-66.3-44.5-179.9172.30000111.7Y48 I93 C94 T95 E99 L100 L101 M121 Y125Y48-V97 HydrophobicContact CD1-CG2 3.27Å; Y48-V97 HydrophobicContact CD2-CG2 3.92Å; Y48-V97 HydrophobicContact CE1-CG2 3.59Å; Y48-V97 HydrophobicContact CE2-CG2 4.2Å; Y48-V97 HydrophobicContact CG-CG2 3.44Å; Y48-V97 VanDerWaalsContact CG-CG2 3.44Å; I93-V97 WeakPolarHBondContact O-CG2 3.29Å; I93-V97 PolarHBondContact O-N 3.41Å; C94-V97 PolarHBondContact O-N 2.99Å; T95-V97 VanDerWaalsContact C-N 3.33Å; T95-V97 PolarHBondContact O-N 2.84Å; V97-E99 VanDerWaalsContact C-N 3.29Å; V97-E99 PolarHBondContact O-N 3.26Å; V97-L100 PolarHBondContact O-N 2.76Å; V97-L100 VanDerWaalsContact O-N 3.15Å; V97-L101 HydrophobicContact CG1-CD1 3.7Å; V97-L101 HydrophobicContact CG1-CG 4.18Å; V97-L101 WeakPolarHBondContact O-CB 3.42Å; V97-L101 VanDerWaalsContact O-CG 3.27Å; V97-L101 WeakPolarHBondContact O-CG 3.41Å; V97-L101 PolarHBondContact O-N 3.47Å; V97-M121 HydrophobicContact CG1-CE 3.7Å; V97-Y125 HydrophobicContact CB-CD1 3.9Å; V97-Y125 HydrophobicContact CB-CD2 4.31Å; V97-Y125 HydrophobicContact CB-CE1 3.93Å; V97-Y125 HydrophobicContact CB-CE2 4.41Å; V97-Y125 HydrophobicContact CB-CG 4.1Å; V97-Y125 HydrophobicContact CG1-CD1 4Å; V97-Y125 HydrophobicContact CG1-CD2 3.5Å; V97-Y125 VanDerWaalsContact CG1-CD2 3.5Å; V97-Y125 HydrophobicContact CG1-CE1 4.02Å; V97-Y125 HydrophobicContact CG1-CE2 3.6Å; V97-Y125 HydrophobicContact CG1-CG 3.74Å; V97-Y125 HydrophobicContact CG2-CD1 4.17Å; V97-Y125 HydrophobicContact CG2-CE1 3.7Å
98L98.7Very high98.1Very high14 Ų1447.2 Ų47.27%0.07325%0.251CS..Hα-helixtrans-60.1-40.4178-69.7169.7000111.5C94 T95 L101 D102 K122 F126 L129C94-L98 WeakPolarHBondContact O-CB 3.39Å; C94-L98 VanDerWaalsContact O-CG 3.23Å; C94-L98 WeakPolarHBondContact O-CG 3.38Å; C94-L98 PolarHBondContact O-N 3.19Å; T95-L98 PolarHBondContact O-N 3.07Å; L98-L101 PolarHBondContact O-N 3.17Å; L98-D102 WeakPolarHBondContact O-CB 3.33Å; L98-D102 PolarHBondContact O-N 3.43Å; L98-K122 HydrophobicContact CD2-CG 3.82Å; L98-F126 HydrophobicContact CD1-CD1 3.84Å; L98-F126 HydrophobicContact CD1-CE1 3.55Å; L98-F126 HydrophobicContact CD1-CE2 4.33Å; L98-F126 HydrophobicContact CD1-CG 4.35Å; L98-F126 HydrophobicContact CD1-CZ 3.82Å; L98-F126 HydrophobicContact CD2-CD1 4.46Å; L98-F126 HydrophobicContact CD2-CD2 3.77Å; L98-F126 HydrophobicContact CD2-CE1 4.32Å; L98-F126 HydrophobicContact CD2-CE2 3.58Å; L98-F126 HydrophobicContact CD2-CG 4.21Å; L98-F126 HydrophobicContact CD2-CZ 3.88Å; L98-F126 HydrophobicContact CG-CZ 4.41Å; L98-L129 HydrophobicContact CD1-CD1 3.62Å
99E98.5Very high98Very high94 Ų9445.1 Ų45.144%0.43924%0.238SC..Hα-helixtrans-64.9-40.8174.1-74.8-172.8-147.700113T95 T96 V97 L101 K103T95-E99 WeakPolarHBondContact O-CB 3.17Å; T95-E99 WeakPolarHBondContact O-CG 3.09Å; T95-E99 PolarHBondContact O-N 3.39Å; T96-E99 PolarHBondContact O-N 3.45Å; V97-E99 VanDerWaalsContact C-N 3.29Å; V97-E99 PolarHBondContact O-N 3.26Å; E99-L101 VanDerWaalsContact C-N 3.32Å; E99-K103 VanDerWaalsContact O-CB 3.26Å; E99-K103 WeakPolarHBondContact O-CB 3.41Å; E99-K103 WeakPolarHBondContact O-CG 3.48Å; E99-K103 PolarHBondContact O-N 3Å; E99-K103 IonicContact OE2-NZ 3.08Å; E99-K103 PolarHBondContact OE2-NZ 2.87Å
100L98.7Very high98Very high4 Ų447.5 Ų47.52%0.02126%0.257CS..Hα-helixtrans-63.6-42.2175.6-69.4172.7000111.4K27 T30 E31 Y48 T96 V97 Y104 L105K27-L100 HydrophobicContact CB-CD1 4.26Å; K27-L100 HydrophobicContact CG-CD1 4.07Å; K27-L100 HydrophobicContact CG-CD2 4.14Å; T30-L100 HydrophobicContact CG2-CB 4.23Å; T30-L100 HydrophobicContact CG2-CD2 3.96Å; E31-L100 HydrophobicContact CG-CD2 3.75Å; Y48-L100 HydrophobicContact CE2-CD1 3.94Å; T96-L100 HydrophobicContact CG2-CD1 4.32Å; T96-L100 WeakPolarHBondContact O-CG 3.19Å; T96-L100 PolarHBondContact O-N 2.94Å; V97-L100 PolarHBondContact O-N 2.76Å; V97-L100 VanDerWaalsContact O-N 3.15Å; L100-Y104 HydrophobicContact CD2-CD2 3.95Å; L100-Y104 HydrophobicContact CD2-CE2 4.17Å; L100-Y104 PolarHBondContact O-N 2.92Å; L100-L105 HydrophobicContact CB-CD1 4.45Å; L100-L105 PolarHBondContact O-N 3.14Å; L100-L105 VanDerWaalsContact O-N 3.17Å
101L98.7Very high97.9Very high0 Ų050 Ų500%027%0.271CS..Iπ-helixtrans-59.9-51.4177.2-73.1166.2000110.9V97 L98 E99 L105 I106 Y118 M121 K122V97-L101 HydrophobicContact CG1-CD1 3.7Å; V97-L101 HydrophobicContact CG1-CG 4.18Å; V97-L101 WeakPolarHBondContact O-CB 3.42Å; V97-L101 VanDerWaalsContact O-CG 3.27Å; V97-L101 WeakPolarHBondContact O-CG 3.41Å; V97-L101 PolarHBondContact O-N 3.47Å; L98-L101 PolarHBondContact O-N 3.17Å; E99-L101 VanDerWaalsContact C-N 3.32Å; L101-L105 HydrophobicContact CD2-CB 4.35Å; L101-L105 HydrophobicContact CD2-CD1 3.81Å; L101-L105 HydrophobicContact CG-CD1 4.31Å; L101-L105 PolarHBondContact O-N 3.31Å; L101-I106 HydrophobicContact CB-CD1 4.05Å; L101-I106 HydrophobicContact CB-CG1 4.43Å; L101-I106 WeakPolarHBondContact O-CB 3.25Å; L101-I106 WeakPolarHBondContact O-CG1 3.08Å; L101-I106 PolarHBondContact O-N 3.05Å; L101-Y118 HydrophobicContact CD2-CD1 3.93Å; L101-Y118 HydrophobicContact CD2-CG 4.2Å; L101-M121 HydrophobicContact CD1-CB 4.35Å; L101-M121 HydrophobicContact CD1-CG 4.18Å; L101-M121 HydrophobicContact CD2-CB 4.24Å; L101-M121 HydrophobicContact CD2-CG 4.36Å; L101-M121 HydrophobicContact CD2-SD 4.14Å; L101-K122 HydrophobicContact CD1-CB 3.96Å
102D98.4Very high97.9Very high73 Ų7346.6 Ų46.639%0.3926%0.264SS..Iπ-helixtrans-72.5-40.7-175.2-73.5-16.5000113L98 A107 K122L98-D102 WeakPolarHBondContact O-CB 3.33Å; L98-D102 PolarHBondContact O-N 3.43Å; D102-A107 WeakPolarHBondContact O-CB 3.37Å; D102-K122 WeakPolarHBondContact OD1-CE 3.33Å; D102-K122 IonicContact OD1-NZ 2.67Å; D102-K122 PolarHBondContact OD1-NZ 3.21Å; D102-K122 IonicContact OD2-NZ 3.7Å; D102-K122 PolarHBondContact OD2-NZ 2.82Å
103K98.2Very high97.8Very high118 Ų11845.6 Ų45.651%0.51325%0.251SS..Iπ-helixtrans-83.5-33-173.8-65.5173.7-176.4165.10113.8E99E99-K103 VanDerWaalsContact O-CB 3.26Å; E99-K103 WeakPolarHBondContact O-CB 3.41Å; E99-K103 WeakPolarHBondContact O-CG 3.48Å; E99-K103 PolarHBondContact O-N 3Å; E99-K103 IonicContact OE2-NZ 3.08Å; E99-K103 PolarHBondContact OE2-NZ 2.87Å
104Y98.4Very high97.8Very high68 Ų6844.6 Ų44.627%0.26725%0.246SC..Iπ-helixtrans-127.3-31.3-167.7-56.1-77.6000114.8T30 E31 L100 N108T30-Y104 HydrophobicContact CG2-CD2 4.41Å; T30-Y104 HydrophobicContact CG2-CG 4.34Å; E31-Y104 HydrophobicContact CB-CE2 4.42Å; E31-Y104 HydrophobicContact CG-CD2 4.42Å; E31-Y104 HydrophobicContact CG-CE2 3.79Å; L100-Y104 HydrophobicContact CD2-CD2 3.95Å; L100-Y104 HydrophobicContact CD2-CE2 4.17Å; L100-Y104 PolarHBondContact O-N 2.92Å; Y104-N108 VanDerWaalsContact O-CB 3.3Å; Y104-N108 WeakPolarHBondContact O-CB 3.42Å; Y104-N108 PolarHBondContact O-ND2 3.33Å
105L98.5Very high97.8Very high7 Ų747.9 Ų47.94%0.03726%0.26CS..Iπ-helixtrans-98.3-58.5-170.4-58.5166.9000112.1T30 L36 L44 L100 L101 A107 N108 A109 Y118T30-L105 HydrophobicContact CG2-CD1 4.11Å; T30-L105 HydrophobicContact CG2-CD2 3.65Å; T30-L105 HydrophobicContact CG2-CG 3.76Å; L36-L105 HydrophobicContact CD1-CD2 3.61Å; L36-L105 HydrophobicContact CG-CD2 3.88Å; L44-L105 HydrophobicContact CD2-CD1 3.43Å; L44-L105 VanDerWaalsContact CD2-CD1 3.43Å; L44-L105 HydrophobicContact CD2-CD2 4.26Å; L44-L105 HydrophobicContact CD2-CG 4.49Å; L100-L105 HydrophobicContact CB-CD1 4.45Å; L100-L105 PolarHBondContact O-N 3.14Å; L100-L105 VanDerWaalsContact O-N 3.17Å; L101-L105 HydrophobicContact CD2-CB 4.35Å; L101-L105 HydrophobicContact CD2-CD1 3.81Å; L101-L105 HydrophobicContact CG-CD1 4.31Å; L101-L105 PolarHBondContact O-N 3.31Å; L105-A107 VanDerWaalsContact C-N 3.33Å; L105-N108 PolarHBondContact O-N 3.48Å; L105-A109 WeakPolarHBondContact O-CB 3.39Å; L105-A109 PolarHBondContact O-N 3.33Å; L105-Y118 HydrophobicContact CB-CD1 3.82Å; L105-Y118 HydrophobicContact CB-CD2 3.81Å; L105-Y118 HydrophobicContact CB-CE1 3.88Å; L105-Y118 HydrophobicContact CB-CE2 3.9Å; L105-Y118 HydrophobicContact CB-CG 3.8Å; L105-Y118 HydrophobicContact CD1-CD1 4.1Å; L105-Y118 HydrophobicContact CD1-CE1 4.03Å; L105-Y118 HydrophobicContact CD2-CE1 3.9Å; L105-Y118 HydrophobicContact CD2-CE2 4.47Å; L105-Y118 HydrophobicContact CG-CD1 4.39Å; L105-Y118 HydrophobicContact CG-CE1 4.15Å
106I98.3Very high97.8Very high32 Ų3244.8 Ų44.816%0.16424%0.241CC..THydrogen-bonded Turntrans-65.6-41176.7-61.9170.8000109.7L101 N108 A109 L119 K122L101-I106 HydrophobicContact CB-CD1 4.05Å; L101-I106 HydrophobicContact CB-CG1 4.43Å; L101-I106 WeakPolarHBondContact O-CB 3.25Å; L101-I106 WeakPolarHBondContact O-CG1 3.08Å; L101-I106 PolarHBondContact O-N 3.05Å; I106-N108 VanDerWaalsContact C-N 3.27Å; I106-N108 PolarHBondContact O-N 2.97Å; I106-A109 PolarHBondContact O-N 3.21Å; I106-L119 HydrophobicContact CD1-CD2 4.01Å; I106-L119 HydrophobicContact CD1-CG 4.49Å; I106-K122 HydrophobicContact CD1-CB 4.28Å; I106-K122 HydrophobicContact CD1-CD 3.7Å
107A96.8Very high97.8Very high67 Ų6744.4 Ų44.455%0.55424%0.237SC*.THydrogen-bonded Turntrans-62.5-30.7179.300000113.8D102 L105D102-A107 WeakPolarHBondContact O-CB 3.37Å; L105-A107 VanDerWaalsContact C-N 3.33Å
108N95.3Very high97.8Very high62 Ų6244.4 Ų44.433%0.33224%0.237SC..THydrogen-bonded Turntrans-108.23.7-178-61.8-44.7000113.6G33 Y104 L105 I106 T110G33-N108 PolarHBondContact O-ND2 3.34Å; Y104-N108 VanDerWaalsContact O-CB 3.3Å; Y104-N108 WeakPolarHBondContact O-CB 3.42Å; Y104-N108 PolarHBondContact O-ND2 3.33Å; L105-N108 PolarHBondContact O-N 3.48Å; I106-N108 VanDerWaalsContact C-N 3.27Å; I106-N108 PolarHBondContact O-N 2.97Å; N108-T110 PolarHBondContact O-N 3.39Å
109A97.1Very high97.8Very high22 Ų2243.8 Ų43.818%0.18223%0.234CC..  trans-68.9116.4179.600000110.4E35 L105 I106 K115 Y118E35-A109 WeakPolarHBondContact OE1-CA 3.49Å; L105-A109 WeakPolarHBondContact O-CB 3.39Å; L105-A109 PolarHBondContact O-N 3.33Å; I106-A109 PolarHBondContact O-N 3.21Å; A109-K115 HydrophobicContact CB-CB 4.12Å; A109-Y118 HydrophobicContact CB-CD2 4.11Å; A109-Y118 HydrophobicContact CB-CE2 4.29Å
110T96.3Very high97.8Very high114 Ų11441.1 Ų41.170%0.69922%0.221SC*.  trans-93.3-19.6-17659.20000113.5E35 N108E35-T110 VanDerWaalsContact CD-OG1 3.27Å; E35-T110 PolarHBondContact OE1-N 3.48Å; E35-T110 PolarHBondContact OE1-OG1 3.03Å; E35-T110 VanDerWaalsContact OE1-OG1 3.1Å; E35-T110 WeakPolarHBondContact OE2-CB 3.34Å; E35-T110 WeakPolarHBondContact OE2-CG2 3.48Å; E35-T110 PolarHBondContact OE2-OG1 2.92Å; N108-T110 PolarHBondContact O-N 3.39Å
111N96Very high97.8Very high55 Ų5541.3 Ų41.329%0.29422%0.221SC..SBendtrans-120150.9-176.161.286.2000112.1E35 E113 S114 K115E35-N111 PolarHBondContact OE1-ND2 3.43Å; N111-E113 VanDerWaalsContact C-N 3.29Å; N111-E113 PolarHBondContact O-N 3.47Å; N111-E113 PolarHBondContact OD1-N 3.38Å; N111-S114 PolarHBondContact ND2-OG 3.45Å; N111-S114 PolarHBondContact O-N 2.97Å; N111-S114 VanDerWaalsContact OD1-CB 3.29Å; N111-S114 WeakPolarHBondContact OD1-CB 3.3Å; N111-S114 PolarHBondContact OD1-N 3.4Å; N111-S114 PolarHBondContact OD1-OG 2.97Å; N111-K115 PolarHBondContact O-N 2.85Å; N111-K115 VanDerWaalsContact O-N 3.11Å
112P97.2Very high97.8Very high51 Ų5143.3 Ų43.333%0.33123%0.23SC..Hα-helixtrans-57.1-39-179.8-27.435.3000113.8S114 K115 V116 I155 E159P112-S114 PolarHBondContact O-N 3.13Å; P112-K115 PolarHBondContact O-N 3.31Å; P112-V116 VanDerWaalsContact O-CG2 3.28Å; P112-V116 WeakPolarHBondContact O-CG2 3.32Å; P112-V116 PolarHBondContact O-N 3.14Å; P112-I155 HydrophobicContact CB-CG2 4.09Å; P112-E159 HydrophobicContact CB-CB 3.6Å; P112-E159 HydrophobicContact CB-CG 3.79Å; P112-E159 HydrophobicContact CG-CB 4.01Å; P112-E159 HydrophobicContact CG-CG 3.88Å
113E97.1Very high97.9Very high54 Ų5439.9 Ų39.925%0.25221%0.212SC..Hα-helixtrans-59.5-50.5-178.5-171.6-163.911900111.7R41 N111 K115 V116 F117 M160 H164 I166R41-E113 IonicContact CZ-OE1 3.21Å; R41-E113 IonicContact NH1-OE1 2.89Å; R41-E113 PolarHBondContact NH1-OE1 3.37Å; R41-E113 IonicContact NH2-OE1 3.98Å; R41-E113 PolarHBondContact NH2-OE1 2.89Å; N111-E113 VanDerWaalsContact C-N 3.29Å; N111-E113 PolarHBondContact O-N 3.47Å; N111-E113 PolarHBondContact OD1-N 3.38Å; E113-K115 VanDerWaalsContact C-N 3.34Å; E113-K115 PolarHBondContact O-N 3.17Å; E113-V116 PolarHBondContact O-N 3.1Å; E113-F117 WeakPolarHBondContact O-CB 3.28Å; E113-F117 PolarHBondContact O-N 2.61Å; E113-M160 HydrophobicContact CB-CE 4.13Å; E113-M160 HydrophobicContact CG-CE 3.84Å; E113-H164 IonicContact OE2-NE2 3.88Å; E113-I166 HydrophobicContact CG-CD1 3.39Å
114S97.8Very high97.9Very high1 Ų134.7 Ų34.71%0.00719%0.19CC..Hα-helixtrans-65-40.3178.6-620000111.2R41 N111 P112 F117 Y118R41-S114 PolarHBondContact NH1-OG 3.39Å; N111-S114 PolarHBondContact ND2-OG 3.45Å; N111-S114 PolarHBondContact O-N 2.97Å; N111-S114 VanDerWaalsContact OD1-CB 3.29Å; N111-S114 WeakPolarHBondContact OD1-CB 3.3Å; N111-S114 PolarHBondContact OD1-N 3.4Å; N111-S114 PolarHBondContact OD1-OG 2.97Å; P112-S114 PolarHBondContact O-N 3.13Å; S114-F117 WeakPolarHBondContact O-CB 3.38Å; S114-F117 PolarHBondContact O-N 3.09Å; S114-Y118 WeakPolarHBondContact O-CD2 3.28Å; S114-Y118 VanDerWaalsContact O-CG 3.31Å; S114-Y118 PolarHBondContact O-N 3.42Å
