A0A087XMA0_POEFO Loading...

DnaJ homolog subfamily C member 3

AlphaFold DB , UniProt , Accession A0A087XMA0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 502 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M50.3Low59.7Low245 Ų245126.4 Ų126.4100%1.20766%0.658SS**  0960-73.5164110.500107.5S3M1-S3 PolarHBondContact O-N 3.03Å
2V50Low60.4Low132 Ų132125.3 Ų125.380%0.865%0.652SS**  trans-74.2115.5174.71770000106.3I4V2-I4 PolarHBondContact O-N 3.02Å
3S52.4Low61.3Low68 Ų68119.8 Ų119.848%0.47663%0.632SS.*  trans-62.7123.2-171-165.80000110.7M1 E5 H6M1-S3 PolarHBondContact O-N 3.03Å; S3-E5 PolarHBondContact O-N 3.31Å; S3-E5 VanDerWaalsContact O-N 3.09Å; S3-H6 PolarHBondContact O-N 3.5Å
4I60.9Low62.4Low146 Ų146121.4 Ų121.475%0.74963%0.626SS**Hα-helixtrans-55.4-26.7-179-64.9172.2000111.3V2 H6 V7 A8V2-I4 PolarHBondContact O-N 3.02Å; I4-H6 VanDerWaalsContact C-N 3.29Å; I4-H6 PolarHBondContact O-N 3.24Å; I4-V7 PolarHBondContact O-N 3.47Å; I4-A8 PolarHBondContact O-N 2.89Å; I4-A8 VanDerWaalsContact O-N 3.08Å
5E58.3Low63.5Low155 Ų155118.5 Ų118.572%0.72461%0.611SS**Hα-helixtrans-59.4-35.9175.9-71.4-179.5147.100113.3S3 V7 A8 H9S3-E5 PolarHBondContact O-N 3.31Å; S3-E5 VanDerWaalsContact O-N 3.09Å; E5-V7 VanDerWaalsContact C-N 3.34Å; E5-V7 PolarHBondContact O-N 3.32Å; E5-A8 PolarHBondContact O-N 3.48Å; E5-H9 WeakPolarHBondContact O-CB 3.3Å; E5-H9 PolarHBondContact O-N 3.26Å
6H58.5Low64.1Low139 Ų139115.6 Ų115.664%0.64460%0.602SS**Hα-helixtrans-74.3-28.3-176-138.378.6000112.4S3 I4 K10S3-H6 PolarHBondContact O-N 3.5Å; I4-H6 VanDerWaalsContact C-N 3.29Å; I4-H6 PolarHBondContact O-N 3.24Å; H6-K10 PolarHBondContact O-N 2.99Å
7V63.8Low64.8Low81 Ų81118.3 Ų118.349%0.49160%0.604SS.*Hα-helixtrans-79-41.5174.8178.50000110.3I4 E5 H9 K10 I11I4-V7 PolarHBondContact O-N 3.47Å; E5-V7 VanDerWaalsContact C-N 3.34Å; E5-V7 PolarHBondContact O-N 3.32Å; V7-H9 PolarHBondContact O-N 3.4Å; V7-K10 PolarHBondContact O-N 3.11Å; V7-I11 HydrophobicContact CG1-CD1 3.87Å; V7-I11 WeakPolarHBondContact O-CG1 3.44Å; V7-I11 PolarHBondContact O-N 3.11Å
8A63.2Low65.5Low45 Ų45115.9 Ų115.937%0.37260%0.596SS.*Hα-helixtrans-60.8-43.2176.500000112I4 E5 K10 I11 L12I4-A8 PolarHBondContact O-N 2.89Å; I4-A8 VanDerWaalsContact O-N 3.08Å; E5-A8 PolarHBondContact O-N 3.48Å; A8-K10 VanDerWaalsContact C-N 3.35Å; A8-K10 PolarHBondContact O-N 2.9Å; A8-I11 PolarHBondContact O-N 3.07Å; A8-L12 WeakPolarHBondContact O-CB 3.41Å; A8-L12 WeakPolarHBondContact O-CD1 3.49Å; A8-L12 PolarHBondContact O-N 3.1Å
9H64.9Low65.8Low148 Ų148115.3 Ų115.369%0.68559%0.593SS**Hα-helixtrans-68.2-33.2-179.5-143.6-46.9000113E5 V7 S13E5-H9 WeakPolarHBondContact O-CB 3.3Å; E5-H9 PolarHBondContact O-N 3.26Å; V7-H9 PolarHBondContact O-N 3.4Å; H9-S13 PolarHBondContact O-N 3.22Å
10K65.4Low66.1Low125 Ų125113.5 Ų113.554%0.54359%0.588SS.*Hα-helixtrans-68.1-45.9171.9-89.3-176.2175.1-1790111.4H6 V7 A8 L12 S13 Y14H6-K10 PolarHBondContact O-N 2.99Å; V7-K10 PolarHBondContact O-N 3.11Å; A8-K10 VanDerWaalsContact C-N 3.35Å; A8-K10 PolarHBondContact O-N 2.9Å; K10-L12 VanDerWaalsContact C-N 3.34Å; K10-L12 PolarHBondContact O-N 2.99Å; K10-S13 WeakPolarHBondContact O-CB 3.48Å; K10-S13 PolarHBondContact O-N 2.89Å; K10-S13 VanDerWaalsContact O-N 3.14Å; K10-S13 PolarHBondContact O-OG 3.46Å; K10-Y14 HydrophobicContact CB-CE2 4.48Å; K10-Y14 WeakPolarHBondContact O-CD2 3.07Å; K10-Y14 WeakPolarHBondContact O-CE2 3.5Å; K10-Y14 PolarHBondContact O-N 2.88Å
11I68.7Low66.2Low106 Ų106112.8 Ų112.854%0.54458%0.584SS.*Hα-helixtrans-61.2-43.7178.5-66.5169000110.8V7 A8 S13 Y14 I15V7-I11 HydrophobicContact CG1-CD1 3.87Å; V7-I11 WeakPolarHBondContact O-CG1 3.44Å; V7-I11 PolarHBondContact O-N 3.11Å; A8-I11 PolarHBondContact O-N 3.07Å; I11-S13 VanDerWaalsContact C-N 3.27Å; I11-S13 PolarHBondContact O-N 3.47Å; I11-Y14 PolarHBondContact O-N 3.06Å; I11-Y14 VanDerWaalsContact O-N 3.12Å; I11-I15 PolarHBondContact O-N 2.93Å
12L68.6Low67.1Low113 Ų113105.5 Ų105.559%0.59255%0.549SS*.Hα-helixtrans-62-31.5176-95.9128.7000113.4A8 K10 Y14 I15 P16A8-L12 WeakPolarHBondContact O-CB 3.41Å; A8-L12 WeakPolarHBondContact O-CD1 3.49Å; A8-L12 PolarHBondContact O-N 3.1Å; K10-L12 VanDerWaalsContact C-N 3.34Å; K10-L12 PolarHBondContact O-N 2.99Å; L12-Y14 VanDerWaalsContact C-N 3.26Å; L12-Y14 PolarHBondContact O-N 2.78Å; L12-I15 HydrophobicContact CB-CD1 4.48Å; L12-I15 HydrophobicContact CD2-CD1 4.22Å; L12-I15 HydrophobicContact CG-CD1 4Å; L12-I15 PolarHBondContact O-N 3.09Å; L12-P16 WeakPolarHBondContact O-CD 3.42Å
13S72.5Confident67.6Low55 Ų55104.1 Ų104.139%0.38554%0.537SS..Hα-helixtrans-69.3-20.9176.377.30000114H9 K10 I11 Y17H9-S13 PolarHBondContact O-N 3.22Å; K10-S13 WeakPolarHBondContact O-CB 3.48Å; K10-S13 PolarHBondContact O-N 2.89Å; K10-S13 VanDerWaalsContact O-N 3.14Å; K10-S13 PolarHBondContact O-OG 3.46Å; I11-S13 VanDerWaalsContact C-N 3.27Å; I11-S13 PolarHBondContact O-N 3.47Å; S13-Y17 WeakPolarHBondContact O-CD2 3.37Å
14Y76.3Confident67.8Low141 Ų141106.5 Ų106.555%0.55354%0.542SS*.Hα-helixtrans-92.1-14.6177.7-64.9-68.4000113.4K10 I11 L12 Y17 V18K10-Y14 HydrophobicContact CB-CE2 4.48Å; K10-Y14 WeakPolarHBondContact O-CD2 3.07Å; K10-Y14 WeakPolarHBondContact O-CE2 3.5Å; K10-Y14 PolarHBondContact O-N 2.88Å; I11-Y14 PolarHBondContact O-N 3.06Å; I11-Y14 VanDerWaalsContact O-N 3.12Å; L12-Y14 VanDerWaalsContact C-N 3.26Å; L12-Y14 PolarHBondContact O-N 2.78Å; Y14-Y17 WeakPolarHBondContact O-CB 3.49Å; Y14-Y17 PolarHBondContact O-N 2.85Å; Y14-Y17 VanDerWaalsContact O-N 3.13Å; Y14-V18 WeakPolarHBondContact O-CG2 3.43Å; Y14-V18 PolarHBondContact O-N 3.49Å
15I78.1Confident67.5Low78 Ų78108.8 Ų108.840%0.454%0.542SS..Hα-helixtrans-56.3-45.3177.7-64.1176.8000112.8I11 L12 Y17 V18 L19I11-I15 PolarHBondContact O-N 2.93Å; L12-I15 HydrophobicContact CB-CD1 4.48Å; L12-I15 HydrophobicContact CD2-CD1 4.22Å; L12-I15 HydrophobicContact CG-CD1 4Å; L12-I15 PolarHBondContact O-N 3.09Å; I15-Y17 VanDerWaalsContact C-N 3.3Å; I15-Y17 PolarHBondContact O-N 3.15Å; I15-V18 PolarHBondContact O-N 3.21Å; I15-L19 HydrophobicContact CG2-CD1 3.84Å; I15-L19 HydrophobicContact CG2-CG 4.3Å; I15-L19 WeakPolarHBondContact O-CB 3.29Å; I15-L19 WeakPolarHBondContact O-CG 3.49Å; I15-L19 PolarHBondContact O-N 2.92Å
16P74.3Confident67.2Low73 Ų73109 Ų10947%0.47454%0.537SS..Hα-helixtrans-64.3-34.3176.68.2-9.9000112.7L12 L19 V20L12-P16 WeakPolarHBondContact O-CD 3.42Å; P16-L19 PolarHBondContact O-N 3.19Å; P16-V20 WeakPolarHBondContact O-CB 3.4Å; P16-V20 VanDerWaalsContact O-CG2 3.24Å; P16-V20 WeakPolarHBondContact O-CG2 3.19Å; P16-V20 PolarHBondContact O-N 2.74Å
17Y75.6Confident66.6Low161 Ų161109.3 Ų109.363%0.63154%0.539SS*.Hα-helixtrans-68.9-39.3175.3-69.9-82.9000112.2S13 Y14 I15 V20 L21S13-Y17 WeakPolarHBondContact O-CD2 3.37Å; Y14-Y17 WeakPolarHBondContact O-CB 3.49Å; Y14-Y17 PolarHBondContact O-N 2.85Å; Y14-Y17 VanDerWaalsContact O-N 3.13Å; I15-Y17 VanDerWaalsContact C-N 3.3Å; I15-Y17 PolarHBondContact O-N 3.15Å; Y17-V20 PolarHBondContact O-N 3.22Å; Y17-L21 WeakPolarHBondContact O-CB 3.24Å; Y17-L21 WeakPolarHBondContact O-CD1 3.2Å; Y17-L21 WeakPolarHBondContact O-CG 3.28Å; Y17-L21 PolarHBondContact O-N 2.77Å
18V77Confident65.8Low75 Ų75107.3 Ų107.346%0.45553%0.534SS..Hα-helixtrans-67.1-39.6174.91740000110.7Y14 I15 L21 I22Y14-V18 WeakPolarHBondContact O-CG2 3.43Å; Y14-V18 PolarHBondContact O-N 3.49Å; I15-V18 PolarHBondContact O-N 3.21Å; V18-L21 PolarHBondContact O-N 3.08Å; V18-I22 HydrophobicContact CG1-CD1 3.78Å; V18-I22 HydrophobicContact CG1-CG1 4.43Å; V18-I22 WeakPolarHBondContact O-CB 3.44Å; V18-I22 WeakPolarHBondContact O-CG1 3.18Å; V18-I22 PolarHBondContact O-N 3.1Å
19L71.3Confident64.8Low104 Ų104111.1 Ų111.155%0.54555%0.553SS.*Hα-helixtrans-65.3-41.7175-72.3170.4000112I15 P16 L21 I22 D23I15-L19 HydrophobicContact CG2-CD1 3.84Å; I15-L19 HydrophobicContact CG2-CG 4.3Å; I15-L19 WeakPolarHBondContact O-CB 3.29Å; I15-L19 WeakPolarHBondContact O-CG 3.49Å; I15-L19 PolarHBondContact O-N 2.92Å; P16-L19 PolarHBondContact O-N 3.19Å; L19-L21 VanDerWaalsContact C-N 3.35Å; L19-L21 PolarHBondContact O-N 2.91Å; L19-I22 PolarHBondContact O-N 3.1Å; L19-D23 WeakPolarHBondContact O-CB 3.21Å; L19-D23 PolarHBondContact O-N 3.04Å
20V71.2Confident63.8Low80 Ų80112.1 Ų112.149%0.48556%0.555SS.*Hα-helixtrans-65-36.7173.7167.70000112P16 Y17 D23 M24P16-V20 WeakPolarHBondContact O-CB 3.4Å; P16-V20 VanDerWaalsContact O-CG2 3.24Å; P16-V20 WeakPolarHBondContact O-CG2 3.19Å; P16-V20 PolarHBondContact O-N 2.74Å; Y17-V20 PolarHBondContact O-N 3.22Å; V20-D23 PolarHBondContact O-N 3.25Å; V20-M24 HydrophobicContact CG1-CE 3.78Å; V20-M24 WeakPolarHBondContact O-CB 3.39Å; V20-M24 WeakPolarHBondContact O-CG 3.37Å; V20-M24 PolarHBondContact O-N 3.11Å
21L69.3Low62.8Low98 Ų98110.6 Ų110.651%0.51356%0.559SS.*Hα-helixtrans-70.8-31.6174.4-73167.9000112.3Y17 V18 L19 M24 R25Y17-L21 WeakPolarHBondContact O-CB 3.24Å; Y17-L21 WeakPolarHBondContact O-CD1 3.2Å; Y17-L21 WeakPolarHBondContact O-CG 3.28Å; Y17-L21 PolarHBondContact O-N 2.77Å; V18-L21 PolarHBondContact O-N 3.08Å; L19-L21 VanDerWaalsContact C-N 3.35Å; L19-L21 PolarHBondContact O-N 2.91Å; L21-M24 HydrophobicContact CD2-CE 3.92Å; L21-R25 WeakPolarHBondContact O-CB 3.41Å; L21-R25 VanDerWaalsContact O-CG 3.29Å; L21-R25 WeakPolarHBondContact O-CG 3.37Å; L21-R25 PolarHBondContact O-N 2.67Å; L21-R25 VanDerWaalsContact O-N 3.11Å
22I69.3Low61.8Low92 Ų92108.2 Ų108.247%0.47256%0.561SS.*Hα-helixtrans-72.1-42.5172.7-69.8166000109.9V18 L19 R25 Y26V18-I22 HydrophobicContact CG1-CD1 3.78Å; V18-I22 HydrophobicContact CG1-CG1 4.43Å; V18-I22 WeakPolarHBondContact O-CB 3.44Å; V18-I22 WeakPolarHBondContact O-CG1 3.18Å; V18-I22 PolarHBondContact O-N 3.1Å; L19-I22 PolarHBondContact O-N 3.1Å; I22-R25 CarbonylContact O-C 3.53Å; I22-R25 PolarHBondContact O-N 3.04Å; I22-Y26 WeakPolarHBondContact O-CB 3.35Å; I22-Y26 PolarHBondContact O-N 3.5Å
23D59.4Low61Low104 Ų104111 Ų11156%0.55657%0.568SS**Hα-helixtrans-64.8-45.3176.4-118.6-1.1000111.8L19 V20 R25 Y26 E27L19-D23 WeakPolarHBondContact O-CB 3.21Å; L19-D23 PolarHBondContact O-N 3.04Å; V20-D23 PolarHBondContact O-N 3.25Å; D23-R25 PolarHBondContact O-N 3.28Å; D23-Y26 PolarHBondContact O-N 3.41Å; D23-E27 PolarHBondContact O-N 3.16Å
24M57.3Low60.1Low118 Ų118113.8 Ų113.858%0.58158%0.579SS**Hα-helixtrans-60.3-34.2172.7-84.4-164.3-81.700112.4V20 L21 G28V20-M24 HydrophobicContact CG1-CE 3.78Å; V20-M24 WeakPolarHBondContact O-CB 3.39Å; V20-M24 WeakPolarHBondContact O-CG 3.37Å; V20-M24 PolarHBondContact O-N 3.11Å; L21-M24 HydrophobicContact CD2-CE 3.92Å; M24-G28 WeakPolarHBondContact O-CA 3.42Å; M24-G28 PolarHBondContact O-N 2.66Å
25R55.1Low59.3Low193 Ų193108.9 Ų108.973%0.72857%0.571SS**Hα-helixtrans-77.2-31.1173.9-78-173.5175.5-1580.4112.2L21 I22 D23 V29L21-R25 WeakPolarHBondContact O-CB 3.41Å; L21-R25 VanDerWaalsContact O-CG 3.29Å; L21-R25 WeakPolarHBondContact O-CG 3.37Å; L21-R25 PolarHBondContact O-N 2.67Å; L21-R25 VanDerWaalsContact O-N 3.11Å; I22-R25 CarbonylContact O-C 3.53Å; I22-R25 PolarHBondContact O-N 3.04Å; D23-R25 PolarHBondContact O-N 3.28Å; R25-V29 WeakPolarHBondContact O-CB 3.3Å; R25-V29 WeakPolarHBondContact O-CG2 3.5Å; R25-V29 PolarHBondContact O-N 2.86Å
26Y52.2Low59.3Low161 Ų161108.1 Ų108.163%0.63157%0.573SS**Hα-helixtrans-80.8-40.1-178.1-140.2-101.2000112.2I22 D23 K30I22-Y26 WeakPolarHBondContact O-CB 3.35Å; I22-Y26 PolarHBondContact O-N 3.5Å; D23-Y26 PolarHBondContact O-N 3.41Å; Y26-K30 PolarHBondContact O-N 2.71Å
27E45.8Very low59.9Low145 Ų145105 Ų10568%0.67855%0.552SS**Hα-helixtrans-69.1-39.4169-76.4-171.3147.700111.5D23 V29 C31D23-E27 PolarHBondContact O-N 3.16Å; E27-V29 PolarHBondContact O-N 2.93Å; E27-C31 WeakPolarHBondContact O-CB 3.45Å; E27-C31 PolarHBondContact O-N 2.79Å; E27-C31 VanDerWaalsContact O-N 3.16Å
28G45.4Very low60.5Low39 Ų39102 Ų10240%0.40255%0.547SS..Hα-helixtrans-67.4-31176.600000114.5M24 G32M24-G28 WeakPolarHBondContact O-CA 3.42Å; M24-G28 PolarHBondContact O-N 2.66Å; G28-G32 PolarHBondContact O-N 3.08Å; G28-G32 VanDerWaalsContact O-N 3.16Å
29V43.6Very low61.2Low125 Ų125103.5 Ų103.576%0.75855%0.553SS**Hα-helixtrans-82.9-24.5-179169.20000112.8R25 E27R25-V29 WeakPolarHBondContact O-CB 3.3Å; R25-V29 WeakPolarHBondContact O-CG2 3.5Å; R25-V29 PolarHBondContact O-N 2.86Å; E27-V29 PolarHBondContact O-N 2.93Å
30K43.8Very low62.3Low169 Ų169100.8 Ų100.874%0.73554%0.537SS*.Hα-helixtrans-85-18.7168.6-84.2-174.9176-1790113.9Y26Y26-K30 PolarHBondContact O-N 2.71Å
31C45Very low63.4Low93 Ų9397.4 Ų97.463%0.62852%0.516SS*.Hα-helixtrans-105.2-8.6-174.8-149.80000114.9E27E27-C31 WeakPolarHBondContact O-CB 3.45Å; E27-C31 PolarHBondContact O-N 2.79Å; E27-C31 VanDerWaalsContact O-N 3.16Å
32G47.5Very low64.6Low56 Ų5697.1 Ų97.158%0.57751%0.512SS*.SBendtrans-90.2-12.6-163.600000119.3G28G28-G32 PolarHBondContact O-N 3.08Å; G28-G32 VanDerWaalsContact O-N 3.16Å
33K51.9Low65.8Low170 Ų17096.5 Ų96.574%0.73951%0.508SS*.SBendtrans-133.1-47.5179.4-86.3-177.1174.7176.70113.9
34D53.1Low67.4Low115 Ų11591.5 Ų91.562%0.61548%0.482SS*.Hα-helixtrans-83.1-37.7-174.4-59.7-22.9000112.4S36 V37 D38D34-S36 VanDerWaalsContact C-N 3.32Å; D34-S36 PolarHBondContact O-N 2.86Å; D34-V37 PolarHBondContact O-N 3.29Å; D34-D38 PolarHBondContact O-N 2.8Å
35G59Low69.2Low38 Ų3889.4 Ų89.439%0.39247%0.469SS..Hα-helixtrans-65.4-28.8-179.100000114.8N39G35-N39 VanDerWaalsContact O-CB 3.3Å; G35-N39 WeakPolarHBondContact O-CB 3.35Å; G35-N39 PolarHBondContact O-N 3.26Å
36S78.8Confident71.1Confident62 Ų6287.1 Ų87.143%0.43446%0.464SS..Hα-helixtrans-74.8-38.4175.9-167.40000111.8D34 H40D34-S36 VanDerWaalsContact C-N 3.32Å; D34-S36 PolarHBondContact O-N 2.86Å; S36-H40 PolarHBondContact O-CD2 3.08Å; S36-H40 PolarHBondContact O-N 3.23Å; S36-H40 VanDerWaalsContact O-N 3.11Å
37V87.2Confident73.2Confident7 Ų780.1 Ų80.14%0.04244%0.438CS..Hα-helixtrans-69.4-46.6178.7175.40000110.2D34 N39 H40 M41 A63 D67D34-V37 PolarHBondContact O-N 3.29Å; V37-N39 VanDerWaalsContact C-N 3.32Å; V37-N39 PolarHBondContact O-N 3.48Å; V37-H40 PolarHBondContact O-N 3.28Å; V37-M41 HydrophobicContact CG1-CG 4.29Å; V37-M41 WeakPolarHBondContact O-CB 3.47Å; V37-M41 VanDerWaalsContact O-CG 3.28Å; V37-M41 WeakPolarHBondContact O-CG 3.45Å; V37-M41 PolarHBondContact O-N 2.96Å; V37-A63 HydrophobicContact CG1-CB 4.25Å; V37-D67 HydrophobicContact CG1-CB 4.25Å; V37-D67 HydrophobicContact CG2-CB 4.25Å
38D88.3Confident75.5Confident99 Ų9975.2 Ų75.253%0.52942%0.416SS..Hα-helixtrans-62.3-39.4178.9-74.7-24.4000112.1D34 M41 E42D34-D38 PolarHBondContact O-N 2.8Å; D38-M41 PolarHBondContact O-N 3.39Å; D38-E42 WeakPolarHBondContact O-CG 3.43Å; D38-E42 PolarHBondContact O-N 2.99Å
39N91.4Very high77.8Confident106 Ų10677.8 Ų77.857%0.56743%0.434SS*.Hα-helixtrans-63.1-44.6174.4-17324.9000111.8G35 V37 M41 E42 M43G35-N39 VanDerWaalsContact O-CB 3.3Å; G35-N39 WeakPolarHBondContact O-CB 3.35Å; G35-N39 PolarHBondContact O-N 3.26Å; V37-N39 VanDerWaalsContact C-N 3.32Å; V37-N39 PolarHBondContact O-N 3.48Å; N39-M41 VanDerWaalsContact C-N 3.32Å; N39-M41 PolarHBondContact O-N 2.86Å; N39-E42 PolarHBondContact O-N 3.07Å; N39-M43 WeakPolarHBondContact O-CB 3.33Å; N39-M43 PolarHBondContact O-N 3.14Å
40H93.6Very high80.2Confident47 Ų4775.1 Ų75.122%0.21843%0.425CS..Hα-helixtrans-63.6-37.2174.3-73.3-39.8000112.6S36 V37 G44 H59 A63S36-H40 PolarHBondContact O-CD2 3.08Å; S36-H40 PolarHBondContact O-N 3.23Å; S36-H40 VanDerWaalsContact O-N 3.11Å; V37-H40 PolarHBondContact O-N 3.28Å; H40-G44 PolarHBondContact O-N 3.44Å; H40-H59 AromaticContact CE1-ND1 3.99Å; H40-H59 AromaticContact ND1-CE1 3.94Å; H40-H59 AromaticContact ND1-ND1 3.2Å; H40-H59 PolarHBondContact ND1-ND1 3.19Å; H40-A63 HydrophobicContact CB-CB 4.18Å
41M94.6Very high82.5Confident9 Ų969.5 Ų69.54%0.04442%0.415CS..Hα-helixtrans-64.8-44.4175.6-73.7-65.1-73.800112V37 D38 N39 K45 F60 A63 I72 A73 R76V37-M41 HydrophobicContact CG1-CG 4.29Å; V37-M41 WeakPolarHBondContact O-CB 3.47Å; V37-M41 VanDerWaalsContact O-CG 3.28Å; V37-M41 WeakPolarHBondContact O-CG 3.45Å; V37-M41 PolarHBondContact O-N 2.96Å; D38-M41 PolarHBondContact O-N 3.39Å; N39-M41 VanDerWaalsContact C-N 3.32Å; N39-M41 PolarHBondContact O-N 2.86Å; M41-K45 VanDerWaalsContact O-CG 3.24Å; M41-K45 WeakPolarHBondContact O-CG 3.46Å; M41-K45 PolarHBondContact O-N 3.36Å; M41-F60 HydrophobicContact SD-CD1 3.85Å; M41-F60 HydrophobicContact SD-CE1 4.03Å; M41-A63 HydrophobicContact CG-CB 3.87Å; M41-A63 HydrophobicContact SD-CB 3.61Å; M41-I72 HydrophobicContact CE-CB 4.04Å; M41-I72 HydrophobicContact CE-CG2 3.61Å; M41-A73 HydrophobicContact CE-CB 4.24Å; M41-A73 HydrophobicContact SD-CB 3.71Å; M41-R76 HydrophobicContact CE-CG 4.23Å
42E94.3Very high84.9Confident92 Ų9269.7 Ų69.743%0.4341%0.406SS..Hα-helixtrans-68.6-42.9177.6-74.5-56124.900112.3D38 N39 K45 K46D38-E42 WeakPolarHBondContact O-CG 3.43Å; D38-E42 PolarHBondContact O-N 2.99Å; N39-E42 PolarHBondContact O-N 3.07Å; E42-K45 PolarHBondContact O-N 2.95Å; E42-K45 IonicContact OE1-NZ 3.09Å; E42-K45 PolarHBondContact OE1-NZ 3.02Å; E42-K46 WeakPolarHBondContact O-CG 3.07Å; E42-K46 PolarHBondContact O-N 3.38Å
43M93.6Very high87.1Confident78 Ų7869.1 Ų69.138%0.38439%0.39SS..Hα-helixtrans-64-44.7176.2-168.561.3-177.700111.4N39 K45 K46 L47N39-M43 WeakPolarHBondContact O-CB 3.33Å; N39-M43 PolarHBondContact O-N 3.14Å; M43-K45 VanDerWaalsContact C-N 3.32Å; M43-K45 PolarHBondContact O-N 3.49Å; M43-K46 PolarHBondContact O-N 3.41Å; M43-L47 HydrophobicContact CE-CD1 4.05Å; M43-L47 HydrophobicContact CE-CD2 4.15Å; M43-L47 HydrophobicContact CE-CG 4.1Å; M43-L47 HydrophobicContact CG-CD1 3.92Å; M43-L47 HydrophobicContact CG-CG 4.47Å; M43-L47 WeakPolarHBondContact O-CG 3.42Å; M43-L47 PolarHBondContact O-N 3.34Å
44G94.4Very high89.2Confident0 Ų063.7 Ų63.70%038%0.377CS..Hα-helixtrans-58.8-40.7175.400000112.6H40 L48H40-G44 PolarHBondContact O-N 3.44Å; G44-L48 VanDerWaalsContact O-CB 3.26Å; G44-L48 WeakPolarHBondContact O-CB 3.38Å; G44-L48 PolarHBondContact O-N 3.4Å
45K94.6Very high91.1Very high74 Ų7462 Ų6232%0.32237%0.368SS..Hα-helixtrans-63-45.2174.6-74.5170.1-167.3170.60112.3M41 E42 M43 L48 A49 F60M41-K45 VanDerWaalsContact O-CG 3.24Å; M41-K45 WeakPolarHBondContact O-CG 3.46Å; M41-K45 PolarHBondContact O-N 3.36Å; E42-K45 PolarHBondContact O-N 2.95Å; E42-K45 IonicContact OE1-NZ 3.09Å; E42-K45 PolarHBondContact OE1-NZ 3.02Å; M43-K45 VanDerWaalsContact C-N 3.32Å; M43-K45 PolarHBondContact O-N 3.49Å; K45-L48 PolarHBondContact O-N 3.04Å; K45-A49 WeakPolarHBondContact O-CB 3.36Å; K45-A49 PolarHBondContact O-N 3.01Å; K45-F60 HydrophobicContact CG-CZ 4.43Å
46K95.7Very high92.8Very high144 Ų14460.2 Ų60.263%0.62635%0.349SS*.Hα-helixtrans-62.2-46.2178.6-73.3177.3-177.91760111.5E42 M43 A49 A50E42-K46 WeakPolarHBondContact O-CG 3.07Å; E42-K46 PolarHBondContact O-N 3.38Å; M43-K46 PolarHBondContact O-N 3.41Å; K46-A49 PolarHBondContact O-N 3.21Å; K46-A50 WeakPolarHBondContact O-CB 3.31Å; K46-A50 PolarHBondContact O-N 3.19Å
47L95.3Very high93.6Very high14 Ų1458.1 Ų58.17%0.07333%0.333CS..Hα-helixtrans-64.9-39.4178.2-69.7166.5000112.1M43 A50 G51 Q52 D55 A56 H59M43-L47 HydrophobicContact CE-CD1 4.05Å; M43-L47 HydrophobicContact CE-CD2 4.15Å; M43-L47 HydrophobicContact CE-CG 4.1Å; M43-L47 HydrophobicContact CG-CD1 3.92Å; M43-L47 HydrophobicContact CG-CG 4.47Å; M43-L47 WeakPolarHBondContact O-CG 3.42Å; M43-L47 PolarHBondContact O-N 3.34Å; L47-A50 CarbonylContact O-C 3.54Å; L47-A50 PolarHBondContact O-N 3.37Å; L47-G51 PolarHBondContact O-N 3.18Å; L47-G51 VanDerWaalsContact O-N 3.13Å; L47-Q52 HydrophobicContact CB-CB 4.31Å; L47-Q52 HydrophobicContact CD2-CB 4.14Å; L47-Q52 PolarHBondContact O-N 2.99Å; L47-D55 HydrophobicContact CD1-CB 3.88Å; L47-D55 HydrophobicContact CD2-CB 4.28Å; L47-A56 HydrophobicContact CB-CB 3.86Å; L47-H59 WeakPolarHBondContact CD1-CD2 3.25Å
48L93.8Very high94Very high43 Ų4361.4 Ų61.423%0.22536%0.356CS..Hα-helixtrans-62.4-44.2174.2179.856.8000111.5G44 K45 A50 G51 L53 A56 F60 V80G44-L48 VanDerWaalsContact O-CB 3.26Å; G44-L48 WeakPolarHBondContact O-CB 3.38Å; G44-L48 PolarHBondContact O-N 3.4Å; K45-L48 PolarHBondContact O-N 3.04Å; L48-A50 PolarHBondContact O-N 3.47Å; L48-G51 PolarHBondContact O-N 3.07Å; L48-L53 HydrophobicContact CD1-CD2 3.54Å; L48-A56 HydrophobicContact CB-CB 4.13Å; L48-F60 HydrophobicContact CD2-CE2 4.36Å; L48-V80 HydrophobicContact CD1-CG2 3.87Å; L48-V80 HydrophobicContact CD2-CG2 4Å; L48-V80 HydrophobicContact CG-CG2 4.41Å
49A93.8Very high94.3Very high93 Ų9359 Ų5977%0.76934%0.342SS*.Hα-helixtrans-64.3-31.1175.300000112.5K45 K46 G51K45-A49 WeakPolarHBondContact O-CB 3.36Å; K45-A49 PolarHBondContact O-N 3.01Å; K46-A49 PolarHBondContact O-N 3.21Å; A49-G51 PolarHBondContact O-N 3.42Å
50A94.2Very high94.5Very high69 Ų6954 Ų5457%0.5732%0.315SS*.THydrogen-bonded Turntrans-78.7-1.8173.400000113.9K46 L47 L48 Q52K46-A50 WeakPolarHBondContact O-CB 3.31Å; K46-A50 PolarHBondContact O-N 3.19Å; L47-A50 CarbonylContact O-C 3.54Å; L47-A50 PolarHBondContact O-N 3.37Å; L48-A50 PolarHBondContact O-N 3.47Å; A50-Q52 VanDerWaalsContact C-N 3.25Å; A50-Q52 HydrophobicContact CB-CG 4.46Å; A50-Q52 PolarHBondContact O-N 3.11Å
51G92.6Very high94.6Very high51 Ų5155 Ų5553%0.52632%0.32SS..THydrogen-bonded Turntrans76.45.7-17800000114.7L47 L48 A49 L53L47-G51 PolarHBondContact O-N 3.18Å; L47-G51 VanDerWaalsContact O-N 3.13Å; L48-G51 PolarHBondContact O-N 3.07Å; A49-G51 PolarHBondContact O-N 3.42Å; G51-L53 VanDerWaalsContact C-N 3.26Å; G51-L53 PolarHBondContact O-N 3.34Å
52Q95.3Very high94.6Very high96 Ų9656.3 Ų56.345%0.44933%0.331SS..  trans-80.871.9177.8-64.4-177-80.400110.4L47 A50 A54 D55 A56L47-Q52 HydrophobicContact CB-CB 4.31Å; L47-Q52 HydrophobicContact CD2-CB 4.14Å; L47-Q52 PolarHBondContact O-N 2.99Å; A50-Q52 VanDerWaalsContact C-N 3.25Å; A50-Q52 HydrophobicContact CB-CG 4.46Å; A50-Q52 PolarHBondContact O-N 3.11Å; Q52-A54 PolarHBondContact O-N 2.63Å; Q52-D55 HydrophobicContact CB-CB 4.44Å; Q52-D55 PolarHBondContact O-N 3.29Å; Q52-A56 VanDerWaalsContact O-CB 3.31Å; Q52-A56 WeakPolarHBondContact O-CB 3.33Å; Q52-A56 PolarHBondContact O-N 3.41Å
53L94.9Very high94.6Very high45 Ų4551.9 Ų51.924%0.23631%0.311CS..Hα-helixtrans-62.3-38.7-171.2-59-178.6000113.5L48 G51 L57 V80 A83 M84L48-L53 HydrophobicContact CD1-CD2 3.54Å; G51-L53 VanDerWaalsContact C-N 3.26Å; G51-L53 PolarHBondContact O-N 3.34Å; L53-L57 WeakPolarHBondContact O-CB 3.26Å; L53-L57 PolarHBondContact O-N 3.14Å; L53-V80 HydrophobicContact CB-CG1 4.31Å; L53-V80 VanDerWaalsContact O-CG1 3.25Å; L53-V80 WeakPolarHBondContact O-CG1 3.41Å; L53-A83 HydrophobicContact CD1-CB 3.99Å; L53-A83 HydrophobicContact CD2-CB 3.94Å; L53-M84 HydrophobicContact CB-CE 4.37Å; L53-M84 HydrophobicContact CB-CG 3.72Å; L53-M84 HydrophobicContact CB-SD 4.2Å; L53-M84 HydrophobicContact CD1-CG 3.8Å; L53-M84 HydrophobicContact CG-CG 4.37Å
54A94.6Very high94.6Very high56 Ų5648.4 Ų48.446%0.46329%0.294SS..Hα-helixtrans-67.9-44.7-178.900000112.2Q52 L57 S58 M84Q52-A54 PolarHBondContact O-N 2.63Å; A54-L57 WeakPolarHBondContact O-CB 3.31Å; A54-L57 PolarHBondContact O-N 3.05Å; A54-S58 PolarHBondContact O-N 3.13Å; A54-S58 PolarHBondContact O-OG 2.86Å; A54-M84 HydrophobicContact CB-CE 4.29Å
55D93.4Very high94.6Very high79 Ų7954.1 Ų54.142%0.42232%0.324SS..Hα-helixtrans-69.5-41.3178.9-57.8-39.4000110.9L47 Q52 L57 S58 H59L47-D55 HydrophobicContact CD1-CB 3.88Å; L47-D55 HydrophobicContact CD2-CB 4.28Å; Q52-D55 HydrophobicContact CB-CB 4.44Å; Q52-D55 PolarHBondContact O-N 3.29Å; D55-L57 VanDerWaalsContact C-N 3.26Å; D55-L57 PolarHBondContact O-N 3.02Å; D55-S58 WeakPolarHBondContact O-CB 3.41Å; D55-S58 PolarHBondContact O-N 3.03Å; D55-H59 PolarHBondContact O-CD2 2.94Å; D55-H59 VanDerWaalsContact O-CD2 3.3Å; D55-H59 PolarHBondContact O-N 3.38Å; D55-H59 VanDerWaalsContact O-N 3.16Å
56A95.7Very high94.5Very high0 Ų052.8 Ų52.80%033%0.332CS..Hα-helixtrans-57.4-41.1172.800000111.6L47 L48 Q52 S58 H59 F60 V80L47-A56 HydrophobicContact CB-CB 3.86Å; L48-A56 HydrophobicContact CB-CB 4.13Å; Q52-A56 VanDerWaalsContact O-CB 3.31Å; Q52-A56 WeakPolarHBondContact O-CB 3.33Å; Q52-A56 PolarHBondContact O-N 3.41Å; A56-S58 PolarHBondContact O-N 3.42Å; A56-H59 PolarHBondContact O-N 3.34Å; A56-F60 HydrophobicContact CB-CE2 4.25Å; A56-F60 WeakPolarHBondContact O-CD2 3.49Å; A56-F60 WeakPolarHBondContact O-CG 3.5Å; A56-F60 PolarHBondContact O-N 3.36Å; A56-V80 HydrophobicContact CB-CG2 4.37Å
57L95.6Very high94.3Very high18 Ų1848.4 Ų48.49%0.09432%0.315CS..Hα-helixtrans-61.9-42.2178.1-17365.3000112.1L53 A54 D55 F60 H61 R77 V80 F81 M84L53-L57 WeakPolarHBondContact O-CB 3.26Å; L53-L57 PolarHBondContact O-N 3.14Å; A54-L57 WeakPolarHBondContact O-CB 3.31Å; A54-L57 PolarHBondContact O-N 3.05Å; D55-L57 VanDerWaalsContact C-N 3.26Å; D55-L57 PolarHBondContact O-N 3.02Å; L57-F60 PolarHBondContact O-N 3.47Å; L57-H61 PolarHBondContact O-N 3.13Å; L57-H61 PolarHBondContact O-ND1 3.25Å; L57-R77 HydrophobicContact CD1-CG 3.83Å; L57-V80 HydrophobicContact CB-CG1 3.89Å; L57-V80 HydrophobicContact CD1-CB 4.32Å; L57-V80 HydrophobicContact CD1-CG1 4.08Å; L57-F81 HydrophobicContact CD1-CD1 3.89Å; L57-F81 HydrophobicContact CD1-CD2 4.37Å; L57-F81 HydrophobicContact CD1-CE1 3.65Å; L57-F81 HydrophobicContact CD1-CE2 4.16Å; L57-F81 HydrophobicContact CD1-CG 4.26Å; L57-F81 HydrophobicContact CD1-CZ 3.8Å; L57-F81 HydrophobicContact CD2-CD1 4.18Å; L57-F81 HydrophobicContact CD2-CE1 3.69Å; L57-F81 HydrophobicContact CD2-CZ 4.4Å; L57-F81 HydrophobicContact CG-CE1 4.26Å; L57-M84 HydrophobicContact CD2-SD 3.94Å
58S94.4Very high94.1Very high76 Ų7651 Ų5153%0.53133%0.333SS..Hα-helixtrans-61.7-43.8177.5-61.60000111.7A54 D55 A56 H61 A62A54-S58 PolarHBondContact O-N 3.13Å; A54-S58 PolarHBondContact O-OG 2.86Å; D55-S58 WeakPolarHBondContact O-CB 3.41Å; D55-S58 PolarHBondContact O-N 3.03Å; A56-S58 PolarHBondContact O-N 3.42Å; S58-H61 WeakPolarHBondContact O-CB 3.42Å; S58-H61 PolarHBondContact O-N 3.48Å; S58-A62 PolarHBondContact O-N 3.01Å
59H95.4Very high94.1Very high50 Ų5056.9 Ų56.923%0.23136%0.357CS..Hα-helixtrans-66.4-40.3175.9-77.2-65.6000112.9H40 L47 D55 A56 H61 A62 A63H40-H59 AromaticContact CE1-ND1 3.99Å; H40-H59 AromaticContact ND1-CE1 3.94Å; H40-H59 AromaticContact ND1-ND1 3.2Å; H40-H59 PolarHBondContact ND1-ND1 3.19Å; L47-H59 WeakPolarHBondContact CD1-CD2 3.25Å; D55-H59 PolarHBondContact O-CD2 2.94Å; D55-H59 VanDerWaalsContact O-CD2 3.3Å; D55-H59 PolarHBondContact O-N 3.38Å; D55-H59 VanDerWaalsContact O-N 3.16Å; A56-H59 PolarHBondContact O-N 3.34Å; H59-H61 VanDerWaalsContact C-N 3.31Å; H59-H61 PolarHBondContact O-N 3.39Å; H59-A62 PolarHBondContact O-N 2.86Å; H59-A63 WeakPolarHBondContact O-CB 3.14Å; H59-A63 PolarHBondContact O-N 3.01Å
60F95.8Very high94.1Very high0 Ų053.8 Ų53.80%033%0.327CS..Hα-helixtrans-70.1-26.2174.8-66.4-48.8000113.1M41 K45 L48 A56 L57 V64 R76 R77 V80M41-F60 HydrophobicContact SD-CD1 3.85Å; M41-F60 HydrophobicContact SD-CE1 4.03Å; K45-F60 HydrophobicContact CG-CZ 4.43Å; L48-F60 HydrophobicContact CD2-CE2 4.36Å; A56-F60 HydrophobicContact CB-CE2 4.25Å; A56-F60 WeakPolarHBondContact O-CD2 3.49Å; A56-F60 WeakPolarHBondContact O-CG 3.5Å; A56-F60 PolarHBondContact O-N 3.36Å; L57-F60 PolarHBondContact O-N 3.47Å; F60-V64 WeakPolarHBondContact O-CG2 3.49Å; F60-V64 PolarHBondContact O-N 2.94Å; F60-V64 VanDerWaalsContact O-N 3.09Å; F60-R76 HydrophobicContact CD1-CB 3.78Å; F60-R76 HydrophobicContact CD2-CB 4.19Å; F60-R76 HydrophobicContact CE1-CB 3.54Å; F60-R76 HydrophobicContact CE1-CG 4.05Å; F60-R76 HydrophobicContact CE2-CB 3.97Å; F60-R76 HydrophobicContact CG-CB 4.12Å; F60-R76 HydrophobicContact CZ-CB 3.64Å; F60-R76 HydrophobicContact CZ-CG 4.18Å; F60-R77 HydrophobicContact CB-CB 3.93Å; F60-R77 HydrophobicContact CB-CG 4.11Å; F60-V80 HydrophobicContact CD2-CG2 3.6Å; F60-V80 HydrophobicContact CE2-CG2 3.57Å
61H95.6Very high94.1Very high69 Ų6953.2 Ų53.232%0.31931%0.311SS..Hα-helixtrans-63.5-52.4167.5-84.168000110.9L57 S58 H59 A63 V64 D65 F81L57-H61 PolarHBondContact O-N 3.13Å; L57-H61 PolarHBondContact O-ND1 3.25Å; S58-H61 WeakPolarHBondContact O-CB 3.42Å; S58-H61 PolarHBondContact O-N 3.48Å; H59-H61 VanDerWaalsContact C-N 3.31Å; H59-H61 PolarHBondContact O-N 3.39Å; H61-A63 PolarHBondContact O-N 2.76Å; H61-V64 PolarHBondContact O-N 2.95Å; H61-D65 PolarHBondContact O-N 3.26Å; H61-F81 AromaticContact CE1-CZ 3.64Å
62A93.6Very high94.3Very high35 Ų3553.8 Ų53.829%0.28930%0.301SS..Hα-helixtrans-58.4-3617800000112.5S58 H59 D65 G66S58-A62 PolarHBondContact O-N 3.01Å; H59-A62 PolarHBondContact O-N 2.86Å; A62-D65 PolarHBondContact O-N 2.71Å; A62-G66 PolarHBondContact O-N 3.16Å
63A94.1Very high94.2Very high0 Ų049.2 Ų49.20%028%0.28CS..Hα-helixtrans-66.5-40.5175.100000113V37 H40 M41 H59 H61 D67 A73V37-A63 HydrophobicContact CG1-CB 4.25Å; H40-A63 HydrophobicContact CB-CB 4.18Å; M41-A63 HydrophobicContact CG-CB 3.87Å; M41-A63 HydrophobicContact SD-CB 3.61Å; H59-A63 WeakPolarHBondContact O-CB 3.14Å; H59-A63 PolarHBondContact O-N 3.01Å; H61-A63 PolarHBondContact O-N 2.76Å; A63-D67 PolarHBondContact O-N 3.1Å; A63-A73 HydrophobicContact CB-CB 4.14Å
64V94.9Very high94.3Very high4 Ų448.4 Ų48.42%0.02427%0.274CS..Hα-helixtrans-67.8-39.5175.3168.20000111.5F60 H61 G66 D67 P68 A73 Y74F60-V64 WeakPolarHBondContact O-CG2 3.49Å; F60-V64 PolarHBondContact O-N 2.94Å; F60-V64 VanDerWaalsContact O-N 3.09Å; H61-V64 PolarHBondContact O-N 2.95Å; V64-G66 VanDerWaalsContact C-N 3.34Å; V64-D67 CarbonylContact O-C 3.4Å; V64-D67 VanDerWaalsContact O-C 3.26Å; V64-P68 WeakPolarHBondContact O-CA 3.49Å; V64-A73 HydrophobicContact CG2-CB 3.74Å; V64-Y74 HydrophobicContact CG1-CD1 4.16Å; V64-Y74 HydrophobicContact CG1-CE1 3.48Å; V64-Y74 VanDerWaalsContact CG1-CE1 3.48Å; V64-Y74 HydrophobicContact CG1-CE2 4.12Å; V64-Y74 VanDerWaalsContact CG1-CZ 3.46Å; V64-Y74 HydrophobicContact CG2-CD1 4.15Å; V64-Y74 HydrophobicContact CG2-CD2 4.47Å; V64-Y74 HydrophobicContact CG2-CE1 4.3Å; V64-Y74 HydrophobicContact CG2-CG 4.24Å
65D93.5Very high94.4Very high120 Ų12047.6 Ų47.664%0.64226%0.259SS*.Hα-helixtrans-69.3-34.6178.7-66.1-19.5000111.7H61 A62H61-D65 PolarHBondContact O-N 3.26Å; A62-D65 PolarHBondContact O-N 2.71Å
66G91.8Very high94.5Very high46 Ų4648.1 Ų48.147%0.47426%0.255SS..Hα-helixtrans-73.8-37.6177.200000114A62 V64A62-G66 PolarHBondContact O-N 3.16Å; V64-G66 VanDerWaalsContact C-N 3.34Å
67D91.3Very high94.6Very high52 Ų5249.4 Ų49.428%0.27826%0.26SS..  trans-136.194.2170.8-176.76.6000112.7V37 A63 V64 K69 N70V37-D67 HydrophobicContact CG1-CB 4.25Å; V37-D67 HydrophobicContact CG2-CB 4.25Å; A63-D67 PolarHBondContact O-N 3.1Å; V64-D67 CarbonylContact O-C 3.4Å; V64-D67 VanDerWaalsContact O-C 3.26Å; D67-K69 PolarHBondContact O-N 3.37Å; D67-K69 VanDerWaalsContact O-N 3.08Å; D67-K69 PolarHBondContact OD1-N 3.33Å; D67-N70 HydrophobicContact CB-CB 4.04Å; D67-N70 WeakPolarHBondContact O-CB 3.46Å; D67-N70 PolarHBondContact O-N 3.12Å; D67-N70 VanDerWaalsContact O-N 3.12Å; D67-N70 WeakPolarHBondContact OD2-CB 3.44Å
68P92.9Very high94.6Very high70 Ų7048.6 Ų48.646%0.45526%0.255SS..THydrogen-bonded Turntrans-67.4-3.9177.5-23.234.7000115.6V64 Y74V64-P68 WeakPolarHBondContact O-CA 3.49Å; P68-Y74 WeakPolarHBondContact O-CE2 3.49Å
69K93.4Very high94.6Very high166 Ų16646.5 Ų46.572%0.72224%0.24SC*.THydrogen-bonded Turntrans-101.8-7.1174.9-64.9-176.2-178.7179.80112.6D67 Y71D67-K69 PolarHBondContact O-N 3.37Å; D67-K69 VanDerWaalsContact O-N 3.08Å; D67-K69 PolarHBondContact OD1-N 3.33Å; K69-Y71 PolarHBondContact O-N 3.49Å
70N93.3Very high94.5Very high27 Ų2744.1 Ų44.114%0.14423%0.229CC..  trans-75.596.2179-171.1-16.8000111.7D67 I72 A73 Y74D67-N70 HydrophobicContact CB-CB 4.04Å; D67-N70 WeakPolarHBondContact O-CB 3.46Å; D67-N70 PolarHBondContact O-N 3.12Å; D67-N70 VanDerWaalsContact O-N 3.12Å; D67-N70 WeakPolarHBondContact OD2-CB 3.44Å; N70-I72 PolarHBondContact O-N 3.29Å; N70-I72 WeakPolarHBondContact OD1-CB 3.27Å; N70-I72 PolarHBondContact OD1-N 3.46Å; N70-A73 HydrophobicContact CB-CB 4.08Å; N70-A73 WeakPolarHBondContact O-CB 3.25Å; N70-A73 PolarHBondContact O-N 3.33Å; N70-A73 VanDerWaalsContact O-N 3.15Å; N70-A73 PolarHBondContact OD1-N 2.88Å; N70-Y74 WeakPolarHBondContact O-CD2 3.48Å; N70-Y74 PolarHBondContact O-N 3.36Å
71Y95.1Very high94.5Very high58 Ų5844.9 Ų44.923%0.22723%0.232CC..Hα-helixtrans-59.6-28.2177.981.4-88000113.1K69 Y74 Y75 V97 K101 F104K69-Y71 PolarHBondContact O-N 3.49Å; Y71-Y74 PolarHBondContact O-N 3.01Å; Y71-Y75 WeakPolarHBondContact O-CB 3.49Å; Y71-Y75 PolarHBondContact O-N 2.71Å; Y71-V97 HydrophobicContact CD2-CG1 4.1Å; Y71-V97 WeakPolarHBondContact O-CG2 3.37Å; Y71-K101 HydrophobicContact CD1-CB 4.27Å; Y71-K101 HydrophobicContact CD1-CD 3.94Å; Y71-K101 HydrophobicContact CD2-CB 4.14Å; Y71-K101 HydrophobicContact CD2-CD 3.97Å; Y71-K101 HydrophobicContact CE1-CD 3.5Å; Y71-K101 VanDerWaalsContact CE1-CD 3.5Å; Y71-K101 HydrophobicContact CE2-CD 3.54Å; Y71-K101 HydrophobicContact CG-CB 3.97Å; Y71-K101 HydrophobicContact CG-CD 4.15Å; Y71-K101 PolarHBondContact OH-NZ 3.01Å; Y71-F104 HydrophobicContact CD2-CD1 4.5Å; Y71-F104 HydrophobicContact CE2-CD1 4.4Å; Y71-F104 HydrophobicContact CE2-CD2 4.32Å; Y71-F104 HydrophobicContact CE2-CG 4.26Å
72I95Very high94.2Very high63 Ų6343.9 Ų43.932%0.32323%0.229SC..Hα-helixtrans-69.5-38-179.8-53.9176.9000109.9M41 N70 Y75 R76M41-I72 HydrophobicContact CE-CB 4.04Å; M41-I72 HydrophobicContact CE-CG2 3.61Å; N70-I72 PolarHBondContact O-N 3.29Å; N70-I72 WeakPolarHBondContact OD1-CB 3.27Å; N70-I72 PolarHBondContact OD1-N 3.46Å; I72-Y75 PolarHBondContact O-N 3.2Å; I72-R76 HydrophobicContact CG2-CG 4.16Å; I72-R76 WeakPolarHBondContact O-CB 3.35Å; I72-R76 VanDerWaalsContact O-CG 3.26Å; I72-R76 WeakPolarHBondContact O-CG 3.4Å; I72-R76 PolarHBondContact O-N 3.39Å
73A95Very high94.1Very high0 Ų045.1 Ų45.10%024%0.239CC..Hα-helixtrans-60.9-48.1176.600000111.1M41 A63 V64 N70 Y75 R76 R77M41-A73 HydrophobicContact CE-CB 4.24Å; M41-A73 HydrophobicContact SD-CB 3.71Å; A63-A73 HydrophobicContact CB-CB 4.14Å; V64-A73 HydrophobicContact CG2-CB 3.74Å; N70-A73 HydrophobicContact CB-CB 4.08Å; N70-A73 WeakPolarHBondContact O-CB 3.25Å; N70-A73 PolarHBondContact O-N 3.33Å; N70-A73 VanDerWaalsContact O-N 3.15Å; N70-A73 PolarHBondContact OD1-N 2.88Å; A73-Y75 PolarHBondContact O-N 3.36Å; A73-R76 PolarHBondContact O-N 2.85Å; A73-R77 WeakPolarHBondContact O-CB 3.43Å; A73-R77 PolarHBondContact O-N 3.46Å
74Y97Very high93.9Very high28 Ų2848.1 Ų48.111%0.1125%0.254CS..Hα-helixtrans-59.8-45.4173.7-73-79.2000112.4V64 P68 N70 Y71 R76 R77 A78 D93 R96 L100V64-Y74 HydrophobicContact CG1-CD1 4.16Å; V64-Y74 HydrophobicContact CG1-CE1 3.48Å; V64-Y74 VanDerWaalsContact CG1-CE1 3.48Å; V64-Y74 HydrophobicContact CG1-CE2 4.12Å; V64-Y74 VanDerWaalsContact CG1-CZ 3.46Å; V64-Y74 HydrophobicContact CG2-CD1 4.15Å; V64-Y74 HydrophobicContact CG2-CD2 4.47Å; V64-Y74 HydrophobicContact CG2-CE1 4.3Å; V64-Y74 HydrophobicContact CG2-CG 4.24Å; P68-Y74 WeakPolarHBondContact O-CE2 3.49Å; N70-Y74 WeakPolarHBondContact O-CD2 3.48Å; N70-Y74 PolarHBondContact O-N 3.36Å; Y71-Y74 PolarHBondContact O-N 3.01Å; Y74-R76 PolarHBondContact O-N 3.28Å; Y74-R77 PolarHBondContact O-N 3.16Å; Y74-A78 WeakPolarHBondContact O-CB 3.42Å; Y74-A78 PolarHBondContact O-N 3.06Å; Y74-D93 HydrophobicContact CD1-CB 4.45Å; Y74-R96 HydrophobicContact CD1-CB 4.22Å; Y74-R96 HydrophobicContact CD1-CG 4.02Å; Y74-R96 HydrophobicContact CD2-CG 4.08Å; Y74-R96 HydrophobicContact CE1-CB 4.43Å; Y74-R96 HydrophobicContact CE1-CG 3.89Å; Y74-R96 HydrophobicContact CE2-CG 3.97Å; Y74-R96 HydrophobicContact CG-CB 4.43Å; Y74-R96 HydrophobicContact CG-CG 4.11Å; Y74-L100 HydrophobicContact CD2-CD1 3.99Å; Y74-L100 HydrophobicContact CE2-CD1 4.07Å
75Y96.7Very high93.4Very high38 Ų3850.3 Ų50.315%0.14928%0.277CS..Hα-helixtrans-62.4-44.7179.8-179.8-112.3000111.9Y71 I72 A73 A78 T79 L94 F104 A107Y71-Y75 WeakPolarHBondContact O-CB 3.49Å; Y71-Y75 PolarHBondContact O-N 2.71Å; I72-Y75 PolarHBondContact O-N 3.2Å; A73-Y75 PolarHBondContact O-N 3.36Å; Y75-A78 WeakPolarHBondContact O-CB 3.45Å; Y75-A78 PolarHBondContact O-N 3.27Å; Y75-T79 HydrophobicContact CD1-CG2 4.47Å; Y75-T79 HydrophobicContact CE1-CG2 4.08Å; Y75-T79 HydrophobicContact CE2-CG2 4.18Å; Y75-T79 WeakPolarHBondContact O-CG2 3.47Å; Y75-T79 PolarHBondContact O-N 2.98Å; Y75-T79 PolarHBondContact O-OG1 3.19Å; Y75-L94 HydrophobicContact CD2-CD2 4.15Å; Y75-L94 HydrophobicContact CE2-CD2 4.39Å; Y75-F104 AromaticContact CD1-CE1 3.93Å; Y75-F104 HydrophobicContact CD1-CE1 3.93Å; Y75-F104 HydrophobicContact CD1-CZ 4.06Å; Y75-F104 AromaticContact CD2-CE1 3.66Å; Y75-F104 HydrophobicContact CD2-CE1 3.66Å; Y75-F104 HydrophobicContact CD2-CZ 4.5Å; Y75-F104 HydrophobicContact CE1-CE1 4.08Å; Y75-F104 AromaticContact CE1-CZ 3.98Å; Y75-F104 HydrophobicContact CE1-CZ 3.98Å; Y75-F104 AromaticContact CE2-CE1 3.81Å; Y75-F104 HydrophobicContact CE2-CE1 3.81Å; Y75-F104 HydrophobicContact CE2-CZ 4.42Å; Y75-F104 AromaticContact CG-CE1 3.71Å; Y75-F104 HydrophobicContact CG-CE1 3.71Å; Y75-F104 HydrophobicContact CG-CZ 4.31Å; Y75-A107 HydrophobicContact CD2-CB 3.94Å; Y75-A107 HydrophobicContact CE2-CB 4.14Å
76R95.5Very high93Very high90 Ų9049.2 Ų49.234%0.3427%0.267SS..Hα-helixtrans-64-44.7177.4-68.2-64.1179.4-175.80.3111.1M41 F60 I72 A73 Y74 A78 T79 V80M41-R76 HydrophobicContact CE-CG 4.23Å; F60-R76 HydrophobicContact CD1-CB 3.78Å; F60-R76 HydrophobicContact CD2-CB 4.19Å; F60-R76 HydrophobicContact CE1-CB 3.54Å; F60-R76 HydrophobicContact CE1-CG 4.05Å; F60-R76 HydrophobicContact CE2-CB 3.97Å; F60-R76 HydrophobicContact CG-CB 4.12Å; F60-R76 HydrophobicContact CZ-CB 3.64Å; F60-R76 HydrophobicContact CZ-CG 4.18Å; I72-R76 HydrophobicContact CG2-CG 4.16Å; I72-R76 WeakPolarHBondContact O-CB 3.35Å; I72-R76 VanDerWaalsContact O-CG 3.26Å; I72-R76 WeakPolarHBondContact O-CG 3.4Å; I72-R76 PolarHBondContact O-N 3.39Å; A73-R76 PolarHBondContact O-N 2.85Å; Y74-R76 PolarHBondContact O-N 3.28Å; R76-A78 VanDerWaalsContact C-N 3.33Å; R76-A78 PolarHBondContact O-N 3.43Å; R76-T79 WeakPolarHBondContact CA-OG1 3.37Å; R76-T79 PolarHBondContact O-N 2.97Å; R76-T79 VanDerWaalsContact O-N 3.13Å; R76-T79 PolarHBondContact O-OG1 3.36Å; R76-V80 WeakPolarHBondContact O-CG2 3.27Å; R76-V80 PolarHBondContact O-N 3.35Å