115K98.3Very high97.9Very high69 Ų6931.7 Ų31.730%0.318%0.178SC..Hα-helixtrans-61.8-46.9176.7-170.3169177.7-174.10111.9A109 N111 P112 E113 Y118 L119 E151 I155A109-K115 HydrophobicContact CB-CB 4.12Å; N111-K115 PolarHBondContact O-N 2.85Å; N111-K115 VanDerWaalsContact O-N 3.11Å; P112-K115 PolarHBondContact O-N 3.31Å; E113-K115 VanDerWaalsContact C-N 3.34Å; E113-K115 PolarHBondContact O-N 3.17Å; K115-Y118 PolarHBondContact O-N 3.24Å; K115-L119 HydrophobicContact CG-CD1 3.85Å; K115-L119 HydrophobicContact CG-CG 4.45Å; K115-L119 WeakPolarHBondContact O-CB 3.36Å; K115-L119 VanDerWaalsContact O-CG 3.31Å; K115-L119 WeakPolarHBondContact O-CG 3.33Å; K115-L119 PolarHBondContact O-N 2.86Å; K115-E151 VanDerWaalsContact CE-OE1 3.28Å; K115-E151 WeakPolarHBondContact CE-OE1 3.48Å; K115-E151 IonicContact NZ-OE1 3.12Å; K115-E151 PolarHBondContact NZ-OE1 2.93Å; K115-E151 VanDerWaalsContact NZ-OE1 3.12Å; K115-I155 HydrophobicContact CD-CD1 3.79Å; K115-I155 HydrophobicContact CG-CD1 4.02Å
116V98.7Very high97.9Very high0 Ų032.6 Ų32.60%018%0.181CC..Hα-helixtrans-62.9-42.4176174.90000110.9P112 E113 Y118 L119 K120 A152 I155 M160 I166 L170P112-V116 VanDerWaalsContact O-CG2 3.28Å; P112-V116 WeakPolarHBondContact O-CG2 3.32Å; P112-V116 PolarHBondContact O-N 3.14Å; E113-V116 PolarHBondContact O-N 3.1Å; V116-Y118 PolarHBondContact O-N 3.03Å; V116-L119 PolarHBondContact O-N 2.86Å; V116-K120 WeakPolarHBondContact O-CB 3.5Å; V116-K120 PolarHBondContact O-N 3.36Å; V116-A152 HydrophobicContact CG1-CB 4.35Å; V116-I155 HydrophobicContact CG2-CB 3.79Å; V116-I155 HydrophobicContact CG2-CG2 3.52Å; V116-M160 HydrophobicContact CB-SD 4.12Å; V116-M160 HydrophobicContact CG1-SD 4.04Å; V116-M160 HydrophobicContact CG2-SD 4Å; V116-I166 HydrophobicContact CB-CG2 4.26Å; V116-I166 HydrophobicContact CG1-CG2 3.68Å; V116-L170 HydrophobicContact CG1-CD2 4.06Å
117F98.5Very high97.9Very high26 Ų2631.7 Ų31.711%0.11418%0.176CC..Hα-helixtrans-57.7-49.1177.5-172.5-79.4000111.8R41 E113 S114 M121 I166R41-F117 VanDerWaalsContact CD-CD1 3.45Å; R41-F117 HydrophobicContact CG-CD1 3.57Å; R41-F117 HydrophobicContact CG-CE1 3.38Å; R41-F117 HydrophobicContact CG-CE2 4.36Å; R41-F117 HydrophobicContact CG-CG 4.15Å; R41-F117 HydrophobicContact CG-CZ 3.8Å; E113-F117 WeakPolarHBondContact O-CB 3.28Å; E113-F117 PolarHBondContact O-N 2.61Å; S114-F117 WeakPolarHBondContact O-CB 3.38Å; S114-F117 PolarHBondContact O-N 3.09Å; F117-M121 HydrophobicContact CE1-SD 4.49Å; F117-M121 WeakPolarHBondContact O-CB 3.26Å; F117-M121 PolarHBondContact O-N 2.94Å; F117-I166 HydrophobicContact CB-CD1 4.38Å; F117-I166 HydrophobicContact CD2-CD1 3.85Å; F117-I166 HydrophobicContact CD2-CG1 4.15Å
118Y98.8Very high98Very high2 Ų229.5 Ų29.51%0.00815%0.154CC..Hα-helixtrans-72-37.8-178.6-61.6-46.3000112.9R41 L101 L105 A109 S114 K115 V116 M121 K122R41-Y118 HydrophobicContact CG-CE1 3.68Å; L101-Y118 HydrophobicContact CD2-CD1 3.93Å; L101-Y118 HydrophobicContact CD2-CG 4.2Å; L105-Y118 HydrophobicContact CB-CD1 3.82Å; L105-Y118 HydrophobicContact CB-CD2 3.81Å; L105-Y118 HydrophobicContact CB-CE1 3.88Å; L105-Y118 HydrophobicContact CB-CE2 3.9Å; L105-Y118 HydrophobicContact CB-CG 3.8Å; L105-Y118 HydrophobicContact CD1-CD1 4.1Å; L105-Y118 HydrophobicContact CD1-CE1 4.03Å; L105-Y118 HydrophobicContact CD2-CE1 3.9Å; L105-Y118 HydrophobicContact CD2-CE2 4.47Å; L105-Y118 HydrophobicContact CG-CD1 4.39Å; L105-Y118 HydrophobicContact CG-CE1 4.15Å; A109-Y118 HydrophobicContact CB-CD2 4.11Å; A109-Y118 HydrophobicContact CB-CE2 4.29Å; S114-Y118 WeakPolarHBondContact O-CD2 3.28Å; S114-Y118 VanDerWaalsContact O-CG 3.31Å; S114-Y118 PolarHBondContact O-N 3.42Å; K115-Y118 PolarHBondContact O-N 3.24Å; V116-Y118 PolarHBondContact O-N 3.03Å; Y118-M121 WeakPolarHBondContact O-CB 3.32Å; Y118-M121 PolarHBondContact O-N 2.89Å; Y118-K122 WeakPolarHBondContact O-CB 3.39Å; Y118-K122 PolarHBondContact O-N 3.25Å
119L98.9Very high98.1Very high1 Ų127.5 Ų27.51%0.00514%0.143CC..Hα-helixtrans-66.8-41175.3-74168.2000112.1I106 K115 V116 M121 K122 G123 E151 A152 I155I106-L119 HydrophobicContact CD1-CD2 4.01Å; I106-L119 HydrophobicContact CD1-CG 4.49Å; K115-L119 HydrophobicContact CG-CD1 3.85Å; K115-L119 HydrophobicContact CG-CG 4.45Å; K115-L119 WeakPolarHBondContact O-CB 3.36Å; K115-L119 VanDerWaalsContact O-CG 3.31Å; K115-L119 WeakPolarHBondContact O-CG 3.33Å; K115-L119 PolarHBondContact O-N 2.86Å; V116-L119 PolarHBondContact O-N 2.86Å; L119-M121 VanDerWaalsContact C-N 3.3Å; L119-M121 PolarHBondContact O-N 2.78Å; L119-K122 WeakPolarHBondContact O-CB 3.27Å; L119-K122 PolarHBondContact O-N 2.99Å; L119-G123 PolarHBondContact O-N 3.39Å; L119-E151 HydrophobicContact CD1-CB 4.09Å; L119-E151 HydrophobicContact CD1-CG 3.71Å; L119-E151 HydrophobicContact CD2-CB 4.47Å; L119-E151 HydrophobicContact CD2-CG 4.47Å; L119-E151 WeakPolarHBondContact CD2-OE2 3.17Å; L119-A152 HydrophobicContact CB-CB 3.64Å; L119-I155 HydrophobicContact CD1-CD1 3.75Å
120K98.7Very high98.1Very high37 Ų3726.4 Ų26.416%0.16113%0.134CC..Hα-helixtrans-56-47.9170.4177.5-167.8168.3-670110.6V116 K122 G123 D124 G169 L170 N173V116-K120 WeakPolarHBondContact O-CB 3.5Å; V116-K120 PolarHBondContact O-N 3.36Å; K120-K122 VanDerWaalsContact C-N 3.34Å; K120-K122 PolarHBondContact O-N 2.84Å; K120-G123 PolarHBondContact O-N 3.4Å; K120-D124 IonicContact NZ-OD2 2.8Å; K120-D124 PolarHBondContact NZ-OD2 3.22Å; K120-D124 VanDerWaalsContact O-CG 3.28Å; K120-D124 PolarHBondContact O-N 2.98Å; K120-G169 WeakPolarHBondContact CE-O 3.39Å; K120-L170 HydrophobicContact CB-CD1 3.98Å; K120-L170 HydrophobicContact CD-CB 4.11Å; K120-L170 HydrophobicContact CG-CB 4.3Å; K120-L170 HydrophobicContact CG-CD1 3.96Å; K120-N173 WeakPolarHBondContact CE-ND2 3.12Å; K120-N173 PolarHBondContact NZ-ND2 2.99Å
121M98.6Very high98Very high8 Ų822 Ų224%0.03911%0.106CC..Hα-helixtrans-60.3-44.2176.9-168.1173.5173.700110.7V97 L101 F117 Y118 L119 G123 D124 Y125V97-M121 HydrophobicContact CG1-CE 3.7Å; L101-M121 HydrophobicContact CD1-CB 4.35Å; L101-M121 HydrophobicContact CD1-CG 4.18Å; L101-M121 HydrophobicContact CD2-CB 4.24Å; L101-M121 HydrophobicContact CD2-CG 4.36Å; L101-M121 HydrophobicContact CD2-SD 4.14Å; F117-M121 HydrophobicContact CE1-SD 4.49Å; F117-M121 WeakPolarHBondContact O-CB 3.26Å; F117-M121 PolarHBondContact O-N 2.94Å; Y118-M121 WeakPolarHBondContact O-CB 3.32Å; Y118-M121 PolarHBondContact O-N 2.89Å; L119-M121 VanDerWaalsContact C-N 3.3Å; L119-M121 PolarHBondContact O-N 2.78Å; M121-G123 VanDerWaalsContact C-N 3.34Å; M121-G123 PolarHBondContact O-N 2.56Å; M121-D124 WeakPolarHBondContact O-CA 3.32Å; M121-D124 WeakPolarHBondContact O-CB 3.49Å; M121-D124 PolarHBondContact O-N 3.36Å; M121-Y125 HydrophobicContact CE-CD2 4.47Å; M121-Y125 HydrophobicContact CE-CE2 3.65Å; M121-Y125 HydrophobicContact CG-CD2 3.82Å; M121-Y125 HydrophobicContact CG-CE2 3.64Å; M121-Y125 VanDerWaalsContact O-CD2 3.25Å; M121-Y125 WeakPolarHBondContact O-CD2 3.3Å; M121-Y125 PolarHBondContact O-N 3.41Å; M121-Y125 HydrophobicContact SD-CE2 4.5Å
122K98.8Very high97.9Very high43 Ų4320 Ų2019%0.18710%0.095CC..Hα-helixtrans-56.6-45.9175.3-173.9171.9179.21710112L98 L101 D102 I106 Y118 L119 K120 Y125 F126 A148L98-K122 HydrophobicContact CD2-CG 3.82Å; L101-K122 HydrophobicContact CD1-CB 3.96Å; D102-K122 WeakPolarHBondContact OD1-CE 3.33Å; D102-K122 IonicContact OD1-NZ 2.67Å; D102-K122 PolarHBondContact OD1-NZ 3.21Å; D102-K122 IonicContact OD2-NZ 3.7Å; D102-K122 PolarHBondContact OD2-NZ 2.82Å; I106-K122 HydrophobicContact CD1-CB 4.28Å; I106-K122 HydrophobicContact CD1-CD 3.7Å; Y118-K122 WeakPolarHBondContact O-CB 3.39Å; Y118-K122 PolarHBondContact O-N 3.25Å; L119-K122 WeakPolarHBondContact O-CB 3.27Å; L119-K122 PolarHBondContact O-N 2.99Å; K120-K122 VanDerWaalsContact C-N 3.34Å; K120-K122 PolarHBondContact O-N 2.84Å; K122-Y125 PolarHBondContact O-N 3.42Å; K122-F126 HydrophobicContact CD-CE2 4.32Å; K122-F126 HydrophobicContact CG-CD2 3.92Å; K122-F126 HydrophobicContact CG-CE2 3.75Å; K122-F126 WeakPolarHBondContact O-CD2 3.25Å; K122-F126 PolarHBondContact O-N 3.45Å; K122-A148 HydrophobicContact CB-CB 4.04Å; K122-A148 HydrophobicContact CD-CB 4.24Å; K122-A148 HydrophobicContact CG-CB 3.93Å
123G98.8Very high97.6Very high0 Ų018.3 Ų18.30%09%0.085CC..Hα-helixtrans-57.5-46.7172.300000112.2L119 K120 M121 Y125 F126 R127 S145 Y149L119-G123 PolarHBondContact O-N 3.39Å; K120-G123 PolarHBondContact O-N 3.4Å; M121-G123 VanDerWaalsContact C-N 3.34Å; M121-G123 PolarHBondContact O-N 2.56Å; G123-Y125 PolarHBondContact O-N 2.99Å; G123-F126 PolarHBondContact O-N 3.23Å; G123-R127 WeakPolarHBondContact O-CB 3.27Å; G123-R127 PolarHBondContact O-N 3.15Å; G123-S145 PolarHBondContact O-OG 3.06Å; G123-S145 VanDerWaalsContact O-OG 3.11Å; G123-Y149 VanDerWaalsContact C-CZ 3.41Å
124D98.8Very high97Very high9 Ų920.6 Ų20.65%0.04811%0.106CC..Hα-helixtrans-57.8-45.5177.7-68-35.5000112.6K120 M121 R127 Y128 Y149 N173K120-D124 IonicContact NZ-OD2 2.8Å; K120-D124 PolarHBondContact NZ-OD2 3.22Å; K120-D124 VanDerWaalsContact O-CG 3.28Å; K120-D124 PolarHBondContact O-N 2.98Å; M121-D124 WeakPolarHBondContact O-CA 3.32Å; M121-D124 WeakPolarHBondContact O-CB 3.49Å; M121-D124 PolarHBondContact O-N 3.36Å; D124-R127 WeakPolarHBondContact O-CB 3.32Å; D124-R127 PolarHBondContact O-N 3.39Å; D124-R127 IonicContact OD1-NH2 2.81Å; D124-Y128 HydrophobicContact CB-CE2 4.13Å; D124-Y128 WeakPolarHBondContact O-CD1 3.39Å; D124-Y128 WeakPolarHBondContact O-CD2 3.41Å; D124-Y128 WeakPolarHBondContact O-CE2 3.36Å; D124-Y128 PolarHBondContact O-N 3.16Å; D124-Y149 VanDerWaalsContact CA-OH 3.3Å; D124-Y149 WeakPolarHBondContact CA-OH 3.49Å; D124-Y149 PolarHBondContact N-OH 3.26Å; D124-Y149 PolarHBondContact OD1-OH 3.01Å; D124-N173 VanDerWaalsContact OD1-CB 3.32Å; D124-N173 WeakPolarHBondContact OD1-CB 3.42Å; D124-N173 PolarHBondContact OD1-ND2 3.33Å; D124-N173 PolarHBondContact OD2-ND2 2.91Å
125Y98.7Very high96.4Very high6 Ų623.4 Ų23.42%0.02414%0.136CC..Hα-helixtrans-73.3-34.1-178.4-79.9-87.8000113.3Y48 K49 V52 C94 V97 M121 K122 G123 Y128 L129Y48-Y125 WeakPolarHBondContact CB-OH 3.45Å; Y48-Y125 PolarHBondContact O-OH 3.43Å; K49-Y125 PolarHBondContact N-OH 3.17Å; V52-Y125 HydrophobicContact CB-CE1 4.09Å; V52-Y125 HydrophobicContact CG1-CE1 4Å; V52-Y125 HydrophobicContact CG2-CE1 4.23Å; C94-Y125 HydrophobicContact CB-CD1 4.05Å; V97-Y125 HydrophobicContact CB-CD1 3.9Å; V97-Y125 HydrophobicContact CB-CD2 4.31Å; V97-Y125 HydrophobicContact CB-CE1 3.93Å; V97-Y125 HydrophobicContact CB-CE2 4.41Å; V97-Y125 HydrophobicContact CB-CG 4.1Å; V97-Y125 HydrophobicContact CG1-CD1 4Å; V97-Y125 HydrophobicContact CG1-CD2 3.5Å; V97-Y125 VanDerWaalsContact CG1-CD2 3.5Å; V97-Y125 HydrophobicContact CG1-CE1 4.02Å; V97-Y125 HydrophobicContact CG1-CE2 3.6Å; V97-Y125 HydrophobicContact CG1-CG 3.74Å; V97-Y125 HydrophobicContact CG2-CD1 4.17Å; V97-Y125 HydrophobicContact CG2-CE1 3.7Å; M121-Y125 HydrophobicContact CE-CD2 4.47Å; M121-Y125 HydrophobicContact CE-CE2 3.65Å; M121-Y125 HydrophobicContact CG-CD2 3.82Å; M121-Y125 HydrophobicContact CG-CE2 3.64Å; M121-Y125 VanDerWaalsContact O-CD2 3.25Å; M121-Y125 WeakPolarHBondContact O-CD2 3.3Å; M121-Y125 PolarHBondContact O-N 3.41Å; M121-Y125 HydrophobicContact SD-CE2 4.5Å; K122-Y125 PolarHBondContact O-N 3.42Å; G123-Y125 PolarHBondContact O-N 2.99Å; Y125-Y128 HydrophobicContact CD1-CD2 4.07Å; Y125-Y128 HydrophobicContact CE1-CD2 4.33Å; Y125-Y128 HydrophobicContact CE1-CE2 4.5Å; Y125-Y128 HydrophobicContact CG-CD2 4.31Å; Y125-Y128 PolarHBondContact O-N 3.08Å; Y125-L129 WeakPolarHBondContact O-CG 3.41Å; Y125-L129 PolarHBondContact O-N 3.03Å; Y125-L129 VanDerWaalsContact O-N 3.09Å
126F98.7Very high95.7Very high25 Ų2526.9 Ų26.911%0.1116%0.157CC..Hα-helixtrans-67.1-39.5168.6-79-59.7000111.8L98 K122 G123 Y128 L129 A130 T141 N144L98-F126 HydrophobicContact CD1-CD1 3.84Å; L98-F126 HydrophobicContact CD1-CE1 3.55Å; L98-F126 HydrophobicContact CD1-CE2 4.33Å; L98-F126 HydrophobicContact CD1-CG 4.35Å; L98-F126 HydrophobicContact CD1-CZ 3.82Å; L98-F126 HydrophobicContact CD2-CD1 4.46Å; L98-F126 HydrophobicContact CD2-CD2 3.77Å; L98-F126 HydrophobicContact CD2-CE1 4.32Å; L98-F126 HydrophobicContact CD2-CE2 3.58Å; L98-F126 HydrophobicContact CD2-CG 4.21Å; L98-F126 HydrophobicContact CD2-CZ 3.88Å; L98-F126 HydrophobicContact CG-CZ 4.41Å; K122-F126 HydrophobicContact CD-CE2 4.32Å; K122-F126 HydrophobicContact CG-CD2 3.92Å; K122-F126 HydrophobicContact CG-CE2 3.75Å; K122-F126 WeakPolarHBondContact O-CD2 3.25Å; K122-F126 PolarHBondContact O-N 3.45Å; G123-F126 PolarHBondContact O-N 3.23Å; F126-Y128 VanDerWaalsContact C-N 3.31Å; F126-Y128 PolarHBondContact O-N 3.43Å; F126-L129 HydrophobicContact CD1-CD1 4.13Å; F126-L129 CarbonylContact O-C 3.42Å; F126-L129 WeakPolarHBondContact O-CB 3.35Å; F126-L129 PolarHBondContact O-N 3.33Å; F126-L129 VanDerWaalsContact O-N 3.13Å; F126-A130 PolarHBondContact O-N 3.18Å; F126-T141 HydrophobicContact CB-CG2 4.35Å; F126-T141 HydrophobicContact CD1-CG2 4.16Å; F126-T141 WeakPolarHBondContact O-CG2 3.44Å; F126-N144 HydrophobicContact CD1-CB 3.84Å; F126-N144 HydrophobicContact CD2-CB 3.73Å; F126-N144 HydrophobicContact CE1-CB 3.81Å; F126-N144 HydrophobicContact CE2-CB 3.69Å; F126-N144 HydrophobicContact CG-CB 3.8Å; F126-N144 HydrophobicContact CZ-CB 3.74Å