77R96.3Very high92.6Very high28 Ų2847.5 Ų47.511%0.10625%0.247CC..Hα-helixtrans-57.5-44.9174.6-161171.170.5177-0.4112L57 F60 A73 Y74 T79 V80 F81 D93L57-R77 HydrophobicContact CD1-CG 3.83Å; F60-R77 HydrophobicContact CB-CB 3.93Å; F60-R77 HydrophobicContact CB-CG 4.11Å; A73-R77 WeakPolarHBondContact O-CB 3.43Å; A73-R77 PolarHBondContact O-N 3.46Å; Y74-R77 PolarHBondContact O-N 3.16Å; R77-T79 PolarHBondContact O-N 3.3Å; R77-V80 PolarHBondContact O-N 3.44Å; R77-F81 HydrophobicContact CG-CD2 4.13Å; R77-F81 HydrophobicContact CG-CE2 3.73Å; R77-F81 HydrophobicContact CG-CZ 4.43Å; R77-F81 WeakPolarHBondContact O-CD2 3.42Å; R77-F81 PolarHBondContact O-N 3.12Å; R77-D93 IonicContact CZ-OD1 2.83Å; R77-D93 IonicContact CZ-OD2 3.69Å; R77-D93 IonicContact NE-OD1 3.82Å; R77-D93 IonicContact NE-OD2 3.3Å; R77-D93 PolarHBondContact NE-OD2 3.15Å; R77-D93 IonicContact NH2-OD1 3.65Å; R77-D93 PolarHBondContact NH2-OD1 2.96Å; R77-D93 IonicContact NH2-OD2 3.53Å; R77-D93 PolarHBondContact NH2-OD2 3.49Å
78A95.8Very high92.3Very high0 Ų049.5 Ų49.50%025%0.254CS..Hα-helixtrans-59.4-44.1174.200000112.6Y74 Y75 R76 V80 F81 L82 A90 D93 L94Y74-A78 WeakPolarHBondContact O-CB 3.42Å; Y74-A78 PolarHBondContact O-N 3.06Å; Y75-A78 WeakPolarHBondContact O-CB 3.45Å; Y75-A78 PolarHBondContact O-N 3.27Å; R76-A78 VanDerWaalsContact C-N 3.33Å; R76-A78 PolarHBondContact O-N 3.43Å; A78-V80 VanDerWaalsContact C-N 3.32Å; A78-V80 PolarHBondContact O-N 3.21Å; A78-F81 WeakPolarHBondContact O-CB 3.36Å; A78-F81 PolarHBondContact O-N 3.17Å; A78-L82 WeakPolarHBondContact O-CG 3.49Å; A78-L82 PolarHBondContact O-N 2.82Å; A78-A90 HydrophobicContact CB-CB 4.45Å; A78-D93 HydrophobicContact CB-CB 3.78Å; A78-L94 HydrophobicContact CB-CD2 3.78Å; A78-L94 HydrophobicContact CB-CG 3.82Å
79T93.7Very high92.1Very high32 Ų3248.6 Ų48.620%0.19625%0.249CC..Hα-helixtrans-63.8-36.8177.757.50000112.5Y75 R76 R77 L82 A83Y75-T79 HydrophobicContact CD1-CG2 4.47Å; Y75-T79 HydrophobicContact CE1-CG2 4.08Å; Y75-T79 HydrophobicContact CE2-CG2 4.18Å; Y75-T79 WeakPolarHBondContact O-CG2 3.47Å; Y75-T79 PolarHBondContact O-N 2.98Å; Y75-T79 PolarHBondContact O-OG1 3.19Å; R76-T79 WeakPolarHBondContact CA-OG1 3.37Å; R76-T79 PolarHBondContact O-N 2.97Å; R76-T79 VanDerWaalsContact O-N 3.13Å; R76-T79 PolarHBondContact O-OG1 3.36Å; R77-T79 PolarHBondContact O-N 3.3Å; T79-L82 PolarHBondContact O-N 3.47Å; T79-A83 WeakPolarHBondContact O-CB 3.33Å; T79-A83 PolarHBondContact O-N 3Å
80V95.2Very high92.1Very high0 Ų040.7 Ų40.70%022%0.215CC..Hα-helixtrans-66.7-44173.4179.90000110.7L48 L53 A56 L57 F60 R76 R77 A78 L82 A83 M84L48-V80 HydrophobicContact CD1-CG2 3.87Å; L48-V80 HydrophobicContact CD2-CG2 4Å; L48-V80 HydrophobicContact CG-CG2 4.41Å; L53-V80 HydrophobicContact CB-CG1 4.31Å; L53-V80 VanDerWaalsContact O-CG1 3.25Å; L53-V80 WeakPolarHBondContact O-CG1 3.41Å; A56-V80 HydrophobicContact CB-CG2 4.37Å; L57-V80 HydrophobicContact CB-CG1 3.89Å; L57-V80 HydrophobicContact CD1-CB 4.32Å; L57-V80 HydrophobicContact CD1-CG1 4.08Å; F60-V80 HydrophobicContact CD2-CG2 3.6Å; F60-V80 HydrophobicContact CE2-CG2 3.57Å; R76-V80 WeakPolarHBondContact O-CG2 3.27Å; R76-V80 PolarHBondContact O-N 3.35Å; R77-V80 PolarHBondContact O-N 3.44Å; A78-V80 VanDerWaalsContact C-N 3.32Å; A78-V80 PolarHBondContact O-N 3.21Å; V80-L82 VanDerWaalsContact C-N 3.3Å; V80-L82 PolarHBondContact O-N 2.85Å; V80-A83 PolarHBondContact O-N 3.06Å; V80-M84 HydrophobicContact CG1-CG 4.42Å; V80-M84 HydrophobicContact CG1-SD 4.13Å; V80-M84 VanDerWaalsContact O-CG 3.3Å; V80-M84 WeakPolarHBondContact O-CG 3.31Å; V80-M84 PolarHBondContact O-N 3.32Å
81F94.4Very high92.1Very high17 Ų1741.1 Ų41.18%0.07522%0.217CC..Hα-helixtrans-57.1-43.6173.8-77.7-50.7000112.1L57 H61 R77 A78 M84 G85 K86 A90 D93L57-F81 HydrophobicContact CD1-CD1 3.89Å; L57-F81 HydrophobicContact CD1-CD2 4.37Å; L57-F81 HydrophobicContact CD1-CE1 3.65Å; L57-F81 HydrophobicContact CD1-CE2 4.16Å; L57-F81 HydrophobicContact CD1-CG 4.26Å; L57-F81 HydrophobicContact CD1-CZ 3.8Å; L57-F81 HydrophobicContact CD2-CD1 4.18Å; L57-F81 HydrophobicContact CD2-CE1 3.69Å; L57-F81 HydrophobicContact CD2-CZ 4.4Å; L57-F81 HydrophobicContact CG-CE1 4.26Å; H61-F81 AromaticContact CE1-CZ 3.64Å; R77-F81 HydrophobicContact CG-CD2 4.13Å; R77-F81 HydrophobicContact CG-CE2 3.73Å; R77-F81 HydrophobicContact CG-CZ 4.43Å; R77-F81 WeakPolarHBondContact O-CD2 3.42Å; R77-F81 PolarHBondContact O-N 3.12Å; A78-F81 WeakPolarHBondContact O-CB 3.36Å; A78-F81 PolarHBondContact O-N 3.17Å; F81-M84 CarbonylContact O-C 3.34Å; F81-M84 PolarHBondContact O-N 3.43Å; F81-G85 PolarHBondContact O-N 3.2Å; F81-K86 HydrophobicContact CB-CB 4.27Å; F81-K86 HydrophobicContact CD1-CB 3.95Å; F81-K86 HydrophobicContact CD1-CD 4.05Å; F81-K86 HydrophobicContact CE1-CD 4.41Å; F81-K86 WeakPolarHBondContact O-CA 3.47Å; F81-K86 WeakPolarHBondContact O-CB 3.31Å; F81-K86 PolarHBondContact O-N 3.03Å; F81-A90 HydrophobicContact CB-CB 3.83Å; F81-D93 WeakPolarHBondContact CE2-OD2 3.49Å
82L90.6Very high92.1Very high47 Ų4742 Ų4225%0.24623%0.229CC..Hα-helixtrans-64.1-42.5176.2-69.6173.7000112.3A78 T79 V80 M84 G85 A90 L94 L114A78-L82 WeakPolarHBondContact O-CG 3.49Å; A78-L82 PolarHBondContact O-N 2.82Å; T79-L82 PolarHBondContact O-N 3.47Å; V80-L82 VanDerWaalsContact C-N 3.3Å; V80-L82 PolarHBondContact O-N 2.85Å; L82-M84 PolarHBondContact O-N 3.21Å; L82-G85 PolarHBondContact O-N 3.39Å; L82-A90 HydrophobicContact CD2-CB 3.77Å; L82-A90 HydrophobicContact CG-CB 3.79Å; L82-L94 HydrophobicContact CD1-CD1 4.5Å; L82-L114 HydrophobicContact CD2-CD1 4.29Å; L82-L114 HydrophobicContact CD2-CD2 4.42Å
83A90.4Very high92.1Very high61 Ų6139.4 Ų39.450%0.50422%0.216SC..Hα-helixtrans-62.7-30.9175.600000112.5L53 T79 V80 G85L53-A83 HydrophobicContact CD1-CB 3.99Å; L53-A83 HydrophobicContact CD2-CB 3.94Å; T79-A83 WeakPolarHBondContact O-CB 3.33Å; T79-A83 PolarHBondContact O-N 3Å; V80-A83 PolarHBondContact O-N 3.06Å; A83-G85 VanDerWaalsContact C-N 3.29Å
84M90.1Very high92.2Very high63 Ų6339.4 Ų39.431%0.3122%0.216SC..THydrogen-bonded Turntrans-83.10.9173.4-63.4-179.796.400113.7L53 A54 L57 V80 F81 L82 K86L53-M84 HydrophobicContact CB-CE 4.37Å; L53-M84 HydrophobicContact CB-CG 3.72Å; L53-M84 HydrophobicContact CB-SD 4.2Å; L53-M84 HydrophobicContact CD1-CG 3.8Å; L53-M84 HydrophobicContact CG-CG 4.37Å; A54-M84 HydrophobicContact CB-CE 4.29Å; L57-M84 HydrophobicContact CD2-SD 3.94Å; V80-M84 HydrophobicContact CG1-CG 4.42Å; V80-M84 HydrophobicContact CG1-SD 4.13Å; V80-M84 VanDerWaalsContact O-CG 3.3Å; V80-M84 WeakPolarHBondContact O-CG 3.31Å; V80-M84 PolarHBondContact O-N 3.32Å; F81-M84 CarbonylContact O-C 3.34Å; F81-M84 PolarHBondContact O-N 3.43Å; L82-M84 PolarHBondContact O-N 3.21Å; M84-K86 HydrophobicContact CB-CD 4.3Å; M84-K86 HydrophobicContact CB-CG 4.1Å; M84-K86 PolarHBondContact O-N 3.26Å; M84-K86 HydrophobicContact SD-CD 4.49Å
85G84.4Confident92.2Very high51 Ų5139.3 Ų39.353%0.52622%0.22SC..THydrogen-bonded Turntrans70.411.9-174.200000114.7F81 L82 A83 S87F81-G85 PolarHBondContact O-N 3.2Å; L82-G85 PolarHBondContact O-N 3.39Å; A83-G85 VanDerWaalsContact C-N 3.29Å; G85-S87 VanDerWaalsContact C-N 3.27Å; G85-S87 PolarHBondContact O-N 3.17Å; G85-S87 VanDerWaalsContact O-N 3.1Å
86K86Confident92.2Very high97 Ų9741.8 Ų41.842%0.42223%0.229SC..  trans-87.759.3-178.5-65.4-176.1179179.40112.2F81 M84 K88 S89 A90F81-K86 HydrophobicContact CB-CB 4.27Å; F81-K86 HydrophobicContact CD1-CB 3.95Å; F81-K86 HydrophobicContact CD1-CD 4.05Å; F81-K86 HydrophobicContact CE1-CD 4.41Å; F81-K86 WeakPolarHBondContact O-CA 3.47Å; F81-K86 WeakPolarHBondContact O-CB 3.31Å; F81-K86 PolarHBondContact O-N 3.03Å; M84-K86 HydrophobicContact CB-CD 4.3Å; M84-K86 HydrophobicContact CB-CG 4.1Å; M84-K86 PolarHBondContact O-N 3.26Å; M84-K86 HydrophobicContact SD-CD 4.49Å; K86-K88 VanDerWaalsContact C-N 3.33Å; K86-K88 PolarHBondContact O-N 3.43Å; K86-S89 PolarHBondContact O-N 3.47Å; K86-A90 PolarHBondContact O-N 3.19Å
87S83.4Confident92.2Very high9 Ų937.5 Ų37.56%0.06321%0.213CC..Hα-helixtrans-56.4-37.5-176.3-660000115.2G85 S89 A90 L91 W186G85-S87 VanDerWaalsContact C-N 3.27Å; G85-S87 PolarHBondContact O-N 3.17Å; G85-S87 VanDerWaalsContact O-N 3.1Å; S87-S89 VanDerWaalsContact C-N 3.3Å; S87-S89 PolarHBondContact O-N 3.49Å; S87-A90 PolarHBondContact O-N 2.77Å; S87-L91 PolarHBondContact O-N 3.17Å; S87-W186 WeakPolarHBondContact OG-CH2 3.35Å; S87-W186 WeakPolarHBondContact OG-CZ2 3.32Å; S87-W186 WeakPolarHBondContact OG-CZ3 3.29Å
88K83.4Confident92.2Very high94 Ų9437 Ų3741%0.40921%0.212SC..Hα-helixtrans-60.2-39.5175.2-68.8178.2176.8174.30112.5K86 P92 K216 L217 N219K86-K88 VanDerWaalsContact C-N 3.33Å; K86-K88 PolarHBondContact O-N 3.43Å; K88-P92 VanDerWaalsContact O-CD 3.29Å; K88-P92 WeakPolarHBondContact O-CD 3.41Å; K88-K216 PolarHBondContact NZ-O 3.24Å; K88-L217 WeakPolarHBondContact CE-O 3.29Å; K88-L217 PolarHBondContact NZ-O 3.13Å; K88-N219 PolarHBondContact NZ-OD1 3.44Å; K88-N219 VanDerWaalsContact NZ-OD1 3.07Å
89S89.7Confident92.2Very high51 Ų5143 Ų4336%0.35724%0.24SC..Hα-helixtrans-78.5-27-178.9-55.40000112.4K86 S87 P92K86-S89 PolarHBondContact O-N 3.47Å; S87-S89 VanDerWaalsContact C-N 3.3Å; S87-S89 PolarHBondContact O-N 3.49Å; S89-P92 WeakPolarHBondContact O-CD 3.45Å; S89-P92 WeakPolarHBondContact O-CG 3.32Å
90A92.6Very high92.3Very high0 Ų044.1 Ų44.10%025%0.245CC..Hα-helixtrans-74.3-35.8179.400000113.9A78 F81 L82 K86 S87 D93 L94 L114A78-A90 HydrophobicContact CB-CB 4.45Å; F81-A90 HydrophobicContact CB-CB 3.83Å; L82-A90 HydrophobicContact CD2-CB 3.77Å; L82-A90 HydrophobicContact CG-CB 3.79Å; K86-A90 PolarHBondContact O-N 3.19Å; S87-A90 PolarHBondContact O-N 2.77Å; A90-D93 PolarHBondContact O-N 3.08Å; A90-L94 WeakPolarHBondContact O-CG 3.39Å; A90-L94 PolarHBondContact O-N 3.17Å; A90-L114 HydrophobicContact CB-CD2 4.23Å
91L93.1Very high92.3Very high37 Ų3747 Ų4719%0.19426%0.257CS..Hα-helixtrans-54.6-48.8-177.2-166.986.8000114.5S87 D93 L94 S95 R111 L114 L115S87-L91 PolarHBondContact O-N 3.17Å; L91-D93 VanDerWaalsContact C-N 3.35Å; L91-D93 PolarHBondContact O-N 3.34Å; L91-L94 PolarHBondContact O-N 2.85Å; L91-S95 WeakPolarHBondContact O-CB 3.2Å; L91-S95 PolarHBondContact O-N 3.19Å; L91-S95 PolarHBondContact O-OG 3.37Å; L91-R111 HydrophobicContact CD1-CG 4.15Å; L91-L114 HydrophobicContact CB-CD2 3.76Å; L91-L114 HydrophobicContact CD1-CB 4.5Å; L91-L114 HydrophobicContact CD1-CD2 3.64Å; L91-L114 HydrophobicContact CD1-CG 3.9Å; L91-L114 HydrophobicContact CG-CD2 4.33Å; L91-L115 HydrophobicContact CD1-CD2 3.92Å; L91-L115 HydrophobicContact CD1-CG 4.17Å
92P94.7Very high92.2Very high75 Ų7549.9 Ų49.949%0.48728%0.278SS..Hα-helixtrans-64.7-39178.924.6-34.6000112K88 S89 S95 R96K88-P92 VanDerWaalsContact O-CD 3.29Å; K88-P92 WeakPolarHBondContact O-CD 3.41Å; S89-P92 WeakPolarHBondContact O-CD 3.45Å; S89-P92 WeakPolarHBondContact O-CG 3.32Å; P92-S95 PolarHBondContact O-N 2.73Å; P92-R96 WeakPolarHBondContact O-CB 3.45Å; P92-R96 PolarHBondContact O-N 3.06Å
93D96.2Very high92.1Very high9 Ų952.7 Ų52.75%0.04829%0.293CS..Hα-helixtrans-63.5-45.6177.3-76.8-4.9000111.3Y74 R77 A78 F81 A90 L91 S95 R96 V97Y74-D93 HydrophobicContact CD1-CB 4.45Å; R77-D93 IonicContact CZ-OD1 2.83Å; R77-D93 IonicContact CZ-OD2 3.69Å; R77-D93 IonicContact NE-OD1 3.82Å; R77-D93 IonicContact NE-OD2 3.3Å; R77-D93 PolarHBondContact NE-OD2 3.15Å; R77-D93 IonicContact NH2-OD1 3.65Å; R77-D93 PolarHBondContact NH2-OD1 2.96Å; R77-D93 IonicContact NH2-OD2 3.53Å; R77-D93 PolarHBondContact NH2-OD2 3.49Å; A78-D93 HydrophobicContact CB-CB 3.78Å; F81-D93 WeakPolarHBondContact CE2-OD2 3.49Å; A90-D93 PolarHBondContact O-N 3.08Å; L91-D93 VanDerWaalsContact C-N 3.35Å; L91-D93 PolarHBondContact O-N 3.34Å; D93-S95 VanDerWaalsContact C-N 3.31Å; D93-S95 PolarHBondContact O-N 3.45Å; D93-R96 WeakPolarHBondContact O-CB 3.35Å; D93-R96 PolarHBondContact O-N 3.19Å; D93-V97 VanDerWaalsContact O-CG2 3.28Å; D93-V97 WeakPolarHBondContact O-CG2 3.42Å; D93-V97 PolarHBondContact O-N 2.98Å
94L96.8Very high92.2Very high0 Ų052 Ų520%028%0.279CS..Hα-helixtrans-62.2-39.4175.8-69.3172.2000112.2Y75 A78 L82 A90 L91 R96 V97 I98 A107 Q110 R111 L114Y75-L94 HydrophobicContact CD2-CD2 4.15Å; Y75-L94 HydrophobicContact CE2-CD2 4.39Å; A78-L94 HydrophobicContact CB-CD2 3.78Å; A78-L94 HydrophobicContact CB-CG 3.82Å; L82-L94 HydrophobicContact CD1-CD1 4.5Å; A90-L94 WeakPolarHBondContact O-CG 3.39Å; A90-L94 PolarHBondContact O-N 3.17Å; L91-L94 PolarHBondContact O-N 2.85Å; L94-R96 VanDerWaalsContact C-N 3.34Å; L94-V97 WeakPolarHBondContact O-CB 3.49Å; L94-V97 PolarHBondContact O-N 3.31Å; L94-I98 WeakPolarHBondContact O-CD1 3.23Å; L94-I98 WeakPolarHBondContact O-CG1 3.47Å; L94-I98 PolarHBondContact O-N 3.16Å; L94-I98 VanDerWaalsContact O-N 3.13Å; L94-A107 HydrophobicContact CD2-CB 4.25Å; L94-Q110 HydrophobicContact CD1-CB 4.1Å; L94-Q110 HydrophobicContact CD2-CB 4.1Å; L94-R111 HydrophobicContact CB-CB 4.15Å; L94-R111 HydrophobicContact CB-CG 4.37Å; L94-R111 HydrophobicContact CD1-CB 4.28Å; L94-L114 HydrophobicContact CD1-CD2 4.07Å
95S96.5Very high92.4Very high27 Ų2749.8 Ų49.819%0.18927%0.269CS..Hα-helixtrans-64.1-42175.8-600000111L91 P92 D93 V97 I98 E99 R111L91-S95 WeakPolarHBondContact O-CB 3.2Å; L91-S95 PolarHBondContact O-N 3.19Å; L91-S95 PolarHBondContact O-OG 3.37Å; P92-S95 PolarHBondContact O-N 2.73Å; D93-S95 VanDerWaalsContact C-N 3.31Å; D93-S95 PolarHBondContact O-N 3.45Å; S95-V97 VanDerWaalsContact C-N 3.33Å; S95-V97 PolarHBondContact O-N 3.49Å; S95-I98 PolarHBondContact O-N 3.27Å; S95-I98 VanDerWaalsContact O-N 3.15Å; S95-E99 WeakPolarHBondContact O-CG 3.18Å; S95-E99 PolarHBondContact O-N 2.66Å; S95-R111 WeakPolarHBondContact OG-CD 3.36Å; S95-R111 PolarHBondContact OG-NH1 2.92Å
96R96.4Very high92.7Very high90 Ų9048.9 Ų48.934%0.3425%0.254SS..Hα-helixtrans-63-38.1175.8-172.555.7175.4172.41.3112.6Y74 P92 D93 L94 I98 E99 L100Y74-R96 HydrophobicContact CD1-CB 4.22Å; Y74-R96 HydrophobicContact CD1-CG 4.02Å; Y74-R96 HydrophobicContact CD2-CG 4.08Å; Y74-R96 HydrophobicContact CE1-CB 4.43Å; Y74-R96 HydrophobicContact CE1-CG 3.89Å; Y74-R96 HydrophobicContact CE2-CG 3.97Å; Y74-R96 HydrophobicContact CG-CB 4.43Å; Y74-R96 HydrophobicContact CG-CG 4.11Å; P92-R96 WeakPolarHBondContact O-CB 3.45Å; P92-R96 PolarHBondContact O-N 3.06Å; D93-R96 WeakPolarHBondContact O-CB 3.35Å; D93-R96 PolarHBondContact O-N 3.19Å; L94-R96 VanDerWaalsContact C-N 3.34Å; R96-I98 VanDerWaalsContact C-N 3.32Å; R96-I98 PolarHBondContact O-N 2.96Å; R96-E99 WeakPolarHBondContact CD-OE2 3.47Å; R96-E99 IonicContact CZ-OE2 2.69Å; R96-E99 IonicContact NH1-OE2 2.71Å; R96-E99 PolarHBondContact NH1-OE2 3.2Å; R96-E99 PolarHBondContact O-N 3.08Å; R96-L100 HydrophobicContact CG-CD1 4.06Å; R96-L100 HydrophobicContact CG-CG 4.46Å; R96-L100 WeakPolarHBondContact O-CB 3.45Å; R96-L100 VanDerWaalsContact O-CG 3.32Å; R96-L100 WeakPolarHBondContact O-CG 3.44Å; R96-L100 PolarHBondContact O-N 3.08Å
97V97.1Very high93.1Very high0 Ų044.3 Ų44.30%023%0.234CC..Hα-helixtrans-59.8-45173.5175.40000111Y71 D93 L94 S95 E99 L100 K101 F104 A107Y71-V97 HydrophobicContact CD2-CG1 4.1Å; Y71-V97 WeakPolarHBondContact O-CG2 3.37Å; D93-V97 VanDerWaalsContact O-CG2 3.28Å; D93-V97 WeakPolarHBondContact O-CG2 3.42Å; D93-V97 PolarHBondContact O-N 2.98Å; L94-V97 WeakPolarHBondContact O-CB 3.49Å; L94-V97 PolarHBondContact O-N 3.31Å; S95-V97 VanDerWaalsContact C-N 3.33Å; S95-V97 PolarHBondContact O-N 3.49Å; V97-E99 VanDerWaalsContact C-N 3.33Å; V97-E99 PolarHBondContact O-N 3.12Å; V97-L100 PolarHBondContact O-N 3.27Å; V97-K101 WeakPolarHBondContact O-CA 3.45Å; V97-K101 PolarHBondContact O-N 3.35Å; V97-F104 HydrophobicContact CG1-CD1 3.6Å; V97-F104 HydrophobicContact CG1-CE1 4.24Å; V97-A107 HydrophobicContact CB-CB 4.01Å; V97-A107 HydrophobicContact CG1-CB 3.47Å; V97-A107 VanDerWaalsContact CG1-CB 3.47Å
98I95.7Very high93.7Very high17 Ų1744.7 Ų44.79%0.08724%0.235CC..Hα-helixtrans-68.5-33.8-179.1-65.7161.6000111.5L94 S95 R96 K101 P102 A107 R108 R111L94-I98 WeakPolarHBondContact O-CD1 3.23Å; L94-I98 WeakPolarHBondContact O-CG1 3.47Å; L94-I98 PolarHBondContact O-N 3.16Å; L94-I98 VanDerWaalsContact O-N 3.13Å; S95-I98 PolarHBondContact O-N 3.27Å; S95-I98 VanDerWaalsContact O-N 3.15Å; R96-I98 VanDerWaalsContact C-N 3.32Å; R96-I98 PolarHBondContact O-N 2.96Å; I98-K101 CarbonylContact O-C 3.52Å; I98-P102 WeakPolarHBondContact O-CA 3.44Å; I98-A107 HydrophobicContact CG1-CB 4.31Å; I98-R108 HydrophobicContact CD1-CB 4.06Å; I98-R108 HydrophobicContact CD1-CG 4.32Å; I98-R108 HydrophobicContact CG1-CB 4.32Å; I98-R111 HydrophobicContact CD1-CB 4.07Å; I98-R111 VanDerWaalsContact CD1-NE 3.32Å
99E95.7Very high94.3Very high126 Ų12640.4 Ų40.459%0.58922%0.216SC*.Hα-helixtrans-65.6-46.7172.5-72.3170.1-167.500112.2S95 R96 V97S95-E99 WeakPolarHBondContact O-CG 3.18Å; S95-E99 PolarHBondContact O-N 2.66Å; R96-E99 WeakPolarHBondContact CD-OE2 3.47Å; R96-E99 IonicContact CZ-OE2 2.69Å; R96-E99 IonicContact NH1-OE2 2.71Å; R96-E99 PolarHBondContact NH1-OE2 3.2Å; R96-E99 PolarHBondContact O-N 3.08Å; V97-E99 VanDerWaalsContact C-N 3.33Å; V97-E99 PolarHBondContact O-N 3.12Å
100L95.6Very high94.6Very high56 Ų5640.9 Ų40.929%0.29321%0.213SC..Hα-helixtrans-72.7-36.1-179-69.5172.3000112.1Y74 R96 V97Y74-L100 HydrophobicContact CD2-CD1 3.99Å; Y74-L100 HydrophobicContact CE2-CD1 4.07Å; R96-L100 HydrophobicContact CG-CD1 4.06Å; R96-L100 HydrophobicContact CG-CG 4.46Å; R96-L100 WeakPolarHBondContact O-CB 3.45Å; R96-L100 VanDerWaalsContact O-CG 3.32Å; R96-L100 WeakPolarHBondContact O-CG 3.44Å; R96-L100 PolarHBondContact O-N 3.08Å; V97-L100 PolarHBondContact O-N 3.27Å
101K94.6Very high94.7Very high59 Ų5943 Ų4326%0.25722%0.221SC..  trans-140.285.3-175.7-167.1168.8-179.2155.40111.8Y71 V97 I98 D103 F104Y71-K101 HydrophobicContact CD1-CB 4.27Å; Y71-K101 HydrophobicContact CD1-CD 3.94Å; Y71-K101 HydrophobicContact CD2-CB 4.14Å; Y71-K101 HydrophobicContact CD2-CD 3.97Å; Y71-K101 HydrophobicContact CE1-CD 3.5Å; Y71-K101 VanDerWaalsContact CE1-CD 3.5Å; Y71-K101 HydrophobicContact CE2-CD 3.54Å; Y71-K101 HydrophobicContact CG-CB 3.97Å; Y71-K101 HydrophobicContact CG-CD 4.15Å; Y71-K101 PolarHBondContact OH-NZ 3.01Å; V97-K101 WeakPolarHBondContact O-CA 3.45Å; V97-K101 PolarHBondContact O-N 3.35Å; I98-K101 CarbonylContact O-C 3.52Å; K101-D103 VanDerWaalsContact C-N 3.29Å; K101-D103 VanDerWaalsContact CE-CG 3.47Å; K101-D103 VanDerWaalsContact CE-OD1 3.26Å; K101-D103 WeakPolarHBondContact CE-OD1 3.41Å; K101-D103 WeakPolarHBondContact CE-OD2 3.46Å; K101-D103 WeakPolarHBondContact CG-OD1 3.47Å; K101-D103 IonicContact NZ-OD2 3.23Å; K101-D103 PolarHBondContact O-N 2.93Å; K101-F104 HydrophobicContact CB-CB 4.25Å; K101-F104 HydrophobicContact CD-CB 4.1Å; K101-F104 HydrophobicContact CG-CB 3.93Å; K101-F104 WeakPolarHBondContact O-CB 3.29Å; K101-F104 PolarHBondContact O-N 2.97Å
102P92.2Very high94.9Very high79 Ų7941.3 Ų41.351%0.51321%0.212SC..THydrogen-bonded Turntrans-65.6-24.5-176.4-24.134.7000115.3I98 F104 R108I98-P102 WeakPolarHBondContact O-CA 3.44Å; P102-F104 VanDerWaalsContact C-N 3.26Å; P102-F104 PolarHBondContact O-N 3.12Å; P102-R108 VanDerWaalsContact O-CZ 3.26Å; P102-R108 PolarHBondContact O-NH1 3.25Å; P102-R108 PolarHBondContact O-NH2 3.04Å
103D89.7Confident94.9Very high106 Ų10638.8 Ų38.857%0.56719%0.194SC*.THydrogen-bonded Turntrans-76.6-10.5177.460-48.4000113.1K101 T105K101-D103 VanDerWaalsContact C-N 3.29Å; K101-D103 VanDerWaalsContact CE-CG 3.47Å; K101-D103 VanDerWaalsContact CE-OD1 3.26Å; K101-D103 WeakPolarHBondContact CE-OD1 3.41Å; K101-D103 WeakPolarHBondContact CE-OD2 3.46Å; K101-D103 WeakPolarHBondContact CG-OD1 3.47Å; K101-D103 IonicContact NZ-OD2 3.23Å; K101-D103 PolarHBondContact O-N 2.93Å; D103-T105 PolarHBondContact O-N 3.07Å
104F92.6Very high94.8Very high46 Ų4638.6 Ų38.620%0.20219%0.193CC..  trans-79.184-178.8-165.3-119.9000112.1Y71 Y75 V97 K101 P102 S106 A107Y71-F104 HydrophobicContact CD2-CD1 4.5Å; Y71-F104 HydrophobicContact CE2-CD1 4.4Å; Y71-F104 HydrophobicContact CE2-CD2 4.32Å; Y71-F104 HydrophobicContact CE2-CG 4.26Å; Y75-F104 AromaticContact CD1-CE1 3.93Å; Y75-F104 HydrophobicContact CD1-CE1 3.93Å; Y75-F104 HydrophobicContact CD1-CZ 4.06Å; Y75-F104 AromaticContact CD2-CE1 3.66Å; Y75-F104 HydrophobicContact CD2-CE1 3.66Å; Y75-F104 HydrophobicContact CD2-CZ 4.5Å; Y75-F104 HydrophobicContact CE1-CE1 4.08Å; Y75-F104 AromaticContact CE1-CZ 3.98Å; Y75-F104 HydrophobicContact CE1-CZ 3.98Å; Y75-F104 AromaticContact CE2-CE1 3.81Å; Y75-F104 HydrophobicContact CE2-CE1 3.81Å; Y75-F104 HydrophobicContact CE2-CZ 4.42Å; Y75-F104 AromaticContact CG-CE1 3.71Å; Y75-F104 HydrophobicContact CG-CE1 3.71Å; Y75-F104 HydrophobicContact CG-CZ 4.31Å; V97-F104 HydrophobicContact CG1-CD1 3.6Å; V97-F104 HydrophobicContact CG1-CE1 4.24Å; K101-F104 HydrophobicContact CB-CB 4.25Å; K101-F104 HydrophobicContact CD-CB 4.1Å; K101-F104 HydrophobicContact CG-CB 3.93Å; K101-F104 WeakPolarHBondContact O-CB 3.29Å; K101-F104 PolarHBondContact O-N 2.97Å; P102-F104 VanDerWaalsContact C-N 3.26Å; P102-F104 PolarHBondContact O-N 3.12Å; F104-S106 VanDerWaalsContact C-N 3.31Å; F104-S106 PolarHBondContact O-N 2.95Å; F104-A107 HydrophobicContact CD1-CB 3.47Å; F104-A107 VanDerWaalsContact CD1-CB 3.47Å; F104-A107 HydrophobicContact CE1-CB 3.85Å; F104-A107 PolarHBondContact O-N 3.45Å
105T93.1Very high94.7Very high16 Ų1638.8 Ų38.810%0.09819%0.194CC..Hα-helixtrans-56.7-38.3-176.949.90000113.5D103 A107 R108 L109 E140D103-T105 PolarHBondContact O-N 3.07Å; T105-A107 VanDerWaalsContact C-N 3.34Å; T105-A107 PolarHBondContact O-N 3.31Å; T105-R108 WeakPolarHBondContact O-CB 3.45Å; T105-R108 PolarHBondContact O-N 2.94Å; T105-R108 VanDerWaalsContact O-N 3.07Å; T105-L109 PolarHBondContact O-N 3.41Å; T105-E140 PolarHBondContact OG1-OE1 3.35Å; T105-E140 PolarHBondContact OG1-OE2 3.11Å
106S92.6Very high94.7Very high33 Ų3337.7 Ų37.723%0.23119%0.186CC..Hα-helixtrans-62.7-37.9-177-46.50000112.6F104 Q110 E140F104-S106 VanDerWaalsContact C-N 3.31Å; F104-S106 PolarHBondContact O-N 2.95Å; S106-Q110 VanDerWaalsContact O-CG 3.27Å; S106-Q110 WeakPolarHBondContact O-CG 3.24Å; S106-Q110 PolarHBondContact O-N 3.41Å; S106-E140 WeakPolarHBondContact CA-OE1 3.36Å; S106-E140 PolarHBondContact N-OE1 3.02Å; S106-E140 PolarHBondContact OG-OE1 3.05Å
107A94.6Very high94.5Very high0 Ų038 Ų380%019%0.19CC..Hα-helixtrans-68.4-37174.300000112.2Y75 L94 V97 I98 F104 T105 Q110 R111Y75-A107 HydrophobicContact CD2-CB 3.94Å; Y75-A107 HydrophobicContact CE2-CB 4.14Å; L94-A107 HydrophobicContact CD2-CB 4.25Å; V97-A107 HydrophobicContact CB-CB 4.01Å; V97-A107 HydrophobicContact CG1-CB 3.47Å; V97-A107 VanDerWaalsContact CG1-CB 3.47Å; I98-A107 HydrophobicContact CG1-CB 4.31Å; F104-A107 HydrophobicContact CD1-CB 3.47Å; F104-A107 VanDerWaalsContact CD1-CB 3.47Å; F104-A107 HydrophobicContact CE1-CB 3.85Å; F104-A107 PolarHBondContact O-N 3.45Å; T105-A107 VanDerWaalsContact C-N 3.34Å; T105-A107 PolarHBondContact O-N 3.31Å; A107-Q110 PolarHBondContact O-N 2.92Å; A107-R111 WeakPolarHBondContact O-CB 3.45Å; A107-R111 PolarHBondContact O-N 3.04Å
108R95.9Very high94.2Very high18 Ų1839.8 Ų39.87%0.06820%0.198CC..Hα-helixtrans-66.3-41.5176.2-169.6176.7-70.8111.7-0.4112I98 P102 T105 R111 G112 D127 V131I98-R108 HydrophobicContact CD1-CB 4.06Å; I98-R108 HydrophobicContact CD1-CG 4.32Å; I98-R108 HydrophobicContact CG1-CB 4.32Å; P102-R108 VanDerWaalsContact O-CZ 3.26Å; P102-R108 PolarHBondContact O-NH1 3.25Å; P102-R108 PolarHBondContact O-NH2 3.04Å; T105-R108 WeakPolarHBondContact O-CB 3.45Å; T105-R108 PolarHBondContact O-N 2.94Å; T105-R108 VanDerWaalsContact O-N 3.07Å; R108-R111 PolarHBondContact O-N 2.88Å; R108-G112 PolarHBondContact O-N 3.1Å; R108-D127 WeakPolarHBondContact CD-O 3.38Å; R108-D127 HydrophobicContact CG-CB 3.8Å; R108-V131 HydrophobicContact CB-CG2 3.87Å; R108-V131 HydrophobicContact CG-CG2 3.88Å
109L95.4Very high94.1Very high4 Ų440 Ų402%0.02120%0.204CC..Hα-helixtrans-60.6-46.2173.7-17764.9000111.3T105 R111 G112 N113 F128 V131 E140 E143 A144T105-L109 PolarHBondContact O-N 3.41Å; L109-R111 VanDerWaalsContact C-N 3.33Å; L109-R111 PolarHBondContact O-N 3.07Å; L109-G112 PolarHBondContact O-N 2.96Å; L109-N113 PolarHBondContact O-N 3.08Å; L109-F128 HydrophobicContact CD1-CD1 3.92Å; L109-F128 HydrophobicContact CD1-CE1 3.91Å; L109-V131 HydrophobicContact CB-CG2 4.21Å; L109-E140 HydrophobicContact CD2-CB 4.13Å; L109-E140 HydrophobicContact CD2-CG 3.9Å; L109-E143 HydrophobicContact CD1-CG 4.28Å; L109-E143 HydrophobicContact CD2-CB 4.32Å; L109-E143 HydrophobicContact CD2-CG 4.31Å; L109-A144 HydrophobicContact CD1-CB 4.02Å
110Q95.2Very high94.1Very high60 Ų6037.9 Ų37.928%0.2819%0.193SC..Hα-helixtrans-63.3-38.1176.3-68.2-58.3-44.100112.4L94 S106 A107 N113 L114L94-Q110 HydrophobicContact CD1-CB 4.1Å; L94-Q110 HydrophobicContact CD2-CB 4.1Å; S106-Q110 VanDerWaalsContact O-CG 3.27Å; S106-Q110 WeakPolarHBondContact O-CG 3.24Å; S106-Q110 PolarHBondContact O-N 3.41Å; A107-Q110 PolarHBondContact O-N 2.92Å; Q110-N113 PolarHBondContact O-N 3.25Å; Q110-L114 WeakPolarHBondContact O-CB 3.45Å; Q110-L114 PolarHBondContact O-N 3.22Å
111R96.3Very high94.1Very high46 Ų4635.8 Ų35.817%0.17418%0.182CC..Hα-helixtrans-66.6-44.2175.5-165.4177.268.4173.61.3111.4L91 L94 S95 I98 A107 R108 L109 N113 L114 L115 D127L91-R111 HydrophobicContact CD1-CG 4.15Å; L94-R111 HydrophobicContact CB-CB 4.15Å; L94-R111 HydrophobicContact CB-CG 4.37Å; L94-R111 HydrophobicContact CD1-CB 4.28Å; S95-R111 WeakPolarHBondContact OG-CD 3.36Å; S95-R111 PolarHBondContact OG-NH1 2.92Å; I98-R111 HydrophobicContact CD1-CB 4.07Å; I98-R111 VanDerWaalsContact CD1-NE 3.32Å; A107-R111 WeakPolarHBondContact O-CB 3.45Å; A107-R111 PolarHBondContact O-N 3.04Å; R108-R111 PolarHBondContact O-N 2.88Å; L109-R111 VanDerWaalsContact C-N 3.33Å; L109-R111 PolarHBondContact O-N 3.07Å; R111-N113 PolarHBondContact O-N 3.32Å; R111-L114 WeakPolarHBondContact O-CB 3.43Å; R111-L114 PolarHBondContact O-N 3.02Å; R111-L114 VanDerWaalsContact O-N 3.14Å; R111-L115 HydrophobicContact CG-CD1 3.94Å; R111-L115 HydrophobicContact CG-CG 4.29Å; R111-L115 WeakPolarHBondContact O-CB 3.38Å; R111-L115 VanDerWaalsContact O-CG 3.24Å; R111-L115 WeakPolarHBondContact O-CG 3.46Å; R111-L115 PolarHBondContact O-N 2.8Å; R111-D127 IonicContact CZ-OD1 2.67Å; R111-D127 IonicContact CZ-OD2 2.64Å; R111-D127 VanDerWaalsContact CZ-OD2 3.3Å; R111-D127 IonicContact NE-OD1 3.95Å; R111-D127 IonicContact NE-OD2 3.39Å; R111-D127 PolarHBondContact NE-OD2 3.01Å; R111-D127 VanDerWaalsContact NH2-CG 3.31Å; R111-D127 IonicContact NH2-OD1 3.81Å; R111-D127 PolarHBondContact NH2-OD1 3.41Å; R111-D127 IonicContact NH2-OD2 3.66Å; R111-D127 PolarHBondContact NH2-OD2 3.45Å; R111-D127 VanDerWaalsContact NH2-OD2 3.09Å
112G96Very high94.1Very high0 Ų038.2 Ų38.20%020%0.198CC..Hα-helixtrans-56.4-46.9174.200000112.4R108 L109 L114 L115 L116 A124R108-G112 PolarHBondContact O-N 3.1Å; L109-G112 PolarHBondContact O-N 2.96Å; G112-L114 VanDerWaalsContact C-N 3.3Å; G112-L114 PolarHBondContact O-N 3.33Å; G112-L115 PolarHBondContact O-N 3.37Å; G112-L116 WeakPolarHBondContact O-CB 3.4Å; G112-L116 PolarHBondContact O-N 2.94Å; G112-A124 WeakPolarHBondContact O-CB 3.42Å
113N94.8Very high94.3Very high23 Ų2339.1 Ų39.112%0.12320%0.195CC..Hα-helixtrans-59.6-39.7175.7-74.1-21.5000112.7L109 Q110 R111 K117 F128 E143 Q147L109-N113 PolarHBondContact O-N 3.08Å; Q110-N113 PolarHBondContact O-N 3.25Å; R111-N113 PolarHBondContact O-N 3.32Å; N113-K117 WeakPolarHBondContact O-CG 3.47Å; N113-K117 PolarHBondContact O-N 3.31Å; N113-F128 WeakPolarHBondContact OD1-CE1 3.45Å; N113-F128 WeakPolarHBondContact OD1-CZ 3.33Å; N113-E143 PolarHBondContact ND2-OE1 2.94Å; N113-Q147 WeakPolarHBondContact OD1-CG 3.01Å
114L94.4Very high94.6Very high4 Ų434 Ų342%0.02117%0.168CC..Hα-helixtrans-69.3-42.8178.5-177.757.1000111.9L82 A90 L91 L94 Q110 R111 G112 K117 Q118 W186L82-L114 HydrophobicContact CD2-CD1 4.29Å; L82-L114 HydrophobicContact CD2-CD2 4.42Å; A90-L114 HydrophobicContact CB-CD2 4.23Å; L91-L114 HydrophobicContact CB-CD2 3.76Å; L91-L114 HydrophobicContact CD1-CB 4.5Å; L91-L114 HydrophobicContact CD1-CD2 3.64Å; L91-L114 HydrophobicContact CD1-CG 3.9Å; L91-L114 HydrophobicContact CG-CD2 4.33Å; L94-L114 HydrophobicContact CD1-CD2 4.07Å; Q110-L114 WeakPolarHBondContact O-CB 3.45Å; Q110-L114 PolarHBondContact O-N 3.22Å; R111-L114 WeakPolarHBondContact O-CB 3.43Å; R111-L114 PolarHBondContact O-N 3.02Å; R111-L114 VanDerWaalsContact O-N 3.14Å; G112-L114 VanDerWaalsContact C-N 3.3Å; G112-L114 PolarHBondContact O-N 3.33Å; L114-K117 PolarHBondContact O-N 3.02Å; L114-Q118 WeakPolarHBondContact O-CG 3.43Å; L114-Q118 PolarHBondContact O-N 2.84Å; L114-Q118 VanDerWaalsContact O-N 3.12Å; L114-W186 HydrophobicContact CD1-CE3 4Å; L114-W186 HydrophobicContact CD1-CZ3 3.49Å; L114-W186 VanDerWaalsContact CD1-CZ3 3.49Å
115L95.3Very high94.8Very high4 Ų432.5 Ų32.52%0.02116%0.162CC..Hα-helixtrans-63.4-41.3175.8-71.3166.3000111.3L91 R111 G112 K117 Q118 G119 K120 E123 A124L91-L115 HydrophobicContact CD1-CD2 3.92Å; L91-L115 HydrophobicContact CD1-CG 4.17Å; R111-L115 HydrophobicContact CG-CD1 3.94Å; R111-L115 HydrophobicContact CG-CG 4.29Å; R111-L115 WeakPolarHBondContact O-CB 3.38Å; R111-L115 VanDerWaalsContact O-CG 3.24Å; R111-L115 WeakPolarHBondContact O-CG 3.46Å; R111-L115 PolarHBondContact O-N 2.8Å; G112-L115 PolarHBondContact O-N 3.37Å; L115-K117 PolarHBondContact O-N 3.44Å; L115-Q118 CarbonylContact O-C 3.52Å; L115-Q118 WeakPolarHBondContact O-CA 3.37Å; L115-Q118 WeakPolarHBondContact O-CB 3.33Å; L115-Q118 PolarHBondContact O-N 3.19Å; L115-Q118 VanDerWaalsContact O-N 3.08Å; L115-G119 PolarHBondContact O-N 3.37Å; L115-K120 HydrophobicContact CB-CB 4.23Å; L115-K120 HydrophobicContact CD2-CB 4.03Å; L115-K120 HydrophobicContact CD2-CD 3.54Å; L115-K120 HydrophobicContact CD2-CG 4.46Å; L115-K120 PolarHBondContact O-N 2.88Å; L115-E123 HydrophobicContact CD1-CB 3.85Å; L115-E123 HydrophobicContact CD2-CB 4.16Å; L115-E123 HydrophobicContact CG-CB 4.47Å; L115-A124 HydrophobicContact CB-CB 3.8Å
116L95.1Very high95Very high5 Ų534.2 Ų34.23%0.02617%0.174CC..Hα-helixtrans-59.4-46.6175-170.372.5000111.1G112 Q118 G119 L121 A124 Q147 L154 C184G112-L116 WeakPolarHBondContact O-CB 3.4Å; G112-L116 PolarHBondContact O-N 2.94Å; L116-Q118 PolarHBondContact O-N 3.11Å; L116-G119 PolarHBondContact O-N 2.96Å; L116-L121 HydrophobicContact CD1-CD2 3.74Å; L116-A124 HydrophobicContact CB-CB 4.13Å; L116-A124 HydrophobicContact CD1-CB 4.49Å; L116-Q147 VanDerWaalsContact CD2-OE1 3.23Å; L116-L154 HydrophobicContact CD1-CD1 4Å; L116-L154 HydrophobicContact CG-CD1 4.46Å; L116-C184 PolarHBondContact O-SG 2.93Å
117K92.6Very high95.1Very high96 Ų9632.8 Ų32.842%0.41716%0.164SC..Hα-helixtrans-62.6-27.2175.5-73-178.6178.8-175.20113.5N113 L114 L115 G119 C184 V185 W186 D187N113-K117 WeakPolarHBondContact O-CG 3.47Å; N113-K117 PolarHBondContact O-N 3.31Å; L114-K117 PolarHBondContact O-N 3.02Å; L115-K117 PolarHBondContact O-N 3.44Å; K117-G119 VanDerWaalsContact C-N 3.3Å; K117-C184 CarbonylContact O-C 3.56Å; K117-C184 WeakPolarHBondContact O-CA 3.49Å; K117-V185 HydrophobicContact CB-CG2 4.4Å; K117-V185 HydrophobicContact CG-CG2 4.49Å; K117-V185 PolarHBondContact O-N 3.25Å; K117-W186 HydrophobicContact CB-CD2 4.39Å; K117-W186 HydrophobicContact CB-CE3 3.59Å; K117-W186 HydrophobicContact CB-CZ3 3.72Å; K117-W186 HydrophobicContact CD-CE3 4.21Å; K117-W186 HydrophobicContact CD-CH2 3.72Å; K117-W186 HydrophobicContact CD-CZ3 3.5Å; K117-W186 VanDerWaalsContact CD-CZ3 3.5Å; K117-W186 HydrophobicContact CG-CZ3 4.26Å; K117-W186 CarbonylContact O-C 3.2Å; K117-W186 WeakPolarHBondContact O-CA 3.47Å; K117-W186 PolarHBondContact O-N 2.8Å; K117-D187 PolarHBondContact O-N 2.64Å
118Q91.6Very high95.3Very high37 Ų3732.8 Ų32.817%0.17316%0.164CC..THydrogen-bonded Turntrans-83.1-2.3174.7-71178.3-10.900113.4L114 L115 L116 K120 W186 D187L114-Q118 WeakPolarHBondContact O-CG 3.43Å; L114-Q118 PolarHBondContact O-N 2.84Å; L114-Q118 VanDerWaalsContact O-N 3.12Å; L115-Q118 CarbonylContact O-C 3.52Å; L115-Q118 WeakPolarHBondContact O-CA 3.37Å; L115-Q118 WeakPolarHBondContact O-CB 3.33Å; L115-Q118 PolarHBondContact O-N 3.19Å; L115-Q118 VanDerWaalsContact O-N 3.08Å; L116-Q118 PolarHBondContact O-N 3.11Å; Q118-K120 HydrophobicContact CB-CD 4.39Å; Q118-K120 HydrophobicContact CB-CG 4.32Å; Q118-K120 PolarHBondContact O-N 2.88Å; Q118-W186 HydrophobicContact CG-CB 4.32Å; Q118-D187 WeakPolarHBondContact O-CA 3.29Å
119G93.3Very high95.3Very high21 Ų2136.1 Ų36.122%0.21618%0.179CC..THydrogen-bonded Turntrans74.810.6-175.400000114.1L115 L116 K117 L121L115-G119 PolarHBondContact O-N 3.37Å; L116-G119 PolarHBondContact O-N 2.96Å; K117-G119 VanDerWaalsContact C-N 3.3Å; G119-L121 PolarHBondContact O-N 3.18Å
120K94.6Very high95.2Very high82 Ų8240.5 Ų40.536%0.35720%0.198SC..  trans-84.165176.9-68.2176.2154-134.10110.5L115 Q118 D122 E123 A124L115-K120 HydrophobicContact CB-CB 4.23Å; L115-K120 HydrophobicContact CD2-CB 4.03Å; L115-K120 HydrophobicContact CD2-CD 3.54Å; L115-K120 HydrophobicContact CD2-CG 4.46Å; L115-K120 PolarHBondContact O-N 2.88Å; Q118-K120 HydrophobicContact CB-CD 4.39Å; Q118-K120 HydrophobicContact CB-CG 4.32Å; Q118-K120 PolarHBondContact O-N 2.88Å; K120-D122 PolarHBondContact O-N 3.23Å; K120-E123 HydrophobicContact CB-CB 4.34Å; K120-E123 VanDerWaalsContact CD-OE1 3.3Å; K120-E123 WeakPolarHBondContact CD-OE1 3.31Å; K120-E123 WeakPolarHBondContact CE-OE1 3.46Å; K120-E123 IonicContact NZ-OE1 3.7Å; K120-E123 PolarHBondContact NZ-OE1 3.07Å; K120-E123 IonicContact NZ-OE2 2.79Å; K120-E123 PolarHBondContact O-N 2.72Å; K120-A124 WeakPolarHBondContact O-CB 3.44Å; K120-A124 PolarHBondContact O-N 2.96Å
121L95.8Very high95.2Very high13 Ų1337.7 Ų37.77%0.06819%0.185CC..Hα-helixtrans-58.5-49.3-168.7-53.5-176.7000112.2L116 G119 E123 A124 E125 L154 Q155 V158L116-L121 HydrophobicContact CD1-CD2 3.74Å; G119-L121 PolarHBondContact O-N 3.18Å; L121-E123 VanDerWaalsContact C-N 3.35Å; L121-E123 PolarHBondContact O-N 3.48Å; L121-A124 WeakPolarHBondContact O-CB 3.26Å; L121-A124 PolarHBondContact O-N 3.46Å; L121-A124 VanDerWaalsContact O-N 3.11Å; L121-E125 WeakPolarHBondContact O-CG 3.4Å; L121-E125 PolarHBondContact O-N 2.89Å; L121-L154 HydrophobicContact CD1-CB 3.9Å; L121-L154 HydrophobicContact CD2-CB 4.15Å; L121-L154 HydrophobicContact CD2-CD1 4.23Å; L121-Q155 HydrophobicContact CD1-CB 3.95Å; L121-Q155 HydrophobicContact CD1-CG 4.24Å; L121-V158 HydrophobicContact CD1-CG2 4.17Å
122D95.9Very high95.2Very high110 Ų11038.2 Ų38.259%0.58819%0.191SC*.Hα-helixtrans-60.7-41.5-178.6-58.3-29.8000112.9K120 S126 Q155K120-D122 PolarHBondContact O-N 3.23Å; D122-S126 WeakPolarHBondContact O-CB 3.49Å; D122-S126 PolarHBondContact O-N 2.94Å; D122-S126 VanDerWaalsContact O-N 3.12Å; D122-Q155 PolarHBondContact OD1-NE2 3.49Å
123E95.6Very high95Very high97 Ų9746.6 Ų46.645%0.45323%0.227SC..Hα-helixtrans-66.9-41.5176.8-62.2-177.2-116.600110.7L115 K120 L121 S126 D127L115-E123 HydrophobicContact CD1-CB 3.85Å; L115-E123 HydrophobicContact CD2-CB 4.16Å; L115-E123 HydrophobicContact CG-CB 4.47Å; K120-E123 HydrophobicContact CB-CB 4.34Å; K120-E123 VanDerWaalsContact CD-OE1 3.3Å; K120-E123 WeakPolarHBondContact CD-OE1 3.31Å; K120-E123 WeakPolarHBondContact CE-OE1 3.46Å; K120-E123 IonicContact NZ-OE1 3.7Å; K120-E123 PolarHBondContact NZ-OE1 3.07Å; K120-E123 IonicContact NZ-OE2 2.79Å; K120-E123 PolarHBondContact O-N 2.72Å; L121-E123 VanDerWaalsContact C-N 3.35Å; L121-E123 PolarHBondContact O-N 3.48Å; E123-S126 WeakPolarHBondContact O-CB 3.43Å; E123-S126 PolarHBondContact O-N 3.19Å; E123-D127 PolarHBondContact O-N 2.91Å
124A96.4Very high94.7Very high0 Ų047.7 Ų47.70%024%0.237CC..Hα-helixtrans-62.9-46.7178.100000111.8G112 L115 L116 K120 L121 S126 D127 F128G112-A124 WeakPolarHBondContact O-CB 3.42Å; L115-A124 HydrophobicContact CB-CB 3.8Å; L116-A124 HydrophobicContact CB-CB 4.13Å; L116-A124 HydrophobicContact CD1-CB 4.49Å; K120-A124 WeakPolarHBondContact O-CB 3.44Å; K120-A124 PolarHBondContact O-N 2.96Å; L121-A124 WeakPolarHBondContact O-CB 3.26Å; L121-A124 PolarHBondContact O-N 3.46Å; L121-A124 VanDerWaalsContact O-N 3.11Å; A124-S126 VanDerWaalsContact C-N 3.33Å; A124-S126 PolarHBondContact O-N 3.06Å; A124-D127 WeakPolarHBondContact O-CB 3.45Å; A124-D127 PolarHBondContact O-N 2.89Å; A124-D127 VanDerWaalsContact O-N 3.16Å; A124-F128 HydrophobicContact CB-CD2 4.48Å; A124-F128 HydrophobicContact CB-CE2 4.01Å; A124-F128 WeakPolarHBondContact O-CD2 3.46Å; A124-F128 WeakPolarHBondContact O-CG 3.28Å; A124-F128 PolarHBondContact O-N 3.31Å
125E96.4Very high94.3Very high14 Ų1455 Ų557%0.06528%0.276CS..Hα-helixtrans-61.7-41.3176.9-70-175.5-158.400112.7L121 D127 F128 K129 L148 S151L121-E125 WeakPolarHBondContact O-CG 3.4Å; L121-E125 PolarHBondContact O-N 2.89Å; E125-D127 PolarHBondContact O-N 3.25Å; E125-F128 PolarHBondContact O-N 2.82Å; E125-K129 HydrophobicContact CB-CD 4.48Å; E125-K129 VanDerWaalsContact O-CB 3.25Å; E125-K129 WeakPolarHBondContact O-CB 3.35Å; E125-K129 WeakPolarHBondContact O-CD 3.37Å; E125-K129 VanDerWaalsContact O-CG 3.25Å; E125-K129 WeakPolarHBondContact O-CG 3.35Å; E125-K129 PolarHBondContact O-N 3.14Å; E125-K129 IonicContact OE2-NZ 2.78Å; E125-K129 PolarHBondContact OE2-NZ 2.91Å; E125-L148 HydrophobicContact CB-CD1 3.84Å; E125-L148 HydrophobicContact CG-CD1 3.75Å; E125-S151 WeakPolarHBondContact CG-OG 3.41Å; E125-S151 PolarHBondContact OE1-OG 3.35Å; E125-S151 VanDerWaalsContact OE1-OG 3.04Å
126S96.5Very high94Very high51 Ų5155.8 Ų55.836%0.35728%0.282SS..Hα-helixtrans-57.2-41.1176.1-171.90000110.9D122 E123 A124 K130D122-S126 WeakPolarHBondContact O-CB 3.49Å; D122-S126 PolarHBondContact O-N 2.94Å; D122-S126 VanDerWaalsContact O-N 3.12Å; E123-S126 WeakPolarHBondContact O-CB 3.43Å; E123-S126 PolarHBondContact O-N 3.19Å; A124-S126 VanDerWaalsContact C-N 3.33Å; A124-S126 PolarHBondContact O-N 3.06Å; S126-K130 WeakPolarHBondContact O-CB 3.49Å; S126-K130 WeakPolarHBondContact O-CD 3.35Å; S126-K130 VanDerWaalsContact O-CG 3.25Å; S126-K130 WeakPolarHBondContact O-CG 3.31Å; S126-K130 PolarHBondContact O-N 3.47Å; S126-K130 VanDerWaalsContact O-N 3.1Å
127D96.3Very high93.9Very high3 Ų358.4 Ų58.42%0.01630%0.3CS..Hα-helixtrans-69.2-47.3176.4-84.7-9.6000112.8R108 R111 E123 A124 E125 K129 K130 V131R108-D127 WeakPolarHBondContact CD-O 3.38Å; R108-D127 HydrophobicContact CG-CB 3.8Å; R111-D127 IonicContact CZ-OD1 2.67Å; R111-D127 IonicContact CZ-OD2 2.64Å; R111-D127 VanDerWaalsContact CZ-OD2 3.3Å; R111-D127 IonicContact NE-OD1 3.95Å; R111-D127 IonicContact NE-OD2 3.39Å; R111-D127 PolarHBondContact NE-OD2 3.01Å; R111-D127 VanDerWaalsContact NH2-CG 3.31Å; R111-D127 IonicContact NH2-OD1 3.81Å; R111-D127 PolarHBondContact NH2-OD1 3.41Å; R111-D127 IonicContact NH2-OD2 3.66Å; R111-D127 PolarHBondContact NH2-OD2 3.45Å; R111-D127 VanDerWaalsContact NH2-OD2 3.09Å; E123-D127 PolarHBondContact O-N 2.91Å; A124-D127 WeakPolarHBondContact O-CB 3.45Å; A124-D127 PolarHBondContact O-N 2.89Å; A124-D127 VanDerWaalsContact O-N 3.16Å; E125-D127 PolarHBondContact O-N 3.25Å; D127-K129 PolarHBondContact O-N 3.39Å; D127-K130 PolarHBondContact O-N 2.86Å; D127-V131 WeakPolarHBondContact O-CG2 3.02Å; D127-V131 PolarHBondContact O-N 3.34Å
128F97.1Very high93.9Very high0 Ų059.7 Ų59.70%031%0.311CS..Hα-helixtrans-61.5-44.3177.3-62.9-47.3000111.9L109 N113 A124 E125 K130 V131 L132 A144 Q147 L148L109-F128 HydrophobicContact CD1-CD1 3.92Å; L109-F128 HydrophobicContact CD1-CE1 3.91Å; N113-F128 WeakPolarHBondContact OD1-CE1 3.45Å; N113-F128 WeakPolarHBondContact OD1-CZ 3.33Å; A124-F128 HydrophobicContact CB-CD2 4.48Å; A124-F128 HydrophobicContact CB-CE2 4.01Å; A124-F128 WeakPolarHBondContact O-CD2 3.46Å; A124-F128 WeakPolarHBondContact O-CG 3.28Å; A124-F128 PolarHBondContact O-N 3.31Å; E125-F128 PolarHBondContact O-N 2.82Å; F128-K130 VanDerWaalsContact C-N 3.29Å; F128-K130 PolarHBondContact O-N 3.33Å; F128-V131 WeakPolarHBondContact O-CB 3.41Å; F128-V131 PolarHBondContact O-N 2.96Å; F128-V131 VanDerWaalsContact O-N 3.13Å; F128-L132 WeakPolarHBondContact O-CG 3.33Å; F128-L132 PolarHBondContact O-N 3.39Å; F128-A144 HydrophobicContact CB-CB 4.42Å; F128-A144 HydrophobicContact CD1-CB 4.36Å; F128-Q147 HydrophobicContact CD1-CB 4.29Å; F128-Q147 HydrophobicContact CD2-CB 4.07Å; F128-Q147 HydrophobicContact CE1-CB 3.8Å; F128-Q147 HydrophobicContact CE1-CG 4.2Å; F128-Q147 HydrophobicContact CE2-CB 3.56Å; F128-Q147 HydrophobicContact CG-CB 4.43Å; F128-Q147 HydrophobicContact CZ-CB 3.4Å; F128-Q147 HydrophobicContact CZ-CG 4Å; F128-L148 HydrophobicContact CB-CD1 4.19Å
129K95.9Very high94Very high88 Ų8865.6 Ų65.638%0.38334%0.336SS..Hα-helixtrans-60.7-36.6175.8-73.9164.6176.8154.10111.8E125 D127 K133 L148E125-K129 HydrophobicContact CB-CD 4.48Å; E125-K129 VanDerWaalsContact O-CB 3.25Å; E125-K129 WeakPolarHBondContact O-CB 3.35Å; E125-K129 WeakPolarHBondContact O-CD 3.37Å; E125-K129 VanDerWaalsContact O-CG 3.25Å; E125-K129 WeakPolarHBondContact O-CG 3.35Å; E125-K129 PolarHBondContact O-N 3.14Å; E125-K129 IonicContact OE2-NZ 2.78Å; E125-K129 PolarHBondContact OE2-NZ 2.91Å; D127-K129 PolarHBondContact O-N 3.39Å; K129-K133 VanDerWaalsContact O-CG 3.32Å; K129-K133 WeakPolarHBondContact O-CG 3.48Å; K129-K133 PolarHBondContact O-N 2.92Å; K129-L148 HydrophobicContact CD-CD1 4.36Å; K129-L148 HydrophobicContact CG-CD1 4.03Å; K129-L148 HydrophobicContact CG-CD2 4.19Å
130K95Very high94Very high97 Ų9765.8 Ų65.842%0.42233%0.332SS..Hα-helixtrans-71.4-35.6174.8-78.5170.9-172.9167.80112.6S126 D127 F128 K133 S134S126-K130 WeakPolarHBondContact O-CB 3.49Å; S126-K130 WeakPolarHBondContact O-CD 3.35Å; S126-K130 VanDerWaalsContact O-CG 3.25Å; S126-K130 WeakPolarHBondContact O-CG 3.31Å; S126-K130 PolarHBondContact O-N 3.47Å; S126-K130 VanDerWaalsContact O-N 3.1Å; D127-K130 PolarHBondContact O-N 2.86Å; F128-K130 VanDerWaalsContact C-N 3.29Å; F128-K130 PolarHBondContact O-N 3.33Å; K130-K133 PolarHBondContact O-N 2.98Å; K130-S134 WeakPolarHBondContact O-CB 3.47Å; K130-S134 PolarHBondContact O-N 3.4Å; K130-S134 PolarHBondContact O-OG 3.41Å
131V95.3Very high93.9Very high0 Ų066.4 Ų66.40%034%0.336CS..Hα-helixtrans-59.9-48.8172.9170.70000110.1R108 L109 D127 F128 K133 S134 P136 A144R108-V131 HydrophobicContact CB-CG2 3.87Å; R108-V131 HydrophobicContact CG-CG2 3.88Å; L109-V131 HydrophobicContact CB-CG2 4.21Å; D127-V131 WeakPolarHBondContact O-CG2 3.02Å; D127-V131 PolarHBondContact O-N 3.34Å; F128-V131 WeakPolarHBondContact O-CB 3.41Å; F128-V131 PolarHBondContact O-N 2.96Å; F128-V131 VanDerWaalsContact O-N 3.13Å; V131-K133 PolarHBondContact O-N 2.9Å; V131-S134 PolarHBondContact O-N 3.08Å; V131-P136 HydrophobicContact CG1-CB 4.13Å; V131-P136 WeakPolarHBondContact O-CD 3.42Å; V131-A144 HydrophobicContact CB-CB 4.42Å; V131-A144 HydrophobicContact CG1-CB 4.11Å
132L94.3Very high93.9Very high58 Ų5873.2 Ų73.230%0.30437%0.365SS..Hα-helixtrans-61.2-26178.8-65174.3000113.6F128 E141 A144 L148F128-L132 WeakPolarHBondContact O-CG 3.33Å; F128-L132 PolarHBondContact O-N 3.39Å; L132-E141 HydrophobicContact CD2-CB 4.42Å; L132-E141 HydrophobicContact CD2-CG 3.72Å; L132-A144 HydrophobicContact CD2-CB 3.85Å; L132-A144 HydrophobicContact CG-CB 4.02Å; L132-L148 HydrophobicContact CD1-CD2 4.45Å
133K93.4Very high93.9Very high175 Ų17570.7 Ų70.776%0.76135%0.35SS*.THydrogen-bonded Turntrans-85.9-8.5176.8-70.7175.4-177.7-175.40114.5K129 K130 V131K129-K133 VanDerWaalsContact O-CG 3.32Å; K129-K133 WeakPolarHBondContact O-CG 3.48Å; K129-K133 PolarHBondContact O-N 2.92Å; K130-K133 PolarHBondContact O-N 2.98Å; V131-K133 PolarHBondContact O-N 2.9Å
134S88.6Confident93.9Very high47 Ų4766 Ų6633%0.32933%0.328SS..SBendtrans-109.130.1-168.4-56.90000113.6K130 V131K130-S134 WeakPolarHBondContact O-CB 3.47Å; K130-S134 PolarHBondContact O-N 3.4Å; K130-S134 PolarHBondContact O-OG 3.41Å; V131-S134 PolarHBondContact O-N 3.08Å
135N85.8Confident93.9Very high156 Ų15669.4 Ų69.483%0.83435%0.349SS*.  trans51.864.8-174.6-63.3-16.9000113
136P88.9Confident93.9Very high22 Ų2271.4 Ų71.414%0.14336%0.364CS..  trans-66.9158.3179.232-36.8000111.7V131 E140 E141V131-P136 HydrophobicContact CG1-CB 4.13Å; V131-P136 WeakPolarHBondContact O-CD 3.42Å; P136-E140 HydrophobicContact CB-CB 3.9Å; P136-E141 HydrophobicContact CB-CB 4.28Å; P136-E141 HydrophobicContact CG-CB 3.82Å; P136-E141 HydrophobicContact CG-CG 4.12Å
137S92.1Very high93.9Very high59 Ų5970.8 Ų70.841%0.41336%0.356SS..  trans-67.7155.916360.70000111.1K139 E140 E141S137-K139 PolarHBondContact O-N 3.17Å; S137-E140 PolarHBondContact N-OE2 3.09Å; S137-E140 VanDerWaalsContact N-OE2 3.07Å; S137-E140 PolarHBondContact O-N 3.21Å; S137-E140 VanDerWaalsContact OG-CG 3.24Å; S137-E140 WeakPolarHBondContact OG-CG 3.39Å; S137-E140 PolarHBondContact OG-N 3.18Å; S137-E140 PolarHBondContact OG-OE2 2.73Å; S137-E141 PolarHBondContact O-N 3.19Å
138D92.6Very high93.8Very high123 Ų12372 Ų7266%0.65836%0.362SS*.Hα-helixtrans-49.7-34.2177.5-65.23.3000113.5K142D138-K142 WeakPolarHBondContact O-CB 3.42Å; D138-K142 WeakPolarHBondContact O-CD 3.16Å; D138-K142 VanDerWaalsContact O-CG 3.24Å; D138-K142 WeakPolarHBondContact O-CG 3.44Å; D138-K142 PolarHBondContact O-N 2.99Å
139K93.6Very high93.8Very high161 Ų16174.8 Ų74.870%0.739%0.385SS*.Hα-helixtrans-70.7-48.2177-177-178.3175.2-176.50111.5S137 E141 K142 E143S137-K139 PolarHBondContact O-N 3.17Å; K139-E141 VanDerWaalsContact C-N 3.31Å; K139-K142 PolarHBondContact O-N 3Å; K139-E143 WeakPolarHBondContact O-CB 3.17Å; K139-E143 PolarHBondContact O-N 3.47Å
140E93.1Very high93.8Very high25 Ų2574.9 Ų74.912%0.11739%0.386CS..Hα-helixtrans-65.8-36179.1-70.2170.814000111.4T105 S106 L109 P136 S137 E143 A144T105-E140 PolarHBondContact OG1-OE1 3.35Å; T105-E140 PolarHBondContact OG1-OE2 3.11Å; S106-E140 WeakPolarHBondContact CA-OE1 3.36Å; S106-E140 PolarHBondContact N-OE1 3.02Å; S106-E140 PolarHBondContact OG-OE1 3.05Å; L109-E140 HydrophobicContact CD2-CB 4.13Å; L109-E140 HydrophobicContact CD2-CG 3.9Å; P136-E140 HydrophobicContact CB-CB 3.9Å; S137-E140 PolarHBondContact N-OE2 3.09Å; S137-E140 VanDerWaalsContact N-OE2 3.07Å; S137-E140 PolarHBondContact O-N 3.21Å; S137-E140 VanDerWaalsContact OG-CG 3.24Å; S137-E140 WeakPolarHBondContact OG-CG 3.39Å; S137-E140 PolarHBondContact OG-N 3.18Å; S137-E140 PolarHBondContact OG-OE2 2.73Å; E140-E143 PolarHBondContact O-N 3.29Å; E140-A144 WeakPolarHBondContact O-CB 3.21Å; E140-A144 PolarHBondContact O-N 3.36Å
141E94Very high93.8Very high96 Ų9670.3 Ų70.345%0.44937%0.366SS..Hα-helixtrans-64-49.1176.2-167.1-177.3155.700111.7L132 P136 S137 K139 E143 A144 T145L132-E141 HydrophobicContact CD2-CB 4.42Å; L132-E141 HydrophobicContact CD2-CG 3.72Å; P136-E141 HydrophobicContact CB-CB 4.28Å; P136-E141 HydrophobicContact CG-CB 3.82Å; P136-E141 HydrophobicContact CG-CG 4.12Å; S137-E141 PolarHBondContact O-N 3.19Å; K139-E141 VanDerWaalsContact C-N 3.31Å; E141-E143 VanDerWaalsContact C-N 3.35Å; E141-E143 PolarHBondContact O-N 2.98Å; E141-A144 PolarHBondContact O-N 2.99Å; E141-T145 WeakPolarHBondContact O-CB 3.25Å; E141-T145 PolarHBondContact O-N 3.33Å; E141-T145 PolarHBondContact O-OG1 3.08Å
142K95.6Very high93.8Very high156 Ų15673.4 Ų73.468%0.67838%0.382SS*.Hα-helixtrans-61.3-43.4176.3-74.3173.2-176.1175.20111.7D138 K139 S146D138-K142 WeakPolarHBondContact O-CB 3.42Å; D138-K142 WeakPolarHBondContact O-CD 3.16Å; D138-K142 VanDerWaalsContact O-CG 3.24Å; D138-K142 WeakPolarHBondContact O-CG 3.44Å; D138-K142 PolarHBondContact O-N 2.99Å; K139-K142 PolarHBondContact O-N 3Å; K142-S146 VanDerWaalsContact O-CB 3.32Å; K142-S146 WeakPolarHBondContact O-CB 3.31Å; K142-S146 PolarHBondContact O-N 3.1Å
143E95.6Very high93.8Very high56 Ų5677.2 Ų77.226%0.26240%0.399SS..Hα-helixtrans-64.5-51.9178-170.4174.4162.400111L109 N113 K139 E140 E141 T145 S146 Q147L109-E143 HydrophobicContact CD1-CG 4.28Å; L109-E143 HydrophobicContact CD2-CB 4.32Å; L109-E143 HydrophobicContact CD2-CG 4.31Å; N113-E143 PolarHBondContact ND2-OE1 2.94Å; K139-E143 WeakPolarHBondContact O-CB 3.17Å; K139-E143 PolarHBondContact O-N 3.47Å; E140-E143 PolarHBondContact O-N 3.29Å; E141-E143 VanDerWaalsContact C-N 3.35Å; E141-E143 PolarHBondContact O-N 2.98Å; E143-T145 VanDerWaalsContact C-N 3.32Å; E143-T145 PolarHBondContact O-N 3.14Å; E143-S146 PolarHBondContact O-N 2.98Å; E143-Q147 HydrophobicContact CG-CG 4.36Å; E143-Q147 VanDerWaalsContact O-CG 3.25Å; E143-Q147 WeakPolarHBondContact O-CG 3.45Å; E143-Q147 PolarHBondContact O-N 3.43Å
144A95.4Very high93.9Very high0 Ų069.4 Ų69.40%037%0.365CS..Hα-helixtrans-59.5-41.6179.700000112.2L109 F128 V131 L132 E140 E141 Q147 L148L109-A144 HydrophobicContact CD1-CB 4.02Å; F128-A144 HydrophobicContact CB-CB 4.42Å; F128-A144 HydrophobicContact CD1-CB 4.36Å; V131-A144 HydrophobicContact CB-CB 4.42Å; V131-A144 HydrophobicContact CG1-CB 4.11Å; L132-A144 HydrophobicContact CD2-CB 3.85Å; L132-A144 HydrophobicContact CG-CB 4.02Å; E140-A144 WeakPolarHBondContact O-CB 3.21Å; E140-A144 PolarHBondContact O-N 3.36Å; E141-A144 PolarHBondContact O-N 2.99Å; A144-Q147 PolarHBondContact O-N 3.18Å; A144-L148 VanDerWaalsContact O-CB 3.28Å; A144-L148 WeakPolarHBondContact O-CB 3.33Å; A144-L148 PolarHBondContact O-N 3.46Å
145T96.1Very high94.3Very high71 Ų7170.9 Ų70.944%0.43637%0.367SS..Hα-helixtrans-65.7-43.2177.4-55.40000111.6E141 E143 L148 A149E141-T145 WeakPolarHBondContact O-CB 3.25Å; E141-T145 PolarHBondContact O-N 3.33Å; E141-T145 PolarHBondContact O-OG1 3.08Å; E143-T145 VanDerWaalsContact C-N 3.32Å; E143-T145 PolarHBondContact O-N 3.14Å; T145-L148 PolarHBondContact O-N 3.11Å; T145-A149 PolarHBondContact O-N 3.29Å; T145-A149 VanDerWaalsContact O-N 3.09Å
146S96.6Very high94.7Very high56 Ų5672.2 Ų72.239%0.39236%0.36SS..Hα-helixtrans-63.4-42.9176.9-179.40000112.1K142 E143 K150K142-S146 VanDerWaalsContact O-CB 3.32Å; K142-S146 WeakPolarHBondContact O-CB 3.31Å; K142-S146 PolarHBondContact O-N 3.1Å; E143-S146 PolarHBondContact O-N 2.98Å; S146-K150 WeakPolarHBondContact O-CG 3.08Å; S146-K150 PolarHBondContact O-N 2.79Å
147Q96Very high95.1Very high37 Ų3773 Ų7317%0.17336%0.363CS..Hα-helixtrans-70.6-33178.7-61.6-65.4-8.500112.2N113 L116 F128 E143 A144 K150 S151N113-Q147 WeakPolarHBondContact OD1-CG 3.01Å; L116-Q147 VanDerWaalsContact CD2-OE1 3.23Å; F128-Q147 HydrophobicContact CD1-CB 4.29Å; F128-Q147 HydrophobicContact CD2-CB 4.07Å; F128-Q147 HydrophobicContact CE1-CB 3.8Å; F128-Q147 HydrophobicContact CE1-CG 4.2Å; F128-Q147 HydrophobicContact CE2-CB 3.56Å; F128-Q147 HydrophobicContact CG-CB 4.43Å; F128-Q147 HydrophobicContact CZ-CB 3.4Å; F128-Q147 HydrophobicContact CZ-CG 4Å; E143-Q147 HydrophobicContact CG-CG 4.36Å; E143-Q147 VanDerWaalsContact O-CG 3.25Å; E143-Q147 WeakPolarHBondContact O-CG 3.45Å; E143-Q147 PolarHBondContact O-N 3.43Å; A144-Q147 PolarHBondContact O-N 3.18Å; Q147-K150 PolarHBondContact O-N 3.07Å; Q147-S151 PolarHBondContact O-N 3.12Å
148L95.6Very high95.3Very high28 Ų2871.2 Ų71.215%0.14735%0.349CS..Hα-helixtrans-64.3-46.3174.9-168.372.3000111.5E125 F128 K129 L132 A144 T145 K150 S151 D152E125-L148 HydrophobicContact CB-CD1 3.84Å; E125-L148 HydrophobicContact CG-CD1 3.75Å; F128-L148 HydrophobicContact CB-CD1 4.19Å; K129-L148 HydrophobicContact CD-CD1 4.36Å; K129-L148 HydrophobicContact CG-CD1 4.03Å; K129-L148 HydrophobicContact CG-CD2 4.19Å; L132-L148 HydrophobicContact CD1-CD2 4.45Å; A144-L148 VanDerWaalsContact O-CB 3.28Å; A144-L148 WeakPolarHBondContact O-CB 3.33Å; A144-L148 PolarHBondContact O-N 3.46Å; T145-L148 PolarHBondContact O-N 3.11Å; L148-K150 VanDerWaalsContact C-N 3.29Å; L148-K150 PolarHBondContact O-N 3.14Å; L148-S151 WeakPolarHBondContact O-CB 3.38Å; L148-S151 PolarHBondContact O-N 3.46Å; L148-S151 VanDerWaalsContact O-N 3.11Å; L148-D152 PolarHBondContact O-N 3.41Å
149A95.9Very high95.5Very high59 Ų5967.7 Ų67.749%0.48834%0.337SS..Hα-helixtrans-59.8-39.717600000112.4T145 D152 E153T145-A149 PolarHBondContact O-N 3.29Å; T145-A149 VanDerWaalsContact O-N 3.09Å; A149-D152 PolarHBondContact O-N 2.92Å; A149-E153 PolarHBondContact O-N 2.84Å
150K95.3Very high95.7Very high91 Ų9163.5 Ų63.540%0.39632%0.32SS..Hα-helixtrans-64.9-40.8173.8-70.9174.9-178.5179.40112.4S146 Q147 L148 E153 L154S146-K150 WeakPolarHBondContact O-CG 3.08Å; S146-K150 PolarHBondContact O-N 2.79Å; Q147-K150 PolarHBondContact O-N 3.07Å; L148-K150 VanDerWaalsContact C-N 3.29Å; L148-K150 PolarHBondContact O-N 3.14Å; K150-E153 PolarHBondContact O-N 3.26Å; K150-L154 WeakPolarHBondContact O-CB 3.28Å; K150-L154 VanDerWaalsContact O-CG 3.29Å; K150-L154 WeakPolarHBondContact O-CG 3.39Å; K150-L154 PolarHBondContact O-N 3.12Å
151S95.9Very high95.9Very high0 Ų062.3 Ų62.30%031%0.314CS..Hα-helixtrans-60.9-45.5176.5-171.10000111.5E125 Q147 L148 E153 L154 Q155E125-S151 WeakPolarHBondContact CG-OG 3.41Å; E125-S151 PolarHBondContact OE1-OG 3.35Å; E125-S151 VanDerWaalsContact OE1-OG 3.04Å; Q147-S151 PolarHBondContact O-N 3.12Å; L148-S151 WeakPolarHBondContact O-CB 3.38Å; L148-S151 PolarHBondContact O-N 3.46Å; L148-S151 VanDerWaalsContact O-N 3.11Å; S151-E153 VanDerWaalsContact C-N 3.32Å; S151-E153 PolarHBondContact O-N 2.98Å; S151-L154 PolarHBondContact O-N 2.88Å; S151-Q155 WeakPolarHBondContact O-CB 3.39Å; S151-Q155 PolarHBondContact O-N 3.45Å
152D94.6Very high96Very high65 Ų6564.9 Ų64.935%0.34832%0.32SS..Hα-helixtrans-60-41.8178.2-69.8-15.4000111.5L148 A149 Q155 R156L148-D152 PolarHBondContact O-N 3.41Å; A149-D152 PolarHBondContact O-N 2.92Å; D152-Q155 PolarHBondContact O-N 3.16Å; D152-R156 WeakPolarHBondContact O-CG 3.26Å; D152-R156 PolarHBondContact O-N 3.43Å
153E95.3Very high96.1Very high139 Ų13965.2 Ų65.265%0.6532%0.317SS*.Hα-helixtrans-64.5-48175.5-176.6176.5-172.600111.8A149 K150 S151 Q155 R156 L157A149-E153 PolarHBondContact O-N 2.84Å; K150-E153 PolarHBondContact O-N 3.26Å; S151-E153 VanDerWaalsContact C-N 3.32Å; S151-E153 PolarHBondContact O-N 2.98Å; E153-Q155 VanDerWaalsContact C-N 3.27Å; E153-Q155 PolarHBondContact O-N 3.16Å; E153-R156 WeakPolarHBondContact O-CB 3.36Å; E153-R156 PolarHBondContact O-N 3.29Å; E153-L157 PolarHBondContact O-N 2.67Å
154L95.9Very high96.2Very high10 Ų1063.3 Ų63.35%0.05231%0.31CS..Hα-helixtrans-60.2-37.2177.1-75165.9000112L116 L121 K150 S151 R156 L157 V158 I180 T183L116-L154 HydrophobicContact CD1-CD1 4Å; L116-L154 HydrophobicContact CG-CD1 4.46Å; L121-L154 HydrophobicContact CD1-CB 3.9Å; L121-L154 HydrophobicContact CD2-CB 4.15Å; L121-L154 HydrophobicContact CD2-CD1 4.23Å; K150-L154 WeakPolarHBondContact O-CB 3.28Å; K150-L154 VanDerWaalsContact O-CG 3.29Å; K150-L154 WeakPolarHBondContact O-CG 3.39Å; K150-L154 PolarHBondContact O-N 3.12Å; S151-L154 PolarHBondContact O-N 2.88Å; L154-R156 VanDerWaalsContact C-N 3.33Å; L154-R156 PolarHBondContact O-N 3.23Å; L154-L157 PolarHBondContact O-N 3.44Å; L154-V158 WeakPolarHBondContact O-CB 3.47Å; L154-V158 VanDerWaalsContact O-CG2 3.26Å; L154-V158 WeakPolarHBondContact O-CG2 3.26Å; L154-V158 PolarHBondContact O-N 2.96Å; L154-I180 HydrophobicContact CD2-CG1 4.48Å; L154-I180 HydrophobicContact CD2-CG2 4.5Å; L154-T183 HydrophobicContact CD1-CG2 3.82Å
155Q95.7Very high96.3Very high78 Ų7866.8 Ų66.836%0.36432%0.323SS..Hα-helixtrans-65.6-38.6-180-154.9-178.925.400111.4L121 D122 S151 D152 E153 A159L121-Q155 HydrophobicContact CD1-CB 3.95Å; L121-Q155 HydrophobicContact CD1-CG 4.24Å; D122-Q155 PolarHBondContact OD1-NE2 3.49Å; S151-Q155 WeakPolarHBondContact O-CB 3.39Å; S151-Q155 PolarHBondContact O-N 3.45Å; D152-Q155 PolarHBondContact O-N 3.16Å; E153-Q155 VanDerWaalsContact C-N 3.27Å; E153-Q155 PolarHBondContact O-N 3.16Å; Q155-A159 PolarHBondContact O-N 3.4Å; Q155-A159 VanDerWaalsContact O-N 3.1Å
156R96Very high96.4Very high184 Ų18466.2 Ų66.269%0.69433%0.332SS*.Hα-helixtrans-64.1-45.8172.3-66.5175.6-175.6-174.12.4111.2D152 E153 L154 V158 A159 E160D152-R156 WeakPolarHBondContact O-CG 3.26Å; D152-R156 PolarHBondContact O-N 3.43Å; E153-R156 WeakPolarHBondContact O-CB 3.36Å; E153-R156 PolarHBondContact O-N 3.29Å; L154-R156 VanDerWaalsContact C-N 3.33Å; L154-R156 PolarHBondContact O-N 3.23Å; R156-V158 PolarHBondContact O-N 3.12Å; R156-A159 WeakPolarHBondContact O-CB 3.18Å; R156-A159 PolarHBondContact O-N 2.79Å; R156-A159 VanDerWaalsContact O-N 3.16Å; R156-E160 PolarHBondContact O-N 2.02Å
157L96.4Very high96.4Very high39 Ų3967.6 Ų67.620%0.20434%0.341CS..Hα-helixtrans-64.3-39.2-179.7-166.962.6000112E153 L154 A159 E160 A161 Q176 A179 I180E153-L157 PolarHBondContact O-N 2.67Å; L154-L157 PolarHBondContact O-N 3.44Å; L157-A159 VanDerWaalsContact C-N 3.35Å; L157-A159 PolarHBondContact O-N 2.99Å; L157-E160 PolarHBondContact O-N 3.27Å; L157-A161 WeakPolarHBondContact O-CB 3.45Å; L157-A161 PolarHBondContact O-N 2.91Å; L157-Q176 HydrophobicContact CD1-CB 4.19Å; L157-Q176 HydrophobicContact CD1-CG 4.14Å; L157-A179 HydrophobicContact CD2-CB 3.85Å; L157-I180 HydrophobicContact CB-CD1 4.44Å; L157-I180 HydrophobicContact CB-CG1 4.21Å; L157-I180 HydrophobicContact CD2-CD1 4.42Å; L157-I180 HydrophobicContact CD2-CG1 3.61Å; L157-I180 HydrophobicContact CG-CD1 4.06Å; L157-I180 HydrophobicContact CG-CG1 3.78Å
158V96.4Very high96.4Very high22 Ų2273 Ų7313%0.13336%0.364CS..Hα-helixtrans-62.4-41.8173.2168.30000111L121 L154 R156 A161 R162 I180L121-V158 HydrophobicContact CD1-CG2 4.17Å; L154-V158 WeakPolarHBondContact O-CB 3.47Å; L154-V158 VanDerWaalsContact O-CG2 3.26Å; L154-V158 WeakPolarHBondContact O-CG2 3.26Å; L154-V158 PolarHBondContact O-N 2.96Å; R156-V158 PolarHBondContact O-N 3.12Å; V158-A161 PolarHBondContact O-N 3.07Å; V158-R162 WeakPolarHBondContact O-CB 3.24Å; V158-R162 VanDerWaalsContact O-CG 3.29Å; V158-R162 WeakPolarHBondContact O-CG 3.4Å; V158-R162 PolarHBondContact O-N 2.49Å; V158-I180 HydrophobicContact CB-CD1 4.33Å; V158-I180 HydrophobicContact CG2-CD1 3.66Å; V158-I180 HydrophobicContact CG2-CG1 4.2Å; V158-I180 HydrophobicContact CG2-CG2 4.26Å
159A96.6Very high96.5Very high48 Ų4874.6 Ų74.640%0.39737%0.373SS..Hα-helixtrans-66.6-36.8176.800000112.3Q155 R156 L157 R163Q155-A159 PolarHBondContact O-N 3.4Å; Q155-A159 VanDerWaalsContact O-N 3.1Å; R156-A159 WeakPolarHBondContact O-CB 3.18Å; R156-A159 PolarHBondContact O-N 2.79Å; R156-A159 VanDerWaalsContact O-N 3.16Å; L157-A159 VanDerWaalsContact C-N 3.35Å; L157-A159 PolarHBondContact O-N 2.99Å; A159-R163 WeakPolarHBondContact O-CG 3.46Å; A159-R163 PolarHBondContact O-N 2.91Å; A159-R163 VanDerWaalsContact O-N 3.15Å; A159-R163 PolarHBondContact O-NE 2.98Å
160E97.1Very high96.6Very high73 Ų7374 Ų7434%0.34136%0.358SS..Hα-helixtrans-65.4-50.4172.1-76.8171.7-168.500112.1R156 L157 R162 R163 S164R156-E160 PolarHBondContact O-N 2.02Å; L157-E160 PolarHBondContact O-N 3.27Å; E160-R162 VanDerWaalsContact C-N 3.28Å; E160-R162 PolarHBondContact O-N 3.27Å; E160-R163 WeakPolarHBondContact O-CA 3.27Å; E160-R163 WeakPolarHBondContact O-CB 3.32Å; E160-R163 PolarHBondContact O-N 3.44Å; E160-R163 IonicContact OE1-NH2 2.73Å; E160-S164 PolarHBondContact O-N 3.1Å; E160-S164 PolarHBondContact O-OG 3.39Å; E160-S164 VanDerWaalsContact O-OG 3.12Å
161A97.5Very high96.7Very high0 Ų076.3 Ų76.30%037%0.372CS..Hα-helixtrans-54.6-43.5176.700000112L157 V158 S164 Y165 Q176 L177 I180L157-A161 WeakPolarHBondContact O-CB 3.45Å; L157-A161 PolarHBondContact O-N 2.91Å; V158-A161 PolarHBondContact O-N 3.07Å; A161-S164 PolarHBondContact O-N 3.17Å; A161-Y165 WeakPolarHBondContact O-CB 3.39Å; A161-Y165 PolarHBondContact O-N 3.04Å; A161-Q176 VanDerWaalsContact CA-OE1 3.27Å; A161-Q176 HydrophobicContact CB-CB 3.91Å; A161-L177 HydrophobicContact CB-CD2 3.99Å; A161-L177 HydrophobicContact CB-CG 4.04Å; A161-I180 HydrophobicContact CB-CD1 4.05Å
162R96.8Very high96.7Very high150 Ų15078.7 Ų78.757%0.56639%0.387SS*.Hα-helixtrans-64.9-37.2175.8-73.7175-177.8-175.23.8112.9V158 E160 G166 M193V158-R162 WeakPolarHBondContact O-CB 3.24Å; V158-R162 VanDerWaalsContact O-CG 3.29Å; V158-R162 WeakPolarHBondContact O-CG 3.4Å; V158-R162 PolarHBondContact O-N 2.49Å; E160-R162 VanDerWaalsContact C-N 3.28Å; E160-R162 PolarHBondContact O-N 3.27Å; R162-G166 PolarHBondContact O-N 3.33Å; R162-M193 HydrophobicContact CG-CE 4.06Å; R162-M193 HydrophobicContact CG-SD 4.45Å
163R97.8Very high96.9Very high164 Ų16475.6 Ų75.662%0.61937%0.371SS*.Hα-helixtrans-66.3-50.1175.4-77.9-175.6-71.9152.4-8.7111.1A159 E160 Y165 G166 S167A159-R163 WeakPolarHBondContact O-CG 3.46Å; A159-R163 PolarHBondContact O-N 2.91Å; A159-R163 VanDerWaalsContact O-N 3.15Å; A159-R163 PolarHBondContact O-NE 2.98Å; E160-R163 WeakPolarHBondContact O-CA 3.27Å; E160-R163 WeakPolarHBondContact O-CB 3.32Å; E160-R163 PolarHBondContact O-N 3.44Å; E160-R163 IonicContact OE1-NH2 2.73Å; R163-Y165 VanDerWaalsContact C-N 3.3Å; R163-Y165 PolarHBondContact O-N 3.49Å; R163-G166 PolarHBondContact O-N 3.49Å; R163-G166 VanDerWaalsContact O-N 3.13Å; R163-S167 PolarHBondContact O-N 3.3Å; R163-S167 PolarHBondContact O-OG 3.34Å
164S97.8Very high97Very high16 Ų1669.3 Ų69.311%0.11234%0.342CS..Hα-helixtrans-58.4-43.5177.1-52.60000111.4E160 A161 S167 K168 D169 Q176E160-S164 PolarHBondContact O-N 3.1Å; E160-S164 PolarHBondContact O-OG 3.39Å; E160-S164 VanDerWaalsContact O-OG 3.12Å; A161-S164 PolarHBondContact O-N 3.17Å; S164-S167 WeakPolarHBondContact CA-OG 3.46Å; S164-S167 PolarHBondContact O-N 3.25Å; S164-S167 PolarHBondContact O-OG 3.2Å; S164-K168 PolarHBondContact O-N 2.67Å; S164-D169 PolarHBondContact O-N 3.34Å; S164-Q176 PolarHBondContact OG-OE1 2.96Å
165Y97.4Very high97.1Very high72 Ų7271.7 Ų71.728%0.28236%0.363SS..Hα-helixtrans-61.3-45.6174.8-175.3-87.7000111.8A161 R163 S167 K168 Y170 M193 E196 C197A161-Y165 WeakPolarHBondContact O-CB 3.39Å; A161-Y165 PolarHBondContact O-N 3.04Å; R163-Y165 VanDerWaalsContact C-N 3.3Å; R163-Y165 PolarHBondContact O-N 3.49Å; Y165-S167 VanDerWaalsContact C-N 3.32Å; Y165-S167 PolarHBondContact O-N 3.18Å; Y165-K168 WeakPolarHBondContact O-CA 3.49Å; Y165-K168 PolarHBondContact O-N 3.4Å; Y165-Y170 HydrophobicContact CD2-CD1 4.3Å; Y165-Y170 HydrophobicContact CD2-CE1 4.36Å; Y165-Y170 HydrophobicContact CE2-CD1 4.38Å; Y165-Y170 HydrophobicContact CE2-CE1 4.2Å; Y165-M193 HydrophobicContact CD1-CE 4.12Å; Y165-M193 HydrophobicContact CD2-CE 4.02Å; Y165-M193 HydrophobicContact CG-CE 3.71Å; Y165-E196 HydrophobicContact CE2-CB 4.36Å; Y165-E196 HydrophobicContact CE2-CG 4.38Å; Y165-E196 VanDerWaalsContact OH-CG 3.27Å; Y165-E196 WeakPolarHBondContact OH-CG 3.47Å; Y165-C197 VanDerWaalsContact CD2-SG 3.58Å
166G97Very high97.1Very high59 Ų5969.4 Ų69.461%0.60835%0.353SS*.Hα-helixtrans-64.1-33.1177.800000113.7R162 R163 K168R162-G166 PolarHBondContact O-N 3.33Å; R163-G166 PolarHBondContact O-N 3.49Å; R163-G166 VanDerWaalsContact O-N 3.13Å; G166-K168 PolarHBondContact O-N 3.02Å
167S97.2Very high97.2Very high85 Ų8560.8 Ų60.859%0.59432%0.32SS*.THydrogen-bonded Turntrans-803.3172.159.70000113.8R163 S164 Y165 D169R163-S167 PolarHBondContact O-N 3.3Å; R163-S167 PolarHBondContact O-OG 3.34Å; S164-S167 WeakPolarHBondContact CA-OG 3.46Å; S164-S167 PolarHBondContact O-N 3.25Å; S164-S167 PolarHBondContact O-OG 3.2Å; Y165-S167 VanDerWaalsContact C-N 3.32Å; Y165-S167 PolarHBondContact O-N 3.18Å; S167-D169 PolarHBondContact O-N 3.47Å
168K96.2Very high97.2Very high151 Ų15163.7 Ų63.766%0.65733%0.333SS*.THydrogen-bonded Turntrans60.921-175.6-53-178.1178.2-178.80114.3S164 Y165 G166 Y170S164-K168 PolarHBondContact O-N 2.67Å; Y165-K168 WeakPolarHBondContact O-CA 3.49Å; Y165-K168 PolarHBondContact O-N 3.4Å; G166-K168 PolarHBondContact O-N 3.02Å; K168-Y170 HydrophobicContact CB-CE1 4.48Å; K168-Y170 HydrophobicContact CB-CE2 3.96Å; K168-Y170 WeakPolarHBondContact O-CD2 3.14Å; K168-Y170 PolarHBondContact O-N 3.03Å
169D97.4Very high97.2Very high62 Ų6264.5 Ų64.533%0.33234%0.342SS..  trans-82.575.6168.3-175.6-2000108.6S164 S167 M171 T172 A173S164-D169 PolarHBondContact O-N 3.34Å; S167-D169 PolarHBondContact O-N 3.47Å; D169-M171 VanDerWaalsContact C-N 3.27Å; D169-M171 PolarHBondContact O-N 2.85Å; D169-T172 VanDerWaalsContact CG-CB 3.46Å; D169-T172 PolarHBondContact OD1-N 3.43Å; D169-T172 VanDerWaalsContact OD1-N 3.16Å; D169-T172 PolarHBondContact OD1-OG1 2.99Å; D169-T172 WeakPolarHBondContact OD2-CB 3.35Å; D169-T172 PolarHBondContact OD2-OG1 3.17Å; D169-A173 VanDerWaalsContact O-CB 3.26Å; D169-A173 WeakPolarHBondContact O-CB 3.33Å; D169-A173 PolarHBondContact O-N 3.43Å
170Y97.8Very high97.2Very high45 Ų4562.2 Ų62.218%0.17632%0.323CS..Hα-helixtrans-67.5-28.7-174.3-59.2-58000112.8Y165 K168 A174 C197 Q200Y165-Y170 HydrophobicContact CD2-CD1 4.3Å; Y165-Y170 HydrophobicContact CD2-CE1 4.36Å; Y165-Y170 HydrophobicContact CE2-CD1 4.38Å; Y165-Y170 HydrophobicContact CE2-CE1 4.2Å; K168-Y170 HydrophobicContact CB-CE1 4.48Å; K168-Y170 HydrophobicContact CB-CE2 3.96Å; K168-Y170 WeakPolarHBondContact O-CD2 3.14Å; K168-Y170 PolarHBondContact O-N 3.03Å; Y170-A174 WeakPolarHBondContact O-CB 3.48Å; Y170-A174 PolarHBondContact O-N 3.27Å; Y170-C197 HydrophobicContact CD1-CB 4.45Å; Y170-Q200 HydrophobicContact CD1-CB 4.31Å; Y170-Q200 HydrophobicContact CD1-CG 4.44Å; Y170-Q200 HydrophobicContact CD2-CB 3.52Å; Y170-Q200 HydrophobicContact CD2-CG 4.28Å; Y170-Q200 HydrophobicContact CE1-CB 4.28Å; Y170-Q200 HydrophobicContact CE1-CG 4.03Å; Y170-Q200 HydrophobicContact CE2-CB 3.45Å; Y170-Q200 VanDerWaalsContact CE2-CB 3.45Å; Y170-Q200 HydrophobicContact CE2-CG 3.83Å; Y170-Q200 HydrophobicContact CG-CB 3.95Å
171M97.1Very high97.1Very high140 Ų14059.2 Ų59.269%0.6931%0.309SS*.Hα-helixtrans-67.7-51.6178.6-176.317563.900110.6D169 A174 A175 M201D169-M171 VanDerWaalsContact C-N 3.27Å; D169-M171 PolarHBondContact O-N 2.85Å; M171-A174 PolarHBondContact O-N 2.89Å; M171-A175 PolarHBondContact O-N 2.89Å; M171-M201 HydrophobicContact CB-SD 4.08Å
172T97.5Very high97Very high51 Ų5166.3 Ų66.331%0.31334%0.342SS..Hα-helixtrans-64.6-42.5176.4-56.70000111.2D169 A174 A175 Q176D169-T172 VanDerWaalsContact CG-CB 3.46Å; D169-T172 PolarHBondContact OD1-N 3.43Å; D169-T172 VanDerWaalsContact OD1-N 3.16Å; D169-T172 PolarHBondContact OD1-OG1 2.99Å; D169-T172 WeakPolarHBondContact OD2-CB 3.35Å; D169-T172 PolarHBondContact OD2-OG1 3.17Å; T172-A174 VanDerWaalsContact C-N 3.34Å; T172-A174 PolarHBondContact O-N 3.3Å; T172-A175 PolarHBondContact O-N 3.47Å; T172-Q176 HydrophobicContact CG2-CG 4.46Å; T172-Q176 WeakPolarHBondContact O-CG 3.43Å; T172-Q176 PolarHBondContact O-N 3.36Å
173A98Very high96.8Very high0 Ų062.1 Ų62.10%033%0.334CS..Hα-helixtrans-59.7-43.4176.900000111.9D169 A175 Q176 L177D169-A173 VanDerWaalsContact O-CB 3.26Å; D169-A173 WeakPolarHBondContact O-CB 3.33Å; D169-A173 PolarHBondContact O-N 3.43Å; A173-A175 PolarHBondContact O-N 2.96Å; A173-Q176 PolarHBondContact O-N 2.89Å; A173-L177 WeakPolarHBondContact O-CB 3.12Å; A173-L177 WeakPolarHBondContact O-CD1 3.49Å; A173-L177 WeakPolarHBondContact O-CG 3.34Å; A173-L177 PolarHBondContact O-N 3.39Å
174A97.4Very high96.6Very high6 Ų654.3 Ų54.35%0.0530%0.304CS..Hα-helixtrans-63.1-41.617900000112.4Y170 M171 T172 L177 E178 R194 C197 F198Y170-A174 WeakPolarHBondContact O-CB 3.48Å; Y170-A174 PolarHBondContact O-N 3.27Å; M171-A174 PolarHBondContact O-N 2.89Å; T172-A174 VanDerWaalsContact C-N 3.34Å; T172-A174 PolarHBondContact O-N 3.3Å; A174-L177 PolarHBondContact O-N 3.28Å; A174-E178 WeakPolarHBondContact O-CB 3.41Å; A174-E178 PolarHBondContact O-N 3.33Å; A174-R194 HydrophobicContact CB-CG 4.31Å; A174-C197 HydrophobicContact CB-CB 4.02Å; A174-F198 HydrophobicContact CB-CE1 4.24Å; A174-F198 HydrophobicContact CB-CZ 4.47Å
175A97.1Very high96.3Very high60 Ų6055.9 Ų55.950%0.49631%0.313SS..Hα-helixtrans-65.2-42.1176.600000112.2M171 T172 A173 E178 A179M171-A175 PolarHBondContact O-N 2.89Å; T172-A175 PolarHBondContact O-N 3.47Å; A173-A175 PolarHBondContact O-N 2.96Å; A175-E178 WeakPolarHBondContact O-CB 3.19Å; A175-E178 PolarHBondContact O-N 3.32Å; A175-A179 PolarHBondContact O-N 3.27Å
176Q97.6Very high95.9Very high31 Ų3155.8 Ų55.815%0.14531%0.312CS..Hα-helixtrans-63.9-42.2175-70.2168.9-34.100111.5L157 A161 S164 T172 A173 E178 A179 I180L157-Q176 HydrophobicContact CD1-CB 4.19Å; L157-Q176 HydrophobicContact CD1-CG 4.14Å; A161-Q176 VanDerWaalsContact CA-OE1 3.27Å; A161-Q176 HydrophobicContact CB-CB 3.91Å; S164-Q176 PolarHBondContact OG-OE1 2.96Å; T172-Q176 HydrophobicContact CG2-CG 4.46Å; T172-Q176 WeakPolarHBondContact O-CG 3.43Å; T172-Q176 PolarHBondContact O-N 3.36Å; A173-Q176 PolarHBondContact O-N 2.89Å; Q176-E178 VanDerWaalsContact C-N 3.32Å; Q176-E178 PolarHBondContact O-N 2.95Å; Q176-A179 PolarHBondContact O-N 3.24Å; Q176-I180 WeakPolarHBondContact O-CG1 3.22Å; Q176-I180 PolarHBondContact O-N 3.18Å; Q176-I180 VanDerWaalsContact O-N 3.11Å
177L97.8Very high95.7Very high2 Ų253.5 Ų53.51%0.0129%0.286CS..Hα-helixtrans-66.2-32.9176.5-69.7164.6000112.5A161 A173 A174 I180 I181 M193 R194A161-L177 HydrophobicContact CB-CD2 3.99Å; A161-L177 HydrophobicContact CB-CG 4.04Å; A173-L177 WeakPolarHBondContact O-CB 3.12Å; A173-L177 WeakPolarHBondContact O-CD1 3.49Å; A173-L177 WeakPolarHBondContact O-CG 3.34Å; A173-L177 PolarHBondContact O-N 3.39Å; A174-L177 PolarHBondContact O-N 3.28Å; L177-I180 HydrophobicContact CD2-CD1 4.18Å; L177-I180 PolarHBondContact O-N 3.45Å; L177-I181 WeakPolarHBondContact O-CB 3.37Å; L177-I181 WeakPolarHBondContact O-CD1 3.37Å; L177-I181 WeakPolarHBondContact O-CG1 3.42Å; L177-I181 PolarHBondContact O-N 3.16Å; L177-M193 HydrophobicContact CD1-CB 3.75Å; L177-M193 HydrophobicContact CD2-CB 4.3Å; L177-R194 HydrophobicContact CB-CB 3.94Å; L177-R194 HydrophobicContact CB-CG 4.1Å; L177-R194 HydrophobicContact CD1-CB 3.91Å; L177-R194 HydrophobicContact CD1-CG 4.49Å
178E96.6Very high95.4Very high100 Ų10051.2 Ų51.247%0.46727%0.268SS..Hα-helixtrans-61.8-50.1173.5-179.5156.9-135.700112A174 A175 Q176 I180 I181 E182 R194A174-E178 WeakPolarHBondContact O-CB 3.41Å; A174-E178 PolarHBondContact O-N 3.33Å; A175-E178 WeakPolarHBondContact O-CB 3.19Å; A175-E178 PolarHBondContact O-N 3.32Å; Q176-E178 VanDerWaalsContact C-N 3.32Å; Q176-E178 PolarHBondContact O-N 2.95Å; E178-I180 VanDerWaalsContact C-N 3.25Å; E178-I180 PolarHBondContact O-N 3.3Å; E178-I181 PolarHBondContact O-N 3.49Å; E178-E182 WeakPolarHBondContact O-CG 3.43Å; E178-E182 PolarHBondContact O-N 3.01Å; E178-R194 IonicContact OE1-NH1 3.2Å
179A95.9Very high95.2Very high40 Ų4047.6 Ų47.633%0.33126%0.259SS..Hα-helixtrans-59.4-35.1174.800000112.7L157 A175 Q176L157-A179 HydrophobicContact CD2-CB 3.85Å; A175-A179 PolarHBondContact O-N 3.27Å; Q176-A179 PolarHBondContact O-N 3.24Å
180I96.5Very high95Very high0 Ų044.9 Ų44.90%025%0.245CC..Hα-helixtrans-64.3-48.5172.8-65.8160.5000110.6L154 L157 V158 A161 Q176 L177 E178 E182 T183 C184L154-I180 HydrophobicContact CD2-CG1 4.48Å; L154-I180 HydrophobicContact CD2-CG2 4.5Å; L157-I180 HydrophobicContact CB-CD1 4.44Å; L157-I180 HydrophobicContact CB-CG1 4.21Å; L157-I180 HydrophobicContact CD2-CD1 4.42Å; L157-I180 HydrophobicContact CD2-CG1 3.61Å; L157-I180 HydrophobicContact CG-CD1 4.06Å; L157-I180 HydrophobicContact CG-CG1 3.78Å; V158-I180 HydrophobicContact CB-CD1 4.33Å; V158-I180 HydrophobicContact CG2-CD1 3.66Å; V158-I180 HydrophobicContact CG2-CG1 4.2Å; V158-I180 HydrophobicContact CG2-CG2 4.26Å; A161-I180 HydrophobicContact CB-CD1 4.05Å; Q176-I180 WeakPolarHBondContact O-CG1 3.22Å; Q176-I180 PolarHBondContact O-N 3.18Å; Q176-I180 VanDerWaalsContact O-N 3.11Å; L177-I180 HydrophobicContact CD2-CD1 4.18Å; L177-I180 PolarHBondContact O-N 3.45Å; E178-I180 VanDerWaalsContact C-N 3.25Å; E178-I180 PolarHBondContact O-N 3.3Å; I180-E182 VanDerWaalsContact C-N 3.29Å; I180-E182 PolarHBondContact O-N 3.13Å; I180-T183 PolarHBondContact O-N 3.32Å; I180-T183 VanDerWaalsContact O-N 3.16Å; I180-C184 HydrophobicContact CG2-CB 4.14Å; I180-C184 WeakPolarHBondContact O-CB 3.34Å; I180-C184 PolarHBondContact O-N 3.31Å
181I95.6Very high94.9Very high10 Ų1044.8 Ų44.85%0.05124%0.244CC..Hα-helixtrans-68-26.6-174.8-69.1161.2000112.3L177 E178 T183 C184 V185 R191 R194L177-I181 WeakPolarHBondContact O-CB 3.37Å; L177-I181 WeakPolarHBondContact O-CD1 3.37Å; L177-I181 WeakPolarHBondContact O-CG1 3.42Å; L177-I181 PolarHBondContact O-N 3.16Å; E178-I181 PolarHBondContact O-N 3.49Å; I181-T183 VanDerWaalsContact C-N 3.25Å; I181-T183 PolarHBondContact O-N 3.07Å; I181-C184 CarbonylContact O-C 3.47Å; I181-V185 WeakPolarHBondContact O-CA 3.44Å; I181-V185 PolarHBondContact O-N 2.83Å; I181-R191 HydrophobicContact CD1-CB 4.34Å; I181-R191 HydrophobicContact CD1-CG 3.63Å; I181-R191 HydrophobicContact CG1-CG 3.93Å; I181-R191 HydrophobicContact CG2-CG 4.31Å; I181-R194 HydrophobicContact CD1-CB 4.3Å
182E94.1Very high94.7Very high148 Ų14841.4 Ų41.469%0.69223%0.227SC*.Hα-helixtrans-57.9-38.9172.3-74.3-177.1171.400112.1E178 I180E178-E182 WeakPolarHBondContact O-CG 3.43Å; E178-E182 PolarHBondContact O-N 3.01Å; I180-E182 VanDerWaalsContact C-N 3.29Å; I180-E182 PolarHBondContact O-N 3.13Å
183T92.5Very high94.6Very high62 Ų6240.5 Ų40.538%0.3822%0.22SC..Hα-helixtrans-91.2-48.8176.7-550000111.6L154 I180 I181 V185L154-T183 HydrophobicContact CD1-CG2 3.82Å; I180-T183 PolarHBondContact O-N 3.32Å; I180-T183 VanDerWaalsContact O-N 3.16Å; I181-T183 VanDerWaalsContact C-N 3.25Å; I181-T183 PolarHBondContact O-N 3.07Å; T183-V185 VanDerWaalsContact C-N 3.32Å; T183-V185 PolarHBondContact O-N 2.78Å; T183-V185 VanDerWaalsContact O-N 3.17Å
184C94.1Very high94.6Very high1 Ų141.7 Ų41.71%0.00722%0.224CC..  trans-90.362.1-179.1-590000111.1L116 K117 I180 I181 W186 D187L116-C184 PolarHBondContact O-SG 2.93Å; K117-C184 CarbonylContact O-C 3.56Å; K117-C184 WeakPolarHBondContact O-CA 3.49Å; I180-C184 HydrophobicContact CG2-CB 4.14Å; I180-C184 WeakPolarHBondContact O-CB 3.34Å; I180-C184 PolarHBondContact O-N 3.31Å; I181-C184 CarbonylContact O-C 3.47Å; C184-W186 PolarHBondContact O-N 3.09Å; C184-D187 HydrophobicContact CB-CB 3.81Å; C184-D187 WeakPolarHBondContact O-CB 3.46Å; C184-D187 PolarHBondContact O-N 3.48Å
185V91.5Very high94.5Very high48 Ų4841.5 Ų41.529%0.29122%0.222SC..THydrogen-bonded Turntrans-57.7-22.9-172.7-640000114.9K117 I181 T183 R191K117-V185 HydrophobicContact CB-CG2 4.4Å; K117-V185 HydrophobicContact CG-CG2 4.49Å; K117-V185 PolarHBondContact O-N 3.25Å; I181-V185 WeakPolarHBondContact O-CA 3.44Å; I181-V185 PolarHBondContact O-N 2.83Å; T183-V185 VanDerWaalsContact C-N 3.32Å; T183-V185 PolarHBondContact O-N 2.78Å; T183-V185 VanDerWaalsContact O-N 3.17Å; V185-R191 PolarHBondContact O-NE 2.89Å; V185-R191 VanDerWaalsContact O-NE 3.1Å; V185-R191 PolarHBondContact O-NH2 3.35Å
186W89.5Confident94.4Very high71 Ų7140.3 Ų40.327%0.26921%0.206SC..THydrogen-bonded Turntrans-111.514.9-180-55.3-35.9000113.2S87 L114 K117 Q118 C184 V188 L217S87-W186 WeakPolarHBondContact OG-CH2 3.35Å; S87-W186 WeakPolarHBondContact OG-CZ2 3.32Å; S87-W186 WeakPolarHBondContact OG-CZ3 3.29Å; L114-W186 HydrophobicContact CD1-CE3 4Å; L114-W186 HydrophobicContact CD1-CZ3 3.49Å; L114-W186 VanDerWaalsContact CD1-CZ3 3.49Å; K117-W186 HydrophobicContact CB-CD2 4.39Å; K117-W186 HydrophobicContact CB-CE3 3.59Å; K117-W186 HydrophobicContact CB-CZ3 3.72Å; K117-W186 HydrophobicContact CD-CE3 4.21Å; K117-W186 HydrophobicContact CD-CH2 3.72Å; K117-W186 HydrophobicContact CD-CZ3 3.5Å; K117-W186 VanDerWaalsContact CD-CZ3 3.5Å; K117-W186 HydrophobicContact CG-CZ3 4.26Å; K117-W186 CarbonylContact O-C 3.2Å; K117-W186 WeakPolarHBondContact O-CA 3.47Å; K117-W186 PolarHBondContact O-N 2.8Å; Q118-W186 HydrophobicContact CG-CB 4.32Å; C184-W186 PolarHBondContact O-N 3.09Å; W186-V188 PolarHBondContact O-N 3.2Å; W186-V188 VanDerWaalsContact O-N 3.15Å; W186-L217 HydrophobicContact CB-CD2 4.25Å; W186-L217 HydrophobicContact CG-CD2 4.19Å
187D92.2Very high94.4Very high11 Ų1138.8 Ų38.86%0.05920%0.199CC..  trans-72106.6173.3-176.2-3.3000110.8K117 Q118 C184 T189 S190 R191K117-D187 PolarHBondContact O-N 2.64Å; Q118-D187 WeakPolarHBondContact O-CA 3.29Å; C184-D187 HydrophobicContact CB-CB 3.81Å; C184-D187 WeakPolarHBondContact O-CB 3.46Å; C184-D187 PolarHBondContact O-N 3.48Å; D187-T189 WeakPolarHBondContact OD1-CB 3.28Å; D187-T189 PolarHBondContact OD1-N 3.32Å; D187-S190 PolarHBondContact OD1-N 2.91Å; D187-S190 VanDerWaalsContact OD1-N 3.14Å; D187-S190 WeakPolarHBondContact OD2-CB 3.4Å; D187-S190 PolarHBondContact OD2-OG 3.26Å; D187-R191 WeakPolarHBondContact O-CB 3.24Å; D187-R191 WeakPolarHBondContact O-CD 3.44Å; D187-R191 VanDerWaalsContact O-CG 3.31Å; D187-R191 WeakPolarHBondContact O-CG 3.35Å; D187-R191 PolarHBondContact O-N 3.02Å
188V90.7Very high94.3Very high36 Ų3639.4 Ų39.422%0.21820%0.202CC..Hα-helixtrans-67-40.5177.71750000110.7W186 R191 E192 L214 L217W186-V188 PolarHBondContact O-N 3.2Å; W186-V188 VanDerWaalsContact O-N 3.15Å; V188-R191 PolarHBondContact O-N 3.41Å; V188-E192 HydrophobicContact CG1-CG 4.37Å; V188-E192 WeakPolarHBondContact O-CB 3.49Å; V188-E192 WeakPolarHBondContact O-CG 3.43Å; V188-E192 PolarHBondContact O-N 3.41Å; V188-L214 HydrophobicContact CB-CD2 4.24Å; V188-L214 HydrophobicContact CG1-CD2 3.78Å; V188-L214 WeakPolarHBondContact O-CD2 3.32Å; V188-L217 HydrophobicContact CG2-CB 4.15Å