127R98.2Very high95.2Very high13 Ų1332.7 Ų32.75%0.04919%0.188CC..Hα-helixtrans-56.4-45.3172.6170.8165.773.8901.1112G123 D124 L129 A130 E131 S145 Y149 F177 E180 I181G123-R127 WeakPolarHBondContact O-CB 3.27Å; G123-R127 PolarHBondContact O-N 3.15Å; D124-R127 WeakPolarHBondContact O-CB 3.32Å; D124-R127 PolarHBondContact O-N 3.39Å; D124-R127 IonicContact OD1-NH2 2.81Å; R127-L129 VanDerWaalsContact C-N 3.3Å; R127-L129 PolarHBondContact O-N 2.93Å; R127-A130 WeakPolarHBondContact O-CB 3.5Å; R127-A130 PolarHBondContact O-N 3.01Å; R127-A130 VanDerWaalsContact O-N 3.1Å; R127-E131 PolarHBondContact O-N 2.9Å; R127-E131 VanDerWaalsContact O-N 3.17Å; R127-S145 PolarHBondContact N-OG 3.27Å; R127-Y149 PolarHBondContact NE-OH 2.86Å; R127-F177 HydrophobicContact CB-CD2 4.25Å; R127-F177 HydrophobicContact CG-CD2 4.33Å; R127-E180 IonicContact NH1-OE2 3.89Å; R127-E180 PolarHBondContact NH1-OE2 3.44Å; R127-I181 HydrophobicContact CG-CD1 4.07Å; R127-I181 HydrophobicContact CG-CG1 3.72Å
128Y98.1Very high95Very high22 Ų2235.7 Ų35.79%0.08620%0.199CC..Hα-helixtrans-63.2-36.4176.6-55.5-28.6000112.6V52 R56 D124 Y125 F126 E131V52-Y128 HydrophobicContact CG1-CD2 4Å; V52-Y128 HydrophobicContact CG1-CE2 3.84Å; V52-Y128 HydrophobicContact CG2-CD2 3.96Å; R56-Y128 VanDerWaalsContact NE-CD1 3.26Å; D124-Y128 HydrophobicContact CB-CE2 4.13Å; D124-Y128 WeakPolarHBondContact O-CD1 3.39Å; D124-Y128 WeakPolarHBondContact O-CD2 3.41Å; D124-Y128 WeakPolarHBondContact O-CE2 3.36Å; D124-Y128 PolarHBondContact O-N 3.16Å; Y125-Y128 HydrophobicContact CD1-CD2 4.07Å; Y125-Y128 HydrophobicContact CE1-CD2 4.33Å; Y125-Y128 HydrophobicContact CE1-CE2 4.5Å; Y125-Y128 HydrophobicContact CG-CD2 4.31Å; Y125-Y128 PolarHBondContact O-N 3.08Å; F126-Y128 VanDerWaalsContact C-N 3.31Å; F126-Y128 PolarHBondContact O-N 3.43Å; Y128-E131 WeakPolarHBondContact O-CB 3.37Å; Y128-E131 PolarHBondContact O-N 3.43Å
129L97.6Very high94.8Very high19 Ų1942 Ų4210%0.09923%0.226CC..Hα-helixtrans-65.7-38.9171.9-73.4173.4000111.7R91 C94 L98 Y125 F126 R127 E131 V132 A133 T141R91-L129 HydrophobicContact CB-CD2 4.22Å; R91-L129 HydrophobicContact CG-CD2 3.75Å; C94-L129 HydrophobicContact CB-CD1 3.89Å; C94-L129 HydrophobicContact CB-CD2 3.64Å; C94-L129 HydrophobicContact CB-CG 3.57Å; L98-L129 HydrophobicContact CD1-CD1 3.62Å; Y125-L129 WeakPolarHBondContact O-CG 3.41Å; Y125-L129 PolarHBondContact O-N 3.03Å; Y125-L129 VanDerWaalsContact O-N 3.09Å; F126-L129 HydrophobicContact CD1-CD1 4.13Å; F126-L129 CarbonylContact O-C 3.42Å; F126-L129 WeakPolarHBondContact O-CB 3.35Å; F126-L129 PolarHBondContact O-N 3.33Å; F126-L129 VanDerWaalsContact O-N 3.13Å; R127-L129 VanDerWaalsContact C-N 3.3Å; R127-L129 PolarHBondContact O-N 2.93Å; L129-E131 PolarHBondContact O-N 3.42Å; L129-V132 WeakPolarHBondContact O-CG2 3.38Å; L129-V132 PolarHBondContact O-N 2.93Å; L129-V132 VanDerWaalsContact O-N 3.14Å; L129-A133 VanDerWaalsContact O-CB 3.29Å; L129-A133 WeakPolarHBondContact O-CB 3.33Å; L129-A133 PolarHBondContact O-N 3.18Å; L129-T141 HydrophobicContact CB-CG2 3.52Å
130A96.7Very high94.6Very high0 Ų046.6 Ų46.60%025%0.248CC..Hα-helixtrans-64.5-29.6-179.900000112.4F126 R127 V132 R138 T141 I142 I181F126-A130 PolarHBondContact O-N 3.18Å; R127-A130 WeakPolarHBondContact O-CB 3.5Å; R127-A130 PolarHBondContact O-N 3.01Å; R127-A130 VanDerWaalsContact O-N 3.1Å; A130-V132 PolarHBondContact O-N 3.15Å; A130-R138 PolarHBondContact O-NH1 2.98Å; A130-R138 VanDerWaalsContact O-NH1 3.14Å; A130-T141 HydrophobicContact CB-CG2 3.88Å; A130-I142 HydrophobicContact CB-CG1 3.94Å; A130-I181 HydrophobicContact CB-CD1 4.39Å; A130-I181 HydrophobicContact CB-CG2 3.96Å
131E94.4Very high94.6Very high22 Ų2245.8 Ų45.810%0.10325%0.246CC..Hα-helixtrans-58.4-37.6174.1-70.6169.7-141.500112R56 W59 R60 R127 Y128 L129 I181R56-E131 IonicContact CZ-OE1 3.74Å; R56-E131 IonicContact CZ-OE2 3.53Å; R56-E131 IonicContact NE-OE1 2.76Å; R56-E131 PolarHBondContact NE-OE1 3.39Å; R56-E131 IonicContact NE-OE2 3.63Å; R56-E131 PolarHBondContact NE-OE2 3.37Å; R56-E131 VanDerWaalsContact NH2-CD 3.35Å; R56-E131 IonicContact NH2-OE1 3.36Å; R56-E131 PolarHBondContact NH2-OE1 2.7Å; R56-E131 IonicContact NH2-OE2 3.84Å; R56-E131 PolarHBondContact NH2-OE2 3.33Å; W59-E131 VanDerWaalsContact CH2-O 3.3Å; W59-E131 WeakPolarHBondContact CH2-O 3.46Å; W59-E131 HydrophobicContact CZ3-CB 4.36Å; R60-E131 IonicContact CZ-OE2 2.67Å; R60-E131 IonicContact NH1-OE2 3.91Å; R60-E131 IonicContact NH2-OE1 2.86Å; R60-E131 IonicContact NH2-OE2 3.33Å; R60-E131 PolarHBondContact NH2-OE2 2.97Å; R127-E131 PolarHBondContact O-N 2.9Å; R127-E131 VanDerWaalsContact O-N 3.17Å; Y128-E131 WeakPolarHBondContact O-CB 3.37Å; Y128-E131 PolarHBondContact O-N 3.43Å; L129-E131 PolarHBondContact O-N 3.42Å; E131-I181 HydrophobicContact CG-CD1 3.91Å
132V93.9Very high94.5Very high12 Ų1246.7 Ų46.77%0.07325%0.251CS..Hα-helixtrans-106.4-10.2-174.2-54.10000114.1W59 E87 L90 R91 L129 A130W59-V132 HydrophobicContact CD2-CG1 3.84Å; W59-V132 HydrophobicContact CE3-CG1 4.32Å; W59-V132 HydrophobicContact CG-CG1 4.2Å; W59-V132 HydrophobicContact CH2-CG1 4.41Å; W59-V132 HydrophobicContact CZ2-CG1 3.95Å; E87-V132 HydrophobicContact CG-CB 4.06Å; E87-V132 HydrophobicContact CG-CG1 4.18Å; L90-V132 HydrophobicContact CD2-CG1 4.01Å; L90-V132 HydrophobicContact CD2-CG2 3.67Å; R91-V132 HydrophobicContact CG-CG2 4.37Å; L129-V132 WeakPolarHBondContact O-CG2 3.38Å; L129-V132 PolarHBondContact O-N 2.93Å; L129-V132 VanDerWaalsContact O-N 3.14Å; A130-V132 PolarHBondContact O-N 3.15Å
133A91.9Very high94.5Very high15 Ų1549 Ų4912%0.12426%0.262CS..  trans-77.4150.6-178.700000112.4L129 R138L129-A133 VanDerWaalsContact O-CB 3.29Å; L129-A133 WeakPolarHBondContact O-CB 3.33Å; L129-A133 PolarHBondContact O-N 3.18Å; A133-R138 HydrophobicContact CB-CB 3.88Å; A133-R138 HydrophobicContact CB-CG 4.23Å; A133-R138 PolarHBondContact O-NH1 2.92Å
134C85.2Confident94.5Very high102 Ų10251.8 Ų51.869%0.68928%0.277SS*.  trans-127.9157177.3-56.60000110.9
135G84.6Confident94.4Very high61 Ų6151.3 Ų51.363%0.62928%0.275SS*.Hα-helixtrans60.1-142.9174.500000114.1D137 R138G135-D137 VanDerWaalsContact C-N 3.3Å; G135-D137 PolarHBondContact O-N 3.44Å; G135-R138 WeakPolarHBondContact O-CB 2.95Å; G135-R138 PolarHBondContact O-N 3.09Å; G135-R138 VanDerWaalsContact O-N 3.13Å
136D82.9Confident94.4Very high142 Ų14254.5 Ų54.576%0.75929%0.29SS*.Hα-helixtrans-63.8-34-176.7-66.7-30.4000112.9R138 K139 Q140D136-R138 PolarHBondContact O-N 3.29Å; D136-K139 PolarHBondContact O-N 2.94Å; D136-K139 VanDerWaalsContact O-N 3.13Å; D136-Q140 PolarHBondContact O-N 3.34Å
137D89.3Confident94.4Very high121 Ų12155.2 Ų55.265%0.64730%0.304SS*.Hα-helixtrans-58.4-36175.6-70.7-14.6000111.1G135 T141G135-D137 VanDerWaalsContact C-N 3.3Å; G135-D137 PolarHBondContact O-N 3.44Å; D137-T141 VanDerWaalsContact O-CB 3.26Å; D137-T141 WeakPolarHBondContact O-CB 3.46Å; D137-T141 PolarHBondContact O-N 3.15Å; D137-T141 VanDerWaalsContact O-N 3.07Å; D137-T141 PolarHBondContact O-OG1 2.66Å
138R93.3Very high94.5Very high89 Ų8954.8 Ų54.834%0.33630%0.304SS..Hα-helixtrans-65.4-46.1177.1-169.7-175.7179.3108.5-3.5111.1A130 A133 G135 D136 Q140 T141 I142A130-R138 PolarHBondContact O-NH1 2.98Å; A130-R138 VanDerWaalsContact O-NH1 3.14Å; A133-R138 HydrophobicContact CB-CB 3.88Å; A133-R138 HydrophobicContact CB-CG 4.23Å; A133-R138 PolarHBondContact O-NH1 2.92Å; G135-R138 WeakPolarHBondContact O-CB 2.95Å; G135-R138 PolarHBondContact O-N 3.09Å; G135-R138 VanDerWaalsContact O-N 3.13Å; D136-R138 PolarHBondContact O-N 3.29Å; R138-Q140 PolarHBondContact O-N 3.4Å; R138-T141 PolarHBondContact O-N 3.07Å; R138-I142 HydrophobicContact CG-CD1 3.93Å; R138-I142 HydrophobicContact CG-CG1 4.42Å; R138-I142 VanDerWaalsContact O-CG1 3.26Å; R138-I142 WeakPolarHBondContact O-CG1 3.42Å; R138-I142 PolarHBondContact O-N 3.38Å
139K94.7Very high94.5Very high134 Ų13453.8 Ų53.858%0.58330%0.3SS*.Hα-helixtrans-59.9-49.4-178.7-176-178.5173.5-174.20111.3D136 T141 I142 E143D136-K139 PolarHBondContact O-N 2.94Å; D136-K139 VanDerWaalsContact O-N 3.13Å; K139-T141 VanDerWaalsContact C-N 3.3Å; K139-T141 PolarHBondContact O-N 3.39Å; K139-I142 PolarHBondContact O-N 3.26Å; K139-E143 WeakPolarHBondContact CE-OE1 3.32Å; K139-E143 WeakPolarHBondContact O-CG 3.28Å; K139-E143 PolarHBondContact O-N 3.18Å
140Q95.9Very high94.6Very high99 Ų9956 Ų5646%0.46331%0.31SS..Hα-helixtrans-62.7-38.8178.7-173.861.171.500112.1D136 R138 E143 N144D136-Q140 PolarHBondContact O-N 3.34Å; R138-Q140 PolarHBondContact O-N 3.4Å; Q140-E143 PolarHBondContact O-N 2.87Å; Q140-N144 PolarHBondContact NE2-OD1 2.76Å; Q140-N144 VanDerWaalsContact NE2-OD1 3.15Å; Q140-N144 WeakPolarHBondContact O-CB 3.34Å; Q140-N144 PolarHBondContact O-N 3.37Å; Q140-N144 PolarHBondContact O-ND2 3.39Å
141T96.9Very high94.7Very high20 Ų2059.9 Ų59.912%0.12333%0.328CS..Hα-helixtrans-64.1-41.1177.4-60.40000111.7F126 L129 A130 D137 R138 K139 N144 S145F126-T141 HydrophobicContact CB-CG2 4.35Å; F126-T141 HydrophobicContact CD1-CG2 4.16Å; F126-T141 WeakPolarHBondContact O-CG2 3.44Å; L129-T141 HydrophobicContact CB-CG2 3.52Å; A130-T141 HydrophobicContact CB-CG2 3.88Å; D137-T141 VanDerWaalsContact O-CB 3.26Å; D137-T141 WeakPolarHBondContact O-CB 3.46Å; D137-T141 PolarHBondContact O-N 3.15Å; D137-T141 VanDerWaalsContact O-N 3.07Å; D137-T141 PolarHBondContact O-OG1 2.66Å; R138-T141 PolarHBondContact O-N 3.07Å; K139-T141 VanDerWaalsContact C-N 3.3Å; K139-T141 PolarHBondContact O-N 3.39Å; T141-N144 PolarHBondContact O-N 3.45Å; T141-S145 WeakPolarHBondContact O-CB 3.27Å; T141-S145 PolarHBondContact O-N 2.94Å
142I97.9Very high94.9Very high27 Ų2758.9 Ų58.914%0.13832%0.323CS..Hα-helixtrans-63-47.5175.4-70.3173.7000110.8A130 R138 K139 N144 S145 Q146 F177 I181 L182A130-I142 HydrophobicContact CB-CG1 3.94Å; R138-I142 HydrophobicContact CG-CD1 3.93Å; R138-I142 HydrophobicContact CG-CG1 4.42Å; R138-I142 VanDerWaalsContact O-CG1 3.26Å; R138-I142 WeakPolarHBondContact O-CG1 3.42Å; R138-I142 PolarHBondContact O-N 3.38Å; K139-I142 PolarHBondContact O-N 3.26Å; I142-N144 VanDerWaalsContact C-N 3.32Å; I142-N144 PolarHBondContact O-N 3.25Å; I142-S145 WeakPolarHBondContact O-CB 3.48Å; I142-S145 PolarHBondContact O-N 2.97Å; I142-Q146 WeakPolarHBondContact O-CB 3.26Å; I142-Q146 PolarHBondContact O-N 3.07Å; I142-F177 HydrophobicContact CG2-CE2 4.44Å; I142-F177 HydrophobicContact CG2-CZ 4.02Å; I142-I181 HydrophobicContact CD1-CG2 3.89Å; I142-I181 HydrophobicContact CG1-CG2 3.63Å; I142-L182 HydrophobicContact CG2-CD2 3.48Å; I142-L182 VanDerWaalsContact CG2-CD2 3.48Å
143E97.8Very high95.1Very high90 Ų9059.4 Ų59.442%0.42132%0.324SS..Hα-helixtrans-60.1-42.7178-71.8173.6-17600111.5K139 Q140 Q146 G147K139-E143 WeakPolarHBondContact CE-OE1 3.32Å; K139-E143 WeakPolarHBondContact O-CG 3.28Å; K139-E143 PolarHBondContact O-N 3.18Å; Q140-E143 PolarHBondContact O-N 2.87Å; E143-Q146 PolarHBondContact O-N 3.49Å; E143-G147 PolarHBondContact O-N 3.13Å
144N98.3Very high95.4Very high59 Ų5962.2 Ų62.232%0.31634%0.337SS..Hα-helixtrans-65-41.2176.5-70.8-19.3000112.4F126 Q140 T141 I142 A148F126-N144 HydrophobicContact CD1-CB 3.84Å; F126-N144 HydrophobicContact CD2-CB 3.73Å; F126-N144 HydrophobicContact CE1-CB 3.81Å; F126-N144 HydrophobicContact CE2-CB 3.69Å; F126-N144 HydrophobicContact CG-CB 3.8Å; F126-N144 HydrophobicContact CZ-CB 3.74Å; Q140-N144 PolarHBondContact NE2-OD1 2.76Å; Q140-N144 VanDerWaalsContact NE2-OD1 3.15Å; Q140-N144 WeakPolarHBondContact O-CB 3.34Å; Q140-N144 PolarHBondContact O-N 3.37Å; Q140-N144 PolarHBondContact O-ND2 3.39Å; T141-N144 PolarHBondContact O-N 3.45Å; I142-N144 VanDerWaalsContact C-N 3.32Å; I142-N144 PolarHBondContact O-N 3.25Å; N144-A148 WeakPolarHBondContact O-CB 3.26Å; N144-A148 PolarHBondContact O-N 3.13Å
145S98.6Very high96Very high0 Ų058.9 Ų58.90%031%0.312CS..Hα-helixtrans-60-51.3174.9-176.40000110.9G123 R127 T141 I142 G147 A148 Y149 F177G123-S145 PolarHBondContact O-OG 3.06Å; G123-S145 VanDerWaalsContact O-OG 3.11Å; R127-S145 PolarHBondContact N-OG 3.27Å; T141-S145 WeakPolarHBondContact O-CB 3.27Å; T141-S145 PolarHBondContact O-N 2.94Å; I142-S145 WeakPolarHBondContact O-CB 3.48Å; I142-S145 PolarHBondContact O-N 2.97Å; S145-G147 PolarHBondContact O-N 3Å; S145-A148 PolarHBondContact O-N 3.18Å; S145-Y149 WeakPolarHBondContact O-CD2 3.2Å; S145-Y149 PolarHBondContact O-N 3.07Å; S145-Y149 WeakPolarHBondContact OG-CE2 3.41Å; S145-F177 VanDerWaalsContact OG-CD2 3.32Å; S145-F177 WeakPolarHBondContact OG-CD2 3.36Å; S145-F177 VanDerWaalsContact OG-CE2 3.24Å; S145-F177 WeakPolarHBondContact OG-CE2 3.49Å
146Q98.6Very high96.7Very high72 Ų7256 Ų5634%0.33628%0.283SS..Hα-helixtrans-63-43.5-179.7-172.7172.8-100111.6I142 E143 A148 Y149 Q150 F177I142-Q146 WeakPolarHBondContact O-CB 3.26Å; I142-Q146 PolarHBondContact O-N 3.07Å; E143-Q146 PolarHBondContact O-N 3.49Å; Q146-A148 PolarHBondContact O-N 3.49Å; Q146-Y149 PolarHBondContact O-N 3.38Å; Q146-Q150 VanDerWaalsContact O-CB 3.32Å; Q146-Q150 WeakPolarHBondContact O-CB 3.43Å; Q146-Q150 PolarHBondContact O-N 2.85Å; Q146-F177 HydrophobicContact CB-CE1 3.82Å; Q146-F177 HydrophobicContact CB-CZ 3.84Å; Q146-F177 HydrophobicContact CG-CE1 4.14Å