189T91.9Very high94.3Very high75 Ų7536.4 Ų36.446%0.4619%0.189SC..Hα-helixtrans-69.1-47.2-173.1-49.20000110.6D187 R191 E192 M193D187-T189 WeakPolarHBondContact OD1-CB 3.28Å; D187-T189 PolarHBondContact OD1-N 3.32Å; T189-R191 PolarHBondContact O-N 3.25Å; T189-E192 PolarHBondContact O-N 2.95Å; T189-M193 WeakPolarHBondContact O-CG 3.45Å; T189-M193 PolarHBondContact O-N 2.96Å
190S94.6Very high94.2Very high6 Ų639.3 Ų39.34%0.04220%0.195CC..Hα-helixtrans-65.5-39.3179.2-64.80000111.9D187 M193 R194D187-S190 PolarHBondContact OD1-N 2.91Å; D187-S190 VanDerWaalsContact OD1-N 3.14Å; D187-S190 WeakPolarHBondContact OD2-CB 3.4Å; D187-S190 PolarHBondContact OD2-OG 3.26Å; S190-M193 PolarHBondContact O-N 2.96Å; S190-R194 WeakPolarHBondContact O-CB 3.38Å; S190-R194 PolarHBondContact O-N 3.2Å
191R94.8Very high94.2Very high42 Ų4242.2 Ų42.216%0.15821%0.21CC..Hα-helixtrans-64.3-40.8173.7-77175.1-178.2-953112.4I181 V185 D187 V188 T189 R194 A195 A213 L214I181-R191 HydrophobicContact CD1-CB 4.34Å; I181-R191 HydrophobicContact CD1-CG 3.63Å; I181-R191 HydrophobicContact CG1-CG 3.93Å; I181-R191 HydrophobicContact CG2-CG 4.31Å; V185-R191 PolarHBondContact O-NE 2.89Å; V185-R191 VanDerWaalsContact O-NE 3.1Å; V185-R191 PolarHBondContact O-NH2 3.35Å; D187-R191 WeakPolarHBondContact O-CB 3.24Å; D187-R191 WeakPolarHBondContact O-CD 3.44Å; D187-R191 VanDerWaalsContact O-CG 3.31Å; D187-R191 WeakPolarHBondContact O-CG 3.35Å; D187-R191 PolarHBondContact O-N 3.02Å; V188-R191 PolarHBondContact O-N 3.41Å; T189-R191 PolarHBondContact O-N 3.25Å; R191-R194 PolarHBondContact O-N 3.42Å; R191-A195 WeakPolarHBondContact O-CB 2.94Å; R191-A195 PolarHBondContact O-N 3.42Å; R191-A213 VanDerWaalsContact NH1-CB 3.34Å; R191-L214 HydrophobicContact CB-CD1 4.27Å; R191-L214 HydrophobicContact CB-CD2 3.73Å; R191-L214 HydrophobicContact CB-CG 4.03Å
192E93.3Very high94.1Very high70 Ų7044.1 Ų44.133%0.32723%0.232SC..Hα-helixtrans-64-43.7176-80177.217400111.8V188 T189 R194 A195 E196 L214 N221V188-E192 HydrophobicContact CG1-CG 4.37Å; V188-E192 WeakPolarHBondContact O-CB 3.49Å; V188-E192 WeakPolarHBondContact O-CG 3.43Å; V188-E192 PolarHBondContact O-N 3.41Å; T189-E192 PolarHBondContact O-N 2.95Å; E192-R194 VanDerWaalsContact C-N 3.34Å; E192-A195 PolarHBondContact O-N 3.46Å; E192-E196 PolarHBondContact O-N 3.44Å; E192-L214 HydrophobicContact CB-CD1 4.26Å; E192-L214 HydrophobicContact CG-CD1 3.45Å; E192-L214 VanDerWaalsContact CG-CD1 3.45Å; E192-L214 HydrophobicContact CG-CD2 3.78Å; E192-L214 HydrophobicContact CG-CG 4.24Å; E192-N221 PolarHBondContact OE1-ND2 2.96Å
193M95.1Very high94.2Very high32 Ų3240.6 Ų40.616%0.15822%0.215CC..Hα-helixtrans-62.3-41.4174.9-72.7-178.363.300111.7R162 Y165 L177 T189 S190 E196 C197R162-M193 HydrophobicContact CG-CE 4.06Å; R162-M193 HydrophobicContact CG-SD 4.45Å; Y165-M193 HydrophobicContact CD1-CE 4.12Å; Y165-M193 HydrophobicContact CD2-CE 4.02Å; Y165-M193 HydrophobicContact CG-CE 3.71Å; L177-M193 HydrophobicContact CD1-CB 3.75Å; L177-M193 HydrophobicContact CD2-CB 4.3Å; T189-M193 WeakPolarHBondContact O-CG 3.45Å; T189-M193 PolarHBondContact O-N 2.96Å; S190-M193 PolarHBondContact O-N 2.96Å; M193-E196 WeakPolarHBondContact O-CB 3.49Å; M193-E196 PolarHBondContact O-N 3.38Å; M193-C197 PolarHBondContact O-N 2.98Å; M193-C197 PolarHBondContact O-SG 2.84Å; M193-C197 VanDerWaalsContact O-SG 3.35Å
194R97.2Very high94.2Very high25 Ų2539.9 Ų39.99%0.09421%0.208CC..Hα-helixtrans-69.2-40.8-179.4-165.517668.4170.3-1.5111.8A174 L177 E178 I181 S190 R191 E192 E196 C197 F198 D210A174-R194 HydrophobicContact CB-CG 4.31Å; L177-R194 HydrophobicContact CB-CB 3.94Å; L177-R194 HydrophobicContact CB-CG 4.1Å; L177-R194 HydrophobicContact CD1-CB 3.91Å; L177-R194 HydrophobicContact CD1-CG 4.49Å; E178-R194 IonicContact OE1-NH1 3.2Å; I181-R194 HydrophobicContact CD1-CB 4.3Å; S190-R194 WeakPolarHBondContact O-CB 3.38Å; S190-R194 PolarHBondContact O-N 3.2Å; R191-R194 PolarHBondContact O-N 3.42Å; E192-R194 VanDerWaalsContact C-N 3.34Å; R194-E196 VanDerWaalsContact C-N 3.27Å; R194-E196 PolarHBondContact O-N 3.04Å; R194-C197 WeakPolarHBondContact O-CB 3.37Å; R194-C197 PolarHBondContact O-N 3.27Å; R194-F198 HydrophobicContact CG-CD2 4.15Å; R194-F198 HydrophobicContact CG-CE2 3.58Å; R194-F198 HydrophobicContact CG-CZ 4.02Å; R194-F198 VanDerWaalsContact O-CD2 3.26Å; R194-F198 WeakPolarHBondContact O-CD2 3.47Å; R194-F198 PolarHBondContact O-N 3.42Å; R194-D210 IonicContact CZ-OD1 2.82Å; R194-D210 IonicContact CZ-OD2 2.65Å; R194-D210 IonicContact NE-OD1 3.88Å; R194-D210 IonicContact NE-OD2 2.77Å; R194-D210 PolarHBondContact NE-OD2 3.03Å; R194-D210 IonicContact NH2-OD1 3.84Å; R194-D210 PolarHBondContact NH2-OD1 3.09Å; R194-D210 IonicContact NH2-OD2 3.54Å; R194-D210 PolarHBondContact NH2-OD2 3.45Å
195A95.6Very high94.3Very high1 Ų142.5 Ų42.51%0.00824%0.236CC..Hα-helixtrans-57.4-42.4171.800000111.4R191 E192 F198 I199 D210 L211R191-A195 WeakPolarHBondContact O-CB 2.94Å; R191-A195 PolarHBondContact O-N 3.42Å; E192-A195 PolarHBondContact O-N 3.46Å; A195-F198 PolarHBondContact O-N 2.98Å; A195-I199 VanDerWaalsContact O-CG1 3.3Å; A195-I199 WeakPolarHBondContact O-CG1 3.5Å; A195-I199 PolarHBondContact O-N 3.08Å; A195-D210 HydrophobicContact CB-CB 3.85Å; A195-L211 HydrophobicContact CB-CD2 4.15Å; A195-L211 HydrophobicContact CB-CG 4.04Å
196E94.8Very high94.5Very high35 Ų3545.5 Ų45.516%0.16425%0.245CC..Hα-helixtrans-65.2-42.8175.9-167.661.6-138.800112Y165 E192 M193 R194 F198 I199 Q200 K227Y165-E196 HydrophobicContact CE2-CB 4.36Å; Y165-E196 HydrophobicContact CE2-CG 4.38Å; Y165-E196 VanDerWaalsContact OH-CG 3.27Å; Y165-E196 WeakPolarHBondContact OH-CG 3.47Å; E192-E196 PolarHBondContact O-N 3.44Å; M193-E196 WeakPolarHBondContact O-CB 3.49Å; M193-E196 PolarHBondContact O-N 3.38Å; R194-E196 VanDerWaalsContact C-N 3.27Å; R194-E196 PolarHBondContact O-N 3.04Å; E196-F198 VanDerWaalsContact C-N 3.3Å; E196-F198 PolarHBondContact O-N 3.16Å; E196-I199 PolarHBondContact O-N 3.35Å; E196-I199 VanDerWaalsContact O-N 3.15Å; E196-Q200 VanDerWaalsContact O-CG 3.31Å; E196-Q200 WeakPolarHBondContact O-CG 3.44Å; E196-Q200 PolarHBondContact O-N 3.4Å; E196-Q200 PolarHBondContact OE1-NE2 3.23Å; E196-K227 IonicContact OE2-NZ 3.4Å; E196-K227 PolarHBondContact OE2-NZ 3.46Å
197C97.2Very high94.8Very high0 Ų042.1 Ų42.10%023%0.232CC..Hα-helixtrans-53.6-47.7172-67.50000111.5Y165 Y170 A174 M193 R194 I199 Q200 M201Y165-C197 VanDerWaalsContact CD2-SG 3.58Å; Y170-C197 HydrophobicContact CD1-CB 4.45Å; A174-C197 HydrophobicContact CB-CB 4.02Å; M193-C197 PolarHBondContact O-N 2.98Å; M193-C197 PolarHBondContact O-SG 2.84Å; M193-C197 VanDerWaalsContact O-SG 3.35Å; R194-C197 WeakPolarHBondContact O-CB 3.37Å; R194-C197 PolarHBondContact O-N 3.27Å; C197-I199 VanDerWaalsContact C-N 3.35Å; C197-I199 PolarHBondContact O-N 3.29Å; C197-Q200 PolarHBondContact O-N 2.95Å; C197-M201 VanDerWaalsContact O-CG 3.28Å; C197-M201 WeakPolarHBondContact O-CG 3.42Å; C197-M201 PolarHBondContact O-N 2.73Å
198F97.6Very high95Very high14 Ų1442.5 Ų42.56%0.06123%0.234CC..Hα-helixtrans-62.9-38.7178.4-69.7-47.2000113A174 R194 A195 E196 M201 G202 E203 K206 A207A174-F198 HydrophobicContact CB-CE1 4.24Å; A174-F198 HydrophobicContact CB-CZ 4.47Å; R194-F198 HydrophobicContact CG-CD2 4.15Å; R194-F198 HydrophobicContact CG-CE2 3.58Å; R194-F198 HydrophobicContact CG-CZ 4.02Å; R194-F198 VanDerWaalsContact O-CD2 3.26Å; R194-F198 WeakPolarHBondContact O-CD2 3.47Å; R194-F198 PolarHBondContact O-N 3.42Å; A195-F198 PolarHBondContact O-N 2.98Å; E196-F198 VanDerWaalsContact C-N 3.3Å; E196-F198 PolarHBondContact O-N 3.16Å; F198-M201 HydrophobicContact CD1-CE 3.43Å; F198-M201 VanDerWaalsContact CD1-CE 3.43Å; F198-M201 HydrophobicContact CE1-CE 3.85Å; F198-M201 PolarHBondContact O-N 3.03Å; F198-G202 PolarHBondContact O-N 2.97Å; F198-G202 VanDerWaalsContact O-N 3.1Å; F198-E203 HydrophobicContact CB-CB 4.27Å; F198-E203 HydrophobicContact CD1-CB 4.09Å; F198-E203 PolarHBondContact O-N 2.85Å; F198-K206 HydrophobicContact CB-CB 4.33Å; F198-K206 HydrophobicContact CD1-CB 3.83Å; F198-K206 HydrophobicContact CD1-CD 3.91Å; F198-K206 HydrophobicContact CD2-CB 3.62Å; F198-K206 HydrophobicContact CE1-CB 4.03Å; F198-K206 HydrophobicContact CE1-CD 3.47Å; F198-K206 VanDerWaalsContact CE1-CD 3.47Å; F198-K206 HydrophobicContact CE1-CG 4.41Å; F198-K206 HydrophobicContact CE2-CB 3.77Å; F198-K206 HydrophobicContact CE2-CD 4.36Å; F198-K206 HydrophobicContact CG-CB 3.67Å; F198-K206 HydrophobicContact CZ-CB 4Å; F198-K206 HydrophobicContact CZ-CD 3.73Å; F198-A207 HydrophobicContact CB-CB 3.82Å
199I95.1Very high95.2Very high38 Ų3844.7 Ų44.720%0.19525%0.251CS..Hα-helixtrans-61-46.5174.1-67.2165.1000110.4A195 E196 C197 M201 G202 A207 I231A195-I199 VanDerWaalsContact O-CG1 3.3Å; A195-I199 WeakPolarHBondContact O-CG1 3.5Å; A195-I199 PolarHBondContact O-N 3.08Å; E196-I199 PolarHBondContact O-N 3.35Å; E196-I199 VanDerWaalsContact O-N 3.15Å; C197-I199 VanDerWaalsContact C-N 3.35Å; C197-I199 PolarHBondContact O-N 3.29Å; I199-M201 VanDerWaalsContact C-N 3.28Å; I199-M201 PolarHBondContact O-N 2.71Å; I199-G202 PolarHBondContact O-N 3.36Å; I199-G202 VanDerWaalsContact O-N 3.09Å; I199-A207 HydrophobicContact CG1-CB 3.75Å; I199-I231 HydrophobicContact CD1-CD1 3.92Å; I199-I231 HydrophobicContact CG1-CD1 3.93Å
200Q95.1Very high95.3Very high100 Ų10041.4 Ų41.447%0.46723%0.23SC..Hα-helixtrans-66.8-29.2-179.8-62.2-62.1-39.900112.8Y170 E196 C197 G202Y170-Q200 HydrophobicContact CD1-CB 4.31Å; Y170-Q200 HydrophobicContact CD1-CG 4.44Å; Y170-Q200 HydrophobicContact CD2-CB 3.52Å; Y170-Q200 HydrophobicContact CD2-CG 4.28Å; Y170-Q200 HydrophobicContact CE1-CB 4.28Å; Y170-Q200 HydrophobicContact CE1-CG 4.03Å; Y170-Q200 HydrophobicContact CE2-CB 3.45Å; Y170-Q200 VanDerWaalsContact CE2-CB 3.45Å; Y170-Q200 HydrophobicContact CE2-CG 3.83Å; Y170-Q200 HydrophobicContact CG-CB 3.95Å; E196-Q200 VanDerWaalsContact O-CG 3.31Å; E196-Q200 WeakPolarHBondContact O-CG 3.44Å; E196-Q200 PolarHBondContact O-N 3.4Å; E196-Q200 PolarHBondContact OE1-NE2 3.23Å; C197-Q200 PolarHBondContact O-N 2.95Å; Q200-G202 VanDerWaalsContact C-N 3.33Å
201M95.4Very high95.3Very high62 Ų6241.3 Ų41.331%0.30523%0.229SC..THydrogen-bonded Turntrans-82.6-6.9174.2-64.8-174.2-37.100113.6M171 C197 F198 I199 E203M171-M201 HydrophobicContact CB-SD 4.08Å; C197-M201 VanDerWaalsContact O-CG 3.28Å; C197-M201 WeakPolarHBondContact O-CG 3.42Å; C197-M201 PolarHBondContact O-N 2.73Å; F198-M201 HydrophobicContact CD1-CE 3.43Å; F198-M201 VanDerWaalsContact CD1-CE 3.43Å; F198-M201 HydrophobicContact CE1-CE 3.85Å; F198-M201 PolarHBondContact O-N 3.03Å; I199-M201 VanDerWaalsContact C-N 3.28Å; I199-M201 PolarHBondContact O-N 2.71Å; M201-E203 VanDerWaalsContact C-N 3.29Å; M201-E203 HydrophobicContact CB-CG 4.32Å; M201-E203 HydrophobicContact CE-CG 4.34Å; M201-E203 WeakPolarHBondContact CE-OE1 3.48Å; M201-E203 PolarHBondContact O-N 2.83Å
202G94Very high95.1Very high50 Ų5043 Ų4352%0.51524%0.238SC..THydrogen-bonded Turntrans78.47.1-17500000114.7F198 I199 Q200 M204F198-G202 PolarHBondContact O-N 2.97Å; F198-G202 VanDerWaalsContact O-N 3.1Å; I199-G202 PolarHBondContact O-N 3.36Å; I199-G202 VanDerWaalsContact O-N 3.09Å; Q200-G202 VanDerWaalsContact C-N 3.33Å; G202-M204 VanDerWaalsContact C-N 3.25Å; G202-M204 PolarHBondContact O-N 2.93Å
203E95.3Very high95Very high73 Ų7340.8 Ų40.834%0.34123%0.232SC..  trans-83.363.1179.4-66.2-162.4-134.500111.9F198 M201 G205 K206 A207F198-E203 HydrophobicContact CB-CB 4.27Å; F198-E203 HydrophobicContact CD1-CB 4.09Å; F198-E203 PolarHBondContact O-N 2.85Å; M201-E203 VanDerWaalsContact C-N 3.29Å; M201-E203 HydrophobicContact CB-CG 4.32Å; M201-E203 HydrophobicContact CE-CG 4.34Å; M201-E203 WeakPolarHBondContact CE-OE1 3.48Å; M201-E203 PolarHBondContact O-N 2.83Å; E203-G205 VanDerWaalsContact C-N 3.28Å; E203-G205 PolarHBondContact O-N 3.28Å; E203-K206 PolarHBondContact O-N 3.23Å; E203-K206 VanDerWaalsContact O-N 3.15Å; E203-K206 IonicContact OE1-NZ 3.84Å; E203-K206 WeakPolarHBondContact OE2-CD 3.4Å; E203-K206 WeakPolarHBondContact OE2-CE 3.34Å; E203-K206 IonicContact OE2-NZ 2.7Å; E203-K206 PolarHBondContact OE2-NZ 3.35Å; E203-A207 PolarHBondContact O-N 3.29Å
204M94.3Very high94.8Very high47 Ų4739.3 Ų39.323%0.23222%0.224CC..Hα-helixtrans-57.3-36.4-172.2-60.8-57.4177.600113.6G202 K206 A207 I208 I231 L235G202-M204 VanDerWaalsContact C-N 3.25Å; G202-M204 PolarHBondContact O-N 2.93Å; M204-K206 PolarHBondContact O-N 3.03Å; M204-A207 PolarHBondContact O-N 3.49Å; M204-I208 VanDerWaalsContact O-CG1 3.27Å; M204-I208 WeakPolarHBondContact O-CG1 3.04Å; M204-I208 PolarHBondContact O-N 3.49Å; M204-I231 HydrophobicContact CB-CG2 3.82Å; M204-I231 HydrophobicContact CG-CG2 4.18Å; M204-I231 HydrophobicContact SD-CG1 4.31Å; M204-I231 HydrophobicContact SD-CG2 3.95Å; M204-L235 HydrophobicContact CB-CD1 4.09Å; M204-L235 HydrophobicContact CB-CD2 4.14Å; M204-L235 HydrophobicContact CB-CG 4.44Å; M204-L235 HydrophobicContact CG-CD2 4.17Å
205G94.6Very high94.4Very high57 Ų5739.3 Ų39.359%0.58823%0.228SC*.Hα-helixtrans-61.2-42.5178.700000113.2E203 S209E203-G205 VanDerWaalsContact C-N 3.28Å; E203-G205 PolarHBondContact O-N 3.28Å; G205-S209 PolarHBondContact O-N 3.35Å
206K95.8Very high93.9Very high111 Ų11147.2 Ų47.248%0.48326%0.263SS..Hα-helixtrans-69.8-40.1176.3-65.3-171.3-171.5158.30111.3F198 E203 M204 I208 S209 D210F198-K206 HydrophobicContact CB-CB 4.33Å; F198-K206 HydrophobicContact CD1-CB 3.83Å; F198-K206 HydrophobicContact CD1-CD 3.91Å; F198-K206 HydrophobicContact CD2-CB 3.62Å; F198-K206 HydrophobicContact CE1-CB 4.03Å; F198-K206 HydrophobicContact CE1-CD 3.47Å; F198-K206 VanDerWaalsContact CE1-CD 3.47Å; F198-K206 HydrophobicContact CE1-CG 4.41Å; F198-K206 HydrophobicContact CE2-CB 3.77Å; F198-K206 HydrophobicContact CE2-CD 4.36Å; F198-K206 HydrophobicContact CG-CB 3.67Å; F198-K206 HydrophobicContact CZ-CB 4Å; F198-K206 HydrophobicContact CZ-CD 3.73Å; E203-K206 PolarHBondContact O-N 3.23Å; E203-K206 VanDerWaalsContact O-N 3.15Å; E203-K206 IonicContact OE1-NZ 3.84Å; E203-K206 WeakPolarHBondContact OE2-CD 3.4Å; E203-K206 WeakPolarHBondContact OE2-CE 3.34Å; E203-K206 IonicContact OE2-NZ 2.7Å; E203-K206 PolarHBondContact OE2-NZ 3.35Å; M204-K206 PolarHBondContact O-N 3.03Å; K206-I208 PolarHBondContact O-N 2.85Å; K206-S209 WeakPolarHBondContact O-CB 3.5Å; K206-S209 PolarHBondContact O-N 3.42Å; K206-D210 PolarHBondContact O-N 2.88Å
207A96.4Very high93.3Very high0 Ų047.2 Ų47.20%026%0.263CS..Hα-helixtrans-59-43.7174.900000112.6F198 I199 E203 M204 S209 D210 L211 I231F198-A207 HydrophobicContact CB-CB 3.82Å; I199-A207 HydrophobicContact CG1-CB 3.75Å; E203-A207 PolarHBondContact O-N 3.29Å; M204-A207 PolarHBondContact O-N 3.49Å; A207-S209 VanDerWaalsContact C-N 3.31Å; A207-S209 PolarHBondContact O-N 2.8Å; A207-D210 PolarHBondContact O-N 3.49Å; A207-L211 WeakPolarHBondContact O-CB 3.5Å; A207-L211 WeakPolarHBondContact O-CG 3.35Å; A207-L211 PolarHBondContact O-N 3.08Å; A207-I231 HydrophobicContact CB-CD1 4.11Å
208I95.8Very high92.5Very high19 Ų1950.8 Ų50.810%0.09728%0.279CS..Hα-helixtrans-59.1-43176.3-71163000110.9M204 K206 D210 L211 K212 L228 I231 Y232 L235M204-I208 VanDerWaalsContact O-CG1 3.27Å; M204-I208 WeakPolarHBondContact O-CG1 3.04Å; M204-I208 PolarHBondContact O-N 3.49Å; K206-I208 PolarHBondContact O-N 2.85Å; I208-D210 PolarHBondContact O-N 3.23Å; I208-L211 PolarHBondContact O-N 3.47Å; I208-K212 HydrophobicContact CG2-CD 4.04Å; I208-K212 HydrophobicContact CG2-CG 4.32Å; I208-K212 WeakPolarHBondContact O-CB 3.3Å; I208-K212 WeakPolarHBondContact O-CG 3.49Å; I208-K212 PolarHBondContact O-N 3.32Å; I208-L228 HydrophobicContact CB-CD2 4.33Å; I208-L228 HydrophobicContact CG1-CD2 4.35Å; I208-L228 HydrophobicContact CG2-CD2 4.07Å; I208-I231 HydrophobicContact CD1-CG2 3.83Å; I208-I231 HydrophobicContact CG1-CG2 3.8Å; I208-Y232 HydrophobicContact CD1-CD1 4.33Å; I208-Y232 HydrophobicContact CD1-CE1 3.88Å; I208-Y232 WeakPolarHBondContact CG2-OH 3.49Å; I208-L235 HydrophobicContact CD1-CD1 3.87Å
209S94.9Very high91.4Very high81 Ų8155.9 Ų55.957%0.56631%0.307SS*.Hα-helixtrans-58.6-47.8178.6-170.60000111.7G205 K206 A207 K212 A213G205-S209 PolarHBondContact O-N 3.35Å; K206-S209 WeakPolarHBondContact O-CB 3.5Å; K206-S209 PolarHBondContact O-N 3.42Å; A207-S209 VanDerWaalsContact C-N 3.31Å; A207-S209 PolarHBondContact O-N 2.8Å; S209-K212 PolarHBondContact O-N 3.47Å; S209-A213 PolarHBondContact O-N 3.02Å; S209-A213 VanDerWaalsContact O-N 3.09Å
210D94.3Very high90.6Very high6 Ų659.1 Ų59.13%0.03232%0.324CS..Hα-helixtrans-66.2-44.5178.7-82.8-17.1000112.3R194 A195 K206 A207 I208 K212 A213 L214R194-D210 IonicContact CZ-OD1 2.82Å; R194-D210 IonicContact CZ-OD2 2.65Å; R194-D210 IonicContact NE-OD1 3.88Å; R194-D210 IonicContact NE-OD2 2.77Å; R194-D210 PolarHBondContact NE-OD2 3.03Å; R194-D210 IonicContact NH2-OD1 3.84Å; R194-D210 PolarHBondContact NH2-OD1 3.09Å; R194-D210 IonicContact NH2-OD2 3.54Å; R194-D210 PolarHBondContact NH2-OD2 3.45Å; A195-D210 HydrophobicContact CB-CB 3.85Å; K206-D210 PolarHBondContact O-N 2.88Å; A207-D210 PolarHBondContact O-N 3.49Å; I208-D210 PolarHBondContact O-N 3.23Å; D210-K212 VanDerWaalsContact C-N 3.34Å; D210-K212 PolarHBondContact O-N 3.33Å; D210-A213 WeakPolarHBondContact O-CB 3.2Å; D210-A213 PolarHBondContact O-N 3.03Å; D210-A213 VanDerWaalsContact O-N 3.13Å; D210-L214 VanDerWaalsContact O-CG 3.29Å; D210-L214 WeakPolarHBondContact O-CG 3.45Å; D210-L214 PolarHBondContact O-N 3.3Å
211L93.9Very high90Very high4 Ų454.5 Ų54.52%0.02130%0.303CS..Hα-helixtrans-65.2-35.4178.6-68.8168.3000112.9A195 A207 I208 A213 L214 S215 A224 K227 L228 I231A195-L211 HydrophobicContact CB-CD2 4.15Å; A195-L211 HydrophobicContact CB-CG 4.04Å; A207-L211 WeakPolarHBondContact O-CB 3.5Å; A207-L211 WeakPolarHBondContact O-CG 3.35Å; A207-L211 PolarHBondContact O-N 3.08Å; I208-L211 PolarHBondContact O-N 3.47Å; L211-A213 VanDerWaalsContact C-N 3.34Å; L211-L214 HydrophobicContact CD2-CD1 4.07Å; L211-L214 WeakPolarHBondContact O-CB 3.49Å; L211-L214 PolarHBondContact O-N 3.34Å; L211-S215 PolarHBondContact O-N 3.46Å; L211-A224 HydrophobicContact CD2-CB 4.32Å; L211-K227 HydrophobicContact CD1-CB 3.94Å; L211-K227 HydrophobicContact CD2-CB 4.24Å; L211-K227 HydrophobicContact CD2-CD 4.28Å; L211-L228 HydrophobicContact CB-CD1 4Å; L211-L228 HydrophobicContact CB-CD2 3.53Å; L211-L228 HydrophobicContact CB-CG 3.54Å; L211-L228 HydrophobicContact CD1-CD2 4.08Å; L211-L228 HydrophobicContact CD1-CG 4.09Å; L211-L228 HydrophobicContact CG-CD2 4.47Å; L211-L228 HydrophobicContact CG-CG 4.43Å; L211-I231 HydrophobicContact CD1-CD1 3.53Å
212K92.6Very high89.7Confident78 Ų7852.7 Ų52.734%0.33930%0.296SS..Hα-helixtrans-67.3-33.4172.2-78.5-175.1177.2-1790112.7I208 S209 D210 S215 L228 Y232I208-K212 HydrophobicContact CG2-CD 4.04Å; I208-K212 HydrophobicContact CG2-CG 4.32Å; I208-K212 WeakPolarHBondContact O-CB 3.3Å; I208-K212 WeakPolarHBondContact O-CG 3.49Å; I208-K212 PolarHBondContact O-N 3.32Å; S209-K212 PolarHBondContact O-N 3.47Å; D210-K212 VanDerWaalsContact C-N 3.34Å; D210-K212 PolarHBondContact O-N 3.33Å; K212-S215 PolarHBondContact O-OG 3.37Å; K212-L228 HydrophobicContact CG-CD1 4.26Å; K212-L228 HydrophobicContact CG-CD2 4.17Å; K212-Y232 WeakPolarHBondContact CE-OH 3.43Å; K212-Y232 PolarHBondContact NZ-OH 3Å
213A90.9Very high89.4Confident24 Ų2454.2 Ų54.220%0.19829%0.289CS..Hα-helixtrans-67.6-41.5171.600000110.5R191 S209 D210 L211 S215 K216 L217R191-A213 VanDerWaalsContact NH1-CB 3.34Å; S209-A213 PolarHBondContact O-N 3.02Å; S209-A213 VanDerWaalsContact O-N 3.09Å; D210-A213 WeakPolarHBondContact O-CB 3.2Å; D210-A213 PolarHBondContact O-N 3.03Å; D210-A213 VanDerWaalsContact O-N 3.13Å; L211-A213 VanDerWaalsContact C-N 3.34Å; A213-S215 PolarHBondContact O-N 3.12Å; A213-K216 WeakPolarHBondContact O-CB 3.39Å; A213-K216 PolarHBondContact O-N 2.65Å; A213-K216 VanDerWaalsContact O-N 3.15Å; A213-L217 WeakPolarHBondContact O-CG 3.45Å; A213-L217 PolarHBondContact O-N 3.14Å
214L90.4Very high89.2Confident0 Ų050.9 Ų50.90%027%0.274CS..Hα-helixtrans-61.8-40.1178.7-73.7165.3000113.4V188 R191 E192 D210 L211 K216 L217 K218V188-L214 HydrophobicContact CB-CD2 4.24Å; V188-L214 HydrophobicContact CG1-CD2 3.78Å; V188-L214 WeakPolarHBondContact O-CD2 3.32Å; R191-L214 HydrophobicContact CB-CD1 4.27Å; R191-L214 HydrophobicContact CB-CD2 3.73Å; R191-L214 HydrophobicContact CB-CG 4.03Å; E192-L214 HydrophobicContact CB-CD1 4.26Å; E192-L214 HydrophobicContact CG-CD1 3.45Å; E192-L214 VanDerWaalsContact CG-CD1 3.45Å; E192-L214 HydrophobicContact CG-CD2 3.78Å; E192-L214 HydrophobicContact CG-CG 4.24Å; D210-L214 VanDerWaalsContact O-CG 3.29Å; D210-L214 WeakPolarHBondContact O-CG 3.45Å; D210-L214 PolarHBondContact O-N 3.3Å; L211-L214 HydrophobicContact CD2-CD1 4.07Å; L211-L214 WeakPolarHBondContact O-CB 3.49Å; L211-L214 PolarHBondContact O-N 3.34Å; L214-K216 PolarHBondContact O-N 3.44Å; L214-L217 CarbonylContact O-C 3.57Å; L214-L217 PolarHBondContact O-N 3.45Å; L214-L217 VanDerWaalsContact O-N 3.09Å; L214-K218 PolarHBondContact O-N 3.43Å
215S87.8Confident89.2Confident26 Ų2649.9 Ų49.918%0.18227%0.269CS..Hα-helixtrans-64-24.6176.666.50000113.3L211 K212 A213L211-S215 PolarHBondContact O-N 3.46Å; K212-S215 PolarHBondContact O-OG 3.37Å; A213-S215 PolarHBondContact O-N 3.12Å
216K85.1Confident89.2Confident167 Ų16749.5 Ų49.573%0.72625%0.25SC*.Hα-helixtrans-82.8-34.6171.4-61.6177.4-176.7179.50112.2K88 A213 L214K88-K216 PolarHBondContact NZ-O 3.24Å; A213-K216 WeakPolarHBondContact O-CB 3.39Å; A213-K216 PolarHBondContact O-N 2.65Å; A213-K216 VanDerWaalsContact O-N 3.15Å; L214-K216 PolarHBondContact O-N 3.44Å
217L82.7Confident89.1Confident35 Ų3547 Ų4718%0.18324%0.239CC..Hα-helixtrans-77.3-20.2-179.6-68.7177000113.5K88 W186 V188 A213 L214K88-L217 WeakPolarHBondContact CE-O 3.29Å; K88-L217 PolarHBondContact NZ-O 3.13Å; W186-L217 HydrophobicContact CB-CD2 4.25Å; W186-L217 HydrophobicContact CG-CD2 4.19Å; V188-L217 HydrophobicContact CG2-CB 4.15Å; A213-L217 WeakPolarHBondContact O-CG 3.45Å; A213-L217 PolarHBondContact O-N 3.14Å; L214-L217 CarbonylContact O-C 3.57Å; L214-L217 PolarHBondContact O-N 3.45Å; L214-L217 VanDerWaalsContact O-N 3.09Å
218K79.8Confident89.1Confident74 Ų7447 Ų4732%0.32224%0.239SC..  trans-137119.2177.6-177.4178.1178.7-173.70110L214 D220 N221L214-K218 PolarHBondContact O-N 3.43Å; K218-D220 VanDerWaalsContact C-N 3.29Å; K218-D220 WeakPolarHBondContact CE-O 3.34Å; K218-D220 WeakPolarHBondContact CE-OD1 3.29Å; K218-D220 WeakPolarHBondContact CE-OD2 3.49Å; K218-D220 WeakPolarHBondContact CG-OD1 3.39Å; K218-D220 IonicContact NZ-OD2 3.7Å; K218-D220 PolarHBondContact O-N 2.86Å; K218-N221 HydrophobicContact CB-CB 3.94Å; K218-N221 HydrophobicContact CD-CB 4.03Å; K218-N221 HydrophobicContact CG-CB 3.96Å
219N74.5Confident89.1Confident121 Ų12146 Ų4665%0.64723%0.234SC*.THydrogen-bonded Turntrans-74.2-24.9-174.6-64.712.4000111.8K88 L251K88-N219 PolarHBondContact NZ-OD1 3.44Å; K88-N219 VanDerWaalsContact NZ-OD1 3.07Å; N219-L251 WeakPolarHBondContact O-CD2 3.26Å
220D79.4Confident89.2Confident106 Ų10644 Ų4457%0.56722%0.218SC*.THydrogen-bonded Turntrans-10542.5179.863-43.3000111.2K218 T222K218-D220 VanDerWaalsContact C-N 3.29Å; K218-D220 WeakPolarHBondContact CE-O 3.34Å; K218-D220 WeakPolarHBondContact CE-OD1 3.29Å; K218-D220 WeakPolarHBondContact CE-OD2 3.49Å; K218-D220 WeakPolarHBondContact CG-OD1 3.39Å; K218-D220 IonicContact NZ-OD2 3.7Å; K218-D220 PolarHBondContact O-N 2.86Å; D220-T222 PolarHBondContact O-N 3.14Å
221N82.1Confident89.2Confident4 Ų444.1 Ų44.12%0.02122%0.219CC..  trans-10261.1-178.6-153.7-15.5000113.7E192 K218 Q223 A224 F225E192-N221 PolarHBondContact OE1-ND2 2.96Å; K218-N221 HydrophobicContact CB-CB 3.94Å; K218-N221 HydrophobicContact CD-CB 4.03Å; K218-N221 HydrophobicContact CG-CB 3.96Å; N221-Q223 PolarHBondContact O-N 2.95Å; N221-A224 HydrophobicContact CB-CB 4.04Å; N221-A224 WeakPolarHBondContact ND2-CB 3.37Å; N221-A224 PolarHBondContact O-N 3.18Å; N221-A224 VanDerWaalsContact O-N 3.16Å; N221-A224 WeakPolarHBondContact OD1-CB 3.37Å; N221-A224 PolarHBondContact OD1-N 3.05Å; N221-F225 VanDerWaalsContact O-CD2 3.28Å; N221-F225 WeakPolarHBondContact O-CD2 3.5Å; N221-F225 PolarHBondContact O-N 3.26Å
222T89Confident89.4Confident24 Ų2444.7 Ų44.715%0.14722%0.221CC..Hα-helixtrans-52-38.8174.3-49.80000111.9D220 F225 Y226 C248 D252 H255D220-T222 PolarHBondContact O-N 3.14Å; T222-F225 PolarHBondContact O-N 3.35Å; T222-Y226 PolarHBondContact O-N 3.3Å; T222-C248 WeakPolarHBondContact CG2-SG 3.48Å; T222-D252 HydrophobicContact CG2-CB 3.96Å; T222-H255 HydrophobicContact CG2-CB 4.19Å; T222-H255 WeakPolarHBondContact CG2-CD2 3.43Å
223Q88.6Confident89.6Confident81 Ų8141.5 Ų41.538%0.37921%0.207SC..Hα-helixtrans-67.8-38.6-179.9-170.862.329.400113.3N221 Y226 K227N221-Q223 PolarHBondContact O-N 2.95Å; Q223-Y226 PolarHBondContact O-N 3.48Å; Q223-K227 WeakPolarHBondContact O-CG 3.35Å; Q223-K227 PolarHBondContact O-N 3.22Å
224A91Very high89.7Confident4 Ų443.6 Ų43.63%0.03322%0.215CC..Hα-helixtrans-65-42.1177.200000111.7L211 N221 Y226 K227 L228L211-A224 HydrophobicContact CD2-CB 4.32Å; N221-A224 HydrophobicContact CB-CB 4.04Å; N221-A224 WeakPolarHBondContact ND2-CB 3.37Å; N221-A224 PolarHBondContact O-N 3.18Å; N221-A224 VanDerWaalsContact O-N 3.16Å; N221-A224 WeakPolarHBondContact OD1-CB 3.37Å; N221-A224 PolarHBondContact OD1-N 3.05Å; A224-Y226 VanDerWaalsContact C-N 3.34Å; A224-Y226 PolarHBondContact O-N 2.92Å; A224-K227 PolarHBondContact O-N 3.42Å; A224-L228 WeakPolarHBondContact O-CB 3.39Å; A224-L228 WeakPolarHBondContact O-CG 3.31Å; A224-L228 PolarHBondContact O-N 3.2Å
225F94.2Very high89.9Confident25 Ų2547.1 Ų47.111%0.1123%0.233CC..Hα-helixtrans-62.4-41.1174.5-75-69.1000112N221 T222 L228 S229 E244 E247 C248 L251N221-F225 VanDerWaalsContact O-CD2 3.28Å; N221-F225 WeakPolarHBondContact O-CD2 3.5Å; N221-F225 PolarHBondContact O-N 3.26Å; T222-F225 PolarHBondContact O-N 3.35Å; F225-L228 PolarHBondContact O-N 2.51Å; F225-S229 VanDerWaalsContact O-CB 3.32Å; F225-S229 WeakPolarHBondContact O-CB 3.45Å; F225-S229 PolarHBondContact O-N 3.35Å; F225-E244 VanDerWaalsContact CD1-OE2 3.3Å; F225-E244 WeakPolarHBondContact CD1-OE2 3.46Å; F225-E247 HydrophobicContact CD1-CB 3.76Å; F225-E247 HydrophobicContact CE1-CB 3.69Å; F225-E247 HydrophobicContact CE1-CG 4.33Å; F225-E247 HydrophobicContact CG-CB 4.25Å; F225-E247 HydrophobicContact CZ-CB 4.14Å; F225-C248 HydrophobicContact CB-CB 3.79Å; F225-L251 HydrophobicContact CD2-CD1 3.71Å; F225-L251 HydrophobicContact CE2-CD1 3.64Å
226Y94.6Very high90.3Very high49 Ų4946.5 Ų46.519%0.19223%0.231CC..Hα-helixtrans-60.8-47.7174-178.3-111.4000112.6T222 Q223 A224 S229 T230 Q257 C258 H261T222-Y226 PolarHBondContact O-N 3.3Å; Q223-Y226 PolarHBondContact O-N 3.48Å; A224-Y226 VanDerWaalsContact C-N 3.34Å; A224-Y226 PolarHBondContact O-N 2.92Å; Y226-S229 PolarHBondContact O-N 3.31Å; Y226-T230 WeakPolarHBondContact O-CB 3.41Å; Y226-T230 PolarHBondContact O-N 3.38Å; Y226-T230 PolarHBondContact O-OG1 3.2Å; Y226-Q257 HydrophobicContact CD2-CB 4.34Å; Y226-Q257 HydrophobicContact CE1-CB 4.31Å; Y226-Q257 HydrophobicContact CE2-CB 3.75Å; Y226-C258 VanDerWaalsContact CB-SG 3.59Å; Y226-C258 HydrophobicContact CD2-CB 4.45Å; Y226-C258 VanDerWaalsContact CD2-SG 3.53Å; Y226-H261 HydrophobicContact CE2-CB 3.97Å
227K93.8Very high90.8Very high58 Ų5842.2 Ų42.225%0.25222%0.216SC..Hα-helixtrans-61.8-46.1176.8-73.9-169.9178.6-1640111.5E196 L211 Q223 A224 S229 T230 I231E196-K227 IonicContact OE2-NZ 3.4Å; E196-K227 PolarHBondContact OE2-NZ 3.46Å; L211-K227 HydrophobicContact CD1-CB 3.94Å; L211-K227 HydrophobicContact CD2-CB 4.24Å; L211-K227 HydrophobicContact CD2-CD 4.28Å; Q223-K227 WeakPolarHBondContact O-CG 3.35Å; Q223-K227 PolarHBondContact O-N 3.22Å; A224-K227 PolarHBondContact O-N 3.42Å; K227-S229 PolarHBondContact O-N 2.97Å; K227-T230 PolarHBondContact O-N 3.03Å; K227-I231 WeakPolarHBondContact O-CG1 3.43Å; K227-I231 PolarHBondContact O-N 2.87Å
228L95.2Very high91.5Very high0 Ų041.7 Ų41.70%021%0.212CC..Hα-helixtrans-56.6-50.2175.6-82.5167.8000111.7I208 L211 K212 A224 F225 T230 I231 Y232 E244I208-L228 HydrophobicContact CB-CD2 4.33Å; I208-L228 HydrophobicContact CG1-CD2 4.35Å; I208-L228 HydrophobicContact CG2-CD2 4.07Å; L211-L228 HydrophobicContact CB-CD1 4Å; L211-L228 HydrophobicContact CB-CD2 3.53Å; L211-L228 HydrophobicContact CB-CG 3.54Å; L211-L228 HydrophobicContact CD1-CD2 4.08Å; L211-L228 HydrophobicContact CD1-CG 4.09Å; L211-L228 HydrophobicContact CG-CD2 4.47Å; L211-L228 HydrophobicContact CG-CG 4.43Å; K212-L228 HydrophobicContact CG-CD1 4.26Å; K212-L228 HydrophobicContact CG-CD2 4.17Å; A224-L228 WeakPolarHBondContact O-CB 3.39Å; A224-L228 WeakPolarHBondContact O-CG 3.31Å; A224-L228 PolarHBondContact O-N 3.2Å; F225-L228 PolarHBondContact O-N 2.51Å; L228-T230 VanDerWaalsContact C-N 3.26Å; L228-T230 PolarHBondContact O-N 3.48Å; L228-I231 PolarHBondContact O-N 3.26Å; L228-Y232 HydrophobicContact CD2-CE2 4.45Å; L228-Y232 VanDerWaalsContact O-CD2 3.26Å; L228-Y232 WeakPolarHBondContact O-CD2 3.47Å; L228-Y232 PolarHBondContact O-N 3.19Å; L228-E244 HydrophobicContact CB-CB 4.32Å; L228-E244 HydrophobicContact CB-CG 4.18Å
229S96.8Very high92.3Very high0 Ų043 Ų430%022%0.22CC..Hα-helixtrans-59.7-39.3178.8179.20000112.1F225 Y226 K227 Y233 S241 V245 H261F225-S229 VanDerWaalsContact O-CB 3.32Å; F225-S229 WeakPolarHBondContact O-CB 3.45Å; F225-S229 PolarHBondContact O-N 3.35Å; Y226-S229 PolarHBondContact O-N 3.31Å; K227-S229 PolarHBondContact O-N 2.97Å; S229-Y233 WeakPolarHBondContact O-CB 3.5Å; S229-Y233 PolarHBondContact O-N 3.01Å; S229-S241 WeakPolarHBondContact CB-O 3.45Å; S229-S241 WeakPolarHBondContact O-CB 3.38Å; S229-S241 PolarHBondContact O-OG 2.93Å; S229-S241 PolarHBondContact OG-O 3.49Å; S229-S241 PolarHBondContact OG-OG 3.03Å; S229-V245 WeakPolarHBondContact OG-CB 3.5Å; S229-H261 PolarHBondContact OG-CD2 3.35Å; S229-H261 PolarHBondContact OG-NE2 3.49Å
230T95.6Very high93.4Very high38 Ų3840.5 Ų40.523%0.23321%0.205CC..Hα-helixtrans-67.5-41.8178-550000111.6Y226 K227 L228 Y233 N234Y226-T230 WeakPolarHBondContact O-CB 3.41Å; Y226-T230 PolarHBondContact O-N 3.38Å; Y226-T230 PolarHBondContact O-OG1 3.2Å; K227-T230 PolarHBondContact O-N 3.03Å; L228-T230 VanDerWaalsContact C-N 3.26Å; L228-T230 PolarHBondContact O-N 3.48Å; T230-Y233 WeakPolarHBondContact O-CB 3.2Å; T230-Y233 PolarHBondContact O-N 3.24Å; T230-N234 VanDerWaalsContact O-CG 3.28Å; T230-N234 PolarHBondContact O-N 3.05Å; T230-N234 PolarHBondContact O-ND2 2.99Å
231I95.7Very high94.3Very high8 Ų835.5 Ų35.54%0.04118%0.178CC..Hα-helixtrans-63.6-48.9176.4-66166.9000110.2I199 M204 A207 I208 L211 K227 L228 Y233 N234 L235I199-I231 HydrophobicContact CD1-CD1 3.92Å; I199-I231 HydrophobicContact CG1-CD1 3.93Å; M204-I231 HydrophobicContact CB-CG2 3.82Å; M204-I231 HydrophobicContact CG-CG2 4.18Å; M204-I231 HydrophobicContact SD-CG1 4.31Å; M204-I231 HydrophobicContact SD-CG2 3.95Å; A207-I231 HydrophobicContact CB-CD1 4.11Å; I208-I231 HydrophobicContact CD1-CG2 3.83Å; I208-I231 HydrophobicContact CG1-CG2 3.8Å; L211-I231 HydrophobicContact CD1-CD1 3.53Å; K227-I231 WeakPolarHBondContact O-CG1 3.43Å; K227-I231 PolarHBondContact O-N 2.87Å; L228-I231 PolarHBondContact O-N 3.26Å; I231-Y233 VanDerWaalsContact C-N 3.25Å; I231-Y233 PolarHBondContact O-N 3.14Å; I231-N234 PolarHBondContact O-N 3.31Å; I231-N234 VanDerWaalsContact O-N 3.15Å; I231-L235 HydrophobicContact CG2-CD1 3.98Å; I231-L235 HydrophobicContact CG2-CG 4.4Å; I231-L235 WeakPolarHBondContact O-CG 3.5Å; I231-L235 PolarHBondContact O-N 3.26Å
232Y97.3Very high95Very high16 Ų1635.5 Ų35.56%0.06318%0.178CC..Hα-helixtrans-57.9-40.3176.1-78.8-54.3000112.1I208 K212 L228 N234 L235 G236 D237 M240 E244I208-Y232 HydrophobicContact CD1-CD1 4.33Å; I208-Y232 HydrophobicContact CD1-CE1 3.88Å; I208-Y232 WeakPolarHBondContact CG2-OH 3.49Å; K212-Y232 WeakPolarHBondContact CE-OH 3.43Å; K212-Y232 PolarHBondContact NZ-OH 3Å; L228-Y232 HydrophobicContact CD2-CE2 4.45Å; L228-Y232 VanDerWaalsContact O-CD2 3.26Å; L228-Y232 WeakPolarHBondContact O-CD2 3.47Å; L228-Y232 PolarHBondContact O-N 3.19Å; Y232-N234 PolarHBondContact O-N 3.36Å; Y232-L235 PolarHBondContact O-N 3.12Å; Y232-G236 PolarHBondContact O-N 3.16Å; Y232-D237 HydrophobicContact CD1-CB 3.86Å; Y232-D237 HydrophobicContact CG-CB 4.41Å; Y232-D237 WeakPolarHBondContact O-CA 3.4Å; Y232-D237 PolarHBondContact O-N 3.4Å; Y232-M240 HydrophobicContact CD1-CB 3.78Å; Y232-M240 HydrophobicContact CD1-CG 4.47Å; Y232-M240 HydrophobicContact CD2-CB 3.84Å; Y232-M240 HydrophobicContact CE1-CB 4.05Å; Y232-M240 HydrophobicContact CE1-CG 4.38Å; Y232-M240 HydrophobicContact CE2-CB 4.09Å; Y232-M240 HydrophobicContact CE2-CE 4.23Å; Y232-M240 HydrophobicContact CG-CB 3.68Å; Y232-E244 HydrophobicContact CD2-CG 3.9Å; Y232-E244 HydrophobicContact CE2-CG 3.95Å
233Y96.8Very high95.4Very high12 Ų1237.8 Ų37.85%0.04719%0.19CC..Hα-helixtrans-59.2-47.6175.6-170.2-104.1000112.3S229 T230 I231 L235 G236 H261 Q264 V265 L268 E298 V301 F304S229-Y233 WeakPolarHBondContact O-CB 3.5Å; S229-Y233 PolarHBondContact O-N 3.01Å; T230-Y233 WeakPolarHBondContact O-CB 3.2Å; T230-Y233 PolarHBondContact O-N 3.24Å; I231-Y233 VanDerWaalsContact C-N 3.25Å; I231-Y233 PolarHBondContact O-N 3.14Å; Y233-L235 PolarHBondContact O-N 3.21Å; Y233-G236 PolarHBondContact O-N 3.43Å; Y233-H261 AromaticContact CG-CE1 3.75Å; Y233-Q264 WeakPolarHBondContact OH-CG 3Å; Y233-Q264 PolarHBondContact OH-NE2 2.93Å; Y233-V265 HydrophobicContact CD2-CG2 3.59Å; Y233-V265 HydrophobicContact CE2-CG2 3.79Å; Y233-V265 HydrophobicContact CG-CG2 4.5Å; Y233-L268 HydrophobicContact CE2-CD2 3.73Å; Y233-E298 HydrophobicContact CE1-CG 4.24Å; Y233-E298 VanDerWaalsContact OH-CD 3.28Å; Y233-E298 WeakPolarHBondContact OH-CG 3.48Å; Y233-E298 PolarHBondContact OH-OE2 3.16Å; Y233-V301 HydrophobicContact CD1-CG2 4.08Å; Y233-V301 HydrophobicContact CE1-CG2 3.78Å; Y233-F304 HydrophobicContact CD1-CE2 4.2Å; Y233-F304 AromaticContact CD2-CE2 3.87Å; Y233-F304 HydrophobicContact CD2-CE2 3.87Å; Y233-F304 AromaticContact CD2-CZ 3.93Å; Y233-F304 HydrophobicContact CD2-CZ 3.93Å; Y233-F304 AromaticContact CE1-CE2 3.99Å; Y233-F304 HydrophobicContact CE1-CE2 3.99Å; Y233-F304 AromaticContact CE2-CE2 3.65Å; Y233-F304 HydrophobicContact CE2-CE2 3.65Å; Y233-F304 AromaticContact CE2-CZ 3.93Å; Y233-F304 HydrophobicContact CE2-CZ 3.93Å; Y233-F304 HydrophobicContact CG-CE2 4.17Å; Y233-F304 HydrophobicContact CG-CZ 4.48Å; Y233-F304 AromaticContact CZ-CE2 3.72Å; Y233-F304 VanDerWaalsContact O-CE2 3.29Å; Y233-F304 WeakPolarHBondContact O-CE2 3.11Å; Y233-F304 WeakPolarHBondContact O-CZ 3.46Å
234N94.4Very high95.7Very high68 Ų6835.2 Ų35.236%0.36418%0.178SC..Hα-helixtrans-69.8-22.1-179.9-67.4-18.8000112.9T230 I231 Y232 G236 Q303T230-N234 VanDerWaalsContact O-CG 3.28Å; T230-N234 PolarHBondContact O-N 3.05Å; T230-N234 PolarHBondContact O-ND2 2.99Å; I231-N234 PolarHBondContact O-N 3.31Å; I231-N234 VanDerWaalsContact O-N 3.15Å; Y232-N234 PolarHBondContact O-N 3.36Å; N234-G236 VanDerWaalsContact C-N 3.29Å; N234-Q303 WeakPolarHBondContact O-CG 3.36Å; N234-Q303 PolarHBondContact O-OE1 3.4Å; N234-Q303 VanDerWaalsContact O-OE1 3.05Å
235L94.6Very high96Very high73 Ų7335 Ų3538%0.38218%0.176SC..THydrogen-bonded Turntrans-82-7.4171.5-67.3175.5000112.9M204 I208 I231 Y232 Y233 D237M204-L235 HydrophobicContact CB-CD1 4.09Å; M204-L235 HydrophobicContact CB-CD2 4.14Å; M204-L235 HydrophobicContact CB-CG 4.44Å; M204-L235 HydrophobicContact CG-CD2 4.17Å; I208-L235 HydrophobicContact CD1-CD1 3.87Å; I231-L235 HydrophobicContact CG2-CD1 3.98Å; I231-L235 HydrophobicContact CG2-CG 4.4Å; I231-L235 WeakPolarHBondContact O-CG 3.5Å; I231-L235 PolarHBondContact O-N 3.26Å; Y232-L235 PolarHBondContact O-N 3.12Å; Y233-L235 PolarHBondContact O-N 3.21Å; L235-D237 VanDerWaalsContact C-N 3.34Å
236G95Very high96.2Very high13 Ų1339.1 Ų39.113%0.13419%0.191CC..THydrogen-bonded Turntrans88.4-3.8-175.300000114.3Y232 Y233 N234 H238 F304Y232-G236 PolarHBondContact O-N 3.16Å; Y233-G236 PolarHBondContact O-N 3.43Å; N234-G236 VanDerWaalsContact C-N 3.29Å; G236-H238 PolarHBondContact O-CD2 3.11Å; G236-H238 PolarHBondContact O-N 3.21Å; G236-F304 WeakPolarHBondContact O-CE1 2.97Å
237D96.1Very high96.1Very high78 Ų7840.4 Ų40.442%0.41720%0.198SC..  trans-76.369.1178.8-71.4-31.8000111.5Y232 L235 E239 M240 S241Y232-D237 HydrophobicContact CD1-CB 3.86Å; Y232-D237 HydrophobicContact CG-CB 4.41Å; Y232-D237 WeakPolarHBondContact O-CA 3.4Å; Y232-D237 PolarHBondContact O-N 3.4Å; L235-D237 VanDerWaalsContact C-N 3.34Å; D237-E239 VanDerWaalsContact C-N 3.28Å; D237-E239 PolarHBondContact O-N 3.46Å; D237-M240 HydrophobicContact CB-CB 4.24Å; D237-M240 PolarHBondContact O-N 2.68Å; D237-S241 VanDerWaalsContact O-CB 3.29Å; D237-S241 WeakPolarHBondContact O-CB 3.45Å; D237-S241 PolarHBondContact O-N 3.49Å
238H96.8Very high96.2Very high23 Ų2337.7 Ų37.711%0.10619%0.186CC..Hα-helixtrans-59.9-33.3-177.156.183.3000113.6G236 L242 V265 N269 I272 F304G236-H238 PolarHBondContact O-CD2 3.11Å; G236-H238 PolarHBondContact O-N 3.21Å; H238-L242 WeakPolarHBondContact O-CB 3.24Å; H238-L242 PolarHBondContact O-N 3.32Å; H238-V265 WeakPolarHBondContact O-CG1 3.39Å; H238-N269 PolarHBondContact ND1-OD1 2.86Å; H238-I272 VanDerWaalsContact CD2-CD1 3.48Å; H238-I272 WeakPolarHBondContact CD2-CD1 2.97Å; H238-F304 HydrophobicContact CB-CE1 3.88Å; H238-F304 HydrophobicContact CB-CZ 4.12Å
239E97.3Very high96.2Very high102 Ų10239 Ų3948%0.47719%0.194SC..Hα-helixtrans-69.6-48.7-180-58-155.1142.500111.9D237 S241 L242 N243 Q273D237-E239 VanDerWaalsContact C-N 3.28Å; D237-E239 PolarHBondContact O-N 3.46Å; E239-S241 VanDerWaalsContact C-N 3.33Å; E239-L242 PolarHBondContact O-N 3.32Å; E239-N243 PolarHBondContact O-N 3.36Å; E239-N243 PolarHBondContact O-ND2 3.48Å; E239-Q273 PolarHBondContact OE1-NE2 3.06Å