147G98.7Very high97.4Very high40 Ų4054.2 Ų54.241%0.41227%0.268SS..Hα-helixtrans-59.6-45177.600000112.5E143 S145 Q150 E151E143-G147 PolarHBondContact O-N 3.13Å; S145-G147 PolarHBondContact O-N 3Å; G147-Q150 PolarHBondContact O-N 3.38Å; G147-E151 PolarHBondContact O-N 3.23Å
148A98.8Very high97.7Very high5 Ų556.4 Ų56.44%0.04127%0.272CS..Hα-helixtrans-65.3-43.4177.900000112.5K122 N144 S145 Q146 A152K122-A148 HydrophobicContact CB-CB 4.04Å; K122-A148 HydrophobicContact CD-CB 4.24Å; K122-A148 HydrophobicContact CG-CB 3.93Å; N144-A148 WeakPolarHBondContact O-CB 3.26Å; N144-A148 PolarHBondContact O-N 3.13Å; S145-A148 PolarHBondContact O-N 3.18Å; Q146-A148 PolarHBondContact O-N 3.49Å; A148-A152 WeakPolarHBondContact O-CB 3.28Å; A148-A152 PolarHBondContact O-N 2.81Å
149Y98.8Very high97.9Very high0 Ų058 Ų580%028%0.283CS..Hα-helixtrans-64.7-41.5175.1-75.4-53.6000112.4G123 D124 R127 S145 Q146 A152 F153 L170 N173 F174 F177G123-Y149 VanDerWaalsContact C-CZ 3.41Å; D124-Y149 VanDerWaalsContact CA-OH 3.3Å; D124-Y149 WeakPolarHBondContact CA-OH 3.49Å; D124-Y149 PolarHBondContact N-OH 3.26Å; D124-Y149 PolarHBondContact OD1-OH 3.01Å; R127-Y149 PolarHBondContact NE-OH 2.86Å; S145-Y149 WeakPolarHBondContact O-CD2 3.2Å; S145-Y149 PolarHBondContact O-N 3.07Å; S145-Y149 WeakPolarHBondContact OG-CE2 3.41Å; Q146-Y149 PolarHBondContact O-N 3.38Å; Y149-A152 WeakPolarHBondContact O-CB 3.24Å; Y149-A152 PolarHBondContact O-N 3.44Å; Y149-F153 VanDerWaalsContact O-CB 3.26Å; Y149-F153 WeakPolarHBondContact O-CB 3.44Å; Y149-F153 PolarHBondContact O-N 3.49Å; Y149-L170 HydrophobicContact CD1-CD1 3.7Å; Y149-L170 HydrophobicContact CE1-CD1 4.41Å; Y149-N173 HydrophobicContact CE1-CB 4.14Å; Y149-F174 VanDerWaalsContact CB-CD2 3.47Å; Y149-F174 VanDerWaalsContact CB-CE2 3.47Å; Y149-F174 HydrophobicContact CD1-CB 4.1Å; Y149-F174 HydrophobicContact CD1-CD2 4.45Å; Y149-F174 HydrophobicContact CD1-CG 4.31Å; Y149-F174 AromaticContact CD2-CD2 3.63Å; Y149-F174 HydrophobicContact CD2-CD2 3.63Å; Y149-F174 AromaticContact CD2-CE2 3.99Å; Y149-F174 HydrophobicContact CD2-CE2 3.99Å; Y149-F174 HydrophobicContact CD2-CG 4.28Å; Y149-F174 HydrophobicContact CE2-CD2 4.43Å; Y149-F174 HydrophobicContact CG-CB 4.13Å; Y149-F174 HydrophobicContact CG-CD1 4.45Å; Y149-F174 AromaticContact CG-CD2 3.63Å; Y149-F174 HydrophobicContact CG-CD2 3.63Å; Y149-F174 HydrophobicContact CG-CE2 4.05Å; Y149-F174 AromaticContact CG-CG 3.86Å; Y149-F174 HydrophobicContact CG-CG 3.86Å; Y149-F177 HydrophobicContact CD2-CB 4.19Å; Y149-F177 HydrophobicContact CD2-CD1 4.28Å; Y149-F177 HydrophobicContact CD2-CG 4.08Å; Y149-F177 HydrophobicContact CE2-CB 3.69Å; Y149-F177 HydrophobicContact CE2-CD2 4.13Å; Y149-F177 AromaticContact CE2-CG 3.86Å; Y149-F177 HydrophobicContact CE2-CG 3.86Å
150Q98.7Very high98Very high66 Ų6652.3 Ų52.331%0.30826%0.259SS..Hα-helixtrans-65.6-43.8179.4-170.66253.100111.6Q146 G147 A152 F153 D154Q146-Q150 VanDerWaalsContact O-CB 3.32Å; Q146-Q150 WeakPolarHBondContact O-CB 3.43Å; Q146-Q150 PolarHBondContact O-N 2.85Å; G147-Q150 PolarHBondContact O-N 3.38Å; Q150-A152 VanDerWaalsContact C-N 3.34Å; Q150-A152 PolarHBondContact O-N 2.94Å; Q150-F153 PolarHBondContact O-N 3.5Å; Q150-F153 VanDerWaalsContact O-N 3.13Å; Q150-D154 PolarHBondContact NE2-OD1 3.25Å; Q150-D154 VanDerWaalsContact O-CG 3.26Å; Q150-D154 PolarHBondContact O-N 3.13Å
151E98.7Very high98Very high82 Ų8253.5 Ų53.538%0.38326%0.264SS..Hα-helixtrans-60.5-44.5175.1-169.4-172.5165.700111K115 L119 G147 F153 I155K115-E151 VanDerWaalsContact CE-OE1 3.28Å; K115-E151 WeakPolarHBondContact CE-OE1 3.48Å; K115-E151 IonicContact NZ-OE1 3.12Å; K115-E151 PolarHBondContact NZ-OE1 2.93Å; K115-E151 VanDerWaalsContact NZ-OE1 3.12Å; L119-E151 HydrophobicContact CD1-CB 4.09Å; L119-E151 HydrophobicContact CD1-CG 3.71Å; L119-E151 HydrophobicContact CD2-CB 4.47Å; L119-E151 HydrophobicContact CD2-CG 4.47Å; L119-E151 WeakPolarHBondContact CD2-OE2 3.17Å; G147-E151 PolarHBondContact O-N 3.23Å; E151-F153 VanDerWaalsContact C-N 3.27Å; E151-F153 PolarHBondContact O-N 2.83Å; E151-I155 HydrophobicContact CG-CD1 4.16Å; E151-I155 WeakPolarHBondContact O-CD1 3.38Å; E151-I155 WeakPolarHBondContact O-CG1 3.36Å; E151-I155 PolarHBondContact O-N 3.32Å
152A98.8Very high98Very high0 Ų053 Ų530%026%0.262CS..Hα-helixtrans-59.1-42174.900000111.4V116 L119 A148 Y149 Q150 I155 S156 L170V116-A152 HydrophobicContact CG1-CB 4.35Å; L119-A152 HydrophobicContact CB-CB 3.64Å; A148-A152 WeakPolarHBondContact O-CB 3.28Å; A148-A152 PolarHBondContact O-N 2.81Å; Y149-A152 WeakPolarHBondContact O-CB 3.24Å; Y149-A152 PolarHBondContact O-N 3.44Å; Q150-A152 VanDerWaalsContact C-N 3.34Å; Q150-A152 PolarHBondContact O-N 2.94Å; A152-I155 PolarHBondContact O-N 3.48Å; A152-S156 VanDerWaalsContact O-CB 3.28Å; A152-S156 WeakPolarHBondContact O-CB 3.32Å; A152-S156 PolarHBondContact O-N 2.92Å; A152-S156 PolarHBondContact O-OG 3.26Å; A152-L170 VanDerWaalsContact C-CD2 3.48Å; A152-L170 HydrophobicContact CB-CD1 3.82Å; A152-L170 HydrophobicContact CB-CD2 3.64Å; A152-L170 HydrophobicContact CB-CG 4.41Å
153F98.4Very high98Very high23 Ų2352 Ų5210%0.10126%0.257CS..Hα-helixtrans-68.7-44-175.4-165.3-110.6000111.4Y149 Q150 E151 I155 S156 K157 L170 F174 L191Y149-F153 VanDerWaalsContact O-CB 3.26Å; Y149-F153 WeakPolarHBondContact O-CB 3.44Å; Y149-F153 PolarHBondContact O-N 3.49Å; Q150-F153 PolarHBondContact O-N 3.5Å; Q150-F153 VanDerWaalsContact O-N 3.13Å; E151-F153 VanDerWaalsContact C-N 3.27Å; E151-F153 PolarHBondContact O-N 2.83Å; F153-I155 VanDerWaalsContact C-N 3.33Å; F153-I155 PolarHBondContact O-N 3.02Å; F153-S156 WeakPolarHBondContact CA-OG 3.27Å; F153-S156 PolarHBondContact O-N 3.43Å; F153-S156 PolarHBondContact O-OG 3.23Å; F153-K157 HydrophobicContact CD1-CD 4.05Å; F153-K157 HydrophobicContact CD1-CG 4.49Å; F153-K157 HydrophobicContact CE1-CD 3.7Å; F153-K157 HydrophobicContact CE1-CG 4.34Å; F153-K157 VanDerWaalsContact CE1-NZ 3.33Å; F153-K157 HydrophobicContact CZ-CD 4.18Å; F153-K157 PolarHBondContact O-N 2.8Å; F153-L170 HydrophobicContact CB-CD2 4.13Å; F153-L170 HydrophobicContact CD2-CD2 4.13Å; F153-L170 HydrophobicContact CD2-CG 4.45Å; F153-F174 HydrophobicContact CB-CE1 4.45Å; F153-L191 HydrophobicContact CE1-CD1 4.2Å; F153-L191 HydrophobicContact CE2-CD1 3.64Å; F153-L191 HydrophobicContact CZ-CD1 3.39Å
154D98.4Very high97.9Very high75 Ų7550.1 Ų50.140%0.40125%0.248SC..Hα-helixtrans-62.2-38.7177.9-69.6-12.8000112.6Q150 K158Q150-D154 PolarHBondContact NE2-OD1 3.25Å; Q150-D154 VanDerWaalsContact O-CG 3.26Å; Q150-D154 PolarHBondContact O-N 3.13Å; D154-K158 WeakPolarHBondContact O-CG 3.06Å
155I98.6Very high97.8Very high32 Ų3248.3 Ų48.316%0.16424%0.239CC..Hα-helixtrans-70.1-47.7174-62.4163.1000109.7P112 K115 V116 L119 E151 A152 F153 K157 K158 E159P112-I155 HydrophobicContact CB-CG2 4.09Å; K115-I155 HydrophobicContact CD-CD1 3.79Å; K115-I155 HydrophobicContact CG-CD1 4.02Å; V116-I155 HydrophobicContact CG2-CB 3.79Å; V116-I155 HydrophobicContact CG2-CG2 3.52Å; L119-I155 HydrophobicContact CD1-CD1 3.75Å; E151-I155 HydrophobicContact CG-CD1 4.16Å; E151-I155 WeakPolarHBondContact O-CD1 3.38Å; E151-I155 WeakPolarHBondContact O-CG1 3.36Å; E151-I155 PolarHBondContact O-N 3.32Å; A152-I155 PolarHBondContact O-N 3.48Å; F153-I155 VanDerWaalsContact C-N 3.33Å; F153-I155 PolarHBondContact O-N 3.02Å; I155-K157 VanDerWaalsContact C-N 3.29Å; I155-K157 PolarHBondContact O-N 2.93Å; I155-K158 PolarHBondContact O-N 3.27Å; I155-K158 VanDerWaalsContact O-N 3.08Å; I155-E159 HydrophobicContact CG2-CG 4.12Å; I155-E159 WeakPolarHBondContact O-CB 3.17Å; I155-E159 PolarHBondContact O-N 3.28Å
156S98.3Very high97.8Very high0 Ų049.3 Ų49.30%025%0.245CC..Hα-helixtrans-61.2-36.2-176.475.70000113.1A152 F153 K158 M160A152-S156 VanDerWaalsContact O-CB 3.28Å; A152-S156 WeakPolarHBondContact O-CB 3.32Å; A152-S156 PolarHBondContact O-N 2.92Å; A152-S156 PolarHBondContact O-OG 3.26Å; F153-S156 WeakPolarHBondContact CA-OG 3.27Å; F153-S156 PolarHBondContact O-N 3.43Å; F153-S156 PolarHBondContact O-OG 3.23Å; S156-K158 VanDerWaalsContact C-N 3.29Å; S156-K158 PolarHBondContact O-N 3.11Å; S156-M160 VanDerWaalsContact O-CB 3.3Å; S156-M160 WeakPolarHBondContact O-CB 3.35Å; S156-M160 PolarHBondContact O-N 3.25Å
157K97.2Very high97.7Very high105 Ų10547 Ų4746%0.45723%0.233SC..Hα-helixtrans-66.4-29.9177.1-84.6-171.6160.9-179.30113.4F153 I155F153-K157 HydrophobicContact CD1-CD 4.05Å; F153-K157 HydrophobicContact CD1-CG 4.49Å; F153-K157 HydrophobicContact CE1-CD 3.7Å; F153-K157 HydrophobicContact CE1-CG 4.34Å; F153-K157 VanDerWaalsContact CE1-NZ 3.33Å; F153-K157 HydrophobicContact CZ-CD 4.18Å; F153-K157 PolarHBondContact O-N 2.8Å; I155-K157 VanDerWaalsContact C-N 3.29Å; I155-K157 PolarHBondContact O-N 2.93Å
158K97.3Very high97.7Very high167 Ų16745.2 Ų45.273%0.72621%0.213SC*.Hα-helixtrans-87.9-38.1-178.4-66.9174.2-173.1173.60112.2D154 I155 S156D154-K158 WeakPolarHBondContact O-CG 3.06Å; I155-K158 PolarHBondContact O-N 3.27Å; I155-K158 VanDerWaalsContact O-N 3.08Å; S156-K158 VanDerWaalsContact C-N 3.29Å; S156-K158 PolarHBondContact O-N 3.11Å
159E97.6Very high97.7Very high122 Ų12245.4 Ų45.457%0.5722%0.216SC*.Hα-helixtrans-110.1-7.5-164.8-57.1-63150.200113.8P112 I155P112-E159 HydrophobicContact CB-CB 3.6Å; P112-E159 HydrophobicContact CB-CG 3.79Å; P112-E159 HydrophobicContact CG-CB 4.01Å; P112-E159 HydrophobicContact CG-CG 3.88Å; I155-E159 HydrophobicContact CG2-CG 4.12Å; I155-E159 WeakPolarHBondContact O-CB 3.17Å; I155-E159 PolarHBondContact O-N 3.28Å
160M96.4Very high97.7Very high15 Ų1545.4 Ų45.47%0.07422%0.216CC..SBendtrans-133.5139.1-171.9-45-177.99300111.8E113 V116 S156 H164 I166 R167E113-M160 HydrophobicContact CB-CE 4.13Å; E113-M160 HydrophobicContact CG-CE 3.84Å; V116-M160 HydrophobicContact CB-SD 4.12Å; V116-M160 HydrophobicContact CG1-SD 4.04Å; V116-M160 HydrophobicContact CG2-SD 4Å; S156-M160 VanDerWaalsContact O-CB 3.3Å; S156-M160 WeakPolarHBondContact O-CB 3.35Å; S156-M160 PolarHBondContact O-N 3.25Å; M160-H164 HydrophobicContact CB-CB 4.18Å; M160-H164 WeakPolarHBondContact CE-CE1 3.47Å; M160-H164 WeakPolarHBondContact CE-ND1 3.39Å; M160-I166 HydrophobicContact CE-CB 4.03Å; M160-I166 HydrophobicContact CE-CG2 4.14Å; M160-I166 HydrophobicContact SD-CG2 4.47Å; M160-R167 HydrophobicContact CB-CB 4.32Å; M160-R167 PolarHBondContact O-NH1 3.12Å; M160-R167 HydrophobicContact SD-CB 4.41Å
161Q95.9Very high97.7Very high123 Ų12342.4 Ų42.458%0.57520%0.202SC*.  trans-64.1148.6174.1-61.9-59-22.900111.2T163 H164 R167 E202Q161-T163 PolarHBondContact O-N 2.87Å; Q161-T163 VanDerWaalsContact O-N 3.12Å; Q161-H164 WeakPolarHBondContact O-CB 3.41Å; Q161-H164 PolarHBondContact O-N 3.03Å; Q161-R167 WeakPolarHBondContact O-CD 3.31Å; Q161-E202 PolarHBondContact OE1-OE2 3.39Å
162P97.2Very high97.7Very high11 Ų1139.4 Ų39.47%0.07119%0.189CC..THydrogen-bonded Turntrans-51.4-32.9175.6-28.535.8000114.6H164 L168 E198 E202P162-H164 VanDerWaalsContact C-N 3.29Å; P162-H164 PolarHBondContact O-N 3.16Å; P162-L168 WeakPolarHBondContact O-CG 3.32Å; P162-E198 HydrophobicContact CB-CB 3.86Å; P162-E198 HydrophobicContact CG-CB 4.3Å; P162-E202 WeakPolarHBondContact CD-OE2 3.36Å
163T96.4Very high97.7Very high6 Ų640.8 Ų40.84%0.03720%0.196CC..THydrogen-bonded Turntrans-80.5-3.5179.3540000114.2Q161 A199 E202 S214Q161-T163 PolarHBondContact O-N 2.87Å; Q161-T163 VanDerWaalsContact O-N 3.12Å; T163-A199 HydrophobicContact CG2-CB 4.44Å; T163-A199 WeakPolarHBondContact CG2-O 3.44Å; T163-E202 HydrophobicContact CG2-CB 3.94Å; T163-S214 WeakPolarHBondContact O-CB 3.45Å; T163-S214 PolarHBondContact O-OG 3.4Å
164H96.2Very high97.7Very high49 Ų4939.7 Ų39.723%0.22719%0.192CC..  trans-68.1127.5-176.2-169.5-64.6000111.5E113 M160 Q161 P162 I166 R167 L168E113-H164 IonicContact OE2-NE2 3.88Å; M160-H164 HydrophobicContact CB-CB 4.18Å; M160-H164 WeakPolarHBondContact CE-CE1 3.47Å; M160-H164 WeakPolarHBondContact CE-ND1 3.39Å; Q161-H164 WeakPolarHBondContact O-CB 3.41Å; Q161-H164 PolarHBondContact O-N 3.03Å; P162-H164 VanDerWaalsContact C-N 3.29Å; P162-H164 PolarHBondContact O-N 3.16Å; H164-I166 VanDerWaalsContact C-N 3.32Å; H164-I166 PolarHBondContact ND1-N 3.44Å; H164-I166 VanDerWaalsContact ND1-N 3.15Å; H164-I166 PolarHBondContact O-N 2.88Å; H164-I166 VanDerWaalsContact O-N 3.17Å; H164-R167 HydrophobicContact CB-CB 4.23Å; H164-R167 PolarHBondContact O-N 3.23Å; H164-L168 PolarHBondContact O-N 3.49Å
165P96.5Very high97.7Very high22 Ų2236.1 Ų36.114%0.14317%0.173CC..Hα-helixtrans-53.5-42.6-175.3-26.430000114.4L168 G169 D213 S214 I217P165-L168 PolarHBondContact O-N 3.01Å; P165-G169 PolarHBondContact O-N 2.89Å; P165-D213 HydrophobicContact CB-CB 4.15Å; P165-D213 HydrophobicContact CG-CB 4.11Å; P165-S214 WeakPolarHBondContact CD-OG 3.31Å; P165-S214 WeakPolarHBondContact CG-OG 3.4Å; P165-I217 HydrophobicContact CB-CD1 4.15Å; P165-I217 VanDerWaalsContact O-CD1 3.28Å; P165-I217 WeakPolarHBondContact O-CD1 3.46Å
166I97.5Very high97.7Very high21 Ų2135.5 Ų35.511%0.10817%0.17CC..Hα-helixtrans-65-40177.5-67.7170.8000112.7E113 V116 F117 M160 H164 G169 L170E113-I166 HydrophobicContact CG-CD1 3.39Å; V116-I166 HydrophobicContact CB-CG2 4.26Å; V116-I166 HydrophobicContact CG1-CG2 3.68Å; F117-I166 HydrophobicContact CB-CD1 4.38Å; F117-I166 HydrophobicContact CD2-CD1 3.85Å; F117-I166 HydrophobicContact CD2-CG1 4.15Å; M160-I166 HydrophobicContact CE-CB 4.03Å; M160-I166 HydrophobicContact CE-CG2 4.14Å; M160-I166 HydrophobicContact SD-CG2 4.47Å; H164-I166 VanDerWaalsContact C-N 3.32Å; H164-I166 PolarHBondContact ND1-N 3.44Å; H164-I166 VanDerWaalsContact ND1-N 3.15Å; H164-I166 PolarHBondContact O-N 2.88Å; H164-I166 VanDerWaalsContact O-N 3.17Å; I166-G169 PolarHBondContact O-N 3.17Å; I166-L170 WeakPolarHBondContact O-CB 3.47Å; I166-L170 PolarHBondContact O-N 2.82Å
167R98.1Very high97.7Very high24 Ų2435.5 Ų35.59%0.09117%0.17CC..Hα-helixtrans-66.5-45176.9177.6176.3167.5171.9-6.1110.8M160 Q161 H164 L170 A171 E198M160-R167 HydrophobicContact CB-CB 4.32Å; M160-R167 PolarHBondContact O-NH1 3.12Å; M160-R167 HydrophobicContact SD-CB 4.41Å; Q161-R167 WeakPolarHBondContact O-CD 3.31Å; H164-R167 HydrophobicContact CB-CB 4.23Å; H164-R167 PolarHBondContact O-N 3.23Å; R167-L170 WeakPolarHBondContact O-CB 3.28Å; R167-L170 PolarHBondContact O-N 3.15Å; R167-A171 PolarHBondContact O-N 3.01Å; R167-E198 IonicContact CZ-OE2 3.84Å; R167-E198 IonicContact NH2-OE2 2.74Å; R167-E198 PolarHBondContact NH2-OE2 3.4Å
168L98.5Very high97.8Very high1 Ų131.1 Ų31.11%0.00515%0.151CC..Hα-helixtrans-60.2-46.1174-75.3170.6000111.8P162 H164 P165 L170 A171 L172 A199 I217 M218 L221P162-L168 WeakPolarHBondContact O-CG 3.32Å; H164-L168 PolarHBondContact O-N 3.49Å; P165-L168 PolarHBondContact O-N 3.01Å; L168-L170 VanDerWaalsContact C-N 3.28Å; L168-L170 PolarHBondContact O-N 2.99Å; L168-A171 PolarHBondContact O-N 3.39Å; L168-L172 PolarHBondContact O-N 3.3Å; L168-A199 HydrophobicContact CD1-CB 4.47Å; L168-A199 HydrophobicContact CD2-CB 3.72Å; L168-I217 HydrophobicContact CB-CB 4.19Å; L168-I217 HydrophobicContact CB-CD1 4.47Å; L168-I217 HydrophobicContact CB-CG2 3.65Å; L168-M218 HydrophobicContact CD1-CG 3.92Å; L168-M218 HydrophobicContact CD1-SD 4.36Å; L168-M218 HydrophobicContact CD2-CG 4.08Å; L168-L221 HydrophobicContact CD2-CD1 3.99Å
169G98.4Very high97.8Very high10 Ų1026.1 Ų26.110%0.10313%0.128CC..Hα-helixtrans-65-32.5178.500000112.7K120 P165 I166 N173K120-G169 WeakPolarHBondContact CE-O 3.39Å; P165-G169 PolarHBondContact O-N 2.89Å; I166-G169 PolarHBondContact O-N 3.17Å; G169-N173 PolarHBondContact O-N 2.93Å; G169-N173 VanDerWaalsContact O-N 3.12Å
170L98.8Very high97.7Very high0 Ų024.8 Ų24.80%012%0.122CC..Hα-helixtrans-64.9-49.2170.917063000111V116 K120 Y149 A152 F153 I166 R167 L168 L172 N173 F174V116-L170 HydrophobicContact CG1-CD2 4.06Å; K120-L170 HydrophobicContact CB-CD1 3.98Å; K120-L170 HydrophobicContact CD-CB 4.11Å; K120-L170 HydrophobicContact CG-CB 4.3Å; K120-L170 HydrophobicContact CG-CD1 3.96Å; Y149-L170 HydrophobicContact CD1-CD1 3.7Å; Y149-L170 HydrophobicContact CE1-CD1 4.41Å; A152-L170 VanDerWaalsContact C-CD2 3.48Å; A152-L170 HydrophobicContact CB-CD1 3.82Å; A152-L170 HydrophobicContact CB-CD2 3.64Å; A152-L170 HydrophobicContact CB-CG 4.41Å; F153-L170 HydrophobicContact CB-CD2 4.13Å; F153-L170 HydrophobicContact CD2-CD2 4.13Å; F153-L170 HydrophobicContact CD2-CG 4.45Å; I166-L170 WeakPolarHBondContact O-CB 3.47Å; I166-L170 PolarHBondContact O-N 2.82Å; R167-L170 WeakPolarHBondContact O-CB 3.28Å; R167-L170 PolarHBondContact O-N 3.15Å; L168-L170 VanDerWaalsContact C-N 3.28Å; L168-L170 PolarHBondContact O-N 2.99Å; L170-L172 VanDerWaalsContact C-N 3.3Å; L170-L172 PolarHBondContact O-N 2.92Å; L170-N173 PolarHBondContact O-N 3.42Å; L170-F174 VanDerWaalsContact O-CB 3.27Å; L170-F174 WeakPolarHBondContact O-CB 3.48Å; L170-F174 PolarHBondContact O-N 3.19Å
171A98.8Very high97.8Very high2 Ų224.8 Ų24.82%0.01712%0.122CC..Hα-helixtrans-59.6-41.5178.200000112R167 L168 S175 A195R167-A171 PolarHBondContact O-N 3.01Å; L168-A171 PolarHBondContact O-N 3.39Å; A171-S175 WeakPolarHBondContact O-CB 3.24Å; A171-S175 PolarHBondContact O-N 3.36Å; A171-S175 PolarHBondContact O-OG 3.09Å; A171-S175 VanDerWaalsContact O-OG 3.1Å; A171-A195 HydrophobicContact CB-CB 3.43Å; A171-A195 VanDerWaalsContact CB-CB 3.43Å
172L98.7Very high97.8Very high19 Ų1921.7 Ų21.710%0.09911%0.109CC..Hα-helixtrans-59-49175.1176.864.9000112.1L168 L170 S175 V176 I217 L220 L221 N224L168-L172 PolarHBondContact O-N 3.3Å; L170-L172 VanDerWaalsContact C-N 3.3Å; L170-L172 PolarHBondContact O-N 2.92Å; L172-S175 PolarHBondContact O-OG 3.1Å; L172-V176 VanDerWaalsContact O-CG2 3.28Å; L172-V176 WeakPolarHBondContact O-CG2 3.41Å; L172-V176 PolarHBondContact O-N 2.98Å; L172-I217 HydrophobicContact CB-CG2 4.3Å; L172-I217 HydrophobicContact CD2-CG2 4.17Å; L172-L220 HydrophobicContact CD1-CB 4.13Å; L172-L220 HydrophobicContact CD2-CB 3.9Å; L172-L220 HydrophobicContact CD2-CD1 3.93Å; L172-L221 HydrophobicContact CB-CD2 3.9Å; L172-L221 HydrophobicContact CB-CG 4.21Å; L172-L221 HydrophobicContact CD1-CD2 3.96Å; L172-L221 HydrophobicContact CD1-CG 4.18Å; L172-N224 VanDerWaalsContact CD1-ND2 3.32Å; L172-N224 WeakPolarHBondContact CD1-ND2 3.34Å
173N98.6Very high97.7Very high29 Ų2927.8 Ų27.816%0.15514%0.141CC..Hα-helixtrans-73.7-34.7-176.7-77.319000112.4K120 D124 Y149 G169 L170 V176 F177K120-N173 WeakPolarHBondContact CE-ND2 3.12Å; K120-N173 PolarHBondContact NZ-ND2 2.99Å; D124-N173 VanDerWaalsContact OD1-CB 3.32Å; D124-N173 WeakPolarHBondContact OD1-CB 3.42Å; D124-N173 PolarHBondContact OD1-ND2 3.33Å; D124-N173 PolarHBondContact OD2-ND2 2.91Å; Y149-N173 HydrophobicContact CE1-CB 4.14Å; G169-N173 PolarHBondContact O-N 2.93Å; G169-N173 VanDerWaalsContact O-N 3.12Å; L170-N173 PolarHBondContact O-N 3.42Å; N173-V176 PolarHBondContact O-N 3.49Å; N173-F177 PolarHBondContact O-N 3.02Å
174F98.8Very high97.8Very high1 Ų130.3 Ų30.30%0.00415%0.154CC..Hα-helixtrans-73.4-33.6178.8-166-170.4000111.7Y149 F153 L170 F177 Y178 L191Y149-F174 VanDerWaalsContact CB-CD2 3.47Å; Y149-F174 VanDerWaalsContact CB-CE2 3.47Å; Y149-F174 HydrophobicContact CD1-CB 4.1Å; Y149-F174 HydrophobicContact CD1-CD2 4.45Å; Y149-F174 HydrophobicContact CD1-CG 4.31Å; Y149-F174 AromaticContact CD2-CD2 3.63Å; Y149-F174 HydrophobicContact CD2-CD2 3.63Å; Y149-F174 AromaticContact CD2-CE2 3.99Å; Y149-F174 HydrophobicContact CD2-CE2 3.99Å; Y149-F174 HydrophobicContact CD2-CG 4.28Å; Y149-F174 HydrophobicContact CE2-CD2 4.43Å; Y149-F174 HydrophobicContact CG-CB 4.13Å; Y149-F174 HydrophobicContact CG-CD1 4.45Å; Y149-F174 AromaticContact CG-CD2 3.63Å; Y149-F174 HydrophobicContact CG-CD2 3.63Å; Y149-F174 HydrophobicContact CG-CE2 4.05Å; Y149-F174 AromaticContact CG-CG 3.86Å; Y149-F174 HydrophobicContact CG-CG 3.86Å; F153-F174 HydrophobicContact CB-CE1 4.45Å; L170-F174 VanDerWaalsContact O-CB 3.27Å; L170-F174 WeakPolarHBondContact O-CB 3.48Å; L170-F174 PolarHBondContact O-N 3.19Å; F174-F177 HydrophobicContact CD2-CB 4.27Å; F174-F177 AromaticContact CD2-CD1 3.77Å; F174-F177 HydrophobicContact CD2-CD1 3.77Å; F174-F177 HydrophobicContact CD2-CG 4.39Å; F174-F177 AromaticContact CE2-CD1 3.7Å; F174-F177 HydrophobicContact CE2-CD1 3.7Å; F174-F177 HydrophobicContact CE2-CE1 4.11Å; F174-F177 WeakPolarHBondContact O-CB 3.43Å; F174-F177 PolarHBondContact O-N 3.45Å; F174-Y178 HydrophobicContact CD1-CE2 4.12Å; F174-Y178 AromaticContact CD2-CD2 3.98Å; F174-Y178 HydrophobicContact CD2-CD2 3.98Å; F174-Y178 AromaticContact CD2-CE2 3.56Å; F174-Y178 HydrophobicContact CD2-CE2 3.56Å; F174-Y178 HydrophobicContact CE1-CE2 4Å; F174-Y178 HydrophobicContact CE2-CD2 4.18Å; F174-Y178 HydrophobicContact CE2-CE1 4.15Å; F174-Y178 AromaticContact CE2-CE2 3.41Å; F174-Y178 HydrophobicContact CE2-CE2 3.41Å; F174-Y178 VanDerWaalsContact CE2-CE2 3.41Å; F174-Y178 AromaticContact CE2-CZ 3.41Å; F174-Y178 VanDerWaalsContact CE2-CZ 3.41Å; F174-Y178 WeakPolarHBondContact CE2-OH 3.33Å; F174-Y178 HydrophobicContact CG-CD2 4.4Å; F174-Y178 AromaticContact CG-CE2 3.93Å; F174-Y178 HydrophobicContact CG-CE2 3.93Å; F174-Y178 AromaticContact CZ-CE2 3.67Å; F174-Y178 HydrophobicContact CZ-CE2 3.67Å; F174-Y178 AromaticContact CZ-CZ 3.53Å; F174-Y178 WeakPolarHBondContact CZ-OH 3.32Å; F174-Y178 WeakPolarHBondContact O-CD2 3.5Å; F174-Y178 PolarHBondContact O-N 3.34Å; F174-L191 HydrophobicContact CB-CD2 3.77Å; F174-L191 HydrophobicContact CD1-CD2 3.85Å; F174-L191 HydrophobicContact CG-CD2 3.85Å
175S98.6Very high97.8Very high0 Ų030 Ų300%016%0.156CC..Hα-helixtrans-66.3-40.517263.80000111.5A171 L172 F177 Y178 Y179 A188A171-S175 WeakPolarHBondContact O-CB 3.24Å; A171-S175 PolarHBondContact O-N 3.36Å; A171-S175 PolarHBondContact O-OG 3.09Å; A171-S175 VanDerWaalsContact O-OG 3.1Å; L172-S175 PolarHBondContact O-OG 3.1Å; S175-F177 VanDerWaalsContact C-N 3.29Å; S175-F177 PolarHBondContact O-N 3.43Å; S175-Y178 PolarHBondContact O-N 2.87Å; S175-Y178 VanDerWaalsContact O-N 3.16Å; S175-Y179 PolarHBondContact O-N 3.08Å; S175-A188 WeakPolarHBondContact CB-O 3.4Å; S175-A188 VanDerWaalsContact O-CB 3.27Å; S175-A188 WeakPolarHBondContact O-CB 3.49Å
176V98.3Very high97.8Very high18 Ų1836.3 Ų36.311%0.10918%0.184CC..Hα-helixtrans-60.4-38.9172.3172.80000111.4L172 N173 Y179 E180 W228L172-V176 VanDerWaalsContact O-CG2 3.28Å; L172-V176 WeakPolarHBondContact O-CG2 3.41Å; L172-V176 PolarHBondContact O-N 2.98Å; N173-V176 PolarHBondContact O-N 3.49Å; V176-Y179 PolarHBondContact O-N 3.11Å; V176-E180 VanDerWaalsContact CG1-CD 3.43Å; V176-E180 HydrophobicContact CG1-CG 3.92Å; V176-E180 WeakPolarHBondContact CG1-OE2 3.3Å; V176-E180 WeakPolarHBondContact O-CB 3.26Å; V176-E180 PolarHBondContact O-N 3.35Å; V176-W228 HydrophobicContact CG2-CH2 3.98Å; V176-W228 HydrophobicContact CG2-CZ2 3.93Å
177F98.6Very high97.8Very high0 Ų038.4 Ų38.40%020%0.195CC..Hα-helixtrans-59.9-47.6172.8169.5-100.6000112.3R127 I142 S145 Q146 Y149 N173 F174 S175 Y179 I181 L182R127-F177 HydrophobicContact CB-CD2 4.25Å; R127-F177 HydrophobicContact CG-CD2 4.33Å; I142-F177 HydrophobicContact CG2-CE2 4.44Å; I142-F177 HydrophobicContact CG2-CZ 4.02Å; S145-F177 VanDerWaalsContact OG-CD2 3.32Å; S145-F177 WeakPolarHBondContact OG-CD2 3.36Å; S145-F177 VanDerWaalsContact OG-CE2 3.24Å; S145-F177 WeakPolarHBondContact OG-CE2 3.49Å; Q146-F177 HydrophobicContact CB-CE1 3.82Å; Q146-F177 HydrophobicContact CB-CZ 3.84Å; Q146-F177 HydrophobicContact CG-CE1 4.14Å; Y149-F177 HydrophobicContact CD2-CB 4.19Å; Y149-F177 HydrophobicContact CD2-CD1 4.28Å; Y149-F177 HydrophobicContact CD2-CG 4.08Å; Y149-F177 HydrophobicContact CE2-CB 3.69Å; Y149-F177 HydrophobicContact CE2-CD2 4.13Å; Y149-F177 AromaticContact CE2-CG 3.86Å; Y149-F177 HydrophobicContact CE2-CG 3.86Å; N173-F177 PolarHBondContact O-N 3.02Å; F174-F177 HydrophobicContact CD2-CB 4.27Å; F174-F177 AromaticContact CD2-CD1 3.77Å; F174-F177 HydrophobicContact CD2-CD1 3.77Å; F174-F177 HydrophobicContact CD2-CG 4.39Å; F174-F177 AromaticContact CE2-CD1 3.7Å; F174-F177 HydrophobicContact CE2-CD1 3.7Å; F174-F177 HydrophobicContact CE2-CE1 4.11Å; F174-F177 WeakPolarHBondContact O-CB 3.43Å; F174-F177 PolarHBondContact O-N 3.45Å; S175-F177 VanDerWaalsContact C-N 3.29Å; S175-F177 PolarHBondContact O-N 3.43Å; F177-Y179 VanDerWaalsContact C-N 3.29Å; F177-Y179 PolarHBondContact O-N 2.94Å; F177-I181 HydrophobicContact CD2-CB 3.76Å; F177-I181 HydrophobicContact CD2-CG1 3.79Å; F177-I181 HydrophobicContact CD2-CG2 4.13Å; F177-I181 HydrophobicContact CE2-CB 3.85Å; F177-I181 HydrophobicContact CE2-CG1 4.25Å; F177-I181 HydrophobicContact CE2-CG2 3.71Å; F177-I181 WeakPolarHBondContact O-CB 3.33Å; F177-I181 PolarHBondContact O-N 3.27Å; F177-L182 HydrophobicContact CD1-CD1 4.11Å; F177-L182 HydrophobicContact CD1-CG 4.39Å; F177-L182 HydrophobicContact CE1-CD1 3.35Å; F177-L182 HydrophobicContact CE1-CG 3.71Å; F177-L182 HydrophobicContact CZ-CD1 3.89Å; F177-L182 HydrophobicContact CZ-CD2 4.24Å; F177-L182 HydrophobicContact CZ-CG 3.82Å; F177-L182 PolarHBondContact O-N 3.23Å
178Y98.5Very high97.8Very high14 Ų1437.3 Ų37.36%0.05519%0.191CC..Hα-helixtrans-58.9-42.7177.6-77.4-58000112F174 S175 L182 N183 N184 L187 L191F174-Y178 HydrophobicContact CD1-CE2 4.12Å; F174-Y178 AromaticContact CD2-CD2 3.98Å; F174-Y178 HydrophobicContact CD2-CD2 3.98Å; F174-Y178 AromaticContact CD2-CE2 3.56Å; F174-Y178 HydrophobicContact CD2-CE2 3.56Å; F174-Y178 HydrophobicContact CE1-CE2 4Å; F174-Y178 HydrophobicContact CE2-CD2 4.18Å; F174-Y178 HydrophobicContact CE2-CE1 4.15Å; F174-Y178 AromaticContact CE2-CE2 3.41Å; F174-Y178 HydrophobicContact CE2-CE2 3.41Å; F174-Y178 VanDerWaalsContact CE2-CE2 3.41Å; F174-Y178 AromaticContact CE2-CZ 3.41Å; F174-Y178 VanDerWaalsContact CE2-CZ 3.41Å; F174-Y178 WeakPolarHBondContact CE2-OH 3.33Å; F174-Y178 HydrophobicContact CG-CD2 4.4Å; F174-Y178 AromaticContact CG-CE2 3.93Å; F174-Y178 HydrophobicContact CG-CE2 3.93Å; F174-Y178 AromaticContact CZ-CE2 3.67Å; F174-Y178 HydrophobicContact CZ-CE2 3.67Å; F174-Y178 AromaticContact CZ-CZ 3.53Å; F174-Y178 WeakPolarHBondContact CZ-OH 3.32Å; F174-Y178 WeakPolarHBondContact O-CD2 3.5Å; F174-Y178 PolarHBondContact O-N 3.34Å; S175-Y178 PolarHBondContact O-N 2.87Å; S175-Y178 VanDerWaalsContact O-N 3.16Å; Y178-L182 HydrophobicContact CD1-CD1 3.53Å; Y178-L182 HydrophobicContact CE1-CD1 3.67Å; Y178-L182 CarbonylContact O-C 3.52Å; Y178-N183 PolarHBondContact O-N 2.61Å; Y178-N184 PolarHBondContact O-N 3.21Å; Y178-L187 HydrophobicContact CD1-CB 4.32Å; Y178-L187 HydrophobicContact CD1-CD2 3.44Å; Y178-L187 VanDerWaalsContact CD1-CD2 3.44Å; Y178-L187 HydrophobicContact CD1-CG 3.78Å; Y178-L187 HydrophobicContact CD2-CD2 4.46Å; Y178-L187 HydrophobicContact CD2-CG 4.04Å; Y178-L187 HydrophobicContact CE1-CD2 3.19Å; Y178-L187 HydrophobicContact CE1-CG 3.84Å; Y178-L187 HydrophobicContact CE2-CD2 4.24Å; Y178-L187 HydrophobicContact CE2-CG 4.06Å; Y178-L187 HydrophobicContact CG-CB 4.34Å; Y178-L187 HydrophobicContact CG-CD2 4.11Å; Y178-L187 HydrophobicContact CG-CG 3.91Å; Y178-L191 HydrophobicContact CD2-CD2 3.99Å; Y178-L191 HydrophobicContact CE2-CD2 3.91Å