240M96.9Very high96.1Very high69 Ų6946 Ų4634%0.3422%0.224SC..Hα-helixtrans-63.6-43.2175.8-68.5-58-6200110.4Y232 D237 L242 N243 E244Y232-M240 HydrophobicContact CD1-CB 3.78Å; Y232-M240 HydrophobicContact CD1-CG 4.47Å; Y232-M240 HydrophobicContact CD2-CB 3.84Å; Y232-M240 HydrophobicContact CE1-CB 4.05Å; Y232-M240 HydrophobicContact CE1-CG 4.38Å; Y232-M240 HydrophobicContact CE2-CB 4.09Å; Y232-M240 HydrophobicContact CE2-CE 4.23Å; Y232-M240 HydrophobicContact CG-CB 3.68Å; D237-M240 HydrophobicContact CB-CB 4.24Å; D237-M240 PolarHBondContact O-N 2.68Å; M240-L242 VanDerWaalsContact C-N 3.29Å; M240-L242 PolarHBondContact O-N 3.02Å; M240-N243 PolarHBondContact O-N 3.24Å; M240-N243 VanDerWaalsContact O-N 3.16Å; M240-E244 WeakPolarHBondContact O-CG 3.33Å; M240-E244 PolarHBondContact O-N 2.89Å
241S97.8Very high95.9Very high0 Ų047.7 Ų47.70%023%0.231CC..Hα-helixtrans-54-46.1174.1-174.50000112.1S229 D237 E239 N243 E244 V245 H261S229-S241 WeakPolarHBondContact CB-O 3.45Å; S229-S241 WeakPolarHBondContact O-CB 3.38Å; S229-S241 PolarHBondContact O-OG 2.93Å; S229-S241 PolarHBondContact OG-O 3.49Å; S229-S241 PolarHBondContact OG-OG 3.03Å; D237-S241 VanDerWaalsContact O-CB 3.29Å; D237-S241 WeakPolarHBondContact O-CB 3.45Å; D237-S241 PolarHBondContact O-N 3.49Å; E239-S241 VanDerWaalsContact C-N 3.33Å; S241-N243 PolarHBondContact O-N 3.01Å; S241-E244 PolarHBondContact O-N 2.69Å; S241-V245 WeakPolarHBondContact O-CG1 3.29Å; S241-V245 PolarHBondContact O-N 3.35Å; S241-V245 VanDerWaalsContact O-N 3.11Å; S241-H261 PolarHBondContact OG-NE2 3.36Å
242L98.1Very high95.8Very high4 Ų450 Ų502%0.02124%0.244CC..Hα-helixtrans-65.8-37.5179.7-174.957.1000112.4H238 E239 M240 V245 R246 Y262 V265 K266 N269H238-L242 WeakPolarHBondContact O-CB 3.24Å; H238-L242 PolarHBondContact O-N 3.32Å; E239-L242 PolarHBondContact O-N 3.32Å; M240-L242 VanDerWaalsContact C-N 3.29Å; M240-L242 PolarHBondContact O-N 3.02Å; L242-V245 HydrophobicContact CD1-CG1 4.34Å; L242-V245 WeakPolarHBondContact O-CG1 3.43Å; L242-R246 WeakPolarHBondContact O-CD 3.41Å; L242-R246 VanDerWaalsContact O-CG 3.22Å; L242-R246 WeakPolarHBondContact O-CG 3.46Å; L242-R246 PolarHBondContact O-N 3.23Å; L242-Y262 HydrophobicContact CD1-CD2 3.84Å; L242-Y262 HydrophobicContact CD1-CE2 3.92Å; L242-V265 HydrophobicContact CB-CG1 3.77Å; L242-V265 HydrophobicContact CD1-CB 4.5Å; L242-V265 HydrophobicContact CD1-CG1 4.28Å; L242-K266 HydrophobicContact CD1-CB 4.11Å; L242-N269 HydrophobicContact CD2-CB 4.04Å
243N97Very high95.6Very high73 Ų7353.6 Ų53.639%0.3927%0.269SS..Hα-helixtrans-68.3-46.1178.2-69.7-22.6000111.6E239 M240 S241 V245 R246 E247E239-N243 PolarHBondContact O-N 3.36Å; E239-N243 PolarHBondContact O-ND2 3.48Å; M240-N243 PolarHBondContact O-N 3.24Å; M240-N243 VanDerWaalsContact O-N 3.16Å; S241-N243 PolarHBondContact O-N 3.01Å; N243-V245 PolarHBondContact O-N 2.75Å; N243-R246 WeakPolarHBondContact O-CB 3.21Å; N243-R246 PolarHBondContact O-N 3.01Å; N243-R246 PolarHBondContact OD1-NH1 2.98Å; N243-R246 VanDerWaalsContact OD1-NH1 3.12Å; N243-E247 PolarHBondContact O-N 2.92Å; N243-E247 VanDerWaalsContact O-N 3.16Å
244E95.9Very high95.5Very high27 Ų2759.9 Ų59.913%0.12630%0.303CS..Hα-helixtrans-66.3-38.5-179.6-61.1-60.4167.600112.1F225 L228 Y232 M240 S241 R246 E247 C248F225-E244 VanDerWaalsContact CD1-OE2 3.3Å; F225-E244 WeakPolarHBondContact CD1-OE2 3.46Å; L228-E244 HydrophobicContact CB-CB 4.32Å; L228-E244 HydrophobicContact CB-CG 4.18Å; Y232-E244 HydrophobicContact CD2-CG 3.9Å; Y232-E244 HydrophobicContact CE2-CG 3.95Å; M240-E244 WeakPolarHBondContact O-CG 3.33Å; M240-E244 PolarHBondContact O-N 2.89Å; S241-E244 PolarHBondContact O-N 2.69Å; E244-R246 VanDerWaalsContact C-N 3.31Å; E244-R246 PolarHBondContact O-N 3.29Å; E244-E247 PolarHBondContact O-N 3.46Å; E244-C248 PolarHBondContact O-N 3.44Å
245V97Very high95.5Very high0 Ų058 Ų580%029%0.292CS..Hα-helixtrans-71.2-25.3176.472.20000112.8S229 S241 L242 N243 C248 L249 C258 H261 Y262S229-V245 WeakPolarHBondContact OG-CB 3.5Å; S241-V245 WeakPolarHBondContact O-CG1 3.29Å; S241-V245 PolarHBondContact O-N 3.35Å; S241-V245 VanDerWaalsContact O-N 3.11Å; L242-V245 HydrophobicContact CD1-CG1 4.34Å; L242-V245 WeakPolarHBondContact O-CG1 3.43Å; N243-V245 PolarHBondContact O-N 2.75Å; V245-C248 WeakPolarHBondContact O-CB 3.28Å; V245-C248 PolarHBondContact O-N 2.85Å; V245-L249 WeakPolarHBondContact O-CG 3.35Å; V245-L249 PolarHBondContact O-N 3.29Å; V245-C258 HydrophobicContact CG2-CB 3.89Å; V245-C258 WeakPolarHBondContact CG2-O 3.34Å; V245-H261 HydrophobicContact CG2-CB 4.41Å; V245-Y262 HydrophobicContact CG1-CD2 4.06Å
246R96.8Very high95.6Very high111 Ų11163.1 Ų63.142%0.41931%0.312SS..Hα-helixtrans-67.2-42.5170.4-77.3166.5174.9155-3.4111.1L242 N243 E244 C248 L249 K250 Y262L242-R246 WeakPolarHBondContact O-CD 3.41Å; L242-R246 VanDerWaalsContact O-CG 3.22Å; L242-R246 WeakPolarHBondContact O-CG 3.46Å; L242-R246 PolarHBondContact O-N 3.23Å; N243-R246 WeakPolarHBondContact O-CB 3.21Å; N243-R246 PolarHBondContact O-N 3.01Å; N243-R246 PolarHBondContact OD1-NH1 2.98Å; N243-R246 VanDerWaalsContact OD1-NH1 3.12Å; E244-R246 VanDerWaalsContact C-N 3.31Å; E244-R246 PolarHBondContact O-N 3.29Å; R246-C248 VanDerWaalsContact C-N 3.29Å; R246-C248 PolarHBondContact O-N 2.9Å; R246-L249 PolarHBondContact O-N 3.18Å; R246-K250 WeakPolarHBondContact O-CB 3.12Å; R246-K250 PolarHBondContact O-N 3.37Å; R246-Y262 HydrophobicContact CG-CD2 4.39Å; R246-Y262 HydrophobicContact CG-CE2 4.08Å
247E94.4Very high95.6Very high76 Ų7667.3 Ų67.336%0.35533%0.328SS..Hα-helixtrans-64.3-36.4173.8-67.3-58.2128.200111.1F225 N243 E244 L249 K250 L251F225-E247 HydrophobicContact CD1-CB 3.76Å; F225-E247 HydrophobicContact CE1-CB 3.69Å; F225-E247 HydrophobicContact CE1-CG 4.33Å; F225-E247 HydrophobicContact CG-CB 4.25Å; F225-E247 HydrophobicContact CZ-CB 4.14Å; N243-E247 PolarHBondContact O-N 2.92Å; N243-E247 VanDerWaalsContact O-N 3.16Å; E244-E247 PolarHBondContact O-N 3.46Å; E247-L249 PolarHBondContact O-N 3.25Å; E247-K250 WeakPolarHBondContact O-CB 3.43Å; E247-K250 PolarHBondContact O-N 3.21Å; E247-K250 IonicContact OE1-NZ 3.41Å; E247-K250 PolarHBondContact OE1-NZ 3.12Å; E247-K250 WeakPolarHBondContact OE2-CD 3.42Å; E247-K250 IonicContact OE2-NZ 2.88Å; E247-K250 PolarHBondContact OE2-NZ 3.32Å; E247-L251 WeakPolarHBondContact O-CG 3.44Å; E247-L251 PolarHBondContact O-N 2.96Å
248C94.9Very high95.6Very high0 Ų063.6 Ų63.60%031%0.308CS..Hα-helixtrans-54.5-53.3169.7179.80000112.2T222 F225 E244 V245 R246 K250 L251 D252 C258T222-C248 WeakPolarHBondContact CG2-SG 3.48Å; F225-C248 HydrophobicContact CB-CB 3.79Å; E244-C248 PolarHBondContact O-N 3.44Å; V245-C248 WeakPolarHBondContact O-CB 3.28Å; V245-C248 PolarHBondContact O-N 2.85Å; R246-C248 VanDerWaalsContact C-N 3.29Å; R246-C248 PolarHBondContact O-N 2.9Å; C248-K250 VanDerWaalsContact C-N 3.27Å; C248-K250 PolarHBondContact O-N 3.14Å; C248-L251 PolarHBondContact O-N 3.22Å; C248-D252 PolarHBondContact O-N 3.47Å; C248-C258 HydrophobicContact CB-CB 3.91Å; C248-C258 WeakPolarHBondContact CB-SG 3.36Å; C248-C258 WeakPolarHBondContact SG-CB 3.44Å; C248-C258 CovalentContact SG-SG 2.02Å; C248-C258 PolarHBondContact SG-SG 3.42Å
249L95.4Very high95.7Very high29 Ų2967 Ų6715%0.15232%0.323CS..Hα-helixtrans-71-20.7-177.9-70.1174.8000114V245 R246 E247 D252 P253 C258 F259 Y262V245-L249 WeakPolarHBondContact O-CG 3.35Å; V245-L249 PolarHBondContact O-N 3.29Å; R246-L249 PolarHBondContact O-N 3.18Å; E247-L249 PolarHBondContact O-N 3.25Å; L249-D252 WeakPolarHBondContact CA-O 3.37Å; L249-D252 CarbonylContact O-C 3.56Å; L249-P253 VanDerWaalsContact O-CA 3.3Å; L249-P253 WeakPolarHBondContact O-CA 3.3Å; L249-P253 VanDerWaalsContact O-N 3.15Å; L249-C258 HydrophobicContact CD2-CB 3.83Å; L249-C258 HydrophobicContact CG-CB 4.09Å; L249-F259 HydrophobicContact CD1-CD2 4.32Å; L249-F259 HydrophobicContact CD2-CB 4.05Å; L249-Y262 HydrophobicContact CD1-CD1 4.1Å; L249-Y262 HydrophobicContact CD1-CD2 4.16Å; L249-Y262 HydrophobicContact CD1-CG 3.72Å
250K94.8Very high95.7Very high145 Ų14566 Ų6663%0.6333%0.327SS*.Hα-helixtrans-72.2-33.4172.8-178.2-175.2173.4-170.90111.6R246 E247 C248R246-K250 WeakPolarHBondContact O-CB 3.12Å; R246-K250 PolarHBondContact O-N 3.37Å; E247-K250 WeakPolarHBondContact O-CB 3.43Å; E247-K250 PolarHBondContact O-N 3.21Å; E247-K250 IonicContact OE1-NZ 3.41Å; E247-K250 PolarHBondContact OE1-NZ 3.12Å; E247-K250 WeakPolarHBondContact OE2-CD 3.42Å; E247-K250 IonicContact OE2-NZ 2.88Å; E247-K250 PolarHBondContact OE2-NZ 3.32Å; C248-K250 VanDerWaalsContact C-N 3.27Å; C248-K250 PolarHBondContact O-N 3.14Å
251L91.8Very high95.7Very high74 Ų7463.8 Ų63.839%0.38732%0.315SS..Hα-helixtrans-77-42.6173.5-63.8-179.3000111.7N219 F225 E247 C248N219-L251 WeakPolarHBondContact O-CD2 3.26Å; F225-L251 HydrophobicContact CD2-CD1 3.71Å; F225-L251 HydrophobicContact CE2-CD1 3.64Å; E247-L251 WeakPolarHBondContact O-CG 3.44Å; E247-L251 PolarHBondContact O-N 2.96Å; C248-L251 PolarHBondContact O-N 3.22Å
252D92.5Very high95.7Very high57 Ų5765.9 Ų65.931%0.30532%0.324SS..  trans-139.197179.4-179.85.5000111T222 C248 L249 D254 H255T222-D252 HydrophobicContact CG2-CB 3.96Å; C248-D252 PolarHBondContact O-N 3.47Å; L249-D252 WeakPolarHBondContact CA-O 3.37Å; L249-D252 CarbonylContact O-C 3.56Å; D252-D254 PolarHBondContact O-N 3.38Å; D252-D254 PolarHBondContact OD1-N 3.33Å; D252-H255 HydrophobicContact CB-CB 4.04Å; D252-H255 WeakPolarHBondContact O-CB 3.13Å; D252-H255 PolarHBondContact O-N 3.26Å; D252-H255 PolarHBondContact OD1-N 3.13Å; D252-H255 WeakPolarHBondContact OD2-CB 3.41Å; D252-H255 IonicContact OD2-CD2 3.6Å; D252-H255 IonicContact OD2-CG 3.58Å
253P94.3Very high95.7Very high92 Ų9271.5 Ų71.560%0.59735%0.348SS*.THydrogen-bonded Turntrans-62.7-24.2179.1-25.135.3000114.5L249L249-P253 VanDerWaalsContact O-CA 3.3Å; L249-P253 WeakPolarHBondContact O-CA 3.3Å; L249-P253 VanDerWaalsContact O-N 3.15Å
254D93.8Very high95.6Very high143 Ų14370.7 Ų70.777%0.76534%0.342SS*.THydrogen-bonded Turntrans-95.54.4-175.9-68.8-33.9000112.5D252 K256D252-D254 PolarHBondContact O-N 3.38Å; D252-D254 PolarHBondContact OD1-N 3.33Å; D254-K256 PolarHBondContact O-N 2.91Å
255H95.1Very high95.7Very high28 Ų2869.4 Ų69.413%0.1334%0.336CS..  trans-66.4101.2-178.9-165.7-70.8000112.3T222 D252 Q257 C258 F259T222-H255 HydrophobicContact CG2-CB 4.19Å; T222-H255 WeakPolarHBondContact CG2-CD2 3.43Å; D252-H255 HydrophobicContact CB-CB 4.04Å; D252-H255 WeakPolarHBondContact O-CB 3.13Å; D252-H255 PolarHBondContact O-N 3.26Å; D252-H255 PolarHBondContact OD1-N 3.13Å; D252-H255 WeakPolarHBondContact OD2-CB 3.41Å; D252-H255 IonicContact OD2-CD2 3.6Å; D252-H255 IonicContact OD2-CG 3.58Å; H255-Q257 PolarHBondContact ND1-N 3.49Å; H255-Q257 PolarHBondContact O-N 3.32Å; H255-C258 HydrophobicContact CB-CB 4.19Å; H255-C258 PolarHBondContact ND1-N 3.38Å; H255-C258 PolarHBondContact O-N 3.46Å; H255-F259 WeakPolarHBondContact O-CB 3.35Å; H255-F259 PolarHBondContact O-N 3.39Å
256K95.2Very high95.8Very high182 Ų18274.2 Ų74.279%0.79136%0.357SS*.Hα-helixtrans-52.9-45.3-173.4-63.8-177.9-177.6177.10114.3D254 F259 S260D254-K256 PolarHBondContact O-N 2.91Å; K256-F259 PolarHBondContact O-N 2.91Å; K256-S260 WeakPolarHBondContact O-CB 3.29Å; K256-S260 PolarHBondContact O-N 2.91Å
257Q96Very high95.8Very high101 Ų10174.2 Ų74.247%0.47236%0.36SS..Hα-helixtrans-69.6-52-176.7-54.3176.5-69.500111.5Y226 H255 F259 S260 H261Y226-Q257 HydrophobicContact CD2-CB 4.34Å; Y226-Q257 HydrophobicContact CE1-CB 4.31Å; Y226-Q257 HydrophobicContact CE2-CB 3.75Å; H255-Q257 PolarHBondContact ND1-N 3.49Å; H255-Q257 PolarHBondContact O-N 3.32Å; Q257-F259 VanDerWaalsContact C-N 3.28Å; Q257-F259 PolarHBondContact O-N 2.02Å; Q257-S260 PolarHBondContact O-N 3.45Å; Q257-H261 WeakPolarHBondContact O-CB 3.2Å; Q257-H261 PolarHBondContact O-N 2.79Å
258C96.5Very high96Very high0 Ų070.6 Ų70.60%034%0.343CS..Hα-helixtrans-53.5-40.5171.4-71.60000113.5Y226 V245 C248 L249 H255 H261 Y262Y226-C258 VanDerWaalsContact CB-SG 3.59Å; Y226-C258 HydrophobicContact CD2-CB 4.45Å; Y226-C258 VanDerWaalsContact CD2-SG 3.53Å; V245-C258 HydrophobicContact CG2-CB 3.89Å; V245-C258 WeakPolarHBondContact CG2-O 3.34Å; C248-C258 HydrophobicContact CB-CB 3.91Å; C248-C258 WeakPolarHBondContact CB-SG 3.36Å; C248-C258 WeakPolarHBondContact SG-CB 3.44Å; C248-C258 CovalentContact SG-SG 2.02Å; C248-C258 PolarHBondContact SG-SG 3.42Å; L249-C258 HydrophobicContact CD2-CB 3.83Å; L249-C258 HydrophobicContact CG-CB 4.09Å; H255-C258 HydrophobicContact CB-CB 4.19Å; H255-C258 PolarHBondContact ND1-N 3.38Å; H255-C258 PolarHBondContact O-N 3.46Å; C258-H261 PolarHBondContact O-N 3.41Å; C258-Y262 WeakPolarHBondContact O-CB 3.49Å; C258-Y262 PolarHBondContact O-N 3.16Å
259F97.5Very high96.1Very high95 Ų9571.1 Ų71.142%0.41735%0.345SS..Hα-helixtrans-68.3-41178.9-173.5-117.7000112.5L249 H255 K256 Q257 K263L249-F259 HydrophobicContact CD1-CD2 4.32Å; L249-F259 HydrophobicContact CD2-CB 4.05Å; H255-F259 WeakPolarHBondContact O-CB 3.35Å; H255-F259 PolarHBondContact O-N 3.39Å; K256-F259 PolarHBondContact O-N 2.91Å; Q257-F259 VanDerWaalsContact C-N 3.28Å; Q257-F259 PolarHBondContact O-N 2.02Å; F259-K263 HydrophobicContact CE1-CD 4.4Å; F259-K263 WeakPolarHBondContact O-CG 3.46Å; F259-K263 PolarHBondContact O-N 3.06Å; F259-K263 VanDerWaalsContact O-N 3.16Å
260S97.2Very high96.2Very high81 Ų8177 Ų7757%0.56637%0.37SS*.Hα-helixtrans-61.5-48.6173.7-171.10000111.3K256 Q257 K263 Q264K256-S260 WeakPolarHBondContact O-CB 3.29Å; K256-S260 PolarHBondContact O-N 2.91Å; Q257-S260 PolarHBondContact O-N 3.45Å; S260-K263 PolarHBondContact O-N 3.4Å; S260-Q264 PolarHBondContact O-N 2.96Å
261H97.5Very high96.4Very high21 Ų2171.8 Ų71.810%0.09735%0.348CS..Hα-helixtrans-61.8-46.3178.3-170.755.7000111.6Y226 S229 Y233 S241 V245 Q257 C258 K263 Q264 V265Y226-H261 HydrophobicContact CE2-CB 3.97Å; S229-H261 PolarHBondContact OG-CD2 3.35Å; S229-H261 PolarHBondContact OG-NE2 3.49Å; Y233-H261 AromaticContact CG-CE1 3.75Å; S241-H261 PolarHBondContact OG-NE2 3.36Å; V245-H261 HydrophobicContact CG2-CB 4.41Å; Q257-H261 WeakPolarHBondContact O-CB 3.2Å; Q257-H261 PolarHBondContact O-N 2.79Å; C258-H261 PolarHBondContact O-N 3.41Å; H261-K263 VanDerWaalsContact C-N 3.3Å; H261-K263 PolarHBondContact O-N 2.91Å; H261-Q264 WeakPolarHBondContact O-CB 3.12Å; H261-Q264 PolarHBondContact O-N 3.46Å; H261-Q264 VanDerWaalsContact O-N 3.07Å; H261-V265 VanDerWaalsContact CE1-CG2 3.43Å; H261-V265 WeakPolarHBondContact CE1-CG2 3.38Å; H261-V265 WeakPolarHBondContact NE2-CG2 3.38Å; H261-V265 WeakPolarHBondContact O-CG2 3.47Å; H261-V265 PolarHBondContact O-N 3.48Å
262Y98.3Very high96.7Very high45 Ų4568.5 Ų68.518%0.17633%0.331CS..Hα-helixtrans-53.7-43.3175.7167.9-100.2000112.7L242 V245 R246 L249 C258 Q264 K266L242-Y262 HydrophobicContact CD1-CD2 3.84Å; L242-Y262 HydrophobicContact CD1-CE2 3.92Å; V245-Y262 HydrophobicContact CG1-CD2 4.06Å; R246-Y262 HydrophobicContact CG-CD2 4.39Å; R246-Y262 HydrophobicContact CG-CE2 4.08Å; L249-Y262 HydrophobicContact CD1-CD1 4.1Å; L249-Y262 HydrophobicContact CD1-CD2 4.16Å; L249-Y262 HydrophobicContact CD1-CG 3.72Å; C258-Y262 WeakPolarHBondContact O-CB 3.49Å; C258-Y262 PolarHBondContact O-N 3.16Å; Y262-Q264 PolarHBondContact O-N 2.86Å; Y262-K266 HydrophobicContact CE1-CD 3.85Å; Y262-K266 HydrophobicContact CE2-CB 4.5Å; Y262-K266 HydrophobicContact CE2-CD 4.31Å; Y262-K266 WeakPolarHBondContact O-CB 3.42Å; Y262-K266 PolarHBondContact O-N 3.47Å; Y262-K266 WeakPolarHBondContact OH-CD 3.4Å; Y262-K266 WeakPolarHBondContact OH-CE 3.5Å; Y262-K266 PolarHBondContact OH-NZ 3.23Å
263K97.5Very high96.9Very high121 Ų12170 Ų7053%0.52634%0.336SS..Hα-helixtrans-61.7-44.7177.9-73.2-179.5-172.31770111.8F259 S260 H261 K267F259-K263 HydrophobicContact CE1-CD 4.4Å; F259-K263 WeakPolarHBondContact O-CG 3.46Å; F259-K263 PolarHBondContact O-N 3.06Å; F259-K263 VanDerWaalsContact O-N 3.16Å; S260-K263 PolarHBondContact O-N 3.4Å; H261-K263 VanDerWaalsContact C-N 3.3Å; H261-K263 PolarHBondContact O-N 2.91Å; K263-K267 WeakPolarHBondContact O-CB 3.49Å; K263-K267 PolarHBondContact O-N 3Å; K263-K267 VanDerWaalsContact O-N 3.1Å
264Q96.3Very high97.1Very high57 Ų5767.3 Ų67.327%0.26632%0.319SS..Hα-helixtrans-62.9-56.4178.7179.664.3700110.4Y233 S260 H261 Y262 K266 K267 L268 T297 E298Y233-Q264 WeakPolarHBondContact OH-CG 3Å; Y233-Q264 PolarHBondContact OH-NE2 2.93Å; S260-Q264 PolarHBondContact O-N 2.96Å; H261-Q264 WeakPolarHBondContact O-CB 3.12Å; H261-Q264 PolarHBondContact O-N 3.46Å; H261-Q264 VanDerWaalsContact O-N 3.07Å; Y262-Q264 PolarHBondContact O-N 2.86Å; Q264-K266 VanDerWaalsContact C-N 3.34Å; Q264-K266 PolarHBondContact O-N 2.92Å; Q264-K267 PolarHBondContact O-N 3.35Å; Q264-L268 PolarHBondContact O-N 2.99Å; Q264-T297 PolarHBondContact NE2-O 3.1Å; Q264-E298 PolarHBondContact NE2-OE2 3.21Å; Q264-E298 VanDerWaalsContact NE2-OE2 3.13Å
265V97.6Very high97.3Very high0 Ų060.5 Ų60.50%028%0.283CS..Hα-helixtrans-60.9-42-178.5-174.30000111.3Y233 H238 L242 H261 K267 L268 N269Y233-V265 HydrophobicContact CD2-CG2 3.59Å; Y233-V265 HydrophobicContact CE2-CG2 3.79Å; Y233-V265 HydrophobicContact CG-CG2 4.5Å; H238-V265 WeakPolarHBondContact O-CG1 3.39Å; L242-V265 HydrophobicContact CB-CG1 3.77Å; L242-V265 HydrophobicContact CD1-CB 4.5Å; L242-V265 HydrophobicContact CD1-CG1 4.28Å; H261-V265 VanDerWaalsContact CE1-CG2 3.43Å; H261-V265 WeakPolarHBondContact CE1-CG2 3.38Å; H261-V265 WeakPolarHBondContact NE2-CG2 3.38Å; H261-V265 WeakPolarHBondContact O-CG2 3.47Å; H261-V265 PolarHBondContact O-N 3.48Å; V265-K267 VanDerWaalsContact C-N 3.35Å; V265-K267 PolarHBondContact O-N 2.97Å; V265-L268 PolarHBondContact O-N 2.88Å; V265-N269 WeakPolarHBondContact O-CB 2.97Å; V265-N269 PolarHBondContact O-N 3.32Å
266K98.3Very high97.5Very high100 Ų10061.9 Ų61.944%0.43529%0.289SS..Hα-helixtrans-61.3-42.9178.1-177.9-174.8-170.4169.20112L242 Y262 Q264 K270L242-K266 HydrophobicContact CD1-CB 4.11Å; Y262-K266 HydrophobicContact CE1-CD 3.85Å; Y262-K266 HydrophobicContact CE2-CB 4.5Å; Y262-K266 HydrophobicContact CE2-CD 4.31Å; Y262-K266 WeakPolarHBondContact O-CB 3.42Å; Y262-K266 PolarHBondContact O-N 3.47Å; Y262-K266 WeakPolarHBondContact OH-CD 3.4Å; Y262-K266 WeakPolarHBondContact OH-CE 3.5Å; Y262-K266 PolarHBondContact OH-NZ 3.23Å; Q264-K266 VanDerWaalsContact C-N 3.34Å; Q264-K266 PolarHBondContact O-N 2.92Å; K266-K270 WeakPolarHBondContact O-CB 3.34Å; K266-K270 PolarHBondContact O-N 2.95Å; K266-K270 VanDerWaalsContact O-N 3.07Å
267K97.5Very high97.6Very high112 Ų11257.8 Ų57.849%0.48727%0.273SS..Hα-helixtrans-64-49.1178-179.1-177172.3-169.20110.3K263 Q264 V265 K270 Q271 T297K263-K267 WeakPolarHBondContact O-CB 3.49Å; K263-K267 PolarHBondContact O-N 3Å; K263-K267 VanDerWaalsContact O-N 3.1Å; Q264-K267 PolarHBondContact O-N 3.35Å; V265-K267 VanDerWaalsContact C-N 3.35Å; V265-K267 PolarHBondContact O-N 2.97Å; K267-K270 PolarHBondContact O-N 3.05Å; K267-Q271 WeakPolarHBondContact O-CG 3.37Å; K267-Q271 PolarHBondContact O-N 3.15Å; K267-Q271 VanDerWaalsContact O-N 3.08Å; K267-T297 HydrophobicContact CD-CG2 3.91Å; K267-T297 HydrophobicContact CG-CG2 4.31Å
268L97.4Very high97.7Very high0 Ų053.5 Ų53.50%025%0.253CS..Hα-helixtrans-61.7-50.2-179.5-165.771000111.5Y233 Q264 V265 K270 Q271 I272 V294 T297 E298 F304Y233-L268 HydrophobicContact CE2-CD2 3.73Å; Q264-L268 PolarHBondContact O-N 2.99Å; V265-L268 PolarHBondContact O-N 2.88Å; L268-K270 VanDerWaalsContact C-N 3.29Å; L268-K270 PolarHBondContact O-N 3.22Å; L268-Q271 WeakPolarHBondContact O-CB 3.27Å; L268-Q271 PolarHBondContact O-N 3.2Å; L268-I272 HydrophobicContact CG-CD1 4.12Å; L268-I272 WeakPolarHBondContact O-CG1 3.37Å; L268-I272 PolarHBondContact O-N 3.11Å; L268-V294 HydrophobicContact CD1-CB 4.45Å; L268-V294 HydrophobicContact CD1-CG1 3.76Å; L268-T297 HydrophobicContact CD1-CG2 4.2Å; L268-E298 HydrophobicContact CD1-CB 3.94Å; L268-E298 HydrophobicContact CD2-CB 4.16Å; L268-F304 HydrophobicContact CD2-CD1 3.82Å; L268-F304 HydrophobicContact CD2-CD2 3.72Å; L268-F304 HydrophobicContact CD2-CE1 3.63Å; L268-F304 HydrophobicContact CD2-CE2 3.53Å; L268-F304 HydrophobicContact CD2-CG 3.87Å; L268-F304 HydrophobicContact CD2-CZ 3.49Å; L268-F304 VanDerWaalsContact CD2-CZ 3.49Å
269N98Very high97.8Very high10 Ų1054.2 Ų54.25%0.05326%0.257CS..Hα-helixtrans-56.9-41.7177.2-173.688.3000111.9H238 L242 V265 I272 Q273H238-N269 PolarHBondContact ND1-OD1 2.86Å; L242-N269 HydrophobicContact CD2-CB 4.04Å; V265-N269 WeakPolarHBondContact O-CB 2.97Å; V265-N269 PolarHBondContact O-N 3.32Å; N269-I272 PolarHBondContact O-N 3.42Å; N269-Q273 PolarHBondContact ND2-NE2 3.43Å; N269-Q273 VanDerWaalsContact ND2-NE2 3.14Å; N269-Q273 PolarHBondContact ND2-OE1 2.87Å; N269-Q273 VanDerWaalsContact ND2-OE1 3.12Å; N269-Q273 WeakPolarHBondContact O-CB 3.38Å; N269-Q273 VanDerWaalsContact O-CG 3.31Å; N269-Q273 WeakPolarHBondContact O-CG 3.36Å; N269-Q273 PolarHBondContact O-N 2.76Å
270K98.1Very high97.8Very high154 Ų15458.7 Ų58.767%0.6727%0.271SS*.Hα-helixtrans-65.4-38.2176.8-174.5178.2-179.4-178.90112.1K266 K267 L268 S274K266-K270 WeakPolarHBondContact O-CB 3.34Å; K266-K270 PolarHBondContact O-N 2.95Å; K266-K270 VanDerWaalsContact O-N 3.07Å; K267-K270 PolarHBondContact O-N 3.05Å; L268-K270 VanDerWaalsContact C-N 3.29Å; L268-K270 PolarHBondContact O-N 3.22Å; K270-S274 WeakPolarHBondContact O-CB 3.34Å; K270-S274 PolarHBondContact O-N 3.32Å
271Q97.7Very high97.8Very high34 Ų3459.5 Ų59.516%0.15927%0.266CS..Hα-helixtrans-65.7-46.1176.8-72.3169.5-44.800111.2K267 L268 S274 A275 V294 T297K267-Q271 WeakPolarHBondContact O-CG 3.37Å; K267-Q271 PolarHBondContact O-N 3.15Å; K267-Q271 VanDerWaalsContact O-N 3.08Å; L268-Q271 WeakPolarHBondContact O-CB 3.27Å; L268-Q271 PolarHBondContact O-N 3.2Å; Q271-S274 PolarHBondContact O-N 3.29Å; Q271-A275 WeakPolarHBondContact O-CB 3.49Å; Q271-A275 PolarHBondContact O-N 3.47Å; Q271-V294 HydrophobicContact CB-CG2 3.66Å; Q271-T297 PolarHBondContact NE2-OG1 3.23Å; Q271-T297 VanDerWaalsContact NE2-OG1 3.09Å; Q271-T297 PolarHBondContact OE1-OG1 3.11Å
272I98.1Very high97.7Very high6 Ų665.6 Ų65.63%0.03129%0.294CS..Hα-helixtrans-64.7-49.2179.3-63.3169.3000110.8H238 L268 N269 S274 A275 E276 Y291 V294 F304 L307H238-I272 VanDerWaalsContact CD2-CD1 3.48Å; H238-I272 WeakPolarHBondContact CD2-CD1 2.97Å; L268-I272 HydrophobicContact CG-CD1 4.12Å; L268-I272 WeakPolarHBondContact O-CG1 3.37Å; L268-I272 PolarHBondContact O-N 3.11Å; N269-I272 PolarHBondContact O-N 3.42Å; I272-S274 VanDerWaalsContact C-N 3.29Å; I272-S274 PolarHBondContact O-N 3.19Å; I272-A275 WeakPolarHBondContact O-CB 3.48Å; I272-A275 PolarHBondContact O-N 2.87Å; I272-E276 PolarHBondContact O-N 3.29Å; I272-Y291 HydrophobicContact CG1-CE1 4.46Å; I272-Y291 HydrophobicContact CG2-CE1 4.35Å; I272-V294 HydrophobicContact CD1-CG1 4.22Å; I272-V294 HydrophobicContact CG1-CG1 4.01Å; I272-V294 HydrophobicContact CG1-CG2 3.74Å; I272-F304 HydrophobicContact CD1-CD1 4.08Å; I272-F304 HydrophobicContact CD1-CE1 4.22Å; I272-L307 HydrophobicContact CD1-CD2 4.36Å
273Q97.9Very high97.7Very high88 Ų8868.5 Ų68.541%0.41131%0.305SS..Hα-helixtrans-60-39.4177.7-74.1-179.4-17.500112.3E239 N269 A275 E277E239-Q273 PolarHBondContact OE1-NE2 3.06Å; N269-Q273 PolarHBondContact ND2-NE2 3.43Å; N269-Q273 VanDerWaalsContact ND2-NE2 3.14Å; N269-Q273 PolarHBondContact ND2-OE1 2.87Å; N269-Q273 VanDerWaalsContact ND2-OE1 3.12Å; N269-Q273 WeakPolarHBondContact O-CB 3.38Å; N269-Q273 VanDerWaalsContact O-CG 3.31Å; N269-Q273 WeakPolarHBondContact O-CG 3.36Å; N269-Q273 PolarHBondContact O-N 2.76Å; Q273-A275 VanDerWaalsContact C-N 3.34Å; Q273-E277 WeakPolarHBondContact O-CB 3.33Å; Q273-E277 PolarHBondContact O-N 3.48Å
274S98.1Very high97.7Very high36 Ų3664.3 Ų64.325%0.25229%0.287SS..Hα-helixtrans-66.3-34.9174.5177.70000112.4K270 Q271 I272 L278K270-S274 WeakPolarHBondContact O-CB 3.34Å; K270-S274 PolarHBondContact O-N 3.32Å; Q271-S274 PolarHBondContact O-N 3.29Å; I272-S274 VanDerWaalsContact C-N 3.29Å; I272-S274 PolarHBondContact O-N 3.19Å; S274-L278 WeakPolarHBondContact O-CD1 3.13Å; S274-L278 VanDerWaalsContact O-CG 3.27Å; S274-L278 WeakPolarHBondContact O-CG 3.47Å; S274-L278 PolarHBondContact O-N 2.81Å; S274-L278 VanDerWaalsContact O-N 3.16Å
275A98.2Very high97.7Very high0 Ų065.2 Ų65.20%029%0.291CS..Hα-helixtrans-69.4-44.4177.400000111.4Q271 I272 Q273 E277 L278 I279 K290 Y291Q271-A275 WeakPolarHBondContact O-CB 3.49Å; Q271-A275 PolarHBondContact O-N 3.47Å; I272-A275 WeakPolarHBondContact O-CB 3.48Å; I272-A275 PolarHBondContact O-N 2.87Å; Q273-A275 VanDerWaalsContact C-N 3.34Å; A275-E277 VanDerWaalsContact C-N 3.32Å; A275-E277 PolarHBondContact O-N 2.97Å; A275-L278 WeakPolarHBondContact O-CB 3.3Å; A275-L278 PolarHBondContact O-N 2.69Å; A275-I279 WeakPolarHBondContact O-CG1 3.22Å; A275-I279 PolarHBondContact O-N 3.09Å; A275-K290 HydrophobicContact CB-CB 3.69Å; A275-Y291 HydrophobicContact CB-CD1 4.44Å; A275-Y291 HydrophobicContact CB-CD2 3.68Å; A275-Y291 HydrophobicContact CB-CE1 4.18Å; A275-Y291 HydrophobicContact CB-CE2 3.39Å; A275-Y291 HydrophobicContact CB-CG 4.19Å
276E97.8Very high97.7Very high56 Ų5669.5 Ų69.526%0.26231%0.311SS..Hα-helixtrans-64.4-35.9175.3-71.7-56.3133.800112.5I272 I279 R280 Y291 R311I272-E276 PolarHBondContact O-N 3.29Å; E276-I279 PolarHBondContact O-N 3.26Å; E276-R280 WeakPolarHBondContact O-CG 3.1Å; E276-R280 PolarHBondContact O-N 2.83Å; E276-R280 VanDerWaalsContact O-N 3.08Å; E276-Y291 VanDerWaalsContact CD-OH 3.32Å; E276-Y291 WeakPolarHBondContact CG-OH 3.48Å; E276-Y291 PolarHBondContact OE1-OH 3.24Å; E276-R311 IonicContact OE1-CZ 2.8Å; E276-R311 IonicContact OE1-NE 2.7Å; E276-R311 PolarHBondContact OE1-NE 3.45Å; E276-R311 IonicContact OE1-NH2 3.36Å; E276-R311 PolarHBondContact OE1-NH2 3.22Å; E276-R311 IonicContact OE2-CZ 3.74Å; E276-R311 IonicContact OE2-NE 2.71Å; E276-R311 IonicContact OE2-NH2 3.36Å; E276-R311 PolarHBondContact OE2-NH2 2.91Å
277E98.3Very high97.7Very high97 Ų9764.8 Ų64.845%0.45329%0.291SS..Hα-helixtrans-61.5-43.8172.3-172.5168.7-147.300111.9Q273 A275 I279 R280 E281Q273-E277 WeakPolarHBondContact O-CB 3.33Å; Q273-E277 PolarHBondContact O-N 3.48Å; A275-E277 VanDerWaalsContact C-N 3.32Å; A275-E277 PolarHBondContact O-N 2.97Å; E277-I279 VanDerWaalsContact C-N 3.35Å; E277-I279 PolarHBondContact O-N 2.99Å; E277-R280 PolarHBondContact O-N 3.36Å; E277-E281 WeakPolarHBondContact O-CG 3.3Å; E277-E281 PolarHBondContact O-N 3.07Å
278L98.4Very high97.7Very high11 Ų1159.6 Ų59.66%0.05827%0.268CS..Hα-helixtrans-64.3-36.4176.2-70.8164.1000112.7S274 A275 E281 Q282 R283 E286 A287 K290S274-L278 WeakPolarHBondContact O-CD1 3.13Å; S274-L278 VanDerWaalsContact O-CG 3.27Å; S274-L278 WeakPolarHBondContact O-CG 3.47Å; S274-L278 PolarHBondContact O-N 2.81Å; S274-L278 VanDerWaalsContact O-N 3.16Å; A275-L278 WeakPolarHBondContact O-CB 3.3Å; A275-L278 PolarHBondContact O-N 2.69Å; L278-E281 CarbonylContact O-C 3.18Å; L278-E281 PolarHBondContact O-N 3.19Å; L278-Q282 PolarHBondContact O-N 2.91Å; L278-Q282 VanDerWaalsContact O-N 3.16Å; L278-R283 HydrophobicContact CB-CB 4.37Å; L278-R283 HydrophobicContact CD2-CB 3.92Å; L278-R283 PolarHBondContact O-N 3.46Å; L278-E286 HydrophobicContact CD1-CB 3.94Å; L278-E286 HydrophobicContact CD2-CB 4.17Å; L278-A287 HydrophobicContact CB-CB 3.88Å; L278-K290 HydrophobicContact CD1-CG 3.75Å
279I97.6Very high97.8Very high15 Ų1563 Ų638%0.07729%0.292CS..Hα-helixtrans-61.7-44.9173.2-68.8173.8000110.2A275 E276 E277 E281 Q282 F284 A287 Y291 A315A275-I279 WeakPolarHBondContact O-CG1 3.22Å; A275-I279 PolarHBondContact O-N 3.09Å; E276-I279 PolarHBondContact O-N 3.26Å; E277-I279 VanDerWaalsContact C-N 3.35Å; E277-I279 PolarHBondContact O-N 2.99Å; I279-E281 VanDerWaalsContact C-N 3.29Å; I279-E281 PolarHBondContact O-N 3.46Å; I279-Q282 PolarHBondContact O-N 2.91Å; I279-F284 HydrophobicContact CG2-CE1 4.31Å; I279-A287 HydrophobicContact CD1-CB 4.38Å; I279-A287 HydrophobicContact CG1-CB 3.63Å; I279-Y291 HydrophobicContact CD1-CE2 3.96Å; I279-A315 HydrophobicContact CG1-CB 4.5Å
280R97.6Very high97.8Very high188 Ų18866.6 Ų66.671%0.70931%0.307SS*.Hα-helixtrans-63.6-33.8176.3-68.1-174.8-57.9-160.41.4112.9E276 E277 Q282E276-R280 WeakPolarHBondContact O-CG 3.1Å; E276-R280 PolarHBondContact O-N 2.83Å; E276-R280 VanDerWaalsContact O-N 3.08Å; E277-R280 PolarHBondContact O-N 3.36Å; R280-Q282 PolarHBondContact O-N 2.91Å
281E97.6Very high97.8Very high98 Ų9859.3 Ų59.346%0.45828%0.276SS..THydrogen-bonded Turntrans-77.51.8173.4-68.4-179.1178.500113.7E277 L278 I279 R283E277-E281 WeakPolarHBondContact O-CG 3.3Å; E277-E281 PolarHBondContact O-N 3.07Å; L278-E281 CarbonylContact O-C 3.18Å; L278-E281 PolarHBondContact O-N 3.19Å; I279-E281 VanDerWaalsContact C-N 3.29Å; I279-E281 PolarHBondContact O-N 3.46Å; E281-R283 HydrophobicContact CB-CG 4.28Å; E281-R283 PolarHBondContact O-N 3.25Å; E281-R283 WeakPolarHBondContact OE2-CD 3.34Å; E281-R283 IonicContact OE2-CZ 2.93Å; E281-R283 IonicContact OE2-NH1 3.87Å; E281-R283 PolarHBondContact OE2-NH1 3.42Å
282Q96.6Very high97.7Very high150 Ų15061.9 Ų61.970%0.70129%0.287SS*.THydrogen-bonded Turntrans61.221.5-175.9-53.1176.712.600114.2L278 I279 R280 F284L278-Q282 PolarHBondContact O-N 2.91Å; L278-Q282 VanDerWaalsContact O-N 3.16Å; I279-Q282 PolarHBondContact O-N 2.91Å; R280-Q282 PolarHBondContact O-N 2.91Å; Q282-F284 VanDerWaalsContact C-N 3.33Å; Q282-F284 HydrophobicContact CB-CE2 3.97Å; Q282-F284 HydrophobicContact CB-CZ 3.96Å; Q282-F284 HydrophobicContact CG-CZ 4.21Å; Q282-F284 WeakPolarHBondContact O-CD2 3.24Å; Q282-F284 PolarHBondContact O-N 3.43Å
283R97.8Very high97.7Very high106 Ų10663 Ų6340%0.430%0.298SS..  trans-92.963.7177.5-69168.365.7-167.55.2110.4L278 E281 E285 E286 A287L278-R283 HydrophobicContact CB-CB 4.37Å; L278-R283 HydrophobicContact CD2-CB 3.92Å; L278-R283 PolarHBondContact O-N 3.46Å; E281-R283 HydrophobicContact CB-CG 4.28Å; E281-R283 PolarHBondContact O-N 3.25Å; E281-R283 WeakPolarHBondContact OE2-CD 3.34Å; E281-R283 IonicContact OE2-CZ 2.93Å; E281-R283 IonicContact OE2-NH1 3.87Å; E281-R283 PolarHBondContact OE2-NH1 3.42Å; R283-E285 PolarHBondContact O-N 3.48Å; R283-E286 IonicContact CZ-OE1 3.37Å; R283-E286 IonicContact CZ-OE2 3.77Å; R283-E286 IonicContact NE-OE1 3.95Å; R283-E286 PolarHBondContact NE-OE1 3.29Å; R283-E286 IonicContact NE-OE2 2.9Å; R283-E286 IonicContact NH2-OE1 3.66Å; R283-E286 PolarHBondContact NH2-OE1 3.45Å; R283-E286 IonicContact NH2-OE2 3.73Å; R283-E286 PolarHBondContact NH2-OE2 3.19Å; R283-E286 PolarHBondContact O-N 2.92Å; R283-A287 PolarHBondContact O-N 2.98Å; R283-A287 VanDerWaalsContact O-N 3.12Å
284F97.7Very high97.7Very high32 Ų3258.9 Ų58.914%0.1428%0.278CS..Hα-helixtrans-63.2-42.8-167-58.2-60.7000114.9I279 Q282 E286 A287 V288 A315 Q318 A319I279-F284 HydrophobicContact CG2-CE1 4.31Å; Q282-F284 VanDerWaalsContact C-N 3.33Å; Q282-F284 HydrophobicContact CB-CE2 3.97Å; Q282-F284 HydrophobicContact CB-CZ 3.96Å; Q282-F284 HydrophobicContact CG-CZ 4.21Å; Q282-F284 WeakPolarHBondContact O-CD2 3.24Å; Q282-F284 PolarHBondContact O-N 3.43Å; F284-E286 VanDerWaalsContact C-N 3.3Å; F284-E286 PolarHBondContact O-N 3.44Å; F284-A287 WeakPolarHBondContact O-CA 3.32Å; F284-A287 WeakPolarHBondContact O-CB 3.38Å; F284-A287 PolarHBondContact O-N 3.02Å; F284-A287 VanDerWaalsContact O-N 3.1Å; F284-V288 WeakPolarHBondContact O-CG2 3.33Å; F284-V288 PolarHBondContact O-N 2.96Å; F284-A315 HydrophobicContact CB-CB 4.22Å; F284-A315 WeakPolarHBondContact CB-O 3.31Å; F284-A315 HydrophobicContact CD1-CB 4.23Å; F284-A315 WeakPolarHBondContact CG-O 3.45Å; F284-Q318 HydrophobicContact CD1-CB 4.09Å; F284-Q318 HydrophobicContact CD2-CB 4.38Å; F284-Q318 HydrophobicContact CE1-CB 3.57Å; F284-Q318 HydrophobicContact CE1-CG 4.34Å; F284-Q318 HydrophobicContact CE2-CB 3.89Å; F284-Q318 HydrophobicContact CG-CB 4.47Å; F284-Q318 HydrophobicContact CZ-CB 3.46Å; F284-Q318 VanDerWaalsContact CZ-CB 3.46Å; F284-Q318 HydrophobicContact CZ-CG 4.43Å; F284-A319 HydrophobicContact CB-CB 3.78Å; F284-A319 HydrophobicContact CD2-CB 3.87Å; F284-A319 HydrophobicContact CG-CB 4.1Å
285E96.3Very high97.6Very high76 Ų7659.5 Ų59.536%0.35528%0.278SS..Hα-helixtrans-65.1-34.5-180-75.4-76.1-157.700113R283 V288 S289 Q321 R324R283-E285 PolarHBondContact O-N 3.48Å; E285-V288 PolarHBondContact O-N 3.31Å; E285-S289 PolarHBondContact O-N 3.09Å; E285-S289 PolarHBondContact O-OG 2.94Å; E285-Q321 PolarHBondContact OE1-NE2 3.47Å; E285-Q321 PolarHBondContact OE1-OE1 3.41Å; E285-R324 IonicContact OE1-CZ 2.8Å; E285-R324 IonicContact OE1-NH1 3.08Å; E285-R324 PolarHBondContact OE1-NH1 3.33Å; E285-R324 IonicContact OE1-NH2 3.2Å; E285-R324 IonicContact OE2-CZ 2.79Å; E285-R324 IonicContact OE2-NH1 3.89Å; E285-R324 IonicContact OE2-NH2 3.87Å; E285-R324 PolarHBondContact OE2-NH2 2.71Å
286E97.7Very high97.5Very high91 Ų9167.1 Ų67.143%0.42531%0.311SS..Hα-helixtrans-69.4-37.9173.4-64.9-173.4-11500110.9L278 R283 F284 S289 K290L278-E286 HydrophobicContact CD1-CB 3.94Å; L278-E286 HydrophobicContact CD2-CB 4.17Å; R283-E286 IonicContact CZ-OE1 3.37Å; R283-E286 IonicContact CZ-OE2 3.77Å; R283-E286 IonicContact NE-OE1 3.95Å; R283-E286 PolarHBondContact NE-OE1 3.29Å; R283-E286 IonicContact NE-OE2 2.9Å; R283-E286 IonicContact NH2-OE1 3.66Å; R283-E286 PolarHBondContact NH2-OE1 3.45Å; R283-E286 IonicContact NH2-OE2 3.73Å; R283-E286 PolarHBondContact NH2-OE2 3.19Å; R283-E286 PolarHBondContact O-N 2.92Å; F284-E286 VanDerWaalsContact C-N 3.3Å; F284-E286 PolarHBondContact O-N 3.44Å; E286-S289 WeakPolarHBondContact O-CB 3.5Å; E286-S289 PolarHBondContact O-N 3.27Å; E286-K290 WeakPolarHBondContact O-CG 3.27Å; E286-K290 PolarHBondContact O-N 3.48Å
287A98.1Very high97.4Very high0 Ų065.5 Ų65.50%031%0.305CS..Hα-helixtrans-62.8-43.2173.800000112.1L278 I279 R283 F284 S289 K290 Y291L278-A287 HydrophobicContact CB-CB 3.88Å; I279-A287 HydrophobicContact CD1-CB 4.38Å; I279-A287 HydrophobicContact CG1-CB 3.63Å; R283-A287 PolarHBondContact O-N 2.98Å; R283-A287 VanDerWaalsContact O-N 3.12Å; F284-A287 WeakPolarHBondContact O-CA 3.32Å; F284-A287 WeakPolarHBondContact O-CB 3.38Å; F284-A287 PolarHBondContact O-N 3.02Å; F284-A287 VanDerWaalsContact O-N 3.1Å; A287-S289 VanDerWaalsContact C-N 3.34Å; A287-S289 PolarHBondContact O-N 3.19Å; A287-K290 WeakPolarHBondContact O-CB 3.3Å; A287-K290 PolarHBondContact O-N 2.92Å; A287-K290 VanDerWaalsContact O-N 3.12Å; A287-Y291 PolarHBondContact O-N 3.05Å
288V97.8Very high97.3Very high3 Ų361.5 Ų61.52%0.01829%0.287CS..Hα-helixtrans-56.6-49.4173.9171.10000110.3F284 E285 K290 Y291 E292 I312 A315 L316F284-V288 WeakPolarHBondContact O-CG2 3.33Å; F284-V288 PolarHBondContact O-N 2.96Å; E285-V288 PolarHBondContact O-N 3.31Å; V288-K290 VanDerWaalsContact C-N 3.25Å; V288-K290 PolarHBondContact O-N 3.31Å; V288-Y291 PolarHBondContact O-N 3.15Å; V288-Y291 VanDerWaalsContact O-N 3.11Å; V288-E292 WeakPolarHBondContact O-CG 3.29Å; V288-E292 PolarHBondContact O-N 3.09Å; V288-I312 HydrophobicContact CG1-CG1 4.31Å; V288-I312 HydrophobicContact CG1-CG2 4.11Å; V288-I312 HydrophobicContact CG2-CG2 4.28Å; V288-A315 HydrophobicContact CG2-CB 3.9Å; V288-L316 HydrophobicContact CG2-CD2 4.11Å; V288-L316 HydrophobicContact CG2-CG 4.07Å
289S97.7Very high97.1Very high71 Ų7164.9 Ų64.950%0.49731%0.309SS..Hα-helixtrans-59-35.3177.5-60.50000112.8E285 E286 A287 A293E285-S289 PolarHBondContact O-N 3.09Å; E285-S289 PolarHBondContact O-OG 2.94Å; E286-S289 WeakPolarHBondContact O-CB 3.5Å; E286-S289 PolarHBondContact O-N 3.27Å; A287-S289 VanDerWaalsContact C-N 3.34Å; A287-S289 PolarHBondContact O-N 3.19Å; S289-A293 PolarHBondContact O-N 2.86Å
290K98Very high97Very high86 Ų8670.6 Ų70.637%0.37434%0.34SS..Hα-helixtrans-69.5-43.5174.8-69.3-66.5-177.6-179.60111.9A275 L278 E286 A287 V288 A293 V294A275-K290 HydrophobicContact CB-CB 3.69Å; L278-K290 HydrophobicContact CD1-CG 3.75Å; E286-K290 WeakPolarHBondContact O-CG 3.27Å; E286-K290 PolarHBondContact O-N 3.48Å; A287-K290 WeakPolarHBondContact O-CB 3.3Å; A287-K290 PolarHBondContact O-N 2.92Å; A287-K290 VanDerWaalsContact O-N 3.12Å; V288-K290 VanDerWaalsContact C-N 3.25Å; V288-K290 PolarHBondContact O-N 3.31Å; K290-A293 CarbonylContact O-C 3.51Å; K290-A293 WeakPolarHBondContact O-CA 2.76Å; K290-A293 WeakPolarHBondContact O-CB 3.42Å; K290-A293 PolarHBondContact O-N 3.29Å; K290-A293 VanDerWaalsContact O-N 3.08Å; K290-V294 WeakPolarHBondContact O-CG2 3.45Å; K290-V294 PolarHBondContact O-N 3.07Å
291Y98.1Very high96.9Very high2 Ų262.2 Ų62.21%0.00831%0.31CS..Hα-helixtrans-67.5-35.4178.6-86.3-58.3000113.2I272 A275 E276 I279 A287 V288 A293 V294 M295 A308 R311 I312I272-Y291 HydrophobicContact CG1-CE1 4.46Å; I272-Y291 HydrophobicContact CG2-CE1 4.35Å; A275-Y291 HydrophobicContact CB-CD1 4.44Å; A275-Y291 HydrophobicContact CB-CD2 3.68Å; A275-Y291 HydrophobicContact CB-CE1 4.18Å; A275-Y291 HydrophobicContact CB-CE2 3.39Å; A275-Y291 HydrophobicContact CB-CG 4.19Å; E276-Y291 VanDerWaalsContact CD-OH 3.32Å; E276-Y291 WeakPolarHBondContact CG-OH 3.48Å; E276-Y291 PolarHBondContact OE1-OH 3.24Å; I279-Y291 HydrophobicContact CD1-CE2 3.96Å; A287-Y291 PolarHBondContact O-N 3.05Å; V288-Y291 PolarHBondContact O-N 3.15Å; V288-Y291 VanDerWaalsContact O-N 3.11Å; Y291-A293 PolarHBondContact O-N 2.89Å; Y291-V294 HydrophobicContact CD1-CB 4.43Å; Y291-V294 HydrophobicContact CD1-CG2 4.22Å; Y291-V294 WeakPolarHBondContact O-CB 3.41Å; Y291-V294 PolarHBondContact O-N 3.47Å; Y291-V294 VanDerWaalsContact O-N 3.11Å; Y291-M295 PolarHBondContact O-N 3.06Å; Y291-M295 VanDerWaalsContact O-N 3.12Å; Y291-A308 HydrophobicContact CD1-CB 3.87Å; Y291-A308 HydrophobicContact CG-CB 4.42Å; Y291-R311 HydrophobicContact CD1-CB 4.48Å; Y291-R311 HydrophobicContact CD2-CB 3.76Å; Y291-R311 HydrophobicContact CE1-CB 4.17Å; Y291-R311 HydrophobicContact CE1-CG 4.31Å; Y291-R311 HydrophobicContact CE2-CB 3.35Å; Y291-R311 HydrophobicContact CE2-CG 4.04Å; Y291-R311 HydrophobicContact CG-CB 4.32Å; Y291-I312 HydrophobicContact CG-CG1 4.45Å
292E97.1Very high96.7Very high87 Ų8761.9 Ų61.941%0.40732%0.316SS..Hα-helixtrans-60.4-36.8168.5-70.6-179177.700111.9V288 M295 K296 I312V288-E292 WeakPolarHBondContact O-CG 3.29Å; V288-E292 PolarHBondContact O-N 3.09Å; E292-M295 PolarHBondContact O-N 2.98Å; E292-K296 WeakPolarHBondContact O-CG 3.26Å; E292-K296 PolarHBondContact O-N 3.39Å; E292-K296 VanDerWaalsContact O-N 3.14Å; E292-I312 HydrophobicContact CG-CD1 4.18Å