179Y98Very high97.8Very high61 Ų6138.3 Ų38.324%0.23920%0.198CC..Hα-helixtrans-70.9-59.8179.5-173.7-89.4000112S175 V176 F177 N183 P185 W228 D231S175-Y179 PolarHBondContact O-N 3.08Å; V176-Y179 PolarHBondContact O-N 3.11Å; F177-Y179 VanDerWaalsContact C-N 3.29Å; F177-Y179 PolarHBondContact O-N 2.94Å; Y179-N183 WeakPolarHBondContact O-CA 3.47Å; Y179-N183 PolarHBondContact O-N 3.44Å; Y179-P185 HydrophobicContact CD2-CB 4Å; Y179-P185 HydrophobicContact CE2-CB 4.13Å; Y179-W228 AromaticContact CD1-CD1 3.97Å; Y179-W228 HydrophobicContact CD1-CZ2 4.5Å; Y179-W228 AromaticContact CD1-NE1 3.51Å; Y179-W228 HydrophobicContact CD2-CB 4.04Å; Y179-W228 AromaticContact CD2-CD1 3.47Å; Y179-W228 VanDerWaalsContact CD2-CD1 3.47Å; Y179-W228 AromaticContact CD2-CD2 3.75Å; Y179-W228 HydrophobicContact CD2-CD2 3.75Å; Y179-W228 AromaticContact CD2-CE2 3.87Å; Y179-W228 AromaticContact CD2-CG 3.49Å; Y179-W228 HydrophobicContact CD2-CG 3.49Å; Y179-W228 VanDerWaalsContact CD2-CG 3.49Å; Y179-W228 AromaticContact CD2-NE1 3.68Å; Y179-W228 AromaticContact CE1-CD1 3.7Å; Y179-W228 AromaticContact CE1-NE1 3.58Å; Y179-W228 HydrophobicContact CE2-CB 3.75Å; Y179-W228 AromaticContact CE2-CD1 3.16Å; Y179-W228 HydrophobicContact CE2-CD2 4.2Å; Y179-W228 AromaticContact CE2-CG 3.44Å; Y179-W228 HydrophobicContact CE2-CG 3.44Å; Y179-W228 VanDerWaalsContact CE2-CG 3.44Å; Y179-W228 AromaticContact CE2-NE1 3.75Å; Y179-W228 AromaticContact CG-CD1 3.86Å; Y179-W228 HydrophobicContact CG-CD2 4.05Å; Y179-W228 AromaticContact CG-CE2 3.69Å; Y179-W228 HydrophobicContact CG-CG 4.14Å; Y179-W228 HydrophobicContact CG-CZ2 4.17Å; Y179-W228 AromaticContact CG-NE1 3.56Å; Y179-W228 AromaticContact CZ-CD1 3.29Å; Y179-W228 AromaticContact CZ-NE1 3.7Å; Y179-D231 PolarHBondContact OH-OD2 3.22Å
180E95.8Very high97.7Very high95 Ų9541.4 Ų41.444%0.44422%0.215SC..Hα-helixtrans-78-31.3-169.1-64-176.5162.300114R127 V176R127-E180 IonicContact NH1-OE2 3.89Å; R127-E180 PolarHBondContact NH1-OE2 3.44Å; V176-E180 VanDerWaalsContact CG1-CD 3.43Å; V176-E180 HydrophobicContact CG1-CG 3.92Å; V176-E180 WeakPolarHBondContact CG1-OE2 3.3Å; V176-E180 WeakPolarHBondContact O-CB 3.26Å; V176-E180 PolarHBondContact O-N 3.35Å
181I96.9Very high97.7Very high15 Ų1542.3 Ų42.38%0.07722%0.219CC..THydrogen-bonded Turntrans-105.5-45.1-171.6-54.3-56.7000112.2R127 A130 E131 I142 F177R127-I181 HydrophobicContact CG-CD1 4.07Å; R127-I181 HydrophobicContact CG-CG1 3.72Å; A130-I181 HydrophobicContact CB-CD1 4.39Å; A130-I181 HydrophobicContact CB-CG2 3.96Å; E131-I181 HydrophobicContact CG-CD1 3.91Å; I142-I181 HydrophobicContact CD1-CG2 3.89Å; I142-I181 HydrophobicContact CG1-CG2 3.63Å; F177-I181 HydrophobicContact CD2-CB 3.76Å; F177-I181 HydrophobicContact CD2-CG1 3.79Å; F177-I181 HydrophobicContact CD2-CG2 4.13Å; F177-I181 HydrophobicContact CE2-CB 3.85Å; F177-I181 HydrophobicContact CE2-CG1 4.25Å; F177-I181 HydrophobicContact CE2-CG2 3.71Å; F177-I181 WeakPolarHBondContact O-CB 3.33Å; F177-I181 PolarHBondContact O-N 3.27Å
182L96.6Very high97.7Very high58 Ų5842.2 Ų42.230%0.30422%0.219SC..THydrogen-bonded Turntrans-88.1-5.9178.9-68.1-177.6000113.1I142 F177 Y178 N184I142-L182 HydrophobicContact CG2-CD2 3.48Å; I142-L182 VanDerWaalsContact CG2-CD2 3.48Å; F177-L182 HydrophobicContact CD1-CD1 4.11Å; F177-L182 HydrophobicContact CD1-CG 4.39Å; F177-L182 HydrophobicContact CE1-CD1 3.35Å; F177-L182 HydrophobicContact CE1-CG 3.71Å; F177-L182 HydrophobicContact CZ-CD1 3.89Å; F177-L182 HydrophobicContact CZ-CD2 4.24Å; F177-L182 HydrophobicContact CZ-CG 3.82Å; F177-L182 PolarHBondContact O-N 3.23Å; Y178-L182 HydrophobicContact CD1-CD1 3.53Å; Y178-L182 HydrophobicContact CE1-CD1 3.67Å; Y178-L182 CarbonylContact O-C 3.52Å; L182-N184 HydrophobicContact CB-CB 4.35Å; L182-N184 PolarHBondContact O-N 3Å
183N96Very high97.7Very high139 Ų13947 Ų4774%0.74324%0.239SC*.  trans49.942.6-176.9-163.252.7000112Y178 Y179 P185Y178-N183 PolarHBondContact O-N 2.61Å; Y179-N183 WeakPolarHBondContact O-CA 3.47Å; Y179-N183 PolarHBondContact O-N 3.44Å; N183-P185 WeakPolarHBondContact O-CD 3.33Å
184N97.2Very high97.7Very high59 Ų5948.4 Ų48.432%0.31625%0.248SC..  trans-121.579.7-176.6-168.9-26.7000110Y178 L182 E186 L187 A188Y178-N184 PolarHBondContact O-N 3.21Å; L182-N184 HydrophobicContact CB-CB 4.35Å; L182-N184 PolarHBondContact O-N 3Å; N184-E186 VanDerWaalsContact C-N 3.31Å; N184-E186 PolarHBondContact O-N 2.87Å; N184-L187 HydrophobicContact CB-CB 4.36Å; N184-L187 PolarHBondContact O-N 3.46Å; N184-L187 VanDerWaalsContact OD1-CB 3.31Å; N184-L187 WeakPolarHBondContact OD1-CB 3.42Å; N184-L187 PolarHBondContact OD1-N 3.06Å; N184-A188 WeakPolarHBondContact O-CB 3.48Å; N184-A188 PolarHBondContact O-N 3.49Å; N184-A188 VanDerWaalsContact O-N 3.09Å
185P96.5Very high97.7Very high42 Ų4249 Ų4927%0.27325%0.253SS..Hα-helixtrans-64.5-33.6-178.225-34000112.8Y179 N183 L187 A188 C189Y179-P185 HydrophobicContact CD2-CB 4Å; Y179-P185 HydrophobicContact CE2-CB 4.13Å; N183-P185 WeakPolarHBondContact O-CD 3.33Å; P185-L187 PolarHBondContact O-N 2.9Å; P185-A188 PolarHBondContact O-N 2.79Å; P185-C189 VanDerWaalsContact O-CB 3.31Å; P185-C189 WeakPolarHBondContact O-CB 2.97Å; P185-C189 PolarHBondContact O-N 3.12Å; P185-C189 PolarHBondContact O-SG 3.49Å; P185-C189 VanDerWaalsContact O-SG 3.34Å
186E96.5Very high97.6Very high155 Ų15550.7 Ų50.772%0.72426%0.261SS*.Hα-helixtrans-60.1-49.2177.9-175.7-175.3177.600111.4N184 C189 T190N184-E186 VanDerWaalsContact C-N 3.31Å; N184-E186 PolarHBondContact O-N 2.87Å; E186-C189 PolarHBondContact O-N 3.33Å; E186-T190 WeakPolarHBondContact O-CB 3.38Å; E186-T190 PolarHBondContact O-N 3.44Å; E186-T190 PolarHBondContact O-OG1 3.5Å
187L97.2Very high97.6Very high65 Ų6553.6 Ų53.634%0.3428%0.276SS..Hα-helixtrans-70.1-36.5179.8-172.752.9000111.8Y178 N184 P185 L191Y178-L187 HydrophobicContact CD1-CB 4.32Å; Y178-L187 HydrophobicContact CD1-CD2 3.44Å; Y178-L187 VanDerWaalsContact CD1-CD2 3.44Å; Y178-L187 HydrophobicContact CD1-CG 3.78Å; Y178-L187 HydrophobicContact CD2-CD2 4.46Å; Y178-L187 HydrophobicContact CD2-CG 4.04Å; Y178-L187 HydrophobicContact CE1-CD2 3.19Å; Y178-L187 HydrophobicContact CE1-CG 3.84Å; Y178-L187 HydrophobicContact CE2-CD2 4.24Å; Y178-L187 HydrophobicContact CE2-CG 4.06Å; Y178-L187 HydrophobicContact CG-CB 4.34Å; Y178-L187 HydrophobicContact CG-CD2 4.11Å; Y178-L187 HydrophobicContact CG-CG 3.91Å; N184-L187 HydrophobicContact CB-CB 4.36Å; N184-L187 PolarHBondContact O-N 3.46Å; N184-L187 VanDerWaalsContact OD1-CB 3.31Å; N184-L187 WeakPolarHBondContact OD1-CB 3.42Å; N184-L187 PolarHBondContact OD1-N 3.06Å; P185-L187 PolarHBondContact O-N 2.9Å; L187-L191 WeakPolarHBondContact O-CB 3.44Å; L187-L191 PolarHBondContact O-N 3.48Å
188A98.1Very high97.6Very high0 Ų056.8 Ų56.80%029%0.29CS..Hα-helixtrans-59.9-51173.900000111.8S175 N184 P185 L191 A192 W228S175-A188 WeakPolarHBondContact CB-O 3.4Å; S175-A188 VanDerWaalsContact O-CB 3.27Å; S175-A188 WeakPolarHBondContact O-CB 3.49Å; N184-A188 WeakPolarHBondContact O-CB 3.48Å; N184-A188 PolarHBondContact O-N 3.49Å; N184-A188 VanDerWaalsContact O-N 3.09Å; P185-A188 PolarHBondContact O-N 2.79Å; A188-L191 PolarHBondContact O-N 2.88Å; A188-A192 WeakPolarHBondContact O-CB 3.4Å; A188-A192 PolarHBondContact O-N 3.42Å; A188-W228 HydrophobicContact CB-CE3 4.17Å; A188-W228 HydrophobicContact CB-CZ3 4.02Å
189C98.1Very high97.5Very high22 Ų2256.1 Ų56.115%0.14929%0.288CS..Hα-helixtrans-64.7-42.3178.8-73.60000111.7P185 E186 L191 A192 K193 L225P185-C189 VanDerWaalsContact O-CB 3.31Å; P185-C189 WeakPolarHBondContact O-CB 2.97Å; P185-C189 PolarHBondContact O-N 3.12Å; P185-C189 PolarHBondContact O-SG 3.49Å; P185-C189 VanDerWaalsContact O-SG 3.34Å; E186-C189 PolarHBondContact O-N 3.33Å; C189-L191 PolarHBondContact O-N 2.85Å; C189-A192 PolarHBondContact O-N 2.81Å; C189-K193 WeakPolarHBondContact O-CB 3.44Å; C189-K193 PolarHBondContact O-N 3.08Å; C189-L225 HydrophobicContact CB-CD2 4.1Å; C189-L225 WeakPolarHBondContact O-CD2 3.28Å
190T98.1Very high97.4Very high75 Ų7557.2 Ų57.246%0.4630%0.297SS..Hα-helixtrans-58.4-50.4176.6-61.80000110.7E186 K193 T194E186-T190 WeakPolarHBondContact O-CB 3.38Å; E186-T190 PolarHBondContact O-N 3.44Å; E186-T190 PolarHBondContact O-OG1 3.5Å; T190-K193 PolarHBondContact O-N 3.33Å; T190-T194 WeakPolarHBondContact O-CB 3.46Å; T190-T194 PolarHBondContact O-N 2.95Å; T190-T194 PolarHBondContact O-OG1 3.39Å
191L98.4Very high97.5Very high19 Ų1956.7 Ų56.710%0.09931%0.309CS..Hα-helixtrans-62.3-48.4180-178.966.9000112.3F153 F174 Y178 L187 A188 C189 A195F153-L191 HydrophobicContact CE1-CD1 4.2Å; F153-L191 HydrophobicContact CE2-CD1 3.64Å; F153-L191 HydrophobicContact CZ-CD1 3.39Å; F174-L191 HydrophobicContact CB-CD2 3.77Å; F174-L191 HydrophobicContact CD1-CD2 3.85Å; F174-L191 HydrophobicContact CG-CD2 3.85Å; Y178-L191 HydrophobicContact CD2-CD2 3.99Å; Y178-L191 HydrophobicContact CE2-CD2 3.91Å; L187-L191 WeakPolarHBondContact O-CB 3.44Å; L187-L191 PolarHBondContact O-N 3.48Å; A188-L191 PolarHBondContact O-N 2.88Å; C189-L191 PolarHBondContact O-N 2.85Å; L191-A195 WeakPolarHBondContact O-CB 3.38Å; L191-A195 PolarHBondContact O-N 3.15Å
192A98.4Very high97.4Very high0 Ų059.2 Ų59.20%032%0.32CS..Hα-helixtrans-63.8-42.2-178.300000111.7A188 C189 A195 F196 L221 L225 W228A188-A192 WeakPolarHBondContact O-CB 3.4Å; A188-A192 PolarHBondContact O-N 3.42Å; C189-A192 PolarHBondContact O-N 2.81Å; A192-A195 PolarHBondContact O-N 3.42Å; A192-F196 WeakPolarHBondContact O-CB 3.47Å; A192-F196 PolarHBondContact O-N 3.17Å; A192-L221 HydrophobicContact CB-CD2 3.87Å; A192-L225 HydrophobicContact CB-CD1 4.37Å; A192-L225 HydrophobicContact CB-CD2 3.83Å; A192-L225 HydrophobicContact CB-CG 3.94Å; A192-W228 HydrophobicContact CB-CZ3 4.32Å
193K98.1Very high97.2Very high121 Ų12158.1 Ų58.153%0.52631%0.314SS..Hα-helixtrans-65.9-47.4178.1-175.4177.1-178.9-177.40111.7C189 T190 A195 F196 D197 L225C189-K193 WeakPolarHBondContact O-CB 3.44Å; C189-K193 PolarHBondContact O-N 3.08Å; T190-K193 PolarHBondContact O-N 3.33Å; K193-A195 VanDerWaalsContact C-N 3.33Å; K193-A195 PolarHBondContact O-N 3.26Å; K193-F196 PolarHBondContact O-N 2.8Å; K193-D197 WeakPolarHBondContact CG-OD2 3.12Å; K193-D197 WeakPolarHBondContact O-CB 3.43Å; K193-D197 VanDerWaalsContact O-CG 3.29Å; K193-D197 PolarHBondContact O-N 3.33Å; K193-L225 HydrophobicContact CB-CD1 4.18Å; K193-L225 HydrophobicContact CB-CD2 4.09Å
194T98.4Very high97Very high58 Ų5859.7 Ų59.736%0.35632%0.323SS..Hα-helixtrans-57.6-46.6176.6-63.60000111.4T190 F196 D197 E198T190-T194 WeakPolarHBondContact O-CB 3.46Å; T190-T194 PolarHBondContact O-N 2.95Å; T190-T194 PolarHBondContact O-OG1 3.39Å; T194-F196 VanDerWaalsContact C-N 3.34Å; T194-F196 PolarHBondContact O-N 3.04Å; T194-D197 PolarHBondContact O-N 2.65Å; T194-E198 HydrophobicContact CG2-CG 4.22Å; T194-E198 WeakPolarHBondContact CG2-OE1 3.49Å; T194-E198 WeakPolarHBondContact O-CB 3.42Å; T194-E198 VanDerWaalsContact O-CG 3.24Å; T194-E198 WeakPolarHBondContact O-CG 3.32Å; T194-E198 PolarHBondContact O-N 3.29Å
195A98.4Very high96.5Very high12 Ų1261.8 Ų61.810%0.09934%0.338CS..Hα-helixtrans-63.5-39.4178.700000112.7A171 L191 A192 K193 A199 L221A171-A195 HydrophobicContact CB-CB 3.43Å; A171-A195 VanDerWaalsContact CB-CB 3.43Å; L191-A195 WeakPolarHBondContact O-CB 3.38Å; L191-A195 PolarHBondContact O-N 3.15Å; A192-A195 PolarHBondContact O-N 3.42Å; K193-A195 VanDerWaalsContact C-N 3.33Å; K193-A195 PolarHBondContact O-N 3.26Å; A195-A199 VanDerWaalsContact O-CB 3.28Å; A195-A199 WeakPolarHBondContact O-CB 3.29Å; A195-A199 PolarHBondContact O-N 3.32Å; A195-A199 VanDerWaalsContact O-N 3.12Å; A195-L221 HydrophobicContact CB-CD1 4.36Å
196F98.1Very high96.1Very high36 Ų3661.1 Ų61.116%0.15833%0.332CS..Hα-helixtrans-66.2-48177.1-176.4-99.3000111.9A192 K193 T194 A199 I200 M218 L221 R222A192-F196 WeakPolarHBondContact O-CB 3.47Å; A192-F196 PolarHBondContact O-N 3.17Å; K193-F196 PolarHBondContact O-N 2.8Å; T194-F196 VanDerWaalsContact C-N 3.34Å; T194-F196 PolarHBondContact O-N 3.04Å; F196-A199 PolarHBondContact O-N 2.79Å; F196-I200 HydrophobicContact CD1-CD1 3.62Å; F196-I200 HydrophobicContact CD1-CG1 4.35Å; F196-I200 HydrophobicContact CE1-CD1 3.08Å; F196-I200 HydrophobicContact CE1-CG1 4.14Å; F196-I200 HydrophobicContact CE2-CD1 4.16Å; F196-I200 HydrophobicContact CG-CD1 4.38Å; F196-I200 HydrophobicContact CZ-CD1 3.4Å; F196-I200 HydrophobicContact CZ-CG1 4.28Å; F196-I200 WeakPolarHBondContact O-CB 3.31Å; F196-I200 WeakPolarHBondContact O-CG1 3.38Å; F196-I200 PolarHBondContact O-N 3.06Å; F196-M218 HydrophobicContact CD2-CB 4.07Å; F196-M218 WeakPolarHBondContact CD2-O 3.35Å; F196-M218 HydrophobicContact CE2-CB 4.08Å; F196-M218 WeakPolarHBondContact CE2-O 3.46Å; F196-L221 HydrophobicContact CD2-CB 4.42Å; F196-R222 HydrophobicContact CD2-CB 4.42Å; F196-R222 HydrophobicContact CE2-CB 3.85Å; F196-R222 HydrophobicContact CE2-CG 4.46Å; F196-R222 HydrophobicContact CZ-CB 4.12Å; F196-R222 HydrophobicContact CZ-CG 4.23Å