293A97.1Very high96.6Very high30 Ų3058.7 Ų58.725%0.24830%0.301CS..Hα-helixtrans-71.5-28.3175.500000113.1S289 K290 Y291 K296 T297S289-A293 PolarHBondContact O-N 2.86Å; K290-A293 CarbonylContact O-C 3.51Å; K290-A293 WeakPolarHBondContact O-CA 2.76Å; K290-A293 WeakPolarHBondContact O-CB 3.42Å; K290-A293 PolarHBondContact O-N 3.29Å; K290-A293 VanDerWaalsContact O-N 3.08Å; Y291-A293 PolarHBondContact O-N 2.89Å; A293-K296 PolarHBondContact O-N 3.46Å; A293-T297 WeakPolarHBondContact O-CB 3.39Å; A293-T297 PolarHBondContact O-N 3.16Å; A293-T297 PolarHBondContact O-OG1 2.93Å
294V97.7Very high96.6Very high1 Ų153.6 Ų53.61%0.00628%0.282CS..Hα-helixtrans-61.9-50.8170.9170.10000109.3L268 Q271 I272 K290 Y291 K296 T297 E298L268-V294 HydrophobicContact CD1-CB 4.45Å; L268-V294 HydrophobicContact CD1-CG1 3.76Å; Q271-V294 HydrophobicContact CB-CG2 3.66Å; I272-V294 HydrophobicContact CD1-CG1 4.22Å; I272-V294 HydrophobicContact CG1-CG1 4.01Å; I272-V294 HydrophobicContact CG1-CG2 3.74Å; K290-V294 WeakPolarHBondContact O-CG2 3.45Å; K290-V294 PolarHBondContact O-N 3.07Å; Y291-V294 HydrophobicContact CD1-CB 4.43Å; Y291-V294 HydrophobicContact CD1-CG2 4.22Å; Y291-V294 WeakPolarHBondContact O-CB 3.41Å; Y291-V294 PolarHBondContact O-N 3.47Å; Y291-V294 VanDerWaalsContact O-N 3.11Å; V294-K296 VanDerWaalsContact C-N 3.28Å; V294-K296 PolarHBondContact O-N 3.16Å; V294-T297 PolarHBondContact O-N 3.3Å; V294-E298 PolarHBondContact O-N 3.35Å
295M96.3Very high96.5Very high49 Ų4953.3 Ų53.324%0.24128%0.283CS..Hα-helixtrans-60.6-35.1178.1-63.6173.565.400113Y291 E292 E298 A308 K309 I312Y291-M295 PolarHBondContact O-N 3.06Å; Y291-M295 VanDerWaalsContact O-N 3.12Å; E292-M295 PolarHBondContact O-N 2.98Å; M295-E298 CarbonylContact O-C 3.26Å; M295-A308 HydrophobicContact CG-CB 3.44Å; M295-A308 VanDerWaalsContact CG-CB 3.44Å; M295-A308 HydrophobicContact SD-CB 3.84Å; M295-K309 HydrophobicContact CE-CG 4.12Å; M295-K309 HydrophobicContact SD-CG 4.24Å; M295-I312 HydrophobicContact SD-CD1 4.4Å
296K96.2Very high96.4Very high160 Ų16052 Ų5270%0.69629%0.285SS*.Hα-helixtrans-71.6-31.1173.9-69.7170.6-171.9168.20112.9E292 A293 V294E292-K296 WeakPolarHBondContact O-CG 3.26Å; E292-K296 PolarHBondContact O-N 3.39Å; E292-K296 VanDerWaalsContact O-N 3.14Å; A293-K296 PolarHBondContact O-N 3.46Å; V294-K296 VanDerWaalsContact C-N 3.28Å; V294-K296 PolarHBondContact O-N 3.16Å
297T95.7Very high96.3Very high22 Ų2250.1 Ų50.114%0.13528%0.278CS..Hα-helixtrans-79.8-34.2-178.4-59.50000111.4Q264 K267 L268 Q271 A293 V294Q264-T297 PolarHBondContact NE2-O 3.1Å; K267-T297 HydrophobicContact CD-CG2 3.91Å; K267-T297 HydrophobicContact CG-CG2 4.31Å; L268-T297 HydrophobicContact CD1-CG2 4.2Å; Q271-T297 PolarHBondContact NE2-OG1 3.23Å; Q271-T297 VanDerWaalsContact NE2-OG1 3.09Å; Q271-T297 PolarHBondContact OE1-OG1 3.11Å; A293-T297 WeakPolarHBondContact O-CB 3.39Å; A293-T297 PolarHBondContact O-N 3.16Å; A293-T297 PolarHBondContact O-OG1 2.93Å; V294-T297 PolarHBondContact O-N 3.3Å
298E95.9Very high96.3Very high14 Ų1450.1 Ų50.17%0.06528%0.278CS..  trans-132.589.2173.5-173.751.9-10500111.8Y233 Q264 L268 V294 M295 N300 V301 F304Y233-E298 HydrophobicContact CE1-CG 4.24Å; Y233-E298 VanDerWaalsContact OH-CD 3.28Å; Y233-E298 WeakPolarHBondContact OH-CG 3.48Å; Y233-E298 PolarHBondContact OH-OE2 3.16Å; Q264-E298 PolarHBondContact NE2-OE2 3.21Å; Q264-E298 VanDerWaalsContact NE2-OE2 3.13Å; L268-E298 HydrophobicContact CD1-CB 3.94Å; L268-E298 HydrophobicContact CD2-CB 4.16Å; V294-E298 PolarHBondContact O-N 3.35Å; M295-E298 CarbonylContact O-C 3.26Å; E298-N300 WeakPolarHBondContact OE1-CB 3.38Å; E298-N300 PolarHBondContact OE1-N 2.96Å; E298-N300 PolarHBondContact OE1-ND2 3.35Å; E298-V301 HydrophobicContact CG-CB 3.96Å; E298-V301 HydrophobicContact CG-CG2 4.1Å; E298-F304 HydrophobicContact CB-CD2 4.23Å; E298-F304 HydrophobicContact CG-CD2 3.66Å; E298-F304 HydrophobicContact CG-CE2 4.3Å
299P95.8Very high96.2Very high82 Ų8252.6 Ų52.653%0.53229%0.289SS..  trans-87.1-14.3177.933.6-34.9000113.7
300N94.8Very high96.2Very high134 Ų13450.8 Ų50.872%0.71727%0.272SS*.SBendtrans-91.8-21.5-168.2-53.3-64.7000113.4E298 P302E298-N300 WeakPolarHBondContact OE1-CB 3.38Å; E298-N300 PolarHBondContact OE1-N 2.96Å; E298-N300 PolarHBondContact OE1-ND2 3.35Å; N300-P302 WeakPolarHBondContact O-CD 3.29Å
301V95.3Very high96.2Very high13 Ų1348.9 Ų48.98%0.07926%0.263CS..  trans-100.6108.6-179.5177.30000108.8Y233 E298 Q303 F304Y233-V301 HydrophobicContact CD1-CG2 4.08Å; Y233-V301 HydrophobicContact CE1-CG2 3.78Å; E298-V301 HydrophobicContact CG-CB 3.96Å; E298-V301 HydrophobicContact CG-CG2 4.1Å; V301-Q303 HydrophobicContact CG1-CB 4.16Å; V301-Q303 VanDerWaalsContact CG1-OE1 3.22Å; V301-Q303 PolarHBondContact O-N 3.47Å; V301-Q303 VanDerWaalsContact O-N 3.14Å; V301-F304 HydrophobicContact CB-CD2 3.81Å; V301-F304 HydrophobicContact CB-CE2 4.29Å; V301-F304 HydrophobicContact CG1-CD2 3.73Å; V301-F304 HydrophobicContact CG1-CE2 3.98Å; V301-F304 PolarHBondContact O-N 3.2Å
302P94.3Very high96.2Very high90 Ų9049.7 Ų49.758%0.58427%0.267SS*.Hα-helixtrans-57.2-32.1-174.9-27.135.5000113.9N300 F304 S305 A306N300-P302 WeakPolarHBondContact O-CD 3.29Å; P302-F304 VanDerWaalsContact C-N 3.32Å; P302-F304 PolarHBondContact O-N 2.98Å; P302-S305 WeakPolarHBondContact O-CB 3.48Å; P302-S305 PolarHBondContact O-N 3.22Å; P302-S305 VanDerWaalsContact O-N 3.09Å; P302-A306 PolarHBondContact O-N 2.9Å
303Q94.4Very high96.3Very high83 Ų8345.5 Ų45.539%0.38825%0.248SC..Hα-helixtrans-59.6-40.1-177.5-68.572.21400111.8N234 V301 L307N234-Q303 WeakPolarHBondContact O-CG 3.36Å; N234-Q303 PolarHBondContact O-OE1 3.4Å; N234-Q303 VanDerWaalsContact O-OE1 3.05Å; V301-Q303 HydrophobicContact CG1-CB 4.16Å; V301-Q303 VanDerWaalsContact CG1-OE1 3.22Å; V301-Q303 PolarHBondContact O-N 3.47Å; V301-Q303 VanDerWaalsContact O-N 3.14Å; Q303-L307 VanDerWaalsContact O-CB 3.32Å; Q303-L307 WeakPolarHBondContact O-CB 3.35Å; Q303-L307 PolarHBondContact O-N 3.46Å
304F96.4Very high96.3Very high0 Ų046 Ų460%025%0.245CC..Hα-helixtrans-72.4-32.7176.6-68-59.4000112.7Y233 G236 H238 L268 I272 E298 V301 P302 A308Y233-F304 HydrophobicContact CD1-CE2 4.2Å; Y233-F304 AromaticContact CD2-CE2 3.87Å; Y233-F304 HydrophobicContact CD2-CE2 3.87Å; Y233-F304 AromaticContact CD2-CZ 3.93Å; Y233-F304 HydrophobicContact CD2-CZ 3.93Å; Y233-F304 AromaticContact CE1-CE2 3.99Å; Y233-F304 HydrophobicContact CE1-CE2 3.99Å; Y233-F304 AromaticContact CE2-CE2 3.65Å; Y233-F304 HydrophobicContact CE2-CE2 3.65Å; Y233-F304 AromaticContact CE2-CZ 3.93Å; Y233-F304 HydrophobicContact CE2-CZ 3.93Å; Y233-F304 HydrophobicContact CG-CE2 4.17Å; Y233-F304 HydrophobicContact CG-CZ 4.48Å; Y233-F304 AromaticContact CZ-CE2 3.72Å; Y233-F304 VanDerWaalsContact O-CE2 3.29Å; Y233-F304 WeakPolarHBondContact O-CE2 3.11Å; Y233-F304 WeakPolarHBondContact O-CZ 3.46Å; G236-F304 WeakPolarHBondContact O-CE1 2.97Å; H238-F304 HydrophobicContact CB-CE1 3.88Å; H238-F304 HydrophobicContact CB-CZ 4.12Å; L268-F304 HydrophobicContact CD2-CD1 3.82Å; L268-F304 HydrophobicContact CD2-CD2 3.72Å; L268-F304 HydrophobicContact CD2-CE1 3.63Å; L268-F304 HydrophobicContact CD2-CE2 3.53Å; L268-F304 HydrophobicContact CD2-CG 3.87Å; L268-F304 HydrophobicContact CD2-CZ 3.49Å; L268-F304 VanDerWaalsContact CD2-CZ 3.49Å; I272-F304 HydrophobicContact CD1-CD1 4.08Å; I272-F304 HydrophobicContact CD1-CE1 4.22Å; E298-F304 HydrophobicContact CB-CD2 4.23Å; E298-F304 HydrophobicContact CG-CD2 3.66Å; E298-F304 HydrophobicContact CG-CE2 4.3Å; V301-F304 HydrophobicContact CB-CD2 3.81Å; V301-F304 HydrophobicContact CB-CE2 4.29Å; V301-F304 HydrophobicContact CG1-CD2 3.73Å; V301-F304 HydrophobicContact CG1-CE2 3.98Å; V301-F304 PolarHBondContact O-N 3.2Å; P302-F304 VanDerWaalsContact C-N 3.32Å; P302-F304 PolarHBondContact O-N 2.98Å; F304-A308 VanDerWaalsContact O-CB 3.25Å; F304-A308 WeakPolarHBondContact O-CB 3.32Å; F304-A308 PolarHBondContact O-N 3.35Å
305S95.4Very high96.3Very high25 Ų2546 Ų4618%0.17524%0.244CC..Hα-helixtrans-69.4-42.2174.4-69.60000111.7P302 A308 K309P302-S305 WeakPolarHBondContact O-CB 3.48Å; P302-S305 PolarHBondContact O-N 3.22Å; P302-S305 VanDerWaalsContact O-N 3.09Å; S305-A308 PolarHBondContact O-N 3.2Å; S305-K309 VanDerWaalsContact O-CG 3.29Å; S305-K309 WeakPolarHBondContact O-CG 3.45Å; S305-K309 PolarHBondContact O-N 3Å
306A95Very high96.3Very high48 Ų4844 Ų4440%0.39724%0.235SC..Hα-helixtrans-61.8-50.1175.200000111.1P302 A308 K309 E310P302-A306 PolarHBondContact O-N 2.9Å; A306-A308 PolarHBondContact O-N 2.86Å; A306-K309 PolarHBondContact O-N 3.38Å; A306-E310 PolarHBondContact O-N 3.39Å
307L95.8Very high96.3Very high53 Ų5336.3 Ų36.328%0.27720%0.202SC..Hα-helixtrans-54.8-50.6175.1176.465.9000111.4I272 Q303 K309 E310 R311I272-L307 HydrophobicContact CD1-CD2 4.36Å; Q303-L307 VanDerWaalsContact O-CB 3.32Å; Q303-L307 WeakPolarHBondContact O-CB 3.35Å; Q303-L307 PolarHBondContact O-N 3.46Å; L307-K309 PolarHBondContact O-N 2.94Å; L307-E310 PolarHBondContact O-N 3.2Å; L307-R311 HydrophobicContact CD1-CG 4.06Å; L307-R311 VanDerWaalsContact O-CG 3.31Å; L307-R311 WeakPolarHBondContact O-CG 3.48Å; L307-R311 PolarHBondContact O-N 2.89Å
308A97.3Very high96.3Very high0 Ų038.7 Ų38.70%021%0.211CC..Hα-helixtrans-61.1-42.5-178.700000112.3Y291 M295 F304 S305 A306 R311 I312Y291-A308 HydrophobicContact CD1-CB 3.87Å; Y291-A308 HydrophobicContact CG-CB 4.42Å; M295-A308 HydrophobicContact CG-CB 3.44Å; M295-A308 VanDerWaalsContact CG-CB 3.44Å; M295-A308 HydrophobicContact SD-CB 3.84Å; F304-A308 VanDerWaalsContact O-CB 3.25Å; F304-A308 WeakPolarHBondContact O-CB 3.32Å; F304-A308 PolarHBondContact O-N 3.35Å; S305-A308 PolarHBondContact O-N 3.2Å; A306-A308 PolarHBondContact O-N 2.86Å; A308-R311 PolarHBondContact O-N 3.3Å; A308-I312 WeakPolarHBondContact O-CB 3.47Å; A308-I312 WeakPolarHBondContact O-CD1 3.43Å; A308-I312 WeakPolarHBondContact O-CG1 3.28Å; A308-I312 PolarHBondContact O-N 3.07Å
309K97.2Very high96.3Very high55 Ų5539.5 Ų39.524%0.23922%0.22CC..Hα-helixtrans-65.7-42.5178.1-70.5177.8-172.5-173.50112.3M295 S305 A306 L307 I312 C313 E331 V332M295-K309 HydrophobicContact CE-CG 4.12Å; M295-K309 HydrophobicContact SD-CG 4.24Å; S305-K309 VanDerWaalsContact O-CG 3.29Å; S305-K309 WeakPolarHBondContact O-CG 3.45Å; S305-K309 PolarHBondContact O-N 3Å; A306-K309 PolarHBondContact O-N 3.38Å; L307-K309 PolarHBondContact O-N 2.94Å; K309-I312 PolarHBondContact O-N 3.26Å; K309-C313 WeakPolarHBondContact O-CB 3.5Å; K309-C313 PolarHBondContact O-N 2.95Å; K309-E331 HydrophobicContact CD-CG 4.39Å; K309-E331 WeakPolarHBondContact CE-OE1 3.31Å; K309-E331 IonicContact NZ-OE1 3.55Å; K309-E331 PolarHBondContact NZ-OE1 3.4Å; K309-V332 HydrophobicContact CB-CG2 3.65Å
310E97.6Very high96.1Very high33 Ų3343 Ų4315%0.15423%0.229CC..Hα-helixtrans-58.6-48.4174.6-174.2-173.5143.100110.8A306 L307 I312 C313 H314 V332 N339 N341A306-E310 PolarHBondContact O-N 3.39Å; L307-E310 PolarHBondContact O-N 3.2Å; E310-I312 PolarHBondContact O-N 3.39Å; E310-C313 WeakPolarHBondContact O-CB 3.25Å; E310-C313 PolarHBondContact O-N 3.15Å; E310-H314 PolarHBondContact O-N 3.44Å; E310-V332 HydrophobicContact CB-CG1 4.47Å; E310-N339 PolarHBondContact OE2-ND2 3.38Å; E310-N339 VanDerWaalsContact OE2-ND2 3.08Å; E310-N341 WeakPolarHBondContact OE1-CB 3.44Å; E310-N341 PolarHBondContact OE1-ND2 2.92Å
311R98Very high96Very high45 Ų4539 Ų3917%0.1721%0.207CC..Hα-helixtrans-70.4-29.7-179.7-58.5-53.7-68.1156.5-3.3113.4E276 Y291 L307 A308 H314 A315E276-R311 IonicContact OE1-CZ 2.8Å; E276-R311 IonicContact OE1-NE 2.7Å; E276-R311 PolarHBondContact OE1-NE 3.45Å; E276-R311 IonicContact OE1-NH2 3.36Å; E276-R311 PolarHBondContact OE1-NH2 3.22Å; E276-R311 IonicContact OE2-CZ 3.74Å; E276-R311 IonicContact OE2-NE 2.71Å; E276-R311 IonicContact OE2-NH2 3.36Å; E276-R311 PolarHBondContact OE2-NH2 2.91Å; Y291-R311 HydrophobicContact CD1-CB 4.48Å; Y291-R311 HydrophobicContact CD2-CB 3.76Å; Y291-R311 HydrophobicContact CE1-CB 4.17Å; Y291-R311 HydrophobicContact CE1-CG 4.31Å; Y291-R311 HydrophobicContact CE2-CB 3.35Å; Y291-R311 HydrophobicContact CE2-CG 4.04Å; Y291-R311 HydrophobicContact CG-CB 4.32Å; L307-R311 HydrophobicContact CD1-CG 4.06Å; L307-R311 VanDerWaalsContact O-CG 3.31Å; L307-R311 WeakPolarHBondContact O-CG 3.48Å; L307-R311 PolarHBondContact O-N 2.89Å; A308-R311 PolarHBondContact O-N 3.3Å; R311-H314 PolarHBondContact NH1-CD2 2.96Å; R311-A315 WeakPolarHBondContact O-CB 3.4Å; R311-A315 PolarHBondContact O-N 2.72Å
312I98.1Very high95.7Very high19 Ų1938.6 Ų38.610%0.09720%0.204CC..Hα-helixtrans-66.4-46.1170.7-73.1164.6000110.7V288 Y291 E292 M295 A308 K309 E310 H314 A315 L316 A328V288-I312 HydrophobicContact CG1-CG1 4.31Å; V288-I312 HydrophobicContact CG1-CG2 4.11Å; V288-I312 HydrophobicContact CG2-CG2 4.28Å; Y291-I312 HydrophobicContact CG-CG1 4.45Å; E292-I312 HydrophobicContact CG-CD1 4.18Å; M295-I312 HydrophobicContact SD-CD1 4.4Å; A308-I312 WeakPolarHBondContact O-CB 3.47Å; A308-I312 WeakPolarHBondContact O-CD1 3.43Å; A308-I312 WeakPolarHBondContact O-CG1 3.28Å; A308-I312 PolarHBondContact O-N 3.07Å; K309-I312 PolarHBondContact O-N 3.26Å; E310-I312 PolarHBondContact O-N 3.39Å; I312-H314 VanDerWaalsContact C-N 3.31Å; I312-H314 PolarHBondContact O-N 3.49Å; I312-A315 PolarHBondContact O-N 3.1Å; I312-L316 HydrophobicContact CG2-CD1 3.69Å; I312-L316 HydrophobicContact CG2-CG 4.3Å; I312-L316 WeakPolarHBondContact O-CB 3.4Å; I312-L316 VanDerWaalsContact O-CG 3.29Å; I312-L316 WeakPolarHBondContact O-CG 3.48Å; I312-L316 PolarHBondContact O-N 3.39Å; I312-A328 HydrophobicContact CG2-CB 4.34Å
313C97.4Very high95.6Very high0 Ų036.8 Ų36.80%020%0.202CC..Hα-helixtrans-53.2-50.6173.4154.20000110.7K309 E310 L316 S317 A328 C329K309-C313 WeakPolarHBondContact O-CB 3.5Å; K309-C313 PolarHBondContact O-N 2.95Å; E310-C313 WeakPolarHBondContact O-CB 3.25Å; E310-C313 PolarHBondContact O-N 3.15Å; C313-L316 PolarHBondContact O-N 3.33Å; C313-S317 PolarHBondContact O-N 3.22Å; C313-A328 HydrophobicContact CB-CB 4.32Å; C313-C329 HydrophobicContact CB-CB 3.93Å; C313-C329 WeakPolarHBondContact CB-SG 3.49Å; C313-C329 WeakPolarHBondContact SG-CA 3.24Å; C313-C329 WeakPolarHBondContact SG-CB 3.26Å; C313-C329 CovalentContact SG-SG 2.02Å; C313-C329 PolarHBondContact SG-SG 3.01Å
314H97.7Very high95.6Very high40 Ų4038.3 Ų38.319%0.18521%0.205CC..Hα-helixtrans-57.2-52.8176.3-17864.9000112.7E310 R311 I312 L316 S317 Q318 D345E310-H314 PolarHBondContact O-N 3.44Å; R311-H314 PolarHBondContact NH1-CD2 2.96Å; I312-H314 VanDerWaalsContact C-N 3.31Å; I312-H314 PolarHBondContact O-N 3.49Å; H314-L316 VanDerWaalsContact C-N 3.31Å; H314-L316 PolarHBondContact O-N 2.96Å; H314-S317 PolarHBondContact O-N 2.85Å; H314-Q318 WeakPolarHBondContact O-CG 3.31Å; H314-Q318 PolarHBondContact O-N 3.35Å; H314-D345 VanDerWaalsContact CA-OD2 3.24Å; H314-D345 WeakPolarHBondContact CA-OD2 3.47Å; H314-D345 WeakPolarHBondContact CB-OD2 3.48Å; H314-D345 IonicContact CE1-OD1 3.26Å; H314-D345 IonicContact CG-OD1 3.88Å; H314-D345 IonicContact CG-OD2 3.8Å; H314-D345 IonicContact ND1-OD1 3.56Å; H314-D345 PolarHBondContact ND1-OD1 3.31Å; H314-D345 IonicContact ND1-OD2 3.67Å; H314-D345 PolarHBondContact ND1-OD2 3.09Å
315A97.8Very high95.6Very high0 Ų038.3 Ų38.30%021%0.205CC..Hα-helixtrans-60.3-39.6-178.600000112.4I279 F284 V288 R311 I312 A319I279-A315 HydrophobicContact CG1-CB 4.5Å; F284-A315 HydrophobicContact CB-CB 4.22Å; F284-A315 WeakPolarHBondContact CB-O 3.31Å; F284-A315 HydrophobicContact CD1-CB 4.23Å; F284-A315 WeakPolarHBondContact CG-O 3.45Å; V288-A315 HydrophobicContact CG2-CB 3.9Å; R311-A315 WeakPolarHBondContact O-CB 3.4Å; R311-A315 PolarHBondContact O-N 2.72Å; I312-A315 PolarHBondContact O-N 3.1Å; A315-A319 VanDerWaalsContact O-CB 3.27Å; A315-A319 WeakPolarHBondContact O-CB 3.39Å; A315-A319 PolarHBondContact O-N 3.36Å
316L96.9Very high95.6Very high7 Ų738.2 Ų38.24%0.03720%0.203CC..Hα-helixtrans-69.3-37.7178.1-70.5169.6000112.6V288 I312 C313 H314 A319 Q320 Q321 R324 A325 A328V288-L316 HydrophobicContact CG2-CD2 4.11Å; V288-L316 HydrophobicContact CG2-CG 4.07Å; I312-L316 HydrophobicContact CG2-CD1 3.69Å; I312-L316 HydrophobicContact CG2-CG 4.3Å; I312-L316 WeakPolarHBondContact O-CB 3.4Å; I312-L316 VanDerWaalsContact O-CG 3.29Å; I312-L316 WeakPolarHBondContact O-CG 3.48Å; I312-L316 PolarHBondContact O-N 3.39Å; C313-L316 PolarHBondContact O-N 3.33Å; H314-L316 VanDerWaalsContact C-N 3.31Å; H314-L316 PolarHBondContact O-N 2.96Å; L316-A319 PolarHBondContact O-N 2.8Å; L316-Q320 PolarHBondContact O-N 2.92Å; L316-Q321 PolarHBondContact O-N 2.91Å; L316-Q321 VanDerWaalsContact O-N 3.12Å; L316-R324 HydrophobicContact CD1-CB 4.22Å; L316-R324 HydrophobicContact CD2-CB 4.29Å; L316-A325 HydrophobicContact CB-CB 3.84Å; L316-A328 HydrophobicContact CD1-CB 3.88Å
317S96.6Very high95.6Very high0 Ų039.9 Ų39.90%021%0.212CC..Hα-helixtrans-63.9-46.8176-172.50000111.1C313 H314 A319 Q320 D345 Q352C313-S317 PolarHBondContact O-N 3.22Å; H314-S317 PolarHBondContact O-N 2.85Å; S317-A319 VanDerWaalsContact C-N 3.28Å; S317-A319 PolarHBondContact O-N 3.13Å; S317-Q320 PolarHBondContact O-N 3.19Å; S317-D345 WeakPolarHBondContact CB-O 3.43Å; S317-D345 PolarHBondContact OG-O 3.05Å; S317-Q352 PolarHBondContact O-NE2 3.34Å
318Q95.5Very high95.7Very high71 Ų7138.1 Ų38.133%0.33221%0.205SC..Hα-helixtrans-66.4-28.2176.2-63.8-57.9-54.100113.2F284 H314 Q320 E348F284-Q318 HydrophobicContact CD1-CB 4.09Å; F284-Q318 HydrophobicContact CD2-CB 4.38Å; F284-Q318 HydrophobicContact CE1-CB 3.57Å; F284-Q318 HydrophobicContact CE1-CG 4.34Å; F284-Q318 HydrophobicContact CE2-CB 3.89Å; F284-Q318 HydrophobicContact CG-CB 4.47Å; F284-Q318 HydrophobicContact CZ-CB 3.46Å; F284-Q318 VanDerWaalsContact CZ-CB 3.46Å; F284-Q318 HydrophobicContact CZ-CG 4.43Å; H314-Q318 WeakPolarHBondContact O-CG 3.31Å; H314-Q318 PolarHBondContact O-N 3.35Å; Q318-Q320 PolarHBondContact O-N 3.15Å; Q318-E348 PolarHBondContact NE2-OE2 3.5Å
319A94.6Very high95.7Very high31 Ų3138.1 Ų38.126%0.25621%0.205SC..THydrogen-bonded Turntrans-74.71173.400000114.2F284 A315 L316 S317 Q321F284-A319 HydrophobicContact CB-CB 3.78Å; F284-A319 HydrophobicContact CD2-CB 3.87Å; F284-A319 HydrophobicContact CG-CB 4.1Å; A315-A319 VanDerWaalsContact O-CB 3.27Å; A315-A319 WeakPolarHBondContact O-CB 3.39Å; A315-A319 PolarHBondContact O-N 3.36Å; L316-A319 PolarHBondContact O-N 2.8Å; S317-A319 VanDerWaalsContact C-N 3.28Å; S317-A319 PolarHBondContact O-N 3.13Å; A319-Q321 VanDerWaalsContact C-N 3.31Å; A319-Q321 HydrophobicContact CB-CG 4.05Å; A319-Q321 PolarHBondContact O-N 3.08Å
320Q92.6Very high95.7Very high156 Ų15636.9 Ų36.973%0.72920%0.203SC*.THydrogen-bonded Turntrans59.636.5-175.7-57.2179.67.900113.8L316 S317 Q318 Q352L316-Q320 PolarHBondContact O-N 2.92Å; S317-Q320 PolarHBondContact O-N 3.19Å; Q318-Q320 PolarHBondContact O-N 3.15Å; Q320-Q352 VanDerWaalsContact CA-OE1 3.26Å
321Q92.4Very high95.6Very high51 Ų5139.6 Ų39.624%0.23822%0.215CC..  trans-104.564179.4-60.4-170.51900111.5E285 L316 A319 G323 R324 A325E285-Q321 PolarHBondContact OE1-NE2 3.47Å; E285-Q321 PolarHBondContact OE1-OE1 3.41Å; L316-Q321 PolarHBondContact O-N 2.91Å; L316-Q321 VanDerWaalsContact O-N 3.12Å; A319-Q321 VanDerWaalsContact C-N 3.31Å; A319-Q321 HydrophobicContact CB-CG 4.05Å; A319-Q321 PolarHBondContact O-N 3.08Å; Q321-G323 PolarHBondContact O-N 2.7Å; Q321-R324 HydrophobicContact CB-CB 4.35Å; Q321-R324 PolarHBondContact O-N 3.21Å; Q321-R324 VanDerWaalsContact O-N 3.07Å; Q321-R324 VanDerWaalsContact OE1-CZ 3.26Å; Q321-A325 WeakPolarHBondContact O-CB 3.28Å; Q321-A325 PolarHBondContact O-N 3.19Å
322G89.8Confident95.5Very high3 Ų337.7 Ų37.73%0.03121%0.209CC..Hα-helixtrans-38-66.4-172.700000114.5R324 A325 V326 D353G322-R324 PolarHBondContact O-N 3.41Å; G322-A325 WeakPolarHBondContact O-CB 3.33Å; G322-A325 PolarHBondContact O-N 2.65Å; G322-A325 VanDerWaalsContact O-N 3.1Å; G322-V326 WeakPolarHBondContact O-CG2 3.5Å; G322-V326 PolarHBondContact O-N 3.12Å; G322-D353 VanDerWaalsContact C-OD2 3.29Å; G322-D353 WeakPolarHBondContact CA-OD2 2.91Å
323G91.1Very high95.5Very high53 Ų5337.5 Ų37.555%0.54621%0.208SC..Hα-helixtrans-57.7-38-178.100000115.8Q321 S327 D353Q321-G323 PolarHBondContact O-N 2.7Å; G323-S327 PolarHBondContact O-N 3.33Å; G323-D353 PolarHBondContact N-OD2 3.21Å
324R94.3Very high95.4Very high115 Ų11545 Ų4543%0.43424%0.243SC..Hα-helixtrans-71.9-41.2175.9-79176.865.9-166.51.5111E285 L316 Q321 G322 S327 A328E285-R324 IonicContact OE1-CZ 2.8Å; E285-R324 IonicContact OE1-NH1 3.08Å; E285-R324 PolarHBondContact OE1-NH1 3.33Å; E285-R324 IonicContact OE1-NH2 3.2Å; E285-R324 IonicContact OE2-CZ 2.79Å; E285-R324 IonicContact OE2-NH1 3.89Å; E285-R324 IonicContact OE2-NH2 3.87Å; E285-R324 PolarHBondContact OE2-NH2 2.71Å; L316-R324 HydrophobicContact CD1-CB 4.22Å; L316-R324 HydrophobicContact CD2-CB 4.29Å; Q321-R324 HydrophobicContact CB-CB 4.35Å; Q321-R324 PolarHBondContact O-N 3.21Å; Q321-R324 VanDerWaalsContact O-N 3.07Å; Q321-R324 VanDerWaalsContact OE1-CZ 3.26Å; G322-R324 PolarHBondContact O-N 3.41Å; R324-S327 PolarHBondContact O-N 3.06Å; R324-A328 PolarHBondContact O-N 3.28Å
325A95.9Very high95.2Very high0 Ų047.3 Ų47.30%026%0.264CS..Hα-helixtrans-61.7-48.7177.300000111L316 Q321 G322 S327 A328 C329 A349L316-A325 HydrophobicContact CB-CB 3.84Å; Q321-A325 WeakPolarHBondContact O-CB 3.28Å; Q321-A325 PolarHBondContact O-N 3.19Å; G322-A325 WeakPolarHBondContact O-CB 3.33Å; G322-A325 PolarHBondContact O-N 2.65Å; G322-A325 VanDerWaalsContact O-N 3.1Å; A325-S327 VanDerWaalsContact C-N 3.3Å; A325-S327 PolarHBondContact O-N 3.48Å; A325-A328 PolarHBondContact O-N 2.86Å; A325-A328 VanDerWaalsContact O-N 3.16Å; A325-C329 WeakPolarHBondContact O-CB 3.4Å; A325-C329 PolarHBondContact O-N 2.91Å; A325-C329 PolarHBondContact O-SG 3.24Å; A325-A349 HydrophobicContact CB-CB 3.73Å
326V96.4Very high95Very high23 Ų2350.5 Ų50.514%0.13928%0.281CS..Hα-helixtrans-56-44.2177.6171.50000111.5G322 S330 R346 A349 Y350G322-V326 WeakPolarHBondContact O-CG2 3.5Å; G322-V326 PolarHBondContact O-N 3.12Å; V326-S330 WeakPolarHBondContact O-CB 3.38Å; V326-S330 PolarHBondContact O-N 3.05Å; V326-S330 PolarHBondContact O-OG 2.77Å; V326-R346 HydrophobicContact CG2-CG 4.38Å; V326-A349 HydrophobicContact CG2-CB 3.91Å; V326-Y350 HydrophobicContact CB-CE1 4.35Å; V326-Y350 HydrophobicContact CG1-CE1 3.67Å; V326-Y350 HydrophobicContact CG2-CD1 3.77Å; V326-Y350 HydrophobicContact CG2-CE1 3.65Å; V326-Y350 HydrophobicContact CG2-CG 4.45Å
327S95.8Very high94.9Very high83 Ų8354 Ų5458%0.5830%0.304SS*.Hα-helixtrans-63.2-48.4177.2-172.30000112.1G323 R324 A325 S330 E331G323-S327 PolarHBondContact O-N 3.33Å; R324-S327 PolarHBondContact O-N 3.06Å; A325-S327 VanDerWaalsContact C-N 3.3Å; A325-S327 PolarHBondContact O-N 3.48Å; S327-S330 PolarHBondContact O-N 3.4Å; S327-E331 PolarHBondContact O-N 2.92Å; S327-E331 VanDerWaalsContact O-N 3.16Å
328A96.3Very high94.8Very high16 Ų1659.7 Ų59.713%0.13233%0.33CS..Hα-helixtrans-65.5-46.3-178.300000112I312 C313 L316 R324 A325 S330 E331 V332I312-A328 HydrophobicContact CG2-CB 4.34Å; C313-A328 HydrophobicContact CB-CB 4.32Å; L316-A328 HydrophobicContact CD1-CB 3.88Å; R324-A328 PolarHBondContact O-N 3.28Å; A325-A328 PolarHBondContact O-N 2.86Å; A325-A328 VanDerWaalsContact O-N 3.16Å; A328-S330 VanDerWaalsContact C-N 3.32Å; A328-S330 PolarHBondContact O-N 3.32Å; A328-E331 WeakPolarHBondContact O-CB 3.47Å; A328-E331 PolarHBondContact O-N 3.4Å; A328-V332 PolarHBondContact O-N 3.45Å
329C97.4Very high94.8Very high0 Ų057.1 Ų57.10%032%0.319CS..Hα-helixtrans-65.6-36.2178-56.40000111.7C313 A325 E331 V332 L333 R346C313-C329 HydrophobicContact CB-CB 3.93Å; C313-C329 WeakPolarHBondContact CB-SG 3.49Å; C313-C329 WeakPolarHBondContact SG-CA 3.24Å; C313-C329 WeakPolarHBondContact SG-CB 3.26Å; C313-C329 CovalentContact SG-SG 2.02Å; C313-C329 PolarHBondContact SG-SG 3.01Å; A325-C329 WeakPolarHBondContact O-CB 3.4Å; A325-C329 PolarHBondContact O-N 2.91Å; A325-C329 PolarHBondContact O-SG 3.24Å; C329-E331 VanDerWaalsContact C-N 3.3Å; C329-E331 PolarHBondContact O-N 3.31Å; C329-V332 WeakPolarHBondContact O-CB 3.43Å; C329-V332 PolarHBondContact O-N 3.18Å; C329-L333 VanDerWaalsContact O-CG 3.28Å; C329-L333 WeakPolarHBondContact O-CG 3.39Å; C329-L333 PolarHBondContact O-N 2.83Å; C329-R346 HydrophobicContact CB-CB 3.66Å; C329-R346 HydrophobicContact CB-CG 3.99Å
330S96.8Very high94.9Very high28 Ų2857.1 Ų57.120%0.19632%0.316CS..Hα-helixtrans-65.6-33.1175.8-62.30000112.6V326 S327 A328 L333 Q334 R346V326-S330 WeakPolarHBondContact O-CB 3.38Å; V326-S330 PolarHBondContact O-N 3.05Å; V326-S330 PolarHBondContact O-OG 2.77Å; S327-S330 PolarHBondContact O-N 3.4Å; A328-S330 VanDerWaalsContact C-N 3.32Å; A328-S330 PolarHBondContact O-N 3.32Å; S330-L333 PolarHBondContact O-N 3.1Å; S330-Q334 VanDerWaalsContact O-CG 3.29Å; S330-Q334 WeakPolarHBondContact O-CG 3.47Å; S330-Q334 PolarHBondContact O-N 2.78Å; S330-R346 WeakPolarHBondContact OG-CD 3.45Å; S330-R346 PolarHBondContact OG-NH1 3.28Å
331E96Very high95Very high90 Ų9053.3 Ų53.342%0.42130%0.3SS..Hα-helixtrans-65-40.4172.7-168.6-177.3168.700111.7K309 S327 A328 C329 Q334K309-E331 HydrophobicContact CD-CG 4.39Å; K309-E331 WeakPolarHBondContact CE-OE1 3.31Å; K309-E331 IonicContact NZ-OE1 3.55Å; K309-E331 PolarHBondContact NZ-OE1 3.4Å; S327-E331 PolarHBondContact O-N 2.92Å; S327-E331 VanDerWaalsContact O-N 3.16Å; A328-E331 WeakPolarHBondContact O-CB 3.47Å; A328-E331 PolarHBondContact O-N 3.4Å; C329-E331 VanDerWaalsContact C-N 3.3Å; C329-E331 PolarHBondContact O-N 3.31Å; E331-Q334 PolarHBondContact O-N 3.02Å
332V97Very high95.2Very high6 Ų650.9 Ų50.94%0.03629%0.289CS..Hα-helixtrans-61.6-48.3174.2178.40000110.4K309 E310 A328 C329 Q334 S335 D336 N339 A342K309-V332 HydrophobicContact CB-CG2 3.65Å; E310-V332 HydrophobicContact CB-CG1 4.47Å; A328-V332 PolarHBondContact O-N 3.45Å; C329-V332 WeakPolarHBondContact O-CB 3.43Å; C329-V332 PolarHBondContact O-N 3.18Å; V332-Q334 VanDerWaalsContact C-N 3.25Å; V332-Q334 PolarHBondContact O-N 2.68Å; V332-S335 PolarHBondContact O-N 3.13Å; V332-S335 PolarHBondContact O-OG 3Å; V332-D336 PolarHBondContact O-N 3.34Å; V332-N339 HydrophobicContact CG1-CB 4.46Å; V332-A342 HydrophobicContact CB-CB 4.13Å; V332-A342 HydrophobicContact CG1-CB 3.76Å
333L96.8Very high95.6Very high14 Ų1451 Ų517%0.07329%0.289CS..Hα-helixtrans-71.6-16.1-177.1-64.5169.1000113.8C329 S330 D336 P337 N339 A342 L343C329-L333 VanDerWaalsContact O-CG 3.28Å; C329-L333 WeakPolarHBondContact O-CG 3.39Å; C329-L333 PolarHBondContact O-N 2.83Å; S330-L333 PolarHBondContact O-N 3.1Å; L333-D336 WeakPolarHBondContact CA-O 3.32Å; L333-D336 WeakPolarHBondContact CD2-O 3.4Å; L333-P337 VanDerWaalsContact O-CA 3.31Å; L333-P337 WeakPolarHBondContact O-CA 3.44Å; L333-P337 WeakPolarHBondContact O-CG 3.5Å; L333-N339 HydrophobicContact CD2-CB 4.12Å; L333-A342 HydrophobicContact CD1-CB 4.48Å; L333-A342 HydrophobicContact CD2-CB 3.9Å; L333-A342 HydrophobicContact CG-CB 4.01Å; L333-L343 HydrophobicContact CD1-CD2 3.83Å; L333-L343 HydrophobicContact CD1-CG 4.25Å; L333-L343 HydrophobicContact CD2-CD2 3.97Å; L333-L343 HydrophobicContact CD2-CG 3.72Å
334Q95.5Very high95.9Very high158 Ų15849.9 Ų49.974%0.73827%0.269SS*.Hα-helixtrans-69.1-35.9167.2-78.8170.617.300111.8S330 E331 V332S330-Q334 VanDerWaalsContact O-CG 3.29Å; S330-Q334 WeakPolarHBondContact O-CG 3.47Å; S330-Q334 PolarHBondContact O-N 2.78Å; E331-Q334 PolarHBondContact O-N 3.02Å; V332-Q334 VanDerWaalsContact C-N 3.25Å; V332-Q334 PolarHBondContact O-N 2.68Å
335S92.8Very high96.1Very high88 Ų8845 Ų4562%0.61525%0.251SS*.Hα-helixtrans-87.2-33.8177.550.40000113.6V332V332-S335 PolarHBondContact O-N 3.13Å; V332-S335 PolarHBondContact O-OG 3Å
336D94.1Very high96.2Very high67 Ų6746.9 Ų46.936%0.35826%0.258SS..  trans-13982.9-177.7-178.29000109.6V332 L333 E338 N339V332-D336 PolarHBondContact O-N 3.34Å; L333-D336 WeakPolarHBondContact CA-O 3.32Å; L333-D336 WeakPolarHBondContact CD2-O 3.4Å; D336-E338 PolarHBondContact O-N 3.26Å; D336-E338 VanDerWaalsContact O-N 3.14Å; D336-E338 PolarHBondContact OD1-N 3.2Å; D336-N339 HydrophobicContact CB-CB 4.21Å; D336-N339 WeakPolarHBondContact O-CB 3.35Å; D336-N339 PolarHBondContact O-N 2.95Å; D336-N339 PolarHBondContact OD1-N 2.92Å; D336-N339 WeakPolarHBondContact OD2-CB 3.49Å; D336-N339 PolarHBondContact OD2-ND2 3.39Å
337P95.2Very high96.2Very high80 Ų8045.8 Ų45.852%0.51925%0.252SS..THydrogen-bonded Turntrans-63.3-17.8-176.6-22.233.2000114.3L333L333-P337 VanDerWaalsContact O-CA 3.31Å; L333-P337 WeakPolarHBondContact O-CA 3.44Å; L333-P337 WeakPolarHBondContact O-CG 3.5Å
338E94.2Very high96.2Very high120 Ų12044.7 Ų44.756%0.56124%0.238SC*.THydrogen-bonded Turntrans-97.22.1-176-53.1-170162.800112.1D336 V340 H369D336-E338 PolarHBondContact O-N 3.26Å; D336-E338 VanDerWaalsContact O-N 3.14Å; D336-E338 PolarHBondContact OD1-N 3.2Å; E338-V340 PolarHBondContact O-N 3.22Å; E338-H369 VanDerWaalsContact CG-CE1 3.43Å; E338-H369 WeakPolarHBondContact CG-CE1 3.28Å; E338-H369 IonicContact OE1-CE1 2.71Å; E338-H369 PolarHBondContact OE1-CE1 2.98Å; E338-H369 IonicContact OE2-CE1 3.47Å; E338-H369 IonicContact OE2-ND1 3.61Å
339N95.8Very high96.3Very high17 Ų1744 Ų449%0.09123%0.231CC..  trans-64.5101.8-179.6-166-62.1000111.4E310 V332 L333 D336 N341 A342 L343E310-N339 PolarHBondContact OE2-ND2 3.38Å; E310-N339 VanDerWaalsContact OE2-ND2 3.08Å; V332-N339 HydrophobicContact CG1-CB 4.46Å; L333-N339 HydrophobicContact CD2-CB 4.12Å; D336-N339 HydrophobicContact CB-CB 4.21Å; D336-N339 WeakPolarHBondContact O-CB 3.35Å; D336-N339 PolarHBondContact O-N 2.95Å; D336-N339 PolarHBondContact OD1-N 2.92Å; D336-N339 WeakPolarHBondContact OD2-CB 3.49Å; D336-N339 PolarHBondContact OD2-ND2 3.39Å; N339-N341 VanDerWaalsContact C-N 3.32Å; N339-N341 PolarHBondContact O-N 2.9Å; N339-N341 PolarHBondContact OD1-N 3.26Å; N339-A342 HydrophobicContact CB-CB 4.09Å; N339-A342 PolarHBondContact O-N 3.05Å; N339-A342 PolarHBondContact OD1-N 3.4Å; N339-L343 WeakPolarHBondContact O-CG 3.42Å; N339-L343 PolarHBondContact O-N 3.37Å
340V96Very high96.2Very high31 Ų3145.2 Ų45.219%0.18824%0.237CC..Hα-helixtrans-59.7-40.1-176.6173.20000112.1E338 L343 K344 A366 H369 I376E338-V340 PolarHBondContact O-N 3.22Å; V340-L343 PolarHBondContact O-N 2.94Å; V340-K344 HydrophobicContact CG1-CD 3.83Å; V340-K344 WeakPolarHBondContact O-CD 3.41Å; V340-K344 VanDerWaalsContact O-CG 3.26Å; V340-K344 WeakPolarHBondContact O-CG 3.48Å; V340-K344 PolarHBondContact O-N 3.28Å; V340-A366 HydrophobicContact CB-CB 4.33Å; V340-A366 HydrophobicContact CG1-CB 4.11Å; V340-A366 HydrophobicContact CG2-CB 4.23Å; V340-H369 HydrophobicContact CG2-CB 3.86Å; V340-I376 HydrophobicContact CG1-CD1 3.94Å
341N95.9Very high96.1Very high76 Ų7644.9 Ų44.941%0.40623%0.233SC..Hα-helixtrans-65.8-49.3-179.2-64.2-27.1000110.8E310 N339 L343 K344 D345E310-N341 WeakPolarHBondContact OE1-CB 3.44Å; E310-N341 PolarHBondContact OE1-ND2 2.92Å; N339-N341 VanDerWaalsContact C-N 3.32Å; N339-N341 PolarHBondContact O-N 2.9Å; N339-N341 PolarHBondContact OD1-N 3.26Å; N341-L343 VanDerWaalsContact C-N 3.32Å; N341-L343 PolarHBondContact O-N 3.03Å; N341-K344 PolarHBondContact O-N 3.38Å; N341-D345 PolarHBondContact O-N 3.32Å
342A97.3Very high95.9Very high0 Ų043.5 Ų43.50%023%0.227CC..Hα-helixtrans-64.5-34.7179.400000112.7V332 L333 N339 R346V332-A342 HydrophobicContact CB-CB 4.13Å; V332-A342 HydrophobicContact CG1-CB 3.76Å; L333-A342 HydrophobicContact CD1-CB 4.48Å; L333-A342 HydrophobicContact CD2-CB 3.9Å; L333-A342 HydrophobicContact CG-CB 4.01Å; N339-A342 HydrophobicContact CB-CB 4.09Å; N339-A342 PolarHBondContact O-N 3.05Å; N339-A342 PolarHBondContact OD1-N 3.4Å; A342-R346 VanDerWaalsContact O-CB 3.26Å; A342-R346 WeakPolarHBondContact O-CB 3.18Å; A342-R346 PolarHBondContact O-N 3.13Å
343L97.8Very high95.6Very high5 Ų546.6 Ų46.63%0.02624%0.243CC..Hα-helixtrans-63.4-45.4172.4-74.9166000111.6L333 N339 V340 N341 R346 A347 D362 T365 A366L333-L343 HydrophobicContact CD1-CD2 3.83Å; L333-L343 HydrophobicContact CD1-CG 4.25Å; L333-L343 HydrophobicContact CD2-CD2 3.97Å; L333-L343 HydrophobicContact CD2-CG 3.72Å; N339-L343 WeakPolarHBondContact O-CG 3.42Å; N339-L343 PolarHBondContact O-N 3.37Å; V340-L343 PolarHBondContact O-N 2.94Å; N341-L343 VanDerWaalsContact C-N 3.32Å; N341-L343 PolarHBondContact O-N 3.03Å; L343-R346 PolarHBondContact O-N 3.4Å; L343-A347 VanDerWaalsContact O-CB 3.28Å; L343-A347 WeakPolarHBondContact O-CB 3.4Å; L343-A347 PolarHBondContact O-N 2.86Å; L343-D362 HydrophobicContact CD2-CB 4.28Å; L343-T365 HydrophobicContact CD1-CG2 3.82Å; L343-T365 HydrophobicContact CD2-CG2 4.37Å; L343-A366 HydrophobicContact CB-CB 3.72Å; L343-A366 HydrophobicContact CD1-CB 3.43Å; L343-A366 VanDerWaalsContact CD1-CB 3.43Å; L343-A366 HydrophobicContact CG-CB 4.2Å
344K97.3Very high95.4Very high31 Ų3152.7 Ų52.714%0.13527%0.271CS..Hα-helixtrans-62.6-49177.4-71.7164.766.7172.70111.6V340 N341 R346 A347 E348 Y363 D373 E375 I376V340-K344 HydrophobicContact CG1-CD 3.83Å; V340-K344 WeakPolarHBondContact O-CD 3.41Å; V340-K344 VanDerWaalsContact O-CG 3.26Å; V340-K344 WeakPolarHBondContact O-CG 3.48Å; V340-K344 PolarHBondContact O-N 3.28Å; N341-K344 PolarHBondContact O-N 3.38Å; K344-R346 VanDerWaalsContact C-N 3.34Å; K344-R346 PolarHBondContact O-N 3.2Å; K344-A347 PolarHBondContact O-N 2.93Å; K344-E348 PolarHBondContact O-N 3.37Å; K344-Y363 HydrophobicContact CG-CE1 4.47Å; K344-D373 IonicContact NZ-OD2 3.64Å; K344-D373 PolarHBondContact NZ-OD2 2.97Å; K344-E375 WeakPolarHBondContact CE-OE2 3.33Å; K344-E375 IonicContact NZ-OE2 3.46Å; K344-E375 PolarHBondContact NZ-OE2 3.45Å; K344-I376 HydrophobicContact CD-CD1 4.25Å; K344-I376 HydrophobicContact CD-CG1 3.84Å; K344-I376 HydrophobicContact CG-CG1 3.99Å
345D97.8Very high95.3Very high12 Ų1249.7 Ų49.76%0.06426%0.257CS..Hα-helixtrans-63.6-39-179.7-72-41.3000111.6H314 S317 N341 A349H314-D345 VanDerWaalsContact CA-OD2 3.24Å; H314-D345 WeakPolarHBondContact CA-OD2 3.47Å; H314-D345 WeakPolarHBondContact CB-OD2 3.48Å; H314-D345 IonicContact CE1-OD1 3.26Å; H314-D345 IonicContact CG-OD1 3.88Å; H314-D345 IonicContact CG-OD2 3.8Å; H314-D345 IonicContact ND1-OD1 3.56Å; H314-D345 PolarHBondContact ND1-OD1 3.31Å; H314-D345 IonicContact ND1-OD2 3.67Å; H314-D345 PolarHBondContact ND1-OD2 3.09Å; S317-D345 WeakPolarHBondContact CB-O 3.43Å; S317-D345 PolarHBondContact OG-O 3.05Å; N341-D345 PolarHBondContact O-N 3.32Å; D345-A349 PolarHBondContact O-N 2.93Å; D345-A349 VanDerWaalsContact O-N 3.07Å
346R97.9Very high95.4Very high39 Ų3946.9 Ų46.915%0.14723%0.233CC..Hα-helixtrans-69.3-39.8175.3-164.5170.568.9-176.4-4112.3V326 C329 S330 A342 L343 K344 E348 A349 Y350 D362V326-R346 HydrophobicContact CG2-CG 4.38Å; C329-R346 HydrophobicContact CB-CB 3.66Å; C329-R346 HydrophobicContact CB-CG 3.99Å; S330-R346 WeakPolarHBondContact OG-CD 3.45Å; S330-R346 PolarHBondContact OG-NH1 3.28Å; A342-R346 VanDerWaalsContact O-CB 3.26Å; A342-R346 WeakPolarHBondContact O-CB 3.18Å; A342-R346 PolarHBondContact O-N 3.13Å; L343-R346 PolarHBondContact O-N 3.4Å; K344-R346 VanDerWaalsContact C-N 3.34Å; K344-R346 PolarHBondContact O-N 3.2Å; R346-E348 VanDerWaalsContact C-N 3.33Å; R346-E348 PolarHBondContact O-N 3.35Å; R346-A349 WeakPolarHBondContact O-CB 3.43Å; R346-A349 PolarHBondContact O-N 3.44Å; R346-Y350 HydrophobicContact CG-CD2 4.1Å; R346-Y350 HydrophobicContact CG-CE2 3.7Å; R346-Y350 WeakPolarHBondContact O-CD2 3.46Å; R346-Y350 PolarHBondContact O-N 2.99Å; R346-D362 IonicContact CZ-OD1 2.88Å; R346-D362 IonicContact CZ-OD2 2.73Å; R346-D362 IonicContact NE-OD1 3.87Å; R346-D362 IonicContact NE-OD2 3.56Å; R346-D362 PolarHBondContact NE-OD2 2.83Å; R346-D362 IonicContact NH2-OD1 3.77Å; R346-D362 PolarHBondContact NH2-OD1 3.49Å; R346-D362 IonicContact NH2-OD2 3.69Å; R346-D362 PolarHBondContact NH2-OD2 2.94Å
347A97.3Very high95.4Very high0 Ų049.8 Ų49.80%025%0.245CC..Hα-helixtrans-62.7-41175.600000111.5L343 K344 Y350 V351 A359 D362 Y363L343-A347 VanDerWaalsContact O-CB 3.28Å; L343-A347 WeakPolarHBondContact O-CB 3.4Å; L343-A347 PolarHBondContact O-N 2.86Å; K344-A347 PolarHBondContact O-N 2.93Å; A347-Y350 PolarHBondContact O-N 3.2Å; A347-V351 WeakPolarHBondContact O-CG2 3.32Å; A347-V351 PolarHBondContact O-N 3.41Å; A347-A359 HydrophobicContact CB-CB 4.46Å; A347-A359 WeakPolarHBondContact O-CB 3.34Å; A347-D362 HydrophobicContact CB-CB 3.8Å; A347-Y363 HydrophobicContact CB-CD1 4.13Å; A347-Y363 HydrophobicContact CB-CD2 3.69Å; A347-Y363 HydrophobicContact CB-CE1 3.91Å; A347-Y363 HydrophobicContact CB-CE2 3.43Å; A347-Y363 VanDerWaalsContact CB-CE2 3.43Å; A347-Y363 HydrophobicContact CB-CG 4.01Å
348E96.2Very high95.5Very high61 Ų6149.7 Ų49.729%0.28524%0.237SC..Hα-helixtrans-62.1-42.9173.3-177.4164.8-154.300111.9Q318 K344 R346 Y350 V351 Q352Q318-E348 PolarHBondContact NE2-OE2 3.5Å; K344-E348 PolarHBondContact O-N 3.37Å; R346-E348 VanDerWaalsContact C-N 3.33Å; R346-E348 PolarHBondContact O-N 3.35Å; E348-Y350 PolarHBondContact O-N 2.82Å; E348-V351 WeakPolarHBondContact O-CB 3.43Å; E348-V351 PolarHBondContact O-N 2.95Å; E348-Q352 WeakPolarHBondContact O-CG 3.47Å; E348-Q352 PolarHBondContact O-N 3.43Å
349A96.4Very high95.6Very high0 Ų044 Ų440%021%0.21CC..Hα-helixtrans-61-41.3174.400000112.4A325 V326 D345 R346 V351 Q352 D353A325-A349 HydrophobicContact CB-CB 3.73Å; V326-A349 HydrophobicContact CG2-CB 3.91Å; D345-A349 PolarHBondContact O-N 2.93Å; D345-A349 VanDerWaalsContact O-N 3.07Å; R346-A349 WeakPolarHBondContact O-CB 3.43Å; R346-A349 PolarHBondContact O-N 3.44Å; A349-V351 VanDerWaalsContact C-N 3.35Å; A349-V351 PolarHBondContact O-N 3.15Å; A349-Q352 WeakPolarHBondContact O-CB 3.36Å; A349-Q352 PolarHBondContact O-N 2.89Å; A349-D353 PolarHBondContact O-N 3.06Å
350Y97.3Very high95.7Very high27 Ų2744 Ų4411%0.10621%0.21CC..Hα-helixtrans-64.5-36.5173.9-76.2-43.6000113.1V326 R346 A347 E348 Q352 D353 E354 Q355 E358 D362V326-Y350 HydrophobicContact CB-CE1 4.35Å; V326-Y350 HydrophobicContact CG1-CE1 3.67Å; V326-Y350 HydrophobicContact CG2-CD1 3.77Å; V326-Y350 HydrophobicContact CG2-CE1 3.65Å; V326-Y350 HydrophobicContact CG2-CG 4.45Å; R346-Y350 HydrophobicContact CG-CD2 4.1Å; R346-Y350 HydrophobicContact CG-CE2 3.7Å; R346-Y350 WeakPolarHBondContact O-CD2 3.46Å; R346-Y350 PolarHBondContact O-N 2.99Å; A347-Y350 PolarHBondContact O-N 3.2Å; E348-Y350 PolarHBondContact O-N 2.82Å; Y350-Q352 VanDerWaalsContact C-N 3.31Å; Y350-D353 CarbonylContact O-C 3.59Å; Y350-D353 PolarHBondContact O-N 2.93Å; Y350-E354 PolarHBondContact O-N 2.88Å; Y350-E354 VanDerWaalsContact O-N 3.17Å; Y350-Q355 HydrophobicContact CD1-CB 3.97Å; Y350-Q355 HydrophobicContact CG-CB 4.41Å; Y350-Q355 PolarHBondContact O-N 3.29Å; Y350-E358 HydrophobicContact CD1-CB 4.3Å; Y350-E358 HydrophobicContact CD2-CB 3.78Å; Y350-E358 HydrophobicContact CE1-CB 4.3Å; Y350-E358 HydrophobicContact CE2-CB 3.78Å; Y350-E358 HydrophobicContact CG-CB 4.05Å; Y350-D362 WeakPolarHBondContact CE2-OD2 3.4Å
351V94.3Very high95.8Very high20 Ų2048 Ų4812%0.12123%0.226CC..Hα-helixtrans-63.4-39.5173.5170.90000110.9A347 E348 A349 D353 E354 Y356 A359 A383 L386A347-V351 WeakPolarHBondContact O-CG2 3.32Å; A347-V351 PolarHBondContact O-N 3.41Å; E348-V351 WeakPolarHBondContact O-CB 3.43Å; E348-V351 PolarHBondContact O-N 2.95Å; A349-V351 VanDerWaalsContact C-N 3.35Å; A349-V351 PolarHBondContact O-N 3.15Å; V351-D353 VanDerWaalsContact C-N 3.32Å; V351-E354 PolarHBondContact O-N 3.14Å; V351-Y356 HydrophobicContact CG1-CE1 4.47Å; V351-A359 HydrophobicContact CG2-CB 3.66Å; V351-A383 HydrophobicContact CG2-CB 4.12Å; V351-L386 HydrophobicContact CG1-CD1 3.68Å
352Q91.1Very high95.9Very high61 Ų6144.7 Ų44.729%0.28521%0.208SC..Hα-helixtrans-64.3-37176.3-65.7166.57.500112.1S317 Q320 E348 A349 Y350 E354S317-Q352 PolarHBondContact O-NE2 3.34Å; Q320-Q352 VanDerWaalsContact CA-OE1 3.26Å; E348-Q352 WeakPolarHBondContact O-CG 3.47Å; E348-Q352 PolarHBondContact O-N 3.43Å; A349-Q352 WeakPolarHBondContact O-CB 3.36Å; A349-Q352 PolarHBondContact O-N 2.89Å; Y350-Q352 VanDerWaalsContact C-N 3.31Å; Q352-E354 VanDerWaalsContact C-N 3.27Å; Q352-E354 PolarHBondContact O-N 3.47Å
353D91.6Very high95.9Very high72 Ų7245.7 Ų45.739%0.38521%0.212SC..THydrogen-bonded Turntrans-86.411177.7-73.3-12.4000113.4G322 G323 A349 Y350 V351 Q355G322-D353 VanDerWaalsContact C-OD2 3.29Å; G322-D353 WeakPolarHBondContact CA-OD2 2.91Å; G323-D353 PolarHBondContact N-OD2 3.21Å; A349-D353 PolarHBondContact O-N 3.06Å; Y350-D353 CarbonylContact O-C 3.59Å; Y350-D353 PolarHBondContact O-N 2.93Å; V351-D353 VanDerWaalsContact C-N 3.32Å; D353-Q355 HydrophobicContact CB-CG 4.32Å; D353-Q355 PolarHBondContact O-N 3.34Å; D353-Q355 VanDerWaalsContact O-N 3.17Å
354E91.4Very high95.8Very high142 Ų14249.9 Ų49.966%0.66423%0.231SC*.THydrogen-bonded Turntrans59.518.7-178.4-51.2-172.6161.300115Y350 V351 Q352 Y356Y350-E354 PolarHBondContact O-N 2.88Å; Y350-E354 VanDerWaalsContact O-N 3.17Å; V351-E354 PolarHBondContact O-N 3.14Å; Q352-E354 VanDerWaalsContact C-N 3.27Å; Q352-E354 PolarHBondContact O-N 3.47Å; E354-Y356 VanDerWaalsContact C-N 3.3Å; E354-Y356 HydrophobicContact CB-CE2 3.97Å; E354-Y356 WeakPolarHBondContact O-CD2 3.2Å; E354-Y356 WeakPolarHBondContact O-CE2 2.68Å; E354-Y356 PolarHBondContact O-N 3.42Å; E354-Y356 VanDerWaalsContact O-N 3.14Å
355Q93.9Very high95.7Very high95 Ų9550.2 Ų50.244%0.44424%0.236SC..  trans-88.260.7177.2-59.3-169.2-60.200111.2Y350 D353 E357 E358 A359Y350-Q355 HydrophobicContact CD1-CB 3.97Å; Y350-Q355 HydrophobicContact CG-CB 4.41Å; Y350-Q355 PolarHBondContact O-N 3.29Å; D353-Q355 HydrophobicContact CB-CG 4.32Å; D353-Q355 PolarHBondContact O-N 3.34Å; D353-Q355 VanDerWaalsContact O-N 3.17Å; Q355-E357 VanDerWaalsContact C-N 3.32Å; Q355-E357 PolarHBondContact O-N 2.99Å; Q355-E358 PolarHBondContact O-N 2.97Å; Q355-A359 PolarHBondContact O-N 3Å
356Y94.8Very high95.6Very high29 Ų2949.7 Ų49.711%0.11423%0.233CC..Hα-helixtrans-63.4-31.3-168.7-49.1-65000114.8V351 E354 A359 I360 L386 L387V351-Y356 HydrophobicContact CG1-CE1 4.47Å; E354-Y356 VanDerWaalsContact C-N 3.3Å; E354-Y356 HydrophobicContact CB-CE2 3.97Å; E354-Y356 WeakPolarHBondContact O-CD2 3.2Å; E354-Y356 WeakPolarHBondContact O-CE2 2.68Å; E354-Y356 PolarHBondContact O-N 3.42Å; E354-Y356 VanDerWaalsContact O-N 3.14Å; Y356-A359 PolarHBondContact O-N 2.86Å; Y356-I360 WeakPolarHBondContact O-CD1 3.44Å; Y356-I360 VanDerWaalsContact O-CG1 3.24Å; Y356-I360 WeakPolarHBondContact O-CG1 3.26Å; Y356-I360 PolarHBondContact O-N 3.39Å; Y356-L386 HydrophobicContact CD1-CB 3.69Å; Y356-L386 HydrophobicContact CD1-CD1 4.37Å; Y356-L386 HydrophobicContact CE1-CB 3.51Å; Y356-L386 HydrophobicContact CE1-CD1 3.9Å; Y356-L386 HydrophobicContact CE1-CG 4.25Å; Y356-L386 HydrophobicContact CG-CB 4.29Å; Y356-L387 HydrophobicContact CG-CB 4.42Å
357E95.1Very high95.4Very high128 Ų12849.9 Ų49.960%0.59824%0.243SC*.Hα-helixtrans-64.8-44.3178.8-67.4178.9-177.300111.7Q355 I360 K361 L387Q355-E357 VanDerWaalsContact C-N 3.32Å; Q355-E357 PolarHBondContact O-N 2.99Å; E357-I360 PolarHBondContact O-N 3.17Å; E357-K361 PolarHBondContact O-N 3.44Å; E357-L387 HydrophobicContact CG-CD1 3.96Å; E357-L387 HydrophobicContact CG-CD2 4.2Å
358E96.7Very high95.3Very high77 Ų7757.4 Ų57.436%0.3628%0.276SS..Hα-helixtrans-69.6-35.9176.5-62.4-59.6150.800111.3Y350 Q355 I360 K361 D362Y350-E358 HydrophobicContact CD1-CB 4.3Å; Y350-E358 HydrophobicContact CD2-CB 3.78Å; Y350-E358 HydrophobicContact CE1-CB 4.3Å; Y350-E358 HydrophobicContact CE2-CB 3.78Å; Y350-E358 HydrophobicContact CG-CB 4.05Å; Q355-E358 PolarHBondContact O-N 2.97Å; E358-I360 PolarHBondContact O-N 3.5Å; E358-K361 PolarHBondContact O-N 3.26Å; E358-K361 IonicContact OE2-NZ 3.18Å; E358-D362 PolarHBondContact O-N 3.47Å
359A96.9Very high95Very high0 Ų058.4 Ų58.40%028%0.28CS..Hα-helixtrans-60-45.7173.800000112.5A347 V351 Q355 Y356 K361 D362 Y363 A383A347-A359 HydrophobicContact CB-CB 4.46Å; A347-A359 WeakPolarHBondContact O-CB 3.34Å; V351-A359 HydrophobicContact CG2-CB 3.66Å; Q355-A359 PolarHBondContact O-N 3Å; Y356-A359 PolarHBondContact O-N 2.86Å; A359-K361 VanDerWaalsContact C-N 3.33Å; A359-K361 PolarHBondContact O-N 3Å; A359-D362 PolarHBondContact O-N 2.76Å; A359-Y363 WeakPolarHBondContact O-CD2 3.44Å; A359-Y363 PolarHBondContact O-N 3.1Å; A359-A383 HydrophobicContact CB-CB 4.3Å
360I97.3Very high94.7Very high18 Ų1860.2 Ų60.29%0.09229%0.293CS..Hα-helixtrans-60-45.6177.6-71.8164.1000110.3Y356 E357 E358 D362 Y363 E364 L380 A383 Q384 L387Y356-I360 WeakPolarHBondContact O-CD1 3.44Å; Y356-I360 VanDerWaalsContact O-CG1 3.24Å; Y356-I360 WeakPolarHBondContact O-CG1 3.26Å; Y356-I360 PolarHBondContact O-N 3.39Å; E357-I360 PolarHBondContact O-N 3.17Å; E358-I360 PolarHBondContact O-N 3.5Å; I360-D362 VanDerWaalsContact C-N 3.34Å; I360-D362 PolarHBondContact O-N 2.98Å; I360-Y363 PolarHBondContact O-N 3.47Å; I360-E364 HydrophobicContact CG2-CG 4.33Å; I360-E364 WeakPolarHBondContact O-CB 3.42Å; I360-E364 WeakPolarHBondContact O-CG 3.4Å; I360-E364 PolarHBondContact O-N 3.15Å; I360-L380 HydrophobicContact CB-CD1 4.29Å; I360-L380 HydrophobicContact CG1-CD1 4.38Å; I360-L380 HydrophobicContact CG2-CD1 3.81Å; I360-A383 HydrophobicContact CG1-CB 3.73Å; I360-Q384 HydrophobicContact CD1-CG 3.86Å; I360-Q384 HydrophobicContact CG1-CG 4.09Å; I360-L387 HydrophobicContact CD1-CB 4.19Å; I360-L387 HydrophobicContact CD1-CD2 3.57Å
361K97.3Very high94Very high116 Ų11666.9 Ų66.950%0.50433%0.325SS..Hα-helixtrans-60.9-40.3178.8-178.1-177.1172.5-169.30113E357 E358 A359 E364 T365E357-K361 PolarHBondContact O-N 3.44Å; E358-K361 PolarHBondContact O-N 3.26Å; E358-K361 IonicContact OE2-NZ 3.18Å; A359-K361 VanDerWaalsContact C-N 3.33Å; A359-K361 PolarHBondContact O-N 3Å; K361-E364 PolarHBondContact O-N 3.18Å; K361-T365 PolarHBondContact O-N 3.32Å; K361-T365 PolarHBondContact O-OG1 3.3Å
362D97.3Very high93.5Very high6 Ų671.9 Ų71.93%0.03235%0.351CS..Hα-helixtrans-67.4-42.3175.6-84.4-5.2000111.6L343 R346 A347 Y350 E358 A359 I360 E364 T365 A366L343-D362 HydrophobicContact CD2-CB 4.28Å; R346-D362 IonicContact CZ-OD1 2.88Å; R346-D362 IonicContact CZ-OD2 2.73Å; R346-D362 IonicContact NE-OD1 3.87Å; R346-D362 IonicContact NE-OD2 3.56Å; R346-D362 PolarHBondContact NE-OD2 2.83Å; R346-D362 IonicContact NH2-OD1 3.77Å; R346-D362 PolarHBondContact NH2-OD1 3.49Å; R346-D362 IonicContact NH2-OD2 3.69Å; R346-D362 PolarHBondContact NH2-OD2 2.94Å; A347-D362 HydrophobicContact CB-CB 3.8Å; Y350-D362 WeakPolarHBondContact CE2-OD2 3.4Å; E358-D362 PolarHBondContact O-N 3.47Å; A359-D362 PolarHBondContact O-N 2.76Å; I360-D362 VanDerWaalsContact C-N 3.34Å; I360-D362 PolarHBondContact O-N 2.98Å; D362-E364 PolarHBondContact O-N 2.96Å; D362-T365 PolarHBondContact O-N 3.49Å; D362-A366 PolarHBondContact O-N 3.35Å
363Y97.4Very high93.5Very high21 Ų2170.7 Ų70.78%0.08235%0.347CS..Hα-helixtrans-65.6-35.6174.4-77.2-57.1000113.4K344 A347 A359 I360 A366 A367 I376 L380 A383K344-Y363 HydrophobicContact CG-CE1 4.47Å; A347-Y363 HydrophobicContact CB-CD1 4.13Å; A347-Y363 HydrophobicContact CB-CD2 3.69Å; A347-Y363 HydrophobicContact CB-CE1 3.91Å; A347-Y363 HydrophobicContact CB-CE2 3.43Å; A347-Y363 VanDerWaalsContact CB-CE2 3.43Å; A347-Y363 HydrophobicContact CB-CG 4.01Å; A359-Y363 WeakPolarHBondContact O-CD2 3.44Å; A359-Y363 PolarHBondContact O-N 3.1Å; I360-Y363 PolarHBondContact O-N 3.47Å; Y363-A366 CarbonylContact O-C 3.49Å; Y363-A366 VanDerWaalsContact O-CA 3.24Å; Y363-A366 WeakPolarHBondContact O-CA 3.2Å; Y363-A366 PolarHBondContact O-N 3.22Å; Y363-A367 PolarHBondContact O-N 2.87Å; Y363-I376 HydrophobicContact CD1-CG2 4.2Å; Y363-I376 WeakPolarHBondContact O-CG2 3.24Å; Y363-L380 HydrophobicContact CG-CB 4.44Å; Y363-A383 HydrophobicContact CD2-CB 4.42Å; Y363-A383 HydrophobicContact CE2-CB 4.46Å
364E95.6Very high93.6Very high92 Ų9273.8 Ų73.843%0.4336%0.359SS..Hα-helixtrans-66.7-40.2174.9-76.3178.4175.500111.9I360 K361 D362 A366 A367 K368 L380I360-E364 HydrophobicContact CG2-CG 4.33Å; I360-E364 WeakPolarHBondContact O-CB 3.42Å; I360-E364 WeakPolarHBondContact O-CG 3.4Å; I360-E364 PolarHBondContact O-N 3.15Å; K361-E364 PolarHBondContact O-N 3.18Å; D362-E364 PolarHBondContact O-N 2.96Å; E364-A366 VanDerWaalsContact C-N 3.34Å; E364-A367 PolarHBondContact O-N 3.48Å; E364-K368 WeakPolarHBondContact O-CG 3.3Å; E364-K368 PolarHBondContact O-N 2.93Å; E364-L380 HydrophobicContact CG-CD1 4.15Å
365T95.7Very high93.6Very high39 Ų3973 Ų7324%0.23936%0.355CS..Hα-helixtrans-62.7-46.5170.3-50.60000110L343 K361 D362 A367 K368 H369L343-T365 HydrophobicContact CD1-CG2 3.82Å; L343-T365 HydrophobicContact CD2-CG2 4.37Å; K361-T365 PolarHBondContact O-N 3.32Å; K361-T365 PolarHBondContact O-OG1 3.3Å; D362-T365 PolarHBondContact O-N 3.49Å; T365-A367 PolarHBondContact O-N 3.31Å; T365-K368 WeakPolarHBondContact O-CB 3.47Å; T365-K368 PolarHBondContact O-N 3.47Å; T365-K368 VanDerWaalsContact O-N 3.12Å; T365-H369 PolarHBondContact O-CD2 3.4Å; T365-H369 VanDerWaalsContact O-CD2 3.29Å
366A95.4Very high93.7Very high1 Ų168.6 Ų68.61%0.00833%0.334CS..Hα-helixtrans-30.1-66.3162.600000114.2V340 L343 D362 Y363 E364 K368 H369 S370 I376V340-A366 HydrophobicContact CB-CB 4.33Å; V340-A366 HydrophobicContact CG1-CB 4.11Å; V340-A366 HydrophobicContact CG2-CB 4.23Å; L343-A366 HydrophobicContact CB-CB 3.72Å; L343-A366 HydrophobicContact CD1-CB 3.43Å; L343-A366 VanDerWaalsContact CD1-CB 3.43Å; L343-A366 HydrophobicContact CG-CB 4.2Å; D362-A366 PolarHBondContact O-N 3.35Å; Y363-A366 CarbonylContact O-C 3.49Å; Y363-A366 VanDerWaalsContact O-CA 3.24Å; Y363-A366 WeakPolarHBondContact O-CA 3.2Å; Y363-A366 PolarHBondContact O-N 3.22Å; E364-A366 VanDerWaalsContact C-N 3.34Å; A366-K368 PolarHBondContact O-N 3.43Å; A366-H369 PolarHBondContact O-N 2.7Å; A366-S370 PolarHBondContact O-N 2.88Å; A366-I376 HydrophobicContact CB-CD1 4.1Å
367A94.9Very high93.7Very high43 Ų4372 Ų7236%0.35535%0.35SS..Hα-helixtrans-66.5-22.3-171.800000113.8Y363 E364 T365 I376Y363-A367 PolarHBondContact O-N 2.87Å; E364-A367 PolarHBondContact O-N 3.48Å; T365-A367 PolarHBondContact O-N 3.31Å; A367-I376 HydrophobicContact CB-CG2 3.97Å
368K93.8Very high93.7Very high158 Ų15871.5 Ų71.569%0.68735%0.347SS*.Hα-helixtrans-72.5-29.8176.5-68170.2-170.5168.90112.6E364 T365 A366E364-K368 WeakPolarHBondContact O-CG 3.3Å; E364-K368 PolarHBondContact O-N 2.93Å; T365-K368 WeakPolarHBondContact O-CB 3.47Å; T365-K368 PolarHBondContact O-N 3.47Å; T365-K368 VanDerWaalsContact O-N 3.12Å; A366-K368 PolarHBondContact O-N 3.43Å
369H91.4Very high93.6Very high82 Ų8268.2 Ų68.238%0.3833%0.334SS..Hα-helixtrans-99.7-13.6-177.2-62.3-75.1000113E338 V340 T365 A366E338-H369 VanDerWaalsContact CG-CE1 3.43Å; E338-H369 WeakPolarHBondContact CG-CE1 3.28Å; E338-H369 IonicContact OE1-CE1 2.71Å; E338-H369 PolarHBondContact OE1-CE1 2.98Å; E338-H369 IonicContact OE2-CE1 3.47Å; E338-H369 IonicContact OE2-ND1 3.61Å; V340-H369 HydrophobicContact CG2-CB 3.86Å; T365-H369 PolarHBondContact O-CD2 3.4Å; T365-H369 VanDerWaalsContact O-CD2 3.29Å; A366-H369 PolarHBondContact O-N 2.7Å
370S89.6Confident93.5Very high37 Ų3769.7 Ų69.726%0.25934%0.342SS..SBendtrans-135.190.6176.5-172.30000111A366 N372 D373A366-S370 PolarHBondContact O-N 2.88Å; S370-N372 PolarHBondContact O-N 3.13Å; S370-D373 WeakPolarHBondContact OG-CB 3.42Å
371E82.8Confident93.4Very high168 Ų16874.3 Ų74.379%0.78536%0.363SS*.THydrogen-bonded Turntrans-67.3126.8176.8-67.3-173.2-179.100110.6
372N83.1Confident93.3Very high125 Ų12573.6 Ų73.667%0.66836%0.36SS*.THydrogen-bonded Turntrans71.519.9176.9-57.2-52.1000117.7S370 H374 K377S370-N372 PolarHBondContact O-N 3.13Å; N372-H374 PolarHBondContact O-N 2.93Å; N372-K377 PolarHBondContact OD1-NZ 2.98Å
373D91.9Very high93.2Very high36 Ų3673.3 Ų73.319%0.19336%0.358CS..  trans-65.5118.6165.8-170.6-25.2000110.6K344 S370 E375 I376 K377K344-D373 IonicContact NZ-OD2 3.64Å; K344-D373 PolarHBondContact NZ-OD2 2.97Å; S370-D373 WeakPolarHBondContact OG-CB 3.42Å; D373-E375 VanDerWaalsContact C-N 3.34Å; D373-E375 WeakPolarHBondContact OD1-CB 3.19Å; D373-E375 PolarHBondContact OD1-N 2.99Å; D373-I376 HydrophobicContact CB-CB 4.18Å; D373-I376 HydrophobicContact CB-CD1 3.72Å; D373-I376 HydrophobicContact CB-CG1 3.85Å; D373-K377 WeakPolarHBondContact O-CG 3.26Å; D373-K377 PolarHBondContact O-N 3.04Å
374H92.6Very high93.1Very high137 Ų13776.6 Ų76.663%0.63438%0.375SS*.Hα-helixtrans-64.9-37.4179.6-176.1-76.4000111.9N372 I376 K377 E378N372-H374 PolarHBondContact O-N 2.93Å; H374-I376 VanDerWaalsContact C-N 3.34Å; H374-I376 PolarHBondContact O-N 3.28Å; H374-K377 PolarHBondContact O-N 3.23Å; H374-E378 IonicContact CE1-OE2 2.72Å; H374-E378 PolarHBondContact CE1-OE2 2.86Å; H374-E378 IonicContact ND1-OE2 3.49Å; H374-E378 WeakPolarHBondContact O-CB 3.36Å; H374-E378 PolarHBondContact O-N 3.42Å
375E93Very high92.9Very high125 Ų12580.1 Ų80.158%0.58438%0.384SS*.Hα-helixtrans-67.2-37.7-177.8-63.7179-17800111K344 D373 G379K344-E375 WeakPolarHBondContact CE-OE2 3.33Å; K344-E375 IonicContact NZ-OE2 3.46Å; K344-E375 PolarHBondContact NZ-OE2 3.45Å; D373-E375 VanDerWaalsContact C-N 3.34Å; D373-E375 WeakPolarHBondContact OD1-CB 3.19Å; D373-E375 PolarHBondContact OD1-N 2.99Å; E375-G379 PolarHBondContact O-N 3.15Å
376I95.1Very high92.7Very high3 Ų380.3 Ų80.32%0.01538%0.383CS..Hα-helixtrans-66.1-44.7176.1-61.6178.4000110.6V340 K344 Y363 A366 A367 D373 H374 G379 L380V340-I376 HydrophobicContact CG1-CD1 3.94Å; K344-I376 HydrophobicContact CD-CD1 4.25Å; K344-I376 HydrophobicContact CD-CG1 3.84Å; K344-I376 HydrophobicContact CG-CG1 3.99Å; Y363-I376 HydrophobicContact CD1-CG2 4.2Å; Y363-I376 WeakPolarHBondContact O-CG2 3.24Å; A366-I376 HydrophobicContact CB-CD1 4.1Å; A367-I376 HydrophobicContact CB-CG2 3.97Å; D373-I376 HydrophobicContact CB-CB 4.18Å; D373-I376 HydrophobicContact CB-CD1 3.72Å; D373-I376 HydrophobicContact CB-CG1 3.85Å; H374-I376 VanDerWaalsContact C-N 3.34Å; H374-I376 PolarHBondContact O-N 3.28Å; I376-G379 PolarHBondContact O-N 3.16Å; I376-L380 VanDerWaalsContact O-CB 3.27Å; I376-L380 WeakPolarHBondContact O-CB 3.42Å; I376-L380 PolarHBondContact O-N 2.9Å
377K94.7Very high92.5Very high101 Ų10181.7 Ų81.744%0.43939%0.39SS..Hα-helixtrans-62.4-47.6178.5-70178.1-176176.60111.3N372 D373 H374 L380 E381N372-K377 PolarHBondContact OD1-NZ 2.98Å; D373-K377 WeakPolarHBondContact O-CG 3.26Å; D373-K377 PolarHBondContact O-N 3.04Å; H374-K377 PolarHBondContact O-N 3.23Å; K377-L380 PolarHBondContact O-N 2.96Å; K377-E381 WeakPolarHBondContact O-CG 3.17Å; K377-E381 PolarHBondContact O-N 3.5Å
378E95.2Very high92.2Very high116 Ų11686.1 Ų86.154%0.54240%0.401SS..Hα-helixtrans-63.2-43178.1-174.2177.1175.300111.8H374 E381 K382H374-E378 IonicContact CE1-OE2 2.72Å; H374-E378 PolarHBondContact CE1-OE2 2.86Å; H374-E378 IonicContact ND1-OE2 3.49Å; H374-E378 WeakPolarHBondContact O-CB 3.36Å; H374-E378 PolarHBondContact O-N 3.42Å; E378-E381 PolarHBondContact O-N 2.88Å; E378-K382 VanDerWaalsContact O-CB 3.26Å; E378-K382 WeakPolarHBondContact O-CB 3.13Å; E378-K382 PolarHBondContact O-N 3.41Å
379G94.4Very high91.6Very high8 Ų885 Ų858%0.08240%0.399CS..Hα-helixtrans-60.9-44.5175.600000112.8E375 I376 K382 A383E375-G379 PolarHBondContact O-N 3.15Å; I376-G379 PolarHBondContact O-N 3.16Å; G379-K382 PolarHBondContact O-N 3.35Å; G379-A383 WeakPolarHBondContact O-CB 3.48Å; G379-A383 PolarHBondContact O-N 3.43Å
380L95.7Very high91.3Very high32 Ų3284.4 Ų84.417%0.16840%0.404CS..Hα-helixtrans-62.7-49.2176.7-177.663.6000111.7I360 Y363 E364 I376 K377 K382 A383 Q384I360-L380 HydrophobicContact CB-CD1 4.29Å; I360-L380 HydrophobicContact CG1-CD1 4.38Å; I360-L380 HydrophobicContact CG2-CD1 3.81Å; Y363-L380 HydrophobicContact CG-CB 4.44Å; E364-L380 HydrophobicContact CG-CD1 4.15Å; I376-L380 VanDerWaalsContact O-CB 3.27Å; I376-L380 WeakPolarHBondContact O-CB 3.42Å; I376-L380 PolarHBondContact O-N 2.9Å; K377-L380 PolarHBondContact O-N 2.96Å; L380-K382 VanDerWaalsContact C-N 3.31Å; L380-K382 PolarHBondContact O-N 3.15Å; L380-A383 PolarHBondContact O-N 2.95Å; L380-Q384 HydrophobicContact CD1-CG 4.47Å; L380-Q384 WeakPolarHBondContact O-CB 3.35Å; L380-Q384 WeakPolarHBondContact O-CG 3.47Å; L380-Q384 PolarHBondContact O-N 3Å
381E95Very high90.9Very high115 Ų11588.2 Ų88.254%0.53742%0.417SS..Hα-helixtrans-61-40.3177.2-74.1-179.6-168.300111.9K377 E378 R385K377-E381 WeakPolarHBondContact O-CG 3.17Å; K377-E381 PolarHBondContact O-N 3.5Å; E378-E381 PolarHBondContact O-N 2.88Å; E381-R385 VanDerWaalsContact O-CB 3.28Å; E381-R385 WeakPolarHBondContact O-CB 3.47Å; E381-R385 PolarHBondContact O-N 3.19Å
382K95Very high90.7Very high101 Ų10185.3 Ų85.344%0.43940%0.399SS..Hα-helixtrans-62-48.7175179-175.8174.3-1720110.9E378 G379 L380 R385 L386E378-K382 VanDerWaalsContact O-CB 3.26Å; E378-K382 WeakPolarHBondContact O-CB 3.13Å; E378-K382 PolarHBondContact O-N 3.41Å; G379-K382 PolarHBondContact O-N 3.35Å; L380-K382 VanDerWaalsContact C-N 3.31Å; L380-K382 PolarHBondContact O-N 3.15Å; K382-R385 PolarHBondContact O-N 2.55Å; K382-L386 HydrophobicContact CG-CD1 4.04Å; K382-L386 WeakPolarHBondContact O-CG 3.44Å; K382-L386 PolarHBondContact O-N 2.9Å
383A95.3Very high90.4Very high0 Ų083.7 Ų83.70%038%0.384CS..Hα-helixtrans-63.6-42.6179.900000111.9V351 A359 I360 Y363 G379 L380 L386 L387V351-A383 HydrophobicContact CG2-CB 4.12Å; A359-A383 HydrophobicContact CB-CB 4.3Å; I360-A383 HydrophobicContact CG1-CB 3.73Å; Y363-A383 HydrophobicContact CD2-CB 4.42Å; Y363-A383 HydrophobicContact CE2-CB 4.46Å; G379-A383 WeakPolarHBondContact O-CB 3.48Å; G379-A383 PolarHBondContact O-N 3.43Å; L380-A383 PolarHBondContact O-N 2.95Å; A383-L386 PolarHBondContact O-N 3.38Å; A383-L387 WeakPolarHBondContact O-CB 3.33Å; A383-L387 PolarHBondContact O-N 3.01Å
384Q94.4Very high90.1Very high90 Ų9084.8 Ų84.842%0.42139%0.39SS..Hα-helixtrans-62.8-41.9175-73175.7-900112.5I360 L380 L387 K388I360-Q384 HydrophobicContact CD1-CG 3.86Å; I360-Q384 HydrophobicContact CG1-CG 4.09Å; L380-Q384 HydrophobicContact CD1-CG 4.47Å; L380-Q384 WeakPolarHBondContact O-CB 3.35Å; L380-Q384 WeakPolarHBondContact O-CG 3.47Å; L380-Q384 PolarHBondContact O-N 3Å; Q384-L387 PolarHBondContact O-N 3.49Å; Q384-K388 WeakPolarHBondContact O-CB 3.49Å; Q384-K388 PolarHBondContact O-N 2.98Å
385R92.3Very high89.8Confident166 Ų16678.3 Ų78.363%0.62636%0.36SS*.Hα-helixtrans-62.6-43.9176.1-171.1-173.1-53.31567.4111.5E381 K382 K388 Q389E381-R385 VanDerWaalsContact O-CB 3.28Å; E381-R385 WeakPolarHBondContact O-CB 3.47Å; E381-R385 PolarHBondContact O-N 3.19Å; K382-R385 PolarHBondContact O-N 2.55Å; R385-K388 PolarHBondContact O-N 3.37Å; R385-Q389 WeakPolarHBondContact O-CB 3.4Å; R385-Q389 PolarHBondContact O-N 3.18Å
386L91.1Very high89.6Confident43 Ų4372.7 Ų72.723%0.22533%0.333CS..Hα-helixtrans-67.3-38.6177.6-70.8170.1000112V351 Y356 K382 A383 Q389 S390V351-L386 HydrophobicContact CG1-CD1 3.68Å; Y356-L386 HydrophobicContact CD1-CB 3.69Å; Y356-L386 HydrophobicContact CD1-CD1 4.37Å; Y356-L386 HydrophobicContact CE1-CB 3.51Å; Y356-L386 HydrophobicContact CE1-CD1 3.9Å; Y356-L386 HydrophobicContact CE1-CG 4.25Å; Y356-L386 HydrophobicContact CG-CB 4.29Å; K382-L386 HydrophobicContact CG-CD1 4.04Å; K382-L386 WeakPolarHBondContact O-CG 3.44Å; K382-L386 PolarHBondContact O-N 2.9Å; A383-L386 PolarHBondContact O-N 3.38Å; L386-Q389 PolarHBondContact O-N 2.9Å; L386-S390 WeakPolarHBondContact O-CB 3.34Å; L386-S390 PolarHBondContact O-N 2.79Å
387L91.8Very high89.3Confident30 Ų3080.6 Ų80.616%0.15737%0.367CS..Hα-helixtrans-61-46.9172-179.362.3000111.4Y356 E357 I360 A383 Q384 Q389 S390 Q391Y356-L387 HydrophobicContact CG-CB 4.42Å; E357-L387 HydrophobicContact CG-CD1 3.96Å; E357-L387 HydrophobicContact CG-CD2 4.2Å; I360-L387 HydrophobicContact CD1-CB 4.19Å; I360-L387 HydrophobicContact CD1-CD2 3.57Å; A383-L387 WeakPolarHBondContact O-CB 3.33Å; A383-L387 PolarHBondContact O-N 3.01Å; Q384-L387 PolarHBondContact O-N 3.49Å; L387-Q389 VanDerWaalsContact C-N 3.28Å; L387-Q389 PolarHBondContact O-N 3.42Å; L387-S390 PolarHBondContact O-N 3.37Å; L387-S390 PolarHBondContact O-OG 2.97Å; L387-Q391 HydrophobicContact CD1-CG 4.21Å; L387-Q391 WeakPolarHBondContact O-CB 3.47Å; L387-Q391 VanDerWaalsContact O-CG 3.31Å; L387-Q391 WeakPolarHBondContact O-CG 3.45Å; L387-Q391 PolarHBondContact O-N 3.48Å
388K87.3Confident89Confident135 Ų13578.3 Ų78.359%0.58736%0.359SS*.Hα-helixtrans-61.8-38.8176.3-172170.5-174164.70111.6Q384 R385 R392Q384-K388 WeakPolarHBondContact O-CB 3.49Å; Q384-K388 PolarHBondContact O-N 2.98Å; R385-K388 PolarHBondContact O-N 3.37Å; K388-R392 WeakPolarHBondContact O-CB 3.43Å; K388-R392 PolarHBondContact O-N 3.32Å
389Q83Confident88.7Confident135 Ų13573 Ų7363%0.63134%0.335SS*.Hα-helixtrans-67.2-37176.1-173.5175.53.100112.6R385 L386 L387 R392R385-Q389 WeakPolarHBondContact O-CB 3.4Å; R385-Q389 PolarHBondContact O-N 3.18Å; L386-Q389 PolarHBondContact O-N 2.9Å; L387-Q389 VanDerWaalsContact C-N 3.28Å; L387-Q389 PolarHBondContact O-N 3.42Å; Q389-R392 PolarHBondContact O-N 3.36Å
390S84Confident88.4Confident69 Ų6975.9 Ų75.948%0.48337%0.365SS..Hα-helixtrans-74.1-32.3178.974.40000112.6L386 L387L386-S390 WeakPolarHBondContact O-CB 3.34Å; L386-S390 PolarHBondContact O-N 2.79Å; L387-S390 PolarHBondContact O-N 3.37Å; L387-S390 PolarHBondContact O-OG 2.97Å
391Q80.8Confident88.2Confident117 Ų11775.7 Ų75.755%0.54737%0.365SS..Hα-helixtrans-77.1-22.7174.7-69176.6-7.700113L387 R393L387-Q391 HydrophobicContact CD1-CG 4.21Å; L387-Q391 WeakPolarHBondContact O-CB 3.47Å; L387-Q391 VanDerWaalsContact O-CG 3.31Å; L387-Q391 WeakPolarHBondContact O-CG 3.45Å; L387-Q391 PolarHBondContact O-N 3.48Å; Q391-R393 PolarHBondContact O-N 3.14Å
392R78.3Confident87.9Confident107 Ų10778.2 Ų78.240%0.40437%0.374SS..SBendtrans-62.6119.1179.3-172.9174.2177.1-178.1-2.7110.7K388 Q389 D394 F458 G461K388-R392 WeakPolarHBondContact O-CB 3.43Å; K388-R392 PolarHBondContact O-N 3.32Å; Q389-R392 PolarHBondContact O-N 3.36Å; R392-D394 PolarHBondContact O-N 3.06Å; R392-F458 PolarHBondContact NH2-O 3.13Å; R392-G461 VanDerWaalsContact NH2-CA 3.32Å; R392-G461 PolarHBondContact NH2-O 2.69Å
393R77.9Confident87.5Confident92 Ų9280.7 Ų80.735%0.34738%0.38SS..  trans-72.5121.9177.5-65.8175.8178.2-131.3-14.5109.7Q391 Y395 I398 D441 F458Q391-R393 PolarHBondContact O-N 3.14Å; R393-Y395 HydrophobicContact CB-CD1 4.49Å; R393-Y395 HydrophobicContact CB-CE1 3.98Å; R393-Y395 PolarHBondContact O-N 3.36Å; R393-I398 HydrophobicContact CB-CD1 4.35Å; R393-D441 IonicContact CZ-OD1 3.83Å; R393-D441 IonicContact NH1-OD1 3.42Å; R393-D441 PolarHBondContact NH1-OD1 2.93Å; R393-D441 IonicContact NH2-OD1 3.81Å; R393-F458 VanDerWaalsContact O-CE2 3.31Å; R393-F458 WeakPolarHBondContact O-CE2 3.5Å; R393-F458 WeakPolarHBondContact O-CZ 3.49Å
394D84.4Confident87.2Confident59 Ų5986.5 Ų86.532%0.31642%0.416SS..  trans-91.593.4169.8-172.9-18.4000110.2R392 Y396 K397 I398R392-D394 PolarHBondContact O-N 3.06Å; D394-Y396 PolarHBondContact O-N 3.44Å; D394-Y396 WeakPolarHBondContact OD1-CB 3.42Å; D394-Y396 PolarHBondContact OD1-N 2.86Å; D394-K397 HydrophobicContact CB-CB 3.79Å; D394-K397 WeakPolarHBondContact O-CB 3.46Å; D394-K397 PolarHBondContact O-N 3.26Å; D394-K397 VanDerWaalsContact O-N 3.1Å; D394-K397 PolarHBondContact OD1-N 3.48Å; D394-K397 VanDerWaalsContact OD1-N 3.1Å; D394-I398 WeakPolarHBondContact O-CG1 3.43Å; D394-I398 PolarHBondContact O-N 2.89Å
395Y87.6Confident87Confident1 Ų182.4 Ų82.40%0.00440%0.398CS..Hα-helixtrans-59-31.7-179.3-59.3-59.9000113.5R393 I398 L399 Q444 A445 V448 F458 D463 M465R393-Y395 HydrophobicContact CB-CD1 4.49Å; R393-Y395 HydrophobicContact CB-CE1 3.98Å; R393-Y395 PolarHBondContact O-N 3.36Å; Y395-I398 HydrophobicContact CD1-CD1 4.17Å; Y395-L399 PolarHBondContact O-N 3.29Å; Y395-L399 VanDerWaalsContact O-N 3.16Å; Y395-Q444 HydrophobicContact CE1-CB 4.48Å; Y395-A445 VanDerWaalsContact CD1-CA 3.49Å; Y395-A445 HydrophobicContact CD1-CB 3.74Å; Y395-A445 HydrophobicContact CG-CB 4.25Å; Y395-V448 HydrophobicContact CD2-CB 4.07Å; Y395-V448 HydrophobicContact CD2-CG1 3.69Å; Y395-V448 HydrophobicContact CD2-CG2 4.35Å; Y395-V448 HydrophobicContact CE1-CG2 4.48Å; Y395-V448 HydrophobicContact CE2-CB 4.21Å; Y395-V448 HydrophobicContact CE2-CG1 3.88Å; Y395-V448 HydrophobicContact CE2-CG2 4Å; Y395-V448 HydrophobicContact CG-CB 4.41Å; Y395-V448 HydrophobicContact CG-CG1 4.44Å; Y395-F458 HydrophobicContact CD2-CD1 4.07Å; Y395-F458 AromaticContact CD2-CD2 3.5Å; Y395-F458 HydrophobicContact CD2-CD2 3.5Å; Y395-F458 AromaticContact CD2-CE1 3.89Å; Y395-F458 HydrophobicContact CD2-CE1 3.89Å; Y395-F458 AromaticContact CD2-CE2 3.31Å; Y395-F458 HydrophobicContact CD2-CE2 3.31Å; Y395-F458 AromaticContact CD2-CG 3.88Å; Y395-F458 HydrophobicContact CD2-CG 3.88Å; Y395-F458 AromaticContact CD2-CZ 3.53Å; Y395-F458 HydrophobicContact CD2-CZ 3.53Å; Y395-F458 AromaticContact CE2-CD2 3.56Å; Y395-F458 HydrophobicContact CE2-CD2 3.56Å; Y395-F458 AromaticContact CE2-CE2 3.49Å; Y395-F458 HydrophobicContact CE2-CE2 3.49Å; Y395-F458 VanDerWaalsContact CE2-CE2 3.49Å; Y395-F458 HydrophobicContact CE2-CG 4.28Å; Y395-F458 HydrophobicContact CE2-CZ 4.18Å; Y395-F458 HydrophobicContact CG-CE2 4.42Å; Y395-F458 HydrophobicContact CG-CZ 4.3Å; Y395-D463 WeakPolarHBondContact CE2-OD1 3.27Å; Y395-D463 VanDerWaalsContact OH-CG 3.29Å; Y395-D463 PolarHBondContact OH-OD1 2.91Å; Y395-D463 PolarHBondContact OH-OD2 3.35Å; Y395-M465 WeakPolarHBondContact OH-CB 3.45Å
396Y88Confident86.9Confident6 Ų681 Ų812%0.02440%0.398CS..Hα-helixtrans-70.2-40.9176.6-65.8-78.4000111D394 L399 G400 V401 R403 L449 R455 F458 D459D394-Y396 PolarHBondContact O-N 3.44Å; D394-Y396 WeakPolarHBondContact OD1-CB 3.42Å; D394-Y396 PolarHBondContact OD1-N 2.86Å; Y396-L399 PolarHBondContact O-N 3.08Å; Y396-G400 PolarHBondContact O-N 3.18Å; Y396-V401 WeakPolarHBondContact CB-O 3.29Å; Y396-V401 HydrophobicContact CD1-CG2 4.11Å; Y396-V401 PolarHBondContact O-N 2.77Å; Y396-R403 HydrophobicContact CD1-CG 4.39Å; Y396-R403 HydrophobicContact CD2-CG 3.83Å; Y396-R403 HydrophobicContact CE1-CB 4.46Å; Y396-R403 HydrophobicContact CE2-CG 3.99Å; Y396-R403 HydrophobicContact CG-CG 4.04Å; Y396-L449 HydrophobicContact CD1-CD1 3.69Å; Y396-L449 HydrophobicContact CD1-CD2 4.11Å; Y396-L449 HydrophobicContact CD2-CD2 4.2Å; Y396-L449 HydrophobicContact CE1-CD1 3.9Å; Y396-L449 HydrophobicContact CE1-CD2 3.62Å; Y396-L449 HydrophobicContact CE1-CG 4.37Å; Y396-L449 HydrophobicContact CE2-CD2 3.74Å; Y396-L449 HydrophobicContact CG-CD1 4.11Å; Y396-L449 HydrophobicContact CG-CD2 4.37Å; Y396-L449 VanDerWaalsContact CZ-CD2 3.43Å; Y396-R455 PolarHBondContact OH-NE 3.12Å; Y396-F458 HydrophobicContact CD2-CD1 4.26Å; Y396-F458 AromaticContact CD2-CE1 3.68Å; Y396-F458 HydrophobicContact CD2-CE1 3.68Å; Y396-F458 AromaticContact CE2-CD1 3.75Å; Y396-F458 HydrophobicContact CE2-CD1 3.75Å; Y396-F458 AromaticContact CE2-CE1 3.64Å; Y396-F458 HydrophobicContact CE2-CE1 3.64Å; Y396-D459 WeakPolarHBondContact CE2-OD1 3.48Å; Y396-D459 VanDerWaalsContact OH-CG 3.28Å; Y396-D459 PolarHBondContact OH-OD1 3.11Å; Y396-D459 PolarHBondContact OH-OD2 2.94Å; Y396-D459 VanDerWaalsContact OH-OD2 3.11Å
397K88.5Confident86.8Confident170 Ų17084.4 Ų84.474%0.73941%0.411SS*.Hα-helixtrans-66.3-39.5174.6-168.8177.5-180-178.50111.9D394 L399 G400D394-K397 HydrophobicContact CB-CB 3.79Å; D394-K397 WeakPolarHBondContact O-CB 3.46Å; D394-K397 PolarHBondContact O-N 3.26Å; D394-K397 VanDerWaalsContact O-N 3.1Å; D394-K397 PolarHBondContact OD1-N 3.48Å; D394-K397 VanDerWaalsContact OD1-N 3.1Å; K397-L399 PolarHBondContact O-N 3.34Å; K397-G400 PolarHBondContact O-N 3.17Å
398I88.3Confident86.8Confident52 Ų5291.4 Ų91.427%0.26744%0.44SS..Hα-helixtrans-59.7-45176.6-69.8164.8000111.2R393 D394 Y395 D441 I442 A445R393-I398 HydrophobicContact CB-CD1 4.35Å; D394-I398 WeakPolarHBondContact O-CG1 3.43Å; D394-I398 PolarHBondContact O-N 2.89Å; Y395-I398 HydrophobicContact CD1-CD1 4.17Å; I398-D441 HydrophobicContact CD1-CB 4.42Å; I398-D441 HydrophobicContact CG2-CB 4.29Å; I398-I442 HydrophobicContact CG2-CG2 3.86Å; I398-A445 HydrophobicContact CB-CB 4.25Å; I398-A445 HydrophobicContact CG2-CB 3.94Å
399L88.9Confident87Confident5 Ų590.1 Ų90.13%0.02644%0.436CS..Hα-helixtrans-85.8-6.5177.9-71.6179.2000114.2Y395 Y396 K397 V401 I410 L417 I442 A445 K446 L449Y395-L399 PolarHBondContact O-N 3.29Å; Y395-L399 VanDerWaalsContact O-N 3.16Å; Y396-L399 PolarHBondContact O-N 3.08Å; K397-L399 PolarHBondContact O-N 3.34Å; L399-V401 VanDerWaalsContact C-N 3.32Å; L399-V401 HydrophobicContact CB-CG2 3.97Å; L399-V401 PolarHBondContact O-N 3.35Å; L399-I410 HydrophobicContact CD1-CG2 3.83Å; L399-L417 HydrophobicContact CD2-CD1 3.92Å; L399-I442 HydrophobicContact CD2-CB 4.1Å; L399-I442 HydrophobicContact CD2-CG2 4.33Å; L399-A445 HydrophobicContact CD1-CB 3.82Å; L399-A445 HydrophobicContact CD2-CB 4.4Å; L399-A445 HydrophobicContact CG-CB 3.7Å; L399-K446 HydrophobicContact CD1-CB 4.47Å; L399-L449 HydrophobicContact CD1-CD1 4.21Å
400G89.3Confident87.4Confident69 Ų6983.7 Ų83.771%0.71141%0.406SS*.THydrogen-bonded Turntrans65.930.9-179.200000113.8Y396 K397Y396-G400 PolarHBondContact O-N 3.18Å; K397-G400 PolarHBondContact O-N 3.17Å
401V90.6Very high87.7Confident28 Ų2882.7 Ų82.717%0.1740%0.395CS..  trans-113.7152.2-177.2-66.60000111Y396 L399 A405 I410 A413 L449Y396-V401 WeakPolarHBondContact CB-O 3.29Å; Y396-V401 HydrophobicContact CD1-CG2 4.11Å; Y396-V401 PolarHBondContact O-N 2.77Å; L399-V401 VanDerWaalsContact C-N 3.32Å; L399-V401 HydrophobicContact CB-CG2 3.97Å; L399-V401 PolarHBondContact O-N 3.35Å; V401-A405 HydrophobicContact CB-CB 3.86Å; V401-A405 HydrophobicContact CG2-CB 4.32Å; V401-I410 HydrophobicContact CG2-CG1 4.32Å; V401-A413 HydrophobicContact CG1-CB 3.55Å; V401-L449 HydrophobicContact CG2-CD1 4.37Å
402K89.6Confident88.2Confident167 Ų16786.7 Ų86.773%0.72641%0.405SS*.  trans-71.5155.1175.9-64.9-176.3179.6-178.50110.4T404 A405K402-T404 PolarHBondContact O-N 3.01Å; K402-T404 VanDerWaalsContact O-N 3.11Å; K402-A405 WeakPolarHBondContact O-CB 3.46Å; K402-A405 PolarHBondContact O-N 3.38Å
403R86.8Confident88.9Confident153 Ų15382.6 Ų82.658%0.57739%0.394SS*.THydrogen-bonded Turntrans-57.1-26.9173.4-68.5-168.5175.2-164.2-0.7113.6Y396 A405 R455Y396-R403 HydrophobicContact CD1-CG 4.39Å; Y396-R403 HydrophobicContact CD2-CG 3.83Å; Y396-R403 HydrophobicContact CE1-CB 4.46Å; Y396-R403 HydrophobicContact CE2-CG 3.99Å; Y396-R403 HydrophobicContact CG-CG 4.04Å; R403-A405 VanDerWaalsContact C-N 3.29Å; R403-A405 PolarHBondContact O-N 3.07Å; R403-R455 PolarHBondContact O-NH2 3.19Å
404T88.8Confident89.6Confident122 Ų12281 Ų8175%0.74839%0.388SS*.THydrogen-bonded Turntrans-83.22.7175.961.10000114K402K402-T404 PolarHBondContact O-N 3.01Å; K402-T404 VanDerWaalsContact O-N 3.11Å
405A88.9Confident90Very high4 Ų486.5 Ų86.53%0.03341%0.405CS..  trans-64137.5-173.800000112V401 K402 R403 E409 I410 R455V401-A405 HydrophobicContact CB-CB 3.86Å; V401-A405 HydrophobicContact CG2-CB 4.32Å; K402-A405 WeakPolarHBondContact O-CB 3.46Å; K402-A405 PolarHBondContact O-N 3.38Å; R403-A405 VanDerWaalsContact C-N 3.29Å; R403-A405 PolarHBondContact O-N 3.07Å; A405-E409 VanDerWaalsContact CA-OE2 3.3Å; A405-E409 WeakPolarHBondContact CA-OE2 3.47Å; A405-E409 HydrophobicContact CB-CB 4.4Å; A405-I410 HydrophobicContact CB-CG1 4.13Å; A405-R455 PolarHBondContact O-NH1 3.33Å; A405-R455 PolarHBondContact O-NH2 3.34Å
406Q90.6Very high90.2Very high138 Ų13893.7 Ų93.765%0.64544%0.436SS*.  trans-78.6156.9178-64-172.26.600111K408 E409 I410Q406-K408 PolarHBondContact O-N 2.93Å; Q406-E409 PolarHBondContact N-OE2 3.29Å; Q406-E409 WeakPolarHBondContact O-CA 3.17Å; Q406-E409 WeakPolarHBondContact O-CB 3.49Å; Q406-E409 PolarHBondContact O-N 3.16Å; Q406-I410 PolarHBondContact O-N 3.34Å; Q406-I410 VanDerWaalsContact O-N 3.1Å
407K90.6Very high90.4Very high113 Ų11395 Ų9549%0.49144%0.443SS..Hα-helixtrans-50.3-38.2-179.9-174.9168179.1152.80113.2I410 I411 T450K407-I410 PolarHBondContact O-N 3.22Å; K407-I411 HydrophobicContact CG-CD1 4.01Å; K407-I411 VanDerWaalsContact O-CG1 3.29Å; K407-I411 WeakPolarHBondContact O-CG1 3.36Å; K407-I411 PolarHBondContact O-N 3.41Å; K407-T450 WeakPolarHBondContact CE-O 3.45Å; K407-T450 HydrophobicContact CG-CG2 4.25Å; K407-T450 PolarHBondContact NZ-O 3.25Å
408K91Very high90.5Very high177 Ų17787.5 Ų87.577%0.7741%0.413SS*.Hα-helixtrans-65.1-37.1177.7-167.9177.1-178.31790112.8Q406 R412Q406-K408 PolarHBondContact O-N 2.93Å; K408-R412 WeakPolarHBondContact O-CB 3.43Å; K408-R412 PolarHBondContact O-N 3.44Å; K408-R412 VanDerWaalsContact O-N 3.11Å
409E90.8Very high90.7Very high108 Ų10892.3 Ų92.351%0.50543%0.434SS..Hα-helixtrans-72.2-40.8178.6-61.7176.3153.800111.2A405 Q406 R412 A413A405-E409 VanDerWaalsContact CA-OE2 3.3Å; A405-E409 WeakPolarHBondContact CA-OE2 3.47Å; A405-E409 HydrophobicContact CB-CB 4.4Å; Q406-E409 PolarHBondContact N-OE2 3.29Å; Q406-E409 WeakPolarHBondContact O-CA 3.17Å; Q406-E409 WeakPolarHBondContact O-CB 3.49Å; Q406-E409 PolarHBondContact O-N 3.16Å; E409-R412 PolarHBondContact O-N 3.49Å; E409-A413 WeakPolarHBondContact O-CB 3.45Å; E409-A413 PolarHBondContact O-N 2.92Å
410I91.3Very high90.7Very high0 Ų097.2 Ų97.20%046%0.457CS..Hα-helixtrans-59.9-47.6175.1-65.2159.5000110.6L399 V401 A405 Q406 K407 R412 A413 Y414 L449 T450L399-I410 HydrophobicContact CD1-CG2 3.83Å; V401-I410 HydrophobicContact CG2-CG1 4.32Å; A405-I410 HydrophobicContact CB-CG1 4.13Å; Q406-I410 PolarHBondContact O-N 3.34Å; Q406-I410 VanDerWaalsContact O-N 3.1Å; K407-I410 PolarHBondContact O-N 3.22Å; I410-R412 VanDerWaalsContact C-N 3.3Å; I410-R412 PolarHBondContact O-N 2.99Å; I410-A413 PolarHBondContact O-N 3.23Å; I410-Y414 WeakPolarHBondContact O-CB 3.43Å; I410-Y414 PolarHBondContact O-N 3.31Å; I410-L449 HydrophobicContact CD1-CB 3.99Å; I410-L449 HydrophobicContact CG2-CB 3.94Å; I410-T450 HydrophobicContact CB-CG2 4.39Å; I410-T450 HydrophobicContact CG2-CG2 3.73Å
411I91.2Very high90.8Very high48 Ų4896.8 Ų96.825%0.24643%0.434CS..Hα-helixtrans-63.5-37.7177.6-67166.6000111.2K407 R415 T450K407-I411 HydrophobicContact CG-CD1 4.01Å; K407-I411 VanDerWaalsContact O-CG1 3.29Å; K407-I411 WeakPolarHBondContact O-CG1 3.36Å; K407-I411 PolarHBondContact O-N 3.41Å; I411-R415 WeakPolarHBondContact O-CG 3.26Å; I411-R415 PolarHBondContact O-N 2.9Å; I411-T450 HydrophobicContact CD1-CG2 4.48Å; I411-T450 HydrophobicContact CG1-CG2 3.92Å
412R92.1Very high90.9Very high202 Ų20298.2 Ų98.276%0.76244%0.439SS*.Hα-helixtrans-66.5-43.7177.3-171.8-179.8-175.6178.51.9111.7K408 E409 I410 R415 K416K408-R412 WeakPolarHBondContact O-CB 3.43Å; K408-R412 PolarHBondContact O-N 3.44Å; K408-R412 VanDerWaalsContact O-N 3.11Å; E409-R412 PolarHBondContact O-N 3.49Å; I410-R412 VanDerWaalsContact C-N 3.3Å; I410-R412 PolarHBondContact O-N 2.99Å; R412-R415 PolarHBondContact O-N 3.15Å; R412-K416 PolarHBondContact O-N 3.1Å
413A91.1Very high90.8Very high20 Ų2090.6 Ų90.617%0.16541%0.406CS..Hα-helixtrans-63.2-45.117600000111.4V401 E409 I410 R415 K416 L417V401-A413 HydrophobicContact CG1-CB 3.55Å; E409-A413 WeakPolarHBondContact O-CB 3.45Å; E409-A413 PolarHBondContact O-N 2.92Å; I410-A413 PolarHBondContact O-N 3.23Å; A413-R415 PolarHBondContact O-N 3.32Å; A413-K416 PolarHBondContact O-N 2.91Å; A413-L417 PolarHBondContact O-N 3.42Å
414Y93.6Very high90.8Very high59 Ų5988.7 Ų88.723%0.23141%0.407CS..Hα-helixtrans-56.1-51.7173.9167.4-103.4000112.2I410 K416 L417 A418 A443 K446I410-Y414 WeakPolarHBondContact O-CB 3.43Å; I410-Y414 PolarHBondContact O-N 3.31Å; Y414-K416 VanDerWaalsContact C-N 3.26Å; Y414-K416 PolarHBondContact O-N 3.16Å; Y414-L417 PolarHBondContact O-N 3.49Å; Y414-A418 HydrophobicContact CD2-CB 4.39Å; Y414-A418 HydrophobicContact CE1-CB 4.39Å; Y414-A418 HydrophobicContact CE2-CB 4Å; Y414-A418 WeakPolarHBondContact O-CB 3.33Å; Y414-A418 PolarHBondContact O-N 2.8Å; Y414-A443 HydrophobicContact CE2-CB 4.38Å; Y414-K446 HydrophobicContact CD1-CB 4.5Å; Y414-K446 HydrophobicContact CD1-CG 4.05Å; Y414-K446 HydrophobicContact CD2-CB 3.61Å; Y414-K446 HydrophobicContact CD2-CG 4.08Å; Y414-K446 HydrophobicContact CE2-CB 4.2Å; Y414-K446 HydrophobicContact CG-CB 3.77Å; Y414-K446 HydrophobicContact CG-CG 3.77Å
415R91.9Very high90.6Very high174 Ų17487.4 Ų87.466%0.65740%0.396SS*.Hα-helixtrans-57.3-41.2-179.2-75.6178-174.7177.51112.2I411 R412 A413 Q419I411-R415 WeakPolarHBondContact O-CG 3.26Å; I411-R415 PolarHBondContact O-N 2.9Å; R412-R415 PolarHBondContact O-N 3.15Å; A413-R415 PolarHBondContact O-N 3.32Å; R415-Q419 WeakPolarHBondContact O-CB 3.34Å; R415-Q419 PolarHBondContact O-N 2.99Å; R415-Q419 VanDerWaalsContact O-N 3.08Å
416K93.2Very high90.7Very high153 Ų15389.4 Ų89.467%0.66540%0.404SS*.Hα-helixtrans-64.7-47.8178.3-173.8-178.4177.3-174.50111.5R412 A413 Y414 Q420R412-K416 PolarHBondContact O-N 3.1Å; A413-K416 PolarHBondContact O-N 2.91Å; Y414-K416 VanDerWaalsContact C-N 3.26Å; Y414-K416 PolarHBondContact O-N 3.16Å; K416-Q420 WeakPolarHBondContact O-CB 3.26Å; K416-Q420 PolarHBondContact O-N 3.48Å; K416-Q420 VanDerWaalsContact O-N 3.15Å