197D98.2Very high95.6Very high80 Ų8058 Ų5843%0.42832%0.32SS..Hα-helixtrans-65.5-43.4-178.9-69-15.7000111.5K193 T194 A199 I200 A201K193-D197 WeakPolarHBondContact CG-OD2 3.12Å; K193-D197 WeakPolarHBondContact O-CB 3.43Å; K193-D197 VanDerWaalsContact O-CG 3.29Å; K193-D197 PolarHBondContact O-N 3.33Å; T194-D197 PolarHBondContact O-N 2.65Å; D197-A199 PolarHBondContact O-N 2.99Å; D197-I200 PolarHBondContact O-N 3.43Å; D197-A201 PolarHBondContact O-N 3.15Å; D197-A201 VanDerWaalsContact O-N 3.08Å
198E97.7Very high95.1Very high66 Ų6663.5 Ų63.531%0.30834%0.344SS..Hα-helixtrans-60.8-43.2174.9-72.5177.5176.100111.4P162 R167 T194 A201P162-E198 HydrophobicContact CB-CB 3.86Å; P162-E198 HydrophobicContact CG-CB 4.3Å; R167-E198 IonicContact CZ-OE2 3.84Å; R167-E198 IonicContact NH2-OE2 2.74Å; R167-E198 PolarHBondContact NH2-OE2 3.4Å; T194-E198 HydrophobicContact CG2-CG 4.22Å; T194-E198 WeakPolarHBondContact CG2-OE1 3.49Å; T194-E198 WeakPolarHBondContact O-CB 3.42Å; T194-E198 VanDerWaalsContact O-CG 3.24Å; T194-E198 WeakPolarHBondContact O-CG 3.32Å; T194-E198 PolarHBondContact O-N 3.29Å; E198-A201 PolarHBondContact O-N 2.95Å
199A97.2Very high94.4Very high0 Ų070.5 Ų70.50%038%0.382CS..Hα-helixtrans-72.2-35.2179.800000113.1T163 L168 A195 F196 D197 A201 E202 L203 M218T163-A199 HydrophobicContact CG2-CB 4.44Å; T163-A199 WeakPolarHBondContact CG2-O 3.44Å; L168-A199 HydrophobicContact CD1-CB 4.47Å; L168-A199 HydrophobicContact CD2-CB 3.72Å; A195-A199 VanDerWaalsContact O-CB 3.28Å; A195-A199 WeakPolarHBondContact O-CB 3.29Å; A195-A199 PolarHBondContact O-N 3.32Å; A195-A199 VanDerWaalsContact O-N 3.12Å; F196-A199 PolarHBondContact O-N 2.79Å; D197-A199 PolarHBondContact O-N 2.99Å; A199-A201 VanDerWaalsContact C-N 3.33Å; A199-E202 PolarHBondContact O-N 3.27Å; A199-L203 WeakPolarHBondContact O-CA 3.38Å; A199-L203 WeakPolarHBondContact O-CB 3.49Å; A199-L203 PolarHBondContact O-N 3.23Å; A199-M218 HydrophobicContact CB-CE 3.87Å; A199-M218 HydrophobicContact CB-CG 4.3Å; A199-M218 HydrophobicContact CB-SD 3.93Å
200I96.5Very high94Very high85 Ų8571 Ų7144%0.43639%0.385SS..Hα-helixtrans-60.5-45.1172.4-79.7-175.8000110.8F196 D197 E202 L203 M218F196-I200 HydrophobicContact CD1-CD1 3.62Å; F196-I200 HydrophobicContact CD1-CG1 4.35Å; F196-I200 HydrophobicContact CE1-CD1 3.08Å; F196-I200 HydrophobicContact CE1-CG1 4.14Å; F196-I200 HydrophobicContact CE2-CD1 4.16Å; F196-I200 HydrophobicContact CG-CD1 4.38Å; F196-I200 HydrophobicContact CZ-CD1 3.4Å; F196-I200 HydrophobicContact CZ-CG1 4.28Å; F196-I200 WeakPolarHBondContact O-CB 3.31Å; F196-I200 WeakPolarHBondContact O-CG1 3.38Å; F196-I200 PolarHBondContact O-N 3.06Å; D197-I200 PolarHBondContact O-N 3.43Å; I200-E202 PolarHBondContact O-N 2.85Å; I200-E202 VanDerWaalsContact O-N 3.15Å; I200-L203 WeakPolarHBondContact O-CB 3.26Å; I200-L203 PolarHBondContact O-N 2.9Å; I200-M218 HydrophobicContact CB-CE 4.36Å; I200-M218 HydrophobicContact CG1-CE 3.45Å; I200-M218 VanDerWaalsContact CG1-CE 3.45Å
201A96.6Very high93.7Very high83 Ų8372.9 Ų72.969%0.68639%0.385SS*.Hα-helixtrans-60.9-25-17700000113.2D197 E198 A199D197-A201 PolarHBondContact O-N 3.15Å; D197-A201 VanDerWaalsContact O-N 3.08Å; E198-A201 PolarHBondContact O-N 2.95Å; A199-A201 VanDerWaalsContact C-N 3.33Å
202E95.4Very high93.5Very high68 Ų6879.7 Ų79.732%0.31841%0.413SS..THydrogen-bonded Turntrans-114.77.6-178.3-64.7-173.7-157.300113.5Q161 P162 T163 A199 I200 D204 T205Q161-E202 PolarHBondContact OE1-OE2 3.39Å; P162-E202 WeakPolarHBondContact CD-OE2 3.36Å; T163-E202 HydrophobicContact CG2-CB 3.94Å; A199-E202 PolarHBondContact O-N 3.27Å; I200-E202 PolarHBondContact O-N 2.85Å; I200-E202 VanDerWaalsContact O-N 3.15Å; E202-D204 PolarHBondContact O-N 3.43Å; E202-T205 WeakPolarHBondContact O-CB 3.05Å; E202-T205 PolarHBondContact O-N 3.01Å; E202-T205 PolarHBondContact O-OG1 3.46Å
203L92.3Very high93.3Very high35 Ų3583.9 Ų83.918%0.18344%0.436CS..G310 helixtrans-60-34.9-172.2-171.562.3000112.8A199 I200 T205 L206 Y211 T215 M218A199-L203 WeakPolarHBondContact O-CA 3.38Å; A199-L203 WeakPolarHBondContact O-CB 3.49Å; A199-L203 PolarHBondContact O-N 3.23Å; I200-L203 WeakPolarHBondContact O-CB 3.26Å; I200-L203 PolarHBondContact O-N 2.9Å; L203-T205 PolarHBondContact O-N 2.87Å; L203-T205 VanDerWaalsContact O-N 3.15Å; L203-L206 HydrophobicContact CD1-CD2 4.05Å; L203-L206 VanDerWaalsContact O-CB 3.24Å; L203-L206 WeakPolarHBondContact O-CB 3.44Å; L203-L206 PolarHBondContact O-N 3.21Å; L203-L206 VanDerWaalsContact O-N 3.14Å; L203-Y211 HydrophobicContact CD1-CE2 4.46Å; L203-Y211 HydrophobicContact CG-CE2 4.47Å; L203-T215 HydrophobicContact CD1-CG2 4.17Å; L203-M218 HydrophobicContact CD1-CE 4.35Å; L203-M218 HydrophobicContact CD1-SD 3.91Å; L203-M218 HydrophobicContact CD2-CE 4.39Å
204D90.7Very high93.3Very high172 Ų17278.1 Ų78.192%0.9241%0.411SS*.G310 helixtrans-65.7-14179-67.2-23.9000113.5E202E202-D204 PolarHBondContact O-N 3.43Å
205T87.7Confident93.2Very high103 Ų10377.4 Ų77.463%0.63241%0.406SS*.G310 helixtrans-89.2-7.6178.172.20000113.3E202 L203E202-T205 WeakPolarHBondContact O-CB 3.05Å; E202-T205 PolarHBondContact O-N 3.01Å; E202-T205 PolarHBondContact O-OG1 3.46Å; L203-T205 PolarHBondContact O-N 2.87Å; L203-T205 VanDerWaalsContact O-N 3.15Å
206L87.9Confident93.1Very high29 Ų2981.7 Ų81.715%0.15243%0.427CS..  trans-75.4137.1-171.3-166.758.3000111.7L203 Y211L203-L206 HydrophobicContact CD1-CD2 4.05Å; L203-L206 VanDerWaalsContact O-CB 3.24Å; L203-L206 WeakPolarHBondContact O-CB 3.44Å; L203-L206 PolarHBondContact O-N 3.21Å; L203-L206 VanDerWaalsContact O-N 3.14Å; L206-Y211 HydrophobicContact CB-CD2 4.42Å; L206-Y211 HydrophobicContact CD2-CD2 4.16Å
207N86.7Confident93.1Very high88 Ų8881.3 Ų81.347%0.47143%0.427SS..  trans-74.6159.1174.664.331.6000112.1D209 S210 Y211N207-D209 VanDerWaalsContact C-N 3.25Å; N207-D209 PolarHBondContact O-N 3.37Å; N207-S210 PolarHBondContact O-N 3.48Å; N207-S210 WeakPolarHBondContact OD1-CB 3.29Å; N207-S210 PolarHBondContact OD1-N 2.85Å; N207-S210 PolarHBondContact OD1-OG 3.47Å; N207-S210 VanDerWaalsContact OD1-OG 3.11Å; N207-Y211 WeakPolarHBondContact O-CB 3.38Å; N207-Y211 PolarHBondContact O-N 2.94Å; N207-Y211 VanDerWaalsContact O-N 3.08Å
208E85.1Confident93.1Very high181 Ų18178 Ų7885%0.84641%0.408SS*.Hα-helixtrans-59-35.9-178.9-68.5-175.1174.800112.7S210 Y211E208-S210 PolarHBondContact O-N 2.97Å; E208-Y211 PolarHBondContact O-N 3.3Å
209D85Confident93.1Very high147 Ų14777.8 Ų77.879%0.78641%0.408SS*.Hα-helixtrans-63.9-38-176.8-66.8-28.7000112.9N207N207-D209 VanDerWaalsContact C-N 3.25Å; N207-D209 PolarHBondContact O-N 3.37Å
210S89.6Confident93.2Very high32 Ų3281.3 Ų81.322%0.22443%0.426CS..Hα-helixtrans-95.1-15.5-179.2-55.40000113.1N207 E208 K212 D213 S214N207-S210 PolarHBondContact O-N 3.48Å; N207-S210 WeakPolarHBondContact OD1-CB 3.29Å; N207-S210 PolarHBondContact OD1-N 2.85Å; N207-S210 PolarHBondContact OD1-OG 3.47Å; N207-S210 VanDerWaalsContact OD1-OG 3.11Å; E208-S210 PolarHBondContact O-N 2.97Å; S210-K212 VanDerWaalsContact C-N 3.33Å; S210-K212 PolarHBondContact O-N 3.46Å; S210-D213 PolarHBondContact O-N 2.88Å; S210-S214 PolarHBondContact O-N 2.86Å; S210-S214 PolarHBondContact O-OG 3.05Å
211Y91.9Very high93.3Very high116 Ų11677.3 Ų77.346%0.45541%0.405SS..Hα-helixtrans-54.1-47.5-172.3-170.3-91.1000112.9L203 L206 N207 E208 T215L203-Y211 HydrophobicContact CD1-CE2 4.46Å; L203-Y211 HydrophobicContact CG-CE2 4.47Å; L206-Y211 HydrophobicContact CB-CD2 4.42Å; L206-Y211 HydrophobicContact CD2-CD2 4.16Å; N207-Y211 WeakPolarHBondContact O-CB 3.38Å; N207-Y211 PolarHBondContact O-N 2.94Å; N207-Y211 VanDerWaalsContact O-N 3.08Å; E208-Y211 PolarHBondContact O-N 3.3Å; Y211-T215 HydrophobicContact CD1-CG2 4.14Å; Y211-T215 HydrophobicContact CE1-CG2 3.82Å; Y211-T215 HydrophobicContact CE2-CG2 4.25Å; Y211-T215 HydrophobicContact CG-CG2 4.48Å; Y211-T215 WeakPolarHBondContact O-CB 3.17Å; Y211-T215 VanDerWaalsContact O-CG2 3.27Å; Y211-T215 WeakPolarHBondContact O-CG2 3.41Å; Y211-T215 PolarHBondContact O-N 2.85Å; Y211-T215 PolarHBondContact O-OG1 3.39Å
212K94.1Very high93.3Very high161 Ų16178.9 Ų78.970%0.739%0.394SS*.Hα-helixtrans-64.3-44.4-177.8-174.6-177.1176.3-173.40112.4S210 T215 L216S210-K212 VanDerWaalsContact C-N 3.33Å; S210-K212 PolarHBondContact O-N 3.46Å; K212-T215 PolarHBondContact O-OG1 3.42Å; K212-L216 WeakPolarHBondContact O-CB 3.41Å; K212-L216 PolarHBondContact O-N 2.91Å; K212-L216 VanDerWaalsContact O-N 3.15Å
213D94.7Very high93.5Very high89 Ų8979 Ų7948%0.47640%0.396SS..Hα-helixtrans-71.9-44.1-176.8-72-13.5000111.1P165 S210 L216 I217P165-D213 HydrophobicContact CB-CB 4.15Å; P165-D213 HydrophobicContact CG-CB 4.11Å; S210-D213 PolarHBondContact O-N 2.88Å; D213-L216 PolarHBondContact O-N 3.37Å; D213-I217 WeakPolarHBondContact O-CD1 3.24Å; D213-I217 VanDerWaalsContact O-CG1 3.26Å; D213-I217 WeakPolarHBondContact O-CG1 3.45Å; D213-I217 PolarHBondContact O-N 3.49Å; D213-I217 VanDerWaalsContact O-N 3.08Å
214S96.5Very high93.7Very high0 Ų079 Ų790%040%0.397CS..Hα-helixtrans-63.3-46.4178-61.50000112.2T163 P165 S210 L216 I217 M218T163-S214 WeakPolarHBondContact O-CB 3.45Å; T163-S214 PolarHBondContact O-OG 3.4Å; P165-S214 WeakPolarHBondContact CD-OG 3.31Å; P165-S214 WeakPolarHBondContact CG-OG 3.4Å; S210-S214 PolarHBondContact O-N 2.86Å; S210-S214 PolarHBondContact O-OG 3.05Å; S214-L216 VanDerWaalsContact C-N 3.33Å; S214-L216 PolarHBondContact O-N 3.05Å; S214-I217 PolarHBondContact O-N 3.46Å; S214-I217 VanDerWaalsContact O-N 3.16Å; S214-M218 VanDerWaalsContact O-CG 3.25Å; S214-M218 WeakPolarHBondContact O-CG 3.41Å; S214-M218 PolarHBondContact O-N 2.89Å
215T96.7Very high94Very high42 Ų4272.1 Ų72.126%0.25836%0.36SS..Hα-helixtrans-64.8-36.8179.6520000112.4L203 Y211 K212 M218 Q219L203-T215 HydrophobicContact CD1-CG2 4.17Å; Y211-T215 HydrophobicContact CD1-CG2 4.14Å; Y211-T215 HydrophobicContact CE1-CG2 3.82Å; Y211-T215 HydrophobicContact CE2-CG2 4.25Å; Y211-T215 HydrophobicContact CG-CG2 4.48Å; Y211-T215 WeakPolarHBondContact O-CB 3.17Å; Y211-T215 VanDerWaalsContact O-CG2 3.27Å; Y211-T215 WeakPolarHBondContact O-CG2 3.41Å; Y211-T215 PolarHBondContact O-N 2.85Å; Y211-T215 PolarHBondContact O-OG1 3.39Å; K212-T215 PolarHBondContact O-OG1 3.42Å; T215-M218 PolarHBondContact O-N 2.86Å; T215-Q219 WeakPolarHBondContact O-CB 3.21Å; T215-Q219 PolarHBondContact O-N 2.94Å
216L97.2Very high94.4Very high103 Ų10371.2 Ų71.254%0.53935%0.354SS..Hα-helixtrans-61.7-42.7172.417962.2000111.7K212 D213 S214 Q219 L220K212-L216 WeakPolarHBondContact O-CB 3.41Å; K212-L216 PolarHBondContact O-N 2.91Å; K212-L216 VanDerWaalsContact O-N 3.15Å; D213-L216 PolarHBondContact O-N 3.37Å; S214-L216 VanDerWaalsContact C-N 3.33Å; S214-L216 PolarHBondContact O-N 3.05Å; L216-Q219 WeakPolarHBondContact O-CB 3.42Å; L216-Q219 PolarHBondContact O-N 3.47Å; L216-L220 WeakPolarHBondContact O-CG 3.43Å; L216-L220 PolarHBondContact O-N 3.38Å; L216-L220 VanDerWaalsContact O-N 3.14Å
217I98Very high94.7Very high28 Ų2874.1 Ų74.114%0.14437%0.37CS..Hα-helixtrans-70.4-39.8179-61.5164.4000111.2P165 L168 L172 D213 S214 Q219 L220 L221P165-I217 HydrophobicContact CB-CD1 4.15Å; P165-I217 VanDerWaalsContact O-CD1 3.28Å; P165-I217 WeakPolarHBondContact O-CD1 3.46Å; L168-I217 HydrophobicContact CB-CB 4.19Å; L168-I217 HydrophobicContact CB-CD1 4.47Å; L168-I217 HydrophobicContact CB-CG2 3.65Å; L172-I217 HydrophobicContact CB-CG2 4.3Å; L172-I217 HydrophobicContact CD2-CG2 4.17Å; D213-I217 WeakPolarHBondContact O-CD1 3.24Å; D213-I217 VanDerWaalsContact O-CG1 3.26Å; D213-I217 WeakPolarHBondContact O-CG1 3.45Å; D213-I217 PolarHBondContact O-N 3.49Å; D213-I217 VanDerWaalsContact O-N 3.08Å; S214-I217 PolarHBondContact O-N 3.46Å; S214-I217 VanDerWaalsContact O-N 3.16Å; I217-Q219 VanDerWaalsContact C-N 3.28Å; I217-Q219 PolarHBondContact O-N 3.12Å; I217-L220 WeakPolarHBondContact O-CB 3.49Å; I217-L220 PolarHBondContact O-N 3.14Å; I217-L220 VanDerWaalsContact O-N 3.17Å; I217-L221 PolarHBondContact O-N 2.66Å
218M98.1Very high95.1Very high9 Ų970.3 Ų70.34%0.04435%0.349CS..Hα-helixtrans-60.6-39.1174.1-70.1169.772.500111.7L168 F196 A199 I200 L203 S214 T215 L221 R222L168-M218 HydrophobicContact CD1-CG 3.92Å; L168-M218 HydrophobicContact CD1-SD 4.36Å; L168-M218 HydrophobicContact CD2-CG 4.08Å; F196-M218 HydrophobicContact CD2-CB 4.07Å; F196-M218 WeakPolarHBondContact CD2-O 3.35Å; F196-M218 HydrophobicContact CE2-CB 4.08Å; F196-M218 WeakPolarHBondContact CE2-O 3.46Å; A199-M218 HydrophobicContact CB-CE 3.87Å; A199-M218 HydrophobicContact CB-CG 4.3Å; A199-M218 HydrophobicContact CB-SD 3.93Å; I200-M218 HydrophobicContact CB-CE 4.36Å; I200-M218 HydrophobicContact CG1-CE 3.45Å; I200-M218 VanDerWaalsContact CG1-CE 3.45Å; L203-M218 HydrophobicContact CD1-CE 4.35Å; L203-M218 HydrophobicContact CD1-SD 3.91Å; L203-M218 HydrophobicContact CD2-CE 4.39Å; S214-M218 VanDerWaalsContact O-CG 3.25Å; S214-M218 WeakPolarHBondContact O-CG 3.41Å; S214-M218 PolarHBondContact O-N 2.89Å; T215-M218 PolarHBondContact O-N 2.86Å; M218-L221 WeakPolarHBondContact O-CB 3.46Å; M218-L221 PolarHBondContact O-N 2.99Å; M218-R222 PolarHBondContact O-N 3.44Å