417L91.7Very high90.3Very high34 Ų3492.2 Ų92.218%0.17842%0.417CS..Hα-helixtrans-71.4-36.7-179.1-71.7168.7000112.5L399 A413 Y414 Q420 W421 I442L399-L417 HydrophobicContact CD2-CD1 3.92Å; A413-L417 PolarHBondContact O-N 3.42Å; Y414-L417 PolarHBondContact O-N 3.49Å; L417-Q420 PolarHBondContact O-N 3.28Å; L417-W421 WeakPolarHBondContact O-CB 2.87Å; L417-W421 PolarHBondContact O-N 3.49Å; L417-I442 HydrophobicContact CB-CD1 4.19Å; L417-I442 HydrophobicContact CB-CG2 4.19Å; L417-I442 HydrophobicContact CD1-CG2 4.32Å
418A90.9Very high90.3Very high12 Ų1290.7 Ų90.710%0.09942%0.415CS..Hα-helixtrans-65.3-40.1176.700000111.4Y414 Q420 H422 F439 I442Y414-A418 HydrophobicContact CD2-CB 4.39Å; Y414-A418 HydrophobicContact CE1-CB 4.39Å; Y414-A418 HydrophobicContact CE2-CB 4Å; Y414-A418 WeakPolarHBondContact O-CB 3.33Å; Y414-A418 PolarHBondContact O-N 2.8Å; A418-Q420 VanDerWaalsContact C-N 3.34Å; A418-H422 WeakPolarHBondContact O-CB 3.36Å; A418-H422 PolarHBondContact O-N 2.82Å; A418-H422 VanDerWaalsContact O-N 3.14Å; A418-F439 HydrophobicContact CB-CE2 3.84Å; A418-F439 HydrophobicContact CB-CZ 4.46Å; A418-F439 WeakPolarHBondContact O-CE2 3.5Å; A418-I442 HydrophobicContact CB-CD1 4.09Å
419Q91.3Very high90.1Very high153 Ų15387.1 Ų87.172%0.71541%0.409SS*.Hα-helixtrans-66.6-36.4173.4-172.8178.17.100112.1R415 N425R415-Q419 WeakPolarHBondContact O-CB 3.34Å; R415-Q419 PolarHBondContact O-N 2.99Å; R415-Q419 VanDerWaalsContact O-N 3.08Å; Q419-N425 PolarHBondContact O-ND2 3.09Å
420Q90.4Very high89.8Confident107 Ų10787.6 Ų87.650%0.541%0.411SS..Hα-helixtrans-72.5-45.6-179.3-176.4177.16.800112.4K416 L417 A418 N425K416-Q420 WeakPolarHBondContact O-CB 3.26Å; K416-Q420 PolarHBondContact O-N 3.48Å; K416-Q420 VanDerWaalsContact O-N 3.15Å; L417-Q420 PolarHBondContact O-N 3.28Å; A418-Q420 VanDerWaalsContact C-N 3.34Å; Q420-N425 PolarHBondContact O-ND2 3.18Å; Q420-N425 VanDerWaalsContact O-ND2 3.09Å
421W91.1Very high89.6Confident60 Ų6092.7 Ų92.723%0.22744%0.435CS..SBendtrans-9817.4-174.2-68.4100.7000113.5L417 F426 A435 K438 I442L417-W421 WeakPolarHBondContact O-CB 2.87Å; L417-W421 PolarHBondContact O-N 3.49Å; W421-F426 HydrophobicContact CE3-CE2 4.24Å; W421-F426 AromaticContact CE3-CZ 3.83Å; W421-F426 HydrophobicContact CE3-CZ 3.83Å; W421-F426 HydrophobicContact CZ3-CE1 4.48Å; W421-F426 AromaticContact CZ3-CZ 3.99Å; W421-F426 HydrophobicContact CZ3-CZ 3.99Å; W421-A435 HydrophobicContact CE3-CB 4.1Å; W421-K438 HydrophobicContact CD2-CB 4.25Å; W421-K438 HydrophobicContact CD2-CD 3.73Å; W421-K438 HydrophobicContact CE3-CB 4.29Å; W421-K438 HydrophobicContact CE3-CD 3.65Å; W421-K438 HydrophobicContact CG-CB 4.38Å; W421-K438 HydrophobicContact CH2-CD 3.74Å; W421-K438 HydrophobicContact CZ2-CD 3.78Å; W421-K438 VanDerWaalsContact CZ2-NZ 3.25Å; W421-K438 HydrophobicContact CZ3-CD 3.65Å; W421-I442 HydrophobicContact CB-CD1 4.47Å
422H91.4Very high89.5Confident59 Ų5994 Ų9427%0.27344%0.439SS..  trans-62.1131.1175.1-161.5-92.2000110A418 D424 N425 F426 F439A418-H422 WeakPolarHBondContact O-CB 3.36Å; A418-H422 PolarHBondContact O-N 2.82Å; A418-H422 VanDerWaalsContact O-N 3.14Å; H422-D424 IonicContact CE1-OD2 3.59Å; H422-D424 PolarHBondContact CE1-OD2 2.78Å; H422-D424 WeakPolarHBondContact ND1-CB 3.45Å; H422-D424 PolarHBondContact ND1-N 2.9Å; H422-D424 IonicContact ND1-OD2 2.71Å; H422-D424 PolarHBondContact ND1-OD2 3.47Å; H422-D424 PolarHBondContact O-N 3.12Å; H422-N425 WeakPolarHBondContact O-CB 3.47Å; H422-N425 PolarHBondContact O-N 2.67Å; H422-F426 WeakPolarHBondContact O-CD2 3.47Å; H422-F439 AromaticContact CD2-CE2 3.79Å
423P87.8Confident89.3Confident6 Ų690.9 Ų90.94%0.03943%0.431CS..G310 helixtrans-56.1-27.6-177.1-2936.7000114.5N425 F426 K432 E436P423-N425 PolarHBondContact O-N 2.71Å; P423-F426 PolarHBondContact O-N 3.35Å; P423-K432 HydrophobicContact CB-CG 4.18Å; P423-E436 HydrophobicContact CB-CG 3.79Å; P423-E436 HydrophobicContact CG-CB 4.46Å; P423-E436 HydrophobicContact CG-CG 3.52Å
424D87.1Confident89.1Confident113 Ų11396.5 Ų96.560%0.60445%0.452SS*.G310 helixtrans-68.8-15.2177.8-63-15.7000113.9H422 F426H422-D424 IonicContact CE1-OD2 3.59Å; H422-D424 PolarHBondContact CE1-OD2 2.78Å; H422-D424 WeakPolarHBondContact ND1-CB 3.45Å; H422-D424 PolarHBondContact ND1-N 2.9Å; H422-D424 IonicContact ND1-OD2 2.71Å; H422-D424 PolarHBondContact ND1-OD2 3.47Å; H422-D424 PolarHBondContact O-N 3.12Å; D424-F426 VanDerWaalsContact C-N 3.26Å; D424-F426 PolarHBondContact O-N 3.16Å
425N85.9Confident88.7Confident95 Ų9593.7 Ų93.751%0.50844%0.441SS..G310 helixtrans-78.7-10.7177.2-64-17.5000113Q419 Q420 H422 P423Q419-N425 PolarHBondContact O-ND2 3.09Å; Q420-N425 PolarHBondContact O-ND2 3.18Å; Q420-N425 VanDerWaalsContact O-ND2 3.09Å; H422-N425 WeakPolarHBondContact O-CB 3.47Å; H422-N425 PolarHBondContact O-N 2.67Å; P423-N425 PolarHBondContact O-N 2.71Å
426F89.6Confident88.5Confident47 Ų4789.1 Ų89.121%0.20643%0.427CS..  trans-118.8123.6-173.9-56.2-88.9000110.2W421 H422 P423 D424 E431 K432 A435W421-F426 HydrophobicContact CE3-CE2 4.24Å; W421-F426 AromaticContact CE3-CZ 3.83Å; W421-F426 HydrophobicContact CE3-CZ 3.83Å; W421-F426 HydrophobicContact CZ3-CE1 4.48Å; W421-F426 AromaticContact CZ3-CZ 3.99Å; W421-F426 HydrophobicContact CZ3-CZ 3.99Å; H422-F426 WeakPolarHBondContact O-CD2 3.47Å; P423-F426 PolarHBondContact O-N 3.35Å; D424-F426 VanDerWaalsContact C-N 3.26Å; D424-F426 PolarHBondContact O-N 3.16Å; F426-E431 HydrophobicContact CB-CB 4.3Å; F426-E431 HydrophobicContact CD1-CB 4.11Å; F426-K432 HydrophobicContact CB-CB 4.28Å; F426-A435 HydrophobicContact CD2-CB 3.32Å; F426-A435 HydrophobicContact CE2-CB 3.34Å; F426-A435 HydrophobicContact CG-CB 4.04Å; F426-A435 HydrophobicContact CZ-CB 4.07Å
427Q82.1Confident88.3Confident197 Ų19788.4 Ų88.492%0.92142%0.424SS*.  trans-91.9-26.4-178.8-64.2-179.31.800112.6
428D91.7Very high88.1Confident81 Ų8191.3 Ų91.343%0.43344%0.435SS..SBendtrans-75.8130.8177.2-174.5-63.6000110.7E430 E431 K432D428-E430 VanDerWaalsContact C-N 3.35Å; D428-E430 PolarHBondContact O-N 3.11Å; D428-E430 WeakPolarHBondContact OD1-CB 3.41Å; D428-E430 PolarHBondContact OD1-N 3.41Å; D428-E431 HydrophobicContact CB-CB 4.1Å; D428-E431 HydrophobicContact CB-CG 4.03Å; D428-E431 PolarHBondContact O-N 3.12Å; D428-E431 PolarHBondContact OD1-N 2.89Å; D428-K432 VanDerWaalsContact O-CB 3.25Å; D428-K432 WeakPolarHBondContact O-CB 3.49Å; D428-K432 PolarHBondContact O-N 2.99Å
429P85.3Confident88.1Confident102 Ų10293.2 Ų93.266%0.66244%0.441SS*.Hα-helixtrans-58-37.8-179.7-25.334.3000115.2K433P429-K433 WeakPolarHBondContact O-CB 3.43Å; P429-K433 PolarHBondContact O-N 3.46Å; P429-K433 VanDerWaalsContact O-N 3.11Å
430E85.2Confident87.9Confident117 Ų11790.3 Ų90.355%0.54743%0.43SS..Hα-helixtrans-74.6-38.9179.9-79.1-65.5140.300111.3D428 K434D428-E430 VanDerWaalsContact C-N 3.35Å; D428-E430 PolarHBondContact O-N 3.11Å; D428-E430 WeakPolarHBondContact OD1-CB 3.41Å; D428-E430 PolarHBondContact OD1-N 3.41Å; E430-K434 WeakPolarHBondContact O-CG 3.29Å; E430-K434 PolarHBondContact O-N 3.24Å
431E87.3Confident87.8Confident108 Ų10886.7 Ų86.751%0.50541%0.414SS..Hα-helixtrans-69.2-39.2174.6-63.6-163.4154.500112F426 D428 K433 K434 A435F426-E431 HydrophobicContact CB-CB 4.3Å; F426-E431 HydrophobicContact CD1-CB 4.11Å; D428-E431 HydrophobicContact CB-CB 4.1Å; D428-E431 HydrophobicContact CB-CG 4.03Å; D428-E431 PolarHBondContact O-N 3.12Å; D428-E431 PolarHBondContact OD1-N 2.89Å; E431-K433 VanDerWaalsContact C-N 3.34Å; E431-K433 PolarHBondContact O-N 3.33Å; E431-K434 PolarHBondContact O-N 3.46Å; E431-A435 WeakPolarHBondContact O-CB 3.12Å; E431-A435 PolarHBondContact O-N 3.34Å
432K88.5Confident87.9Confident76 Ų7684.1 Ų84.133%0.3340%0.404SS..Hα-helixtrans-60-44.3175.5-173.5173.6-178.31750111.4P423 F426 D428 K434 A435 E436P423-K432 HydrophobicContact CB-CG 4.18Å; F426-K432 HydrophobicContact CB-CB 4.28Å; D428-K432 VanDerWaalsContact O-CB 3.25Å; D428-K432 WeakPolarHBondContact O-CB 3.49Å; D428-K432 PolarHBondContact O-N 2.99Å; K432-K434 VanDerWaalsContact C-N 3.35Å; K432-K434 PolarHBondContact O-N 3.11Å; K432-A435 PolarHBondContact O-N 3.45Å; K432-E436 WeakPolarHBondContact O-CB 3.44Å; K432-E436 WeakPolarHBondContact O-CG 3.45Å; K432-E436 PolarHBondContact O-N 2.82Å
433K88.1Confident87.8Confident135 Ų13582.9 Ų82.959%0.58740%0.404SS*.Hα-helixtrans-62.4-38.8175.8-169.2177.7-178.2-178.50112.7P429 E431 K437P429-K433 WeakPolarHBondContact O-CB 3.43Å; P429-K433 PolarHBondContact O-N 3.46Å; P429-K433 VanDerWaalsContact O-N 3.11Å; E431-K433 VanDerWaalsContact C-N 3.34Å; E431-K433 PolarHBondContact O-N 3.33Å; K433-K437 PolarHBondContact O-N 3.47Å
434K86.9Confident87.9Confident138 Ų13885.1 Ų85.160%0.641%0.414SS*.Hα-helixtrans-66.9-40.6173.7-72.5175.1-176171.80112E430 E431 K432 K437 K438E430-K434 WeakPolarHBondContact O-CG 3.29Å; E430-K434 PolarHBondContact O-N 3.24Å; E431-K434 PolarHBondContact O-N 3.46Å; K432-K434 VanDerWaalsContact C-N 3.35Å; K432-K434 PolarHBondContact O-N 3.11Å; K434-K437 PolarHBondContact O-N 3.29Å; K434-K438 PolarHBondContact O-N 3.28Å; K434-K438 VanDerWaalsContact O-N 3.13Å
435A86Confident88Confident0 Ų079.7 Ų79.70%039%0.385CS..Hα-helixtrans-66.2-41.817700000111.8W421 F426 E431 K432 K437 K438 F439W421-A435 HydrophobicContact CE3-CB 4.1Å; F426-A435 HydrophobicContact CD2-CB 3.32Å; F426-A435 HydrophobicContact CE2-CB 3.34Å; F426-A435 HydrophobicContact CG-CB 4.04Å; F426-A435 HydrophobicContact CZ-CB 4.07Å; E431-A435 WeakPolarHBondContact O-CB 3.12Å; E431-A435 PolarHBondContact O-N 3.34Å; K432-A435 PolarHBondContact O-N 3.45Å; A435-K437 PolarHBondContact O-N 3.18Å; A435-K438 PolarHBondContact O-N 2.88Å; A435-F439 VanDerWaalsContact O-CB 3.31Å; A435-F439 WeakPolarHBondContact O-CB 3.44Å; A435-F439 PolarHBondContact O-N 3.4Å
436E88.1Confident88.3Confident78 Ų7878.6 Ų78.636%0.36438%0.376SS..Hα-helixtrans-57-48173.7-77171.7-173.500111.8P423 K432 K438 F439 I440P423-E436 HydrophobicContact CB-CG 3.79Å; P423-E436 HydrophobicContact CG-CB 4.46Å; P423-E436 HydrophobicContact CG-CG 3.52Å; K432-E436 WeakPolarHBondContact O-CB 3.44Å; K432-E436 WeakPolarHBondContact O-CG 3.45Å; K432-E436 PolarHBondContact O-N 2.82Å; E436-K438 PolarHBondContact O-N 2.94Å; E436-F439 PolarHBondContact O-N 3.18Å; E436-I440 VanDerWaalsContact O-CG1 3.31Å; E436-I440 WeakPolarHBondContact O-CG1 3.46Å; E436-I440 PolarHBondContact O-N 3.5Å
437K88.2Confident88.4Confident139 Ų13981.7 Ų81.760%0.60439%0.391SS*.Hα-helixtrans-58.6-47176.5-171.3176.9178.9179.40111.6K433 K434 A435 F439 I440 D441K433-K437 PolarHBondContact O-N 3.47Å; K434-K437 PolarHBondContact O-N 3.29Å; A435-K437 PolarHBondContact O-N 3.18Å; K437-F439 VanDerWaalsContact C-N 3.33Å; K437-F439 PolarHBondContact O-N 2.76Å; K437-I440 PolarHBondContact O-N 2.85Å; K437-D441 VanDerWaalsContact O-CG 3.3Å; K437-D441 PolarHBondContact O-N 3.49Å; K437-D441 VanDerWaalsContact O-N 3.08Å
438K86.9Confident88.8Confident95 Ų9572.3 Ų72.341%0.41335%0.347SS..Hα-helixtrans-64.4-36.3176.7-75.1-171.8177.7-1760112.8W421 K434 A435 E436 I440 D441 I442W421-K438 HydrophobicContact CD2-CB 4.25Å; W421-K438 HydrophobicContact CD2-CD 3.73Å; W421-K438 HydrophobicContact CE3-CB 4.29Å; W421-K438 HydrophobicContact CE3-CD 3.65Å; W421-K438 HydrophobicContact CG-CB 4.38Å; W421-K438 HydrophobicContact CH2-CD 3.74Å; W421-K438 HydrophobicContact CZ2-CD 3.78Å; W421-K438 VanDerWaalsContact CZ2-NZ 3.25Å; W421-K438 HydrophobicContact CZ3-CD 3.65Å; K434-K438 PolarHBondContact O-N 3.28Å; K434-K438 VanDerWaalsContact O-N 3.13Å; A435-K438 PolarHBondContact O-N 2.88Å; E436-K438 PolarHBondContact O-N 2.94Å; K438-I440 VanDerWaalsContact C-N 3.35Å; K438-D441 PolarHBondContact O-N 3.32Å; K438-I442 WeakPolarHBondContact O-CG1 3.41Å; K438-I442 WeakPolarHBondContact O-CG2 3.37Å; K438-I442 PolarHBondContact O-N 3.35Å
439F91.1Very high88.7Confident51 Ų5168.6 Ų68.622%0.22433%0.327CS..Hα-helixtrans-66.3-38.2178.4-168.3-90.9000111.8A418 H422 A435 E436 K437 I442 A443A418-F439 HydrophobicContact CB-CE2 3.84Å; A418-F439 HydrophobicContact CB-CZ 4.46Å; A418-F439 WeakPolarHBondContact O-CE2 3.5Å; H422-F439 AromaticContact CD2-CE2 3.79Å; A435-F439 VanDerWaalsContact O-CB 3.31Å; A435-F439 WeakPolarHBondContact O-CB 3.44Å; A435-F439 PolarHBondContact O-N 3.4Å; E436-F439 PolarHBondContact O-N 3.18Å; K437-F439 VanDerWaalsContact C-N 3.33Å; K437-F439 PolarHBondContact O-N 2.76Å; F439-I442 HydrophobicContact CD2-CD1 3.92Å; F439-I442 HydrophobicContact CE2-CD1 4.48Å; F439-I442 HydrophobicContact CG-CD1 4.4Å; F439-I442 WeakPolarHBondContact O-CG1 3.25Å; F439-A443 WeakPolarHBondContact O-CB 3.01Å; F439-A443 PolarHBondContact O-N 3.32Å; F439-A443 VanDerWaalsContact O-N 3.15Å
440I88.1Confident88.9Confident93 Ų9364.4 Ų64.448%0.47730%0.3SS..Hα-helixtrans-63.9-47.7172.6-65.9163000110.1E436 K437 K438 I442 A443 Q444E436-I440 VanDerWaalsContact O-CG1 3.31Å; E436-I440 WeakPolarHBondContact O-CG1 3.46Å; E436-I440 PolarHBondContact O-N 3.5Å; K437-I440 PolarHBondContact O-N 2.85Å; K438-I440 VanDerWaalsContact C-N 3.35Å; I440-I442 PolarHBondContact O-N 2.85Å; I440-A443 PolarHBondContact O-N 3.35Å; I440-Q444 HydrophobicContact CG2-CG 4.44Å; I440-Q444 WeakPolarHBondContact O-CG 3.25Å; I440-Q444 PolarHBondContact O-N 2.99Å
441D88.4Confident89.2Confident31 Ų3161.9 Ų61.917%0.16629%0.29CS..Hα-helixtrans-61.4-42-178.5-66.4-23.5000112.4R393 I398 K437 K438 A445R393-D441 IonicContact CZ-OD1 3.83Å; R393-D441 IonicContact NH1-OD1 3.42Å; R393-D441 PolarHBondContact NH1-OD1 2.93Å; R393-D441 IonicContact NH2-OD1 3.81Å; I398-D441 HydrophobicContact CD1-CB 4.42Å; I398-D441 HydrophobicContact CG2-CB 4.29Å; K437-D441 VanDerWaalsContact O-CG 3.3Å; K437-D441 PolarHBondContact O-N 3.49Å; K437-D441 VanDerWaalsContact O-N 3.08Å; K438-D441 PolarHBondContact O-N 3.32Å; D441-A445 VanDerWaalsContact O-CB 3.31Å; D441-A445 WeakPolarHBondContact O-CB 3.41Å; D441-A445 PolarHBondContact O-N 3.3Å
442I91.8Very high89.2Confident6 Ų661.1 Ų61.13%0.03130%0.295CS..Hα-helixtrans-68.9-32.7176.861.5-178.2000112.7I398 L399 L417 A418 W421 K438 F439 I440 K446I398-I442 HydrophobicContact CG2-CG2 3.86Å; L399-I442 HydrophobicContact CD2-CB 4.1Å; L399-I442 HydrophobicContact CD2-CG2 4.33Å; L417-I442 HydrophobicContact CB-CD1 4.19Å; L417-I442 HydrophobicContact CB-CG2 4.19Å; L417-I442 HydrophobicContact CD1-CG2 4.32Å; A418-I442 HydrophobicContact CB-CD1 4.09Å; W421-I442 HydrophobicContact CB-CD1 4.47Å; K438-I442 WeakPolarHBondContact O-CG1 3.41Å; K438-I442 WeakPolarHBondContact O-CG2 3.37Å; K438-I442 PolarHBondContact O-N 3.35Å; F439-I442 HydrophobicContact CD2-CD1 3.92Å; F439-I442 HydrophobicContact CE2-CD1 4.48Å; F439-I442 HydrophobicContact CG-CD1 4.4Å; F439-I442 WeakPolarHBondContact O-CG1 3.25Å; I440-I442 PolarHBondContact O-N 2.85Å; I442-K446 PolarHBondContact O-N 3.07Å
443A90.5Very high89.2Confident33 Ų3364.2 Ų64.227%0.27331%0.31SS..Hα-helixtrans-69.5-46.4177.700000110.8Y414 F439 I440 A445 K446 E447Y414-A443 HydrophobicContact CE2-CB 4.38Å; F439-A443 WeakPolarHBondContact O-CB 3.01Å; F439-A443 PolarHBondContact O-N 3.32Å; F439-A443 VanDerWaalsContact O-N 3.15Å; I440-A443 PolarHBondContact O-N 3.35Å; A443-A445 PolarHBondContact O-N 3.1Å; A443-K446 PolarHBondContact O-N 3.07Å; A443-E447 PolarHBondContact O-N 2.87Å
444Q88.9Confident89.1Confident52 Ų5260.9 Ų60.924%0.24330%0.297CS..Hα-helixtrans-60.2-44.2173.5-70.6-179-11.200111.6Y395 I440 K446 E447 V448 M465Y395-Q444 HydrophobicContact CE1-CB 4.48Å; I440-Q444 HydrophobicContact CG2-CG 4.44Å; I440-Q444 WeakPolarHBondContact O-CG 3.25Å; I440-Q444 PolarHBondContact O-N 2.99Å; Q444-K446 VanDerWaalsContact C-N 3.29Å; Q444-K446 PolarHBondContact O-N 2.67Å; Q444-E447 WeakPolarHBondContact O-CB 3.47Å; Q444-E447 PolarHBondContact O-N 2.92Å; Q444-E447 VanDerWaalsContact O-N 3.11Å; Q444-V448 WeakPolarHBondContact O-CG2 3.5Å; Q444-V448 PolarHBondContact O-N 3.31Å; Q444-M465 HydrophobicContact CG-CE 4.48Å
445A89.9Confident89.1Confident0 Ų056.4 Ų56.40%028%0.277CS..Hα-helixtrans-59.6-39.4176.300000112.5Y395 I398 L399 D441 A443 L449Y395-A445 VanDerWaalsContact CD1-CA 3.49Å; Y395-A445 HydrophobicContact CD1-CB 3.74Å; Y395-A445 HydrophobicContact CG-CB 4.25Å; I398-A445 HydrophobicContact CB-CB 4.25Å; I398-A445 HydrophobicContact CG2-CB 3.94Å; L399-A445 HydrophobicContact CD1-CB 3.82Å; L399-A445 HydrophobicContact CD2-CB 4.4Å; L399-A445 HydrophobicContact CG-CB 3.7Å; D441-A445 VanDerWaalsContact O-CB 3.31Å; D441-A445 WeakPolarHBondContact O-CB 3.41Å; D441-A445 PolarHBondContact O-N 3.3Å; A443-A445 PolarHBondContact O-N 3.1Å; A445-L449 VanDerWaalsContact O-CB 3.28Å; A445-L449 WeakPolarHBondContact O-CB 3.25Å; A445-L449 VanDerWaalsContact O-CG 3.24Å; A445-L449 WeakPolarHBondContact O-CG 3.15Å; A445-L449 PolarHBondContact O-N 3.04Å
446K93.1Very high89.2Confident72 Ų7259.7 Ų59.731%0.31330%0.297SS..Hα-helixtrans-65.4-42.5174.8175.5-92.3165-165.90111L399 Y414 I442 A443 Q444 T450L399-K446 HydrophobicContact CD1-CB 4.47Å; Y414-K446 HydrophobicContact CD1-CB 4.5Å; Y414-K446 HydrophobicContact CD1-CG 4.05Å; Y414-K446 HydrophobicContact CD2-CB 3.61Å; Y414-K446 HydrophobicContact CD2-CG 4.08Å; Y414-K446 HydrophobicContact CE2-CB 4.2Å; Y414-K446 HydrophobicContact CG-CB 3.77Å; Y414-K446 HydrophobicContact CG-CG 3.77Å; I442-K446 PolarHBondContact O-N 3.07Å; A443-K446 PolarHBondContact O-N 3.07Å; Q444-K446 VanDerWaalsContact C-N 3.29Å; Q444-K446 PolarHBondContact O-N 2.67Å; K446-T450 WeakPolarHBondContact CE-OG1 3.25Å; K446-T450 HydrophobicContact CG-CG2 4.1Å; K446-T450 VanDerWaalsContact O-CB 3.26Å; K446-T450 WeakPolarHBondContact O-CB 3.49Å; K446-T450 WeakPolarHBondContact O-CG2 3.47Å; K446-T450 PolarHBondContact O-N 3.44Å; K446-T450 PolarHBondContact O-OG1 2.83Å
447E91.6Very high89Confident111 Ų11160.4 Ų60.452%0.51930%0.299SS..Hα-helixtrans-61.2-54.1-179-172.7168.3-162.400111A443 Q444 L449 T450 D451 M465A443-E447 PolarHBondContact O-N 2.87Å; Q444-E447 WeakPolarHBondContact O-CB 3.47Å; Q444-E447 PolarHBondContact O-N 2.92Å; Q444-E447 VanDerWaalsContact O-N 3.11Å; E447-L449 PolarHBondContact O-N 2.78Å; E447-T450 PolarHBondContact O-N 3.39Å; E447-D451 PolarHBondContact O-N 2.87Å; E447-M465 HydrophobicContact CG-CE 4.33Å; E447-M465 VanDerWaalsContact OE2-CE 3.23Å; E447-M465 WeakPolarHBondContact OE2-CE 3.32Å
448V89.7Confident88.9Confident1 Ų154 Ų541%0.00627%0.271CS..Hα-helixtrans-61-44.3-180175.10000112.1Y395 Q444 M454 R455 F458 P464 M465Y395-V448 HydrophobicContact CD2-CB 4.07Å; Y395-V448 HydrophobicContact CD2-CG1 3.69Å; Y395-V448 HydrophobicContact CD2-CG2 4.35Å; Y395-V448 HydrophobicContact CE1-CG2 4.48Å; Y395-V448 HydrophobicContact CE2-CB 4.21Å; Y395-V448 HydrophobicContact CE2-CG1 3.88Å; Y395-V448 HydrophobicContact CE2-CG2 4Å; Y395-V448 HydrophobicContact CG-CB 4.41Å; Y395-V448 HydrophobicContact CG-CG1 4.44Å; Q444-V448 WeakPolarHBondContact O-CG2 3.5Å; Q444-V448 PolarHBondContact O-N 3.31Å; V448-M454 HydrophobicContact CG1-CB 4.36Å; V448-R455 WeakPolarHBondContact O-CA 3.28Å; V448-R455 PolarHBondContact O-N 2.94Å; V448-R455 VanDerWaalsContact O-N 3.13Å; V448-F458 HydrophobicContact CG1-CB 3.96Å; V448-F458 HydrophobicContact CG1-CG 4.24Å; V448-P464 HydrophobicContact CG1-CG 4.06Å; V448-M465 HydrophobicContact CG2-CG 3.46Å; V448-M465 VanDerWaalsContact CG2-CG 3.46Å
449L90.1Very high88.7Confident2 Ų252.9 Ų52.91%0.0127%0.269CS..Hα-helixtrans-82.6-14.9-174.5-62.5-174000114.6Y396 L399 V401 I410 A445 E447 R455 F458Y396-L449 HydrophobicContact CD1-CD1 3.69Å; Y396-L449 HydrophobicContact CD1-CD2 4.11Å; Y396-L449 HydrophobicContact CD2-CD2 4.2Å; Y396-L449 HydrophobicContact CE1-CD1 3.9Å; Y396-L449 HydrophobicContact CE1-CD2 3.62Å; Y396-L449 HydrophobicContact CE1-CG 4.37Å; Y396-L449 HydrophobicContact CE2-CD2 3.74Å; Y396-L449 HydrophobicContact CG-CD1 4.11Å; Y396-L449 HydrophobicContact CG-CD2 4.37Å; Y396-L449 VanDerWaalsContact CZ-CD2 3.43Å; L399-L449 HydrophobicContact CD1-CD1 4.21Å; V401-L449 HydrophobicContact CG2-CD1 4.37Å; I410-L449 HydrophobicContact CD1-CB 3.99Å; I410-L449 HydrophobicContact CG2-CB 3.94Å; A445-L449 VanDerWaalsContact O-CB 3.28Å; A445-L449 WeakPolarHBondContact O-CB 3.25Å; A445-L449 VanDerWaalsContact O-CG 3.24Å; A445-L449 WeakPolarHBondContact O-CG 3.15Å; A445-L449 PolarHBondContact O-N 3.04Å; E447-L449 PolarHBondContact O-N 2.78Å; L449-R455 HydrophobicContact CD2-CG 4.39Å; L449-F458 HydrophobicContact CD2-CD1 4.28Å
450T89.5Confident88.4Confident14 Ų1457.6 Ų57.69%0.08629%0.292CS..Hα-helixtrans-97.2-16.817960.70000114.1K407 I410 I411 K446 E447K407-T450 WeakPolarHBondContact CE-O 3.45Å; K407-T450 HydrophobicContact CG-CG2 4.25Å; K407-T450 PolarHBondContact NZ-O 3.25Å; I410-T450 HydrophobicContact CB-CG2 4.39Å; I410-T450 HydrophobicContact CG2-CG2 3.73Å; I411-T450 HydrophobicContact CD1-CG2 4.48Å; I411-T450 HydrophobicContact CG1-CG2 3.92Å; K446-T450 WeakPolarHBondContact CE-OG1 3.25Å; K446-T450 HydrophobicContact CG-CG2 4.1Å; K446-T450 VanDerWaalsContact O-CB 3.26Å; K446-T450 WeakPolarHBondContact O-CB 3.49Å; K446-T450 WeakPolarHBondContact O-CG2 3.47Å; K446-T450 PolarHBondContact O-N 3.44Å; K446-T450 PolarHBondContact O-OG1 2.83Å; E447-T450 PolarHBondContact O-N 3.39Å
451D90.8Very high87.7Confident65 Ų6554.9 Ų54.935%0.34829%0.287SS..SBendtrans-86.9121.6169.4-174.2-67.2000110.2E447 E453 M454 R455E447-D451 PolarHBondContact O-N 2.87Å; D451-E453 VanDerWaalsContact C-N 3.33Å; D451-E453 PolarHBondContact O-N 3.04Å; D451-E453 WeakPolarHBondContact OD1-CA 3.46Å; D451-E453 WeakPolarHBondContact OD1-CB 3.4Å; D451-E453 PolarHBondContact OD1-N 3.32Å; D451-M454 HydrophobicContact CB-CB 3.99Å; D451-M454 HydrophobicContact CB-CG 3.97Å; D451-M454 PolarHBondContact OD1-N 3.34Å; D451-R455 WeakPolarHBondContact O-CB 3.41Å; D451-R455 PolarHBondContact O-N 3.13Å
452P87.6Confident87.2Confident91 Ų9159.4 Ų59.459%0.59131%0.307SS*.Hα-helixtrans-61.3-35.6-177.6-23.634.2000114.4T456P452-T456 VanDerWaalsContact O-CB 3.3Å; P452-T456 WeakPolarHBondContact O-CB 3.48Å; P452-T456 PolarHBondContact O-N 3.21Å; P452-T456 VanDerWaalsContact O-N 3.08Å; P452-T456 PolarHBondContact O-OG1 3.04Å
453E88.6Confident86.6Confident142 Ų14260 Ų6066%0.66431%0.31SS*.Hα-helixtrans-75-47-178.2-64.9-176.2-178.300110.4D451 R455 T456 K457D451-E453 VanDerWaalsContact C-N 3.33Å; D451-E453 PolarHBondContact O-N 3.04Å; D451-E453 WeakPolarHBondContact OD1-CA 3.46Å; D451-E453 WeakPolarHBondContact OD1-CB 3.4Å; D451-E453 PolarHBondContact OD1-N 3.32Å; E453-R455 VanDerWaalsContact C-N 3.35Å; E453-R455 PolarHBondContact O-N 3.29Å; E453-T456 PolarHBondContact O-N 3.48Å; E453-K457 WeakPolarHBondContact O-CG 3.43Å; E453-K457 PolarHBondContact O-N 3.38Å
454M86.6Confident86Confident64 Ų6459.1 Ų59.132%0.31530%0.302SS..Hα-helixtrans-63.9-41177.4-61.4-60.9-150.300111.6V448 D451 T456 K457 F458 P464V448-M454 HydrophobicContact CG1-CB 4.36Å; D451-M454 HydrophobicContact CB-CB 3.99Å; D451-M454 HydrophobicContact CB-CG 3.97Å; D451-M454 PolarHBondContact OD1-N 3.34Å; M454-T456 VanDerWaalsContact C-N 3.33Å; M454-T456 PolarHBondContact O-N 3.49Å; M454-K457 PolarHBondContact O-N 2.7Å; M454-F458 WeakPolarHBondContact O-CB 3.41Å; M454-F458 PolarHBondContact O-N 3.39Å; M454-P464 HydrophobicContact CB-CB 4.23Å; M454-P464 HydrophobicContact CB-CG 4.06Å; M454-P464 HydrophobicContact CE-CB 4.33Å; M454-P464 HydrophobicContact CG-CB 4.36Å; M454-P464 VanDerWaalsContact O-CG 3.25Å; M454-P464 WeakPolarHBondContact O-CG 3.44Å; M454-P464 HydrophobicContact SD-CB 3.36Å; M454-P464 WeakPolarHBondContact SD-CB 3.32Å; M454-P464 HydrophobicContact SD-CG 4.13Å
455R86.9Confident85.3Confident44 Ų4459.2 Ų59.217%0.16630%0.303CS..Hα-helixtrans-61.9-43175.1-177.4177179.3168.6-0.9111.6Y396 R403 A405 V448 L449 D451 E453 F458 D459Y396-R455 PolarHBondContact OH-NE 3.12Å; R403-R455 PolarHBondContact O-NH2 3.19Å; A405-R455 PolarHBondContact O-NH1 3.33Å; A405-R455 PolarHBondContact O-NH2 3.34Å; V448-R455 WeakPolarHBondContact O-CA 3.28Å; V448-R455 PolarHBondContact O-N 2.94Å; V448-R455 VanDerWaalsContact O-N 3.13Å; L449-R455 HydrophobicContact CD2-CG 4.39Å; D451-R455 WeakPolarHBondContact O-CB 3.41Å; D451-R455 PolarHBondContact O-N 3.13Å; E453-R455 VanDerWaalsContact C-N 3.35Å; E453-R455 PolarHBondContact O-N 3.29Å; R455-F458 PolarHBondContact O-N 3.38Å; R455-D459 IonicContact NE-OD2 2.71Å; R455-D459 WeakPolarHBondContact O-CB 3.32Å; R455-D459 PolarHBondContact O-N 3.47Å
456T86.5Confident84.2Confident69 Ų6961.3 Ų61.342%0.42331%0.314SS..Hα-helixtrans-63.8-43.8178.3-59.80000111P452 E453 M454 D459 H460P452-T456 VanDerWaalsContact O-CB 3.3Å; P452-T456 WeakPolarHBondContact O-CB 3.48Å; P452-T456 PolarHBondContact O-N 3.21Å; P452-T456 VanDerWaalsContact O-N 3.08Å; P452-T456 PolarHBondContact O-OG1 3.04Å; E453-T456 PolarHBondContact O-N 3.48Å; M454-T456 VanDerWaalsContact C-N 3.33Å; M454-T456 PolarHBondContact O-N 3.49Å; T456-D459 PolarHBondContact O-N 2.98Å; T456-H460 WeakPolarHBondContact CG2-CE1 3.41Å; T456-H460 WeakPolarHBondContact CG2-ND1 3.2Å; T456-H460 PolarHBondContact O-N 3.36Å; T456-H460 PolarHBondContact O-ND1 3.49Å
457K85Confident82.6Confident94 Ų9462.9 Ų62.941%0.40933%0.332SS..Hα-helixtrans-59.3-47.2174.3-72.2175.3-177.7177.70111.8E453 M454 D459 H460 G461 E462 P464E453-K457 WeakPolarHBondContact O-CG 3.43Å; E453-K457 PolarHBondContact O-N 3.38Å; M454-K457 PolarHBondContact O-N 2.7Å; K457-D459 PolarHBondContact O-N 2.91Å; K457-H460 PolarHBondContact O-N 3.2Å; K457-H460 VanDerWaalsContact O-N 3.14Å; K457-G461 PolarHBondContact O-N 3.36Å; K457-E462 CarbonylContact C-O 3.5Å; K457-E462 HydrophobicContact CB-CB 4.44Å; K457-E462 PolarHBondContact O-N 2.91Å; K457-E462 VanDerWaalsContact O-O 3.13Å; K457-P464 HydrophobicContact CB-CG 4.05Å
458F84.9Confident81Confident5 Ų564.5 Ų64.52%0.02234%0.34CS..Hα-helixtrans-60.2-43.8177.3-175.4-106.6000113.2R392 R393 Y395 Y396 V448 L449 M454 R455 H460 G461 E462 P464R392-F458 PolarHBondContact NH2-O 3.13Å; R393-F458 VanDerWaalsContact O-CE2 3.31Å; R393-F458 WeakPolarHBondContact O-CE2 3.5Å; R393-F458 WeakPolarHBondContact O-CZ 3.49Å; Y395-F458 HydrophobicContact CD2-CD1 4.07Å; Y395-F458 AromaticContact CD2-CD2 3.5Å; Y395-F458 HydrophobicContact CD2-CD2 3.5Å; Y395-F458 AromaticContact CD2-CE1 3.89Å; Y395-F458 HydrophobicContact CD2-CE1 3.89Å; Y395-F458 AromaticContact CD2-CE2 3.31Å; Y395-F458 HydrophobicContact CD2-CE2 3.31Å; Y395-F458 AromaticContact CD2-CG 3.88Å; Y395-F458 HydrophobicContact CD2-CG 3.88Å; Y395-F458 AromaticContact CD2-CZ 3.53Å; Y395-F458 HydrophobicContact CD2-CZ 3.53Å; Y395-F458 AromaticContact CE2-CD2 3.56Å; Y395-F458 HydrophobicContact CE2-CD2 3.56Å; Y395-F458 AromaticContact CE2-CE2 3.49Å; Y395-F458 HydrophobicContact CE2-CE2 3.49Å; Y395-F458 VanDerWaalsContact CE2-CE2 3.49Å; Y395-F458 HydrophobicContact CE2-CG 4.28Å; Y395-F458 HydrophobicContact CE2-CZ 4.18Å; Y395-F458 HydrophobicContact CG-CE2 4.42Å; Y395-F458 HydrophobicContact CG-CZ 4.3Å; Y396-F458 HydrophobicContact CD2-CD1 4.26Å; Y396-F458 AromaticContact CD2-CE1 3.68Å; Y396-F458 HydrophobicContact CD2-CE1 3.68Å; Y396-F458 AromaticContact CE2-CD1 3.75Å; Y396-F458 HydrophobicContact CE2-CD1 3.75Å; Y396-F458 AromaticContact CE2-CE1 3.64Å; Y396-F458 HydrophobicContact CE2-CE1 3.64Å; V448-F458 HydrophobicContact CG1-CB 3.96Å; V448-F458 HydrophobicContact CG1-CG 4.24Å; L449-F458 HydrophobicContact CD2-CD1 4.28Å; M454-F458 WeakPolarHBondContact O-CB 3.41Å; M454-F458 PolarHBondContact O-N 3.39Å; R455-F458 PolarHBondContact O-N 3.38Å; F458-H460 VanDerWaalsContact C-N 3.27Å; F458-H460 PolarHBondContact O-N 3.09Å; F458-G461 PolarHBondContact O-N 3.47Å; F458-G461 VanDerWaalsContact O-N 3.13Å; F458-E462 WeakPolarHBondContact CA-O 3.24Å; F458-E462 PolarHBondContact N-O 3.17Å; F458-P464 HydrophobicContact CB-CG 4.25Å
459D83.9Confident79.3Confident70 Ų7067.4 Ų67.437%0.37436%0.36SS..Hα-helixtrans-66.4-29177.8-71.8-20.4000112.1Y396 R455 T456 K457 G461Y396-D459 WeakPolarHBondContact CE2-OD1 3.48Å; Y396-D459 VanDerWaalsContact OH-CG 3.28Å; Y396-D459 PolarHBondContact OH-OD1 3.11Å; Y396-D459 PolarHBondContact OH-OD2 2.94Å; Y396-D459 VanDerWaalsContact OH-OD2 3.11Å; R455-D459 IonicContact NE-OD2 2.71Å; R455-D459 WeakPolarHBondContact O-CB 3.32Å; R455-D459 PolarHBondContact O-N 3.47Å; T456-D459 PolarHBondContact O-N 2.98Å; K457-D459 PolarHBondContact O-N 2.91Å; D459-G461 VanDerWaalsContact C-N 3.3Å
460H83.6Confident77.4Confident150 Ų15074.4 Ų74.469%0.69439%0.393SS*.THydrogen-bonded Turntrans-79.7-4.9173.7-74.4110.4000114.6T456 K457 F458T456-H460 WeakPolarHBondContact CG2-CE1 3.41Å; T456-H460 WeakPolarHBondContact CG2-ND1 3.2Å; T456-H460 PolarHBondContact O-N 3.36Å; T456-H460 PolarHBondContact O-ND1 3.49Å; K457-H460 PolarHBondContact O-N 3.2Å; K457-H460 VanDerWaalsContact O-N 3.14Å; F458-H460 VanDerWaalsContact C-N 3.27Å; F458-H460 PolarHBondContact O-N 3.09Å
461G74.7Confident75.2Confident37 Ų3782.1 Ų82.138%0.38143%0.428SS..THydrogen-bonded Turntrans111.6-9.2178.200000115.2R392 K457 F458 D459R392-G461 VanDerWaalsContact NH2-CA 3.32Å; R392-G461 PolarHBondContact NH2-O 2.69Å; K457-G461 PolarHBondContact O-N 3.36Å; F458-G461 PolarHBondContact O-N 3.47Å; F458-G461 VanDerWaalsContact O-N 3.13Å; D459-G461 VanDerWaalsContact C-N 3.3Å
462E77.7Confident72.6Confident125 Ų12581.8 Ų81.858%0.58444%0.439SS*.  trans-98.7117.1-175.1-63.8176.1-175.400110.3K457 F458 P464K457-E462 CarbonylContact C-O 3.5Å; K457-E462 HydrophobicContact CB-CB 4.44Å; K457-E462 PolarHBondContact O-N 2.91Å; K457-E462 VanDerWaalsContact O-O 3.13Å; F458-E462 WeakPolarHBondContact CA-O 3.24Å; F458-E462 PolarHBondContact N-O 3.17Å; E462-P464 WeakPolarHBondContact O-CD 3.49Å
463D78.1Confident70Confident18 Ų1885.6 Ų85.610%0.09645%0.449CS..  trans-77.5112.7176.3-174.8-8.2000110.2Y395 M465 D466 S469Y395-D463 WeakPolarHBondContact CE2-OD1 3.27Å; Y395-D463 VanDerWaalsContact OH-CG 3.29Å; Y395-D463 PolarHBondContact OH-OD1 2.91Å; Y395-D463 PolarHBondContact OH-OD2 3.35Å; D463-M465 PolarHBondContact O-N 2.84Å; D463-M465 PolarHBondContact OD1-N 3.21Å; D463-M465 VanDerWaalsContact OD1-N 3.08Å; D463-D466 HydrophobicContact CB-CB 3.9Å; D463-D466 WeakPolarHBondContact O-CB 3.24Å; D463-D466 PolarHBondContact O-N 2.93Å; D463-S469 PolarHBondContact O-OG 3.46Å; D463-S469 VanDerWaalsContact O-OG 3.12Å
464P77.9Confident67.3Low16 Ų1688 Ų8810%0.10446%0.46CS..THydrogen-bonded Turntrans-71.3-12.2-174.7-12.128000113.8V448 M454 K457 F458 E462V448-P464 HydrophobicContact CG1-CG 4.06Å; M454-P464 HydrophobicContact CB-CB 4.23Å; M454-P464 HydrophobicContact CB-CG 4.06Å; M454-P464 HydrophobicContact CE-CB 4.33Å; M454-P464 HydrophobicContact CG-CB 4.36Å; M454-P464 VanDerWaalsContact O-CG 3.25Å; M454-P464 WeakPolarHBondContact O-CG 3.44Å; M454-P464 HydrophobicContact SD-CB 3.36Å; M454-P464 WeakPolarHBondContact SD-CB 3.32Å; M454-P464 HydrophobicContact SD-CG 4.13Å; K457-P464 HydrophobicContact CB-CG 4.05Å; F458-P464 HydrophobicContact CB-CG 4.25Å; E462-P464 WeakPolarHBondContact O-CD 3.49Å
465M74.5Confident64.6Low54 Ų5492.9 Ų92.927%0.26648%0.482SS..THydrogen-bonded Turntrans-110.810.5178.2-58.3-66.8-120.100112.1Y395 Q444 E447 V448 D463 P467Y395-M465 WeakPolarHBondContact OH-CB 3.45Å; Q444-M465 HydrophobicContact CG-CE 4.48Å; E447-M465 HydrophobicContact CG-CE 4.33Å; E447-M465 VanDerWaalsContact OE2-CE 3.23Å; E447-M465 WeakPolarHBondContact OE2-CE 3.32Å; V448-M465 HydrophobicContact CG2-CG 3.46Å; V448-M465 VanDerWaalsContact CG2-CG 3.46Å; D463-M465 PolarHBondContact O-N 2.84Å; D463-M465 PolarHBondContact OD1-N 3.21Å; D463-M465 VanDerWaalsContact OD1-N 3.08Å; M465-P467 WeakPolarHBondContact O-CD 3.46Å
466D68Low62.2Low43 Ų4396.2 Ų96.223%0.2351%0.509CS..  trans-69.2122.7172.8-175-2000110.3D463 E468 S469D463-D466 HydrophobicContact CB-CB 3.9Å; D463-D466 WeakPolarHBondContact O-CB 3.24Å; D463-D466 PolarHBondContact O-N 2.93Å; D466-E468 PolarHBondContact O-N 2.92Å; D466-E468 PolarHBondContact OD1-N 3.41Å; D466-E468 VanDerWaalsContact OD1-N 3.17Å; D466-S469 PolarHBondContact O-N 3.07Å; D466-S469 PolarHBondContact O-OG 3.49Å
467P59.5Low59.3Low105 Ų105103 Ų10368%0.68253%0.533SS*.THydrogen-bonded Turntrans-56.2-29.5177.8-25.334.7000114.2M465M465-P467 WeakPolarHBondContact O-CD 3.46Å
468E57.6Low56.6Low145 Ų145107.8 Ų107.868%0.67856%0.556SS**THydrogen-bonded Turntrans-80.9-28.8-179.4-70.8-173.616200113D466 Q470 Q471D466-E468 PolarHBondContact O-N 2.92Å; D466-E468 PolarHBondContact OD1-N 3.41Å; D466-E468 VanDerWaalsContact OD1-N 3.17Å; E468-Q470 PolarHBondContact O-N 2.99Å; E468-Q471 PolarHBondContact O-N 3.48Å
469S53.4Low53.9Low62 Ų62111 Ų11143%0.43459%0.591SS.*G310 helixtrans-71.6-17.8179.8740000112.9D463 D466D463-S469 PolarHBondContact O-OG 3.46Å; D463-S469 VanDerWaalsContact O-OG 3.12Å; D466-S469 PolarHBondContact O-N 3.07Å; D466-S469 PolarHBondContact O-OG 3.49Å
470Q49.7Very low51.4Low150 Ų150111.5 Ų111.570%0.70161%0.613SS**G310 helixtrans-79.9-8.8175-68.5-169.611.900114.6E468E468-Q470 PolarHBondContact O-N 2.99Å
471Q43.6Very low48.7Very low176 Ų176113.8 Ų113.882%0.82262%0.621SS**G310 helixtrans-91.1-5.9178.2-71.3-174.26.900114.2E468E468-Q471 PolarHBondContact O-N 3.48Å
472G36.9Very low46.5Very low57 Ų57121.4 Ų121.459%0.58865%0.646SS**SBendtrans-97-5.2-167.600000118.2
473H32.6Very low44.1Very low171 Ų171118.3 Ų118.379%0.79265%0.647SS**  trans-129.483.4-174.9-79.1-7.2000113.3H475H473-H475 PolarHBondContact O-N 3.03Å
474H30.8Very low41.8Very low192 Ų192127.4 Ų127.489%0.88969%0.687SS**  trans-73.3102.1157.5-90.7-47.7000110
475H31.6Very low39.5Very low168 Ų168135.3 Ų135.378%0.77872%0.722SS**  trans-101125.1153.4-85.3-68.2000109.4H473 F477H473-H475 PolarHBondContact O-N 3.03Å; H475-F477 PolarHBondContact O-N 3.3Å
476P34.9Very low37.4Very low113 Ų113135.7 Ų135.773%0.73474%0.74SS**  trans-92.398.9-179.633.6-27.5000109.8
477F26.4Very low35.6Very low211 Ų211142.5 Ų142.593%0.92577%0.768SS**  trans-147.3129.6153.5-125.5-90.2000110.9H475H475-F477 PolarHBondContact O-N 3.3Å
478H29.2Very low34.4Very low195 Ų195143.6 Ų143.690%0.90377%0.768SS**  trans-51.8145.8-170.2-90-91.1000116.9
479G26.3Very low33.5Very low73 Ų73140.8 Ų140.875%0.75376%0.763SS**  trans155.1101.6153.900000112.2
480G31.7Very low32.8Very low81 Ų81145.2 Ų145.284%0.83577%0.774SS**  trans-61.3142.8-167.100000115.9
481F26.5Very low31.9Very low197 Ų197140.6 Ų140.686%0.86477%0.767SS**  trans-147.995.4157.2-143.6-96.8000109.4
482H29.6Very low31.6Very low198 Ų198138.5 Ų138.592%0.91777%0.772SS**  trans-69.5130.6161.4-94.1-43.7000108.7
483G27.6Very low31.3Very low59 Ų59138.3 Ų138.361%0.60877%0.77SS**  trans129.561.5160.100000115.6Q485G483-Q485 PolarHBondContact O-N 3.18Å; G483-Q485 VanDerWaalsContact O-N 3.14Å
484F28.7Very low31.4Very low209 Ų209136.8 Ų136.892%0.91778%0.776SS**  trans-83.477.3155.9-150-97.2000108.2
485Q30.3Very low31.4Very low182 Ų182136.6 Ų136.685%0.8577%0.772SS**  trans-79.5128.6168.3-142.9171.4-0.400106.9G483 F487G483-Q485 PolarHBondContact O-N 3.18Å; G483-Q485 VanDerWaalsContact O-N 3.14Å; Q485-F487 PolarHBondContact O-N 2.78Å
486G29.9Very low31.2Very low63 Ų63136.4 Ų136.465%0.64978%0.777SS**  trans-45.3131.5-173.300000113.6N488G486-N488 VanDerWaalsContact C-N 3.28Å; G486-N488 PolarHBondContact O-N 2.93Å
487F30.6Very low31.2Very low185 Ų185139.4 Ų139.481%0.81178%0.779SS**  trans-65.893.6165.7-167.8-96000107.8Q485 P489Q485-F487 PolarHBondContact O-N 2.78Å; F487-P489 HydrophobicContact CD1-CB 4.48Å; F487-P489 HydrophobicContact CD1-CG 4.24Å; F487-P489 HydrophobicContact CE1-CB 4.01Å; F487-P489 HydrophobicContact CE1-CG 4.13Å; F487-P489 WeakPolarHBondContact O-CD 3.5Å
488N33.5Very low31.3Very low129 Ų129138.8 Ų138.869%0.6978%0.776SS**  trans-104.497.1176.2-15223000106.6G486 F490G486-N488 VanDerWaalsContact C-N 3.28Å; G486-N488 PolarHBondContact O-N 2.93Å; N488-F490 PolarHBondContact O-N 3.48Å
489P38.7Very low31.4Very low86 Ų86137.9 Ų137.956%0.55877%0.769SS**THydrogen-bonded Turntrans-73.70.3-170.216.4-10.8000113.8F487F487-P489 HydrophobicContact CD1-CB 4.48Å; F487-P489 HydrophobicContact CD1-CG 4.24Å; F487-P489 HydrophobicContact CE1-CB 4.01Å; F487-P489 HydrophobicContact CE1-CG 4.13Å; F487-P489 WeakPolarHBondContact O-CD 3.5Å
490F40.2Very low31.6Very low154 Ų154140 Ų14068%0.67577%0.773SS**THydrogen-bonded Turntrans-135.533.5-177.5-64.5-77.4000113.8N488N488-F490 PolarHBondContact O-N 3.48Å
491G29.2Very low31.8Very low53 Ų53146.1 Ų146.155%0.54677%0.772SS.*  trans-83.6111.9170.300000112.3G493G491-G493 PolarHBondContact O-N 3Å
492S38.9Very low32.3Very low132 Ų132148.1 Ų148.192%0.92379%0.792SS**  trans-54.3109.5179.647.80000115.1
493G30.2Very low32.5Very low54 Ų54145.7 Ų145.756%0.55779%0.786SS**SBendtrans177.6146.3169.400000110.8G491 F495G491-G493 PolarHBondContact O-N 3Å; G493-F495 PolarHBondContact O-N 2.98Å; G493-F495 VanDerWaalsContact O-N 3.08Å
494P35.2Very low32.7Very low139 Ų139150.2 Ų150.290%0.90380%0.795SS**  trans-83.696.7-146.833.7-34000113.2
495F31Very low33Very low188 Ų188146.9 Ų146.983%0.82579%0.789SS**  trans-106.8105.9162.8-89.5-84.1000110.3G493 F497G493-F495 PolarHBondContact O-N 2.98Å; G493-F495 VanDerWaalsContact O-N 3.08Å; F495-F497 HydrophobicContact CB-CE2 4.48Å; F495-F497 PolarHBondContact O-N 2.85Å
496N27.2Very low33.1Very low164 Ų164144.9 Ų144.988%0.87779%0.785SS**  trans-72.4108.8168.2-113.2-17.5000108.9K498N496-K498 PolarHBondContact O-N 3.2Å
497F33.5Very low33.3Very low176 Ų176150 Ų15077%0.77279%0.794SS**  trans-81.5104.1167.9-83.8-87.7000109.7F495F495-F497 HydrophobicContact CB-CE2 4.48Å; F495-F497 PolarHBondContact O-N 2.85Å
498K28.3Very low33.5Very low197 Ų197147.7 Ų147.786%0.85779%0.792SS**  trans-80.5119.4164.4-81.7-175.9175.3179.60109.1N496N496-K498 PolarHBondContact O-N 3.2Å
499F32.7Very low33.5Very low176 Ų176149 Ų14977%0.77280%0.8SS**  trans-83.2116.5163.9-78.2-89.3000109.3
500S29.9Very low33.1Very low119 Ų119153.8 Ų153.883%0.83282%0.818SS**  trans-89112160.131.40000108.6
501Y37.1Very low32.5Very low208 Ų208153.8 Ų153.882%0.81683%0.83SS**  trans-77.6126.3163-81.3-91000108.4
502N36.9Very low32.8Very low240 Ų240163 Ų163100%1.28386%0.856SS**  trans-137.60148.5-90-14.8000107.9

Retrieved 502 of 502 residues in 287 ms (Link to these results)

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