219Q98.1Very high95.4Very high63 Ų6365.6 Ų65.629%0.29433%0.332SS..Hα-helixtrans-59.6-46.6173.2176.755.742.900111.4T215 L216 I217 L221 R222 D223T215-Q219 WeakPolarHBondContact O-CB 3.21Å; T215-Q219 PolarHBondContact O-N 2.94Å; L216-Q219 WeakPolarHBondContact O-CB 3.42Å; L216-Q219 PolarHBondContact O-N 3.47Å; I217-Q219 VanDerWaalsContact C-N 3.28Å; I217-Q219 PolarHBondContact O-N 3.12Å; Q219-L221 PolarHBondContact O-N 2.74Å; Q219-R222 WeakPolarHBondContact O-CB 3.44Å; Q219-R222 PolarHBondContact O-N 3.4Å; Q219-D223 PolarHBondContact NE2-OD1 3.03Å; Q219-D223 PolarHBondContact NE2-OD2 2.95Å; Q219-D223 PolarHBondContact O-N 2.95Å
220L98.4Very high95.5Very high74 Ų7461.8 Ų61.839%0.38732%0.317SS..Hα-helixtrans-62.6-39.8176.4-66.9171.7000112.8L172 L216 I217 D223 N224L172-L220 HydrophobicContact CD1-CB 4.13Å; L172-L220 HydrophobicContact CD2-CB 3.9Å; L172-L220 HydrophobicContact CD2-CD1 3.93Å; L216-L220 WeakPolarHBondContact O-CG 3.43Å; L216-L220 PolarHBondContact O-N 3.38Å; L216-L220 VanDerWaalsContact O-N 3.14Å; I217-L220 WeakPolarHBondContact O-CB 3.49Å; I217-L220 PolarHBondContact O-N 3.14Å; I217-L220 VanDerWaalsContact O-N 3.17Å; L220-D223 PolarHBondContact O-N 3.38Å; L220-N224 PolarHBondContact O-N 3.08Å
221L98.4Very high95Very high0 Ų063.2 Ų63.20%032%0.322CS..Hα-helixtrans-59.3-45.8173.8-78.6168000111.5L168 L172 A192 A195 F196 I217 M218 Q219 N224 L225L168-L221 HydrophobicContact CD2-CD1 3.99Å; L172-L221 HydrophobicContact CB-CD2 3.9Å; L172-L221 HydrophobicContact CB-CG 4.21Å; L172-L221 HydrophobicContact CD1-CD2 3.96Å; L172-L221 HydrophobicContact CD1-CG 4.18Å; A192-L221 HydrophobicContact CB-CD2 3.87Å; A195-L221 HydrophobicContact CB-CD1 4.36Å; F196-L221 HydrophobicContact CD2-CB 4.42Å; I217-L221 PolarHBondContact O-N 2.66Å; M218-L221 WeakPolarHBondContact O-CB 3.46Å; M218-L221 PolarHBondContact O-N 2.99Å; Q219-L221 PolarHBondContact O-N 2.74Å; L221-N224 PolarHBondContact O-N 3.23Å; L221-L225 WeakPolarHBondContact O-CG 3.28Å; L221-L225 PolarHBondContact O-N 3.2Å
222R97.8Very high93.9Very high116 Ų11659.5 Ų59.544%0.43831%0.313SS..Hα-helixtrans-63.3-40.5177.6-170.8-171.574.4-165.84.4112.5F196 M218 Q219 L225 T226F196-R222 HydrophobicContact CD2-CB 4.42Å; F196-R222 HydrophobicContact CE2-CB 3.85Å; F196-R222 HydrophobicContact CE2-CG 4.46Å; F196-R222 HydrophobicContact CZ-CB 4.12Å; F196-R222 HydrophobicContact CZ-CG 4.23Å; M218-R222 PolarHBondContact O-N 3.44Å; Q219-R222 WeakPolarHBondContact O-CB 3.44Å; Q219-R222 PolarHBondContact O-N 3.4Å; R222-L225 PolarHBondContact O-N 3.38Å; R222-T226 PolarHBondContact O-N 2.99Å; R222-T226 PolarHBondContact O-OG1 3.43Å
223D97.9Very high92.5Very high70 Ų7054.4 Ų54.437%0.37430%0.301SS..Hα-helixtrans-67.2-41.6-179.7-65.3-14.7000110.7Q219 L220 T226 L227Q219-D223 PolarHBondContact NE2-OD1 3.03Å; Q219-D223 PolarHBondContact NE2-OD2 2.95Å; Q219-D223 PolarHBondContact O-N 2.95Å; L220-D223 PolarHBondContact O-N 3.38Å; D223-T226 PolarHBondContact O-N 3.48Å; D223-L227 PolarHBondContact O-N 3.46Å
224N97.1Very high90.7Very high36 Ų3651.9 Ų51.919%0.19330%0.296CS..Hα-helixtrans-61.2-45.9172.3-79.22.9000112.4L172 L220 L221 T226 L227 W228L172-N224 VanDerWaalsContact CD1-ND2 3.32Å; L172-N224 WeakPolarHBondContact CD1-ND2 3.34Å; L220-N224 PolarHBondContact O-N 3.08Å; L221-N224 PolarHBondContact O-N 3.23Å; N224-T226 VanDerWaalsContact C-N 3.27Å; N224-T226 PolarHBondContact O-N 3.15Å; N224-L227 PolarHBondContact O-N 3.27Å; N224-W228 HydrophobicContact CB-CD2 4.21Å; N224-W228 HydrophobicContact CB-CE3 4.1Å; N224-W228 HydrophobicContact CB-CH2 3.69Å; N224-W228 HydrophobicContact CB-CZ2 3.78Å; N224-W228 HydrophobicContact CB-CZ3 3.84Å; N224-W228 WeakPolarHBondContact ND2-CH2 3.48Å; N224-W228 WeakPolarHBondContact O-CB 3.28Å; N224-W228 VanDerWaalsContact O-CD2 3.25Å; N224-W228 PolarHBondContact O-N 3.11Å
225L97Very high88.7Confident27 Ų2758.6 Ų58.614%0.14133%0.328CS..Hα-helixtrans-56.2-45.3176-76.9167.8000111.1C189 A192 K193 L221 R222 L227 W228 T229C189-L225 HydrophobicContact CB-CD2 4.1Å; C189-L225 WeakPolarHBondContact O-CD2 3.28Å; A192-L225 HydrophobicContact CB-CD1 4.37Å; A192-L225 HydrophobicContact CB-CD2 3.83Å; A192-L225 HydrophobicContact CB-CG 3.94Å; K193-L225 HydrophobicContact CB-CD1 4.18Å; K193-L225 HydrophobicContact CB-CD2 4.09Å; L221-L225 WeakPolarHBondContact O-CG 3.28Å; L221-L225 PolarHBondContact O-N 3.2Å; R222-L225 PolarHBondContact O-N 3.38Å; L225-L227 PolarHBondContact O-N 3.1Å; L225-W228 PolarHBondContact O-N 3.28Å; L225-T229 WeakPolarHBondContact O-CB 3.34Å; L225-T229 VanDerWaalsContact O-CG2 3.3Å; L225-T229 WeakPolarHBondContact O-CG2 3.45Å; L225-T229 PolarHBondContact O-N 3.45Å; L225-T229 PolarHBondContact O-OG1 3.33Å
226T96.2Very high86.5Confident85 Ų8563.8 Ų63.852%0.52135%0.349SS..Hα-helixtrans-60.9-47.6179.9-56.80000111.2R222 D223 N224 T229 S230R222-T226 PolarHBondContact O-N 2.99Å; R222-T226 PolarHBondContact O-OG1 3.43Å; D223-T226 PolarHBondContact O-N 3.48Å; N224-T226 VanDerWaalsContact C-N 3.27Å; N224-T226 PolarHBondContact O-N 3.15Å; T226-T229 PolarHBondContact O-OG1 3.23Å; T226-S230 WeakPolarHBondContact O-CB 3.3Å; T226-S230 PolarHBondContact O-N 2.65Å; T226-S230 VanDerWaalsContact O-N 3.16Å; T226-S230 PolarHBondContact O-OG 2.97Å
227L94.7Very high84Confident90 Ų9062.8 Ų62.847%0.47135%0.349SS..Hα-helixtrans-58.8-55.1178.1-179.365.8000111.1D223 N224 L225 T229 S230 D231D223-L227 PolarHBondContact O-N 3.46Å; N224-L227 PolarHBondContact O-N 3.27Å; L225-L227 PolarHBondContact O-N 3.1Å; L227-T229 PolarHBondContact O-N 3.36Å; L227-S230 PolarHBondContact O-N 2.88Å; L227-S230 VanDerWaalsContact O-N 3.1Å; L227-S230 PolarHBondContact O-OG 3.08Å; L227-D231 PolarHBondContact O-N 3.29Å; L227-D231 VanDerWaalsContact O-N 3.09Å
228W95.3Very high81.5Confident8 Ų867.2 Ų67.23%0.0337%0.373CS..Hα-helixtrans-68.6-33.8-172.6-58.5-26.4000113.2V176 Y179 A188 A192 N224 L225 S230 S232V176-W228 HydrophobicContact CG2-CH2 3.98Å; V176-W228 HydrophobicContact CG2-CZ2 3.93Å; Y179-W228 AromaticContact CD1-CD1 3.97Å; Y179-W228 HydrophobicContact CD1-CZ2 4.5Å; Y179-W228 AromaticContact CD1-NE1 3.51Å; Y179-W228 HydrophobicContact CD2-CB 4.04Å; Y179-W228 AromaticContact CD2-CD1 3.47Å; Y179-W228 VanDerWaalsContact CD2-CD1 3.47Å; Y179-W228 AromaticContact CD2-CD2 3.75Å; Y179-W228 HydrophobicContact CD2-CD2 3.75Å; Y179-W228 AromaticContact CD2-CE2 3.87Å; Y179-W228 AromaticContact CD2-CG 3.49Å; Y179-W228 HydrophobicContact CD2-CG 3.49Å; Y179-W228 VanDerWaalsContact CD2-CG 3.49Å; Y179-W228 AromaticContact CD2-NE1 3.68Å; Y179-W228 AromaticContact CE1-CD1 3.7Å; Y179-W228 AromaticContact CE1-NE1 3.58Å; Y179-W228 HydrophobicContact CE2-CB 3.75Å; Y179-W228 AromaticContact CE2-CD1 3.16Å; Y179-W228 HydrophobicContact CE2-CD2 4.2Å; Y179-W228 AromaticContact CE2-CG 3.44Å; Y179-W228 HydrophobicContact CE2-CG 3.44Å; Y179-W228 VanDerWaalsContact CE2-CG 3.44Å; Y179-W228 AromaticContact CE2-NE1 3.75Å; Y179-W228 AromaticContact CG-CD1 3.86Å; Y179-W228 HydrophobicContact CG-CD2 4.05Å; Y179-W228 AromaticContact CG-CE2 3.69Å; Y179-W228 HydrophobicContact CG-CG 4.14Å; Y179-W228 HydrophobicContact CG-CZ2 4.17Å; Y179-W228 AromaticContact CG-NE1 3.56Å; Y179-W228 AromaticContact CZ-CD1 3.29Å; Y179-W228 AromaticContact CZ-NE1 3.7Å; A188-W228 HydrophobicContact CB-CE3 4.17Å; A188-W228 HydrophobicContact CB-CZ3 4.02Å; A192-W228 HydrophobicContact CB-CZ3 4.32Å; N224-W228 HydrophobicContact CB-CD2 4.21Å; N224-W228 HydrophobicContact CB-CE3 4.1Å; N224-W228 HydrophobicContact CB-CH2 3.69Å; N224-W228 HydrophobicContact CB-CZ2 3.78Å; N224-W228 HydrophobicContact CB-CZ3 3.84Å; N224-W228 WeakPolarHBondContact ND2-CH2 3.48Å; N224-W228 WeakPolarHBondContact O-CB 3.28Å; N224-W228 VanDerWaalsContact O-CD2 3.25Å; N224-W228 PolarHBondContact O-N 3.11Å; L225-W228 PolarHBondContact O-N 3.28Å; W228-S230 VanDerWaalsContact C-N 3.32Å; W228-S232 PolarHBondContact O-N 3.49Å; W228-S232 PolarHBondContact O-OG 3.29Å
229T90.9Very high79.1Confident81 Ų8170.2 Ų70.250%0.49740%0.4SS..Hα-helixtrans-72.4-27.3174.157.90000112.9L225 T226 L227 A233L225-T229 WeakPolarHBondContact O-CB 3.34Å; L225-T229 VanDerWaalsContact O-CG2 3.3Å; L225-T229 WeakPolarHBondContact O-CG2 3.45Å; L225-T229 PolarHBondContact O-N 3.45Å; L225-T229 PolarHBondContact O-OG1 3.33Å; T226-T229 PolarHBondContact O-OG1 3.23Å; L227-T229 PolarHBondContact O-N 3.36Å; T229-A233 PolarHBondContact O-N 3.12Å
230S87.5Confident76.6Confident67 Ų6770.4 Ų70.447%0.46941%0.412SS..Hα-helixtrans-73.9-36175.468.50000112.2T226 L227 W228 A233 G234T226-S230 WeakPolarHBondContact O-CB 3.3Å; T226-S230 PolarHBondContact O-N 2.65Å; T226-S230 VanDerWaalsContact O-N 3.16Å; T226-S230 PolarHBondContact O-OG 2.97Å; L227-S230 PolarHBondContact O-N 2.88Å; L227-S230 VanDerWaalsContact O-N 3.1Å; L227-S230 PolarHBondContact O-OG 3.08Å; W228-S230 VanDerWaalsContact C-N 3.32Å; S230-A233 PolarHBondContact O-N 2.96Å; S230-G234 PolarHBondContact O-N 3.5Å
231D77.9Confident74.1Confident62 Ų6274.5 Ų74.533%0.33243%0.429SS..Hα-helixtrans-65.4-44.7176.1-66.2-24.2000111.3Y179 L227 A233 G234 E235Y179-D231 PolarHBondContact OH-OD2 3.22Å; L227-D231 PolarHBondContact O-N 3.29Å; L227-D231 VanDerWaalsContact O-N 3.09Å; D231-A233 VanDerWaalsContact C-N 3.31Å; D231-A233 PolarHBondContact O-N 2.89Å; D231-G234 PolarHBondContact O-N 3.42Å; D231-G234 VanDerWaalsContact O-N 3.14Å; D231-E235 PolarHBondContact O-N 3.13Å; D231-E235 VanDerWaalsContact O-N 3.12Å
232S70.1Confident71.4Confident39 Ų3977.7 Ų77.727%0.27346%0.462SS..Hα-helixtrans-63.6-34.2177.8-58.20000113.2W228 G234 E236W228-S232 PolarHBondContact O-N 3.49Å; W228-S232 PolarHBondContact O-OG 3.29Å; S232-G234 VanDerWaalsContact C-N 3.34Å; S232-E236 PolarHBondContact O-N 3.49Å; S232-E236 VanDerWaalsContact O-N 3.15Å
233A64.1Low68.8Low54 Ų5476.3 Ų76.345%0.44648%0.476SS..Hα-helixtrans-69.6-31.4175.500000112.6T229 S230 D231 C237T229-A233 PolarHBondContact O-N 3.12Å; S230-A233 PolarHBondContact O-N 2.96Å; D231-A233 VanDerWaalsContact C-N 3.31Å; D231-A233 PolarHBondContact O-N 2.89Å; A233-C237 PolarHBondContact O-N 3.21Å
234G56.9Low65.9Low36 Ų3681 Ų8137%0.37150%0.495SS..Hα-helixtrans-68.8-43.617400000112.7S230 D231 S232 E236 C237 D238S230-G234 PolarHBondContact O-N 3.5Å; D231-G234 PolarHBondContact O-N 3.42Å; D231-G234 VanDerWaalsContact O-N 3.14Å; S232-G234 VanDerWaalsContact C-N 3.34Å; G234-E236 PolarHBondContact O-N 2.91Å; G234-C237 PolarHBondContact O-N 3.39Å; G234-D238 PolarHBondContact O-N 3.42Å
235E55Low63.2Low141 Ų14190.9 Ų90.966%0.65955%0.548SS*.Hα-helixtrans-65.7-35.4177.2-69.4-177.317300112.7D231 A239D231-E235 PolarHBondContact O-N 3.13Å; D231-E235 VanDerWaalsContact O-N 3.12Å; E235-A239 WeakPolarHBondContact O-CB 3.34Å; E235-A239 PolarHBondContact O-N 3.37Å
236E50.6Low61.5Low151 Ų15194.1 Ų94.171%0.70657%0.568SS**Hα-helixtrans-67-35.8173.8-76.7-177.4179.600112.7S232 G234 A240S232-E236 PolarHBondContact O-N 3.49Å; S232-E236 VanDerWaalsContact O-N 3.15Å; G234-E236 PolarHBondContact O-N 2.91Å; E236-A240 WeakPolarHBondContact O-CB 3.39Å; E236-A240 PolarHBondContact O-N 2.83Å; E236-A240 VanDerWaalsContact O-N 3.15Å
237C44.9Very low59.7Low81 Ų8194.5 Ų94.555%0.54757%0.571SS.*Hα-helixtrans-68-43.6174.3-82.40000112.2A233 G234 A239 A240 E241A233-C237 PolarHBondContact O-N 3.21Å; G234-C237 PolarHBondContact O-N 3.39Å; C237-A239 VanDerWaalsContact C-N 3.33Å; C237-A239 PolarHBondContact O-N 2.83Å; C237-A240 PolarHBondContact O-N 3.05Å; C237-E241 PolarHBondContact O-N 3.47Å; C237-E241 VanDerWaalsContact O-N 3.16Å
238D44.8Very low57.7Low121 Ų12194.8 Ų94.865%0.64758%0.576SS**Hα-helixtrans-67.5-33.5178.2-74.8-14.4000112G234 G242G234-D238 PolarHBondContact O-N 3.42Å; D238-G242 PolarHBondContact O-N 2.93Å
239A47.3Very low55.5Low72 Ų7299.9 Ų99.960%0.59561%0.608SS**Hα-helixtrans-70-30.9174.300000113E235 C237E235-A239 WeakPolarHBondContact O-CB 3.34Å; E235-A239 PolarHBondContact O-N 3.37Å; C237-A239 VanDerWaalsContact C-N 3.33Å; C237-A239 PolarHBondContact O-N 2.83Å
240A45.8Very low53.3Low67 Ų67101.1 Ų101.155%0.55462%0.615SS**Hα-helixtrans-73.8-34.9176.500000112.5E236 C237 G242E236-A240 WeakPolarHBondContact O-CB 3.39Å; E236-A240 PolarHBondContact O-N 2.83Å; E236-A240 VanDerWaalsContact O-N 3.15Å; C237-A240 PolarHBondContact O-N 3.05Å; A240-G242 VanDerWaalsContact C-N 3.28Å; A240-G242 PolarHBondContact O-N 2.75Å
241E45.2Very low51Low161 Ų161103.3 Ų103.375%0.75263%0.625SS**Hα-helixtrans-73.7-17.3176.5-69.8-168.5174.300113.4C237C237-E241 PolarHBondContact O-N 3.47Å; C237-E241 VanDerWaalsContact O-N 3.16Å
242G42.2Very low49.1Very low67 Ų67106.3 Ų106.369%0.69165%0.646SS**THydrogen-bonded Turntrans-83.6-6.817700000115.9D238 A240D238-G242 PolarHBondContact O-N 2.93Å; A240-G242 VanDerWaalsContact C-N 3.28Å; A240-G242 PolarHBondContact O-N 2.75Å
243A43.3Very low47.5Very low87 Ų87111.5 Ų111.572%0.71968%0.675SS**THydrogen-bonded Turntrans-98.10.4-175.200000114.7
244E37.6Very low46.1Very low168 Ų168116.3 Ų116.379%0.78569%0.694SS**  trans-104.483.6172.2-68.6-168.716700110.3
245N39.8Very low45.1Very low243 Ų243123.5 Ų123.5100%1.29972%0.723SS**  trans-172.30146.6-87.1-37.9000112.3

Retrieved 245 of 245 residues in 535.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).